A0A077Z2H2_TRITR Loading...

Zinc finger homeobox protein 3

AlphaFold DB , UniProt , Accession A0A077Z2H2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,888 aa.

						>A0A077Z2H2_TRITR|A0A077Z2H2
MKAFVNVLYLLRVLCLDEGQQFSCPCCSRVFPDLQVLYAHQADSEHAEQGISPSGVLQYMCWWRGCSRYFPSVAAVGAHFREKHARTNGCLETRRFYCTDCDMVFVTGDFLRLHKAYHHNSQNDLLALAKLQNSPEEAHEQGEVTSVNGSVNLRTSESPSYVTDAIEYGQSDGFASANLSGSAEEDSNDDLLYPGIDEDELNSNSAASEAYSSDKSRQFCCHRCKMAFTRQVYLTIHNRGLMHRQCGKTQSMPDKYYSSDRPYKCELCRESFTQKSILLVHFNSVSHLYKLKKLLVAKASAMCSQNINQATLAALSRYHPNALLSSSPAFLDGLLSSISNGVLPFCPTSASQNLAPRLGDISLLSVADVQPRGNGPKRFRCNICHVSYNSRQNLSVHLRSVAHQAKLTHSQGLVKSFVQQQLSGRDNALVGEPDENVSLDGSKNAVCFQSATGLAVSPNPSDDCGNAELSVAGPSGNYFDQDSDVNCAERDDNLNAIEEVMQQVTLKGYSKPVSRTSWKSLLEEYGFEIAMQYNESSCRKLNLSESRCHSPTDNEEIEPPLAKKSHSSSDSTANSIWIKEMAIPAGPENHPELLRCRCVFCDEEFSGVLILKAHVEQRHHEMVPEKEISQVVAAFRKAYERKRLMEQSRIDATANVRDCEENSRQLNPYETEPPISAFSTSSVDTFPSGLAAVDSSAVAAAAASLFCASAANVGFGFGVPFPLLGLPFNPYTLPNPYVAGVSPLNSPMAQRPLDMLSSNANSSLTCRSGAKSYMPTSASTAITPTATSLFAPQQQRQQQQQQHQQQQKRARTRITDDQLKILREYFDINNSPSEEQVEEMSKKSGLPQKVIKHWFRNTLFKERQRSKDSPYNFSIPPSFSIDLEEYEKTGEAKVIPLNSEFTSKAATHGNTGEEPTSCVRADGQEGGVKTENSDPVSSVTADPSSPADESSPVEFAKESSVSSGKSSLTDSKSISRANVDCLQDFSNITQGTVDSLNNLTVLFSRHDGFAKGIAPLPALQYPLGGSGSGFFSPCVGALQGASGAAAASLSGLVSHLSAPQQLPVNLNCGGARRANRTRFTEEQVKVLQEFFEQNAYPKDDDLELLSKKLNLSPRVIVVWFQNARQKARKIYENQPPDSEDRFSRTPGLNYECKSCHLVFLRYYELIKHHKSGCGRLTGAKMDSKSDFVGELSPTAGSSKRCSSEELYRQEEGSTCSPTSDVRIDDQYVCHWCPARFGLSEQLSRHEWEVHRDQNDIWSQAPTQSSASAEESTFSAAASGSSGDESQRRHRTKISPQNVEKLLAHYCKDPNPSSEVMHQIAEEVGISKRVVQVWYQNTRARERRAQGTHKGERSFNKRCPFCGILFHNKHVMMGHITERHAQQFRTTEVNIDCLPDAEEVPTISTFSLPTYLLAATTSRSQYEEAALVDNEQRSESAPLQQSSACEANSGDTGGLSGDEAPLDLSLSVKLHNSCYGTSSQSLDGYFRNVAQENRQFASTSVTSRDEDLNHVVSGEDHEVISRSCSPSPSSQQRFLAALARPQKRFRTHLTPSQVKVMRYLFQDYKTPTMSECEMLGAQIGLHKRVVQVWFQNARAKERKAIFTGGNNSIGSSRQVTRSESGRSSTRCALCNIAYTSGQIIQDHIFTKKHIDRVKLAIGEIVNSTRRDSFEGPSKARENNRVQQNTNAHVDRLQIRSESFCEMPMADAALTSSLTQNLIPYIYPAGVMPVAYYSGLPAPMVYSNNFAGFPSAGNLLYDPNINGTPVSVLQIPQSVRERIIAALKDSKTFVARFTQDGKTVSDLVKSLSAKDRVSLSACDLEVGWSCRQCVTVFQSEHQFDCHKRLFCRTIEPAFKLVQTYYQCTLCKVRFAMQPSGKNRCRYGSIGTVDF
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	44.4	Very low	56.5	Low	206 Å²	206	121.7 Å²	121.7	100%	1.015	62%	0.619	S	S	*	*				0	-72.2	0	-68.1	-175.2	-178.6	0	0	113.7	A3 F4 V5	M1-A3 VanDerWaalsContact C-N 3.32Å; M1-A3 PolarHBondContact O-N 2.99Å; M1-F4 WeakPolarHBondContact O-CA 3.24Å; M1-F4 VanDerWaalsContact O-CB 3.24Å; M1-F4 WeakPolarHBondContact O-CB 3.35Å; M1-F4 PolarHBondContact O-N 2.83Å; M1-V5 PolarHBondContact O-N 3.23Å
2	K	42.7	Very low	55.4	Low	187 Å²	187	129.3 Å²	129.3	81%	0.813	63%	0.634	S	S	*	*	H	α-helix	trans	-53.5	-43.4	-178.4	-75.9	-177.9	178.6	174.4	0	114	F4 V5 N6	K2-F4 VanDerWaalsContact C-N 3.29Å; K2-F4 PolarHBondContact O-N 2.65Å; K2-V5 PolarHBondContact O-N 3.24Å; K2-N6 PolarHBondContact O-N 3.33Å
3	A	57.6	Low	54.8	Low	73 Å²	73	125.5 Å²	125.5	60%	0.603	62%	0.623	S	S	*	*	H	α-helix	trans	-59.8	-36.4	172.3	0	0	0	0	0	113.2	M1 N6 V7	M1-A3 VanDerWaalsContact C-N 3.32Å; M1-A3 PolarHBondContact O-N 2.99Å; A3-N6 PolarHBondContact O-N 2.84Å; A3-V7 WeakPolarHBondContact O-CB 3.43Å; A3-V7 VanDerWaalsContact O-CG2 3.3Å; A3-V7 WeakPolarHBondContact O-CG2 3.22Å; A3-V7 PolarHBondContact O-N 3.38Å
4	F	63	Low	54.1	Low	145 Å²	145	124.6 Å²	124.6	64%	0.636	62%	0.621	S	S	*	*	H	α-helix	trans	-70.3	-35.3	177.7	-151.5	-90.4	0	0	0	111.9	M1 K2 V7 L8	M1-F4 WeakPolarHBondContact O-CA 3.24Å; M1-F4 VanDerWaalsContact O-CB 3.24Å; M1-F4 WeakPolarHBondContact O-CB 3.35Å; M1-F4 PolarHBondContact O-N 2.83Å; K2-F4 VanDerWaalsContact C-N 3.29Å; K2-F4 PolarHBondContact O-N 2.65Å; F4-V7 PolarHBondContact O-N 2.95Å; F4-L8 HydrophobicContact CD1-CD1 3.81Å; F4-L8 HydrophobicContact CD1-CG 4.26Å; F4-L8 HydrophobicContact CE1-CD1 3.98Å; F4-L8 HydrophobicContact CE1-CG 4.37Å; F4-L8 WeakPolarHBondContact O-CB 3.18Å; F4-L8 WeakPolarHBondContact O-CG 2.94Å; F4-L8 PolarHBondContact O-N 3.37Å
5	V	66.4	Low	52.9	Low	94 Å²	94	122.2 Å²	122.2	57%	0.57	62%	0.619	S	S	*	*	H	α-helix	trans	-68.5	-40.4	171.6	178.1	0	0	0	0	110.8	M1 K2 L8 Y9	M1-V5 PolarHBondContact O-N 3.23Å; K2-V5 PolarHBondContact O-N 3.24Å; V5-L8 PolarHBondContact O-N 2.8Å; V5-Y9 WeakPolarHBondContact O-CB 3.33Å; V5-Y9 PolarHBondContact O-N 2.95Å
6	N	55.2	Low	51.6	Low	105 Å²	105	124.4 Å²	124.4	56%	0.561	63%	0.632	S	S	*	*	H	α-helix	trans	-67.5	-36	173.9	-77.2	16.5	0	0	0	112.5	K2 A3 Y9 L10	K2-N6 PolarHBondContact O-N 3.33Å; A3-N6 PolarHBondContact O-N 2.84Å; N6-Y9 PolarHBondContact O-N 2.84Å; N6-L10 WeakPolarHBondContact O-CB 3.4Å; N6-L10 WeakPolarHBondContact O-CG 3.3Å; N6-L10 PolarHBondContact O-N 2.88Å
7	V	66.9	Low	50.6	Low	76 Å²	76	123.8 Å²	123.8	46%	0.461	63%	0.631	S	S	.	*	H	α-helix	trans	-67.8	-40.8	173.2	166.4	0	0	0	0	110.8	A3 F4 Y9 L10 L11	A3-V7 WeakPolarHBondContact O-CB 3.43Å; A3-V7 VanDerWaalsContact O-CG2 3.3Å; A3-V7 WeakPolarHBondContact O-CG2 3.22Å; A3-V7 PolarHBondContact O-N 3.38Å; F4-V7 PolarHBondContact O-N 2.95Å; V7-Y9 VanDerWaalsContact C-N 3.3Å; V7-Y9 PolarHBondContact O-N 3.24Å; V7-L10 PolarHBondContact O-N 3.47Å; V7-L11 HydrophobicContact CG1-CD1 3.88Å; V7-L11 HydrophobicContact CG1-CG 4.38Å; V7-L11 WeakPolarHBondContact O-CB 3.25Å; V7-L11 VanDerWaalsContact O-CG 3.25Å; V7-L11 WeakPolarHBondContact O-CG 3.34Å; V7-L11 PolarHBondContact O-N 3.35Å
8	L	62.4	Low	49.9	Very low	95 Å²	95	126.5 Å²	126.5	50%	0.497	64%	0.64	S	S	.	*	H	α-helix	trans	-67.6	-28.1	171.9	-74.1	170.6	0	0	0	113.1	F4 V5 L11 R12	F4-L8 HydrophobicContact CD1-CD1 3.81Å; F4-L8 HydrophobicContact CD1-CG 4.26Å; F4-L8 HydrophobicContact CE1-CD1 3.98Å; F4-L8 HydrophobicContact CE1-CG 4.37Å; F4-L8 WeakPolarHBondContact O-CB 3.18Å; F4-L8 WeakPolarHBondContact O-CG 2.94Å; F4-L8 PolarHBondContact O-N 3.37Å; V5-L8 PolarHBondContact O-N 2.8Å; L8-L11 HydrophobicContact CD2-CD1 4.43Å; L8-R12 VanDerWaalsContact O-CB 3.24Å; L8-R12 WeakPolarHBondContact O-CB 3.33Å; L8-R12 PolarHBondContact O-N 3.03Å; L8-R12 VanDerWaalsContact O-N 3.14Å
9	Y	51.5	Low	49.4	Very low	169 Å²	169	123.2 Å²	123.2	66%	0.663	64%	0.641	S	S	*	*	H	α-helix	trans	-76.5	-37.5	173.6	-161	-87.3	0	0	0	111.5	V5 N6 V7 R12 V13	V5-Y9 WeakPolarHBondContact O-CB 3.33Å; V5-Y9 PolarHBondContact O-N 2.95Å; N6-Y9 PolarHBondContact O-N 2.84Å; V7-Y9 VanDerWaalsContact C-N 3.3Å; V7-Y9 PolarHBondContact O-N 3.24Å; Y9-R12 CarbonylContact O-C 3.56Å; Y9-R12 PolarHBondContact O-N 3.2Å; Y9-V13 HydrophobicContact CD1-CG2 4.32Å; Y9-V13 HydrophobicContact CE1-CG2 4.22Å; Y9-V13 WeakPolarHBondContact O-CG2 3.44Å; Y9-V13 PolarHBondContact O-N 2.72Å; Y9-V13 VanDerWaalsContact O-N 3.16Å
10	L	54.4	Low	49.6	Very low	98 Å²	98	124.7 Å²	124.7	51%	0.513	65%	0.645	S	S	.	*	H	α-helix	trans	-68.8	-45.5	173	-77.5	165.8	0	0	0	111.3	N6 V7 R12 V13 L14	N6-L10 WeakPolarHBondContact O-CB 3.4Å; N6-L10 WeakPolarHBondContact O-CG 3.3Å; N6-L10 PolarHBondContact O-N 2.88Å; V7-L10 PolarHBondContact O-N 3.47Å; L10-R12 PolarHBondContact O-N 2.74Å; L10-V13 CarbonylContact O-C 3.59Å; L10-V13 WeakPolarHBondContact O-CA 3.33Å; L10-V13 PolarHBondContact O-N 2.95Å; L10-L14 HydrophobicContact CB-CD1 4.35Å; L10-L14 VanDerWaalsContact O-CB 3.27Å; L10-L14 WeakPolarHBondContact O-CB 3.34Å; L10-L14 VanDerWaalsContact O-CG 3.24Å; L10-L14 WeakPolarHBondContact O-CG 3.24Å; L10-L14 PolarHBondContact O-N 3.09Å
11	L	56.4	Low	50	Low	91 Å²	91	125.2 Å²	125.2	48%	0.476	64%	0.644	S	S	.	*	H	α-helix	trans	-56.4	-35.8	171	-73.6	165.2	0	0	0	111.5	V7 L8 V13 L14 C15	V7-L11 HydrophobicContact CG1-CD1 3.88Å; V7-L11 HydrophobicContact CG1-CG 4.38Å; V7-L11 WeakPolarHBondContact O-CB 3.25Å; V7-L11 VanDerWaalsContact O-CG 3.25Å; V7-L11 WeakPolarHBondContact O-CG 3.34Å; V7-L11 PolarHBondContact O-N 3.35Å; L8-L11 HydrophobicContact CD2-CD1 4.43Å; L11-V13 VanDerWaalsContact C-N 3.25Å; L11-V13 PolarHBondContact O-N 2.93Å; L11-L14 PolarHBondContact O-N 3.16Å; L11-C15 PolarHBondContact O-N 3Å; L11-C15 PolarHBondContact O-SG 3.14Å
12	R	43.4	Very low	51.2	Low	212 Å²	212	118.7 Å²	118.7	80%	0.8	61%	0.61	S	S	*	*	H	α-helix	trans	-79.3	-0.6	175.3	-157.5	173.4	-165.8	132.8	10.2	114.8	L8 Y9 L10	L8-R12 VanDerWaalsContact O-CB 3.24Å; L8-R12 WeakPolarHBondContact O-CB 3.33Å; L8-R12 PolarHBondContact O-N 3.03Å; L8-R12 VanDerWaalsContact O-N 3.14Å; Y9-R12 CarbonylContact O-C 3.56Å; Y9-R12 PolarHBondContact O-N 3.2Å; L10-R12 PolarHBondContact O-N 2.74Å
13	V	48.2	Very low	52.8	Low	80 Å²	80	113.3 Å²	113.3	49%	0.485	60%	0.596	S	S	.	*	H	α-helix	trans	-115.9	-16.3	171.5	170.6	0	0	0	0	111.1	Y9 L10 L11	Y9-V13 HydrophobicContact CD1-CG2 4.32Å; Y9-V13 HydrophobicContact CE1-CG2 4.22Å; Y9-V13 WeakPolarHBondContact O-CG2 3.44Å; Y9-V13 PolarHBondContact O-N 2.72Å; Y9-V13 VanDerWaalsContact O-N 3.16Å; L10-V13 CarbonylContact O-C 3.59Å; L10-V13 WeakPolarHBondContact O-CA 3.33Å; L10-V13 PolarHBondContact O-N 2.95Å; L11-V13 VanDerWaalsContact C-N 3.25Å; L11-V13 PolarHBondContact O-N 2.93Å
14	L	45.2	Very low	53.8	Low	114 Å²	114	109.9 Å²	109.9	60%	0.597	57%	0.568	S	S	*	*	H	α-helix	trans	-96.3	-19.3	176.5	-70	169.5	0	0	0	112.9	L10 L11 L16	L10-L14 HydrophobicContact CB-CD1 4.35Å; L10-L14 VanDerWaalsContact O-CB 3.27Å; L10-L14 WeakPolarHBondContact O-CB 3.34Å; L10-L14 VanDerWaalsContact O-CG 3.24Å; L10-L14 WeakPolarHBondContact O-CG 3.24Å; L10-L14 PolarHBondContact O-N 3.09Å; L11-L14 PolarHBondContact O-N 3.16Å; L14-L16 PolarHBondContact O-N 3.39Å
15	C	35.9	Very low	54.2	Low	88 Å²	88	107.3 Å²	107.3	60%	0.595	57%	0.565	S	S	*	*			trans	-71.7	50.2	159.6	-68	0	0	0	0	112.2	L11 D17	L11-C15 PolarHBondContact O-N 3Å; L11-C15 PolarHBondContact O-SG 3.14Å; C15-D17 WeakPolarHBondContact CA-OD2 3.35Å; C15-D17 PolarHBondContact O-N 2.88Å; C15-D17 PolarHBondContact SG-OD2 2.78Å
16	L	32	Very low	54.6	Low	157 Å²	157	106.1 Å²	106.1	82%	0.822	56%	0.56	S	S	*	*			trans	-84.9	45.7	146.8	-72.6	165.7	0	0	0	107.7	L14 E18	L14-L16 PolarHBondContact O-N 3.39Å; L16-E18 PolarHBondContact O-N 3.35Å
17	D	34.8	Very low	55.9	Low	115 Å²	115	103.4 Å²	103.4	62%	0.615	55%	0.549	S	S	*	.			trans	-85.7	110.1	-176.6	-67.5	-48.3	0	0	0	109	C15	C15-D17 WeakPolarHBondContact CA-OD2 3.35Å; C15-D17 PolarHBondContact O-N 2.88Å; C15-D17 PolarHBondContact SG-OD2 2.78Å
18	E	38.3	Very low	56.5	Low	172 Å²	172	104.1 Å²	104.1	80%	0.804	56%	0.558	S	S	*	*			trans	38.1	105.8	146.7	-55.7	-175.1	154.4	0	0	116.8	L16	L16-E18 PolarHBondContact O-N 3.35Å
19	G	40.6	Very low	57.4	Low	63 Å²	63	107.2 Å²	107.2	65%	0.649	56%	0.563	S	S	*	*			trans	-51	139.7	179.7	0	0	0	0	0	113.1	Q21	G19-Q21 WeakPolarHBondContact O-CG 3.5Å; G19-Q21 PolarHBondContact O-N 3.44Å
20	Q	51.9	Low	58.8	Low	154 Å²	154	102.6 Å²	102.6	72%	0.72	55%	0.552	S	S	*	*			trans	-65.4	100.4	-172	-72.4	-170.8	-12.5	0	0	111.7	F22	Q20-F22 HydrophobicContact CB-CE2 4.39Å; Q20-F22 WeakPolarHBondContact O-CD2 3.03Å; Q20-F22 WeakPolarHBondContact O-CE2 3.39Å; Q20-F22 PolarHBondContact O-N 2.94Å; Q20-F22 VanDerWaalsContact O-N 3.11Å
21	Q	59.3	Low	60	Low	135 Å²	135	99.1 Å²	99.1	63%	0.631	53%	0.533	S	S	*	.			trans	-68.7	101.6	-178.2	-71.6	-176.1	20.6	0	0	111	G19 S23 V30	G19-Q21 WeakPolarHBondContact O-CG 3.5Å; G19-Q21 PolarHBondContact O-N 3.44Å; Q21-S23 PolarHBondContact O-N 2.86Å; Q21-V30 HydrophobicContact CB-CG1 3.47Å; Q21-V30 VanDerWaalsContact CB-CG1 3.47Å; Q21-V30 HydrophobicContact CB-CG2 4.33Å; Q21-V30 HydrophobicContact CG-CG1 3.52Å
22	F	69.3	Low	60.8	Low	70 Å²	70	99.8 Å²	99.8	31%	0.307	54%	0.542	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	105.3	175.5	-68.3	-82.5	0	0	0	109.5	Q20 F31 L34 L37	Q20-F22 HydrophobicContact CB-CE2 4.39Å; Q20-F22 WeakPolarHBondContact O-CD2 3.03Å; Q20-F22 WeakPolarHBondContact O-CE2 3.39Å; Q20-F22 PolarHBondContact O-N 2.94Å; Q20-F22 VanDerWaalsContact O-N 3.11Å; F22-F31 PolarHBondContact N-O 3.48Å; F22-F31 WeakPolarHBondContact O-CD2 3.32Å; F22-F31 PolarHBondContact O-N 2.74Å; F22-L34 HydrophobicContact CD1-CB 4.41Å; F22-L34 HydrophobicContact CD1-CD1 3.74Å; F22-L34 HydrophobicContact CD2-CB 4.43Å; F22-L34 HydrophobicContact CE1-CB 4.23Å; F22-L34 HydrophobicContact CE1-CD1 3.84Å; F22-L34 HydrophobicContact CE2-CB 4.25Å; F22-L34 HydrophobicContact CG-CD1 4.41Å; F22-L34 HydrophobicContact CZ-CB 4.15Å; F22-L37 HydrophobicContact CB-CB 4.19Å; F22-L37 HydrophobicContact CB-CD2 3.98Å
23	S	76.3	Confident	62.2	Low	73 Å²	73	93 Å²	93	51%	0.51	52%	0.522	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	138.1	177.8	55.4	0	0	0	0	112.6	Q21 R29	Q21-S23 PolarHBondContact O-N 2.86Å; S23-R29 CarbonylContact C-O 3.58Å; S23-R29 WeakPolarHBondContact CA-O 3.34Å
24	C	78.6	Confident	63.4	Low	1 Å²	1	90.7 Å²	90.7	1%	0.007	51%	0.507	C	S	.	.			trans	-72.8	125.6	171.7	176.4	0	0	0	0	110.6	C26 S28 R29 F31 L37 H40	C24-C26 PolarHBondContact O-N 3.01Å; C24-C26 VanDerWaalsContact O-N 3.15Å; C24-S28 VanDerWaalsContact O-CA 3.26Å; C24-S28 WeakPolarHBondContact O-CA 3.36Å; C24-S28 PolarHBondContact O-N 2.79Å; C24-R29 PolarHBondContact N-O 3.48Å; C24-F31 HydrophobicContact CB-CE2 4.14Å; C24-L37 HydrophobicContact CB-CD1 3.8Å; C24-H40 WeakPolarHBondContact CB-NE2 3.41Å; C24-H40 PolarHBondContact SG-NE2 3.3Å
25	P	71.2	Confident	64.8	Low	91 Å²	91	91.4 Å²	91.4	59%	0.591	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-29.6	-178.7	-26.4	35	0	0	0	114.6
26	C	74.5	Confident	66.9	Low	69 Å²	69	90.2 Å²	90.2	47%	0.466	50%	0.497	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-34.4	-170.9	-60.2	0	0	0	0	113.8	C24 H46	C24-C26 PolarHBondContact O-N 3.01Å; C24-C26 VanDerWaalsContact O-N 3.15Å; C26-H46 HydrophobicContact CB-CB 3.89Å; C26-H46 WeakPolarHBondContact CB-CD2 3.33Å
27	C	82.5	Confident	69.2	Low	48 Å²	48	83 Å²	83	32%	0.324	46%	0.46	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126	1.6	-177.6	72.6	0	0	0	0	114.8	R29 H40 H46	C27-R29 PolarHBondContact O-N 2.87Å; C27-H40 VanDerWaalsContact SG-CE1 3.55Å; C27-H40 PolarHBondContact SG-NE2 3.41Å; C27-H46 VanDerWaalsContact CB-CE1 3.46Å; C27-H46 WeakPolarHBondContact CB-CE1 3.36Å; C27-H46 PolarHBondContact SG-CE1 3.22Å
28	S	79.1	Confident	71.2	Confident	92 Å²	92	78.6 Å²	78.6	64%	0.643	43%	0.434	S	S	*	.			trans	58.9	7	-179.5	-56.9	0	0	0	0	116.4	C24	C24-S28 VanDerWaalsContact O-CA 3.26Å; C24-S28 WeakPolarHBondContact O-CA 3.36Å; C24-S28 PolarHBondContact O-N 2.79Å
29	R	81	Confident	73	Confident	159 Å²	159	72.5 Å²	72.5	60%	0.6	41%	0.413	S	S	*	.			trans	-57.9	139.6	169.4	-75.6	-175.1	175.7	-176.1	-0.1	110.3	S23 C24 C27 F31	S23-R29 CarbonylContact C-O 3.58Å; S23-R29 WeakPolarHBondContact CA-O 3.34Å; C24-R29 PolarHBondContact N-O 3.48Å; C27-R29 PolarHBondContact O-N 2.87Å; R29-F31 HydrophobicContact CB-CE2 3.63Å; R29-F31 HydrophobicContact CB-CZ 3.52Å; R29-F31 VanDerWaalsContact O-CE2 3.26Å; R29-F31 WeakPolarHBondContact O-CE2 3.11Å
30	V	80.7	Confident	75	Confident	72 Å²	72	70 Å²	70	44%	0.436	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	139	-176.9	159.2	0	0	0	0	110.3	Q21	Q21-V30 HydrophobicContact CB-CG1 3.47Å; Q21-V30 VanDerWaalsContact CB-CG1 3.47Å; Q21-V30 HydrophobicContact CB-CG2 4.33Å; Q21-V30 HydrophobicContact CG-CG1 3.52Å
31	F	80.7	Confident	76.3	Confident	26 Å²	26	62.8 Å²	62.8	11%	0.114	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	142.1	179.5	-59	-74.4	0	0	0	111.1	F22 C24 R29 D33 V36 L37 H40	F22-F31 PolarHBondContact N-O 3.48Å; F22-F31 WeakPolarHBondContact O-CD2 3.32Å; F22-F31 PolarHBondContact O-N 2.74Å; C24-F31 HydrophobicContact CB-CE2 4.14Å; R29-F31 HydrophobicContact CB-CE2 3.63Å; R29-F31 HydrophobicContact CB-CZ 3.52Å; R29-F31 VanDerWaalsContact O-CE2 3.26Å; R29-F31 WeakPolarHBondContact O-CE2 3.11Å; F31-D33 PolarHBondContact O-N 2.82Å; F31-V36 HydrophobicContact CB-CB 4.18Å; F31-V36 HydrophobicContact CB-CG1 4.36Å; F31-V36 HydrophobicContact CD1-CB 4.37Å; F31-V36 HydrophobicContact CD1-CG1 3.69Å; F31-V36 HydrophobicContact CG-CG1 4.38Å; F31-L37 HydrophobicContact CB-CB 4.1Å; F31-L37 HydrophobicContact CD2-CB 4.02Å; F31-L37 HydrophobicContact CD2-CD1 3.66Å; F31-L37 HydrophobicContact CD2-CG 4.44Å; F31-L37 HydrophobicContact CE2-CD1 4.02Å; F31-L37 HydrophobicContact CG-CB 4.25Å; F31-H40 HydrophobicContact CD1-CB 4.34Å; F31-H40 HydrophobicContact CD2-CB 4.42Å; F31-H40 HydrophobicContact CE1-CB 3.66Å; F31-H40 AromaticContact CE1-CG 3.92Å; F31-H40 HydrophobicContact CE2-CB 3.77Å; F31-H40 AromaticContact CE2-CD2 3.23Å; F31-H40 WeakPolarHBondContact CE2-CD2 3.38Å; F31-H40 AromaticContact CE2-CG 3.48Å; F31-H40 VanDerWaalsContact CE2-CG 3.48Å; F31-H40 AromaticContact CE2-NE2 4Å; F31-H40 HydrophobicContact CZ-CB 3.35Å; F31-H40 AromaticContact CZ-CD2 3.38Å; F31-H40 WeakPolarHBondContact CZ-CD2 3.38Å; F31-H40 AromaticContact CZ-CG 3.11Å; F31-H40 AromaticContact CZ-ND1 3.68Å
32	P	73	Confident	77.1	Confident	104 Å²	104	59.1 Å²	59.1	68%	0.675	34%	0.343	S	S	*	.	S	Bend	trans	-73.8	-15.3	-175.8	31.3	-36.9	0	0	0	113.1	V36	P32-V36 HydrophobicContact CG-CG2 4.36Å
33	D	72.8	Confident	77.5	Confident	71 Å²	71	62.1 Å²	62.1	38%	0.38	36%	0.363	S	S	.	.	S	Bend	trans	-149.7	149.9	-176.8	152.8	55.4	0	0	0	109.5	F31 Q35 V36 L37	F31-D33 PolarHBondContact O-N 2.82Å; D33-Q35 PolarHBondContact O-N 3.16Å; D33-Q35 PolarHBondContact OD1-N 2.97Å; D33-Q35 VanDerWaalsContact OD1-N 3.08Å; D33-Q35 VanDerWaalsContact OD2-CA 3.29Å; D33-Q35 WeakPolarHBondContact OD2-CA 3.27Å; D33-Q35 WeakPolarHBondContact OD2-CB 3.43Å; D33-Q35 PolarHBondContact OD2-N 2.62Å; D33-V36 HydrophobicContact CB-CG2 4.22Å; D33-V36 PolarHBondContact O-N 2.69Å; D33-V36 PolarHBondContact OD2-N 3.43Å; D33-L37 PolarHBondContact O-N 3.22Å
34	L	74.2	Confident	77.4	Confident	30 Å²	30	60.5 Å²	60.5	16%	0.157	35%	0.352	C	S	.	.	H	α-helix	trans	-60.8	-31.8	177.2	-170.4	75.8	0	0	0	111.9	F22 L37 Y38 F80	F22-L34 HydrophobicContact CD1-CB 4.41Å; F22-L34 HydrophobicContact CD1-CD1 3.74Å; F22-L34 HydrophobicContact CD2-CB 4.43Å; F22-L34 HydrophobicContact CE1-CB 4.23Å; F22-L34 HydrophobicContact CE1-CD1 3.84Å; F22-L34 HydrophobicContact CE2-CB 4.25Å; F22-L34 HydrophobicContact CG-CD1 4.41Å; F22-L34 HydrophobicContact CZ-CB 4.15Å; L34-L37 HydrophobicContact CD1-CD2 4.34Å; L34-L37 PolarHBondContact O-N 3.47Å; L34-Y38 HydrophobicContact CD1-CE2 4.4Å; L34-Y38 HydrophobicContact CD2-CE2 3.74Å; L34-Y38 HydrophobicContact CG-CD2 4.19Å; L34-Y38 HydrophobicContact CG-CE2 3.58Å; L34-Y38 WeakPolarHBondContact O-CD2 3.24Å; L34-Y38 PolarHBondContact O-N 3.49Å; L34-F80 HydrophobicContact CD1-CE1 4.17Å; L34-F80 HydrophobicContact CD1-CZ 4.4Å; L34-F80 HydrophobicContact CD2-CD1 4.06Å; L34-F80 HydrophobicContact CD2-CE1 3.78Å
35	Q	74.2	Confident	76.9	Confident	130 Å²	130	69.1 Å²	69.1	61%	0.607	39%	0.392	S	S	*	.	H	α-helix	trans	-71.3	-32	176.8	-140.2	158.8	-76.2	0	0	112.6	D33 Y38 A39	D33-Q35 PolarHBondContact O-N 3.16Å; D33-Q35 PolarHBondContact OD1-N 2.97Å; D33-Q35 VanDerWaalsContact OD1-N 3.08Å; D33-Q35 VanDerWaalsContact OD2-CA 3.29Å; D33-Q35 WeakPolarHBondContact OD2-CA 3.27Å; D33-Q35 WeakPolarHBondContact OD2-CB 3.43Å; D33-Q35 PolarHBondContact OD2-N 2.62Å; Q35-Y38 PolarHBondContact O-N 2.97Å; Q35-A39 PolarHBondContact O-N 3.4Å
36	V	79.1	Confident	77.1	Confident	62 Å²	62	67 Å²	67	38%	0.376	37%	0.374	S	S	.	.	H	α-helix	trans	-72.9	-34.9	170	-167	0	0	0	0	111.5	F31 P32 D33 A39 H40	F31-V36 HydrophobicContact CB-CB 4.18Å; F31-V36 HydrophobicContact CB-CG1 4.36Å; F31-V36 HydrophobicContact CD1-CB 4.37Å; F31-V36 HydrophobicContact CD1-CG1 3.69Å; F31-V36 HydrophobicContact CG-CG1 4.38Å; P32-V36 HydrophobicContact CG-CG2 4.36Å; D33-V36 HydrophobicContact CB-CG2 4.22Å; D33-V36 PolarHBondContact O-N 2.69Å; D33-V36 PolarHBondContact OD2-N 3.43Å; V36-A39 PolarHBondContact O-N 2.95Å; V36-H40 PolarHBondContact O-N 3.39Å
37	L	82	Confident	76.8	Confident	7 Å²	7	64.3 Å²	64.3	4%	0.037	36%	0.357	C	S	.	.	H	α-helix	trans	-61.8	-41.9	168.8	173.8	62.8	0	0	0	111.6	F22 C24 F31 D33 L34 H40 Q41	F22-L37 HydrophobicContact CB-CB 4.19Å; F22-L37 HydrophobicContact CB-CD2 3.98Å; C24-L37 HydrophobicContact CB-CD1 3.8Å; F31-L37 HydrophobicContact CB-CB 4.1Å; F31-L37 HydrophobicContact CD2-CB 4.02Å; F31-L37 HydrophobicContact CD2-CD1 3.66Å; F31-L37 HydrophobicContact CD2-CG 4.44Å; F31-L37 HydrophobicContact CE2-CD1 4.02Å; F31-L37 HydrophobicContact CG-CB 4.25Å; D33-L37 PolarHBondContact O-N 3.22Å; L34-L37 HydrophobicContact CD1-CD2 4.34Å; L34-L37 PolarHBondContact O-N 3.47Å; L37-H40 PolarHBondContact O-N 2.97Å; L37-Q41 HydrophobicContact CD1-CG 3.94Å; L37-Q41 HydrophobicContact CG-CG 4.47Å; L37-Q41 VanDerWaalsContact CG-OE1 3.29Å; L37-Q41 WeakPolarHBondContact O-CG 3.44Å; L37-Q41 PolarHBondContact O-N 3.11Å
38	Y	75.7	Confident	76	Confident	22 Å²	22	67 Å²	67	9%	0.086	36%	0.364	C	S	.	.	H	α-helix	trans	-60.9	-44	174.4	-78.7	-60.2	0	0	0	112.7	L34 Q35 Q41 A42 W62 F80	L34-Y38 HydrophobicContact CD1-CE2 4.4Å; L34-Y38 HydrophobicContact CD2-CE2 3.74Å; L34-Y38 HydrophobicContact CG-CD2 4.19Å; L34-Y38 HydrophobicContact CG-CE2 3.58Å; L34-Y38 WeakPolarHBondContact O-CD2 3.24Å; L34-Y38 PolarHBondContact O-N 3.49Å; Q35-Y38 PolarHBondContact O-N 2.97Å; Y38-Q41 PolarHBondContact O-N 3.38Å; Y38-A42 PolarHBondContact O-N 3.43Å; Y38-W62 AromaticContact CD1-CH2 3.67Å; Y38-W62 HydrophobicContact CD1-CH2 3.67Å; Y38-W62 HydrophobicContact CD1-CZ2 4.13Å; Y38-W62 AromaticContact CE1-CH2 3.32Å; Y38-W62 HydrophobicContact CE1-CH2 3.32Å; Y38-W62 AromaticContact CE1-CZ2 3.47Å; Y38-W62 HydrophobicContact CE1-CZ2 3.47Å; Y38-W62 VanDerWaalsContact CE1-CZ2 3.47Å; Y38-W62 HydrophobicContact CE1-CZ3 4.45Å; Y38-F80 WeakPolarHBondContact OH-CB 3.46Å; Y38-F80 WeakPolarHBondContact OH-CD1 3.44Å; Y38-F80 WeakPolarHBondContact OH-CG 3.46Å
39	A	76.8	Confident	75.6	Confident	44 Å²	44	68 Å²	68	36%	0.364	36%	0.359	S	S	.	.	H	α-helix	trans	-57.8	-51.5	175.1	0	0	0	0	0	110.2	Q35 V36 Q41 A42 D43	Q35-A39 PolarHBondContact O-N 3.4Å; V36-A39 PolarHBondContact O-N 2.95Å; A39-Q41 PolarHBondContact O-N 3.22Å; A39-A42 WeakPolarHBondContact O-CB 3.34Å; A39-A42 PolarHBondContact O-N 3.43Å; A39-D43 WeakPolarHBondContact O-CB 3.48Å; A39-D43 PolarHBondContact O-N 3.41Å
40	H	81.7	Confident	75.2	Confident	9 Å²	9	61.1 Å²	61.1	4%	0.042	34%	0.338	C	S	.	.	H	α-helix	trans	-58.2	-40.5	176.5	167.3	61.4	0	0	0	114.2	C24 C27 F31 V36 L37 A42 D43 S44 H46	C24-H40 WeakPolarHBondContact CB-NE2 3.41Å; C24-H40 PolarHBondContact SG-NE2 3.3Å; C27-H40 VanDerWaalsContact SG-CE1 3.55Å; C27-H40 PolarHBondContact SG-NE2 3.41Å; F31-H40 HydrophobicContact CD1-CB 4.34Å; F31-H40 HydrophobicContact CD2-CB 4.42Å; F31-H40 HydrophobicContact CE1-CB 3.66Å; F31-H40 AromaticContact CE1-CG 3.92Å; F31-H40 HydrophobicContact CE2-CB 3.77Å; F31-H40 AromaticContact CE2-CD2 3.23Å; F31-H40 WeakPolarHBondContact CE2-CD2 3.38Å; F31-H40 AromaticContact CE2-CG 3.48Å; F31-H40 VanDerWaalsContact CE2-CG 3.48Å; F31-H40 AromaticContact CE2-NE2 4Å; F31-H40 HydrophobicContact CZ-CB 3.35Å; F31-H40 AromaticContact CZ-CD2 3.38Å; F31-H40 WeakPolarHBondContact CZ-CD2 3.38Å; F31-H40 AromaticContact CZ-CG 3.11Å; F31-H40 AromaticContact CZ-ND1 3.68Å; V36-H40 PolarHBondContact O-N 3.39Å; L37-H40 PolarHBondContact O-N 2.97Å; H40-A42 VanDerWaalsContact C-N 3.26Å; H40-A42 PolarHBondContact O-N 3.42Å; H40-D43 PolarHBondContact O-N 2.71Å; H40-S44 VanDerWaalsContact CE1-CB 3.41Å; H40-S44 WeakPolarHBondContact CE1-CB 3.42Å; H40-S44 PolarHBondContact CE1-OG 3.14Å; H40-S44 VanDerWaalsContact CE1-OG 3.25Å; H40-S44 PolarHBondContact ND1-OG 3.34Å; H40-S44 WeakPolarHBondContact O-CB 3.34Å; H40-S44 PolarHBondContact O-N 3.24Å; H40-S44 PolarHBondContact O-OG 3.04Å; H40-H46 AromaticContact CE1-CE1 3.61Å; H40-H46 AromaticContact CE1-ND1 3.22Å; H40-H46 PolarHBondContact CE1-ND1 3.44Å; H40-H46 AromaticContact NE2-CE1 3.67Å; H40-H46 AromaticContact NE2-ND1 2.98Å; H40-H46 PolarHBondContact NE2-ND1 3.41Å
41	Q	80.2	Confident	74.9	Confident	4 Å²	4	63.2 Å²	63.2	2%	0.019	35%	0.345	C	S	.	.	H	α-helix	trans	-72.4	-19.9	178.4	-70.6	-176.5	-95.9	0	0	113.2	L37 Y38 A39 H46 W62	L37-Q41 HydrophobicContact CD1-CG 3.94Å; L37-Q41 HydrophobicContact CG-CG 4.47Å; L37-Q41 VanDerWaalsContact CG-OE1 3.29Å; L37-Q41 WeakPolarHBondContact O-CG 3.44Å; L37-Q41 PolarHBondContact O-N 3.11Å; Y38-Q41 PolarHBondContact O-N 3.38Å; A39-Q41 PolarHBondContact O-N 3.22Å; Q41-H46 HydrophobicContact CB-CB 4.49Å; Q41-H46 HydrophobicContact CG-CB 4.1Å; Q41-H46 PolarHBondContact NE2-O 3.07Å; Q41-H46 PolarHBondContact O-N 3.36Å; Q41-W62 VanDerWaalsContact NE2-CZ3 3.28Å
42	A	75.4	Confident	74.5	Confident	57 Å²	57	62.2 Å²	62.2	47%	0.471	34%	0.341	S	S	.	.	H	α-helix	trans	-80	-48.4	166.9	0	0	0	0	0	111.5	Y38 A39 H40 S44	Y38-A42 PolarHBondContact O-N 3.43Å; A39-A42 WeakPolarHBondContact O-CB 3.34Å; A39-A42 PolarHBondContact O-N 3.43Å; H40-A42 VanDerWaalsContact C-N 3.26Å; H40-A42 PolarHBondContact O-N 3.42Å; A42-S44 VanDerWaalsContact C-N 3.29Å; A42-S44 PolarHBondContact O-N 2.91Å
43	D	77.6	Confident	74.5	Confident	133 Å²	133	63.2 Å²	63.2	71%	0.711	35%	0.348	S	S	*	.	H	α-helix	trans	-73.3	-16	-174.8	-61.2	-22.8	0	0	0	114	A39 H40	A39-D43 WeakPolarHBondContact O-CB 3.48Å; A39-D43 PolarHBondContact O-N 3.41Å; H40-D43 PolarHBondContact O-N 2.71Å
44	S	74	Confident	74.5	Confident	40 Å²	40	64.7 Å²	64.7	28%	0.28	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127	19.9	-175.1	-52	0	0	0	0	113.6	H40 A42 H46	H40-S44 VanDerWaalsContact CE1-CB 3.41Å; H40-S44 WeakPolarHBondContact CE1-CB 3.42Å; H40-S44 PolarHBondContact CE1-OG 3.14Å; H40-S44 VanDerWaalsContact CE1-OG 3.25Å; H40-S44 PolarHBondContact ND1-OG 3.34Å; H40-S44 WeakPolarHBondContact O-CB 3.34Å; H40-S44 PolarHBondContact O-N 3.24Å; H40-S44 PolarHBondContact O-OG 3.04Å; A42-S44 VanDerWaalsContact C-N 3.29Å; A42-S44 PolarHBondContact O-N 2.91Å; S44-H46 WeakPolarHBondContact CB-ND1 3.19Å; S44-H46 PolarHBondContact O-CD2 3.06Å; S44-H46 VanDerWaalsContact O-CG 3.31Å; S44-H46 PolarHBondContact O-N 2.9Å; S44-H46 PolarHBondContact O-ND1 3.36Å
45	E	67.5	Low	74.4	Confident	182 Å²	182	66 Å²	66	85%	0.85	38%	0.384	S	S	*	.			trans	54.7	10.7	177.9	-57.4	-167.3	147.2	0	0	116.4	A47	E45-A47 PolarHBondContact O-N 2.83Å
46	H	76.6	Confident	74.4	Confident	47 Å²	47	63.6 Å²	63.6	22%	0.218	38%	0.378	C	S	.	.			trans	-76.2	35.4	-178.8	-60.4	141.2	0	0	0	114	C26 C27 H40 Q41 S44	C26-H46 HydrophobicContact CB-CB 3.89Å; C26-H46 WeakPolarHBondContact CB-CD2 3.33Å; C27-H46 VanDerWaalsContact CB-CE1 3.46Å; C27-H46 WeakPolarHBondContact CB-CE1 3.36Å; C27-H46 PolarHBondContact SG-CE1 3.22Å; H40-H46 AromaticContact CE1-CE1 3.61Å; H40-H46 AromaticContact CE1-ND1 3.22Å; H40-H46 PolarHBondContact CE1-ND1 3.44Å; H40-H46 AromaticContact NE2-CE1 3.67Å; H40-H46 AromaticContact NE2-ND1 2.98Å; H40-H46 PolarHBondContact NE2-ND1 3.41Å; Q41-H46 HydrophobicContact CB-CB 4.49Å; Q41-H46 HydrophobicContact CG-CB 4.1Å; Q41-H46 PolarHBondContact NE2-O 3.07Å; Q41-H46 PolarHBondContact O-N 3.36Å; S44-H46 WeakPolarHBondContact CB-ND1 3.19Å; S44-H46 PolarHBondContact O-CD2 3.06Å; S44-H46 VanDerWaalsContact O-CG 3.31Å; S44-H46 PolarHBondContact O-N 2.9Å; S44-H46 PolarHBondContact O-ND1 3.36Å
47	A	68.4	Low	74.4	Confident	12 Å²	12	66.1 Å²	66.1	10%	0.099	39%	0.389	C	S	.	.	S	Bend	trans	-114.3	102.6	175.9	0	0	0	0	0	109.4	E45 Q49 Y59 V73	E45-A47 PolarHBondContact O-N 2.83Å; A47-Q49 PolarHBondContact O-N 2.8Å; A47-Y59 HydrophobicContact CB-CD1 3.92Å; A47-Y59 HydrophobicContact CB-CE1 4.15Å; A47-V73 HydrophobicContact CB-CG1 4.46Å; A47-V73 HydrophobicContact CB-CG2 3.92Å
48	E	64.9	Low	74.4	Confident	104 Å²	104	68.2 Å²	68.2	49%	0.486	40%	0.399	S	S	.	.			trans	-55.9	112.5	-174.8	-67.6	-175.5	160	0	0	112.3	M60	E48-M60 HydrophobicContact CB-CE 4.45Å; E48-M60 PolarHBondContact O-N 3.16Å; E48-M60 WeakPolarHBondContact OE2-CE 3.45Å
49	Q	72.2	Confident	74.7	Confident	113 Å²	113	70.2 Å²	70.2	53%	0.528	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	130.3	165.8	-65.1	-177	9.9	0	0	109.2	A47 Y59	A47-Q49 PolarHBondContact O-N 2.8Å; Q49-Y59 HydrophobicContact CG-CD1 3.83Å; Q49-Y59 HydrophobicContact CG-CE1 3.6Å; Q49-Y59 PolarHBondContact NE2-OH 3.07Å
50	G	72	Confident	75	Confident	15 Å²	15	70.5 Å²	70.5	16%	0.155	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	154.9	173.8	0	0	0	0	0	111.2	S52 Q58	G50-S52 PolarHBondContact O-N 3.4Å; G50-Q58 PolarHBondContact N-O 2.91Å; G50-Q58 PolarHBondContact O-N 2.96Å
51	I	74.3	Confident	75	Confident	116 Å²	116	70.2 Å²	70.2	60%	0.595	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.2	117.3	170.2	-57.7	173.9	0	0	0	107.3	L57 Y69	I51-L57 HydrophobicContact CG1-CD2 4.02Å; I51-Y69 WeakPolarHBondContact O-CE1 3.36Å; I51-Y69 PolarHBondContact O-OH 3.19Å
52	S	71.5	Confident	74.7	Confident	5 Å²	5	72.9 Å²	72.9	4%	0.035	41%	0.41	C	S	.	.			trans	-67.8	161.7	173.1	64.7	0	0	0	0	111.2	G50 S54 G55 V56	G50-S52 PolarHBondContact O-N 3.4Å; S52-S54 PolarHBondContact O-N 3.28Å; S52-G55 PolarHBondContact O-N 3.49Å; S52-V56 VanDerWaalsContact CB-O 3.31Å; S52-V56 WeakPolarHBondContact CB-O 3.4Å; S52-V56 PolarHBondContact N-O 3.29Å; S52-V56 PolarHBondContact OG-N 3.34Å; S52-V56 PolarHBondContact OG-O 2.88Å
53	P	73.5	Confident	74.5	Confident	124 Å²	124	73.4 Å²	73.4	81%	0.805	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-21.1	174.9	-27.8	36.5	0	0	0	114.7	G55	P53-G55 VanDerWaalsContact C-N 3.3Å
54	S	71.7	Confident	74.1	Confident	103 Å²	103	78.7 Å²	78.7	72%	0.72	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	5.9	175.8	-48	0	0	0	0	114.1	S52 V56	S52-S54 PolarHBondContact O-N 3.28Å; S54-V56 PolarHBondContact O-N 3.41Å
55	G	73.5	Confident	74	Confident	57 Å²	57	80.6 Å²	80.6	59%	0.588	44%	0.435	S	S	*	.	S	Bend	trans	77.8	-1.6	-177.3	0	0	0	0	0	115.2	S52 P53	S52-G55 PolarHBondContact O-N 3.49Å; P53-G55 VanDerWaalsContact C-N 3.3Å
56	V	74.7	Confident	74.6	Confident	80 Å²	80	73.2 Å²	73.2	49%	0.485	40%	0.404	S	S	.	.			trans	-89.1	135.3	-178.5	-174.2	0	0	0	0	110.2	S52 S54 Q58	S52-V56 VanDerWaalsContact CB-O 3.31Å; S52-V56 WeakPolarHBondContact CB-O 3.4Å; S52-V56 PolarHBondContact N-O 3.29Å; S52-V56 PolarHBondContact OG-N 3.34Å; S52-V56 PolarHBondContact OG-O 2.88Å; S54-V56 PolarHBondContact O-N 3.41Å; V56-Q58 HydrophobicContact CG1-CG 4.31Å; V56-Q58 PolarHBondContact O-N 3.38Å
57	L	77.2	Confident	74.6	Confident	114 Å²	114	74.7 Å²	74.7	60%	0.597	42%	0.42	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.7	125.3	170.7	-77.1	166.9	0	0	0	110.6	I51	I51-L57 HydrophobicContact CG1-CD2 4.02Å
58	Q	82.2	Confident	75.3	Confident	52 Å²	52	81.1 Å²	81.1	24%	0.243	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	151.7	-177.4	-70.4	-175.8	-10.6	0	0	110.4	G50 V56 Y69	G50-Q58 PolarHBondContact N-O 2.91Å; G50-Q58 PolarHBondContact O-N 2.96Å; V56-Q58 HydrophobicContact CG1-CG 4.31Å; V56-Q58 PolarHBondContact O-N 3.38Å; Q58-Y69 HydrophobicContact CB-CD1 4.24Å; Q58-Y69 HydrophobicContact CB-CG 4.5Å
59	Y	81.9	Confident	76.4	Confident	63 Å²	63	79.9 Å²	79.9	25%	0.247	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	127.1	-179.4	-66.1	-84.9	0	0	0	111.1	A47 Q49 Y69 F70 V73	A47-Y59 HydrophobicContact CB-CD1 3.92Å; A47-Y59 HydrophobicContact CB-CE1 4.15Å; Q49-Y59 HydrophobicContact CG-CD1 3.83Å; Q49-Y59 HydrophobicContact CG-CE1 3.6Å; Q49-Y59 PolarHBondContact NE2-OH 3.07Å; Y59-Y69 CarbonylContact O-C 3.5Å; Y59-Y69 WeakPolarHBondContact O-CA 3.43Å; Y59-F70 PolarHBondContact N-O 3.38Å; Y59-F70 PolarHBondContact O-N 2.71Å; Y59-V73 HydrophobicContact CD1-CG2 3.67Å; Y59-V73 HydrophobicContact CD2-CG2 4.31Å; Y59-V73 HydrophobicContact CE1-CG2 3.52Å; Y59-V73 HydrophobicContact CE2-CG2 4.19Å; Y59-V73 HydrophobicContact CG-CG2 4.06Å
60	M	83.6	Confident	76.9	Confident	50 Å²	50	76 Å²	76	25%	0.246	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	141.5	-179.1	-174.9	172.2	60	0	0	111.4	E48 W62	E48-M60 HydrophobicContact CB-CE 4.45Å; E48-M60 PolarHBondContact O-N 3.16Å; E48-M60 WeakPolarHBondContact OE2-CE 3.45Å; M60-W62 PolarHBondContact O-N 3.35Å
61	C	81.5	Confident	77.4	Confident	4 Å²	4	80.4 Å²	80.4	3%	0.027	44%	0.44	C	S	.	.	P	Polyproline II helix	trans	-74.6	116.2	170	-173.7	0	0	0	0	111.6	W63 C66 R68 F70 V76 H79 H84	C61-W63 PolarHBondContact O-N 3.41Å; C61-C66 HydrophobicContact CB-CB 4.37Å; C61-R68 PolarHBondContact N-O 3.18Å; C61-F70 HydrophobicContact CB-CE2 4.24Å; C61-V76 HydrophobicContact CB-CG1 4.36Å; C61-H79 VanDerWaalsContact SG-CD2 3.54Å; C61-H79 PolarHBondContact SG-NE2 2.98Å; C61-H84 VanDerWaalsContact SG-CD2 3.53Å; C61-H84 PolarHBondContact SG-NE2 2.88Å; C61-H84 VanDerWaalsContact SG-NE2 3.4Å
62	W	73.9	Confident	77.7	Confident	59 Å²	59	77.1 Å²	77.1	22%	0.223	43%	0.427	C	S	.	.			trans	-68.9	-5.6	-179.2	60.8	77.6	0	0	0	115.6	Y38 Q41 M60 R64 V76 F80	Y38-W62 AromaticContact CD1-CH2 3.67Å; Y38-W62 HydrophobicContact CD1-CH2 3.67Å; Y38-W62 HydrophobicContact CD1-CZ2 4.13Å; Y38-W62 AromaticContact CE1-CH2 3.32Å; Y38-W62 HydrophobicContact CE1-CH2 3.32Å; Y38-W62 AromaticContact CE1-CZ2 3.47Å; Y38-W62 HydrophobicContact CE1-CZ2 3.47Å; Y38-W62 VanDerWaalsContact CE1-CZ2 3.47Å; Y38-W62 HydrophobicContact CE1-CZ3 4.45Å; Q41-W62 VanDerWaalsContact NE2-CZ3 3.28Å; M60-W62 PolarHBondContact O-N 3.35Å; W62-R64 PolarHBondContact O-N 3.38Å; W62-V76 HydrophobicContact CE3-CG1 4.33Å; W62-V76 HydrophobicContact CZ3-CG1 4.14Å; W62-F80 AromaticContact CD1-CE2 3.98Å; W62-F80 AromaticContact NE1-CD2 3.98Å; W62-F80 AromaticContact NE1-CE2 3.39Å
63	W	71.7	Confident	78.1	Confident	69 Å²	69	78.3 Å²	78.3	26%	0.261	43%	0.434	S	S	.	.	S	Bend	trans	-68.9	121.9	175.6	-170	-89.2	0	0	0	110.1	C61 G65 C66 F80 H84 T87 N88	C61-W63 PolarHBondContact O-N 3.41Å; W63-G65 PolarHBondContact O-N 3.39Å; W63-C66 HydrophobicContact CB-CB 4.4Å; W63-C66 WeakPolarHBondContact O-CB 3.42Å; W63-C66 PolarHBondContact O-N 2.82Å; W63-F80 HydrophobicContact CB-CD2 4.37Å; W63-F80 HydrophobicContact CB-CE2 4.11Å; W63-F80 HydrophobicContact CD2-CE2 4.33Å; W63-F80 HydrophobicContact CD2-CZ 4.49Å; W63-F80 HydrophobicContact CE3-CE1 4.37Å; W63-F80 AromaticContact CE3-CE2 3.53Å; W63-F80 HydrophobicContact CE3-CE2 3.53Å; W63-F80 AromaticContact CE3-CZ 3.41Å; W63-F80 HydrophobicContact CE3-CZ 3.41Å; W63-F80 VanDerWaalsContact CE3-CZ 3.41Å; W63-F80 HydrophobicContact CZ3-CE1 4.39Å; W63-F80 HydrophobicContact CZ3-CE2 4.27Å; W63-F80 AromaticContact CZ3-CZ 3.67Å; W63-F80 HydrophobicContact CZ3-CZ 3.67Å; W63-H84 HydrophobicContact CB-CB 4.4Å; W63-H84 VanDerWaalsContact CB-CD2 3.46Å; W63-H84 WeakPolarHBondContact CB-CD2 3.16Å; W63-H84 AromaticContact CD1-CE1 3.82Å; W63-H84 AromaticContact CD1-CG 3.82Å; W63-H84 AromaticContact CD1-ND1 3.47Å; W63-H84 HydrophobicContact CD2-CB 3.67Å; W63-H84 AromaticContact CD2-CG 3.79Å; W63-H84 HydrophobicContact CE3-CB 3.86Å; W63-H84 HydrophobicContact CG-CB 3.95Å; W63-H84 AromaticContact CG-CD2 3.81Å; W63-H84 AromaticContact CG-CG 3.49Å; W63-H84 VanDerWaalsContact CG-CG 3.49Å; W63-H84 AromaticContact CG-ND1 3.65Å; W63-H84 HydrophobicContact CZ2-CB 4.44Å; W63-H84 HydrophobicContact CZ3-CB 4.27Å; W63-H84 AromaticContact NE1-ND1 3.85Å; W63-T87 VanDerWaalsContact CZ2-OG1 3.27Å; W63-T87 WeakPolarHBondContact CZ2-OG1 3.36Å; W63-N88 WeakPolarHBondContact CH2-OD1 3.49Å
64	R	69.3	Low	78.3	Confident	244 Å²	244	76 Å²	76	92%	0.921	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.6	122.9	-174.9	-78.8	-169.9	172.5	-152.1	-1.3	111.4	W62	W62-R64 PolarHBondContact O-N 3.38Å
65	G	72.7	Confident	78.8	Confident	79 Å²	79	72.3 Å²	72.3	81%	0.814	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.2	4.2	178.3	0	0	0	0	0	115.5	W63	W63-G65 PolarHBondContact O-N 3.39Å
66	C	78.9	Confident	79.2	Confident	27 Å²	27	69.8 Å²	69.8	18%	0.182	38%	0.375	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-44.1	174.4	-166.2	0	0	0	0	113.5	C61 W63 R68 H79 H84	C61-C66 HydrophobicContact CB-CB 4.37Å; W63-C66 HydrophobicContact CB-CB 4.4Å; W63-C66 WeakPolarHBondContact O-CB 3.42Å; W63-C66 PolarHBondContact O-N 2.82Å; C66-R68 PolarHBondContact O-N 2.81Å; C66-H79 PolarHBondContact SG-CE1 3.38Å; C66-H79 PolarHBondContact SG-NE2 3.46Å; C66-H84 WeakPolarHBondContact CB-NE2 3.29Å; C66-H84 PolarHBondContact SG-CE1 2.81Å; C66-H84 PolarHBondContact SG-NE2 3.24Å
67	S	77.5	Confident	79.4	Confident	79 Å²	79	66.1 Å²	66.1	55%	0.552	35%	0.353	S	S	*	.			trans	48.8	26.2	173.6	-56.7	0	0	0	0	115.9
68	R	83	Confident	79.5	Confident	146 Å²	146	62.5 Å²	62.5	55%	0.551	34%	0.339	S	S	*	.			trans	-90.1	137.8	175.9	-75.5	-174.4	177.7	-135.1	-4.4	110	C61 C66 F70	C61-R68 PolarHBondContact N-O 3.18Å; C66-R68 PolarHBondContact O-N 2.81Å; R68-F70 HydrophobicContact CB-CD2 4.43Å; R68-F70 HydrophobicContact CB-CE2 3.43Å; R68-F70 VanDerWaalsContact CB-CE2 3.43Å; R68-F70 HydrophobicContact CB-CZ 3.65Å; R68-F70 WeakPolarHBondContact O-CE2 3.38Å
69	Y	86.5	Confident	79.5	Confident	78 Å²	78	60.5 Å²	60.5	31%	0.306	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	146.1	177.9	-60.9	-97	0	0	0	109.9	I51 Q58 Y59	I51-Y69 WeakPolarHBondContact O-CE1 3.36Å; I51-Y69 PolarHBondContact O-OH 3.19Å; Q58-Y69 HydrophobicContact CB-CD1 4.24Å; Q58-Y69 HydrophobicContact CB-CG 4.5Å; Y59-Y69 CarbonylContact O-C 3.5Å; Y59-Y69 WeakPolarHBondContact O-CA 3.43Å
70	F	84.4	Confident	79.3	Confident	32 Å²	32	58.1 Å²	58.1	14%	0.14	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	147.3	-175.6	-65.6	-82.3	0	0	0	111.7	Y59 C61 R68 S72 A75 V76 H79	Y59-F70 PolarHBondContact N-O 3.38Å; Y59-F70 PolarHBondContact O-N 2.71Å; C61-F70 HydrophobicContact CB-CE2 4.24Å; R68-F70 HydrophobicContact CB-CD2 4.43Å; R68-F70 HydrophobicContact CB-CE2 3.43Å; R68-F70 VanDerWaalsContact CB-CE2 3.43Å; R68-F70 HydrophobicContact CB-CZ 3.65Å; R68-F70 WeakPolarHBondContact O-CE2 3.38Å; F70-S72 PolarHBondContact O-N 2.98Å; F70-A75 HydrophobicContact CB-CB 3.93Å; F70-A75 HydrophobicContact CD1-CB 4.03Å; F70-A75 HydrophobicContact CG-CB 4.3Å; F70-V76 HydrophobicContact CB-CG2 3.84Å; F70-V76 HydrophobicContact CD2-CG2 3.9Å; F70-V76 HydrophobicContact CG-CG2 4.17Å; F70-H79 HydrophobicContact CD1-CB 4.42Å; F70-H79 HydrophobicContact CE1-CB 3.68Å; F70-H79 AromaticContact CE1-CG 3.91Å; F70-H79 HydrophobicContact CE2-CB 3.92Å; F70-H79 AromaticContact CE2-CD2 3.29Å; F70-H79 WeakPolarHBondContact CE2-CD2 3.44Å; F70-H79 AromaticContact CE2-CG 3.54Å; F70-H79 AromaticContact CE2-NE2 3.91Å; F70-H79 HydrophobicContact CZ-CB 3.4Å; F70-H79 AromaticContact CZ-CD2 3.41Å; F70-H79 VanDerWaalsContact CZ-CD2 3.41Å; F70-H79 WeakPolarHBondContact CZ-CD2 3.49Å; F70-H79 AromaticContact CZ-CG 3.12Å; F70-H79 AromaticContact CZ-ND1 3.57Å; F70-H79 AromaticContact CZ-NE2 3.97Å
71	P	81.6	Confident	79	Confident	107 Å²	107	61.8 Å²	61.8	70%	0.695	33%	0.332	S	S	*	.	S	Bend	trans	-71.3	-12.8	-178.6	29.3	-35.8	0	0	0	113.9
72	S	80.7	Confident	78.7	Confident	47 Å²	47	67.6 Å²	67.6	33%	0.329	36%	0.359	S	S	.	.	S	Bend	trans	-152.7	156.2	179.1	70.2	0	0	0	0	112.9	F70 A74 A75 V76	F70-S72 PolarHBondContact O-N 2.98Å; S72-A74 PolarHBondContact O-N 3.42Å; S72-A75 WeakPolarHBondContact O-CB 3.33Å; S72-A75 PolarHBondContact O-N 3.11Å; S72-A75 PolarHBondContact OG-N 3Å; S72-V76 PolarHBondContact O-N 3.08Å; S72-V76 VanDerWaalsContact O-N 3.09Å
73	V	79.6	Confident	78.7	Confident	30 Å²	30	69.7 Å²	69.7	18%	0.182	37%	0.369	C	S	.	.	H	α-helix	trans	-58.1	-35.4	172.3	-176.1	0	0	0	0	111.3	A47 Y59 A75 V76 G77	A47-V73 HydrophobicContact CB-CG1 4.46Å; A47-V73 HydrophobicContact CB-CG2 3.92Å; Y59-V73 HydrophobicContact CD1-CG2 3.67Å; Y59-V73 HydrophobicContact CD2-CG2 4.31Å; Y59-V73 HydrophobicContact CE1-CG2 3.52Å; Y59-V73 HydrophobicContact CE2-CG2 4.19Å; Y59-V73 HydrophobicContact CG-CG2 4.06Å; V73-A75 VanDerWaalsContact C-N 3.32Å; V73-A75 PolarHBondContact O-N 2.83Å; V73-V76 WeakPolarHBondContact O-CB 3.46Å; V73-V76 PolarHBondContact O-N 3.13Å; V73-G77 PolarHBondContact O-N 3.31Å
74	A	78.3	Confident	78.8	Confident	75 Å²	75	67.1 Å²	67.1	62%	0.62	36%	0.36	S	S	*	.	H	α-helix	trans	-61.4	-39	174.8	0	0	0	0	0	112.4	S72 G77 A78	S72-A74 PolarHBondContact O-N 3.42Å; A74-G77 PolarHBondContact O-N 3.43Å; A74-A78 WeakPolarHBondContact O-CB 3.49Å; A74-A78 PolarHBondContact O-N 2.96Å
75	A	82.5	Confident	78.6	Confident	27 Å²	27	58.8 Å²	58.8	22%	0.223	34%	0.343	C	S	.	.	H	α-helix	trans	-70.8	-36.3	174.9	0	0	0	0	0	112.4	F70 S72 V73 G77 A78 H79	F70-A75 HydrophobicContact CB-CB 3.93Å; F70-A75 HydrophobicContact CD1-CB 4.03Å; F70-A75 HydrophobicContact CG-CB 4.3Å; S72-A75 WeakPolarHBondContact O-CB 3.33Å; S72-A75 PolarHBondContact O-N 3.11Å; S72-A75 PolarHBondContact OG-N 3Å; V73-A75 VanDerWaalsContact C-N 3.32Å; V73-A75 PolarHBondContact O-N 2.83Å; A75-G77 VanDerWaalsContact C-N 3.35Å; A75-A78 PolarHBondContact O-N 2.85Å; A75-H79 WeakPolarHBondContact O-CB 3.43Å; A75-H79 PolarHBondContact O-N 3.33Å
76	V	82.5	Confident	77.7	Confident	4 Å²	4	65.4 Å²	65.4	2%	0.024	34%	0.344	C	S	.	.	H	α-helix	trans	-58.7	-46.7	169	-177.4	0	0	0	0	110.8	C61 W62 F70 S72 V73 H79 F80	C61-V76 HydrophobicContact CB-CG1 4.36Å; W62-V76 HydrophobicContact CE3-CG1 4.33Å; W62-V76 HydrophobicContact CZ3-CG1 4.14Å; F70-V76 HydrophobicContact CB-CG2 3.84Å; F70-V76 HydrophobicContact CD2-CG2 3.9Å; F70-V76 HydrophobicContact CG-CG2 4.17Å; S72-V76 PolarHBondContact O-N 3.08Å; S72-V76 VanDerWaalsContact O-N 3.09Å; V73-V76 WeakPolarHBondContact O-CB 3.46Å; V73-V76 PolarHBondContact O-N 3.13Å; V76-H79 PolarHBondContact O-N 3.34Å; V76-F80 WeakPolarHBondContact O-CB 3.21Å; V76-F80 PolarHBondContact O-N 3.06Å
77	G	77.1	Confident	76.4	Confident	2 Å²	2	68.1 Å²	68.1	2%	0.021	36%	0.359	C	S	.	.	H	α-helix	trans	-65.1	-39.7	179.2	0	0	0	0	0	113.5	V73 A74 A75 R81	V73-G77 PolarHBondContact O-N 3.31Å; A74-G77 PolarHBondContact O-N 3.43Å; A75-G77 VanDerWaalsContact C-N 3.35Å; G77-R81 WeakPolarHBondContact O-CG 3.45Å; G77-R81 PolarHBondContact O-N 2.95Å; G77-R81 VanDerWaalsContact O-N 3.11Å
78	A	79.8	Confident	74.6	Confident	38 Å²	38	71.1 Å²	71.1	31%	0.314	37%	0.369	S	S	.	.	H	α-helix	trans	-62.5	-51.3	172.6	0	0	0	0	0	111.3	A74 A75 F80 R81 E82	A74-A78 WeakPolarHBondContact O-CB 3.49Å; A74-A78 PolarHBondContact O-N 2.96Å; A75-A78 PolarHBondContact O-N 2.85Å; A78-F80 VanDerWaalsContact C-N 3.33Å; A78-F80 PolarHBondContact O-N 3.24Å; A78-R81 PolarHBondContact O-N 3.03Å; A78-E82 PolarHBondContact O-N 3.02Å
79	H	83.1	Confident	72.3	Confident	11 Å²	11	67.6 Å²	67.6	5%	0.051	38%	0.379	C	S	.	.	H	α-helix	trans	-55.1	-44.4	177.2	160.4	62.1	0	0	0	113	C61 C66 F70 A75 V76 E82 K83 H84	C61-H79 VanDerWaalsContact SG-CD2 3.54Å; C61-H79 PolarHBondContact SG-NE2 2.98Å; C66-H79 PolarHBondContact SG-CE1 3.38Å; C66-H79 PolarHBondContact SG-NE2 3.46Å; F70-H79 HydrophobicContact CD1-CB 4.42Å; F70-H79 HydrophobicContact CE1-CB 3.68Å; F70-H79 AromaticContact CE1-CG 3.91Å; F70-H79 HydrophobicContact CE2-CB 3.92Å; F70-H79 AromaticContact CE2-CD2 3.29Å; F70-H79 WeakPolarHBondContact CE2-CD2 3.44Å; F70-H79 AromaticContact CE2-CG 3.54Å; F70-H79 AromaticContact CE2-NE2 3.91Å; F70-H79 HydrophobicContact CZ-CB 3.4Å; F70-H79 AromaticContact CZ-CD2 3.41Å; F70-H79 VanDerWaalsContact CZ-CD2 3.41Å; F70-H79 WeakPolarHBondContact CZ-CD2 3.49Å; F70-H79 AromaticContact CZ-CG 3.12Å; F70-H79 AromaticContact CZ-ND1 3.57Å; F70-H79 AromaticContact CZ-NE2 3.97Å; A75-H79 WeakPolarHBondContact O-CB 3.43Å; A75-H79 PolarHBondContact O-N 3.33Å; V76-H79 PolarHBondContact O-N 3.34Å; H79-E82 PolarHBondContact O-N 3.43Å; H79-K83 WeakPolarHBondContact ND1-CG 3.27Å; H79-K83 WeakPolarHBondContact O-CB 3.47Å; H79-K83 WeakPolarHBondContact O-CG 3.33Å; H79-K83 PolarHBondContact O-N 3.14Å; H79-H84 AromaticContact CD2-NE2 3.92Å; H79-H84 AromaticContact CE1-NE2 3.54Å; H79-H84 AromaticContact NE2-CD2 3.83Å; H79-H84 AromaticContact NE2-CE1 3.93Å; H79-H84 AromaticContact NE2-NE2 3.02Å; H79-H84 PolarHBondContact NE2-NE2 2.96Å
80	F	76.5	Confident	69.6	Low	12 Å²	12	69.7 Å²	69.7	5%	0.053	40%	0.404	C	S	.	.	H	α-helix	trans	-67.6	-40.8	179.9	-171	-68.3	0	0	0	111.8	L34 Y38 W62 W63 V76 A78 E82 K83 H84 A85	L34-F80 HydrophobicContact CD1-CE1 4.17Å; L34-F80 HydrophobicContact CD1-CZ 4.4Å; L34-F80 HydrophobicContact CD2-CD1 4.06Å; L34-F80 HydrophobicContact CD2-CE1 3.78Å; Y38-F80 WeakPolarHBondContact OH-CB 3.46Å; Y38-F80 WeakPolarHBondContact OH-CD1 3.44Å; Y38-F80 WeakPolarHBondContact OH-CG 3.46Å; W62-F80 AromaticContact CD1-CE2 3.98Å; W62-F80 AromaticContact NE1-CD2 3.98Å; W62-F80 AromaticContact NE1-CE2 3.39Å; W63-F80 HydrophobicContact CB-CD2 4.37Å; W63-F80 HydrophobicContact CB-CE2 4.11Å; W63-F80 HydrophobicContact CD2-CE2 4.33Å; W63-F80 HydrophobicContact CD2-CZ 4.49Å; W63-F80 HydrophobicContact CE3-CE1 4.37Å; W63-F80 AromaticContact CE3-CE2 3.53Å; W63-F80 HydrophobicContact CE3-CE2 3.53Å; W63-F80 AromaticContact CE3-CZ 3.41Å; W63-F80 HydrophobicContact CE3-CZ 3.41Å; W63-F80 VanDerWaalsContact CE3-CZ 3.41Å; W63-F80 HydrophobicContact CZ3-CE1 4.39Å; W63-F80 HydrophobicContact CZ3-CE2 4.27Å; W63-F80 AromaticContact CZ3-CZ 3.67Å; W63-F80 HydrophobicContact CZ3-CZ 3.67Å; V76-F80 WeakPolarHBondContact O-CB 3.21Å; V76-F80 PolarHBondContact O-N 3.06Å; A78-F80 VanDerWaalsContact C-N 3.33Å; A78-F80 PolarHBondContact O-N 3.24Å; F80-E82 VanDerWaalsContact C-N 3.25Å; F80-E82 PolarHBondContact O-N 3.13Å; F80-K83 PolarHBondContact O-N 3.32Å; F80-H84 HydrophobicContact CD1-CB 3.93Å; F80-H84 HydrophobicContact CD2-CB 4.08Å; F80-H84 AromaticContact CD2-CD2 3.65Å; F80-H84 HydrophobicContact CE1-CB 4.04Å; F80-H84 HydrophobicContact CE2-CB 4.2Å; F80-H84 HydrophobicContact CG-CB 3.95Å; F80-H84 AromaticContact CG-CD2 3.86Å; F80-H84 HydrophobicContact CZ-CB 4.18Å; F80-H84 PolarHBondContact O-N 3.38Å; F80-A85 PolarHBondContact O-N 3.17Å
81	R	77.4	Confident	67.2	Low	128 Å²	128	75.6 Å²	75.6	48%	0.483	44%	0.436	S	S	.	.	H	α-helix	trans	-60.7	-34	172.7	-73.2	-173.7	-60.2	-96.9	3.7	112.3	G77 A78	G77-R81 WeakPolarHBondContact O-CG 3.45Å; G77-R81 PolarHBondContact O-N 2.95Å; G77-R81 VanDerWaalsContact O-N 3.11Å; A78-R81 PolarHBondContact O-N 3.03Å
82	E	75.1	Confident	65.1	Low	125 Å²	125	77.9 Å²	77.9	58%	0.584	44%	0.437	S	S	*	.	H	α-helix	trans	-77.8	-44	176.4	-72.3	-165.3	170.4	0	0	114.6	A78 H79 F80	A78-E82 PolarHBondContact O-N 3.02Å; H79-E82 PolarHBondContact O-N 3.43Å; F80-E82 VanDerWaalsContact C-N 3.25Å; F80-E82 PolarHBondContact O-N 3.13Å
83	K	74.3	Confident	63.2	Low	104 Å²	104	80.9 Å²	80.9	45%	0.452	45%	0.454	S	S	.	.	H	α-helix	trans	-101.4	-40.1	-167.4	-55.3	-51.8	-178.2	-158.6	0	113.8	H79 F80	H79-K83 WeakPolarHBondContact ND1-CG 3.27Å; H79-K83 WeakPolarHBondContact O-CB 3.47Å; H79-K83 WeakPolarHBondContact O-CG 3.33Å; H79-K83 PolarHBondContact O-N 3.14Å; F80-K83 PolarHBondContact O-N 3.32Å
84	H	75.1	Confident	61.8	Low	15 Å²	15	88 Å²	88	7%	0.069	48%	0.477	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.2	-26.6	-166.8	-55.5	-39	0	0	0	113.8	C61 W63 C66 H79 F80 R86 T87	C61-H84 VanDerWaalsContact SG-CD2 3.53Å; C61-H84 PolarHBondContact SG-NE2 2.88Å; C61-H84 VanDerWaalsContact SG-NE2 3.4Å; W63-H84 HydrophobicContact CB-CB 4.4Å; W63-H84 VanDerWaalsContact CB-CD2 3.46Å; W63-H84 WeakPolarHBondContact CB-CD2 3.16Å; W63-H84 AromaticContact CD1-CE1 3.82Å; W63-H84 AromaticContact CD1-CG 3.82Å; W63-H84 AromaticContact CD1-ND1 3.47Å; W63-H84 HydrophobicContact CD2-CB 3.67Å; W63-H84 AromaticContact CD2-CG 3.79Å; W63-H84 HydrophobicContact CE3-CB 3.86Å; W63-H84 HydrophobicContact CG-CB 3.95Å; W63-H84 AromaticContact CG-CD2 3.81Å; W63-H84 AromaticContact CG-CG 3.49Å; W63-H84 VanDerWaalsContact CG-CG 3.49Å; W63-H84 AromaticContact CG-ND1 3.65Å; W63-H84 HydrophobicContact CZ2-CB 4.44Å; W63-H84 HydrophobicContact CZ3-CB 4.27Å; W63-H84 AromaticContact NE1-ND1 3.85Å; C66-H84 WeakPolarHBondContact CB-NE2 3.29Å; C66-H84 PolarHBondContact SG-CE1 2.81Å; C66-H84 PolarHBondContact SG-NE2 3.24Å; H79-H84 AromaticContact CD2-NE2 3.92Å; H79-H84 AromaticContact CE1-NE2 3.54Å; H79-H84 AromaticContact NE2-CD2 3.83Å; H79-H84 AromaticContact NE2-CE1 3.93Å; H79-H84 AromaticContact NE2-NE2 3.02Å; H79-H84 PolarHBondContact NE2-NE2 2.96Å; F80-H84 HydrophobicContact CD1-CB 3.93Å; F80-H84 HydrophobicContact CD2-CB 4.08Å; F80-H84 AromaticContact CD2-CD2 3.65Å; F80-H84 HydrophobicContact CE1-CB 4.04Å; F80-H84 HydrophobicContact CE2-CB 4.2Å; F80-H84 HydrophobicContact CG-CB 3.95Å; F80-H84 AromaticContact CG-CD2 3.86Å; F80-H84 HydrophobicContact CZ-CB 4.18Å; F80-H84 PolarHBondContact O-N 3.38Å; H84-R86 PolarHBondContact O-N 3.41Å; H84-T87 WeakPolarHBondContact CA-OG1 3.38Å; H84-T87 PolarHBondContact O-N 3.28Å; H84-T87 VanDerWaalsContact O-N 3.11Å; H84-T87 PolarHBondContact O-OG1 3.4Å
85	A	63.7	Low	61.5	Low	68 Å²	68	92.5 Å²	92.5	56%	0.562	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-3.5	173	0	0	0	0	0	114.2	F80	F80-A85 PolarHBondContact O-N 3.17Å
86	R	53.7	Low	61.1	Low	218 Å²	218	94.7 Å²	94.7	82%	0.823	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.4	-7.2	176.8	-60.3	-172.6	-176.4	-160.8	2.8	114.5	H84	H84-R86 PolarHBondContact O-N 3.41Å
87	T	53	Low	61	Low	84 Å²	84	101.4 Å²	101.4	52%	0.515	51%	0.509	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.2	-15.2	-166.8	34.9	0	0	0	0	116.3	W63 H84 G89	W63-T87 VanDerWaalsContact CZ2-OG1 3.27Å; W63-T87 WeakPolarHBondContact CZ2-OG1 3.36Å; H84-T87 WeakPolarHBondContact CA-OG1 3.38Å; H84-T87 PolarHBondContact O-N 3.28Å; H84-T87 VanDerWaalsContact O-N 3.11Å; H84-T87 PolarHBondContact O-OG1 3.4Å; T87-G89 PolarHBondContact O-N 3.02Å; T87-G89 VanDerWaalsContact O-N 3.14Å
88	N	39.9	Very low	61.3	Low	142 Å²	142	102 Å²	102	76%	0.759	51%	0.512	S	S	*	.	S	Bend	trans	-84.7	82.1	171.3	-81.6	0.3	0	0	0	110.8	W63	W63-N88 WeakPolarHBondContact CH2-OD1 3.49Å
89	G	34.2	Very low	61.3	Low	73 Å²	73	103.2 Å²	103.2	75%	0.753	52%	0.516	S	S	*	.			trans	-93	139.3	-178.2	0	0	0	0	0	114.4	T87	T87-G89 PolarHBondContact O-N 3.02Å; T87-G89 VanDerWaalsContact O-N 3.14Å
90	C	29.8	Very low	61.1	Low	122 Å²	122	106.1 Å²	106.1	82%	0.824	53%	0.532	S	S	*	.			trans	-152.1	161.2	151.5	-162.5	0	0	0	0	110
91	L	33.5	Very low	61.4	Low	155 Å²	155	107.8 Å²	107.8	81%	0.812	55%	0.545	S	S	*	.	S	Bend	trans	64.2	94.4	176.5	-64.3	167.1	0	0	0	116.6
92	E	37.6	Very low	61.7	Low	155 Å²	155	109.6 Å²	109.6	72%	0.724	56%	0.564	S	S	*	*			trans	8.3	117.8	151.6	-56.1	-177.2	135	0	0	117.8	R94	E92-R94 VanDerWaalsContact C-N 3.29Å; E92-R94 PolarHBondContact O-N 2.91Å
93	T	40.1	Very low	61.8	Low	111 Å²	111	108 Å²	108	68%	0.681	56%	0.557	S	S	*	*			trans	-67.6	80.3	173.4	57.7	0	0	0	0	112.1	R95	T93-R95 PolarHBondContact O-N 3.49Å
94	R	51.6	Low	62.1	Low	178 Å²	178	106 Å²	106	67%	0.672	55%	0.554	S	S	*	*			trans	-63.4	101.3	170.7	-76	-169	174.6	-150.6	-2.6	109.4	E92 F96	E92-R94 VanDerWaalsContact C-N 3.29Å; E92-R94 PolarHBondContact O-N 2.91Å; R94-F96 HydrophobicContact CB-CE2 4.26Å; R94-F96 WeakPolarHBondContact O-CD2 3.42Å; R94-F96 WeakPolarHBondContact O-CE2 3.48Å; R94-F96 PolarHBondContact O-N 2.87Å
95	R	72	Confident	62.3	Low	171 Å²	171	106.5 Å²	106.5	65%	0.645	56%	0.556	S	S	*	*			trans	-57.2	105.8	173.8	-74.6	179.9	-177.7	171.6	1.8	110	T93 Y97 V104	T93-R95 PolarHBondContact O-N 3.49Å; R95-Y97 HydrophobicContact CB-CE2 3.9Å; R95-Y97 WeakPolarHBondContact O-CD2 3.39Å; R95-Y97 WeakPolarHBondContact O-CE2 3.42Å; R95-Y97 PolarHBondContact O-N 2.88Å; R95-V104 HydrophobicContact CB-CG1 3.53Å; R95-V104 HydrophobicContact CG-CG1 3.71Å
96	F	74	Confident	62.6	Low	73 Å²	73	108.2 Å²	108.2	32%	0.32	56%	0.559	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-84.7	90.1	178.2	-74.6	-81.3	0	0	0	109.1	R94 F105 L111	R94-F96 HydrophobicContact CB-CE2 4.26Å; R94-F96 WeakPolarHBondContact O-CD2 3.42Å; R94-F96 WeakPolarHBondContact O-CE2 3.48Å; R94-F96 PolarHBondContact O-N 2.87Å; F96-F105 HydrophobicContact CB-CB 4.05Å; F96-F105 PolarHBondContact N-O 2.85Å; F96-F105 WeakPolarHBondContact O-CD2 3.35Å; F96-F105 PolarHBondContact O-N 3.09Å; F96-L111 HydrophobicContact CB-CB 4.03Å; F96-L111 HydrophobicContact CB-CD2 3.88Å; F96-L111 HydrophobicContact CB-CG 4.48Å; F96-L111 HydrophobicContact CD1-CD2 4.15Å; F96-L111 HydrophobicContact CG-CD2 4.45Å
97	Y	80.4	Confident	63.7	Low	145 Å²	145	100.2 Å²	100.2	57%	0.569	54%	0.535	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.1	137.7	175.7	-55.8	-86.7	0	0	0	111	R95 V104	R95-Y97 HydrophobicContact CB-CE2 3.9Å; R95-Y97 WeakPolarHBondContact O-CD2 3.39Å; R95-Y97 WeakPolarHBondContact O-CE2 3.42Å; R95-Y97 PolarHBondContact O-N 2.88Å; Y97-V104 HydrophobicContact CD1-CG2 3.67Å; Y97-V104 HydrophobicContact CE1-CG1 4.43Å; Y97-V104 HydrophobicContact CE1-CG2 3.73Å
98	C	83.1	Confident	64.9	Low	14 Å²	14	97.3 Å²	97.3	10%	0.095	52%	0.521	C	S	.	.			trans	-70.5	149	164.1	-171	0	0	0	0	110.6	D100 C101 M103 F105 L111 H114	C98-D100 VanDerWaalsContact C-N 3.34Å; C98-D100 PolarHBondContact SG-N 3.46Å; C98-C101 VanDerWaalsContact CB-O 3.32Å; C98-C101 WeakPolarHBondContact CB-O 3.45Å; C98-M103 HydrophobicContact CB-CB 4.4Å; C98-M103 PolarHBondContact N-O 3.3Å; C98-F105 HydrophobicContact CB-CE2 4.32Å; C98-L111 HydrophobicContact CB-CD1 4.01Å; C98-H114 WeakPolarHBondContact CB-NE2 3.41Å; C98-H114 PolarHBondContact SG-CD2 2.8Å; C98-H114 PolarHBondContact SG-NE2 3.31Å
99	T	80.3	Confident	66.5	Low	64 Å²	64	94.5 Å²	94.5	39%	0.393	51%	0.506	S	S	.	.	S	Bend	trans	-89.1	-6.8	179.7	37	0	0	0	0	112.9	K115 R1879	T99-K115 WeakPolarHBondContact OG1-CE 3.34Å; T99-K115 PolarHBondContact OG1-NZ 3.21Å; T99-R1879 PolarHBondContact O-NH1 3.04Å; T99-R1879 PolarHBondContact O-NH2 2.93Å
100	D	78.7	Confident	68.5	Low	72 Å²	72	96.7 Å²	96.7	39%	0.385	50%	0.495	S	S	.	.	S	Bend	trans	-135.6	-3.1	-162.7	-48.7	-84.7	0	0	0	112.4	C98 H118 R1879	C98-D100 VanDerWaalsContact C-N 3.34Å; C98-D100 PolarHBondContact SG-N 3.46Å; D100-H118 PolarHBondContact O-CE1 2.81Å; D100-R1879 IonicContact OD1-CZ 3.38Å; D100-R1879 IonicContact OD1-NH2 3.87Å; D100-R1879 PolarHBondContact OD1-NH2 3.34Å; D100-R1879 IonicContact OD2-NH2 2.73Å
101	C	81.8	Confident	71.1	Confident	47 Å²	47	92 Å²	92	32%	0.318	46%	0.462	S	S	.	.	S	Bend	trans	-162.6	174.4	155.3	70.7	0	0	0	0	110.1	C98 M103 H114 H118	C98-C101 VanDerWaalsContact CB-O 3.32Å; C98-C101 WeakPolarHBondContact CB-O 3.45Å; C101-M103 PolarHBondContact O-N 3.26Å; C101-H114 PolarHBondContact SG-CE1 3.5Å; C101-H114 PolarHBondContact SG-NE2 3.22Å; C101-H118 PolarHBondContact SG-NE2 2.97Å; C101-H118 VanDerWaalsContact SG-NE2 3.41Å
102	D	83.2	Confident	73.3	Confident	165 Å²	165	92.8 Å²	92.8	88%	0.882	45%	0.454	S	S	*	.	S	Bend	trans	-78.3	18.5	-170.8	-48.6	-63.4	0	0	0	115.7
103	M	78.7	Confident	75	Confident	91 Å²	91	88 Å²	88	45%	0.448	43%	0.433	S	S	.	.			trans	-71.7	137.4	177.7	-80.4	-68.5	-61.6	0	0	112.3	C98 C101 F105	C98-M103 HydrophobicContact CB-CB 4.4Å; C98-M103 PolarHBondContact N-O 3.3Å; C101-M103 PolarHBondContact O-N 3.26Å; M103-F105 HydrophobicContact CB-CE2 3.53Å; M103-F105 HydrophobicContact CB-CZ 3.59Å; M103-F105 HydrophobicContact CE-CE1 3.64Å; M103-F105 HydrophobicContact CE-CE2 4.49Å; M103-F105 HydrophobicContact CE-CZ 3.53Å; M103-F105 HydrophobicContact CG-CZ 4.19Å
104	V	80.3	Confident	77	Confident	64 Å²	64	84.1 Å²	84.1	39%	0.388	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	129.6	178.6	-176.3	0	0	0	0	110.3	R95 Y97	R95-V104 HydrophobicContact CB-CG1 3.53Å; R95-V104 HydrophobicContact CG-CG1 3.71Å; Y97-V104 HydrophobicContact CD1-CG2 3.67Å; Y97-V104 HydrophobicContact CE1-CG1 4.43Å; Y97-V104 HydrophobicContact CE1-CG2 3.73Å
105	F	78.3	Confident	78.3	Confident	25 Å²	25	78.4 Å²	78.4	11%	0.11	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	147.5	-177.8	-61.8	-75.5	0	0	0	112.9	F96 C98 M103 F110 L111 H114	F96-F105 HydrophobicContact CB-CB 4.05Å; F96-F105 PolarHBondContact N-O 2.85Å; F96-F105 WeakPolarHBondContact O-CD2 3.35Å; F96-F105 PolarHBondContact O-N 3.09Å; C98-F105 HydrophobicContact CB-CE2 4.32Å; M103-F105 HydrophobicContact CB-CE2 3.53Å; M103-F105 HydrophobicContact CB-CZ 3.59Å; M103-F105 HydrophobicContact CE-CE1 3.64Å; M103-F105 HydrophobicContact CE-CE2 4.49Å; M103-F105 HydrophobicContact CE-CZ 3.53Å; M103-F105 HydrophobicContact CG-CZ 4.19Å; F105-F110 HydrophobicContact CB-CB 4.05Å; F105-F110 HydrophobicContact CD1-CB 3.45Å; F105-F110 VanDerWaalsContact CD1-CB 3.45Å; F105-F110 HydrophobicContact CE1-CB 4.28Å; F105-F110 HydrophobicContact CG-CB 4Å; F105-L111 HydrophobicContact CB-CB 4.18Å; F105-L111 HydrophobicContact CD2-CB 3.95Å; F105-L111 HydrophobicContact CD2-CD1 3.83Å; F105-L111 HydrophobicContact CE2-CD1 4.2Å; F105-L111 HydrophobicContact CG-CB 4.24Å; F105-H114 HydrophobicContact CE1-CB 3.95Å; F105-H114 HydrophobicContact CE2-CB 3.64Å; F105-H114 AromaticContact CE2-CD2 3.33Å; F105-H114 WeakPolarHBondContact CE2-CD2 3.41Å; F105-H114 AromaticContact CE2-CG 3.46Å; F105-H114 VanDerWaalsContact CE2-CG 3.46Å; F105-H114 HydrophobicContact CZ-CB 3.29Å; F105-H114 AromaticContact CZ-CD2 3.57Å; F105-H114 AromaticContact CZ-CG 3.19Å; F105-H114 AromaticContact CZ-ND1 3.59Å
106	V	71.3	Confident	78.3	Confident	104 Å²	104	71 Å²	71	63%	0.63	36%	0.362	S	S	*	.	S	Bend	trans	-79.2	-33.8	179.9	-177.7	0	0	0	0	111.5
107	T	75.9	Confident	78.1	Confident	50 Å²	50	73.7 Å²	73.7	31%	0.307	37%	0.371	S	S	.	.	S	Bend	trans	-124	159.5	175.8	73.5	0	0	0	0	111	D109 F110 L111	T107-D109 PolarHBondContact O-N 3.12Å; T107-D109 PolarHBondContact OG1-N 2.65Å; T107-F110 HydrophobicContact CG2-CD2 4.34Å; T107-F110 HydrophobicContact CG2-CE2 4.31Å; T107-F110 WeakPolarHBondContact OG1-CD2 3.33Å; T107-L111 PolarHBondContact O-N 3.3Å
108	G	78.1	Confident	78	Confident	22 Å²	22	70.4 Å²	70.4	23%	0.227	36%	0.361	C	S	.	.	H	α-helix	trans	-62.5	-22.2	175.1	0	0	0	0	0	112.9	L111 R112	G108-L111 CarbonylContact O-C 3.52Å; G108-L111 WeakPolarHBondContact O-CB 3.36Å; G108-L111 PolarHBondContact O-N 3Å; G108-R112 WeakPolarHBondContact O-CG 3.36Å; G108-R112 PolarHBondContact O-N 3.08Å
109	D	73.5	Confident	77.1	Confident	84 Å²	84	74.1 Å²	74.1	45%	0.449	38%	0.377	S	S	.	.	H	α-helix	trans	-79.1	-40.5	-175.1	-54.4	-60.4	0	0	0	112.7	T107 L111 R112 L113	T107-D109 PolarHBondContact O-N 3.12Å; T107-D109 PolarHBondContact OG1-N 2.65Å; D109-L111 PolarHBondContact O-N 3.49Å; D109-R112 WeakPolarHBondContact O-CB 3.42Å; D109-R112 PolarHBondContact O-N 3.46Å; D109-R112 VanDerWaalsContact O-N 3.12Å; D109-R112 IonicContact OD1-CZ 3.08Å; D109-R112 VanDerWaalsContact OD1-CZ 3.25Å; D109-R112 IonicContact OD1-NE 3.22Å; D109-R112 PolarHBondContact OD1-NE 2.77Å; D109-R112 VanDerWaalsContact OD1-NE 3.08Å; D109-R112 IonicContact OD1-NH2 3.52Å; D109-R112 PolarHBondContact OD1-NH2 3.19Å; D109-L113 WeakPolarHBondContact O-CB 3.46Å; D109-L113 PolarHBondContact O-N 2.9Å
110	F	76.2	Confident	75.8	Confident	119 Å²	119	77.4 Å²	77.4	52%	0.522	39%	0.392	S	S	.	.	H	α-helix	trans	-63.6	-33.8	168.1	-59.8	-62.9	0	0	0	111.2	F105 T107 H114	F105-F110 HydrophobicContact CB-CB 4.05Å; F105-F110 HydrophobicContact CD1-CB 3.45Å; F105-F110 VanDerWaalsContact CD1-CB 3.45Å; F105-F110 HydrophobicContact CE1-CB 4.28Å; F105-F110 HydrophobicContact CG-CB 4Å; T107-F110 HydrophobicContact CG2-CD2 4.34Å; T107-F110 HydrophobicContact CG2-CE2 4.31Å; T107-F110 WeakPolarHBondContact OG1-CD2 3.33Å; F110-H114 WeakPolarHBondContact O-CB 3.14Å; F110-H114 PolarHBondContact O-N 2.79Å
111	L	84.5	Confident	74.5	Confident	23 Å²	23	75 Å²	75	12%	0.12	38%	0.38	C	S	.	.	H	α-helix	trans	-66.3	-39.8	170.2	178.4	64.4	0	0	0	112.3	F96 C98 F105 T107 G108 D109 K115	F96-L111 HydrophobicContact CB-CB 4.03Å; F96-L111 HydrophobicContact CB-CD2 3.88Å; F96-L111 HydrophobicContact CB-CG 4.48Å; F96-L111 HydrophobicContact CD1-CD2 4.15Å; F96-L111 HydrophobicContact CG-CD2 4.45Å; C98-L111 HydrophobicContact CB-CD1 4.01Å; F105-L111 HydrophobicContact CB-CB 4.18Å; F105-L111 HydrophobicContact CD2-CB 3.95Å; F105-L111 HydrophobicContact CD2-CD1 3.83Å; F105-L111 HydrophobicContact CE2-CD1 4.2Å; F105-L111 HydrophobicContact CG-CB 4.24Å; T107-L111 PolarHBondContact O-N 3.3Å; G108-L111 CarbonylContact O-C 3.52Å; G108-L111 WeakPolarHBondContact O-CB 3.36Å; G108-L111 PolarHBondContact O-N 3Å; D109-L111 PolarHBondContact O-N 3.49Å; L111-K115 HydrophobicContact CD1-CD 4.16Å; L111-K115 HydrophobicContact CD1-CG 4.17Å; L111-K115 HydrophobicContact CG-CD 4.25Å; L111-K115 WeakPolarHBondContact O-CB 3.42Å; L111-K115 WeakPolarHBondContact O-CG 3.28Å; L111-K115 PolarHBondContact O-N 2.89Å
112	R	78.9	Confident	73.1	Confident	172 Å²	172	79.9 Å²	79.9	65%	0.649	40%	0.398	S	S	*	.	H	α-helix	trans	-61.1	-49.3	174	-73.7	-164.7	-69.8	167	-0.2	111	G108 D109 H114 K115 A116	G108-R112 WeakPolarHBondContact O-CG 3.36Å; G108-R112 PolarHBondContact O-N 3.08Å; D109-R112 WeakPolarHBondContact O-CB 3.42Å; D109-R112 PolarHBondContact O-N 3.46Å; D109-R112 VanDerWaalsContact O-N 3.12Å; D109-R112 IonicContact OD1-CZ 3.08Å; D109-R112 VanDerWaalsContact OD1-CZ 3.25Å; D109-R112 IonicContact OD1-NE 3.22Å; D109-R112 PolarHBondContact OD1-NE 2.77Å; D109-R112 VanDerWaalsContact OD1-NE 3.08Å; D109-R112 IonicContact OD1-NH2 3.52Å; D109-R112 PolarHBondContact OD1-NH2 3.19Å; R112-H114 PolarHBondContact O-N 3.21Å; R112-K115 PolarHBondContact O-N 3.15Å; R112-A116 PolarHBondContact O-N 3.49Å
113	L	74.4	Confident	71.3	Confident	55 Å²	55	77.9 Å²	77.9	29%	0.288	39%	0.388	S	S	.	.	H	α-helix	trans	-59.9	-46.3	178.4	-177.4	63	0	0	0	111.3	D109 K115 A116 Y117	D109-L113 WeakPolarHBondContact O-CB 3.46Å; D109-L113 PolarHBondContact O-N 2.9Å; L113-K115 PolarHBondContact O-N 2.96Å; L113-A116 WeakPolarHBondContact O-CB 3.41Å; L113-A116 PolarHBondContact O-N 3.24Å; L113-A116 VanDerWaalsContact O-N 3.15Å; L113-Y117 HydrophobicContact CG-CE2 4.47Å; L113-Y117 WeakPolarHBondContact O-CD2 3.38Å; L113-Y117 PolarHBondContact O-N 3.2Å
114	H	81	Confident	70	Confident	29 Å²	29	76.3 Å²	76.3	13%	0.134	38%	0.381	C	S	.	.	H	α-helix	trans	-66.4	-35.2	176.5	175.9	77.3	0	0	0	113.3	C98 C101 F105 F110 R112 A116 Y117 H118	C98-H114 WeakPolarHBondContact CB-NE2 3.41Å; C98-H114 PolarHBondContact SG-CD2 2.8Å; C98-H114 PolarHBondContact SG-NE2 3.31Å; C101-H114 PolarHBondContact SG-CE1 3.5Å; C101-H114 PolarHBondContact SG-NE2 3.22Å; F105-H114 HydrophobicContact CE1-CB 3.95Å; F105-H114 HydrophobicContact CE2-CB 3.64Å; F105-H114 AromaticContact CE2-CD2 3.33Å; F105-H114 WeakPolarHBondContact CE2-CD2 3.41Å; F105-H114 AromaticContact CE2-CG 3.46Å; F105-H114 VanDerWaalsContact CE2-CG 3.46Å; F105-H114 HydrophobicContact CZ-CB 3.29Å; F105-H114 AromaticContact CZ-CD2 3.57Å; F105-H114 AromaticContact CZ-CG 3.19Å; F105-H114 AromaticContact CZ-ND1 3.59Å; F110-H114 WeakPolarHBondContact O-CB 3.14Å; F110-H114 PolarHBondContact O-N 2.79Å; R112-H114 PolarHBondContact O-N 3.21Å; H114-A116 VanDerWaalsContact C-N 3.31Å; H114-A116 PolarHBondContact O-N 3.3Å; H114-Y117 WeakPolarHBondContact O-CB 3.49Å; H114-Y117 PolarHBondContact O-N 3.42Å; H114-H118 AromaticContact CD2-CD2 3.75Å; H114-H118 AromaticContact CD2-NE2 3.79Å; H114-H118 AromaticContact CE1-CD2 3.89Å; H114-H118 AromaticContact CE1-NE2 3.41Å; H114-H118 PolarHBondContact CE1-NE2 3.24Å; H114-H118 AromaticContact NE2-CD2 3.4Å; H114-H118 PolarHBondContact NE2-CD2 3.3Å; H114-H118 AromaticContact NE2-NE2 2.96Å; H114-H118 PolarHBondContact NE2-NE2 3.2Å; H114-H118 PolarHBondContact O-CD2 3.35Å; H114-H118 PolarHBondContact O-N 3.02Å
115	K	79.2	Confident	68.7	Low	58 Å²	58	75.7 Å²	75.7	25%	0.252	38%	0.375	S	S	.	.	H	α-helix	trans	-67.5	-30.1	171.2	-78.3	-176.9	166.2	-173.4	0	112.7	T99 L111 R112 L113 Y117 H118 H119	T99-K115 WeakPolarHBondContact OG1-CE 3.34Å; T99-K115 PolarHBondContact OG1-NZ 3.21Å; L111-K115 HydrophobicContact CD1-CD 4.16Å; L111-K115 HydrophobicContact CD1-CG 4.17Å; L111-K115 HydrophobicContact CG-CD 4.25Å; L111-K115 WeakPolarHBondContact O-CB 3.42Å; L111-K115 WeakPolarHBondContact O-CG 3.28Å; L111-K115 PolarHBondContact O-N 2.89Å; R112-K115 PolarHBondContact O-N 3.15Å; L113-K115 PolarHBondContact O-N 2.96Å; K115-Y117 VanDerWaalsContact C-N 3.33Å; K115-H118 PolarHBondContact O-N 2.9Å; K115-H119 PolarHBondContact O-CD2 3.31Å; K115-H119 VanDerWaalsContact O-CD2 3.31Å; K115-H119 PolarHBondContact O-N 3.49Å; K115-H119 VanDerWaalsContact O-N 3.12Å
116	A	73.2	Confident	67.2	Low	14 Å²	14	79.6 Å²	79.6	12%	0.116	40%	0.397	C	S	.	.	H	α-helix	trans	-65	-36	170.4	0	0	0	0	0	112.1	R112 L113 H114 H119 N120	R112-A116 PolarHBondContact O-N 3.49Å; L113-A116 WeakPolarHBondContact O-CB 3.41Å; L113-A116 PolarHBondContact O-N 3.24Å; L113-A116 VanDerWaalsContact O-N 3.15Å; H114-A116 VanDerWaalsContact C-N 3.31Å; H114-A116 PolarHBondContact O-N 3.3Å; A116-H119 PolarHBondContact O-N 3.12Å; A116-N120 PolarHBondContact O-N 3.31Å
117	Y	70	Confident	66.3	Low	131 Å²	131	77.1 Å²	77.1	51%	0.514	39%	0.387	S	S	.	.	H	α-helix	trans	-61.2	-41.9	171	-85.4	-81.7	0	0	0	112.8	L113 H114 K115 H119 N120 L125	L113-Y117 HydrophobicContact CG-CE2 4.47Å; L113-Y117 WeakPolarHBondContact O-CD2 3.38Å; L113-Y117 PolarHBondContact O-N 3.2Å; H114-Y117 WeakPolarHBondContact O-CB 3.49Å; H114-Y117 PolarHBondContact O-N 3.42Å; K115-Y117 VanDerWaalsContact C-N 3.33Å; Y117-H119 VanDerWaalsContact C-N 3.33Å; Y117-H119 PolarHBondContact O-N 3.48Å; Y117-N120 PolarHBondContact O-N 2.81Å; Y117-L125 HydrophobicContact CE2-CD2 4.42Å
118	H	76.8	Confident	65	Low	75 Å²	75	77.6 Å²	77.6	35%	0.347	39%	0.388	S	S	.	.	H	α-helix	trans	-64.5	-34.4	175.4	-79.7	-71.8	0	0	0	113.3	D100 C101 H114 K115	D100-H118 PolarHBondContact O-CE1 2.81Å; C101-H118 PolarHBondContact SG-NE2 2.97Å; C101-H118 VanDerWaalsContact SG-NE2 3.41Å; H114-H118 AromaticContact CD2-CD2 3.75Å; H114-H118 AromaticContact CD2-NE2 3.79Å; H114-H118 AromaticContact CE1-CD2 3.89Å; H114-H118 AromaticContact CE1-NE2 3.41Å; H114-H118 PolarHBondContact CE1-NE2 3.24Å; H114-H118 AromaticContact NE2-CD2 3.4Å; H114-H118 PolarHBondContact NE2-CD2 3.3Å; H114-H118 AromaticContact NE2-NE2 2.96Å; H114-H118 PolarHBondContact NE2-NE2 3.2Å; H114-H118 PolarHBondContact O-CD2 3.35Å; H114-H118 PolarHBondContact O-N 3.02Å; K115-H118 PolarHBondContact O-N 2.9Å
119	H	64.6	Low	63.5	Low	93 Å²	93	78.9 Å²	78.9	43%	0.431	40%	0.396	S	S	.	.	H	α-helix	trans	-85.9	-2	-179.5	-77.3	-63.5	0	0	0	115.1	K115 A116 Y117 S121	K115-H119 PolarHBondContact O-CD2 3.31Å; K115-H119 VanDerWaalsContact O-CD2 3.31Å; K115-H119 PolarHBondContact O-N 3.49Å; K115-H119 VanDerWaalsContact O-N 3.12Å; A116-H119 PolarHBondContact O-N 3.12Å; Y117-H119 VanDerWaalsContact C-N 3.33Å; Y117-H119 PolarHBondContact O-N 3.48Å; H119-S121 PolarHBondContact O-N 2.79Å
120	N	52.7	Low	62.3	Low	133 Å²	133	82.3 Å²	82.3	71%	0.711	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.9	32.7	175.6	-164.9	48.9	0	0	0	114.3	A116 Y117 Q122	A116-N120 PolarHBondContact O-N 3.31Å; Y117-N120 PolarHBondContact O-N 2.81Å; N120-Q122 PolarHBondContact O-N 2.79Å
121	S	52.1	Low	60.6	Low	20 Å²	20	83.3 Å²	83.3	14%	0.14	42%	0.417	C	S	.	.			trans	-88.8	94.3	-177.4	-174.2	0	0	0	0	110.2	H119 N123 D124 L125	H119-S121 PolarHBondContact O-N 2.79Å; S121-N123 PolarHBondContact O-N 2.81Å; S121-N123 VanDerWaalsContact O-N 3.12Å; S121-D124 WeakPolarHBondContact CB-OD2 3.22Å; S121-D124 PolarHBondContact O-N 3.5Å; S121-D124 VanDerWaalsContact O-N 3.1Å; S121-D124 PolarHBondContact OG-N 2.97Å; S121-D124 PolarHBondContact OG-OD2 2.81Å; S121-L125 PolarHBondContact O-N 2.96Å; S121-L125 VanDerWaalsContact O-N 3.1Å
122	Q	51.5	Low	58.6	Low	150 Å²	150	89.1 Å²	89.1	70%	0.701	44%	0.443	S	S	*	.	H	α-helix	trans	-60.8	-21.3	179.9	-164.8	166.7	-4.3	0	0	112.7	N120 L126	N120-Q122 PolarHBondContact O-N 2.79Å; Q122-L126 PolarHBondContact O-N 3.38Å
123	N	45.4	Very low	56.5	Low	124 Å²	124	87.4 Å²	87.4	66%	0.663	45%	0.447	S	S	*	.	H	α-helix	trans	-77.6	-41.9	173.5	-67.9	-11.3	0	0	0	112.7	S121 L125 L126 A127	S121-N123 PolarHBondContact O-N 2.81Å; S121-N123 VanDerWaalsContact O-N 3.12Å; N123-L125 VanDerWaalsContact C-N 3.32Å; N123-L126 PolarHBondContact O-N 3.35Å; N123-A127 WeakPolarHBondContact O-CB 3.47Å; N123-A127 PolarHBondContact O-N 3.24Å
124	D	53.1	Low	54.5	Low	57 Å²	57	88.5 Å²	88.5	31%	0.305	46%	0.46	S	S	.	.	H	α-helix	trans	-68	-34.9	176.9	-68.5	-71.6	0	0	0	110.9	S121 A127 L128	S121-D124 WeakPolarHBondContact CB-OD2 3.22Å; S121-D124 PolarHBondContact O-N 3.5Å; S121-D124 VanDerWaalsContact O-N 3.1Å; S121-D124 PolarHBondContact OG-N 2.97Å; S121-D124 PolarHBondContact OG-OD2 2.81Å; D124-A127 PolarHBondContact O-N 3.37Å; D124-L128 WeakPolarHBondContact O-CB 3.39Å; D124-L128 WeakPolarHBondContact O-CG 3.26Å; D124-L128 PolarHBondContact O-N 3.31Å
125	L	52.3	Low	52.3	Low	51 Å²	51	93.4 Å²	93.4	27%	0.267	49%	0.494	S	S	.	.	H	α-helix	trans	-65.2	-40	172.2	-76.6	164.9	0	0	0	112.4	Y117 S121 N123 A129	Y117-L125 HydrophobicContact CE2-CD2 4.42Å; S121-L125 PolarHBondContact O-N 2.96Å; S121-L125 VanDerWaalsContact O-N 3.1Å; N123-L125 VanDerWaalsContact C-N 3.32Å; L125-A129 WeakPolarHBondContact O-CB 3.38Å; L125-A129 PolarHBondContact O-N 3.22Å
126	L	47.2	Very low	49.8	Very low	108 Å²	108	98.9 Å²	98.9	57%	0.565	52%	0.52	S	S	*	.	H	α-helix	trans	-71.4	-30	173.2	-106.4	78.8	0	0	0	113.4	Q122 N123 K130	Q122-L126 PolarHBondContact O-N 3.38Å; N123-L126 PolarHBondContact O-N 3.35Å; L126-K130 WeakPolarHBondContact O-CG 3.35Å; L126-K130 PolarHBondContact O-N 3.36Å
127	A	51.1	Low	47.9	Very low	51 Å²	51	107.6 Å²	107.6	42%	0.421	56%	0.559	S	S	.	*	H	α-helix	trans	-71.3	-42.8	176.3	0	0	0	0	0	111.5	N123 D124 K130 L131	N123-A127 WeakPolarHBondContact O-CB 3.47Å; N123-A127 PolarHBondContact O-N 3.24Å; D124-A127 PolarHBondContact O-N 3.37Å; A127-K130 PolarHBondContact O-N 3.14Å; A127-L131 PolarHBondContact O-N 3.34Å
128	L	49.3	Very low	46.2	Very low	61 Å²	61	106.1 Å²	106.1	32%	0.319	57%	0.573	S	S	.	*	H	α-helix	trans	-74.5	-34.5	177.7	-68.2	169	0	0	0	112.5	D124 K130 L131 Q132	D124-L128 WeakPolarHBondContact O-CB 3.39Å; D124-L128 WeakPolarHBondContact O-CG 3.26Å; D124-L128 PolarHBondContact O-N 3.31Å; L128-K130 PolarHBondContact O-N 2.85Å; L128-L131 HydrophobicContact CD2-CD1 4.22Å; L128-L131 CarbonylContact O-C 3.54Å; L128-L131 WeakPolarHBondContact O-CA 3.42Å; L128-L131 PolarHBondContact O-N 2.83Å; L128-Q132 PolarHBondContact O-N 3.47Å
129	A	47.4	Very low	43.9	Very low	48 Å²	48	109.9 Å²	109.9	40%	0.397	59%	0.591	S	S	.	*	H	α-helix	trans	-62.8	-26.6	173.5	0	0	0	0	0	113.2	L125 N133	L125-A129 WeakPolarHBondContact O-CB 3.38Å; L125-A129 PolarHBondContact O-N 3.22Å; A129-N133 PolarHBondContact O-ND2 3.43Å
130	K	47	Very low	42.2	Very low	157 Å²	157	111.8 Å²	111.8	68%	0.683	60%	0.6	S	S	*	*	H	α-helix	trans	-75	-28.7	170.7	-73.6	179.9	173.5	-162.4	0	113.3	L126 A127 L128 Q132 N133	L126-K130 WeakPolarHBondContact O-CG 3.35Å; L126-K130 PolarHBondContact O-N 3.36Å; A127-K130 PolarHBondContact O-N 3.14Å; L128-K130 PolarHBondContact O-N 2.85Å; K130-Q132 VanDerWaalsContact C-N 3.27Å; K130-Q132 PolarHBondContact O-N 3.05Å; K130-N133 PolarHBondContact O-N 2.68Å
131	L	41.4	Very low	40.9	Very low	139 Å²	139	113.7 Å²	113.7	73%	0.728	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.4	-2	176.6	-70	165	0	0	0	113.5	A127 L128	A127-L131 PolarHBondContact O-N 3.34Å; L128-L131 HydrophobicContact CD2-CD1 4.22Å; L128-L131 CarbonylContact O-C 3.54Å; L128-L131 WeakPolarHBondContact O-CA 3.42Å; L128-L131 PolarHBondContact O-N 2.83Å
132	Q	42.2	Very low	39.8	Very low	145 Å²	145	116.6 Å²	116.6	68%	0.678	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.8	8.7	169.6	-63.6	-167.4	-98.3	0	0	113	L128 K130	L128-Q132 PolarHBondContact O-N 3.47Å; K130-Q132 VanDerWaalsContact C-N 3.27Å; K130-Q132 PolarHBondContact O-N 3.05Å
133	N	34.6	Very low	38.6	Very low	136 Å²	136	118.2 Å²	118.2	73%	0.727	65%	0.646	S	S	*	*	S	Bend	trans	-140.4	47.9	-175.8	-71.3	-80.3	0	0	0	111.5	A129 K130	A129-N133 PolarHBondContact O-ND2 3.43Å; K130-N133 PolarHBondContact O-N 2.68Å
134	S	33	Very low	37.8	Very low	79 Å²	79	117.3 Å²	117.3	55%	0.552	64%	0.644	S	S	*	*			trans	-156.2	123.8	175.8	-157.8	0	0	0	0	111.7
135	P	33.5	Very low	36.6	Very low	132 Å²	132	120.4 Å²	120.4	86%	0.857	67%	0.665	S	S	*	*			trans	-96.6	122.9	151.4	32.9	-23.9	0	0	0	109.6
136	E	28.3	Very low	35.3	Very low	172 Å²	172	123 Å²	123	80%	0.804	69%	0.688	S	S	*	*			trans	-132.1	169.4	165.6	-99	-174	127.5	0	0	107.8
137	E	32.7	Very low	34.5	Very low	198 Å²	198	123.3 Å²	123.3	93%	0.925	69%	0.694	S	S	*	*			trans	74.2	129.5	-162	-52.3	173.4	-169	0	0	111.6
138	A	33	Very low	33.3	Very low	99 Å²	99	128.4 Å²	128.4	82%	0.818	71%	0.714	S	S	*	*			cis	-162.4	174.5	1.7	0	0	0	0	0	108.1
139	H	28.9	Very low	32.2	Very low	154 Å²	154	129.3 Å²	129.3	71%	0.713	74%	0.738	S	S	*	*			cis	-174.6	141.2	-31.7	-174.9	-106.8	0	0	0	105.9
140	E	29.1	Very low	31.3	Very low	134 Å²	134	132.6 Å²	132.6	63%	0.626	76%	0.758	S	S	*	*			trans	64.3	142.7	161.4	-86.9	-176.4	129.3	0	0	124.6
141	Q	26.6	Very low	30.4	Very low	172 Å²	172	131 Å²	131	80%	0.804	76%	0.762	S	S	*	*			trans	55.6	113.7	144	-60.6	177.4	38.8	0	0	120.1
142	G	27.9	Very low	29.9	Very low	82 Å²	82	131.3 Å²	131.3	85%	0.845	76%	0.764	S	S	*	*			trans	175.9	90.2	171.2	0	0	0	0	0	113.8
143	E	27.1	Very low	29.3	Very low	184 Å²	184	131.4 Å²	131.4	86%	0.86	77%	0.768	S	S	*	*			trans	-72.2	175.3	172.2	-165.1	-167.6	145.8	0	0	111.7
144	V	28.3	Very low	29	Very low	105 Å²	105	135.2 Å²	135.2	64%	0.636	77%	0.772	S	S	*	*			trans	88.3	79.8	159.7	-167.5	0	0	0	0	118.6
145	T	27.2	Very low	28.6	Very low	122 Å²	122	138.5 Å²	138.5	75%	0.748	79%	0.789	S	S	*	*				61.5	130.2	128.9	69.2	0	0	0	0	124.1
146	S	26	Very low	28.1	Very low	106 Å²	106	137.1 Å²	137.1	74%	0.741	78%	0.783	S	S	*	*				83.3	169.4	126.9	-160.9	0	0	0	0	120.7
147	V	29.3	Very low	28	Very low	114 Å²	114	138.1 Å²	138.1	69%	0.691	79%	0.788	S	S	*	*			trans	55.6	85	173.6	-78.1	0	0	0	0	118.5
148	N	25.6	Very low	27.7	Very low	157 Å²	157	133.1 Å²	133.1	84%	0.84	77%	0.774	S	S	*	*				38.7	108.1	106.2	-50.7	-8	0	0	0	116.4
149	G	27.8	Very low	27.7	Very low	81 Å²	81	133.9 Å²	133.9	84%	0.835	77%	0.771	S	S	*	*			trans	-153.4	32.2	179.2	0	0	0	0	0	115.3
150	S	27.9	Very low	27.7	Very low	116 Å²	116	131.7 Å²	131.7	81%	0.811	77%	0.773	S	S	*	*			trans	-61.9	135.2	178.1	-53.4	0	0	0	0	112.6
151	V	28.3	Very low	27.6	Very low	124 Å²	124	135.2 Å²	135.2	75%	0.752	78%	0.782	S	S	*	*			trans	156.2	97.7	144.3	157.9	0	0	0	0	107.4
152	N	30.8	Very low	27.7	Very low	145 Å²	145	131.2 Å²	131.2	78%	0.775	77%	0.769	S	S	*	*				56.7	101.8	80.2	-77.2	-38.9	0	0	0	115.1
153	L	30.3	Very low	27.7	Very low	148 Å²	148	134.2 Å²	134.2	78%	0.775	77%	0.771	S	S	*	*			trans	-163.9	125.2	153.2	-128.9	68.2	0	0	0	109.8
154	R	26.4	Very low	27.8	Very low	215 Å²	215	132.2 Å²	132.2	81%	0.811	77%	0.766	S	S	*	*			cis	-168.5	125.3	-13.7	-121.2	176.9	-159.4	176.2	5.2	109.3
155	T	25.1	Very low	27.7	Very low	148 Å²	148	131.1 Å²	131.1	91%	0.908	77%	0.769	S	S	*	*			trans	-172.5	146.3	150.9	21.4	0	0	0	0	112
156	S	24.3	Very low	27.6	Very low	104 Å²	104	132.6 Å²	132.6	73%	0.727	77%	0.77	S	S	*	*			trans	-57.7	162.3	-178.8	50.2	0	0	0	0	114.8
157	E	24.8	Very low	27.8	Very low	193 Å²	193	135.4 Å²	135.4	90%	0.902	77%	0.772	S	S	*	*			cis	-107.8	167	13.6	-83.1	-168.6	81.8	0	0	114.4
158	S	26.8	Very low	27.7	Very low	92 Å²	92	140.2 Å²	140.2	64%	0.643	78%	0.779	S	S	*	*			cis	-88.6	-149.1	2.4	55.6	0	0	0	0	112.2
159	P	32.4	Very low	27.8	Very low	115 Å²	115	135.8 Å²	135.8	75%	0.747	77%	0.77	S	S	*	*			cis	-141.7	-163.6	42.9	44.3	-24	0	0	0	114.7
160	S	30.5	Very low	27.9	Very low	108 Å²	108	140.5 Å²	140.5	76%	0.755	77%	0.771	S	S	*	*			trans	-108.6	160.6	145.1	56.7	0	0	0	0	110
161	Y	26.7	Very low	27.8	Very low	208 Å²	208	139.3 Å²	139.3	82%	0.816	76%	0.762	S	S	*	*			trans	101.7	109.2	161.6	-138.6	-99.8	0	0	0	120
162	V	29.4	Very low	27.7	Very low	88 Å²	88	141.3 Å²	141.3	53%	0.533	77%	0.769	S	S	.	*			trans	33.1	130.2	139.5	-168.1	0	0	0	0	121.6
163	T	26.2	Very low	27.9	Very low	145 Å²	145	138 Å²	138	89%	0.89	77%	0.769	S	S	*	*			trans	-151.9	132.7	132.2	-13.4	0	0	0	0	109.7
164	D	28.9	Very low	27.6	Very low	142 Å²	142	140 Å²	140	76%	0.759	77%	0.772	S	S	*	*			trans	-78	150.4	-176.6	-58.2	-87.7	0	0	0	113.2
165	A	26.4	Very low	27.8	Very low	83 Å²	83	133.8 Å²	133.8	69%	0.686	77%	0.766	S	S	*	*				154.7	151	95.1	0	0	0	0	0	112.3
166	I	26.5	Very low	27.9	Very low	152 Å²	152	132.2 Å²	132.2	78%	0.779	76%	0.761	S	S	*	*			trans	68.2	124.4	165.1	-49.8	176.4	0	0	0	113.3
167	E	28.8	Very low	28.3	Very low	165 Å²	165	131.3 Å²	131.3	77%	0.771	76%	0.76	S	S	*	*			cis	-150.6	173.3	11.9	-143.1	146.2	-143.6	0	0	112.3
168	Y	27.5	Very low	28.6	Very low	215 Å²	215	127.2 Å²	127.2	84%	0.843	75%	0.745	S	S	*	*			trans	13.6	110.8	155.8	-90.9	-116.6	0	0	0	120.4
169	G	28.9	Very low	28.9	Very low	64 Å²	64	128.8 Å²	128.8	66%	0.66	75%	0.745	S	S	*	*				85.8	133.3	103	0	0	0	0	0	121.7
170	Q	28.9	Very low	28.8	Very low	181 Å²	181	128.9 Å²	128.9	85%	0.846	75%	0.749	S	S	*	*			trans	75.2	127.7	138.6	-57.1	179.1	-3.5	0	0	121.4
171	S	26.4	Very low	28.8	Very low	90 Å²	90	126.9 Å²	126.9	63%	0.629	74%	0.744	S	S	*	*			trans	57.4	121.2	138.8	61.3	0	0	0	0	122.9
172	D	25.8	Very low	28.8	Very low	167 Å²	167	122.8 Å²	122.8	89%	0.893	75%	0.747	S	S	*	*				60.8	147.5	121.6	-49.4	-35.1	0	0	0	122.9
173	G	34.3	Very low	29	Very low	75 Å²	75	122.7 Å²	122.7	77%	0.773	76%	0.755	S	S	*	*			trans	110.6	112.9	178.2	0	0	0	0	0	112.5
174	F	24.8	Very low	29.2	Very low	191 Å²	191	124.4 Å²	124.4	84%	0.838	75%	0.753	S	S	*	*			cis	88.4	141.8	18.6	-136.9	-80.4	0	0	0	115.6
175	A	29.5	Very low	29.1	Very low	84 Å²	84	126.1 Å²	126.1	69%	0.694	76%	0.756	S	S	*	*			trans	68.6	135.9	-167.9	0	0	0	0	0	114.8
176	S	28.5	Very low	29.2	Very low	115 Å²	115	129.1 Å²	129.1	80%	0.804	76%	0.761	S	S	*	*			cis	75.5	88.3	2.3	-49.8	0	0	0	0	119.6
177	A	32.5	Very low	29.5	Very low	85 Å²	85	126.3 Å²	126.3	70%	0.702	75%	0.754	S	S	*	*			trans	-160.8	127.8	141.2	0	0	0	0	0	106.2
178	N	30.7	Very low	29.5	Very low	107 Å²	107	125.3 Å²	125.3	57%	0.572	75%	0.754	S	S	*	*			cis	95.1	154.1	46	-79.7	-36	0	0	0	114.1	S1203 E1204	N178-S1203 PolarHBondContact ND2-O 2.58Å; N178-E1204 VanDerWaalsContact CB-O 3.3Å; N178-E1204 WeakPolarHBondContact CB-O 3.2Å; N178-E1204 PolarHBondContact ND2-N 3.34Å
179	L	32.9	Very low	29.8	Very low	124 Å²	124	122.1 Å²	122.1	65%	0.649	75%	0.752	S	S	*	*			trans	90.8	158.8	170.3	-54.1	179.5	0	0	0	119	E1204 E1205	L179-E1204 WeakPolarHBondContact CG-O 3.46Å; L179-E1205 WeakPolarHBondContact CD1-O 3.24Å; L179-E1205 WeakPolarHBondContact CD2-O 3.15Å
180	S	29.7	Very low	30.2	Very low	118 Å²	118	125.9 Å²	125.9	83%	0.825	76%	0.757	S	S	*	*			trans	-151.3	135.7	-152.6	55.2	0	0	0	0	112.5
181	G	30.4	Very low	30.5	Very low	65 Å²	65	124.3 Å²	124.3	67%	0.67	75%	0.754	S	S	*	*			trans	-142.7	138.6	155.6	0	0	0	0	0	107.7
182	S	28.1	Very low	30.9	Very low	123 Å²	123	127 Å²	127	86%	0.86	76%	0.76	S	S	*	*			cis	77.1	44.6	47.2	84.7	0	0	0	0	114.5
183	A	32.8	Very low	31.1	Very low	86 Å²	86	129.8 Å²	129.8	71%	0.711	76%	0.76	S	S	*	*			trans	-113	136.8	131.6	0	0	0	0	0	105.5
184	E	29.8	Very low	31.4	Very low	180 Å²	180	131.5 Å²	131.5	84%	0.841	76%	0.757	S	S	*	*			cis	70.8	109.2	49.7	-61.4	-166.4	160	0	0	112.7
185	E	28.4	Very low	32	Very low	179 Å²	179	126.1 Å²	126.1	84%	0.836	76%	0.756	S	S	*	*			trans	70.9	117.4	155	-54.4	-170.8	156.4	0	0	120.2
186	D	28.8	Very low	32.9	Very low	146 Å²	146	127.4 Å²	127.4	78%	0.781	75%	0.75	S	S	*	*			trans	72.4	132.7	139.7	-74.5	8.4	0	0	0	124
187	S	31.6	Very low	34.2	Very low	92 Å²	92	127.6 Å²	127.6	64%	0.643	74%	0.742	S	S	*	*			trans	67.1	96.1	136.2	-64.9	0	0	0	0	120.6
188	N	28.6	Very low	35.5	Very low	144 Å²	144	126.6 Å²	126.6	77%	0.77	72%	0.722	S	S	*	*			trans	67.7	126.7	155.1	-37	-73.2	0	0	0	117.6
189	D	33.2	Very low	37	Very low	149 Å²	149	127 Å²	127	80%	0.797	73%	0.725	S	S	*	*				-167.3	133.6	106.8	-85.9	-19.1	0	0	0	105.7
190	D	38.4	Very low	38.6	Very low	143 Å²	143	127 Å²	127	77%	0.765	72%	0.721	S	S	*	*				72.2	149.6	63.6	-148.5	-1.6	0	0	0	112.8
191	L	35.7	Very low	40.2	Very low	148 Å²	148	123.1 Å²	123.1	78%	0.775	69%	0.691	S	S	*	*			trans	111.3	77.7	-171.8	-62.5	-177.4	0	0	0	117
192	L	34.4	Very low	41.9	Very low	146 Å²	146	120.6 Å²	120.6	76%	0.764	66%	0.662	S	S	*	*			trans	59.2	111.1	133.9	-56.3	171.7	0	0	0	119.6
193	Y	30.4	Very low	43.5	Very low	225 Å²	225	116.5 Å²	116.5	88%	0.882	63%	0.634	S	S	*	*				-160.3	165.7	109.9	-118.5	-116.4	0	0	0	107.5
194	P	39	Very low	44.9	Very low	111 Å²	111	117.8 Å²	117.8	72%	0.721	63%	0.629	S	S	*	*	P	Polyproline II helix	trans	-68.9	147.4	-153.2	26.5	-33.9	0	0	0	114.8
195	G	37.6	Very low	46.4	Very low	78 Å²	78	111.7 Å²	111.7	80%	0.804	61%	0.606	S	S	*	*	P	Polyproline II helix	trans	-63	131.8	-176.5	0	0	0	0	0	113.1
196	I	49.4	Very low	48.2	Very low	111 Å²	111	104.3 Å²	104.3	57%	0.569	58%	0.576	S	S	*	*	P	Polyproline II helix	trans	-77.5	127	179.7	-42.9	172.1	0	0	0	109.1	E198 L201	I196-E198 PolarHBondContact O-N 3.13Å; I196-L201 HydrophobicContact CB-CD1 4.31Å; I196-L201 HydrophobicContact CB-CD2 4.48Å; I196-L201 HydrophobicContact CB-CG 4.28Å; I196-L201 HydrophobicContact CD1-CD2 4.37Å; I196-L201 HydrophobicContact CG2-CD1 4.32Å; I196-L201 HydrophobicContact CG2-CD2 3.89Å; I196-L201 HydrophobicContact CG2-CG 3.75Å
197	D	55.5	Low	49.8	Very low	119 Å²	119	97.4 Å²	97.4	64%	0.636	54%	0.539	S	S	*	.	P	Polyproline II helix	trans	-59.2	129.6	176.9	-85	-49.3	0	0	0	111.3	D199 E200 L201	D197-D199 PolarHBondContact O-N 2.6Å; D197-E200 HydrophobicContact CB-CB 3.99Å; D197-E200 WeakPolarHBondContact O-CA 3.43Å; D197-E200 WeakPolarHBondContact O-CB 3.46Å; D197-E200 PolarHBondContact O-N 3.49Å; D197-L201 PolarHBondContact O-N 2.75Å
198	E	60.8	Low	51.2	Low	64 Å²	64	96.2 Å²	96.2	30%	0.299	53%	0.531	S	S	.	.	H	α-helix	trans	-65	-25.5	177.2	-88.3	-152	-124.6	0	0	112.5	I196 E200 L201 N202 T229 R230	I196-E198 PolarHBondContact O-N 3.13Å; E198-E200 VanDerWaalsContact C-N 3.34Å; E198-L201 HydrophobicContact CG-CD1 4.33Å; E198-N202 WeakPolarHBondContact O-CB 3.46Å; E198-N202 PolarHBondContact O-N 3.49Å; E198-N202 PolarHBondContact O-ND2 3.44Å; E198-T229 WeakPolarHBondContact OE2-CB 3.31Å; E198-T229 PolarHBondContact OE2-OG1 3.1Å; E198-R230 VanDerWaalsContact CD-NE 3.28Å; E198-R230 IonicContact OE1-CZ 2.69Å; E198-R230 IonicContact OE1-NE 3.57Å; E198-R230 PolarHBondContact OE1-NE 3.15Å; E198-R230 IonicContact OE1-NH2 3.25Å; E198-R230 PolarHBondContact OE1-NH2 3.26Å; E198-R230 IonicContact OE2-CZ 2.65Å; E198-R230 IonicContact OE2-NE 3.61Å; E198-R230 PolarHBondContact OE2-NE 3.29Å; E198-R230 IonicContact OE2-NH2 3.08Å
199	D	61.5	Low	52.5	Low	116 Å²	116	95.4 Å²	95.4	62%	0.62	52%	0.522	S	S	*	.	H	α-helix	trans	-72.1	-26.6	170.9	-76.6	-28.2	0	0	0	112.8	D197 S203 Y233	D197-D199 PolarHBondContact O-N 2.6Å; D199-S203 PolarHBondContact O-N 3.09Å; D199-Y233 WeakPolarHBondContact OD1-CE1 3.32Å; D199-Y233 VanDerWaalsContact OD1-CZ 3.28Å; D199-Y233 PolarHBondContact OD1-OH 3.31Å
200	E	66.8	Low	53.5	Low	124 Å²	124	89.5 Å²	89.5	58%	0.579	49%	0.494	S	S	*	.	H	α-helix	trans	-75.7	-45	171.5	-171.6	169.9	-125.8	0	0	110.8	D197 E198 N202 S203 A206	D197-E200 HydrophobicContact CB-CB 3.99Å; D197-E200 WeakPolarHBondContact O-CA 3.43Å; D197-E200 WeakPolarHBondContact O-CB 3.46Å; D197-E200 PolarHBondContact O-N 3.49Å; E198-E200 VanDerWaalsContact C-N 3.34Å; E200-N202 VanDerWaalsContact C-N 3.3Å; E200-N202 PolarHBondContact O-N 3.22Å; E200-S203 WeakPolarHBondContact O-CB 3.21Å; E200-S203 PolarHBondContact O-N 2.66Å; E200-S203 VanDerWaalsContact O-N 3.1Å; E200-S203 PolarHBondContact O-OG 2.79Å; E200-A206 WeakPolarHBondContact O-CB 3.48Å
201	L	63.7	Low	54.1	Low	37 Å²	37	88.6 Å²	88.6	19%	0.194	48%	0.481	C	S	.	.	H	α-helix	trans	-56.9	-41.4	173.4	-72.2	171.3	0	0	0	112	I196 D197 E198 S203 A206 R217 T229	I196-L201 HydrophobicContact CB-CD1 4.31Å; I196-L201 HydrophobicContact CB-CD2 4.48Å; I196-L201 HydrophobicContact CB-CG 4.28Å; I196-L201 HydrophobicContact CD1-CD2 4.37Å; I196-L201 HydrophobicContact CG2-CD1 4.32Å; I196-L201 HydrophobicContact CG2-CD2 3.89Å; I196-L201 HydrophobicContact CG2-CG 3.75Å; D197-L201 PolarHBondContact O-N 2.75Å; E198-L201 HydrophobicContact CG-CD1 4.33Å; L201-S203 VanDerWaalsContact C-N 3.35Å; L201-A206 WeakPolarHBondContact O-CB 3.22Å; L201-R217 VanDerWaalsContact O-CZ 3.27Å; L201-R217 PolarHBondContact O-NH1 2.86Å; L201-R217 PolarHBondContact O-NH2 3.06Å; L201-T229 HydrophobicContact CB-CG2 4.42Å; L201-T229 HydrophobicContact CD1-CG2 4.48Å
202	N	65.5	Low	54.9	Low	11 Å²	11	86.3 Å²	86.3	6%	0.059	48%	0.477	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.1	7.6	179.6	-66.7	-85.5	0	0	0	113.9	E198 E200 F228 T229 Y233	E198-N202 WeakPolarHBondContact O-CB 3.46Å; E198-N202 PolarHBondContact O-N 3.49Å; E198-N202 PolarHBondContact O-ND2 3.44Å; E200-N202 VanDerWaalsContact C-N 3.3Å; E200-N202 PolarHBondContact O-N 3.22Å; N202-F228 HydrophobicContact CB-CD1 4.24Å; N202-F228 VanDerWaalsContact OD1-CA 3.26Å; N202-F228 WeakPolarHBondContact OD1-CA 3.36Å; N202-F228 WeakPolarHBondContact OD1-CB 3.28Å; N202-T229 PolarHBondContact ND2-OG1 3.35Å; N202-T229 PolarHBondContact OD1-N 3.38Å; N202-T229 PolarHBondContact OD1-OG1 3.49Å; N202-Y233 HydrophobicContact CB-CD1 3.53Å; N202-Y233 HydrophobicContact CB-CD2 3.72Å; N202-Y233 HydrophobicContact CB-CE1 3.83Å; N202-Y233 HydrophobicContact CB-CE2 4Å; N202-Y233 HydrophobicContact CB-CG 3.47Å; N202-Y233 VanDerWaalsContact CB-CG 3.47Å; N202-Y233 VanDerWaalsContact CG-CG 3.45Å; N202-Y233 WeakPolarHBondContact ND2-CD2 3.44Å; N202-Y233 VanDerWaalsContact ND2-CE2 3.3Å; N202-Y233 WeakPolarHBondContact ND2-CE2 3.49Å; N202-Y233 WeakPolarHBondContact OD1-CD2 3.19Å
203	S	62.5	Low	55.9	Low	38 Å²	38	84.9 Å²	84.9	27%	0.266	48%	0.48	S	S	.	.	S	Bend	trans	-58.2	153.4	175.1	72.1	0	0	0	0	111.6	D199 E200 L201 S205 A206 A207	D199-S203 PolarHBondContact O-N 3.09Å; E200-S203 WeakPolarHBondContact O-CB 3.21Å; E200-S203 PolarHBondContact O-N 2.66Å; E200-S203 VanDerWaalsContact O-N 3.1Å; E200-S203 PolarHBondContact O-OG 2.79Å; L201-S203 VanDerWaalsContact C-N 3.35Å; S203-S205 PolarHBondContact O-N 3.19Å; S203-A206 PolarHBondContact O-N 3.49Å; S203-A206 WeakPolarHBondContact OG-CB 3.44Å; S203-A206 PolarHBondContact OG-N 3.41Å; S203-A207 VanDerWaalsContact O-CB 3.31Å; S203-A207 WeakPolarHBondContact O-CB 3.22Å; S203-A207 PolarHBondContact O-N 2.93Å
204	N	61.1	Low	57.3	Low	113 Å²	113	77.4 Å²	77.4	60%	0.604	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-13.4	179.8	-79.7	-55.2	0	0	0	114.1
205	S	61.6	Low	58.5	Low	52 Å²	52	81.6 Å²	81.6	36%	0.364	46%	0.462	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88	-58.5	171.8	-146.9	0	0	0	0	110.6	S203 A207 S208 E209	S203-S205 PolarHBondContact O-N 3.19Å; S205-A207 PolarHBondContact O-N 3.18Å; S205-S208 WeakPolarHBondContact O-CA 2.96Å; S205-S208 WeakPolarHBondContact O-CB 3.29Å; S205-S208 PolarHBondContact O-N 3.35Å; S205-S208 PolarHBondContact O-OG 3.37Å; S205-E209 PolarHBondContact O-N 3.25Å; S205-E209 PolarHBondContact OG-OE1 3.21Å
206	A	65.9	Low	59.8	Low	24 Å²	24	80.5 Å²	80.5	20%	0.198	44%	0.442	C	S	.	.	H	α-helix	trans	-61.7	-41.1	-176	0	0	0	0	0	112.7	E200 L201 S203 S208 E209 A210	E200-A206 WeakPolarHBondContact O-CB 3.48Å; L201-A206 WeakPolarHBondContact O-CB 3.22Å; S203-A206 PolarHBondContact O-N 3.49Å; S203-A206 WeakPolarHBondContact OG-CB 3.44Å; S203-A206 PolarHBondContact OG-N 3.41Å; A206-S208 PolarHBondContact O-N 3.49Å; A206-E209 PolarHBondContact O-N 3.02Å; A206-E209 VanDerWaalsContact O-N 3.16Å; A206-A210 PolarHBondContact O-N 3.11Å
207	A	63.3	Low	60.7	Low	1 Å²	1	76.2 Å²	76.2	1%	0.008	42%	0.418	C	S	.	.	H	α-helix	trans	-69.3	-8.7	175	0	0	0	0	0	114	S203 S205 M226 A227 F228	S203-A207 VanDerWaalsContact O-CB 3.31Å; S203-A207 WeakPolarHBondContact O-CB 3.22Å; S203-A207 PolarHBondContact O-N 2.93Å; S205-A207 PolarHBondContact O-N 3.18Å; A207-M226 HydrophobicContact CB-CE 3.82Å; A207-M226 WeakPolarHBondContact O-CA 3.41Å; A207-M226 WeakPolarHBondContact O-CB 3.13Å; A207-M226 WeakPolarHBondContact O-CG 3.07Å; A207-A227 PolarHBondContact O-N 2.86Å; A207-F228 HydrophobicContact CB-CD1 3.89Å; A207-F228 HydrophobicContact CB-CE1 3.5Å; A207-F228 HydrophobicContact CB-CZ 4.09Å
208	S	59.3	Low	61.5	Low	67 Å²	67	77.7 Å²	77.7	47%	0.469	42%	0.421	S	S	.	.	H	α-helix	trans	-93.6	-19.3	171.7	77.4	0	0	0	0	114	S205 A206	S205-S208 WeakPolarHBondContact O-CA 2.96Å; S205-S208 WeakPolarHBondContact O-CB 3.29Å; S205-S208 PolarHBondContact O-N 3.35Å; S205-S208 PolarHBondContact O-OG 3.37Å; A206-S208 PolarHBondContact O-N 3.49Å
209	E	56.5	Low	62.3	Low	127 Å²	127	77.6 Å²	77.6	59%	0.593	42%	0.42	S	S	*	.	H	α-helix	trans	-96.3	-25.3	-175.5	-69.2	164.8	-172.5	0	0	112.2	S205 A206 Y211	S205-E209 PolarHBondContact O-N 3.25Å; S205-E209 PolarHBondContact OG-OE1 3.21Å; A206-E209 PolarHBondContact O-N 3.02Å; A206-E209 VanDerWaalsContact O-N 3.16Å; E209-Y211 PolarHBondContact O-N 2.88Å
210	A	54.3	Low	63.1	Low	25 Å²	25	76 Å²	76	21%	0.207	42%	0.417	C	S	.	.			trans	-87.5	39.3	-171.7	0	0	0	0	0	115.9	A206 S212 R217	A206-A210 PolarHBondContact O-N 3.11Å; A210-S212 PolarHBondContact O-N 3.34Å; A210-R217 VanDerWaalsContact CB-CD 3.5Å
211	Y	51.7	Low	63.8	Low	123 Å²	123	70.2 Å²	70.2	48%	0.482	39%	0.39	S	S	.	.	S	Bend	trans	-72.4	-16	-166.9	-171.2	-130.5	0	0	0	116.2	E209 K225	E209-Y211 PolarHBondContact O-N 2.88Å; Y211-K225 HydrophobicContact CD2-CB 3.9Å; Y211-K225 WeakPolarHBondContact CD2-O 3.08Å; Y211-K225 HydrophobicContact CE1-CB 4.45Å; Y211-K225 HydrophobicContact CE1-CD 4.05Å; Y211-K225 HydrophobicContact CE2-CB 3.46Å; Y211-K225 VanDerWaalsContact CE2-CB 3.46Å; Y211-K225 HydrophobicContact CE2-CD 4.25Å; Y211-K225 HydrophobicContact CE2-CG 3.84Å; Y211-K225 VanDerWaalsContact CE2-O 3.29Å; Y211-K225 WeakPolarHBondContact CE2-O 3.35Å; Y211-K225 WeakPolarHBondContact OH-CD 3.4Å; Y211-K225 WeakPolarHBondContact OH-CE 3.37Å; Y211-K225 PolarHBondContact OH-NZ 3.25Å
212	S	52.7	Low	64.1	Low	100 Å²	100	74.8 Å²	74.8	70%	0.699	41%	0.41	S	S	*	.	S	Bend	trans	-131.3	-5.4	-157.2	-50.9	0	0	0	0	118.5	A210	A210-S212 PolarHBondContact O-N 3.34Å
213	S	54.1	Low	64.5	Low	117 Å²	117	79.7 Å²	79.7	82%	0.818	43%	0.428	S	S	*	.	S	Bend	trans	-153.4	-5.2	-169.4	-164.4	0	0	0	0	118.6	K215	S213-K215 PolarHBondContact O-N 3.38Å
214	D	60.7	Low	65.1	Low	67 Å²	67	79.4 Å²	79.4	36%	0.358	43%	0.426	S	S	.	.			trans	-94.6	105.2	-169.5	-175	-8.8	0	0	0	112.3	S216 R217	D214-S216 PolarHBondContact O-N 2.84Å; D214-S216 VanDerWaalsContact O-N 3.13Å; D214-S216 VanDerWaalsContact OD1-CB 3.3Å; D214-S216 WeakPolarHBondContact OD1-CB 3.5Å; D214-S216 PolarHBondContact OD1-N 3.07Å; D214-S216 PolarHBondContact OD1-OG 3.25Å; D214-S216 PolarHBondContact OD2-OG 3.41Å; D214-R217 HydrophobicContact CB-CB 4.43Å; D214-R217 HydrophobicContact CB-CG 4.16Å; D214-R217 PolarHBondContact O-N 3.43Å; D214-R217 VanDerWaalsContact OD2-CD 3.23Å; D214-R217 WeakPolarHBondContact OD2-CD 3.42Å; D214-R217 WeakPolarHBondContact OD2-CG 3.32Å; D214-R217 IonicContact OD2-CZ 3.69Å; D214-R217 IonicContact OD2-NE 3.29Å; D214-R217 PolarHBondContact OD2-NE 2.64Å
215	K	64.8	Low	65.5	Low	199 Å²	199	78.3 Å²	78.3	87%	0.865	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-17.7	178.6	-75.5	-173.8	177.1	-179.1	0	114	S213 R217	S213-K215 PolarHBondContact O-N 3.38Å; K215-R217 VanDerWaalsContact C-N 3.33Å
216	S	64.1	Low	66.2	Low	55 Å²	55	77 Å²	77	39%	0.385	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-22	175.4	75.3	0	0	0	0	112.8	D214 Q218 T229	D214-S216 PolarHBondContact O-N 2.84Å; D214-S216 VanDerWaalsContact O-N 3.13Å; D214-S216 VanDerWaalsContact OD1-CB 3.3Å; D214-S216 WeakPolarHBondContact OD1-CB 3.5Å; D214-S216 PolarHBondContact OD1-N 3.07Å; D214-S216 PolarHBondContact OD1-OG 3.25Å; D214-S216 PolarHBondContact OD2-OG 3.41Å; S216-Q218 PolarHBondContact O-N 2.99Å; S216-T229 WeakPolarHBondContact O-CA 3.34Å
217	R	68.9	Low	66.8	Low	22 Å²	22	76.2 Å²	76.2	8%	0.083	40%	0.397	C	S	.	.			trans	-97	56.7	-170.2	-65.2	177.1	-175.7	-99.5	-2.5	113.7	L201 A210 D214 K215 F219 A227 F228 T229	L201-R217 VanDerWaalsContact O-CZ 3.27Å; L201-R217 PolarHBondContact O-NH1 2.86Å; L201-R217 PolarHBondContact O-NH2 3.06Å; A210-R217 VanDerWaalsContact CB-CD 3.5Å; D214-R217 HydrophobicContact CB-CB 4.43Å; D214-R217 HydrophobicContact CB-CG 4.16Å; D214-R217 PolarHBondContact O-N 3.43Å; D214-R217 VanDerWaalsContact OD2-CD 3.23Å; D214-R217 WeakPolarHBondContact OD2-CD 3.42Å; D214-R217 WeakPolarHBondContact OD2-CG 3.32Å; D214-R217 IonicContact OD2-CZ 3.69Å; D214-R217 IonicContact OD2-NE 3.29Å; D214-R217 PolarHBondContact OD2-NE 2.64Å; K215-R217 VanDerWaalsContact C-N 3.33Å; R217-F219 PolarHBondContact O-N 3.49Å; R217-A227 HydrophobicContact CB-CB 4.03Å; R217-A227 PolarHBondContact NH1-O 2.77Å; R217-A227 VanDerWaalsContact NH1-O 3.11Å; R217-F228 CarbonylContact C-O 3.56Å; R217-F228 VanDerWaalsContact CA-O 3.29Å; R217-F228 WeakPolarHBondContact CA-O 3.33Å; R217-T229 HydrophobicContact CG-CG2 4.27Å
218	Q	72	Confident	67.6	Low	149 Å²	149	76.3 Å²	76.3	70%	0.696	40%	0.398	S	S	*	.			trans	-61.1	-19	-172.5	-57.1	178.4	11.1	0	0	114.6	S216 F228	S216-Q218 PolarHBondContact O-N 2.99Å; Q218-F228 PolarHBondContact N-O 3.4Å
219	F	76.7	Confident	68.6	Low	63 Å²	63	74 Å²	74	28%	0.276	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	91.6	-169.9	-56.7	-80.9	0	0	0	111.5	R217 F228 T229 R230 Q231 L234	R217-F219 PolarHBondContact O-N 3.49Å; F219-F228 HydrophobicContact CB-CB 4.42Å; F219-F228 PolarHBondContact N-O 3.5Å; F219-F228 VanDerWaalsContact N-O 3.07Å; F219-F228 WeakPolarHBondContact O-CB 3.45Å; F219-F228 WeakPolarHBondContact O-CD2 3.39Å; F219-F228 PolarHBondContact O-N 3.11Å; F219-T229 WeakPolarHBondContact CD2-O 3.47Å; F219-T229 WeakPolarHBondContact CE2-O 3.38Å; F219-R230 VanDerWaalsContact CD2-CA 3.46Å; F219-Q231 HydrophobicContact CD1-CB 3.68Å; F219-Q231 HydrophobicContact CD1-CG 4.39Å; F219-Q231 VanDerWaalsContact CD1-OE1 3.26Å; F219-Q231 HydrophobicContact CE1-CB 3.72Å; F219-Q231 HydrophobicContact CG-CB 4.13Å; F219-Q231 HydrophobicContact CZ-CB 4.19Å; F219-L234 HydrophobicContact CB-CB 4.07Å; F219-L234 HydrophobicContact CB-CD2 3.96Å
220	C	78.7	Confident	69.6	Low	82 Å²	82	74.2 Å²	74.2	55%	0.554	38%	0.376	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.1	144	-179	66.6	0	0	0	0	113.7	H222 L234	C220-H222 PolarHBondContact O-N 2.74Å; C220-L234 WeakPolarHBondContact O-CD2 3.17Å
221	C	80.6	Confident	70.9	Confident	2 Å²	2	77.7 Å²	77.7	1%	0.014	39%	0.388	C	S	.	.			trans	-85.8	108.9	177.5	-176.1	0	0	0	0	112	R223 C224 K225 M226 F228 L234 H237 N238 H243	C221-R223 PolarHBondContact O-N 2.98Å; C221-C224 WeakPolarHBondContact CB-SG 3.16Å; C221-C224 PolarHBondContact O-N 2.99Å; C221-C224 PolarHBondContact SG-SG 2.76Å; C221-K225 VanDerWaalsContact O-CA 3.22Å; C221-K225 WeakPolarHBondContact O-CA 3.47Å; C221-K225 PolarHBondContact O-N 3.2Å; C221-M226 WeakPolarHBondContact CB-O 3.39Å; C221-M226 PolarHBondContact N-O 3.47Å; C221-F228 HydrophobicContact CB-CE2 4.42Å; C221-L234 HydrophobicContact CB-CD1 3.52Å; C221-H237 PolarHBondContact SG-CD2 3.09Å; C221-N238 PolarHBondContact SG-OD1 2.99Å; C221-H243 PolarHBondContact SG-CE1 3.11Å; C221-H243 PolarHBondContact SG-ND1 2.84Å; C221-H243 VanDerWaalsContact SG-ND1 3.36Å
222	H	71.6	Confident	72.2	Confident	133 Å²	133	75.9 Å²	75.9	62%	0.616	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-16.7	179.1	-170.9	82.5	0	0	0	115.3	C220 W1231	C220-H222 PolarHBondContact O-N 2.74Å; H222-W1231 AromaticContact CE1-CZ2 3.69Å
223	R	72.9	Confident	73.6	Confident	115 Å²	115	73 Å²	73	43%	0.434	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.6	-35.2	-179.1	-71.4	169.5	86.4	-131.8	9.8	114.4	C221 H243 C246 W1257	C221-R223 PolarHBondContact O-N 2.98Å; R223-H243 PolarHBondContact NH1-CD2 3.2Å; R223-H243 PolarHBondContact NH1-NE2 3.19Å; R223-H243 PolarHBondContact NH1-O 3.2Å; R223-C246 PolarHBondContact O-SG 2.88Å; R223-W1257 HydrophobicContact CB-CH2 3.82Å; R223-W1257 HydrophobicContact CB-CZ3 3.89Å; R223-W1257 HydrophobicContact CG-CH2 4.09Å; R223-W1257 VanDerWaalsContact CZ-CH2 3.49Å; R223-W1257 VanDerWaalsContact NH2-CZ2 3.33Å; R223-W1257 WeakPolarHBondContact O-CZ3 3.31Å
224	C	74.9	Confident	75	Confident	32 Å²	32	68.1 Å²	68.1	22%	0.216	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.3	-4.4	-178.4	80.5	0	0	0	0	114.3	C221 M226 H237 C246	C221-C224 WeakPolarHBondContact CB-SG 3.16Å; C221-C224 PolarHBondContact O-N 2.99Å; C221-C224 PolarHBondContact SG-SG 2.76Å; C224-M226 PolarHBondContact O-N 3.43Å; C224-M226 VanDerWaalsContact O-N 3.14Å; C224-M226 VanDerWaalsContact SG-CB 3.52Å; C224-M226 WeakPolarHBondContact SG-CG 3.34Å; C224-M226 PolarHBondContact SG-N 3.26Å; C224-H237 PolarHBondContact SG-CE1 3.33Å; C224-H237 PolarHBondContact SG-NE2 3.07Å; C224-C246 VanDerWaalsContact CB-SG 3.57Å
225	K	70.2	Confident	75.9	Confident	89 Å²	89	67.1 Å²	67.1	39%	0.387	32%	0.324	S	S	.	.			trans	68.6	-9.3	-177.9	-71.2	174.5	170.8	-123.3	0	117.4	Y211 C221	Y211-K225 HydrophobicContact CD2-CB 3.9Å; Y211-K225 WeakPolarHBondContact CD2-O 3.08Å; Y211-K225 HydrophobicContact CE1-CB 4.45Å; Y211-K225 HydrophobicContact CE1-CD 4.05Å; Y211-K225 HydrophobicContact CE2-CB 3.46Å; Y211-K225 VanDerWaalsContact CE2-CB 3.46Å; Y211-K225 HydrophobicContact CE2-CD 4.25Å; Y211-K225 HydrophobicContact CE2-CG 3.84Å; Y211-K225 VanDerWaalsContact CE2-O 3.29Å; Y211-K225 WeakPolarHBondContact CE2-O 3.35Å; Y211-K225 WeakPolarHBondContact OH-CD 3.4Å; Y211-K225 WeakPolarHBondContact OH-CE 3.37Å; Y211-K225 PolarHBondContact OH-NZ 3.25Å; C221-K225 VanDerWaalsContact O-CA 3.22Å; C221-K225 WeakPolarHBondContact O-CA 3.47Å; C221-K225 PolarHBondContact O-N 3.2Å
226	M	76.7	Confident	76.5	Confident	25 Å²	25	62.6 Å²	62.6	12%	0.123	31%	0.309	C	S	.	.			trans	-55.6	142.7	175.1	-63	173.7	74.3	0	0	113.4	A207 C221 C224 F228 H237	A207-M226 HydrophobicContact CB-CE 3.82Å; A207-M226 WeakPolarHBondContact O-CA 3.41Å; A207-M226 WeakPolarHBondContact O-CB 3.13Å; A207-M226 WeakPolarHBondContact O-CG 3.07Å; C221-M226 WeakPolarHBondContact CB-O 3.39Å; C221-M226 PolarHBondContact N-O 3.47Å; C224-M226 PolarHBondContact O-N 3.43Å; C224-M226 VanDerWaalsContact O-N 3.14Å; C224-M226 VanDerWaalsContact SG-CB 3.52Å; C224-M226 WeakPolarHBondContact SG-CG 3.34Å; C224-M226 PolarHBondContact SG-N 3.26Å; M226-F228 HydrophobicContact CB-CE2 3.81Å; M226-F228 HydrophobicContact CB-CZ 3.76Å; M226-F228 HydrophobicContact CE-CZ 4.2Å; M226-H237 VanDerWaalsContact SD-CE1 3.6Å
227	A	77.9	Confident	77.3	Confident	7 Å²	7	60.6 Å²	60.6	6%	0.058	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	133.6	-172.9	0	0	0	0	0	113.2	A207 R217	A207-A227 PolarHBondContact O-N 2.86Å; R217-A227 HydrophobicContact CB-CB 4.03Å; R217-A227 PolarHBondContact NH1-O 2.77Å; R217-A227 VanDerWaalsContact NH1-O 3.11Å
228	F	81.2	Confident	77.5	Confident	4 Å²	4	62.4 Å²	62.4	2%	0.018	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	147	-166.9	-58.9	-78.8	0	0	0	112.2	N202 A207 R217 Q218 F219 C221 M226 R230 L234 H237	N202-F228 HydrophobicContact CB-CD1 4.24Å; N202-F228 VanDerWaalsContact OD1-CA 3.26Å; N202-F228 WeakPolarHBondContact OD1-CA 3.36Å; N202-F228 WeakPolarHBondContact OD1-CB 3.28Å; A207-F228 HydrophobicContact CB-CD1 3.89Å; A207-F228 HydrophobicContact CB-CE1 3.5Å; A207-F228 HydrophobicContact CB-CZ 4.09Å; R217-F228 CarbonylContact C-O 3.56Å; R217-F228 VanDerWaalsContact CA-O 3.29Å; R217-F228 WeakPolarHBondContact CA-O 3.33Å; Q218-F228 PolarHBondContact N-O 3.4Å; F219-F228 HydrophobicContact CB-CB 4.42Å; F219-F228 PolarHBondContact N-O 3.5Å; F219-F228 VanDerWaalsContact N-O 3.07Å; F219-F228 WeakPolarHBondContact O-CB 3.45Å; F219-F228 WeakPolarHBondContact O-CD2 3.39Å; F219-F228 PolarHBondContact O-N 3.11Å; C221-F228 HydrophobicContact CB-CE2 4.42Å; M226-F228 HydrophobicContact CB-CE2 3.81Å; M226-F228 HydrophobicContact CB-CZ 3.76Å; M226-F228 HydrophobicContact CE-CZ 4.2Å; F228-R230 VanDerWaalsContact C-N 3.33Å; F228-R230 PolarHBondContact O-N 3.1Å; F228-L234 HydrophobicContact CB-CB 4.44Å; F228-L234 HydrophobicContact CD2-CB 3.8Å; F228-L234 HydrophobicContact CD2-CD1 4Å; F228-L234 HydrophobicContact CD2-CG 4.48Å; F228-L234 HydrophobicContact CE2-CD1 4.07Å; F228-L234 HydrophobicContact CG-CB 4.36Å; F228-H237 HydrophobicContact CE1-CB 4.25Å; F228-H237 HydrophobicContact CE2-CB 3.74Å; F228-H237 AromaticContact CE2-CG 3.82Å; F228-H237 HydrophobicContact CZ-CB 3.47Å; F228-H237 VanDerWaalsContact CZ-CB 3.47Å; F228-H237 AromaticContact CZ-CG 3.6Å; F228-H237 AromaticContact CZ-ND1 3.83Å
229	T	78.9	Confident	77.6	Confident	18 Å²	18	63.5 Å²	63.5	11%	0.11	30%	0.302	C	S	.	.	S	Bend	trans	-69.7	-29.9	179	61.9	0	0	0	0	112.7	E198 L201 N202 S216 R217 F219	E198-T229 WeakPolarHBondContact OE2-CB 3.31Å; E198-T229 PolarHBondContact OE2-OG1 3.1Å; L201-T229 HydrophobicContact CB-CG2 4.42Å; L201-T229 HydrophobicContact CD1-CG2 4.48Å; N202-T229 PolarHBondContact ND2-OG1 3.35Å; N202-T229 PolarHBondContact OD1-N 3.38Å; N202-T229 PolarHBondContact OD1-OG1 3.49Å; S216-T229 WeakPolarHBondContact O-CA 3.34Å; R217-T229 HydrophobicContact CG-CG2 4.27Å; F219-T229 WeakPolarHBondContact CD2-O 3.47Å; F219-T229 WeakPolarHBondContact CE2-O 3.38Å
230	R	78.1	Confident	77.2	Confident	132 Å²	132	61.8 Å²	61.8	50%	0.498	30%	0.302	S	S	.	.	S	Bend	trans	-133.7	142.7	-176.5	-55.2	175.1	-173.3	-159.3	-4.1	111.4	E198 F219 F228 V232 Y233 L234	E198-R230 VanDerWaalsContact CD-NE 3.28Å; E198-R230 IonicContact OE1-CZ 2.69Å; E198-R230 IonicContact OE1-NE 3.57Å; E198-R230 PolarHBondContact OE1-NE 3.15Å; E198-R230 IonicContact OE1-NH2 3.25Å; E198-R230 PolarHBondContact OE1-NH2 3.26Å; E198-R230 IonicContact OE2-CZ 2.65Å; E198-R230 IonicContact OE2-NE 3.61Å; E198-R230 PolarHBondContact OE2-NE 3.29Å; E198-R230 IonicContact OE2-NH2 3.08Å; F219-R230 VanDerWaalsContact CD2-CA 3.46Å; F228-R230 VanDerWaalsContact C-N 3.33Å; F228-R230 PolarHBondContact O-N 3.1Å; R230-V232 PolarHBondContact O-N 3.41Å; R230-Y233 HydrophobicContact CB-CD2 3.92Å; R230-Y233 HydrophobicContact CB-CE2 4.34Å; R230-Y233 HydrophobicContact CG-CD2 4.42Å; R230-Y233 HydrophobicContact CG-CE2 4.41Å; R230-Y233 PolarHBondContact O-N 3.21Å; R230-L234 PolarHBondContact O-N 2.95Å
231	Q	80.6	Confident	76.3	Confident	98 Å²	98	64.2 Å²	64.2	46%	0.458	31%	0.309	S	S	.	.	H	α-helix	trans	-52.5	-26.3	174	-178.3	63.2	-11.6	0	0	113.5	F219 T235	F219-Q231 HydrophobicContact CD1-CB 3.68Å; F219-Q231 HydrophobicContact CD1-CG 4.39Å; F219-Q231 VanDerWaalsContact CD1-OE1 3.26Å; F219-Q231 HydrophobicContact CE1-CB 3.72Å; F219-Q231 HydrophobicContact CG-CB 4.13Å; F219-Q231 HydrophobicContact CZ-CB 4.19Å; Q231-T235 WeakPolarHBondContact O-CB 3.35Å; Q231-T235 PolarHBondContact O-N 3.27Å; Q231-T235 PolarHBondContact O-OG1 2.55Å
232	V	80	Confident	75.1	Confident	84 Å²	84	69.6 Å²	69.6	51%	0.509	34%	0.335	S	S	.	.	H	α-helix	trans	-61.6	-48.5	175.3	179.8	0	0	0	0	111.2	R230 T235 I236	R230-V232 PolarHBondContact O-N 3.41Å; V232-T235 CarbonylContact O-C 3.49Å; V232-T235 WeakPolarHBondContact O-CA 3.05Å; V232-T235 WeakPolarHBondContact O-CB 3.34Å; V232-T235 PolarHBondContact O-N 3.12Å; V232-T235 VanDerWaalsContact O-N 3.11Å; V232-I236 HydrophobicContact CG1-CD1 3.96Å; V232-I236 WeakPolarHBondContact O-CG1 3.47Å; V232-I236 PolarHBondContact O-N 3.27Å
233	Y	81.5	Confident	74.8	Confident	41 Å²	41	64 Å²	64	16%	0.161	31%	0.309	C	S	.	.	H	α-helix	trans	-68	-38.3	178.9	-64.6	-71.9	0	0	0	111.9	D199 N202 R230 T235 I236 H237	D199-Y233 WeakPolarHBondContact OD1-CE1 3.32Å; D199-Y233 VanDerWaalsContact OD1-CZ 3.28Å; D199-Y233 PolarHBondContact OD1-OH 3.31Å; N202-Y233 HydrophobicContact CB-CD1 3.53Å; N202-Y233 HydrophobicContact CB-CD2 3.72Å; N202-Y233 HydrophobicContact CB-CE1 3.83Å; N202-Y233 HydrophobicContact CB-CE2 4Å; N202-Y233 HydrophobicContact CB-CG 3.47Å; N202-Y233 VanDerWaalsContact CB-CG 3.47Å; N202-Y233 VanDerWaalsContact CG-CG 3.45Å; N202-Y233 WeakPolarHBondContact ND2-CD2 3.44Å; N202-Y233 VanDerWaalsContact ND2-CE2 3.3Å; N202-Y233 WeakPolarHBondContact ND2-CE2 3.49Å; N202-Y233 WeakPolarHBondContact OD1-CD2 3.19Å; R230-Y233 HydrophobicContact CB-CD2 3.92Å; R230-Y233 HydrophobicContact CB-CE2 4.34Å; R230-Y233 HydrophobicContact CG-CD2 4.42Å; R230-Y233 HydrophobicContact CG-CE2 4.41Å; R230-Y233 PolarHBondContact O-N 3.21Å; Y233-T235 VanDerWaalsContact C-N 3.28Å; Y233-T235 PolarHBondContact O-N 2.84Å; Y233-I236 HydrophobicContact CD1-CD1 4.41Å; Y233-I236 PolarHBondContact O-N 3.05Å; Y233-H237 WeakPolarHBondContact O-CB 3.42Å; Y233-H237 PolarHBondContact O-N 3.31Å
234	L	83.5	Confident	73.9	Confident	13 Å²	13	67.6 Å²	67.6	7%	0.068	32%	0.323	C	S	.	.	H	α-helix	trans	-60.2	-38.1	169.6	176.5	54.9	0	0	0	111.8	F219 C220 C221 F228 R230 H237 N238	F219-L234 HydrophobicContact CB-CB 4.07Å; F219-L234 HydrophobicContact CB-CD2 3.96Å; C220-L234 WeakPolarHBondContact O-CD2 3.17Å; C221-L234 HydrophobicContact CB-CD1 3.52Å; F228-L234 HydrophobicContact CB-CB 4.44Å; F228-L234 HydrophobicContact CD2-CB 3.8Å; F228-L234 HydrophobicContact CD2-CD1 4Å; F228-L234 HydrophobicContact CD2-CG 4.48Å; F228-L234 HydrophobicContact CE2-CD1 4.07Å; F228-L234 HydrophobicContact CG-CB 4.36Å; R230-L234 PolarHBondContact O-N 2.95Å; L234-H237 PolarHBondContact O-N 2.9Å; L234-N238 VanDerWaalsContact O-CB 3.31Å; L234-N238 WeakPolarHBondContact O-CB 3.18Å; L234-N238 PolarHBondContact O-N 3.46Å; L234-N238 PolarHBondContact O-ND2 3.46Å
235	T	79.5	Confident	72.9	Confident	46 Å²	46	73 Å²	73	28%	0.282	35%	0.345	S	S	.	.	H	α-helix	trans	-70.2	-38.7	177	-58.8	0	0	0	0	112.4	Q231 V232 Y233 N238 R239	Q231-T235 WeakPolarHBondContact O-CB 3.35Å; Q231-T235 PolarHBondContact O-N 3.27Å; Q231-T235 PolarHBondContact O-OG1 2.55Å; V232-T235 CarbonylContact O-C 3.49Å; V232-T235 WeakPolarHBondContact O-CA 3.05Å; V232-T235 WeakPolarHBondContact O-CB 3.34Å; V232-T235 PolarHBondContact O-N 3.12Å; V232-T235 VanDerWaalsContact O-N 3.11Å; Y233-T235 VanDerWaalsContact C-N 3.28Å; Y233-T235 PolarHBondContact O-N 2.84Å; T235-N238 PolarHBondContact O-N 2.85Å; T235-R239 WeakPolarHBondContact O-CB 3.27Å; T235-R239 WeakPolarHBondContact O-CG 3.27Å; T235-R239 PolarHBondContact O-N 3.02Å; T235-R239 VanDerWaalsContact O-N 3.11Å
236	I	77.6	Confident	71.8	Confident	105 Å²	105	70 Å²	70	54%	0.538	34%	0.335	S	S	.	.	H	α-helix	trans	-63.1	-47.7	172.4	-69.6	165	0	0	0	109.7	V232 Y233 N238 R239 G240	V232-I236 HydrophobicContact CG1-CD1 3.96Å; V232-I236 WeakPolarHBondContact O-CG1 3.47Å; V232-I236 PolarHBondContact O-N 3.27Å; Y233-I236 HydrophobicContact CD1-CD1 4.41Å; Y233-I236 PolarHBondContact O-N 3.05Å; I236-N238 PolarHBondContact O-N 2.85Å; I236-R239 PolarHBondContact O-N 3.46Å; I236-G240 PolarHBondContact O-N 2.97Å
237	H	80.4	Confident	69.9	Low	13 Å²	13	69.7 Å²	69.7	6%	0.06	34%	0.338	C	S	.	.	H	α-helix	trans	-54.9	-54.3	174.5	174.5	80.3	0	0	0	110.9	C221 C224 M226 F228 Y233 L234 R239 G240 H243	C221-H237 PolarHBondContact SG-CD2 3.09Å; C224-H237 PolarHBondContact SG-CE1 3.33Å; C224-H237 PolarHBondContact SG-NE2 3.07Å; M226-H237 VanDerWaalsContact SD-CE1 3.6Å; F228-H237 HydrophobicContact CE1-CB 4.25Å; F228-H237 HydrophobicContact CE2-CB 3.74Å; F228-H237 AromaticContact CE2-CG 3.82Å; F228-H237 HydrophobicContact CZ-CB 3.47Å; F228-H237 VanDerWaalsContact CZ-CB 3.47Å; F228-H237 AromaticContact CZ-CG 3.6Å; F228-H237 AromaticContact CZ-ND1 3.83Å; Y233-H237 WeakPolarHBondContact O-CB 3.42Å; Y233-H237 PolarHBondContact O-N 3.31Å; L234-H237 PolarHBondContact O-N 2.9Å; H237-R239 PolarHBondContact O-N 2.94Å; H237-R239 VanDerWaalsContact O-N 3.13Å; H237-G240 PolarHBondContact O-N 3.09Å; H237-H243 AromaticContact CD2-CG 3.94Å; H237-H243 AromaticContact CD2-ND1 3.35Å; H237-H243 PolarHBondContact CD2-ND1 2.86Å; H237-H243 WeakPolarHBondContact NE2-CB 3.29Å; H237-H243 AromaticContact NE2-CG 3.61Å; H237-H243 AromaticContact NE2-ND1 3.04Å; H237-H243 PolarHBondContact NE2-ND1 3.48Å; H237-H243 WeakPolarHBondContact O-CB 3.24Å
238	N	74.7	Confident	68.2	Low	60 Å²	60	76 Å²	76	32%	0.321	36%	0.364	S	S	.	.	H	α-helix	trans	-59.5	-26.6	-178.5	-70.7	-18.5	0	0	0	113.3	C221 L234 T235 I236 H243	C221-N238 PolarHBondContact SG-OD1 2.99Å; L234-N238 VanDerWaalsContact O-CB 3.31Å; L234-N238 WeakPolarHBondContact O-CB 3.18Å; L234-N238 PolarHBondContact O-N 3.46Å; L234-N238 PolarHBondContact O-ND2 3.46Å; T235-N238 PolarHBondContact O-N 2.85Å; I236-N238 PolarHBondContact O-N 2.85Å; N238-H243 PolarHBondContact O-CD2 2.94Å; N238-H243 PolarHBondContact OD1-CE1 2.82Å; N238-H243 PolarHBondContact OD1-ND1 2.67Å
239	R	73.6	Confident	66.2	Low	172 Å²	172	78.7 Å²	78.7	65%	0.649	38%	0.381	S	S	*	.	H	α-helix	trans	-86.3	-21.3	174	-74.4	173.9	165.9	158.8	-4.4	113.7	T235 I236 H237	T235-R239 WeakPolarHBondContact O-CB 3.27Å; T235-R239 WeakPolarHBondContact O-CG 3.27Å; T235-R239 PolarHBondContact O-N 3.02Å; T235-R239 VanDerWaalsContact O-N 3.11Å; I236-R239 PolarHBondContact O-N 3.46Å; H237-R239 PolarHBondContact O-N 2.94Å; H237-R239 VanDerWaalsContact O-N 3.13Å
240	G	69	Low	64.4	Low	26 Å²	26	83.2 Å²	83.2	27%	0.268	40%	0.401	S	S	.	.	S	Bend	trans	-69.6	156.4	-175.1	0	0	0	0	0	114.8	I236 H237 M242 H243 R244	I236-G240 PolarHBondContact O-N 2.97Å; H237-G240 PolarHBondContact O-N 3.09Å; G240-M242 PolarHBondContact O-N 3.27Å; G240-H243 PolarHBondContact O-N 3.45Å; G240-R244 PolarHBondContact O-N 2.91Å
241	L	58.9	Low	62.3	Low	133 Å²	133	82.5 Å²	82.5	70%	0.696	42%	0.416	S	S	*	.	H	α-helix	trans	-56.6	-36.5	177.7	-76	169.3	0	0	0	112.6	H243 R244 Q245	L241-H243 PolarHBondContact O-N 3.47Å; L241-R244 PolarHBondContact O-N 3.12Å; L241-Q245 WeakPolarHBondContact O-CB 3.43Å; L241-Q245 PolarHBondContact O-N 2.83Å
242	M	55	Low	60.3	Low	116 Å²	116	80.7 Å²	80.7	57%	0.571	41%	0.408	S	S	*	.	H	α-helix	trans	-60.7	-42.7	179.1	-60.5	-59.8	95.7	0	0	112.1	G240 Q245 C246	G240-M242 PolarHBondContact O-N 3.27Å; M242-Q245 PolarHBondContact O-N 2.85Å; M242-C246 PolarHBondContact O-N 3.15Å
243	H	65.3	Low	58.6	Low	14 Å²	14	79.1 Å²	79.1	7%	0.065	40%	0.4	C	S	.	.	H	α-helix	trans	-71	-34.6	178.3	-174.4	91.1	0	0	0	113.3	C221 R223 H237 N238 G240 L241 Q245 C246	C221-H243 PolarHBondContact SG-CE1 3.11Å; C221-H243 PolarHBondContact SG-ND1 2.84Å; C221-H243 VanDerWaalsContact SG-ND1 3.36Å; R223-H243 PolarHBondContact NH1-CD2 3.2Å; R223-H243 PolarHBondContact NH1-NE2 3.19Å; R223-H243 PolarHBondContact NH1-O 3.2Å; H237-H243 AromaticContact CD2-CG 3.94Å; H237-H243 AromaticContact CD2-ND1 3.35Å; H237-H243 PolarHBondContact CD2-ND1 2.86Å; H237-H243 WeakPolarHBondContact NE2-CB 3.29Å; H237-H243 AromaticContact NE2-CG 3.61Å; H237-H243 AromaticContact NE2-ND1 3.04Å; H237-H243 PolarHBondContact NE2-ND1 3.48Å; H237-H243 WeakPolarHBondContact O-CB 3.24Å; N238-H243 PolarHBondContact O-CD2 2.94Å; N238-H243 PolarHBondContact OD1-CE1 2.82Å; N238-H243 PolarHBondContact OD1-ND1 2.67Å; G240-H243 PolarHBondContact O-N 3.45Å; L241-H243 PolarHBondContact O-N 3.47Å; H243-Q245 VanDerWaalsContact C-N 3.31Å; H243-C246 WeakPolarHBondContact O-CB 3.45Å
244	R	54.9	Low	57.1	Low	191 Å²	191	82.6 Å²	82.6	72%	0.721	42%	0.421	S	S	*	.	H	α-helix	trans	-65.7	-35.2	171.2	-77.2	-175.1	165	-173.7	-4.7	111.8	G240 L241	G240-R244 PolarHBondContact O-N 2.91Å; L241-R244 PolarHBondContact O-N 3.12Å
245	Q	52.9	Low	55.6	Low	146 Å²	146	88.9 Å²	88.9	68%	0.682	45%	0.448	S	S	*	.	H	α-helix	trans	-80.9	-20.9	179.8	-148.8	72	30.2	0	0	114.3	L241 M242 H243 G247	L241-Q245 WeakPolarHBondContact O-CB 3.43Å; L241-Q245 PolarHBondContact O-N 2.83Å; M242-Q245 PolarHBondContact O-N 2.85Å; H243-Q245 VanDerWaalsContact C-N 3.31Å; Q245-G247 VanDerWaalsContact O-CA 3.27Å; Q245-G247 WeakPolarHBondContact O-CA 3.46Å; Q245-G247 PolarHBondContact O-N 2.9Å; Q245-G247 VanDerWaalsContact O-N 3.16Å
246	C	46.9	Very low	54.7	Low	27 Å²	27	88 Å²	88	18%	0.182	44%	0.439	C	S	.	.	H	α-helix	trans	-48.8	-44.3	-179.1	-155.3	0	0	0	0	111.5	R223 C224 M242 H243 K248 W1257	R223-C246 PolarHBondContact O-SG 2.88Å; C224-C246 VanDerWaalsContact CB-SG 3.57Å; M242-C246 PolarHBondContact O-N 3.15Å; H243-C246 WeakPolarHBondContact O-CB 3.45Å; C246-K248 VanDerWaalsContact C-N 3.31Å; C246-K248 PolarHBondContact O-N 2.78Å; C246-W1257 VanDerWaalsContact C-CE3 3.43Å; C246-W1257 VanDerWaalsContact C-CZ3 3.48Å; C246-W1257 HydrophobicContact CB-CE3 4.24Å; C246-W1257 HydrophobicContact CB-CH2 3.88Å; C246-W1257 HydrophobicContact CB-CZ3 3.52Å; C246-W1257 WeakPolarHBondContact SG-CZ3 3.47Å
247	G	38.5	Very low	53.9	Low	17 Å²	17	89.2 Å²	89.2	18%	0.175	44%	0.438	C	S	.	.	T	Hydrogen-bonded Turn		48.8	-49.9	127.4	0	0	0	0	0	123.6	Q245 W1257	Q245-G247 VanDerWaalsContact O-CA 3.27Å; Q245-G247 WeakPolarHBondContact O-CA 3.46Å; Q245-G247 PolarHBondContact O-N 2.9Å; Q245-G247 VanDerWaalsContact O-N 3.16Å; G247-W1257 VanDerWaalsContact C-NE1 3.3Å; G247-W1257 VanDerWaalsContact CA-CE2 3.46Å; G247-W1257 VanDerWaalsContact N-CE2 3.31Å; G247-W1257 PolarHBondContact O-NE1 2.85Å
248	K	40.7	Very low	52.8	Low	139 Å²	139	90.2 Å²	90.2	60%	0.604	45%	0.447	S	S	*	.	S	Bend	trans	177.1	89.8	-178	-87	128.7	-171.9	-176.1	0	110.7	C246	C246-K248 VanDerWaalsContact C-N 3.31Å; C246-K248 PolarHBondContact O-N 2.78Å
249	T	40.7	Very low	52.5	Low	62 Å²	62	90.5 Å²	90.5	38%	0.38	45%	0.454	S	S	.	.			trans	-150.2	85.8	179.6	52.3	0	0	0	0	116.2	M252 W1257	T249-M252 HydrophobicContact CG2-CE 4.46Å; T249-M252 HydrophobicContact CG2-CG 3.67Å; T249-M252 HydrophobicContact CG2-SD 4.23Å; T249-W1257 CarbonylContact C-O 3.33Å; T249-W1257 WeakPolarHBondContact CA-O 3.41Å; T249-W1257 PolarHBondContact N-O 3.31Å
250	Q	40.4	Very low	52.3	Low	113 Å²	113	86.3 Å²	86.3	53%	0.528	44%	0.444	S	S	.	.	S	Bend	trans	-72.4	136.5	155.4	-89.2	154.9	-4.1	0	0	108.3	M252 W1257 S1258	Q250-M252 PolarHBondContact O-N 3.48Å; Q250-W1257 PolarHBondContact N-O 2.84Å; Q250-W1257 VanDerWaalsContact N-O 3.09Å; Q250-S1258 VanDerWaalsContact CB-CB 3.42Å; Q250-S1258 WeakPolarHBondContact CB-OG 3.47Å; Q250-S1258 PolarHBondContact N-OG 3.22Å; Q250-S1258 VanDerWaalsContact OE1-CB 3.24Å; Q250-S1258 PolarHBondContact OE1-OG 2.89Å
251	S	34.1	Very low	52.8	Low	116 Å²	116	89.4 Å²	89.4	81%	0.811	45%	0.448	S	S	*	.			trans	52.4	51	168.1	179.6	0	0	0	0	114.1
252	M	38.8	Very low	53.8	Low	60 Å²	60	87 Å²	87	30%	0.296	44%	0.44	S	S	.	.			trans	-60.6	130.2	152.6	-79	-81.5	-99.2	0	0	107.8	T249 Q250 D254 Y257 R269	T249-M252 HydrophobicContact CG2-CE 4.46Å; T249-M252 HydrophobicContact CG2-CG 3.67Å; T249-M252 HydrophobicContact CG2-SD 4.23Å; Q250-M252 PolarHBondContact O-N 3.48Å; M252-D254 PolarHBondContact O-N 3.14Å; M252-Y257 HydrophobicContact CE-CD2 4.46Å; M252-Y257 HydrophobicContact CE-CE2 3.46Å; M252-Y257 VanDerWaalsContact CE-CE2 3.46Å; M252-Y257 HydrophobicContact SD-CE2 4.46Å; M252-R269 PolarHBondContact SD-NH1 3.39Å; M252-R269 VanDerWaalsContact SD-NH1 3.43Å
253	P	44.7	Very low	55.1	Low	51 Å²	51	86.1 Å²	86.1	33%	0.331	43%	0.431	S	S	.	.			trans	-77.1	114	177	29.2	-31.6	0	0	0	109.4	K255 Y256	P253-K255 PolarHBondContact O-N 3.09Å; P253-K255 VanDerWaalsContact O-N 3.11Å; P253-Y256 VanDerWaalsContact O-CB 3.3Å; P253-Y256 WeakPolarHBondContact O-CB 3.35Å; P253-Y256 PolarHBondContact O-N 2.94Å
254	D	48.9	Very low	56	Low	115 Å²	115	88.6 Å²	88.6	62%	0.615	44%	0.442	S	S	*	.	H	α-helix	trans	-56.3	-33.1	-178.5	-31.7	-71.8	0	0	0	111	M252 Y256 Y257 S258	M252-D254 PolarHBondContact O-N 3.14Å; D254-Y256 PolarHBondContact O-N 2.93Å; D254-Y257 PolarHBondContact O-N 3.32Å; D254-S258 PolarHBondContact O-N 3.04Å; D254-S258 VanDerWaalsContact O-N 3.12Å
255	K	52.9	Low	57.4	Low	145 Å²	145	79.5 Å²	79.5	63%	0.63	41%	0.407	S	S	*	.	H	α-helix	trans	-60.7	-2.1	171.4	-58.2	-179.7	-176.8	179.3	0	114.8	P253 S271	P253-K255 PolarHBondContact O-N 3.09Å; P253-K255 VanDerWaalsContact O-N 3.11Å; K255-S271 WeakPolarHBondContact O-CB 3.06Å
256	Y	60.4	Low	58.6	Low	26 Å²	26	80.4 Å²	80.4	10%	0.102	41%	0.412	C	S	.	.	H	α-helix	trans	-93	-38	166.6	-166	-110	0	0	0	112.3	P253 D254 K264 E266 R269 S271	P253-Y256 VanDerWaalsContact O-CB 3.3Å; P253-Y256 WeakPolarHBondContact O-CB 3.35Å; P253-Y256 PolarHBondContact O-N 2.94Å; D254-Y256 PolarHBondContact O-N 2.93Å; Y256-K264 HydrophobicContact CD2-CB 4.5Å; Y256-K264 HydrophobicContact CE2-CB 3.76Å; Y256-K264 VanDerWaalsContact O-CD 3.28Å; Y256-K264 WeakPolarHBondContact O-CD 3.38Å; Y256-K264 VanDerWaalsContact O-CE 3.3Å; Y256-K264 WeakPolarHBondContact O-CE 3.26Å; Y256-K264 PolarHBondContact O-NZ 3.33Å; Y256-E266 WeakPolarHBondContact OH-CA 3.48Å; Y256-E266 PolarHBondContact OH-N 2.83Å; Y256-R269 VanDerWaalsContact CD2-CA 3.48Å; Y256-R269 HydrophobicContact CD2-CB 4.05Å; Y256-R269 HydrophobicContact CE2-CB 4.3Å; Y256-R269 HydrophobicContact CG-CB 4.3Å; Y256-S271 VanDerWaalsContact CA-OG 3.31Å; Y256-S271 WeakPolarHBondContact CA-OG 3.48Å; Y256-S271 WeakPolarHBondContact CD2-OG 3.45Å; Y256-S271 PolarHBondContact O-OG 3.09Å
257	Y	61.5	Low	59.8	Low	131 Å²	131	83 Å²	83	51%	0.514	42%	0.423	S	S	.	.	H	α-helix	trans	-90.7	-28.2	-172.1	-75.7	-82.4	0	0	0	114.4	M252 D254 S259 K264	M252-Y257 HydrophobicContact CE-CD2 4.46Å; M252-Y257 HydrophobicContact CE-CE2 3.46Å; M252-Y257 VanDerWaalsContact CE-CE2 3.46Å; M252-Y257 HydrophobicContact SD-CE2 4.46Å; D254-Y257 PolarHBondContact O-N 3.32Å; Y257-S259 PolarHBondContact O-N 2.89Å; Y257-K264 VanDerWaalsContact C-NZ 3.34Å; Y257-K264 PolarHBondContact O-NZ 2.84Å
258	S	56.6	Low	61.6	Low	34 Å²	34	82.7 Å²	82.7	24%	0.238	42%	0.418	C	S	.	.			trans	-32.8	128.2	173.7	61.4	0	0	0	0	115	D254 R261 K264	D254-S258 PolarHBondContact O-N 3.04Å; D254-S258 VanDerWaalsContact O-N 3.12Å; S258-R261 PolarHBondContact O-N 2.97Å; S258-R261 WeakPolarHBondContact OG-CD 3.37Å; S258-K264 PolarHBondContact O-NZ 3.02Å
259	S	67.3	Low	63.4	Low	67 Å²	67	82.5 Å²	82.5	47%	0.469	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-43	174.2	44.2	0	0	0	0	112.3	Y257 R261	Y257-S259 PolarHBondContact O-N 2.89Å; S259-R261 PolarHBondContact O-N 3.32Å
260	D	69.6	Low	65.3	Low	84 Å²	84	82.4 Å²	82.4	45%	0.449	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-41.1	-20.7	169.7	-73.2	20.1	0	0	0	116.7
261	R	79.1	Confident	67.3	Low	91 Å²	91	77.2 Å²	77.2	34%	0.343	39%	0.385	S	S	.	.			trans	-131.7	66.8	-167.3	-60.3	177.7	176	-116.7	-3	111.2	S258 S259 Y263 K264 S271 F272 T273	S258-R261 PolarHBondContact O-N 2.97Å; S258-R261 WeakPolarHBondContact OG-CD 3.37Å; S259-R261 PolarHBondContact O-N 3.32Å; R261-Y263 PolarHBondContact O-N 2.99Å; R261-Y263 VanDerWaalsContact O-N 3.14Å; R261-K264 WeakPolarHBondContact O-CE 3.39Å; R261-S271 WeakPolarHBondContact CD-O 3.41Å; R261-S271 PolarHBondContact NH1-O 2.9Å; R261-F272 CarbonylContact C-O 3.16Å; R261-F272 WeakPolarHBondContact CA-O 2.96Å; R261-T273 HydrophobicContact CG-CG2 4.23Å
262	P	80.4	Confident	69.7	Low	83 Å²	83	72.8 Å²	72.8	54%	0.539	35%	0.351	S	S	.	.			trans	-65.4	-18.3	-173.2	25.1	-34	0	0	0	114
263	Y	83.5	Confident	71.9	Confident	96 Å²	96	73.2 Å²	73.2	38%	0.376	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	104	-178	-55.9	-75.8	0	0	0	111.1	R261 S271 F272 Q274 K275	R261-Y263 PolarHBondContact O-N 2.99Å; R261-Y263 VanDerWaalsContact O-N 3.14Å; Y263-S271 WeakPolarHBondContact O-CA 3.34Å; Y263-F272 PolarHBondContact N-O 3.31Å; Y263-F272 WeakPolarHBondContact O-CD2 3.3Å; Y263-F272 PolarHBondContact O-N 2.85Å; Y263-Q274 VanDerWaalsContact CD2-CA 3.41Å; Y263-K275 HydrophobicContact CD1-CB 3.65Å; Y263-K275 HydrophobicContact CD1-CG 3.8Å; Y263-K275 HydrophobicContact CD2-CB 4.48Å; Y263-K275 HydrophobicContact CE1-CB 3.54Å; Y263-K275 HydrophobicContact CE1-CD 4.28Å; Y263-K275 HydrophobicContact CE1-CG 3.89Å; Y263-K275 HydrophobicContact CE2-CB 4.36Å; Y263-K275 HydrophobicContact CG-CB 4.12Å
264	K	83	Confident	73.5	Confident	67 Å²	67	74.5 Å²	74.5	29%	0.291	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	134.9	-165.6	-46.4	-164.9	170	-164.4	0	111.2	Y256 Y257 S258 R261 S271	Y256-K264 HydrophobicContact CD2-CB 4.5Å; Y256-K264 HydrophobicContact CE2-CB 3.76Å; Y256-K264 VanDerWaalsContact O-CD 3.28Å; Y256-K264 WeakPolarHBondContact O-CD 3.38Å; Y256-K264 VanDerWaalsContact O-CE 3.3Å; Y256-K264 WeakPolarHBondContact O-CE 3.26Å; Y256-K264 PolarHBondContact O-NZ 3.33Å; Y257-K264 VanDerWaalsContact C-NZ 3.34Å; Y257-K264 PolarHBondContact O-NZ 2.84Å; S258-K264 PolarHBondContact O-NZ 3.02Å; R261-K264 WeakPolarHBondContact O-CE 3.39Å; K264-S271 WeakPolarHBondContact CB-OG 3.45Å; K264-S271 VanDerWaalsContact CG-OG 3.31Å; K264-S271 WeakPolarHBondContact CG-OG 3.29Å
265	C	85.3	Confident	75.1	Confident	0 Å²	0	72.5 Å²	72.5	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	99.4	178.2	-172.7	0	0	0	0	111.9	L267 C268 R269 E270 F272 L278 H281 H287	C265-L267 VanDerWaalsContact C-N 3.25Å; C265-L267 PolarHBondContact O-N 2.85Å; C265-C268 WeakPolarHBondContact CB-SG 3.26Å; C265-C268 PolarHBondContact O-N 2.92Å; C265-C268 VanDerWaalsContact O-N 3.1Å; C265-C268 VanDerWaalsContact SG-SG 3.63Å; C265-R269 PolarHBondContact O-N 2.92Å; C265-E270 WeakPolarHBondContact CB-O 3.49Å; C265-E270 PolarHBondContact N-O 3.39Å; C265-F272 HydrophobicContact CB-CE2 4.01Å; C265-L278 HydrophobicContact CB-CD1 3.53Å; C265-H281 VanDerWaalsContact SG-CD2 3.58Å; C265-H281 PolarHBondContact SG-NE2 2.89Å; C265-H287 VanDerWaalsContact SG-CE1 3.55Å
266	E	78	Confident	76.5	Confident	165 Å²	165	68.4 Å²	68.4	77%	0.771	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	-38.8	-178.1	-55.8	-177.7	155.2	0	0	113.6	Y256 C268	Y256-E266 WeakPolarHBondContact OH-CA 3.48Å; Y256-E266 PolarHBondContact OH-N 2.83Å; E266-C268 VanDerWaalsContact C-N 3.29Å; E266-C268 PolarHBondContact O-N 3.15Å
267	L	71.1	Confident	77.4	Confident	80 Å²	80	69.2 Å²	69.2	42%	0.419	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-20.2	-177.7	-68.2	168.5	0	0	0	113.9	C265 F282 L291 L294	C265-L267 VanDerWaalsContact C-N 3.25Å; C265-L267 PolarHBondContact O-N 2.85Å; L267-F282 HydrophobicContact CD1-CE1 4.31Å; L267-L291 HydrophobicContact CD1-CD1 4.28Å; L267-L291 HydrophobicContact CD2-CD1 4.27Å; L267-L294 WeakPolarHBondContact O-CD1 3.33Å
268	C	76.4	Confident	78.6	Confident	12 Å²	12	64 Å²	64	8%	0.081	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-130.3	-15.1	-169.5	90.8	0	0	0	0	114.2	C265 E266 E270 H281 K290	C265-C268 WeakPolarHBondContact CB-SG 3.26Å; C265-C268 PolarHBondContact O-N 2.92Å; C265-C268 VanDerWaalsContact O-N 3.1Å; C265-C268 VanDerWaalsContact SG-SG 3.63Å; E266-C268 VanDerWaalsContact C-N 3.29Å; E266-C268 PolarHBondContact O-N 3.15Å; C268-E270 WeakPolarHBondContact SG-CB 3.46Å; C268-E270 VanDerWaalsContact SG-CG 3.57Å; C268-E270 PolarHBondContact SG-N 2.91Å; C268-H281 PolarHBondContact SG-CE1 2.91Å; C268-H281 PolarHBondContact SG-NE2 3.43Å; C268-K290 HydrophobicContact CB-CD 3.65Å; C268-K290 PolarHBondContact O-NZ 2.87Å
269	R	77.9	Confident	79.9	Confident	135 Å²	135	67 Å²	67	51%	0.509	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	54	49.1	-171.1	-59.2	-171.1	-177	-169.8	0.7	114.4	M252 Y256 C265	M252-R269 PolarHBondContact SD-NH1 3.39Å; M252-R269 VanDerWaalsContact SD-NH1 3.43Å; Y256-R269 VanDerWaalsContact CD2-CA 3.48Å; Y256-R269 HydrophobicContact CD2-CB 4.05Å; Y256-R269 HydrophobicContact CE2-CB 4.3Å; Y256-R269 HydrophobicContact CG-CB 4.3Å; C265-R269 PolarHBondContact O-N 2.92Å
270	E	81	Confident	80.7	Confident	60 Å²	60	69 Å²	69	28%	0.28	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	139.3	166.2	-63.5	164.1	-145.5	0	0	108.7	C265 C268 F272 H281 K290	C265-E270 WeakPolarHBondContact CB-O 3.49Å; C265-E270 PolarHBondContact N-O 3.39Å; C268-E270 WeakPolarHBondContact SG-CB 3.46Å; C268-E270 VanDerWaalsContact SG-CG 3.57Å; C268-E270 PolarHBondContact SG-N 2.91Å; E270-F272 HydrophobicContact CB-CE1 4.34Å; E270-F272 HydrophobicContact CB-CE2 3.96Å; E270-F272 HydrophobicContact CB-CZ 3.52Å; E270-F272 VanDerWaalsContact O-CE2 3.31Å; E270-F272 WeakPolarHBondContact O-CE2 3.29Å; E270-H281 VanDerWaalsContact CD-CE1 3.47Å; E270-H281 IonicContact OE1-CE1 3.94Å; E270-H281 IonicContact OE2-CE1 3.32Å; E270-H281 PolarHBondContact OE2-CE1 3.06Å; E270-H281 IonicContact OE2-ND1 2.7Å; E270-H281 PolarHBondContact OE2-ND1 3.05Å; E270-H281 VanDerWaalsContact OE2-ND1 3.11Å; E270-K290 IonicContact OE1-NZ 3.04Å; E270-K290 PolarHBondContact OE1-NZ 3.23Å
271	S	82.9	Confident	81.5	Confident	3 Å²	3	65.5 Å²	65.5	2%	0.021	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	150.1	175	-58.7	0	0	0	0	112.5	K255 Y256 R261 Y263 K264	K255-S271 WeakPolarHBondContact O-CB 3.06Å; Y256-S271 VanDerWaalsContact CA-OG 3.31Å; Y256-S271 WeakPolarHBondContact CA-OG 3.48Å; Y256-S271 WeakPolarHBondContact CD2-OG 3.45Å; Y256-S271 PolarHBondContact O-OG 3.09Å; R261-S271 WeakPolarHBondContact CD-O 3.41Å; R261-S271 PolarHBondContact NH1-O 2.9Å; Y263-S271 WeakPolarHBondContact O-CA 3.34Å; K264-S271 WeakPolarHBondContact CB-OG 3.45Å; K264-S271 VanDerWaalsContact CG-OG 3.31Å; K264-S271 WeakPolarHBondContact CG-OG 3.29Å
272	F	85.1	Confident	81.8	Confident	24 Å²	24	65 Å²	65	11%	0.105	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	145.6	-166.8	-53.5	-76.2	0	0	0	110.9	R261 Y263 C265 E270 Q274 I277 L278 H281	R261-F272 CarbonylContact C-O 3.16Å; R261-F272 WeakPolarHBondContact CA-O 2.96Å; Y263-F272 PolarHBondContact N-O 3.31Å; Y263-F272 WeakPolarHBondContact O-CD2 3.3Å; Y263-F272 PolarHBondContact O-N 2.85Å; C265-F272 HydrophobicContact CB-CE2 4.01Å; E270-F272 HydrophobicContact CB-CE1 4.34Å; E270-F272 HydrophobicContact CB-CE2 3.96Å; E270-F272 HydrophobicContact CB-CZ 3.52Å; E270-F272 VanDerWaalsContact O-CE2 3.31Å; E270-F272 WeakPolarHBondContact O-CE2 3.29Å; F272-Q274 VanDerWaalsContact C-N 3.27Å; F272-Q274 PolarHBondContact O-N 2.91Å; F272-I277 HydrophobicContact CB-CB 4.16Å; F272-I277 HydrophobicContact CB-CG2 4.29Å; F272-I277 HydrophobicContact CD1-CB 4.24Å; F272-I277 HydrophobicContact CD1-CG2 3.47Å; F272-I277 VanDerWaalsContact CD1-CG2 3.47Å; F272-I277 HydrophobicContact CE1-CG2 4.18Å; F272-I277 HydrophobicContact CG-CB 4.4Å; F272-I277 HydrophobicContact CG-CG2 4.1Å; F272-L278 HydrophobicContact CD2-CB 3.86Å; F272-L278 HydrophobicContact CD2-CD1 3.82Å; F272-L278 HydrophobicContact CD2-CG 4.42Å; F272-L278 HydrophobicContact CE2-CD1 3.9Å; F272-L278 HydrophobicContact CG-CB 4.41Å; F272-H281 HydrophobicContact CE1-CB 4.06Å; F272-H281 HydrophobicContact CE2-CB 3.9Å; F272-H281 AromaticContact CE2-CG 3.7Å; F272-H281 HydrophobicContact CZ-CB 3.58Å; F272-H281 AromaticContact CZ-CG 3.32Å; F272-H281 AromaticContact CZ-ND1 3.34Å; F272-H281 VanDerWaalsContact CZ-ND1 3.34Å; F272-H281 WeakPolarHBondContact CZ-ND1 3.41Å
273	T	84.6	Confident	81.4	Confident	69 Å²	69	65.9 Å²	65.9	42%	0.423	32%	0.324	S	S	.	.	S	Bend	trans	-71.7	-20.2	177.1	50.2	0	0	0	0	113	R261	R261-T273 HydrophobicContact CG-CG2 4.23Å
274	Q	78.3	Confident	81	Confident	78 Å²	78	62.8 Å²	62.8	36%	0.364	32%	0.317	S	S	.	.	S	Bend	trans	-139.6	145.6	-176.5	-60.2	172	-2	0	0	111.7	Y263 F272 S276 I277 L278	Y263-Q274 VanDerWaalsContact CD2-CA 3.41Å; F272-Q274 VanDerWaalsContact C-N 3.27Å; F272-Q274 PolarHBondContact O-N 2.91Å; Q274-S276 VanDerWaalsContact C-N 3.27Å; Q274-S276 VanDerWaalsContact CB-OG 3.3Å; Q274-S276 WeakPolarHBondContact CB-OG 3.41Å; Q274-S276 PolarHBondContact O-N 2.9Å; Q274-S276 PolarHBondContact OE1-OG 3.34Å; Q274-I277 HydrophobicContact CB-CD1 4.01Å; Q274-I277 HydrophobicContact CB-CG1 4.09Å; Q274-I277 HydrophobicContact CG-CD1 4.24Å; Q274-I277 PolarHBondContact O-N 3.34Å; Q274-I277 VanDerWaalsContact O-N 3.12Å; Q274-L278 PolarHBondContact O-N 2.92Å
275	K	83.3	Confident	80.4	Confident	73 Å²	73	65.5 Å²	65.5	32%	0.317	34%	0.339	S	S	.	.	H	α-helix	trans	-61.2	-35.6	176.9	-157.2	-176.6	-179	-168.2	0	112.7	Y263 I277 L278 L279 E523	Y263-K275 HydrophobicContact CD1-CB 3.65Å; Y263-K275 HydrophobicContact CD1-CG 3.8Å; Y263-K275 HydrophobicContact CD2-CB 4.48Å; Y263-K275 HydrophobicContact CE1-CB 3.54Å; Y263-K275 HydrophobicContact CE1-CD 4.28Å; Y263-K275 HydrophobicContact CE1-CG 3.89Å; Y263-K275 HydrophobicContact CE2-CB 4.36Å; Y263-K275 HydrophobicContact CG-CB 4.12Å; K275-I277 VanDerWaalsContact C-N 3.29Å; K275-I277 PolarHBondContact O-N 3.11Å; K275-L278 WeakPolarHBondContact O-CB 3.26Å; K275-L278 PolarHBondContact O-N 3.08Å; K275-L279 HydrophobicContact CG-CD1 4.41Å; K275-L279 PolarHBondContact O-N 3.18Å; K275-E523 IonicContact NZ-OE1 2.69Å; K275-E523 PolarHBondContact NZ-OE1 3.11Å; K275-E523 IonicContact NZ-OE2 2.76Å; K275-E523 PolarHBondContact NZ-OE2 2.88Å
276	S	80.7	Confident	79.7	Confident	58 Å²	58	69.2 Å²	69.2	41%	0.406	37%	0.365	S	S	.	.	H	α-helix	trans	-53.6	-43.7	173.1	55	0	0	0	0	112.2	Q274 L279 V280	Q274-S276 VanDerWaalsContact C-N 3.27Å; Q274-S276 VanDerWaalsContact CB-OG 3.3Å; Q274-S276 WeakPolarHBondContact CB-OG 3.41Å; Q274-S276 PolarHBondContact O-N 2.9Å; Q274-S276 PolarHBondContact OE1-OG 3.34Å; S276-L279 PolarHBondContact O-N 3.5Å; S276-V280 WeakPolarHBondContact O-CG2 3.49Å; S276-V280 PolarHBondContact O-N 2.63Å
277	I	80.2	Confident	79.9	Confident	44 Å²	44	61.6 Å²	61.6	23%	0.226	33%	0.329	C	S	.	.	H	α-helix	trans	-73.3	-34	-179.2	-53.3	169.3	0	0	0	110.4	F272 Q274 K275 H281	F272-I277 HydrophobicContact CB-CB 4.16Å; F272-I277 HydrophobicContact CB-CG2 4.29Å; F272-I277 HydrophobicContact CD1-CB 4.24Å; F272-I277 HydrophobicContact CD1-CG2 3.47Å; F272-I277 VanDerWaalsContact CD1-CG2 3.47Å; F272-I277 HydrophobicContact CE1-CG2 4.18Å; F272-I277 HydrophobicContact CG-CB 4.4Å; F272-I277 HydrophobicContact CG-CG2 4.1Å; Q274-I277 HydrophobicContact CB-CD1 4.01Å; Q274-I277 HydrophobicContact CB-CG1 4.09Å; Q274-I277 HydrophobicContact CG-CD1 4.24Å; Q274-I277 PolarHBondContact O-N 3.34Å; Q274-I277 VanDerWaalsContact O-N 3.12Å; K275-I277 VanDerWaalsContact C-N 3.29Å; K275-I277 PolarHBondContact O-N 3.11Å; I277-H281 WeakPolarHBondContact O-CB 3.35Å; I277-H281 PolarHBondContact O-N 3.01Å
278	L	86.9	Confident	80.3	Confident	20 Å²	20	61.3 Å²	61.3	11%	0.105	33%	0.328	C	S	.	.	H	α-helix	trans	-64.2	-43	171	175.1	59.9	0	0	0	111.9	C265 F272 Q274 K275 H281 F282	C265-L278 HydrophobicContact CB-CD1 3.53Å; F272-L278 HydrophobicContact CD2-CB 3.86Å; F272-L278 HydrophobicContact CD2-CD1 3.82Å; F272-L278 HydrophobicContact CD2-CG 4.42Å; F272-L278 HydrophobicContact CE2-CD1 3.9Å; F272-L278 HydrophobicContact CG-CB 4.41Å; Q274-L278 PolarHBondContact O-N 2.92Å; K275-L278 WeakPolarHBondContact O-CB 3.26Å; K275-L278 PolarHBondContact O-N 3.08Å; L278-H281 WeakPolarHBondContact O-CA 3.36Å; L278-H281 WeakPolarHBondContact O-CB 3.3Å; L278-H281 PolarHBondContact O-N 3.35Å; L278-H281 VanDerWaalsContact O-N 3.16Å; L278-F282 HydrophobicContact CD1-CD2 4.29Å; L278-F282 HydrophobicContact CD1-CE2 3.72Å; L278-F282 HydrophobicContact CD1-CZ 3.88Å; L278-F282 HydrophobicContact CD2-CE2 4.26Å; L278-F282 HydrophobicContact CG-CD2 4.25Å; L278-F282 HydrophobicContact CG-CE2 3.65Å; L278-F282 HydrophobicContact CG-CZ 4.23Å; L278-F282 WeakPolarHBondContact O-CD2 3.37Å; L278-F282 PolarHBondContact O-N 3.25Å
279	L	83.5	Confident	80.3	Confident	99 Å²	99	68.6 Å²	68.6	52%	0.518	36%	0.355	S	S	.	.	H	α-helix	trans	-63.1	-44.9	175.3	-76.5	160.6	0	0	0	112.5	K275 S276 H281 F282	K275-L279 HydrophobicContact CG-CD1 4.41Å; K275-L279 PolarHBondContact O-N 3.18Å; S276-L279 PolarHBondContact O-N 3.5Å; L279-H281 VanDerWaalsContact C-N 3.28Å; L279-H281 PolarHBondContact O-N 3.2Å; L279-F282 PolarHBondContact O-N 2.78Å
280	V	83.5	Confident	80.2	Confident	107 Å²	107	65.8 Å²	65.8	65%	0.648	35%	0.346	S	S	*	.	H	α-helix	trans	-65.7	-32.6	172.2	172.5	0	0	0	0	111.3	S276 N283 S284	S276-V280 WeakPolarHBondContact O-CG2 3.49Å; S276-V280 PolarHBondContact O-N 2.63Å; V280-N283 PolarHBondContact O-N 2.57Å; V280-S284 PolarHBondContact O-N 3.07Å
281	H	86.7	Confident	80	Confident	11 Å²	11	65.1 Å²	65.1	5%	0.051	34%	0.344	C	S	.	.	H	α-helix	trans	-65.5	-44.1	175.5	168.8	88.9	0	0	0	112	C265 C268 E270 F272 I277 L278 L279 N283 S284 H287	C265-H281 VanDerWaalsContact SG-CD2 3.58Å; C265-H281 PolarHBondContact SG-NE2 2.89Å; C268-H281 PolarHBondContact SG-CE1 2.91Å; C268-H281 PolarHBondContact SG-NE2 3.43Å; E270-H281 VanDerWaalsContact CD-CE1 3.47Å; E270-H281 IonicContact OE1-CE1 3.94Å; E270-H281 IonicContact OE2-CE1 3.32Å; E270-H281 PolarHBondContact OE2-CE1 3.06Å; E270-H281 IonicContact OE2-ND1 2.7Å; E270-H281 PolarHBondContact OE2-ND1 3.05Å; E270-H281 VanDerWaalsContact OE2-ND1 3.11Å; F272-H281 HydrophobicContact CE1-CB 4.06Å; F272-H281 HydrophobicContact CE2-CB 3.9Å; F272-H281 AromaticContact CE2-CG 3.7Å; F272-H281 HydrophobicContact CZ-CB 3.58Å; F272-H281 AromaticContact CZ-CG 3.32Å; F272-H281 AromaticContact CZ-ND1 3.34Å; F272-H281 VanDerWaalsContact CZ-ND1 3.34Å; F272-H281 WeakPolarHBondContact CZ-ND1 3.41Å; I277-H281 WeakPolarHBondContact O-CB 3.35Å; I277-H281 PolarHBondContact O-N 3.01Å; L278-H281 WeakPolarHBondContact O-CA 3.36Å; L278-H281 WeakPolarHBondContact O-CB 3.3Å; L278-H281 PolarHBondContact O-N 3.35Å; L278-H281 VanDerWaalsContact O-N 3.16Å; L279-H281 VanDerWaalsContact C-N 3.28Å; L279-H281 PolarHBondContact O-N 3.2Å; H281-N283 PolarHBondContact O-N 2.93Å; H281-S284 WeakPolarHBondContact O-CA 3.41Å; H281-S284 WeakPolarHBondContact O-CB 3.49Å; H281-S284 PolarHBondContact O-N 3.13Å; H281-S284 PolarHBondContact O-OG 2.6Å; H281-H287 AromaticContact CD2-CG 3.98Å; H281-H287 AromaticContact CD2-ND1 3.39Å; H281-H287 PolarHBondContact CD2-ND1 3.06Å; H281-H287 AromaticContact CE1-ND1 3.95Å; H281-H287 AromaticContact NE2-CG 3.55Å; H281-H287 AromaticContact NE2-ND1 2.89Å; H281-H287 PolarHBondContact NE2-ND1 3.43Å; H281-H287 WeakPolarHBondContact O-CB 3.21Å
282	F	85.5	Confident	79.5	Confident	80 Å²	80	71.7 Å²	71.7	35%	0.351	37%	0.372	S	S	.	.	H	α-helix	trans	-54.9	-37.8	177	-74.2	-63.3	0	0	0	112.3	L267 L278 L279 S284 H287	L267-F282 HydrophobicContact CD1-CE1 4.31Å; L278-F282 HydrophobicContact CD1-CD2 4.29Å; L278-F282 HydrophobicContact CD1-CE2 3.72Å; L278-F282 HydrophobicContact CD1-CZ 3.88Å; L278-F282 HydrophobicContact CD2-CE2 4.26Å; L278-F282 HydrophobicContact CG-CD2 4.25Å; L278-F282 HydrophobicContact CG-CE2 3.65Å; L278-F282 HydrophobicContact CG-CZ 4.23Å; L278-F282 WeakPolarHBondContact O-CD2 3.37Å; L278-F282 PolarHBondContact O-N 3.25Å; L279-F282 PolarHBondContact O-N 2.78Å; F282-S284 VanDerWaalsContact C-N 3.34Å; F282-H287 AromaticContact CD1-CE1 3.46Å; F282-H287 VanDerWaalsContact CD1-CE1 3.46Å; F282-H287 WeakPolarHBondContact CD1-CE1 3.22Å; F282-H287 AromaticContact CD1-NE2 3.77Å; F282-H287 AromaticContact CE1-CE1 3.96Å; F282-H287 PolarHBondContact O-CD2 3.46Å
283	N	72.3	Confident	79	Confident	102 Å²	102	77.5 Å²	77.5	55%	0.545	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-1.6	174.6	-80.2	-66.1	0	0	0	114.7	V280 H281 Q404	V280-N283 PolarHBondContact O-N 2.57Å; H281-N283 PolarHBondContact O-N 2.93Å; N283-Q404 PolarHBondContact OD1-NE2 2.94Å
284	S	74.9	Confident	78.2	Confident	31 Å²	31	78.8 Å²	78.8	22%	0.217	40%	0.401	C	S	.	.	S	Bend	trans	-71.8	145.5	-177.3	77.3	0	0	0	0	112.2	V280 H281 F282 S286 H287 L288	V280-S284 PolarHBondContact O-N 3.07Å; H281-S284 WeakPolarHBondContact O-CA 3.41Å; H281-S284 WeakPolarHBondContact O-CB 3.49Å; H281-S284 PolarHBondContact O-N 3.13Å; H281-S284 PolarHBondContact O-OG 2.6Å; F282-S284 VanDerWaalsContact C-N 3.34Å; S284-S286 PolarHBondContact O-N 3.24Å; S284-S286 VanDerWaalsContact O-N 3.17Å; S284-H287 PolarHBondContact O-N 2.97Å; S284-H287 VanDerWaalsContact O-N 3.1Å; S284-H287 VanDerWaalsContact OG-CB 3.31Å; S284-H287 WeakPolarHBondContact OG-CB 3.44Å; S284-H287 PolarHBondContact OG-N 2.75Å; S284-L288 WeakPolarHBondContact O-CG 3.36Å; S284-L288 PolarHBondContact O-N 2.97Å
285	V	70	Confident	77.9	Confident	125 Å²	125	80 Å²	80	76%	0.758	41%	0.41	S	S	*	.	H	α-helix	trans	-61.2	-27.4	176.9	-176.3	0	0	0	0	111.7	Y289	V285-Y289 WeakPolarHBondContact O-CB 3.29Å; V285-Y289 PolarHBondContact O-N 3.49Å
286	S	71.6	Confident	77.1	Confident	78 Å²	78	80.3 Å²	80.3	55%	0.545	42%	0.417	S	S	.	.	H	α-helix	trans	-68.2	-48	173.2	-58.7	0	0	0	0	111.8	S284 Y289 K290	S284-S286 PolarHBondContact O-N 3.24Å; S284-S286 VanDerWaalsContact O-N 3.17Å; S286-Y289 PolarHBondContact O-N 3.15Å; S286-K290 PolarHBondContact O-N 3.36Å
287	H	81.8	Confident	76.3	Confident	5 Å²	5	79.9 Å²	79.9	2%	0.023	42%	0.417	C	S	.	.	H	α-helix	trans	-61.6	-53.7	174.6	-177.7	95	0	0	0	111	C265 H281 F282 S284 Y289 K290 L291	C265-H287 VanDerWaalsContact SG-CE1 3.55Å; H281-H287 AromaticContact CD2-CG 3.98Å; H281-H287 AromaticContact CD2-ND1 3.39Å; H281-H287 PolarHBondContact CD2-ND1 3.06Å; H281-H287 AromaticContact CE1-ND1 3.95Å; H281-H287 AromaticContact NE2-CG 3.55Å; H281-H287 AromaticContact NE2-ND1 2.89Å; H281-H287 PolarHBondContact NE2-ND1 3.43Å; H281-H287 WeakPolarHBondContact O-CB 3.21Å; F282-H287 AromaticContact CD1-CE1 3.46Å; F282-H287 VanDerWaalsContact CD1-CE1 3.46Å; F282-H287 WeakPolarHBondContact CD1-CE1 3.22Å; F282-H287 AromaticContact CD1-NE2 3.77Å; F282-H287 AromaticContact CE1-CE1 3.96Å; F282-H287 PolarHBondContact O-CD2 3.46Å; S284-H287 PolarHBondContact O-N 2.97Å; S284-H287 VanDerWaalsContact O-N 3.1Å; S284-H287 VanDerWaalsContact OG-CB 3.31Å; S284-H287 WeakPolarHBondContact OG-CB 3.44Å; S284-H287 PolarHBondContact OG-N 2.75Å; H287-Y289 PolarHBondContact O-N 3.2Å; H287-Y289 VanDerWaalsContact O-N 3.14Å; H287-K290 CarbonylContact O-C 3.47Å; H287-K290 WeakPolarHBondContact O-CA 3.48Å; H287-K290 PolarHBondContact O-N 3.27Å; H287-L291 VanDerWaalsContact O-CB 3.28Å; H287-L291 WeakPolarHBondContact O-CB 3.38Å; H287-L291 PolarHBondContact O-N 3.43Å
288	L	78.7	Confident	75.5	Confident	73 Å²	73	83.5 Å²	83.5	38%	0.382	43%	0.432	S	S	.	.	H	α-helix	trans	-59.9	-29.2	-179.4	-64.8	172.4	0	0	0	112.4	S284 K292	S284-L288 WeakPolarHBondContact O-CG 3.36Å; S284-L288 PolarHBondContact O-N 2.97Å; L288-K292 WeakPolarHBondContact O-CB 3.33Å; L288-K292 PolarHBondContact O-N 2.99Å
289	Y	76.6	Confident	74.2	Confident	166 Å²	166	85.4 Å²	85.4	65%	0.651	45%	0.45	S	S	*	.	H	α-helix	trans	-76.4	-41.6	171.3	-176.5	-105	0	0	0	113.2	V285 S286 H287 K292 K293	V285-Y289 WeakPolarHBondContact O-CB 3.29Å; V285-Y289 PolarHBondContact O-N 3.49Å; S286-Y289 PolarHBondContact O-N 3.15Å; H287-Y289 PolarHBondContact O-N 3.2Å; H287-Y289 VanDerWaalsContact O-N 3.14Å; Y289-K292 PolarHBondContact O-N 3.45Å; Y289-K293 WeakPolarHBondContact O-CB 3.05Å; Y289-K293 PolarHBondContact O-N 2.76Å
290	K	75.5	Confident	72.8	Confident	76 Å²	76	83.5 Å²	83.5	33%	0.33	45%	0.445	S	S	.	.	H	α-helix	trans	-62.2	-50.7	172.5	-81.6	-178.4	169.5	-178.7	0	111.1	C268 E270 S286 H287 K292 K293 L294	C268-K290 HydrophobicContact CB-CD 3.65Å; C268-K290 PolarHBondContact O-NZ 2.87Å; E270-K290 IonicContact OE1-NZ 3.04Å; E270-K290 PolarHBondContact OE1-NZ 3.23Å; S286-K290 PolarHBondContact O-N 3.36Å; H287-K290 CarbonylContact O-C 3.47Å; H287-K290 WeakPolarHBondContact O-CA 3.48Å; H287-K290 PolarHBondContact O-N 3.27Å; K290-K292 PolarHBondContact O-N 2.94Å; K290-K293 CarbonylContact O-C 3.5Å; K290-K293 WeakPolarHBondContact O-CA 3.39Å; K290-K293 WeakPolarHBondContact O-CB 3.48Å; K290-K293 PolarHBondContact O-N 2.94Å; K290-L294 WeakPolarHBondContact O-CG 3.45Å; K290-L294 PolarHBondContact O-N 3.39Å
291	L	77.3	Confident	71.2	Confident	46 Å²	46	80.6 Å²	80.6	24%	0.241	43%	0.432	C	S	.	.	H	α-helix	trans	-54.8	-48.7	173.2	179	64.3	0	0	0	111	L267 H287 K293 L294 L295	L267-L291 HydrophobicContact CD1-CD1 4.28Å; L267-L291 HydrophobicContact CD2-CD1 4.27Å; H287-L291 VanDerWaalsContact O-CB 3.28Å; H287-L291 WeakPolarHBondContact O-CB 3.38Å; H287-L291 PolarHBondContact O-N 3.43Å; L291-K293 VanDerWaalsContact C-N 3.34Å; L291-K293 PolarHBondContact O-N 2.82Å; L291-L294 PolarHBondContact O-N 2.96Å; L291-L295 HydrophobicContact CD1-CD1 4.04Å; L291-L295 HydrophobicContact CD1-CG 4.16Å; L291-L295 HydrophobicContact CG-CD1 3.95Å; L291-L295 HydrophobicContact CG-CG 4.44Å; L291-L295 WeakPolarHBondContact O-CB 3.35Å; L291-L295 WeakPolarHBondContact O-CG 3.44Å; L291-L295 PolarHBondContact O-N 2.76Å
292	K	73.6	Confident	69.4	Low	140 Å²	140	82.5 Å²	82.5	61%	0.609	44%	0.442	S	S	*	.	H	α-helix	trans	-63	-38.7	174.3	-178.5	166.3	-179.8	169.9	0	112.2	L288 Y289 K290 L294 V296	L288-K292 WeakPolarHBondContact O-CB 3.33Å; L288-K292 PolarHBondContact O-N 2.99Å; Y289-K292 PolarHBondContact O-N 3.45Å; K290-K292 PolarHBondContact O-N 2.94Å; K292-L294 VanDerWaalsContact C-N 3.34Å; K292-V296 HydrophobicContact CG-CG2 4.05Å; K292-V296 VanDerWaalsContact O-CB 3.23Å; K292-V296 WeakPolarHBondContact O-CB 3.34Å; K292-V296 WeakPolarHBondContact O-CG2 3.47Å; K292-V296 PolarHBondContact O-N 2.81Å
293	K	74.1	Confident	67.1	Low	147 Å²	147	81.6 Å²	81.6	64%	0.639	44%	0.444	S	S	*	.	H	α-helix	trans	-65.1	-38.6	176	-168	-173.9	177	-167.3	0	111.2	Y289 K290 L291 A297	Y289-K293 WeakPolarHBondContact O-CB 3.05Å; Y289-K293 PolarHBondContact O-N 2.76Å; K290-K293 CarbonylContact O-C 3.5Å; K290-K293 WeakPolarHBondContact O-CA 3.39Å; K290-K293 WeakPolarHBondContact O-CB 3.48Å; K290-K293 PolarHBondContact O-N 2.94Å; L291-K293 VanDerWaalsContact C-N 3.34Å; L291-K293 PolarHBondContact O-N 2.82Å; K293-A297 WeakPolarHBondContact O-CB 3.36Å; K293-A297 PolarHBondContact O-N 2.81Å
294	L	68.1	Low	65.8	Low	95 Å²	95	77.6 Å²	77.6	50%	0.497	42%	0.424	S	S	.	.	H	α-helix	trans	-72.8	-40.4	177.2	-71.8	172.3	0	0	0	112.6	L267 K290 L291 K292 A297 K298	L267-L294 WeakPolarHBondContact O-CD1 3.33Å; K290-L294 WeakPolarHBondContact O-CG 3.45Å; K290-L294 PolarHBondContact O-N 3.39Å; L291-L294 PolarHBondContact O-N 2.96Å; K292-L294 VanDerWaalsContact C-N 3.34Å; L294-A297 PolarHBondContact O-N 3.35Å; L294-K298 WeakPolarHBondContact O-CB 3.37Å; L294-K298 PolarHBondContact O-N 3.49Å
295	L	70.4	Confident	64.4	Low	105 Å²	105	81.1 Å²	81.1	55%	0.55	44%	0.438	S	S	.	.	H	α-helix	trans	-65.8	-40.1	172.7	-71.7	172.8	0	0	0	111.3	L291 A299	L291-L295 HydrophobicContact CD1-CD1 4.04Å; L291-L295 HydrophobicContact CD1-CG 4.16Å; L291-L295 HydrophobicContact CG-CD1 3.95Å; L291-L295 HydrophobicContact CG-CG 4.44Å; L291-L295 WeakPolarHBondContact O-CB 3.35Å; L291-L295 WeakPolarHBondContact O-CG 3.44Å; L291-L295 PolarHBondContact O-N 2.76Å; L295-A299 WeakPolarHBondContact O-CB 3.24Å; L295-A299 PolarHBondContact O-N 3.49Å
296	V	67.7	Low	63.1	Low	78 Å²	78	78.9 Å²	78.9	47%	0.473	42%	0.422	S	S	.	.	H	α-helix	trans	-68.2	-38.9	173.2	169.2	0	0	0	0	111.2	K292 S300	K292-V296 HydrophobicContact CG-CG2 4.05Å; K292-V296 VanDerWaalsContact O-CB 3.23Å; K292-V296 WeakPolarHBondContact O-CB 3.34Å; K292-V296 WeakPolarHBondContact O-CG2 3.47Å; K292-V296 PolarHBondContact O-N 2.81Å; V296-S300 WeakPolarHBondContact O-CA 3.41Å; V296-S300 WeakPolarHBondContact O-CB 3.31Å; V296-S300 PolarHBondContact O-N 3.21Å; V296-S300 PolarHBondContact O-OG 3.38Å; V296-S300 VanDerWaalsContact O-OG 3.07Å
297	A	64.5	Low	61.6	Low	49 Å²	49	77.6 Å²	77.6	41%	0.405	41%	0.408	S	S	.	.	H	α-helix	trans	-70.3	-36.4	176.8	0	0	0	0	0	112.6	K293 L294 S300 A301	K293-A297 WeakPolarHBondContact O-CB 3.36Å; K293-A297 PolarHBondContact O-N 2.81Å; L294-A297 PolarHBondContact O-N 3.35Å; A297-S300 WeakPolarHBondContact CA-OG 3.12Å; A297-S300 PolarHBondContact O-OG 2.94Å; A297-S300 VanDerWaalsContact O-OG 3.09Å; A297-A301 WeakPolarHBondContact O-CB 3.32Å; A297-A301 PolarHBondContact O-N 3.21Å
298	K	63.1	Low	59.8	Low	121 Å²	121	79.8 Å²	79.8	53%	0.526	42%	0.42	S	S	.	.	H	α-helix	trans	-73.3	-41.6	175.3	-169	170	-176.4	175.9	0	110.9	L294 A301 M302	L294-K298 WeakPolarHBondContact O-CB 3.37Å; L294-K298 PolarHBondContact O-N 3.49Å; K298-A301 PolarHBondContact O-N 3.49Å; K298-M302 HydrophobicContact CG-SD 4.35Å; K298-M302 WeakPolarHBondContact O-CB 3.5Å; K298-M302 VanDerWaalsContact O-CG 3.27Å; K298-M302 WeakPolarHBondContact O-CG 3.24Å; K298-M302 PolarHBondContact O-N 2.86Å
299	A	58.9	Low	58.4	Low	60 Å²	60	81 Å²	81	50%	0.496	42%	0.424	S	S	.	.	H	α-helix	trans	-67	-37.6	172.5	0	0	0	0	0	112.1	L295 C303	L295-A299 WeakPolarHBondContact O-CB 3.24Å; L295-A299 PolarHBondContact O-N 3.49Å; A299-C303 WeakPolarHBondContact O-CB 3.3Å; A299-C303 PolarHBondContact O-N 3.28Å
300	S	53.4	Low	56.7	Low	59 Å²	59	76 Å²	76	41%	0.413	42%	0.416	S	S	.	.	H	α-helix	trans	-70.5	-38.9	174.4	70.3	0	0	0	0	111.1	V296 A297 C303 S304	V296-S300 WeakPolarHBondContact O-CA 3.41Å; V296-S300 WeakPolarHBondContact O-CB 3.31Å; V296-S300 PolarHBondContact O-N 3.21Å; V296-S300 PolarHBondContact O-OG 3.38Å; V296-S300 VanDerWaalsContact O-OG 3.07Å; A297-S300 WeakPolarHBondContact CA-OG 3.12Å; A297-S300 PolarHBondContact O-OG 2.94Å; A297-S300 VanDerWaalsContact O-OG 3.09Å; S300-C303 PolarHBondContact O-N 3.31Å; S300-S304 WeakPolarHBondContact O-CB 3.37Å; S300-S304 PolarHBondContact O-N 2.89Å; S300-S304 PolarHBondContact O-OG 3.19Å
301	A	50.9	Low	55.2	Low	45 Å²	45	75.9 Å²	75.9	37%	0.372	42%	0.422	S	S	.	.	H	α-helix	trans	-63.2	-45.9	173.4	0	0	0	0	0	111.5	A297 K298 S304 Q305	A297-A301 WeakPolarHBondContact O-CB 3.32Å; A297-A301 PolarHBondContact O-N 3.21Å; K298-A301 PolarHBondContact O-N 3.49Å; A301-S304 WeakPolarHBondContact O-CB 3.31Å; A301-S304 PolarHBondContact O-N 3.37Å; A301-Q305 WeakPolarHBondContact O-CB 3.31Å; A301-Q305 VanDerWaalsContact O-CG 3.31Å; A301-Q305 WeakPolarHBondContact O-CG 3.49Å; A301-Q305 PolarHBondContact O-N 3.36Å
302	M	48.8	Very low	53.4	Low	52 Å²	52	79 Å²	79	26%	0.256	44%	0.438	S	S	.	.	H	α-helix	trans	-65.1	-39.7	175	-70.6	178.3	75.4	0	0	112.1	K298 N306 L1843	K298-M302 HydrophobicContact CG-SD 4.35Å; K298-M302 WeakPolarHBondContact O-CB 3.5Å; K298-M302 VanDerWaalsContact O-CG 3.27Å; K298-M302 WeakPolarHBondContact O-CG 3.24Å; K298-M302 PolarHBondContact O-N 2.86Å; M302-N306 WeakPolarHBondContact O-CB 3.47Å; M302-N306 PolarHBondContact O-N 3.13Å; M302-N306 PolarHBondContact O-OD1 3.3Å; M302-L1843 HydrophobicContact CE-CD2 4.24Å
303	C	36.7	Very low	51.8	Low	60 Å²	60	74 Å²	74	41%	0.405	42%	0.423	S	S	.	.	H	α-helix	trans	-64.9	-40.4	174	-168.3	0	0	0	0	111.5	A299 S300 N306 I307	A299-C303 WeakPolarHBondContact O-CB 3.3Å; A299-C303 PolarHBondContact O-N 3.28Å; S300-C303 PolarHBondContact O-N 3.31Å; C303-N306 PolarHBondContact O-N 3.47Å; C303-I307 WeakPolarHBondContact O-CB 3.27Å; C303-I307 VanDerWaalsContact O-CG1 3.27Å; C303-I307 WeakPolarHBondContact O-CG1 3.46Å; C303-I307 PolarHBondContact O-N 3.04Å
304	S	45	Very low	50.2	Low	18 Å²	18	69.4 Å²	69.4	13%	0.126	41%	0.413	C	S	.	.	H	α-helix	trans	-65.4	-47.2	177.5	-64.4	0	0	0	0	111.8	S300 A301 I307 N308 S1264 S1265	S300-S304 WeakPolarHBondContact O-CB 3.37Å; S300-S304 PolarHBondContact O-N 2.89Å; S300-S304 PolarHBondContact O-OG 3.19Å; A301-S304 WeakPolarHBondContact O-CB 3.31Å; A301-S304 PolarHBondContact O-N 3.37Å; S304-I307 PolarHBondContact O-N 3.07Å; S304-N308 VanDerWaalsContact O-CG 3.32Å; S304-N308 PolarHBondContact O-N 3.11Å; S304-N308 PolarHBondContact O-OD1 3.24Å; S304-S1264 CarbonylContact C-O 3.19Å; S304-S1264 VanDerWaalsContact CB-O 3.3Å; S304-S1264 WeakPolarHBondContact CB-O 3.33Å; S304-S1265 WeakPolarHBondContact OG-CA 3.33Å
305	Q	46.9	Very low	48.7	Very low	105 Å²	105	70.9 Å²	70.9	49%	0.491	42%	0.421	S	S	.	.	H	α-helix	trans	-63.1	-46.4	173.4	-73.1	175.3	-52.7	0	0	111.1	A301 I307 N308 Q309	A301-Q305 WeakPolarHBondContact O-CB 3.31Å; A301-Q305 VanDerWaalsContact O-CG 3.31Å; A301-Q305 WeakPolarHBondContact O-CG 3.49Å; A301-Q305 PolarHBondContact O-N 3.36Å; Q305-I307 VanDerWaalsContact C-N 3.31Å; Q305-I307 PolarHBondContact O-N 3.19Å; Q305-N308 PolarHBondContact O-N 3.25Å; Q305-Q309 WeakPolarHBondContact O-CB 3.38Å; Q305-Q309 PolarHBondContact O-N 2.9Å
306	N	42	Very low	47.1	Very low	79 Å²	79	70.4 Å²	70.4	42%	0.422	43%	0.426	S	S	.	.	H	α-helix	trans	-63.1	-34.6	178	-72.7	4.7	0	0	0	112.3	M302 C303 A310	M302-N306 WeakPolarHBondContact O-CB 3.47Å; M302-N306 PolarHBondContact O-N 3.13Å; M302-N306 PolarHBondContact O-OD1 3.3Å; C303-N306 PolarHBondContact O-N 3.47Å; N306-A310 WeakPolarHBondContact O-CB 3.23Å; N306-A310 PolarHBondContact O-N 3.46Å
307	I	40.9	Very low	45.7	Very low	51 Å²	51	75.4 Å²	75.4	26%	0.262	44%	0.436	S	S	.	.	H	α-helix	trans	-77	-44.6	177.6	-70.1	167.9	0	0	0	110.9	C303 S304 Q305 Q309 A310 T311 A1266	C303-I307 WeakPolarHBondContact O-CB 3.27Å; C303-I307 VanDerWaalsContact O-CG1 3.27Å; C303-I307 WeakPolarHBondContact O-CG1 3.46Å; C303-I307 PolarHBondContact O-N 3.04Å; S304-I307 PolarHBondContact O-N 3.07Å; Q305-I307 VanDerWaalsContact C-N 3.31Å; Q305-I307 PolarHBondContact O-N 3.19Å; I307-Q309 PolarHBondContact O-N 2.98Å; I307-A310 PolarHBondContact O-N 3.36Å; I307-T311 WeakPolarHBondContact O-CB 3.46Å; I307-T311 PolarHBondContact O-N 2.87Å; I307-T311 PolarHBondContact O-OG1 3.22Å; I307-T311 VanDerWaalsContact O-OG1 3.09Å; I307-A1266 HydrophobicContact CB-CB 4.34Å; I307-A1266 HydrophobicContact CD1-CB 3.89Å; I307-A1266 HydrophobicContact CG2-CB 3.67Å
308	N	42.2	Very low	44	Very low	50 Å²	50	83.3 Å²	83.3	27%	0.267	46%	0.457	S	S	.	.	H	α-helix	trans	-56.7	-41.4	171.8	-68.3	9.4	0	0	0	111	S304 Q305 L312 S1264 S1265	S304-N308 VanDerWaalsContact O-CG 3.32Å; S304-N308 PolarHBondContact O-N 3.11Å; S304-N308 PolarHBondContact O-OD1 3.24Å; Q305-N308 PolarHBondContact O-N 3.25Å; N308-L312 VanDerWaalsContact O-CB 3.31Å; N308-L312 WeakPolarHBondContact O-CB 3.41Å; N308-L312 WeakPolarHBondContact O-CD1 3.46Å; N308-L312 VanDerWaalsContact O-CG 3.26Å; N308-L312 WeakPolarHBondContact O-CG 3.44Å; N308-L312 PolarHBondContact O-N 3.24Å; N308-S1264 PolarHBondContact ND2-O 3.5Å; N308-S1264 PolarHBondContact OD1-O 3.47Å; N308-S1265 PolarHBondContact OD1-N 2.89Å
309	Q	50	Low	42.6	Very low	100 Å²	100	86.1 Å²	86.1	47%	0.467	47%	0.472	S	S	.	.	H	α-helix	trans	-71.4	-36.4	178.5	-170.8	168.8	78	0	0	112.7	Q305 I307 A313	Q305-Q309 WeakPolarHBondContact O-CB 3.38Å; Q305-Q309 PolarHBondContact O-N 2.9Å; I307-Q309 PolarHBondContact O-N 2.98Å; Q309-A313 WeakPolarHBondContact O-CB 3.23Å; Q309-A313 PolarHBondContact O-N 2.86Å
310	A	41.6	Very low	41.2	Very low	59 Å²	59	87.5 Å²	87.5	49%	0.488	48%	0.476	S	S	.	.	H	α-helix	trans	-72.5	-39.6	175	0	0	0	0	0	112.5	N306 I307 A313 A314	N306-A310 WeakPolarHBondContact O-CB 3.23Å; N306-A310 PolarHBondContact O-N 3.46Å; I307-A310 PolarHBondContact O-N 3.36Å; A310-A313 CarbonylContact O-C 3.31Å; A310-A313 PolarHBondContact O-N 3.08Å; A310-A314 WeakPolarHBondContact O-CB 3.37Å; A310-A314 PolarHBondContact O-N 2.95Å
311	T	43.3	Very low	40	Very low	75 Å²	75	92.2 Å²	92.2	46%	0.46	50%	0.496	S	S	.	.	H	α-helix	trans	-66.9	-42.9	174.6	-59.5	0	0	0	0	110.9	I307 A314 L315	I307-T311 WeakPolarHBondContact O-CB 3.46Å; I307-T311 PolarHBondContact O-N 2.87Å; I307-T311 PolarHBondContact O-OG1 3.22Å; I307-T311 VanDerWaalsContact O-OG1 3.09Å; T311-A314 PolarHBondContact O-N 3.43Å; T311-L315 HydrophobicContact CG2-CD1 4.01Å; T311-L315 WeakPolarHBondContact O-CB 3.37Å; T311-L315 VanDerWaalsContact O-CG 3.32Å; T311-L315 WeakPolarHBondContact O-CG 3.17Å; T311-L315 PolarHBondContact O-N 2.91Å
312	L	39.7	Very low	39.1	Very low	110 Å²	110	94.8 Å²	94.8	58%	0.576	52%	0.517	S	S	*	.	H	α-helix	trans	-62.7	-42.4	171.9	-75	168.3	0	0	0	111.8	N308 A314 L315 S316	N308-L312 VanDerWaalsContact O-CB 3.31Å; N308-L312 WeakPolarHBondContact O-CB 3.41Å; N308-L312 WeakPolarHBondContact O-CD1 3.46Å; N308-L312 VanDerWaalsContact O-CG 3.26Å; N308-L312 WeakPolarHBondContact O-CG 3.44Å; N308-L312 PolarHBondContact O-N 3.24Å; L312-A314 VanDerWaalsContact C-N 3.27Å; L312-A314 PolarHBondContact O-N 3.14Å; L312-L315 PolarHBondContact O-N 2.89Å; L312-S316 WeakPolarHBondContact O-CB 3.07Å; L312-S316 PolarHBondContact O-N 3.03Å; L312-S316 PolarHBondContact O-OG 3.49Å
313	A	40.5	Very low	38	Very low	35 Å²	35	100.6 Å²	100.6	29%	0.289	55%	0.549	S	S	.	.	H	α-helix	trans	-70.8	-16.7	175.3	0	0	0	0	0	114	Q309 A310 R317	Q309-A313 WeakPolarHBondContact O-CB 3.23Å; Q309-A313 PolarHBondContact O-N 2.86Å; A310-A313 CarbonylContact O-C 3.31Å; A310-A313 PolarHBondContact O-N 3.08Å; A313-R317 PolarHBondContact O-NE 2.9Å; A313-R317 PolarHBondContact O-NH2 2.77Å
314	A	39.4	Very low	37.6	Very low	52 Å²	52	106.5 Å²	106.5	43%	0.43	58%	0.575	S	S	.	*	H	α-helix	trans	-82.9	-42.9	171.3	0	0	0	0	0	110.7	A310 T311 L312 S316 R317	A310-A314 WeakPolarHBondContact O-CB 3.37Å; A310-A314 PolarHBondContact O-N 2.95Å; T311-A314 PolarHBondContact O-N 3.43Å; L312-A314 VanDerWaalsContact C-N 3.27Å; L312-A314 PolarHBondContact O-N 3.14Å; A314-S316 VanDerWaalsContact C-N 3.33Å; A314-S316 PolarHBondContact O-N 3.21Å; A314-R317 PolarHBondContact O-N 2.96Å
315	L	36.4	Very low	36.9	Very low	126 Å²	126	110.7 Å²	110.7	66%	0.66	61%	0.605	S	S	*	*	H	α-helix	trans	-68.7	-29.9	176.5	-67.3	168.9	0	0	0	112.4	T311 L312 R317	T311-L315 HydrophobicContact CG2-CD1 4.01Å; T311-L315 WeakPolarHBondContact O-CB 3.37Å; T311-L315 VanDerWaalsContact O-CG 3.32Å; T311-L315 WeakPolarHBondContact O-CG 3.17Å; T311-L315 PolarHBondContact O-N 2.91Å; L312-L315 PolarHBondContact O-N 2.89Å; L315-R317 PolarHBondContact O-N 2.97Å
316	S	38.2	Very low	36.4	Very low	95 Å²	95	110.5 Å²	110.5	66%	0.664	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.2	11.5	175.1	80.2	0	0	0	0	114.8	L312 A314	L312-S316 WeakPolarHBondContact O-CB 3.07Å; L312-S316 PolarHBondContact O-N 3.03Å; L312-S316 PolarHBondContact O-OG 3.49Å; A314-S316 VanDerWaalsContact C-N 3.33Å; A314-S316 PolarHBondContact O-N 3.21Å
317	R	36.6	Very low	35.9	Very low	183 Å²	183	112.1 Å²	112.1	69%	0.691	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.7	5.2	-179.6	-91.7	-179.6	-75.6	-163.9	-2.1	115.1	A313 A314 L315	A313-R317 PolarHBondContact O-NE 2.9Å; A313-R317 PolarHBondContact O-NH2 2.77Å; A314-R317 PolarHBondContact O-N 2.96Å; L315-R317 PolarHBondContact O-N 2.97Å
318	Y	30.4	Very low	35.7	Very low	215 Å²	215	115.1 Å²	115.1	84%	0.843	66%	0.655	S	S	*	*			trans	-110.3	96.1	167.9	-81.2	-86.8	0	0	0	110.3
319	H	32.9	Very low	35.4	Very low	180 Å²	180	117.1 Å²	117.1	83%	0.833	68%	0.678	S	S	*	*			trans	-90.3	126.8	178.1	-158.5	-69.7	0	0	0	109.9
320	P	29.4	Very low	34.4	Very low	89 Å²	89	121.6 Å²	121.6	58%	0.578	70%	0.697	S	S	*	*			trans	-75.5	168.2	172	31.9	-34.4	0	0	0	111.7
321	N	28.6	Very low	33.9	Very low	158 Å²	158	124.7 Å²	124.7	85%	0.845	70%	0.704	S	S	*	*			trans	72.7	79.4	169.3	-47.5	-32.9	0	0	0	117.1
322	A	31.2	Very low	33.1	Very low	98 Å²	98	128.5 Å²	128.5	81%	0.81	72%	0.722	S	S	*	*			trans	-157.6	39.1	164.7	0	0	0	0	0	116
323	L	26.9	Very low	32.7	Very low	175 Å²	175	126.6 Å²	126.6	92%	0.916	73%	0.729	S	S	*	*			trans	-142.4	112	163.6	-80.1	-176.7	0	0	0	111.5
324	L	27.8	Very low	32.3	Very low	184 Å²	184	132.9 Å²	132.9	96%	0.963	76%	0.757	S	S	*	*			trans	-141.7	95	171.5	-93.9	170.3	0	0	0	109
325	S	30.9	Very low	31.7	Very low	106 Å²	106	137.6 Å²	137.6	74%	0.741	77%	0.774	S	S	*	*			trans	-165.3	141.2	164	-175.5	0	0	0	0	111.2
326	S	35.7	Very low	31.2	Very low	101 Å²	101	136.5 Å²	136.5	71%	0.706	78%	0.777	S	S	*	*			trans	48.4	80.7	153.1	54.5	0	0	0	0	120
327	S	31.4	Very low	30.8	Very low	112 Å²	112	136.8 Å²	136.8	78%	0.783	78%	0.779	S	S	*	*				39.6	158.5	101.7	-133.4	0	0	0	0	121
328	P	37.5	Very low	30.7	Very low	115 Å²	115	135.1 Å²	135.1	75%	0.747	78%	0.782	S	S	*	*				-140.1	166.3	-64.5	42	-26.9	0	0	0	114.3
329	A	34.4	Very low	30.6	Very low	91 Å²	91	128.9 Å²	128.9	75%	0.752	77%	0.77	S	S	*	*			trans	-174.2	145.6	150.2	0	0	0	0	0	113.6
330	F	30.3	Very low	30.5	Very low	194 Å²	194	128.1 Å²	128.1	85%	0.851	77%	0.772	S	S	*	*			trans	15	146.7	152.8	-73.3	-104.7	0	0	0	121.2
331	L	30.5	Very low	30.5	Very low	125 Å²	125	127.2 Å²	127.2	65%	0.654	78%	0.779	S	S	*	*			cis	159.9	143	-22	-106.4	168.2	0	0	0	105.6
332	D	26.2	Very low	30.5	Very low	154 Å²	154	126 Å²	126	82%	0.824	78%	0.777	S	S	*	*			trans	33.2	132.7	156.6	-56.9	-19.5	0	0	0	123.2
333	G	31.5	Very low	30.6	Very low	70 Å²	70	128.9 Å²	128.9	72%	0.722	78%	0.778	S	S	*	*			trans	171.7	95.3	160.3	0	0	0	0	0	116.5
334	L	32.7	Very low	31.1	Very low	168 Å²	168	125.4 Å²	125.4	88%	0.88	77%	0.765	S	S	*	*			trans	44.5	112.1	146.1	-52.9	172.6	0	0	0	118.1
335	L	25.6	Very low	31	Very low	151 Å²	151	123.2 Å²	123.2	79%	0.791	75%	0.748	S	S	*	*			cis	65.8	120.4	45	-147.2	167	0	0	0	113.1
336	S	26.6	Very low	31.2	Very low	103 Å²	103	123.5 Å²	123.5	72%	0.72	75%	0.749	S	S	*	*			trans	77.2	156.1	-177.1	-20.3	0	0	0	0	114.4
337	S	29.9	Very low	31.1	Very low	100 Å²	100	124 Å²	124	70%	0.699	75%	0.75	S	S	*	*			cis	-163.8	167.4	3.2	-140.7	0	0	0	0	112.1
338	I	33.5	Very low	30.8	Very low	148 Å²	148	124.8 Å²	124.8	76%	0.759	75%	0.751	S	S	*	*			trans	65.4	126.9	160.8	-56.8	153.4	0	0	0	116.3
339	S	28.9	Very low	30.4	Very low	85 Å²	85	124.5 Å²	124.5	59%	0.594	75%	0.751	S	S	*	*			cis	102	118.3	10.7	93.7	0	0	0	0	118.6
340	N	30.5	Very low	30	Very low	163 Å²	163	124.1 Å²	124.1	87%	0.872	75%	0.748	S	S	*	*			trans	72.2	149.2	155.8	-53.1	-39.5	0	0	0	121.4
341	G	29.5	Very low	30.1	Very low	70 Å²	70	120.2 Å²	120.2	72%	0.722	75%	0.745	S	S	*	*			trans	116.1	92.3	173.3	0	0	0	0	0	114.3
342	V	29.6	Very low	29.9	Very low	133 Å²	133	122.6 Å²	122.6	81%	0.806	75%	0.753	S	S	*	*				78.3	106.2	72.8	177.4	0	0	0	0	115
343	L	32.7	Very low	29.8	Very low	159 Å²	159	121.1 Å²	121.1	83%	0.832	74%	0.744	S	S	*	*			trans	30.2	170.3	135.9	-52	178.7	0	0	0	122
344	P	37	Very low	29.6	Very low	101 Å²	101	125.1 Å²	125.1	66%	0.656	75%	0.749	S	S	*	*			cis	-135.2	-160.4	-25.1	21.7	5.6	0	0	0	113.8
345	F	26.4	Very low	30.1	Very low	138 Å²	138	121.8 Å²	121.8	61%	0.605	75%	0.745	S	S	*	*			trans	84.9	157.8	158.5	-75.5	-76.6	0	0	0	122.5	Y731 L733	F345-Y731 HydrophobicContact CE1-CD1 4.09Å; F345-Y731 HydrophobicContact CE1-CE1 4.19Å; F345-L733 HydrophobicContact CE2-CD1 3.85Å; F345-L733 HydrophobicContact CZ-CD1 3.9Å
346	C	34.5	Very low	30.5	Very low	113 Å²	113	119.9 Å²	119.9	76%	0.764	74%	0.742	S	S	*	*			trans	-118.1	162.1	178.4	-53.7	0	0	0	0	111.4
347	P	33.5	Very low	30.4	Very low	112 Å²	112	126.1 Å²	126.1	73%	0.727	75%	0.749	S	S	*	*				-117.8	155.8	117.7	-6	26.9	0	0	0	111.7
348	T	26.6	Very low	30.2	Very low	128 Å²	128	129.3 Å²	129.3	79%	0.785	76%	0.758	S	S	*	*				57	118.9	67.7	-19.9	0	0	0	0	111.1
349	S	27.6	Very low	30	Very low	108 Å²	108	124.7 Å²	124.7	76%	0.755	75%	0.747	S	S	*	*				-164.3	179.4	52.7	-54	0	0	0	0	113.6
350	A	27.2	Very low	30.1	Very low	84 Å²	84	127.8 Å²	127.8	69%	0.694	76%	0.757	S	S	*	*			trans	-12.5	131.5	166.8	0	0	0	0	0	118.1
351	S	31	Very low	30	Very low	111 Å²	111	125.1 Å²	125.1	78%	0.776	74%	0.741	S	S	*	*				56.4	95.5	64.7	-61.9	0	0	0	0	114.8
352	Q	26.7	Very low	30	Very low	176 Å²	176	125.4 Å²	125.4	82%	0.822	73%	0.732	S	S	*	*				-171.7	141.3	130	-105.7	164.4	78.5	0	0	114.3
353	N	25.3	Very low	29.9	Very low	122 Å²	122	124.4 Å²	124.4	65%	0.652	72%	0.722	S	S	*	*			trans	53.7	118.8	144.8	-65.7	-31.8	0	0	0	123.3
354	L	25.4	Very low	29.7	Very low	155 Å²	155	124 Å²	124	81%	0.812	72%	0.72	S	S	*	*				68.4	108.5	127.4	-61.3	169.9	0	0	0	119.9
355	A	44.4	Very low	29.4	Very low	97 Å²	97	123.8 Å²	123.8	80%	0.802	72%	0.721	S	S	*	*			trans	-70.2	156.3	150.3	0	0	0	0	0	111.6
356	P	33.2	Very low	29.4	Very low	111 Å²	111	124 Å²	124	72%	0.721	73%	0.733	S	S	*	*			trans	-139.2	147.7	150.8	36.5	-21.8	0	0	0	115.7
357	R	25.7	Very low	29.1	Very low	234 Å²	234	122.7 Å²	122.7	88%	0.883	73%	0.73	S	S	*	*			trans	50.6	122.9	137.6	-62.3	-73.7	177.3	164.6	-2	121.1
358	L	25.8	Very low	28.7	Very low	167 Å²	167	124.9 Å²	124.9	87%	0.874	74%	0.736	S	S	*	*				165.2	140.6	122.6	-85.4	156.2	0	0	0	107.1
359	G	28.8	Very low	28.7	Very low	52 Å²	52	124.6 Å²	124.6	54%	0.536	73%	0.734	S	S	.	*			cis	109.3	125.5	9.3	0	0	0	0	0	110.3
360	D	30	Very low	28.7	Very low	150 Å²	150	128.2 Å²	128.2	80%	0.802	74%	0.739	S	S	*	*			cis	-141.3	-165.3	-3.4	-67.4	-71	0	0	0	108.9
361	I	29	Very low	28.8	Very low	106 Å²	106	129.6 Å²	129.6	54%	0.544	74%	0.741	S	S	.	*				-153.8	124.3	57.9	-73.9	170	0	0	0	110.4
362	S	30.2	Very low	28.5	Very low	76 Å²	76	136.6 Å²	136.6	53%	0.531	75%	0.75	S	S	.	*			trans	34.7	140.1	142.2	-49	0	0	0	0	121	C447	S362-C447 WeakPolarHBondContact O-CB 3.44Å; S362-C447 PolarHBondContact O-N 2.91Å
363	L	27.9	Very low	28.5	Very low	112 Å²	112	131.7 Å²	131.7	59%	0.586	75%	0.746	S	S	*	*			cis	-130.6	-176.3	26.6	-68.5	158.7	0	0	0	111.3	A445 V446	L363-A445 HydrophobicContact CD1-CB 3.99Å; L363-V446 HydrophobicContact CD1-CB 4.46Å; L363-V446 HydrophobicContact CD1-CG1 4.34Å
364	L	28.4	Very low	28.7	Very low	151 Å²	151	132.5 Å²	132.5	79%	0.791	75%	0.751	S	S	*	*			cis	-145.4	-121.6	4.9	-148.2	174.4	0	0	0	110.6
365	S	29.2	Very low	29.1	Very low	97 Å²	97	128 Å²	128	68%	0.678	74%	0.742	S	S	*	*			trans	-156.8	159	178.6	-156.9	0	0	0	0	105.4
366	V	27.7	Very low	28.9	Very low	141 Å²	141	128.2 Å²	128.2	86%	0.855	74%	0.735	S	S	*	*				-144.1	165.9	51.1	170.1	0	0	0	0	111.1
367	A	27.5	Very low	29.5	Very low	86 Å²	86	129.1 Å²	129.1	71%	0.711	73%	0.728	S	S	*	*			trans	-86.7	173.8	-169.1	0	0	0	0	0	116.5
368	D	25.8	Very low	31	Very low	158 Å²	158	128 Å²	128	85%	0.845	72%	0.724	S	S	*	*			trans	87.5	167	148.9	-125.2	-43.9	0	0	0	120.6
369	V	26.9	Very low	32.4	Very low	122 Å²	122	123.4 Å²	123.4	74%	0.739	70%	0.697	S	S	*	*			trans	75.5	75	173.3	-159.4	0	0	0	0	118.7
370	Q	26.7	Very low	34.3	Very low	185 Å²	185	127.8 Å²	127.8	86%	0.864	70%	0.697	S	S	*	*			trans	63.6	150.2	135.9	-67.5	-138.4	0	0	0	123.3
371	P	28.4	Very low	36.6	Very low	113 Å²	113	120.8 Å²	120.8	73%	0.734	66%	0.66	S	S	*	*			trans	-98.7	138.6	-177.9	37.4	-32.7	0	0	0	114.7
372	R	25.3	Very low	38.2	Very low	258 Å²	258	122.4 Å²	122.4	97%	0.974	67%	0.669	S	S	*	*			trans	-126.9	128.5	154.4	-69.2	-169.7	176.9	-158.4	0.1	109.4
373	G	27.1	Very low	39.9	Very low	72 Å²	72	121.6 Å²	121.6	74%	0.742	66%	0.659	S	S	*	*			trans	-104.8	153.1	-155	0	0	0	0	0	116.6
374	N	30.2	Very low	42.1	Very low	139 Å²	139	117.2 Å²	117.2	74%	0.743	64%	0.637	S	S	*	*			trans	-157.9	106.5	154.9	-110.4	-70.2	0	0	0	110.5
375	G	33.4	Very low	44	Very low	61 Å²	61	115.2 Å²	115.2	63%	0.629	62%	0.624	S	S	*	*			trans	-66.3	141.5	177.1	0	0	0	0	0	112.5	K377	G375-K377 PolarHBondContact O-N 2.91Å
376	P	40.5	Very low	46.1	Very low	101 Å²	101	113.8 Å²	113.8	66%	0.656	61%	0.611	S	S	*	*			trans	-68.3	120.5	-166.4	24.8	-34.1	0	0	0	113.2	R378	P376-R378 VanDerWaalsContact C-N 3.29Å; P376-R378 VanDerWaalsContact O-CG 3.32Å; P376-R378 WeakPolarHBondContact O-CG 3.15Å; P376-R378 PolarHBondContact O-N 3.4Å
377	K	44.5	Very low	48	Very low	130 Å²	130	109.1 Å²	109.1	57%	0.565	58%	0.584	S	S	*	*			trans	-73.3	75.1	177.5	-63.8	152	172.2	166.7	0	110.8	G375 F379	G375-K377 PolarHBondContact O-N 2.91Å; K377-F379 PolarHBondContact O-N 2.88Å
378	R	57.8	Low	50.2	Low	211 Å²	211	107.7 Å²	107.7	80%	0.796	56%	0.561	S	S	*	*			trans	-55.9	-13.7	-163.7	-56.7	-166.2	-172.3	-119.2	4.2	117.9	P376	P376-R378 VanDerWaalsContact C-N 3.29Å; P376-R378 VanDerWaalsContact O-CG 3.32Å; P376-R378 WeakPolarHBondContact O-CG 3.15Å; P376-R378 PolarHBondContact O-N 3.4Å
379	F	55.1	Low	51.9	Low	71 Å²	71	106.5 Å²	106.5	31%	0.311	55%	0.554	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-121.3	73.2	179.8	-62.3	-76.4	0	0	0	112.2	K377 Y388 R391 L394	K377-F379 PolarHBondContact O-N 2.88Å; F379-Y388 WeakPolarHBondContact CB-O 3.17Å; F379-Y388 PolarHBondContact N-O 3.27Å; F379-Y388 VanDerWaalsContact N-O 3.1Å; F379-Y388 PolarHBondContact O-N 2.93Å; F379-R391 HydrophobicContact CD1-CB 4.1Å; F379-R391 HydrophobicContact CD1-CG 4.12Å; F379-R391 HydrophobicContact CE1-CB 3.81Å; F379-R391 HydrophobicContact CE1-CG 3.85Å; F379-R391 HydrophobicContact CE2-CB 4.24Å; F379-R391 HydrophobicContact CG-CB 4.44Å; F379-R391 HydrophobicContact CZ-CB 3.89Å; F379-R391 HydrophobicContact CZ-CG 4.4Å; F379-L394 HydrophobicContact CB-CB 4.19Å; F379-L394 HydrophobicContact CB-CD2 4.02Å
380	R	69.4	Low	53.8	Low	144 Å²	144	102.4 Å²	102.4	54%	0.543	53%	0.531	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	141.7	172	-160.7	173.5	-170.4	-169.3	1.2	111	H385	R380-H385 PolarHBondContact NH2-ND1 2.95Å
381	C	77.8	Confident	55.9	Low	3 Å²	3	102.8 Å²	102.8	2%	0.02	53%	0.525	C	S	.	.			trans	-86.6	122.5	163	178.5	0	0	0	0	109.8	I383 C384 H385 V386 L394 H397 H403	C381-I383 PolarHBondContact O-N 3.43Å; C381-C384 HydrophobicContact CB-CB 4.36Å; C381-H385 WeakPolarHBondContact O-CA 3.41Å; C381-H385 PolarHBondContact O-N 3.33Å; C381-V386 WeakPolarHBondContact CB-O 3.31Å; C381-V386 PolarHBondContact N-O 3.02Å; C381-L394 HydrophobicContact CB-CD1 3.84Å; C381-H397 WeakPolarHBondContact CB-NE2 3.47Å; C381-H397 VanDerWaalsContact SG-CD2 3.55Å; C381-H397 PolarHBondContact SG-NE2 2.88Å; C381-H403 PolarHBondContact SG-CE1 2.98Å
382	N	62.6	Low	57.9	Low	139 Å²	139	101.6 Å²	101.6	74%	0.743	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-13.2	-176.8	-59.1	8.6	0	0	0	113.9
383	I	66	Low	60.3	Low	60 Å²	60	92.5 Å²	92.5	31%	0.308	48%	0.48	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.8	-24.4	-175.3	-67.6	166	0	0	0	112.3	C381 K406 L407 S410	C381-I383 PolarHBondContact O-N 3.43Å; I383-K406 HydrophobicContact CG2-CB 4.19Å; I383-K406 WeakPolarHBondContact CG2-O 3.5Å; I383-L407 HydrophobicContact CD1-CD2 3.52Å; I383-L407 HydrophobicContact CD1-CG 3.79Å; I383-S410 WeakPolarHBondContact CG2-OG 3.36Å
384	C	74.7	Confident	62.8	Low	19 Å²	19	90.2 Å²	90.2	13%	0.128	45%	0.451	C	S	.	.	T	Hydrogen-bonded Turn	trans	-122	-5.1	-177	-57.8	0	0	0	0	113	C381 V386 H397 H403 K406	C381-C384 HydrophobicContact CB-CB 4.36Å; C384-V386 HydrophobicContact CB-CG2 4.13Å; C384-V386 WeakPolarHBondContact O-CG2 3.48Å; C384-V386 PolarHBondContact O-N 3.47Å; C384-H397 WeakPolarHBondContact CB-NE2 3.29Å; C384-H397 PolarHBondContact SG-NE2 3.42Å; C384-H397 VanDerWaalsContact SG-NE2 3.44Å; C384-H403 PolarHBondContact SG-ND1 3.31Å; C384-K406 HydrophobicContact CB-CD 4.37Å; C384-K406 VanDerWaalsContact SG-CD 3.56Å
385	H	66.7	Low	65	Low	110 Å²	110	85.2 Å²	85.2	51%	0.509	43%	0.426	S	S	.	.			trans	52.9	-7.6	-170.4	-58.1	-59.8	0	0	0	117.3	R380 C381 S387	R380-H385 PolarHBondContact NH2-ND1 2.95Å; C381-H385 WeakPolarHBondContact O-CA 3.41Å; C381-H385 PolarHBondContact O-N 3.33Å; H385-S387 PolarHBondContact O-N 3.5Å; H385-S387 PolarHBondContact O-OG 3.43Å
386	V	73.7	Confident	67	Low	67 Å²	67	85.7 Å²	85.7	41%	0.406	42%	0.417	S	S	.	.			trans	-56.2	123.2	172.1	-172	0	0	0	0	110	C381 C384 Y388	C381-V386 WeakPolarHBondContact CB-O 3.31Å; C381-V386 PolarHBondContact N-O 3.02Å; C384-V386 HydrophobicContact CB-CG2 4.13Å; C384-V386 WeakPolarHBondContact O-CG2 3.48Å; C384-V386 PolarHBondContact O-N 3.47Å; V386-Y388 HydrophobicContact CB-CE2 4.06Å; V386-Y388 HydrophobicContact CG1-CE1 4.32Å; V386-Y388 HydrophobicContact CG1-CE2 3.71Å; V386-Y388 WeakPolarHBondContact CG1-OH 3.48Å
387	S	68.7	Low	69.2	Low	42 Å²	42	81.7 Å²	81.7	29%	0.294	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	128.3	-174.9	-43.8	0	0	0	0	112.1	H385	H385-S387 PolarHBondContact O-N 3.5Å; H385-S387 PolarHBondContact O-OG 3.43Å
388	Y	73.5	Confident	70.7	Confident	56 Å²	56	79.5 Å²	79.5	22%	0.22	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	146.8	-176.5	-68.8	-77.9	0	0	0	112.4	F379 V386 S390 N393 L394 H397	F379-Y388 WeakPolarHBondContact CB-O 3.17Å; F379-Y388 PolarHBondContact N-O 3.27Å; F379-Y388 VanDerWaalsContact N-O 3.1Å; F379-Y388 PolarHBondContact O-N 2.93Å; V386-Y388 HydrophobicContact CB-CE2 4.06Å; V386-Y388 HydrophobicContact CG1-CE1 4.32Å; V386-Y388 HydrophobicContact CG1-CE2 3.71Å; V386-Y388 WeakPolarHBondContact CG1-OH 3.48Å; Y388-S390 VanDerWaalsContact C-N 3.27Å; Y388-N393 HydrophobicContact CD1-CB 3.69Å; Y388-N393 HydrophobicContact CE1-CB 4.49Å; Y388-N393 HydrophobicContact CG-CB 4.14Å; Y388-L394 HydrophobicContact CD2-CB 4.2Å; Y388-L394 HydrophobicContact CD2-CD1 4.01Å; Y388-L394 HydrophobicContact CG-CB 4.46Å; Y388-H397 HydrophobicContact CD2-CB 4.25Å; Y388-H397 HydrophobicContact CE2-CB 3.42Å; Y388-H397 VanDerWaalsContact CE2-CB 3.42Å; Y388-H397 AromaticContact CE2-CD2 3.99Å; Y388-H397 AromaticContact CE2-CG 3.41Å; Y388-H397 VanDerWaalsContact CE2-CG 3.41Å; Y388-H397 AromaticContact CE2-ND1 3.61Å; Y388-H397 AromaticContact CZ-CG 3.76Å; Y388-H397 AromaticContact CZ-ND1 3.63Å; Y388-H397 PolarHBondContact OH-ND1 2.86Å
389	N	61.6	Low	71.4	Confident	133 Å²	133	77.3 Å²	77.3	71%	0.711	38%	0.375	S	S	*	.	S	Bend	trans	-79.4	-3.8	172.7	55.3	3.6	0	0	0	113.7	N393	N389-N393 PolarHBondContact OD1-ND2 3.21Å
390	S	67	Low	72.4	Confident	37 Å²	37	75.7 Å²	75.7	26%	0.259	37%	0.373	S	S	.	.			trans	-151.3	138	-179.1	173.4	0	0	0	0	112.3	Y388 Q392 N393 L394	Y388-S390 VanDerWaalsContact C-N 3.27Å; S390-Q392 PolarHBondContact O-N 3.25Å; S390-Q392 PolarHBondContact OG-N 2.8Å; S390-Q392 VanDerWaalsContact OG-N 3.11Å; S390-N393 WeakPolarHBondContact O-CB 3.27Å; S390-N393 PolarHBondContact O-N 3.08Å; S390-L394 PolarHBondContact O-N 3.3Å
391	R	69.4	Low	72.4	Confident	192 Å²	192	74.8 Å²	74.8	73%	0.725	38%	0.383	S	S	*	.	H	α-helix	trans	-56.7	-28.8	170.7	-154.5	178.3	-161.8	-178.5	7.5	111.9	F379 S395	F379-R391 HydrophobicContact CD1-CB 4.1Å; F379-R391 HydrophobicContact CD1-CG 4.12Å; F379-R391 HydrophobicContact CE1-CB 3.81Å; F379-R391 HydrophobicContact CE1-CG 3.85Å; F379-R391 HydrophobicContact CE2-CB 4.24Å; F379-R391 HydrophobicContact CG-CB 4.44Å; F379-R391 HydrophobicContact CZ-CB 3.89Å; F379-R391 HydrophobicContact CZ-CG 4.4Å; R391-S395 WeakPolarHBondContact O-CB 3.4Å; R391-S395 PolarHBondContact O-N 2.92Å
392	Q	71.3	Confident	72.1	Confident	88 Å²	88	78.2 Å²	78.2	41%	0.411	41%	0.411	S	S	.	.	H	α-helix	trans	-70.4	-39.6	174.4	-61.6	-169.4	14.8	0	0	112	S390 S395 V396	S390-Q392 PolarHBondContact O-N 3.25Å; S390-Q392 PolarHBondContact OG-N 2.8Å; S390-Q392 VanDerWaalsContact OG-N 3.11Å; Q392-S395 CarbonylContact O-C 3.58Å; Q392-S395 WeakPolarHBondContact O-CA 3.42Å; Q392-S395 WeakPolarHBondContact O-CB 3.02Å; Q392-S395 PolarHBondContact O-N 3.28Å; Q392-S395 PolarHBondContact O-OG 2.69Å; Q392-V396 WeakPolarHBondContact O-CG2 3.32Å; Q392-V396 PolarHBondContact O-N 3.05Å
393	N	75.3	Confident	72.8	Confident	68 Å²	68	71.7 Å²	71.7	36%	0.364	38%	0.376	S	S	.	.	H	α-helix	trans	-70.5	-42.3	177.2	-69.3	-14.6	0	0	0	111.2	Y388 N389 S390 S395 V396 H397	Y388-N393 HydrophobicContact CD1-CB 3.69Å; Y388-N393 HydrophobicContact CE1-CB 4.49Å; Y388-N393 HydrophobicContact CG-CB 4.14Å; N389-N393 PolarHBondContact OD1-ND2 3.21Å; S390-N393 WeakPolarHBondContact O-CB 3.27Å; S390-N393 PolarHBondContact O-N 3.08Å; N393-S395 VanDerWaalsContact C-N 3.26Å; N393-S395 PolarHBondContact O-N 3.43Å; N393-V396 WeakPolarHBondContact O-CA 3.07Å; N393-V396 WeakPolarHBondContact O-CB 3.16Å; N393-V396 PolarHBondContact O-N 3.25Å; N393-H397 PolarHBondContact O-N 2.85Å
394	L	79.2	Confident	72.8	Confident	24 Å²	24	72 Å²	72	13%	0.126	38%	0.377	C	S	.	.	H	α-helix	trans	-56.2	-42.7	166.8	-179	62.4	0	0	0	110.4	F379 C381 Y388 S390 V396 H397 L398	F379-L394 HydrophobicContact CB-CB 4.19Å; F379-L394 HydrophobicContact CB-CD2 4.02Å; C381-L394 HydrophobicContact CB-CD1 3.84Å; Y388-L394 HydrophobicContact CD2-CB 4.2Å; Y388-L394 HydrophobicContact CD2-CD1 4.01Å; Y388-L394 HydrophobicContact CG-CB 4.46Å; S390-L394 PolarHBondContact O-N 3.3Å; L394-V396 PolarHBondContact O-N 2.85Å; L394-H397 WeakPolarHBondContact O-CB 3.44Å; L394-H397 PolarHBondContact O-N 3.32Å; L394-L398 HydrophobicContact CD1-CD1 4.35Å; L394-L398 HydrophobicContact CD1-CD2 4.35Å; L394-L398 HydrophobicContact CD1-CG 4.06Å; L394-L398 HydrophobicContact CD2-CD1 4.48Å; L394-L398 HydrophobicContact CG-CD1 3.92Å; L394-L398 HydrophobicContact CG-CG 4.1Å; L394-L398 WeakPolarHBondContact O-CB 3.39Å; L394-L398 VanDerWaalsContact O-CG 3.23Å; L394-L398 WeakPolarHBondContact O-CG 3.23Å; L394-L398 PolarHBondContact O-N 3.38Å
395	S	76.3	Confident	72.6	Confident	33 Å²	33	73.6 Å²	73.6	23%	0.231	39%	0.391	C	S	.	.	H	α-helix	trans	-69.4	-11.5	174.7	92.5	0	0	0	0	115.3	R391 Q392 N393 R399	R391-S395 WeakPolarHBondContact O-CB 3.4Å; R391-S395 PolarHBondContact O-N 2.92Å; Q392-S395 CarbonylContact O-C 3.58Å; Q392-S395 WeakPolarHBondContact O-CA 3.42Å; Q392-S395 WeakPolarHBondContact O-CB 3.02Å; Q392-S395 PolarHBondContact O-N 3.28Å; Q392-S395 PolarHBondContact O-OG 2.69Å; N393-S395 VanDerWaalsContact C-N 3.26Å; N393-S395 PolarHBondContact O-N 3.43Å; S395-R399 VanDerWaalsContact O-CZ 3.25Å; S395-R399 PolarHBondContact O-NE 3.5Å; S395-R399 PolarHBondContact O-NH2 3.21Å; S395-R399 PolarHBondContact OG-NH2 3.29Å
396	V	76.8	Confident	72.7	Confident	71 Å²	71	74.2 Å²	74.2	43%	0.43	39%	0.392	S	S	.	.	H	α-helix	trans	-83.7	-47.9	168	173.6	0	0	0	0	108.5	Q392 N393 L394 R399 S400	Q392-V396 WeakPolarHBondContact O-CG2 3.32Å; Q392-V396 PolarHBondContact O-N 3.05Å; N393-V396 WeakPolarHBondContact O-CA 3.07Å; N393-V396 WeakPolarHBondContact O-CB 3.16Å; N393-V396 PolarHBondContact O-N 3.25Å; L394-V396 PolarHBondContact O-N 2.85Å; V396-R399 CarbonylContact O-C 3.52Å; V396-R399 PolarHBondContact O-N 2.98Å; V396-S400 PolarHBondContact O-N 2.97Å; V396-S400 VanDerWaalsContact O-N 3.12Å
397	H	85.1	Confident	72.3	Confident	17 Å²	17	73 Å²	73	8%	0.079	38%	0.383	C	S	.	.	H	α-helix	trans	-54	-54.4	174.9	179.4	86.1	0	0	0	111.3	C381 C384 Y388 N393 L394 R399 S400 H403	C381-H397 WeakPolarHBondContact CB-NE2 3.47Å; C381-H397 VanDerWaalsContact SG-CD2 3.55Å; C381-H397 PolarHBondContact SG-NE2 2.88Å; C384-H397 WeakPolarHBondContact CB-NE2 3.29Å; C384-H397 PolarHBondContact SG-NE2 3.42Å; C384-H397 VanDerWaalsContact SG-NE2 3.44Å; Y388-H397 HydrophobicContact CD2-CB 4.25Å; Y388-H397 HydrophobicContact CE2-CB 3.42Å; Y388-H397 VanDerWaalsContact CE2-CB 3.42Å; Y388-H397 AromaticContact CE2-CD2 3.99Å; Y388-H397 AromaticContact CE2-CG 3.41Å; Y388-H397 VanDerWaalsContact CE2-CG 3.41Å; Y388-H397 AromaticContact CE2-ND1 3.61Å; Y388-H397 AromaticContact CZ-CG 3.76Å; Y388-H397 AromaticContact CZ-ND1 3.63Å; Y388-H397 PolarHBondContact OH-ND1 2.86Å; N393-H397 PolarHBondContact O-N 2.85Å; L394-H397 WeakPolarHBondContact O-CB 3.44Å; L394-H397 PolarHBondContact O-N 3.32Å; H397-R399 PolarHBondContact O-N 3.22Å; H397-S400 WeakPolarHBondContact O-CB 3.43Å; H397-S400 PolarHBondContact O-N 3.17Å; H397-S400 PolarHBondContact O-OG 3.42Å; H397-H403 AromaticContact CD2-CE1 3.96Å; H397-H403 AromaticContact CD2-CG 3.72Å; H397-H403 AromaticContact CD2-ND1 3.25Å; H397-H403 PolarHBondContact CD2-ND1 3.34Å; H397-H403 VanDerWaalsContact CD2-ND1 3.25Å; H397-H403 AromaticContact CE1-ND1 3.91Å; H397-H403 AromaticContact NE2-CE1 3.9Å; H397-H403 AromaticContact NE2-CG 3.71Å; H397-H403 AromaticContact NE2-ND1 2.99Å; H397-H403 PolarHBondContact NE2-ND1 3.25Å; H397-H403 WeakPolarHBondContact O-CB 3.42Å
398	L	77.7	Confident	72.1	Confident	84 Å²	84	74.5 Å²	74.5	44%	0.44	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-2.4	175.6	-65.6	176.2	0	0	0	115.2	L394 H403	L394-L398 HydrophobicContact CD1-CD1 4.35Å; L394-L398 HydrophobicContact CD1-CD2 4.35Å; L394-L398 HydrophobicContact CD1-CG 4.06Å; L394-L398 HydrophobicContact CD2-CD1 4.48Å; L394-L398 HydrophobicContact CG-CD1 3.92Å; L394-L398 HydrophobicContact CG-CG 4.1Å; L394-L398 WeakPolarHBondContact O-CB 3.39Å; L394-L398 VanDerWaalsContact O-CG 3.23Å; L394-L398 WeakPolarHBondContact O-CG 3.23Å; L394-L398 PolarHBondContact O-N 3.38Å; L398-H403 VanDerWaalsContact CA-CD2 3.44Å; L398-H403 WeakPolarHBondContact CA-CD2 3.48Å; L398-H403 WeakPolarHBondContact CD2-NE2 3.32Å
399	R	71.2	Confident	71.3	Confident	165 Å²	165	77.4 Å²	77.4	62%	0.623	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-135.8	20.6	176.7	-70.1	179.6	-72.4	-166.3	-9.7	112.7	S395 V396 H397	S395-R399 VanDerWaalsContact O-CZ 3.25Å; S395-R399 PolarHBondContact O-NE 3.5Å; S395-R399 PolarHBondContact O-NH2 3.21Å; S395-R399 PolarHBondContact OG-NH2 3.29Å; V396-R399 CarbonylContact O-C 3.52Å; V396-R399 PolarHBondContact O-N 2.98Å; H397-R399 PolarHBondContact O-N 3.22Å
400	S	75.6	Confident	71	Confident	38 Å²	38	72.1 Å²	72.1	27%	0.266	38%	0.38	S	S	.	.	S	Bend	trans	-94.2	147.5	174.8	68.8	0	0	0	0	110	V396 H397 A402 H403 Q404	V396-S400 PolarHBondContact O-N 2.97Å; V396-S400 VanDerWaalsContact O-N 3.12Å; H397-S400 WeakPolarHBondContact O-CB 3.43Å; H397-S400 PolarHBondContact O-N 3.17Å; H397-S400 PolarHBondContact O-OG 3.42Å; S400-A402 VanDerWaalsContact C-N 3.29Å; S400-A402 PolarHBondContact O-N 3.06Å; S400-H403 CarbonylContact O-C 3.52Å; S400-H403 PolarHBondContact O-N 3.33Å; S400-H403 VanDerWaalsContact O-N 3.16Å; S400-H403 VanDerWaalsContact OG-CB 3.26Å; S400-H403 WeakPolarHBondContact OG-CB 3.23Å; S400-H403 PolarHBondContact OG-N 2.89Å; S400-Q404 WeakPolarHBondContact O-CB 3.5Å; S400-Q404 PolarHBondContact O-N 3.37Å
401	V	70.3	Confident	70.3	Confident	125 Å²	125	75.7 Å²	75.7	76%	0.758	39%	0.392	S	S	*	.	H	α-helix	trans	-59.9	-39.9	-178.3	-178.9	0	0	0	0	111.5	H403 Q404 A405	V401-H403 PolarHBondContact O-N 3.06Å; V401-Q404 PolarHBondContact O-N 3.31Å; V401-A405 WeakPolarHBondContact O-CB 3.29Å; V401-A405 PolarHBondContact O-N 3.04Å
402	A	72.3	Confident	69.1	Low	74 Å²	74	68.3 Å²	68.3	61%	0.612	38%	0.376	S	S	*	.	H	α-helix	trans	-63.9	-39.6	176.9	0	0	0	0	0	113	S400 K406	S400-A402 VanDerWaalsContact C-N 3.29Å; S400-A402 PolarHBondContact O-N 3.06Å; A402-K406 WeakPolarHBondContact O-CB 3.21Å; A402-K406 PolarHBondContact O-N 2.94Å
403	H	75.6	Confident	68	Low	2 Å²	2	68.2 Å²	68.2	1%	0.009	38%	0.377	C	S	.	.	H	α-helix	trans	-72.6	-36.2	171.8	178.2	81.5	0	0	0	111.8	C381 C384 H397 L398 S400 V401 A405 K406 L407	C381-H403 PolarHBondContact SG-CE1 2.98Å; C384-H403 PolarHBondContact SG-ND1 3.31Å; H397-H403 AromaticContact CD2-CE1 3.96Å; H397-H403 AromaticContact CD2-CG 3.72Å; H397-H403 AromaticContact CD2-ND1 3.25Å; H397-H403 PolarHBondContact CD2-ND1 3.34Å; H397-H403 VanDerWaalsContact CD2-ND1 3.25Å; H397-H403 AromaticContact CE1-ND1 3.91Å; H397-H403 AromaticContact NE2-CE1 3.9Å; H397-H403 AromaticContact NE2-CG 3.71Å; H397-H403 AromaticContact NE2-ND1 2.99Å; H397-H403 PolarHBondContact NE2-ND1 3.25Å; H397-H403 WeakPolarHBondContact O-CB 3.42Å; L398-H403 VanDerWaalsContact CA-CD2 3.44Å; L398-H403 WeakPolarHBondContact CA-CD2 3.48Å; L398-H403 WeakPolarHBondContact CD2-NE2 3.32Å; S400-H403 CarbonylContact O-C 3.52Å; S400-H403 PolarHBondContact O-N 3.33Å; S400-H403 VanDerWaalsContact O-N 3.16Å; S400-H403 VanDerWaalsContact OG-CB 3.26Å; S400-H403 WeakPolarHBondContact OG-CB 3.23Å; S400-H403 PolarHBondContact OG-N 2.89Å; V401-H403 PolarHBondContact O-N 3.06Å; H403-A405 VanDerWaalsContact C-N 3.34Å; H403-K406 CarbonylContact O-C 3.52Å; H403-K406 PolarHBondContact O-N 2.95Å; H403-L407 VanDerWaalsContact NE2-CD1 3.29Å; H403-L407 WeakPolarHBondContact NE2-CD1 3.35Å; H403-L407 VanDerWaalsContact O-CB 3.29Å; H403-L407 WeakPolarHBondContact O-CB 3.21Å; H403-L407 PolarHBondContact O-N 2.93Å
404	Q	67.5	Low	66.5	Low	68 Å²	68	68.9 Å²	68.9	32%	0.318	38%	0.384	S	S	.	.	H	α-helix	trans	-67.5	-36.7	179.9	-167.5	169.5	-20.8	0	0	111	N283 S400 V401 L407 T408	N283-Q404 PolarHBondContact OD1-NE2 2.94Å; S400-Q404 WeakPolarHBondContact O-CB 3.5Å; S400-Q404 PolarHBondContact O-N 3.37Å; V401-Q404 PolarHBondContact O-N 3.31Å; Q404-L407 CarbonylContact O-C 3.27Å; Q404-L407 WeakPolarHBondContact O-CB 3.2Å; Q404-L407 PolarHBondContact O-N 3.05Å; Q404-T408 PolarHBondContact O-N 3.42Å; Q404-T408 PolarHBondContact O-OG1 2.86Å
405	A	70.8	Confident	64.7	Low	52 Å²	52	73 Å²	73	43%	0.43	40%	0.401	S	S	.	.	H	α-helix	trans	-67.1	-41.3	168.3	0	0	0	0	0	112.1	V401 H403 L407 T408 H409	V401-A405 WeakPolarHBondContact O-CB 3.29Å; V401-A405 PolarHBondContact O-N 3.04Å; H403-A405 VanDerWaalsContact C-N 3.34Å; A405-L407 PolarHBondContact O-N 2.83Å; A405-T408 WeakPolarHBondContact CA-OG1 3.44Å; A405-T408 PolarHBondContact O-N 3.37Å; A405-T408 PolarHBondContact O-OG1 3.44Å; A405-T408 VanDerWaalsContact O-OG1 3.06Å; A405-H409 VanDerWaalsContact O-CB 3.22Å; A405-H409 WeakPolarHBondContact O-CB 3.36Å; A405-H409 PolarHBondContact O-N 3.17Å
406	K	67.5	Low	63	Low	122 Å²	122	73.4 Å²	73.4	53%	0.53	40%	0.403	S	S	.	.	H	α-helix	trans	-66.8	-22.9	169.3	-76.5	-165.4	171.8	-164.6	0	113.1	I383 C384 A402 H403 S410	I383-K406 HydrophobicContact CG2-CB 4.19Å; I383-K406 WeakPolarHBondContact CG2-O 3.5Å; C384-K406 HydrophobicContact CB-CD 4.37Å; C384-K406 VanDerWaalsContact SG-CD 3.56Å; A402-K406 WeakPolarHBondContact O-CB 3.21Å; A402-K406 PolarHBondContact O-N 2.94Å; H403-K406 CarbonylContact O-C 3.52Å; H403-K406 PolarHBondContact O-N 2.95Å; K406-S410 WeakPolarHBondContact O-CA 3.47Å; K406-S410 WeakPolarHBondContact O-CB 3.42Å; K406-S410 PolarHBondContact O-N 3.24Å; K406-S410 PolarHBondContact O-OG 3.28Å
407	L	66.2	Low	61	Low	41 Å²	41	75.3 Å²	75.3	22%	0.215	41%	0.406	C	S	.	.	H	α-helix	trans	-78.4	-40.5	174.7	-117.9	175.6	0	0	0	111.1	I383 H403 Q404 A405 S410 Q411	I383-L407 HydrophobicContact CD1-CD2 3.52Å; I383-L407 HydrophobicContact CD1-CG 3.79Å; H403-L407 VanDerWaalsContact NE2-CD1 3.29Å; H403-L407 WeakPolarHBondContact NE2-CD1 3.35Å; H403-L407 VanDerWaalsContact O-CB 3.29Å; H403-L407 WeakPolarHBondContact O-CB 3.21Å; H403-L407 PolarHBondContact O-N 2.93Å; Q404-L407 CarbonylContact O-C 3.27Å; Q404-L407 WeakPolarHBondContact O-CB 3.2Å; Q404-L407 PolarHBondContact O-N 3.05Å; A405-L407 PolarHBondContact O-N 2.83Å; L407-S410 CarbonylContact O-C 3.56Å; L407-S410 PolarHBondContact O-N 2.75Å; L407-S410 PolarHBondContact O-OG 3.11Å; L407-Q411 HydrophobicContact CD2-CG 4.09Å; L407-Q411 WeakPolarHBondContact O-CA 3.34Å; L407-Q411 WeakPolarHBondContact O-CB 3.49Å; L407-Q411 WeakPolarHBondContact O-CG 3.21Å; L407-Q411 PolarHBondContact O-N 3.34Å
408	T	63.5	Low	58.9	Low	74 Å²	74	77.9 Å²	77.9	45%	0.454	42%	0.423	S	S	.	.	H	α-helix	trans	-70.5	-38.7	172.2	52.2	0	0	0	0	110.5	Q404 A405 S410 Q411 G412	Q404-T408 PolarHBondContact O-N 3.42Å; Q404-T408 PolarHBondContact O-OG1 2.86Å; A405-T408 WeakPolarHBondContact CA-OG1 3.44Å; A405-T408 PolarHBondContact O-N 3.37Å; A405-T408 PolarHBondContact O-OG1 3.44Å; A405-T408 VanDerWaalsContact O-OG1 3.06Å; T408-S410 PolarHBondContact O-N 2.94Å; T408-Q411 CarbonylContact O-C 3.51Å; T408-Q411 PolarHBondContact O-N 3.07Å; T408-G412 WeakPolarHBondContact O-CA 3.47Å; T408-G412 PolarHBondContact O-N 3.35Å
409	H	57.4	Low	57.1	Low	118 Å²	118	80.5 Å²	80.5	55%	0.546	43%	0.433	S	S	.	.	H	α-helix	trans	-66	-34.2	170.6	-169.5	-74.4	0	0	0	112.3	A405 L413	A405-H409 VanDerWaalsContact O-CB 3.22Å; A405-H409 WeakPolarHBondContact O-CB 3.36Å; A405-H409 PolarHBondContact O-N 3.17Å; H409-L413 VanDerWaalsContact O-CB 3.32Å; H409-L413 WeakPolarHBondContact O-CB 3.37Å; H409-L413 WeakPolarHBondContact O-CG 3.5Å; H409-L413 PolarHBondContact O-N 3.3Å
410	S	54.3	Low	55.4	Low	22 Å²	22	78.4 Å²	78.4	15%	0.154	43%	0.43	C	S	.	.	H	α-helix	trans	-84.1	-18	174.9	81.2	0	0	0	0	113.8	I383 K406 L407 T408 V414	I383-S410 WeakPolarHBondContact CG2-OG 3.36Å; K406-S410 WeakPolarHBondContact O-CA 3.47Å; K406-S410 WeakPolarHBondContact O-CB 3.42Å; K406-S410 PolarHBondContact O-N 3.24Å; K406-S410 PolarHBondContact O-OG 3.28Å; L407-S410 CarbonylContact O-C 3.56Å; L407-S410 PolarHBondContact O-N 2.75Å; L407-S410 PolarHBondContact O-OG 3.11Å; T408-S410 PolarHBondContact O-N 2.94Å; S410-V414 WeakPolarHBondContact O-CB 3.3Å; S410-V414 WeakPolarHBondContact O-CG2 3.34Å; S410-V414 PolarHBondContact O-N 3.37Å
411	Q	53.4	Low	53.4	Low	112 Å²	112	80.4 Å²	80.4	52%	0.523	44%	0.435	S	S	.	.	H	α-helix	trans	-88.2	-25.6	169.8	-76.1	175.2	-10.6	0	0	111	L407 T408 K415	L407-Q411 HydrophobicContact CD2-CG 4.09Å; L407-Q411 WeakPolarHBondContact O-CA 3.34Å; L407-Q411 WeakPolarHBondContact O-CB 3.49Å; L407-Q411 WeakPolarHBondContact O-CG 3.21Å; L407-Q411 PolarHBondContact O-N 3.34Å; T408-Q411 CarbonylContact O-C 3.51Å; T408-Q411 PolarHBondContact O-N 3.07Å; Q411-K415 WeakPolarHBondContact O-CA 3.32Å; Q411-K415 WeakPolarHBondContact O-CB 3.41Å; Q411-K415 VanDerWaalsContact O-CG 3.27Å; Q411-K415 WeakPolarHBondContact O-CG 3.43Å; Q411-K415 PolarHBondContact O-N 2.95Å
412	G	44.8	Very low	51.5	Low	36 Å²	36	79.7 Å²	79.7	37%	0.371	43%	0.427	S	S	.	.	H	α-helix	trans	-63.5	-55.1	160.1	0	0	0	0	0	109.1	T408 V414 K415 S416	T408-G412 WeakPolarHBondContact O-CA 3.47Å; T408-G412 PolarHBondContact O-N 3.35Å; G412-V414 VanDerWaalsContact C-N 3.32Å; G412-V414 PolarHBondContact O-N 3.32Å; G412-K415 CarbonylContact O-C 3.53Å; G412-K415 WeakPolarHBondContact O-CB 3.46Å; G412-K415 PolarHBondContact O-N 3Å; G412-S416 WeakPolarHBondContact O-CB 3.02Å; G412-S416 PolarHBondContact O-N 2.67Å; G412-S416 PolarHBondContact O-OG 3.3Å
413	L	47.7	Very low	49.5	Very low	86 Å²	86	80.7 Å²	80.7	45%	0.45	43%	0.429	S	S	.	.	H	α-helix	trans	-63.1	-28.9	173.3	-78.2	169.9	0	0	0	114	H409 S416 F417	H409-L413 VanDerWaalsContact O-CB 3.32Å; H409-L413 WeakPolarHBondContact O-CB 3.37Å; H409-L413 WeakPolarHBondContact O-CG 3.5Å; H409-L413 PolarHBondContact O-N 3.3Å; L413-S416 WeakPolarHBondContact CA-OG 3.45Å; L413-S416 PolarHBondContact O-OG 3.14Å; L413-F417 WeakPolarHBondContact O-CA 3.36Å; L413-F417 WeakPolarHBondContact O-CB 3.48Å; L413-F417 PolarHBondContact O-N 3.44Å
414	V	42.8	Very low	47.3	Very low	83 Å²	83	83.2 Å²	83.2	50%	0.503	46%	0.456	S	S	.	.	H	α-helix	trans	-84.2	-28.2	173.5	166.2	0	0	0	0	111.9	S410 G412 V418	S410-V414 WeakPolarHBondContact O-CB 3.3Å; S410-V414 WeakPolarHBondContact O-CG2 3.34Å; S410-V414 PolarHBondContact O-N 3.37Å; G412-V414 VanDerWaalsContact C-N 3.32Å; G412-V414 PolarHBondContact O-N 3.32Å; V414-V418 HydrophobicContact CG1-CG2 4.24Å; V414-V418 WeakPolarHBondContact O-CB 3.41Å; V414-V418 WeakPolarHBondContact O-CG2 3.2Å; V414-V418 PolarHBondContact O-N 3.31Å
415	K	41.5	Very low	45.3	Very low	111 Å²	111	88.8 Å²	88.8	48%	0.483	47%	0.474	S	S	.	.	H	α-helix	trans	-62.9	-48.8	164.3	-86.6	-174.9	168.7	-156.8	0	109.9	Q411 G412 V418 Q419 E524	Q411-K415 WeakPolarHBondContact O-CA 3.32Å; Q411-K415 WeakPolarHBondContact O-CB 3.41Å; Q411-K415 VanDerWaalsContact O-CG 3.27Å; Q411-K415 WeakPolarHBondContact O-CG 3.43Å; Q411-K415 PolarHBondContact O-N 2.95Å; G412-K415 CarbonylContact O-C 3.53Å; G412-K415 WeakPolarHBondContact O-CB 3.46Å; G412-K415 PolarHBondContact O-N 3Å; K415-V418 PolarHBondContact O-N 3.06Å; K415-Q419 WeakPolarHBondContact O-CB 3.49Å; K415-Q419 PolarHBondContact O-N 3.16Å; K415-E524 IonicContact NZ-OE1 3.55Å; K415-E524 PolarHBondContact NZ-OE1 3.48Å; K415-E524 IonicContact NZ-OE2 2.78Å
416	S	41.7	Very low	43.1	Very low	40 Å²	40	93.1 Å²	93.1	28%	0.28	49%	0.49	S	S	.	.	H	α-helix	trans	-76.8	-26.2	-179.1	71.8	0	0	0	0	113.2	G412 L413 Q419 Q420	G412-S416 WeakPolarHBondContact O-CB 3.02Å; G412-S416 PolarHBondContact O-N 2.67Å; G412-S416 PolarHBondContact O-OG 3.3Å; L413-S416 WeakPolarHBondContact CA-OG 3.45Å; L413-S416 PolarHBondContact O-OG 3.14Å; S416-Q419 CarbonylContact O-C 3.38Å; S416-Q419 PolarHBondContact O-N 2.73Å; S416-Q420 WeakPolarHBondContact O-CB 3.39Å; S416-Q420 WeakPolarHBondContact O-CG 3.47Å; S416-Q420 PolarHBondContact O-N 2.95Å; S416-Q420 PolarHBondContact O-OE1 3.35Å
417	F	34.8	Very low	41.2	Very low	112 Å²	112	95.5 Å²	95.5	49%	0.491	51%	0.508	S	S	.	.	H	α-helix	trans	-78.3	-30.4	169.5	-177.2	-98.9	0	0	0	111.5	L413 Q421	L413-F417 WeakPolarHBondContact O-CA 3.36Å; L413-F417 WeakPolarHBondContact O-CB 3.48Å; L413-F417 PolarHBondContact O-N 3.44Å; F417-Q421 HydrophobicContact CD1-CG 3.8Å; F417-Q421 HydrophobicContact CD2-CG 4.39Å; F417-Q421 HydrophobicContact CE1-CG 3.56Å; F417-Q421 HydrophobicContact CE2-CG 4.18Å; F417-Q421 HydrophobicContact CG-CG 4.22Å; F417-Q421 HydrophobicContact CZ-CG 3.77Å; F417-Q421 WeakPolarHBondContact O-CB 3.14Å; F417-Q421 WeakPolarHBondContact O-CG 3.45Å; F417-Q421 PolarHBondContact O-N 2.72Å
418	V	39.8	Very low	39.4	Very low	71 Å²	71	98.3 Å²	98.3	43%	0.43	54%	0.538	S	S	.	.	H	α-helix	trans	-70	-37.4	165.5	168.4	0	0	0	0	110	V414 K415 L422	V414-V418 HydrophobicContact CG1-CG2 4.24Å; V414-V418 WeakPolarHBondContact O-CB 3.41Å; V414-V418 WeakPolarHBondContact O-CG2 3.2Å; V414-V418 PolarHBondContact O-N 3.31Å; K415-V418 PolarHBondContact O-N 3.06Å; V418-L422 HydrophobicContact CG1-CD1 3.66Å; V418-L422 HydrophobicContact CG1-CG 4.26Å; V418-L422 WeakPolarHBondContact O-CB 3.47Å; V418-L422 WeakPolarHBondContact O-CG 3.39Å; V418-L422 PolarHBondContact O-N 3.44Å
419	Q	40.8	Very low	37.5	Very low	139 Å²	139	103.1 Å²	103.1	65%	0.65	56%	0.56	S	S	*	*	H	α-helix	trans	-64.6	-39.4	172.3	-152.7	75.7	24.7	0	0	111.8	K415 S416 L422 S423	K415-Q419 WeakPolarHBondContact O-CB 3.49Å; K415-Q419 PolarHBondContact O-N 3.16Å; S416-Q419 CarbonylContact O-C 3.38Å; S416-Q419 PolarHBondContact O-N 2.73Å; Q419-L422 CarbonylContact O-C 3.49Å; Q419-S423 VanDerWaalsContact O-CB 3.28Å; Q419-S423 WeakPolarHBondContact O-CB 3.45Å; Q419-S423 PolarHBondContact O-N 2.97Å; Q419-S423 PolarHBondContact O-OG 3.26Å
420	Q	35.8	Very low	36.1	Very low	121 Å²	121	104.6 Å²	104.6	57%	0.565	58%	0.576	S	S	*	*	H	α-helix	trans	-78.5	-29.7	177.5	-76.5	172.9	-42.7	0	0	113.3	S416 S423 G424	S416-Q420 WeakPolarHBondContact O-CB 3.39Å; S416-Q420 WeakPolarHBondContact O-CG 3.47Å; S416-Q420 PolarHBondContact O-N 2.95Å; S416-Q420 PolarHBondContact O-OE1 3.35Å; Q420-S423 CarbonylContact O-C 3.57Å; Q420-S423 PolarHBondContact O-N 2.99Å; Q420-G424 VanDerWaalsContact O-CA 3.23Å; Q420-G424 WeakPolarHBondContact O-CA 3.42Å; Q420-G424 PolarHBondContact O-N 2.87Å
421	Q	33	Very low	34.9	Very low	79 Å²	79	106.4 Å²	106.4	37%	0.369	60%	0.599	S	S	.	*	H	α-helix	trans	-74.6	-34.1	170.4	-71.3	-80.6	-63.6	0	0	110.7	F417 S423 R425	F417-Q421 HydrophobicContact CD1-CG 3.8Å; F417-Q421 HydrophobicContact CD2-CG 4.39Å; F417-Q421 HydrophobicContact CE1-CG 3.56Å; F417-Q421 HydrophobicContact CE2-CG 4.18Å; F417-Q421 HydrophobicContact CG-CG 4.22Å; F417-Q421 HydrophobicContact CZ-CG 3.77Å; F417-Q421 WeakPolarHBondContact O-CB 3.14Å; F417-Q421 WeakPolarHBondContact O-CG 3.45Å; F417-Q421 PolarHBondContact O-N 2.72Å; Q421-S423 PolarHBondContact O-N 3.34Å; Q421-R425 PolarHBondContact O-N 3.09Å
422	L	31.1	Very low	33.7	Very low	111 Å²	111	109.8 Å²	109.8	58%	0.581	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.2	3.5	170.5	-63.4	173.1	0	0	0	113.3	V418 Q419 I1848	V418-L422 HydrophobicContact CG1-CD1 3.66Å; V418-L422 HydrophobicContact CG1-CG 4.26Å; V418-L422 WeakPolarHBondContact O-CB 3.47Å; V418-L422 WeakPolarHBondContact O-CG 3.39Å; V418-L422 PolarHBondContact O-N 3.44Å; Q419-L422 CarbonylContact O-C 3.49Å; L422-I1848 HydrophobicContact CD2-CG2 4.17Å
423	S	29	Very low	33.3	Very low	95 Å²	95	112.6 Å²	112.6	66%	0.664	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-129.3	23.4	167.9	83.9	0	0	0	0	111.8	Q419 Q420 Q421	Q419-S423 VanDerWaalsContact O-CB 3.28Å; Q419-S423 WeakPolarHBondContact O-CB 3.45Å; Q419-S423 PolarHBondContact O-N 2.97Å; Q419-S423 PolarHBondContact O-OG 3.26Å; Q420-S423 CarbonylContact O-C 3.57Å; Q420-S423 PolarHBondContact O-N 2.99Å; Q421-S423 PolarHBondContact O-N 3.34Å
424	G	28.9	Very low	32.2	Very low	55 Å²	55	115.5 Å²	115.5	57%	0.567	64%	0.642	S	S	*	*	S	Bend	trans	-154.1	19.6	-169.4	0	0	0	0	0	113.5	Q420	Q420-G424 VanDerWaalsContact O-CA 3.23Å; Q420-G424 WeakPolarHBondContact O-CA 3.42Å; Q420-G424 PolarHBondContact O-N 2.87Å
425	R	27.1	Very low	31.5	Very low	184 Å²	184	119.2 Å²	119.2	69%	0.694	65%	0.654	S	S	*	*	S	Bend	trans	-141.6	152.2	163.7	-106.2	-176.4	163.4	101.1	4	108.8	Q421	Q421-R425 PolarHBondContact O-N 3.09Å
426	D	24.9	Very low	30.7	Very low	143 Å²	143	119.6 Å²	119.6	77%	0.765	66%	0.662	S	S	*	*	S	Bend	trans	70.5	62	170.1	-47	-15.9	0	0	0	116.2
427	N	25.8	Very low	30	Very low	172 Å²	172	123 Å²	123	92%	0.92	68%	0.681	S	S	*	*			trans	-168.7	91.8	139.2	-103.8	-14.1	0	0	0	112.2
428	A	29.2	Very low	29.7	Very low	100 Å²	100	122.4 Å²	122.4	83%	0.826	69%	0.69	S	S	*	*			trans	168.4	92.5	149.9	0	0	0	0	0	110.8
429	L	24.6	Very low	29.3	Very low	176 Å²	176	126.6 Å²	126.6	92%	0.921	71%	0.709	S	S	*	*			trans	-150.2	112	161.7	-164.9	93.5	0	0	0	107.6
430	V	27.8	Very low	28.7	Very low	148 Å²	148	126.6 Å²	126.6	90%	0.897	71%	0.714	S	S	*	*			trans	-153.3	134.6	-174.7	-176.9	0	0	0	0	108.8
431	G	27.9	Very low	28.5	Very low	61 Å²	61	124 Å²	124	63%	0.629	72%	0.719	S	S	*	*			trans	89.3	114.2	-175.3	0	0	0	0	0	111.6
432	E	29	Very low	28.5	Very low	182 Å²	182	125.1 Å²	125.1	85%	0.85	74%	0.736	S	S	*	*			cis	71.4	135.1	44.8	-53.2	-72.9	140.9	0	0	113.5
433	P	35.4	Very low	28.8	Very low	95 Å²	95	129 Å²	129	62%	0.617	75%	0.748	S	S	*	*			cis	-137.2	-170.7	-36.4	38.7	-20.8	0	0	0	113.9
434	D	25.5	Very low	28.9	Very low	147 Å²	147	131.9 Å²	131.9	79%	0.786	76%	0.756	S	S	*	*			trans	76.6	130.4	150.5	-63.7	-27.7	0	0	0	125.6
435	E	27.4	Very low	29.2	Very low	161 Å²	161	132.2 Å²	132.2	75%	0.752	75%	0.753	S	S	*	*			trans	67.6	112.4	139.3	-60.4	-116.5	111.4	0	0	125.5
436	N	26	Very low	29.6	Very low	119 Å²	119	128.7 Å²	128.7	64%	0.636	75%	0.752	S	S	*	*				78.1	109.3	125.2	-64.7	-30.5	0	0	0	127.1
437	V	25.6	Very low	29.7	Very low	112 Å²	112	124.6 Å²	124.6	68%	0.679	73%	0.734	S	S	*	*				70.6	94.5	124.1	-171.2	0	0	0	0	123
438	S	29.5	Very low	29.7	Very low	100 Å²	100	126.2 Å²	126.2	70%	0.699	73%	0.733	S	S	*	*				57.2	144.3	116.2	-53.1	0	0	0	0	127.3
439	L	31.7	Very low	30	Very low	158 Å²	158	127.9 Å²	127.9	83%	0.827	72%	0.724	S	S	*	*			trans	77.1	149.9	149.8	-72.8	157.4	0	0	0	118.7
440	D	28.4	Very low	30.4	Very low	140 Å²	140	124.4 Å²	124.4	75%	0.749	72%	0.715	S	S	*	*			cis	-147.7	175.9	3.8	-154.2	-30.3	0	0	0	110.7
441	G	30.8	Very low	30.7	Very low	65 Å²	65	121.9 Å²	121.9	67%	0.67	71%	0.709	S	S	*	*			trans	-173.8	-27.2	176.6	0	0	0	0	0	124.3
442	S	33.3	Very low	31	Very low	104 Å²	104	126 Å²	126	73%	0.727	72%	0.722	S	S	*	*			trans	51.1	126.3	170.8	-73.9	0	0	0	0	123.1
443	K	36	Very low	31.2	Very low	191 Å²	191	120.4 Å²	120.4	83%	0.83	71%	0.714	S	S	*	*				179.4	127.8	118.8	-97.7	153.9	-171.7	166.4	0	115.6
444	N	32	Very low	31.2	Very low	156 Å²	156	124.5 Å²	124.5	83%	0.834	73%	0.73	S	S	*	*			trans	61.1	138.3	157.3	-55.8	-10.8	0	0	0	119.5
445	A	35.4	Very low	31.6	Very low	62 Å²	62	121.4 Å²	121.4	51%	0.512	72%	0.724	S	S	.	*			cis	-162.9	119.9	-16.4	0	0	0	0	0	107.7	L363	L363-A445 HydrophobicContact CD1-CB 3.99Å
446	V	34.9	Very low	31.8	Very low	111 Å²	111	120.8 Å²	120.8	67%	0.673	73%	0.732	S	S	*	*				74.8	131.2	82.1	170.2	0	0	0	0	112.7	L363	L363-V446 HydrophobicContact CD1-CB 4.46Å; L363-V446 HydrophobicContact CD1-CG1 4.34Å
447	C	28.3	Very low	32.5	Very low	56 Å²	56	120 Å²	120	38%	0.378	74%	0.735	S	S	.	*			cis	-141.9	150.6	28.9	-162.1	0	0	0	0	117.4	S362	S362-C447 WeakPolarHBondContact O-CB 3.44Å; S362-C447 PolarHBondContact O-N 2.91Å
448	F	25.8	Very low	33.4	Very low	206 Å²	206	119.9 Å²	119.9	90%	0.904	74%	0.737	S	S	*	*			trans	-147.8	155.3	141.8	-128.9	-84.7	0	0	0	107.5
449	Q	34.1	Very low	33.8	Very low	135 Å²	135	122.8 Å²	122.8	63%	0.631	74%	0.744	S	S	*	*			trans	-101.1	151	180	-69.6	-178.8	8.3	0	0	110.9
450	S	32.7	Very low	34.5	Very low	104 Å²	104	120.3 Å²	120.3	73%	0.727	74%	0.738	S	S	*	*			cis	-168.1	150.5	-9.9	-90.3	0	0	0	0	111.6
451	A	35	Very low	34.9	Very low	95 Å²	95	119.2 Å²	119.2	79%	0.785	74%	0.741	S	S	*	*			trans	62.8	150.5	158.7	0	0	0	0	0	120.1
452	T	34.3	Very low	35.5	Very low	146 Å²	146	124.3 Å²	124.3	90%	0.896	75%	0.753	S	S	*	*			cis	-175.1	169.7	-14.7	27.1	0	0	0	0	107.7
453	G	33.9	Very low	35.5	Very low	66 Å²	66	126.1 Å²	126.1	68%	0.68	75%	0.754	S	S	*	*			cis	160	168.4	-5.4	0	0	0	0	0	113.4
454	L	33.5	Very low	35.1	Very low	180 Å²	180	122.7 Å²	122.7	94%	0.942	75%	0.753	S	S	*	*			trans	80.7	145.6	167.7	-49.7	177.3	0	0	0	121.6
455	A	34.2	Very low	35	Very low	82 Å²	82	118.5 Å²	118.5	68%	0.678	75%	0.747	S	S	*	*			cis	-176.9	163.6	-32.6	0	0	0	0	0	115.2
456	V	33.3	Very low	34.6	Very low	149 Å²	149	123.8 Å²	123.8	90%	0.903	77%	0.767	S	S	*	*			trans	98.1	132.1	154.3	-169.9	0	0	0	0	121.8
457	S	39.3	Very low	34.4	Very low	102 Å²	102	123.1 Å²	123.1	71%	0.713	77%	0.773	S	S	*	*			trans	-165.1	160	167.3	-164.2	0	0	0	0	114.9
458	P	45.1	Very low	34.3	Very low	110 Å²	110	128.7 Å²	128.7	71%	0.714	79%	0.793	S	S	*	*			trans	-129.2	-177.7	-176.2	42.6	-27.2	0	0	0	118.6
459	N	37.5	Very low	34.3	Very low	160 Å²	160	125.9 Å²	125.9	86%	0.856	79%	0.787	S	S	*	*			trans	-173	-173.9	176.5	-107.7	-79.3	0	0	0	110.4
460	P	45.8	Very low	34	Very low	107 Å²	107	124.1 Å²	124.1	70%	0.695	79%	0.79	S	S	*	*			cis	-139.6	-173.3	-9	41.6	-21	0	0	0	118.2
461	S	38	Very low	33.8	Very low	117 Å²	117	126 Å²	126	82%	0.818	80%	0.797	S	S	*	*			trans	64.8	136.1	146.4	63	0	0	0	0	126.1
462	D	42.6	Very low	33.7	Very low	171 Å²	171	126.1 Å²	126.1	91%	0.914	80%	0.797	S	S	*	*			trans	-157.1	179.2	170.6	-149.4	-19.2	0	0	0	113
463	D	34.3	Very low	33.7	Very low	142 Å²	142	122.8 Å²	122.8	76%	0.759	79%	0.792	S	S	*	*			trans	-151.1	180	-165.4	-174	41.6	0	0	0	118.9
464	C	27.5	Very low	34.1	Very low	119 Å²	119	125.2 Å²	125.2	80%	0.804	80%	0.795	S	S	*	*			trans	78.9	163.6	168.3	-74.2	0	0	0	0	119.5
465	G	28.8	Very low	34	Very low	68 Å²	68	122.3 Å²	122.3	70%	0.701	79%	0.79	S	S	*	*			cis	159.4	104.9	-14.2	0	0	0	0	0	118.1
466	N	27.9	Very low	33.8	Very low	174 Å²	174	121.5 Å²	121.5	93%	0.93	79%	0.79	S	S	*	*			trans	65.4	137.7	155.2	-67.1	-26.9	0	0	0	125.7
467	A	29.6	Very low	33.5	Very low	97 Å²	97	121.6 Å²	121.6	80%	0.802	79%	0.785	S	S	*	*			trans	118.2	143.1	130	0	0	0	0	0	123.6
468	E	26.5	Very low	32.9	Very low	172 Å²	172	126.2 Å²	126.2	80%	0.804	79%	0.788	S	S	*	*			trans	81	104.5	154.4	-60.4	-145	103.4	0	0	126
469	L	26.9	Very low	32	Very low	147 Å²	147	129.3 Å²	129.3	77%	0.77	79%	0.791	S	S	*	*				74.8	125	124	-108.4	70.8	0	0	0	126.2
470	S	27.5	Very low	31.6	Very low	99 Å²	99	127 Å²	127	69%	0.692	78%	0.779	S	S	*	*			trans	106.3	94.3	133.9	-55.5	0	0	0	0	123.7
471	V	28.9	Very low	30.8	Very low	144 Å²	144	129 Å²	129	87%	0.873	78%	0.778	S	S	*	*				64.9	131.8	124.4	177.1	0	0	0	0	122.8
472	A	31.4	Very low	30.3	Very low	97 Å²	97	130.1 Å²	130.1	80%	0.802	78%	0.775	S	S	*	*			trans	77.4	105.6	160.1	0	0	0	0	0	119.7
473	G	34.3	Very low	29.6	Very low	75 Å²	75	126.9 Å²	126.9	77%	0.773	77%	0.766	S	S	*	*			trans	-93.5	-125.2	171.7	0	0	0	0	0	113.2
474	P	44	Very low	29.3	Very low	117 Å²	117	127.6 Å²	127.6	76%	0.76	77%	0.77	S	S	*	*			cis	-137.2	178.2	1.3	43.3	-26.5	0	0	0	116.1
475	S	30.4	Very low	29.3	Very low	120 Å²	120	128 Å²	128	84%	0.839	77%	0.769	S	S	*	*			trans	69.3	120.8	156.8	-54.8	0	0	0	0	119.2
476	G	29.8	Very low	29.3	Very low	64 Å²	64	132 Å²	132	66%	0.66	77%	0.774	S	S	*	*			cis	-180	138.8	-7.5	0	0	0	0	0	115.8
477	N	27.8	Very low	29.1	Very low	151 Å²	151	129.1 Å²	129.1	81%	0.807	77%	0.766	S	S	*	*				59.4	139.2	127.3	-62.5	20.3	0	0	0	122.1
478	Y	26.5	Very low	29	Very low	199 Å²	199	128.8 Å²	128.8	78%	0.78	76%	0.763	S	S	*	*			cis	-167	165.3	-22.1	-144.5	-92.7	0	0	0	108.4
479	F	25.5	Very low	29.1	Very low	176 Å²	176	128.8 Å²	128.8	77%	0.772	76%	0.763	S	S	*	*			trans	-151.3	146.2	173.9	-141.5	-85	0	0	0	110.8
480	D	30.2	Very low	29.1	Very low	111 Å²	111	129.5 Å²	129.5	59%	0.594	76%	0.756	S	S	*	*			trans	61.8	149.3	174.9	-78.1	-42.2	0	0	0	117.7
481	Q	29.3	Very low	29.2	Very low	148 Å²	148	131.6 Å²	131.6	69%	0.692	76%	0.759	S	S	*	*			cis	-153.3	173.7	-2.9	-141.3	147.4	63.6	0	0	112.3
482	D	27.2	Very low	29.1	Very low	141 Å²	141	131.9 Å²	131.9	75%	0.754	76%	0.756	S	S	*	*			trans	81.4	147	154.8	-68.6	-29.5	0	0	0	125.7
483	S	27.8	Very low	29.1	Very low	103 Å²	103	134.3 Å²	134.3	72%	0.72	76%	0.755	S	S	*	*			trans	86.7	105.4	158.8	67.7	0	0	0	0	123
484	D	28.7	Very low	28.9	Very low	157 Å²	157	137.7 Å²	137.7	84%	0.84	76%	0.755	S	S	*	*			trans	63.6	159.8	134.5	-63.7	-42.4	0	0	0	125.4
485	V	27.6	Very low	28.2	Very low	128 Å²	128	137.4 Å²	137.4	78%	0.776	75%	0.747	S	S	*	*			trans	85.1	91.2	159.6	-163.5	0	0	0	0	120.5
486	N	27.1	Very low	28.2	Very low	151 Å²	151	134.9 Å²	134.9	81%	0.807	73%	0.734	S	S	*	*				68.8	163	127.4	-147.6	6.8	0	0	0	121.8
487	C	23.4	Very low	28.3	Very low	115 Å²	115	137.7 Å²	137.7	78%	0.777	73%	0.732	S	S	*	*			trans	-67.2	134.9	-166.2	-55.4	0	0	0	0	116.9
488	A	27.8	Very low	28.6	Very low	89 Å²	89	135.8 Å²	135.8	74%	0.736	72%	0.718	S	S	*	*				173.5	147	116.4	0	0	0	0	0	112.5
489	E	28.3	Very low	28.8	Very low	172 Å²	172	131.9 Å²	131.9	80%	0.804	71%	0.707	S	S	*	*			trans	31.6	146.6	145.2	-59.9	-168.5	136.8	0	0	122.9
490	R	27.6	Very low	29	Very low	163 Å²	163	128.7 Å²	128.7	62%	0.615	70%	0.702	S	S	*	*			cis	-170.9	146.1	-23.3	-156.8	167.1	173.4	158.5	-8.1	107.6	A585	R490-A585 PolarHBondContact NH2-O 2.65Å; R490-A585 VanDerWaalsContact NH2-O 3.15Å
491	D	29	Very low	29.2	Very low	143 Å²	143	130.3 Å²	130.3	77%	0.765	71%	0.708	S	S	*	*			trans	65.1	-176.9	176.3	-63.8	-61.5	0	0	0	117.1
492	D	27.4	Very low	29.6	Very low	150 Å²	150	128 Å²	128	80%	0.802	70%	0.697	S	S	*	*			trans	56.1	88.8	179.5	-66.3	-17.8	0	0	0	120.4
493	N	30.6	Very low	29.8	Very low	148 Å²	148	128.4 Å²	128.4	79%	0.791	69%	0.694	S	S	*	*				173.1	69.7	127.2	-98.5	-70.3	0	0	0	113.2	N495	N493-N495 VanDerWaalsContact C-N 3.33Å
494	L	31.4	Very low	29.8	Very low	146 Å²	146	130 Å²	130	76%	0.764	70%	0.699	S	S	*	*			trans	-81	-8.2	176.6	-90.7	164.3	0	0	0	114.6
495	N	28.4	Very low	30	Very low	110 Å²	110	127.2 Å²	127.2	59%	0.588	69%	0.688	S	S	*	*	H	α-helix	trans	-85.4	-24.9	-160	-58.7	1.4	0	0	0	114.4	N493 I497 E498 E499	N493-N495 VanDerWaalsContact C-N 3.33Å; N495-I497 VanDerWaalsContact C-N 3.31Å; N495-I497 PolarHBondContact O-N 2.76Å; N495-E498 VanDerWaalsContact O-CB 3.29Å; N495-E498 WeakPolarHBondContact O-CB 3.45Å; N495-E498 PolarHBondContact O-N 2.98Å; N495-E498 VanDerWaalsContact O-N 3.1Å; N495-E499 PolarHBondContact O-N 2.93Å
496	A	30.8	Very low	30	Very low	68 Å²	68	127.8 Å²	127.8	56%	0.562	69%	0.686	S	S	*	*	H	α-helix	trans	-68.8	-28	-178.9	0	0	0	0	0	113.4	E498	A496-E498 VanDerWaalsContact C-N 3.34Å
497	I	31.6	Very low	30	Very low	123 Å²	123	129.9 Å²	129.9	63%	0.631	69%	0.688	S	S	*	*	H	α-helix	trans	-77.3	-25.4	174	-62.5	176.8	0	0	0	110.6	N495 M501	N495-I497 VanDerWaalsContact C-N 3.31Å; N495-I497 PolarHBondContact O-N 2.76Å; I497-M501 HydrophobicContact CG2-SD 4.13Å; I497-M501 WeakPolarHBondContact O-CB 3.41Å; I497-M501 WeakPolarHBondContact O-CG 3.49Å; I497-M501 PolarHBondContact O-N 3.17Å
498	E	33.5	Very low	30.1	Very low	110 Å²	110	127.7 Å²	127.7	51%	0.514	69%	0.685	S	S	.	*	H	α-helix	trans	-65.2	-43.2	172.7	-117.3	-169.5	130.5	0	0	111.5	N495 A496 M501 Q502	N495-E498 VanDerWaalsContact O-CB 3.29Å; N495-E498 WeakPolarHBondContact O-CB 3.45Å; N495-E498 PolarHBondContact O-N 2.98Å; N495-E498 VanDerWaalsContact O-N 3.1Å; A496-E498 VanDerWaalsContact C-N 3.34Å; E498-M501 CarbonylContact O-C 3.58Å; E498-M501 PolarHBondContact O-N 3.32Å; E498-M501 VanDerWaalsContact O-N 3.16Å; E498-Q502 WeakPolarHBondContact O-CB 3.32Å; E498-Q502 WeakPolarHBondContact O-CG 3.48Å; E498-Q502 PolarHBondContact O-N 2.84Å; E498-Q502 PolarHBondContact OE1-NE2 2.88Å; E498-Q502 VanDerWaalsContact OE1-NE2 3.09Å
499	E	31.7	Very low	30.1	Very low	118 Å²	118	134.9 Å²	134.9	55%	0.551	70%	0.695	S	S	*	*	H	α-helix	trans	-64.8	-45.1	-175.5	-167.7	169.3	-165	0	0	112.9	N495 M501 Q502 Q503	N495-E499 PolarHBondContact O-N 2.93Å; E499-M501 VanDerWaalsContact C-N 3.25Å; E499-M501 PolarHBondContact O-N 3.13Å; E499-Q502 PolarHBondContact O-N 3.35Å; E499-Q502 VanDerWaalsContact O-N 3.09Å; E499-Q503 PolarHBondContact O-N 2.91Å; E499-Q503 VanDerWaalsContact O-N 3.1Å
500	V	29.6	Very low	30.1	Very low	109 Å²	109	132.3 Å²	132.3	66%	0.661	70%	0.696	S	S	*	*	H	α-helix	trans	-65.3	-30.1	175.6	-178.9	0	0	0	0	111.7
501	M	35	Very low	30.1	Very low	145 Å²	145	132.4 Å²	132.4	71%	0.714	70%	0.701	S	S	*	*	H	α-helix	trans	-80.4	-20.2	173.8	-69.7	-173.8	64.4	0	0	113.6	I497 E498 E499	I497-M501 HydrophobicContact CG2-SD 4.13Å; I497-M501 WeakPolarHBondContact O-CB 3.41Å; I497-M501 WeakPolarHBondContact O-CG 3.49Å; I497-M501 PolarHBondContact O-N 3.17Å; E498-M501 CarbonylContact O-C 3.58Å; E498-M501 PolarHBondContact O-N 3.32Å; E498-M501 VanDerWaalsContact O-N 3.16Å; E499-M501 VanDerWaalsContact C-N 3.25Å; E499-M501 PolarHBondContact O-N 3.13Å
502	Q	37.6	Very low	30	Very low	99 Å²	99	132 Å²	132	46%	0.463	71%	0.705	S	S	.	*	H	α-helix	trans	-83.7	-28.9	177.1	-74.2	166	11.5	0	0	112.5	E498 E499 V504 T505	E498-Q502 WeakPolarHBondContact O-CB 3.32Å; E498-Q502 WeakPolarHBondContact O-CG 3.48Å; E498-Q502 PolarHBondContact O-N 2.84Å; E498-Q502 PolarHBondContact OE1-NE2 2.88Å; E498-Q502 VanDerWaalsContact OE1-NE2 3.09Å; E499-Q502 PolarHBondContact O-N 3.35Å; E499-Q502 VanDerWaalsContact O-N 3.09Å; Q502-V504 PolarHBondContact O-N 2.77Å; Q502-T505 PolarHBondContact O-N 2.94Å; Q502-T505 VanDerWaalsContact O-N 3.16Å; Q502-T505 PolarHBondContact O-OG1 3.14Å
503	Q	31.4	Very low	30.1	Very low	150 Å²	150	129.5 Å²	129.5	70%	0.701	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.6	-6.1	178.5	-69.4	-173	22.8	0	0	115.4	E499	E499-Q503 PolarHBondContact O-N 2.91Å; E499-Q503 VanDerWaalsContact O-N 3.1Å
504	V	28.2	Very low	30.1	Very low	135 Å²	135	126 Å²	126	82%	0.818	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.3	30.2	169.4	-157.9	0	0	0	0	112	Q502	Q502-V504 PolarHBondContact O-N 2.77Å
505	T	32.7	Very low	30.2	Very low	100 Å²	100	130.5 Å²	130.5	61%	0.613	69%	0.69	S	S	*	*			trans	-82.2	134.3	156	56.2	0	0	0	0	110	Q502	Q502-T505 PolarHBondContact O-N 2.94Å; Q502-T505 VanDerWaalsContact O-N 3.16Å; Q502-T505 PolarHBondContact O-OG1 3.14Å
506	L	26.4	Very low	30.6	Very low	140 Å²	140	129.5 Å²	129.5	73%	0.733	69%	0.688	S	S	*	*				169.6	135.1	128.6	-89.9	164.9	0	0	0	113.6
507	K	27.1	Very low	30.8	Very low	194 Å²	194	127.8 Å²	127.8	84%	0.843	67%	0.672	S	S	*	*			trans	66.1	100.9	153.4	-64.4	163.7	179.2	167.4	0	119.4
508	G	26.9	Very low	30.9	Very low	69 Å²	69	127.2 Å²	127.2	71%	0.711	66%	0.661	S	S	*	*				149.7	109.5	129.7	0	0	0	0	0	119.3
509	Y	27.9	Very low	31	Very low	240 Å²	240	128 Å²	128	94%	0.941	66%	0.663	S	S	*	*			trans	59.9	96.4	154.1	-69.4	-83	0	0	0	119.6
510	S	26.6	Very low	31.5	Very low	118 Å²	118	125.3 Å²	125.3	83%	0.825	66%	0.657	S	S	*	*			trans	-70.2	151.6	158.6	51.1	0	0	0	0	112.6
511	K	29.1	Very low	32	Very low	166 Å²	166	124.7 Å²	124.7	72%	0.722	65%	0.65	S	S	*	*			trans	-118	145.8	154	-76.2	-172.9	175.8	-173.8	0	107.6	V513	K511-V513 PolarHBondContact O-N 3.48Å
512	P	27.3	Very low	32.4	Very low	133 Å²	133	121.7 Å²	121.7	86%	0.864	64%	0.636	S	S	*	*	P	Polyproline II helix	trans	-66.1	121.2	-178.5	26.8	-34	0	0	0	110.5
513	V	29.5	Very low	32.8	Very low	98 Å²	98	121.3 Å²	121.3	59%	0.594	64%	0.635	S	S	*	*	P	Polyproline II helix	trans	-73.7	138	172.5	-176.8	0	0	0	0	108.7	K511 S517 W518	K511-V513 PolarHBondContact O-N 3.48Å; V513-S517 WeakPolarHBondContact CG1-OG 3.41Å; V513-W518 HydrophobicContact CB-CH2 4.39Å; V513-W518 HydrophobicContact CB-CZ2 4.21Å; V513-W518 HydrophobicContact CG1-CH2 3.75Å; V513-W518 HydrophobicContact CG1-CZ2 3.95Å; V513-W518 HydrophobicContact CG1-CZ3 4.38Å
514	S	29.6	Very low	33.5	Very low	75 Å²	75	118.9 Å²	118.9	52%	0.524	62%	0.623	S	S	.	*	P	Polyproline II helix	trans	-73.6	143.8	-170.8	51.2	0	0	0	0	113.1	T516 S517	S514-T516 PolarHBondContact O-N 2.85Å; S514-T516 PolarHBondContact OG-OG1 2.81Å; S514-T516 VanDerWaalsContact OG-OG1 3.08Å; S514-S517 PolarHBondContact O-N 3.14Å; S514-S517 VanDerWaalsContact O-N 3.13Å; S514-S517 PolarHBondContact O-OG 2.75Å
515	R	34.6	Very low	34.2	Very low	241 Å²	241	117.7 Å²	117.7	91%	0.909	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.1	5.1	179.1	-151.6	172.7	-173.6	168.4	1.9	115.9
516	T	36.6	Very low	34.6	Very low	89 Å²	89	114 Å²	114	55%	0.546	59%	0.587	S	S	.	*	T	Hydrogen-bonded Turn	trans	-99.1	-30.9	179.5	44.9	0	0	0	0	114	S514 K519 S520	S514-T516 PolarHBondContact O-N 2.85Å; S514-T516 PolarHBondContact OG-OG1 2.81Å; S514-T516 VanDerWaalsContact OG-OG1 3.08Å; T516-K519 WeakPolarHBondContact O-CB 3.36Å; T516-K519 PolarHBondContact O-N 2.77Å; T516-S520 PolarHBondContact O-N 2.79Å; T516-S520 PolarHBondContact O-OG 3.21Å
517	S	34.9	Very low	35.4	Very low	32 Å²	32	114.6 Å²	114.6	22%	0.224	58%	0.584	C	S	.	*	H	α-helix	trans	-69.4	-43.4	-174	50.2	0	0	0	0	112.6	V513 S514 K519 S520 L521	V513-S517 WeakPolarHBondContact CG1-OG 3.41Å; S514-S517 PolarHBondContact O-N 3.14Å; S514-S517 VanDerWaalsContact O-N 3.13Å; S514-S517 PolarHBondContact O-OG 2.75Å; S517-K519 VanDerWaalsContact C-N 3.25Å; S517-K519 PolarHBondContact O-N 3.17Å; S517-S520 WeakPolarHBondContact O-CB 3.39Å; S517-S520 PolarHBondContact O-N 3.1Å; S517-S520 VanDerWaalsContact O-N 3.12Å; S517-L521 PolarHBondContact O-N 3.23Å
518	W	32.2	Very low	36.4	Very low	110 Å²	110	111.5 Å²	111.5	42%	0.417	57%	0.572	S	S	.	*	H	α-helix	trans	-71.3	-28.9	179.7	-53.4	173	0	0	0	111	V513 L521 L522 E625	V513-W518 HydrophobicContact CB-CH2 4.39Å; V513-W518 HydrophobicContact CB-CZ2 4.21Å; V513-W518 HydrophobicContact CG1-CH2 3.75Å; V513-W518 HydrophobicContact CG1-CZ2 3.95Å; V513-W518 HydrophobicContact CG1-CZ3 4.38Å; W518-L521 HydrophobicContact CE3-CD1 3.98Å; W518-L521 HydrophobicContact CZ3-CD1 4.3Å; W518-L521 PolarHBondContact O-N 3.32Å; W518-L522 WeakPolarHBondContact O-CG 3.35Å; W518-L522 PolarHBondContact O-N 2.7Å; W518-E625 VanDerWaalsContact NE1-CD 3.27Å; W518-E625 PolarHBondContact NE1-OE1 3.05Å; W518-E625 PolarHBondContact NE1-OE2 3.47Å
519	K	37	Very low	37.3	Very low	128 Å²	128	112 Å²	112	56%	0.557	56%	0.557	S	S	*	*	H	α-helix	trans	-63.8	-44.4	168.4	-163	163.7	-170.7	164.5	0	111.1	T516 S517 L522 E523	T516-K519 WeakPolarHBondContact O-CB 3.36Å; T516-K519 PolarHBondContact O-N 2.77Å; S517-K519 VanDerWaalsContact C-N 3.25Å; S517-K519 PolarHBondContact O-N 3.17Å; K519-L522 PolarHBondContact O-N 2.72Å; K519-E523 WeakPolarHBondContact CE-OE1 3.24Å; K519-E523 HydrophobicContact CG-CG 4.27Å; K519-E523 WeakPolarHBondContact CG-OE1 3.4Å; K519-E523 WeakPolarHBondContact O-CB 3.43Å; K519-E523 WeakPolarHBondContact O-CG 3.34Å; K519-E523 PolarHBondContact O-N 3.47Å
520	S	41.7	Very low	38.3	Very low	61 Å²	61	103 Å²	103	43%	0.427	53%	0.533	S	S	.	.	H	α-helix	trans	-62.2	-40.4	172.2	-62.6	0	0	0	0	113	T516 S517 E523 E524	T516-S520 PolarHBondContact O-N 2.79Å; T516-S520 PolarHBondContact O-OG 3.21Å; S517-S520 WeakPolarHBondContact O-CB 3.39Å; S517-S520 PolarHBondContact O-N 3.1Å; S517-S520 VanDerWaalsContact O-N 3.12Å; S520-E523 PolarHBondContact O-N 2.93Å; S520-E524 VanDerWaalsContact O-CB 3.31Å; S520-E524 WeakPolarHBondContact O-CB 3.12Å; S520-E524 WeakPolarHBondContact O-CG 3.35Å; S520-E524 PolarHBondContact O-N 3.1Å
521	L	40.8	Very low	39.5	Very low	96 Å²	96	102 Å²	102	50%	0.503	52%	0.516	S	S	.	.	H	α-helix	trans	-63.3	-44	176.9	-95.1	160.1	0	0	0	112.5	S517 W518 Y525	S517-L521 PolarHBondContact O-N 3.23Å; W518-L521 HydrophobicContact CE3-CD1 3.98Å; W518-L521 HydrophobicContact CZ3-CD1 4.3Å; W518-L521 PolarHBondContact O-N 3.32Å; L521-Y525 HydrophobicContact CD2-CD2 3.99Å; L521-Y525 HydrophobicContact CD2-CE2 4.14Å; L521-Y525 WeakPolarHBondContact O-CB 3.24Å; L521-Y525 WeakPolarHBondContact O-CD2 3.48Å; L521-Y525 PolarHBondContact O-N 3.48Å; L521-Y525 VanDerWaalsContact O-N 3.15Å
522	L	42.5	Very low	40.4	Very low	81 Å²	81	98.3 Å²	98.3	42%	0.424	50%	0.502	S	S	.	.	I	π-helix	trans	-72.1	-30.8	176.3	-69.3	168.6	0	0	0	112.6	W518 K519 G526	W518-L522 WeakPolarHBondContact O-CG 3.35Å; W518-L522 PolarHBondContact O-N 2.7Å; K519-L522 PolarHBondContact O-N 2.72Å; L522-G526 WeakPolarHBondContact O-CA 3.43Å; L522-G526 PolarHBondContact O-N 2.88Å
523	E	47.1	Very low	41	Very low	92 Å²	92	96.7 Å²	96.7	43%	0.43	48%	0.479	S	S	.	.	I	π-helix	trans	-83.6	-27.5	178.7	-69.2	-177.8	174.4	0	0	114.3	K275 K519 S520	K275-E523 IonicContact NZ-OE1 2.69Å; K275-E523 PolarHBondContact NZ-OE1 3.11Å; K275-E523 IonicContact NZ-OE2 2.76Å; K275-E523 PolarHBondContact NZ-OE2 2.88Å; K519-E523 WeakPolarHBondContact CE-OE1 3.24Å; K519-E523 HydrophobicContact CG-CG 4.27Å; K519-E523 WeakPolarHBondContact CG-OE1 3.4Å; K519-E523 WeakPolarHBondContact O-CB 3.43Å; K519-E523 WeakPolarHBondContact O-CG 3.34Å; K519-E523 PolarHBondContact O-N 3.47Å; S520-E523 PolarHBondContact O-N 2.93Å
524	E	46.1	Very low	41.6	Very low	98 Å²	98	97.2 Å²	97.2	46%	0.458	48%	0.478	S	S	.	.	I	π-helix	trans	-84.3	-30	173.6	-71.9	-158.3	106.3	0	0	112.9	K415 S520	K415-E524 IonicContact NZ-OE1 3.55Å; K415-E524 PolarHBondContact NZ-OE1 3.48Å; K415-E524 IonicContact NZ-OE2 2.78Å; S520-E524 VanDerWaalsContact O-CB 3.31Å; S520-E524 WeakPolarHBondContact O-CB 3.12Å; S520-E524 WeakPolarHBondContact O-CG 3.35Å; S520-E524 PolarHBondContact O-N 3.1Å
525	Y	41.9	Very low	42.2	Very low	110 Å²	110	98.2 Å²	98.2	43%	0.431	48%	0.475	S	S	.	.	I	π-helix	trans	-118.6	-36	-173.6	-63.1	-83.9	0	0	0	114.9	L521 F527 I529	L521-Y525 HydrophobicContact CD2-CD2 3.99Å; L521-Y525 HydrophobicContact CD2-CE2 4.14Å; L521-Y525 WeakPolarHBondContact O-CB 3.24Å; L521-Y525 WeakPolarHBondContact O-CD2 3.48Å; L521-Y525 PolarHBondContact O-N 3.48Å; L521-Y525 VanDerWaalsContact O-N 3.15Å; Y525-F527 PolarHBondContact O-N 3.04Å; Y525-I529 WeakPolarHBondContact O-CB 3.38Å; Y525-I529 VanDerWaalsContact O-CG1 3.26Å; Y525-I529 WeakPolarHBondContact O-CG1 3.26Å; Y525-I529 PolarHBondContact O-N 2.87Å; Y525-I529 VanDerWaalsContact O-N 3.11Å
526	G	42	Very low	42.3	Very low	23 Å²	23	88.8 Å²	88.8	24%	0.237	45%	0.446	C	S	.	.	I	π-helix	trans	-63.2	-38.4	-172.9	0	0	0	0	0	113.7	L522 A530	L522-G526 WeakPolarHBondContact O-CA 3.43Å; L522-G526 PolarHBondContact O-N 2.88Å; G526-A530 VanDerWaalsContact O-CB 3.28Å; G526-A530 WeakPolarHBondContact O-CB 3.08Å; G526-A530 PolarHBondContact O-N 3.44Å; G526-A530 VanDerWaalsContact O-N 3.15Å
527	F	42.6	Very low	42.5	Very low	153 Å²	153	86.4 Å²	86.4	67%	0.671	43%	0.433	S	S	*	.	H	α-helix	trans	-75.5	-41.3	-176.7	-151.7	-85.2	0	0	0	113	Y525 M531	Y525-F527 PolarHBondContact O-N 3.04Å; F527-M531 HydrophobicContact CD1-CG 4.46Å; F527-M531 HydrophobicContact CD1-SD 3.99Å; F527-M531 HydrophobicContact CE1-CG 4.35Å; F527-M531 HydrophobicContact CE1-SD 3.81Å; F527-M531 WeakPolarHBondContact O-CB 3.14Å; F527-M531 PolarHBondContact O-N 3.42Å
528	E	48	Very low	42.4	Very low	128 Å²	128	88.2 Å²	88.2	60%	0.598	45%	0.445	S	S	*	.	H	α-helix	trans	-69.3	-42.1	176.6	-79.9	-167.3	148.3	0	0	111.6	A530 M531 Q532	E528-A530 PolarHBondContact O-N 2.88Å; E528-M531 PolarHBondContact O-N 3.18Å; E528-Q532 VanDerWaalsContact O-CB 3.23Å; E528-Q532 WeakPolarHBondContact O-CB 3.31Å; E528-Q532 PolarHBondContact O-N 3.32Å
529	I	46.1	Very low	42.5	Very low	79 Å²	79	90.4 Å²	90.4	41%	0.405	45%	0.453	S	S	.	.	H	α-helix	trans	-64.3	-42.8	179.1	-65.6	170.4	0	0	0	110.9	Y525 Q532 Y533 F635	Y525-I529 WeakPolarHBondContact O-CB 3.38Å; Y525-I529 VanDerWaalsContact O-CG1 3.26Å; Y525-I529 WeakPolarHBondContact O-CG1 3.26Å; Y525-I529 PolarHBondContact O-N 2.87Å; Y525-I529 VanDerWaalsContact O-N 3.11Å; I529-Q532 PolarHBondContact O-N 3.14Å; I529-Y533 WeakPolarHBondContact O-CB 3.16Å; I529-Y533 PolarHBondContact O-N 3.21Å; I529-F635 HydrophobicContact CG2-CD1 4.05Å; I529-F635 HydrophobicContact CG2-CE1 3.52Å; I529-F635 HydrophobicContact CG2-CZ 4.39Å
530	A	47.3	Very low	42.5	Very low	51 Å²	51	88.3 Å²	88.3	42%	0.421	44%	0.444	S	S	.	.	H	α-helix	trans	-64.2	-44.2	175.4	0	0	0	0	0	112.4	G526 E528 Q532 N534	G526-A530 VanDerWaalsContact O-CB 3.28Å; G526-A530 WeakPolarHBondContact O-CB 3.08Å; G526-A530 PolarHBondContact O-N 3.44Å; G526-A530 VanDerWaalsContact O-N 3.15Å; E528-A530 PolarHBondContact O-N 2.88Å; A530-Q532 PolarHBondContact O-N 3.49Å; A530-N534 WeakPolarHBondContact O-CB 3.32Å; A530-N534 PolarHBondContact O-N 3.06Å
531	M	52.5	Low	42.1	Very low	97 Å²	97	90.9 Å²	90.9	48%	0.478	45%	0.452	S	S	.	.	H	α-helix	trans	-58.8	-46.1	173.5	-98.2	179.3	47.9	0	0	112	F527 E528 N534 E535	F527-M531 HydrophobicContact CD1-CG 4.46Å; F527-M531 HydrophobicContact CD1-SD 3.99Å; F527-M531 HydrophobicContact CE1-CG 4.35Å; F527-M531 HydrophobicContact CE1-SD 3.81Å; F527-M531 WeakPolarHBondContact O-CB 3.14Å; F527-M531 PolarHBondContact O-N 3.42Å; E528-M531 PolarHBondContact O-N 3.18Å; M531-N534 PolarHBondContact O-N 2.92Å; M531-E535 WeakPolarHBondContact O-CB 3.26Å; M531-E535 PolarHBondContact O-N 3.13Å
532	Q	47.9	Very low	41.5	Very low	90 Å²	90	93.1 Å²	93.1	42%	0.421	47%	0.465	S	S	.	.	H	α-helix	trans	-75.3	-28.9	-173.3	-160.4	164.4	23.6	0	0	112.2	E528 I529 A530 S536	E528-Q532 VanDerWaalsContact O-CB 3.23Å; E528-Q532 WeakPolarHBondContact O-CB 3.31Å; E528-Q532 PolarHBondContact O-N 3.32Å; I529-Q532 PolarHBondContact O-N 3.14Å; A530-Q532 PolarHBondContact O-N 3.49Å; Q532-S536 VanDerWaalsContact O-CB 3.31Å; Q532-S536 WeakPolarHBondContact O-CB 3.4Å; Q532-S536 PolarHBondContact O-N 2.72Å; Q532-S536 VanDerWaalsContact O-N 3.12Å; Q532-S536 PolarHBondContact O-OG 3.1Å
533	Y	39.7	Very low	41	Very low	99 Å²	99	96.3 Å²	96.3	39%	0.388	48%	0.481	S	S	.	.	H	α-helix	trans	-65.9	-50	166.3	-174.4	-94.7	0	0	0	111.1	I529 E535 S536 S537 L594 F635	I529-Y533 WeakPolarHBondContact O-CB 3.16Å; I529-Y533 PolarHBondContact O-N 3.21Å; Y533-E535 PolarHBondContact O-N 3.22Å; Y533-S536 PolarHBondContact O-N 3.35Å; Y533-S536 VanDerWaalsContact O-N 3.09Å; Y533-S536 PolarHBondContact O-OG 3.43Å; Y533-S536 VanDerWaalsContact O-OG 3.08Å; Y533-S537 PolarHBondContact O-N 3.16Å; Y533-S537 PolarHBondContact O-OG 2.68Å; Y533-L594 HydrophobicContact CE1-CD1 4.31Å; Y533-F635 HydrophobicContact CD2-CE2 4.34Å; Y533-F635 AromaticContact CD2-CZ 3.61Å; Y533-F635 HydrophobicContact CD2-CZ 3.61Å; Y533-F635 HydrophobicContact CE2-CE2 4.31Å; Y533-F635 HydrophobicContact CE2-CZ 4.02Å; Y533-F635 HydrophobicContact CG-CZ 4.16Å
534	N	41.9	Very low	40.1	Very low	108 Å²	108	95.7 Å²	95.7	58%	0.578	49%	0.487	S	S	*	.	H	α-helix	trans	-62.9	-44.2	-179.5	-153.7	14.7	0	0	0	111.8	A530 M531 S536 S537 C538	A530-N534 WeakPolarHBondContact O-CB 3.32Å; A530-N534 PolarHBondContact O-N 3.06Å; M531-N534 PolarHBondContact O-N 2.92Å; N534-S536 VanDerWaalsContact C-N 3.28Å; N534-S536 PolarHBondContact O-N 3.41Å; N534-S537 PolarHBondContact O-N 2.82Å; N534-C538 PolarHBondContact O-N 3.3Å; N534-C538 PolarHBondContact O-SG 3.05Å
535	E	43.6	Very low	39.3	Very low	96 Å²	96	100 Å²	100	45%	0.449	51%	0.507	S	S	.	.	H	α-helix	trans	-62.6	-28.8	173.1	-82.5	-162.2	-152.8	0	0	113.9	M531 Y533 R539	M531-E535 WeakPolarHBondContact O-CB 3.26Å; M531-E535 PolarHBondContact O-N 3.13Å; Y533-E535 PolarHBondContact O-N 3.22Å; E535-R539 WeakPolarHBondContact O-CD 3.3Å; E535-R539 WeakPolarHBondContact O-CG 3.5Å; E535-R539 PolarHBondContact O-N 2.91Å; E535-R539 PolarHBondContact O-NE 3.01Å; E535-R539 IonicContact OE2-CZ 2.61Å; E535-R539 IonicContact OE2-NH2 2.66Å; E535-R539 PolarHBondContact OE2-NH2 2.68Å
536	S	37	Very low	38.6	Very low	44 Å²	44	99.9 Å²	99.9	31%	0.308	52%	0.523	S	S	.	.	H	α-helix	trans	-88.6	-28.5	179.4	56.1	0	0	0	0	113.2	Q532 Y533 N534 R539 K540	Q532-S536 VanDerWaalsContact O-CB 3.31Å; Q532-S536 WeakPolarHBondContact O-CB 3.4Å; Q532-S536 PolarHBondContact O-N 2.72Å; Q532-S536 VanDerWaalsContact O-N 3.12Å; Q532-S536 PolarHBondContact O-OG 3.1Å; Y533-S536 PolarHBondContact O-N 3.35Å; Y533-S536 VanDerWaalsContact O-N 3.09Å; Y533-S536 PolarHBondContact O-OG 3.43Å; Y533-S536 VanDerWaalsContact O-OG 3.08Å; N534-S536 VanDerWaalsContact C-N 3.28Å; N534-S536 PolarHBondContact O-N 3.41Å; S536-R539 PolarHBondContact O-N 3.25Å; S536-K540 PolarHBondContact O-N 2.86Å; S536-K540 VanDerWaalsContact O-N 3.13Å
537	S	39.8	Very low	37.9	Very low	39 Å²	39	109.9 Å²	109.9	27%	0.273	55%	0.553	S	S	.	*	H	α-helix	trans	-67.6	-47.2	168.3	-67.9	0	0	0	0	111.6	Y533 N534 R539 K540 L541	Y533-S537 PolarHBondContact O-N 3.16Å; Y533-S537 PolarHBondContact O-OG 2.68Å; N534-S537 PolarHBondContact O-N 2.82Å; S537-R539 PolarHBondContact O-N 3.16Å; S537-R539 VanDerWaalsContact O-N 3.15Å; S537-K540 PolarHBondContact O-N 2.98Å; S537-L541 PolarHBondContact O-N 3.32Å
538	C	33.4	Very low	37.1	Very low	69 Å²	69	107.7 Å²	107.7	47%	0.466	56%	0.556	S	S	.	*	H	α-helix	trans	-58.5	-28.8	173.8	-70.7	0	0	0	0	113.3	N534 N542	N534-C538 PolarHBondContact O-N 3.3Å; N534-C538 PolarHBondContact O-SG 3.05Å; C538-N542 PolarHBondContact O-ND2 3.18Å
539	R	34.2	Very low	36.2	Very low	157 Å²	157	109.9 Å²	109.9	59%	0.592	57%	0.566	S	S	*	*	H	α-helix	trans	-82.1	-19.2	175.2	-72.6	176.7	-148.7	-160.4	8.5	114.5	E535 S536 S537 L543	E535-R539 WeakPolarHBondContact O-CD 3.3Å; E535-R539 WeakPolarHBondContact O-CG 3.5Å; E535-R539 PolarHBondContact O-N 2.91Å; E535-R539 PolarHBondContact O-NE 3.01Å; E535-R539 IonicContact OE2-CZ 2.61Å; E535-R539 IonicContact OE2-NH2 2.66Å; E535-R539 PolarHBondContact OE2-NH2 2.68Å; S536-R539 PolarHBondContact O-N 3.25Å; S537-R539 PolarHBondContact O-N 3.16Å; S537-R539 VanDerWaalsContact O-N 3.15Å; R539-L543 VanDerWaalsContact O-CD1 3.23Å; R539-L543 WeakPolarHBondContact O-CD1 3.17Å
540	K	35.8	Very low	35.3	Very low	84 Å²	84	111.2 Å²	111.2	37%	0.365	58%	0.582	S	S	.	*	H	α-helix	trans	-93.2	-30.4	176.6	-71.1	-166.6	-176.6	-113.3	0	113.1	S536 S537 N542 L543 S544 E646	S536-K540 PolarHBondContact O-N 2.86Å; S536-K540 VanDerWaalsContact O-N 3.13Å; S537-K540 PolarHBondContact O-N 2.98Å; K540-N542 VanDerWaalsContact C-N 3.28Å; K540-N542 PolarHBondContact O-N 3.46Å; K540-L543 PolarHBondContact O-N 3.05Å; K540-L543 VanDerWaalsContact O-N 3.11Å; K540-S544 PolarHBondContact O-OG 3.19Å; K540-E646 VanDerWaalsContact CE-OE2 3.26Å; K540-E646 WeakPolarHBondContact CE-OE2 3.26Å; K540-E646 IonicContact NZ-OE1 3.08Å; K540-E646 PolarHBondContact NZ-OE1 2.94Å; K540-E646 IonicContact NZ-OE2 2.65Å; K540-E646 PolarHBondContact NZ-OE2 2.66Å
541	L	34.2	Very low	34.8	Very low	115 Å²	115	114.7 Å²	114.7	60%	0.602	60%	0.6	S	S	*	*	H	α-helix	trans	-63.3	-34.1	170.3	-67.2	170.6	0	0	0	112.2	S537 L543	S537-L541 PolarHBondContact O-N 3.32Å; L541-L543 PolarHBondContact O-N 2.88Å; L541-L543 VanDerWaalsContact O-N 3.11Å
542	N	28.1	Very low	33.7	Very low	142 Å²	142	115.7 Å²	115.7	76%	0.759	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.1	11.5	172.9	-82.2	-91	0	0	0	114.6	C538 K540	C538-N542 PolarHBondContact O-ND2 3.18Å; K540-N542 VanDerWaalsContact C-N 3.28Å; K540-N542 PolarHBondContact O-N 3.46Å
543	L	31.4	Very low	32.7	Very low	149 Å²	149	118.2 Å²	118.2	78%	0.78	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-135.9	9	-177.5	-96.4	105.8	0	0	0	114.6	R539 K540 L541	R539-L543 VanDerWaalsContact O-CD1 3.23Å; R539-L543 WeakPolarHBondContact O-CD1 3.17Å; K540-L543 PolarHBondContact O-N 3.05Å; K540-L543 VanDerWaalsContact O-N 3.11Å; L541-L543 PolarHBondContact O-N 2.88Å; L541-L543 VanDerWaalsContact O-N 3.11Å
544	S	28.9	Very low	32.1	Very low	78 Å²	78	119.6 Å²	119.6	55%	0.545	64%	0.642	S	S	.	*	T	Hydrogen-bonded Turn	trans	-123	-21.8	-177.2	51.4	0	0	0	0	115.7	K540 S546	K540-S544 PolarHBondContact O-OG 3.19Å; S544-S546 VanDerWaalsContact C-N 3.31Å; S544-S546 PolarHBondContact O-N 3.14Å
545	E	29	Very low	31.6	Very low	188 Å²	188	122 Å²	122	88%	0.879	65%	0.65	S	S	*	*			trans	-84.9	70.7	178.9	-72.4	-177.9	127.6	0	0	111.9
546	S	26.7	Very low	30.8	Very low	109 Å²	109	125.5 Å²	125.5	76%	0.762	67%	0.667	S	S	*	*			trans	-147	38.7	170.1	75.7	0	0	0	0	113.2	S544	S544-S546 VanDerWaalsContact C-N 3.31Å; S544-S546 PolarHBondContact O-N 3.14Å
547	R	28.8	Very low	30.5	Very low	232 Å²	232	131.4 Å²	131.4	88%	0.875	69%	0.693	S	S	*	*			trans	-161.5	125	169	-120.5	174.9	-168.4	-166.1	0.3	113.9
548	C	25	Very low	30	Very low	107 Å²	107	138.1 Å²	138.1	72%	0.723	72%	0.72	S	S	*	*			trans	43.8	149.9	147.7	59.5	0	0	0	0	122.9
549	H	28.7	Very low	30.6	Very low	175 Å²	175	140.4 Å²	140.4	81%	0.81	73%	0.734	S	S	*	*			cis	-174.3	127.3	-34.1	-122.9	-73.7	0	0	0	108.5
550	S	26.7	Very low	30.6	Very low	107 Å²	107	138.3 Å²	138.3	75%	0.748	74%	0.741	S	S	*	*			trans	48.6	129.5	157.8	47	0	0	0	0	122.1
551	P	36.7	Very low	30.1	Very low	123 Å²	123	142.5 Å²	142.5	80%	0.799	77%	0.766	S	S	*	*			trans	-109.8	172.4	175.2	42.2	-34.8	0	0	0	114.8
552	T	30.1	Very low	29.9	Very low	119 Å²	119	140.6 Å²	140.6	73%	0.73	77%	0.767	S	S	*	*			trans	-159.4	123.4	151.4	42.8	0	0	0	0	112.6
553	D	27.2	Very low	30	Very low	143 Å²	143	143.1 Å²	143.1	77%	0.765	77%	0.771	S	S	*	*				68.5	136.6	126	-49.1	-17.9	0	0	0	125.4
554	N	27.3	Very low	29.8	Very low	127 Å²	127	143.8 Å²	143.8	68%	0.679	77%	0.768	S	S	*	*			trans	88.5	118.9	144.3	-75.2	23.1	0	0	0	125.5
555	E	29.9	Very low	29.7	Very low	158 Å²	158	143.3 Å²	143.3	74%	0.738	76%	0.764	S	S	*	*				82.1	126	128.4	-67.6	171.2	137.9	0	0	123.8
556	E	26.9	Very low	29.7	Very low	171 Å²	171	142 Å²	142	80%	0.799	76%	0.758	S	S	*	*			trans	22.9	137.2	145.2	-49.3	-168.5	139.9	0	0	123.3
557	I	31.7	Very low	29.7	Very low	168 Å²	168	141.6 Å²	141.6	86%	0.862	76%	0.755	S	S	*	*				172.7	153.2	115.7	-87.9	158.6	0	0	0	112
558	E	29.3	Very low	29.8	Very low	180 Å²	180	136.1 Å²	136.1	84%	0.841	75%	0.752	S	S	*	*			trans	-78.3	162.4	-177.2	-84.8	-165.8	112.1	0	0	116.7
559	P	46.7	Very low	29.9	Very low	116 Å²	116	135.9 Å²	135.9	75%	0.753	75%	0.752	S	S	*	*			trans	-100.5	163.3	177.8	39.8	-35.5	0	0	0	114.9
560	P	33.8	Very low	29.8	Very low	114 Å²	114	134.6 Å²	134.6	74%	0.74	75%	0.751	S	S	*	*			trans	-138.2	131	156.6	34.8	-18.6	0	0	0	116.8
561	L	25.8	Very low	29.8	Very low	172 Å²	172	134.7 Å²	134.7	90%	0.901	75%	0.752	S	S	*	*				31.3	136.7	125.1	-52	167.8	0	0	0	118.5
562	A	29.3	Very low	29.4	Very low	74 Å²	74	134.6 Å²	134.6	61%	0.612	75%	0.749	S	S	*	*			cis	-179.1	163.3	42.2	0	0	0	0	0	114.3
563	K	29.8	Very low	29.2	Very low	196 Å²	196	133.5 Å²	133.5	85%	0.852	75%	0.752	S	S	*	*			trans	42.8	140.4	136.3	-59.2	159.1	-166.4	169.8	0	119.3
564	K	28	Very low	29.2	Very low	163 Å²	163	134.4 Å²	134.4	71%	0.709	76%	0.757	S	S	*	*			cis	-177.1	174.1	11.6	-113.7	-177.4	131.7	-83.1	0	106	H566	K564-H566 PolarHBondContact NZ-NE2 3.44Å
565	S	27	Very low	29.3	Very low	68 Å²	68	130.8 Å²	130.8	48%	0.476	74%	0.741	S	S	.	*			cis	166.3	165.6	-27.3	57.4	0	0	0	0	110.4
566	H	28.6	Very low	29.3	Very low	160 Å²	160	129.9 Å²	129.9	74%	0.741	74%	0.74	S	S	*	*			trans	81.5	145.2	173.4	-52.8	-68.8	0	0	0	115.8	K564	K564-H566 PolarHBondContact NZ-NE2 3.44Å
567	S	27.4	Very low	29.5	Very low	100 Å²	100	125.6 Å²	125.6	70%	0.699	72%	0.717	S	S	*	*			cis	-169.4	172.4	-10.7	44.1	0	0	0	0	112.2
568	S	29.2	Very low	29.6	Very low	117 Å²	117	122 Å²	122	82%	0.818	70%	0.698	S	S	*	*			trans	73.5	145.8	171.4	73.1	0	0	0	0	117.3
569	S	27.5	Very low	29.9	Very low	102 Å²	102	121.9 Å²	121.9	71%	0.713	70%	0.695	S	S	*	*			cis	-161.9	156.9	-17.9	42.5	0	0	0	0	111.9
570	D	26.1	Very low	29.3	Very low	148 Å²	148	125.4 Å²	125.4	79%	0.791	70%	0.702	S	S	*	*			trans	68.6	132.7	162.9	-84.9	-49.3	0	0	0	123.6
571	S	26.5	Very low	29.3	Very low	110 Å²	110	126.4 Å²	126.4	77%	0.769	70%	0.698	S	S	*	*			trans	72.1	48.8	144.4	73.6	0	0	0	0	122.1
572	T	28.5	Very low	29.4	Very low	120 Å²	120	122.4 Å²	122.4	74%	0.736	69%	0.69	S	S	*	*			trans	-146.8	105.7	158.5	-56.3	0	0	0	0	113.6
573	A	25.7	Very low	29.7	Very low	97 Å²	97	124.8 Å²	124.8	80%	0.802	69%	0.691	S	S	*	*			trans	-109.6	3.8	178.4	0	0	0	0	0	114.8
574	N	28	Very low	29.7	Very low	161 Å²	161	120.7 Å²	120.7	86%	0.861	68%	0.684	S	S	*	*	S	Bend	trans	-123.6	41.7	-173.2	-72.9	-48.2	0	0	0	112.7
575	S	28.8	Very low	29.7	Very low	51 Å²	51	116.9 Å²	116.9	36%	0.357	68%	0.683	S	S	.	*			trans	-152.8	68.4	-174.7	-162.1	0	0	0	0	113.7
576	I	31.5	Very low	29.9	Very low	140 Å²	140	116.4 Å²	116.4	72%	0.718	69%	0.689	S	S	*	*	S	Bend	trans	-108.9	-33.5	173.8	-67.1	177.8	0	0	0	111.7	I578	I576-I578 VanDerWaalsContact C-N 3.28Å; I576-I578 PolarHBondContact O-N 3.03Å
577	W	30.6	Very low	30	Very low	80 Å²	80	114.6 Å²	114.6	30%	0.303	69%	0.692	S	S	.	*	T	Hydrogen-bonded Turn	trans	-76.7	-4	-175.8	-74.8	46.9	0	0	0	115.4	V599 F600 V623	W577-V599 HydrophobicContact CD2-CG2 4.4Å; W577-V599 HydrophobicContact CZ2-CB 4.35Å; W577-V599 HydrophobicContact CZ2-CG2 4.03Å; W577-F600 HydrophobicContact CZ2-CE2 4.2Å; W577-F600 HydrophobicContact CZ2-CZ 4.47Å; W577-V623 HydrophobicContact CH2-CG1 4.4Å; W577-V623 HydrophobicContact CH2-CG2 4.43Å; W577-V623 HydrophobicContact CZ3-CG1 3.98Å
578	I	32.6	Very low	30	Very low	92 Å²	92	118.3 Å²	118.3	47%	0.472	70%	0.698	S	S	.	*	T	Hydrogen-bonded Turn	trans	-112.8	-19.1	-165	-63.3	178.2	0	0	0	113.5	I576	I576-I578 VanDerWaalsContact C-N 3.28Å; I576-I578 PolarHBondContact O-N 3.03Å
579	K	36	Very low	30	Very low	178 Å²	178	119.5 Å²	119.5	77%	0.774	70%	0.695	S	S	*	*	S	Bend	trans	-90.2	-11.2	-165.5	-109	-179.8	177.4	-179.8	0	117.2
580	E	35.4	Very low	30.3	Very low	191 Å²	191	122.1 Å²	122.1	89%	0.893	70%	0.696	S	S	*	*	S	Bend	trans	-104.8	-5.4	179.7	-65.2	-172.5	137	0	0	114.1	A582	E580-A582 VanDerWaalsContact C-N 3.27Å; E580-A582 PolarHBondContact O-N 3.32Å
581	M	32.1	Very low	30.6	Very low	134 Å²	134	120.9 Å²	120.9	66%	0.66	70%	0.696	S	S	*	*			trans	-90.8	42.1	179.6	-62.9	-164.8	-177.7	0	0	113.5	I583	M581-I583 PolarHBondContact O-N 3.32Å
582	A	29.6	Very low	30.9	Very low	88 Å²	88	120.1 Å²	120.1	73%	0.727	68%	0.68	S	S	*	*			trans	-77.6	100.2	174.8	0	0	0	0	0	110.7	E580 P584	E580-A582 VanDerWaalsContact C-N 3.27Å; E580-A582 PolarHBondContact O-N 3.32Å; A582-P584 WeakPolarHBondContact O-CD 3.27Å
583	I	33.8	Very low	31.4	Very low	125 Å²	125	120.8 Å²	120.8	64%	0.641	68%	0.678	S	S	*	*			trans	-73.4	118.9	179.2	-56.5	176.8	0	0	0	109.5	M581 L593	M581-I583 PolarHBondContact O-N 3.32Å; I583-L593 HydrophobicContact CG1-CD2 4.44Å; I583-L593 HydrophobicContact CG2-CD1 4.37Å; I583-L593 HydrophobicContact CG2-CD2 4.38Å
584	P	30	Very low	32.5	Very low	109 Å²	109	118.8 Å²	118.8	71%	0.708	65%	0.654	S	S	*	*			trans	-68.3	141.5	-176.2	27.3	-34.7	0	0	0	112.4	A582 G586	A582-P584 WeakPolarHBondContact O-CD 3.27Å; P584-G586 PolarHBondContact O-N 2.87Å
585	A	28.6	Very low	33.6	Very low	83 Å²	83	117.7 Å²	117.7	69%	0.686	64%	0.638	S	S	*	*			trans	-94.9	51.8	-171.8	0	0	0	0	0	113.6	R490	R490-A585 PolarHBondContact NH2-O 2.65Å; R490-A585 VanDerWaalsContact NH2-O 3.15Å
586	G	31.7	Very low	35.3	Very low	59 Å²	59	116 Å²	116	61%	0.608	63%	0.625	S	S	*	*			trans	-115.5	151.6	176.9	0	0	0	0	0	113.3	P584	P584-G586 PolarHBondContact O-N 2.87Å
587	P	29.9	Very low	37.3	Very low	121 Å²	121	115.3 Å²	115.3	79%	0.786	61%	0.614	S	S	*	*	S	Bend	trans	-81.1	152.3	164.8	35.4	-33.1	0	0	0	111
588	E	28.7	Very low	39.6	Very low	178 Å²	178	111.5 Å²	111.5	83%	0.832	60%	0.599	S	S	*	*	S	Bend	trans	73	148.3	173	-41.1	-158.1	166.9	0	0	115.9
589	N	28.8	Very low	41.3	Very low	142 Å²	142	111.2 Å²	111.2	76%	0.759	60%	0.602	S	S	*	*			trans	57.1	105.5	178	-55.7	-28.3	0	0	0	119.3
590	H	33.8	Very low	42.9	Very low	158 Å²	158	106.4 Å²	106.4	73%	0.731	58%	0.581	S	S	*	*				156.3	148.9	120.4	-89.9	-83.1	0	0	0	113.8
591	P	31	Very low	44.9	Very low	121 Å²	121	99.6 Å²	99.6	79%	0.786	55%	0.554	S	S	*	*	S	Bend	trans	-97.8	12.9	-169	38.1	-37.7	0	0	0	116.8
592	E	34.7	Very low	46.9	Very low	95 Å²	95	97.9 Å²	97.9	44%	0.444	55%	0.547	S	S	.	.			trans	-108.5	0.1	-153.5	-53.1	-162.9	118.8	0	0	117.6	L594 R595	E592-L594 PolarHBondContact O-N 2.77Å; E592-R595 PolarHBondContact O-N 3.25Å; E592-R595 IonicContact OE1-CZ 3.6Å; E592-R595 IonicContact OE1-NH1 3.77Å; E592-R595 PolarHBondContact OE1-NH1 3.42Å; E592-R595 IonicContact OE1-NH2 2.7Å; E592-R595 PolarHBondContact OE1-NH2 3.28Å; E592-R595 IonicContact OE2-NH1 2.68Å
593	L	38.6	Very low	48.7	Very low	134 Å²	134	97.1 Å²	97.1	70%	0.702	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	26.1	-169.3	-73.1	169.8	0	0	0	117.2	I583	I583-L593 HydrophobicContact CG1-CD2 4.44Å; I583-L593 HydrophobicContact CG2-CD1 4.37Å; I583-L593 HydrophobicContact CG2-CD2 4.38Å
594	L	49	Very low	50.7	Low	54 Å²	54	95.9 Å²	95.9	28%	0.283	52%	0.521	S	S	.	.	T	Hydrogen-bonded Turn	trans	-139.3	9.4	174.6	-93.3	169.1	0	0	0	114.5	Y533 E592 C596 F605 S606 G607	Y533-L594 HydrophobicContact CE1-CD1 4.31Å; E592-L594 PolarHBondContact O-N 2.77Å; L594-C596 PolarHBondContact O-N 2.91Å; L594-C596 VanDerWaalsContact O-N 3.17Å; L594-F605 VanDerWaalsContact O-O 3.04Å; L594-S606 CarbonylContact O-C 3.57Å; L594-S606 VanDerWaalsContact O-C 3.31Å; L594-G607 VanDerWaalsContact O-CA 3.31Å; L594-G607 WeakPolarHBondContact O-CA 3.31Å; L594-G607 PolarHBondContact O-N 2.85Å; L594-G607 VanDerWaalsContact O-N 3.09Å
595	R	49.6	Very low	52.7	Low	139 Å²	139	92 Å²	92	53%	0.525	49%	0.493	S	S	.	.			trans	-68.6	110.2	165.3	-65.9	-154.9	-166.6	93.6	6.8	109.4	E592 E604 F605	E592-R595 PolarHBondContact O-N 3.25Å; E592-R595 IonicContact OE1-CZ 3.6Å; E592-R595 IonicContact OE1-NH1 3.77Å; E592-R595 PolarHBondContact OE1-NH1 3.42Å; E592-R595 IonicContact OE1-NH2 2.7Å; E592-R595 PolarHBondContact OE1-NH2 3.28Å; E592-R595 IonicContact OE2-NH1 2.68Å; R595-E604 WeakPolarHBondContact CD-OE2 3.19Å; R595-E604 IonicContact NE-OE2 2.58Å; R595-F605 CarbonylContact C-O 3.46Å; R595-F605 WeakPolarHBondContact CA-O 3.11Å
596	C	64.3	Low	54.1	Low	14 Å²	14	92.6 Å²	92.6	10%	0.095	49%	0.492	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	104	175.9	-59.6	0	0	0	0	108.2	L594 F605 V608 L611	L594-C596 PolarHBondContact O-N 2.91Å; L594-C596 VanDerWaalsContact O-N 3.17Å; C596-F605 PolarHBondContact N-O 2.87Å; C596-F605 WeakPolarHBondContact O-CB 3.42Å; C596-F605 WeakPolarHBondContact O-CD2 3.12Å; C596-F605 PolarHBondContact O-N 3.05Å; C596-V608 PolarHBondContact SG-N 3.26Å; C596-L611 HydrophobicContact CB-CB 3.82Å; C596-L611 HydrophobicContact CB-CD2 3.72Å; C596-L611 HydrophobicContact CB-CG 4.36Å
597	R	74.4	Confident	55.4	Low	126 Å²	126	90.2 Å²	90.2	48%	0.475	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	144	176.2	179.5	171.9	-80.9	-111	0.2	110.8	D602 E603 E604	R597-D602 WeakPolarHBondContact CD-OD1 3.33Å; R597-D602 IonicContact CZ-OD1 2.91Å; R597-D602 IonicContact NE-OD1 2.69Å; R597-D602 IonicContact NH1-OD1 2.68Å; R597-D602 PolarHBondContact NH1-OD1 3.28Å; R597-E603 WeakPolarHBondContact CA-O 3.39Å; R597-E604 HydrophobicContact CB-CG 4.43Å; R597-E604 IonicContact CZ-OE1 3.16Å; R597-E604 IonicContact NE-OE1 2.76Å; R597-E604 PolarHBondContact NE-OE1 2.94Å; R597-E604 IonicContact NH2-OE1 2.62Å; R597-E604 PolarHBondContact NH2-OE1 2.85Å
598	C	79.4	Confident	56.9	Low	0 Å²	0	86.5 Å²	86.5	0%	0	44%	0.442	C	S	.	.			trans	-87.3	124.5	175.6	-172.1	0	0	0	0	112.7	F600 C601 D602 E603 F605 L611 H614 H619	C598-F600 PolarHBondContact O-N 2.75Å; C598-F600 VanDerWaalsContact O-N 3.1Å; C598-F600 PolarHBondContact SG-N 3.41Å; C598-C601 PolarHBondContact O-N 2.91Å; C598-D602 WeakPolarHBondContact O-CA 3.24Å; C598-D602 PolarHBondContact O-N 3.03Å; C598-E603 PolarHBondContact N-O 2.88Å; C598-F605 HydrophobicContact CB-CE2 4Å; C598-L611 HydrophobicContact CB-CD1 3.6Å; C598-H614 WeakPolarHBondContact CB-NE2 3.41Å; C598-H614 PolarHBondContact SG-CD2 3.43Å; C598-H614 PolarHBondContact SG-NE2 2.71Å; C598-H619 VanDerWaalsContact SG-CD2 3.52Å
599	V	68.7	Low	58.5	Low	86 Å²	86	82.9 Å²	82.9	52%	0.521	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-16.2	178.1	-174.3	0	0	0	0	113.3	W577	W577-V599 HydrophobicContact CD2-CG2 4.4Å; W577-V599 HydrophobicContact CZ2-CB 4.35Å; W577-V599 HydrophobicContact CZ2-CG2 4.03Å
600	F	68.6	Low	60.6	Low	77 Å²	77	79.9 Å²	79.9	34%	0.338	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.4	-14.1	-176.2	-53	-74.9	0	0	0	114.7	W577 C598 V615 H619 E621	W577-F600 HydrophobicContact CZ2-CE2 4.2Å; W577-F600 HydrophobicContact CZ2-CZ 4.47Å; C598-F600 PolarHBondContact O-N 2.75Å; C598-F600 VanDerWaalsContact O-N 3.1Å; C598-F600 PolarHBondContact SG-N 3.41Å; F600-V615 HydrophobicContact CD2-CG1 4.31Å; F600-V615 HydrophobicContact CD2-CG2 4.21Å; F600-V615 HydrophobicContact CE2-CG1 3.85Å; F600-V615 HydrophobicContact CE2-CG2 4.28Å; F600-H619 HydrophobicContact CB-CB 4.25Å; F600-H619 VanDerWaalsContact CB-CG 3.47Å; F600-H619 WeakPolarHBondContact CB-ND1 3.47Å; F600-H619 HydrophobicContact CD2-CB 4.01Å; F600-H619 AromaticContact CD2-CD2 3.82Å; F600-H619 AromaticContact CD2-CG 3.89Å; F600-H619 HydrophobicContact CG-CB 4.15Å; F600-H619 AromaticContact CG-CG 3.86Å; F600-E621 VanDerWaalsContact CE1-OE2 3.23Å; F600-E621 WeakPolarHBondContact CE1-OE2 3.47Å; F600-E621 HydrophobicContact CZ-CB 4.33Å; F600-E621 VanDerWaalsContact CZ-CD 3.47Å; F600-E621 HydrophobicContact CZ-CG 4.48Å; F600-E621 WeakPolarHBondContact CZ-OE1 3.31Å; F600-E621 VanDerWaalsContact CZ-OE2 3.31Å; F600-E621 WeakPolarHBondContact CZ-OE2 3.37Å
601	C	78.1	Confident	62.5	Low	49 Å²	49	73 Å²	73	33%	0.331	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-159.6	18.2	176.3	76.4	0	0	0	0	116.1	C598 E603 H614 H619	C598-C601 PolarHBondContact O-N 2.91Å; C601-E603 PolarHBondContact O-N 3.1Å; C601-H614 PolarHBondContact SG-CE1 2.99Å; C601-H614 PolarHBondContact SG-NE2 3.11Å; C601-H619 PolarHBondContact SG-NE2 3.46Å; C601-H619 VanDerWaalsContact SG-NE2 3.43Å
602	D	74.4	Confident	64.2	Low	97 Å²	97	69.1 Å²	69.1	52%	0.519	35%	0.35	S	S	.	.			trans	58.9	0.5	174.3	-79.6	-70.2	0	0	0	118.3	R597 C598 E604	R597-D602 WeakPolarHBondContact CD-OD1 3.33Å; R597-D602 IonicContact CZ-OD1 2.91Å; R597-D602 IonicContact NE-OD1 2.69Å; R597-D602 IonicContact NH1-OD1 2.68Å; R597-D602 PolarHBondContact NH1-OD1 3.28Å; C598-D602 WeakPolarHBondContact O-CA 3.24Å; C598-D602 PolarHBondContact O-N 3.03Å; D602-E604 PolarHBondContact O-N 3.12Å
603	E	66	Low	66	Low	72 Å²	72	66.3 Å²	66.3	34%	0.336	34%	0.343	S	S	.	.			trans	-58.9	133.6	172.1	-72.3	-176.6	-173.6	0	0	110.3	R597 C598 C601 F605 H614 R618	R597-E603 WeakPolarHBondContact CA-O 3.39Å; C598-E603 PolarHBondContact N-O 2.88Å; C601-E603 PolarHBondContact O-N 3.1Å; E603-F605 HydrophobicContact CB-CE1 4.32Å; E603-F605 HydrophobicContact CB-CE2 3.61Å; E603-F605 HydrophobicContact CB-CZ 3.34Å; E603-F605 HydrophobicContact CG-CZ 4.35Å; E603-F605 WeakPolarHBondContact O-CD2 3.26Å; E603-F605 WeakPolarHBondContact O-CE2 3.47Å; E603-F605 WeakPolarHBondContact OE2-CZ 3.3Å; E603-H614 IonicContact OE2-CE1 3.76Å; E603-H614 PolarHBondContact OE2-CE1 2.76Å; E603-H614 IonicContact OE2-ND1 3.79Å; E603-H614 PolarHBondContact OE2-ND1 3.26Å; E603-R618 VanDerWaalsContact CD-NH1 3.3Å; E603-R618 IonicContact OE1-CZ 3.81Å; E603-R618 IonicContact OE1-NH1 3.63Å; E603-R618 PolarHBondContact OE1-NH1 3.45Å; E603-R618 IonicContact OE1-NH2 2.68Å; E603-R618 PolarHBondContact OE1-NH2 3.09Å; E603-R618 IonicContact OE2-CZ 3.53Å; E603-R618 IonicContact OE2-NH1 3.74Å; E603-R618 PolarHBondContact OE2-NH1 3.13Å; E603-R618 IonicContact OE2-NH2 3.01Å; E603-R618 PolarHBondContact OE2-NH2 3.12Å
604	E	75.5	Confident	68.1	Low	100 Å²	100	60.5 Å²	60.5	47%	0.467	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	126	-179.5	-64.2	-163.9	162.9	0	0	112.4	R595 R597 D602	R595-E604 WeakPolarHBondContact CD-OE2 3.19Å; R595-E604 IonicContact NE-OE2 2.58Å; R597-E604 HydrophobicContact CB-CG 4.43Å; R597-E604 IonicContact CZ-OE1 3.16Å; R597-E604 IonicContact NE-OE1 2.76Å; R597-E604 PolarHBondContact NE-OE1 2.94Å; R597-E604 IonicContact NH2-OE1 2.62Å; R597-E604 PolarHBondContact NH2-OE1 2.85Å; D602-E604 PolarHBondContact O-N 3.12Å
605	F	72.7	Confident	69.2	Low	28 Å²	28	58 Å²	58	12%	0.123	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	137.8	-177.3	-61.3	-68.7	0	0	0	112.7	L594 R595 C596 C598 E603 G607 I610 L611 H614	L594-F605 VanDerWaalsContact O-O 3.04Å; R595-F605 CarbonylContact C-O 3.46Å; R595-F605 WeakPolarHBondContact CA-O 3.11Å; C596-F605 PolarHBondContact N-O 2.87Å; C596-F605 WeakPolarHBondContact O-CB 3.42Å; C596-F605 WeakPolarHBondContact O-CD2 3.12Å; C596-F605 PolarHBondContact O-N 3.05Å; C598-F605 HydrophobicContact CB-CE2 4Å; E603-F605 HydrophobicContact CB-CE1 4.32Å; E603-F605 HydrophobicContact CB-CE2 3.61Å; E603-F605 HydrophobicContact CB-CZ 3.34Å; E603-F605 HydrophobicContact CG-CZ 4.35Å; E603-F605 WeakPolarHBondContact O-CD2 3.26Å; E603-F605 WeakPolarHBondContact O-CE2 3.47Å; E603-F605 WeakPolarHBondContact OE2-CZ 3.3Å; F605-G607 PolarHBondContact O-N 2.9Å; F605-I610 HydrophobicContact CB-CB 4.02Å; F605-I610 HydrophobicContact CB-CG2 3.99Å; F605-I610 HydrophobicContact CD1-CB 4.43Å; F605-I610 HydrophobicContact CD1-CG2 3.52Å; F605-I610 HydrophobicContact CE1-CG2 4.45Å; F605-I610 HydrophobicContact CG-CB 4.5Å; F605-I610 HydrophobicContact CG-CG2 4.04Å; F605-L611 HydrophobicContact CB-CB 4.23Å; F605-L611 HydrophobicContact CD2-CB 4.1Å; F605-L611 HydrophobicContact CD2-CD1 3.89Å; F605-L611 HydrophobicContact CE2-CD1 4.32Å; F605-L611 HydrophobicContact CG-CB 4.43Å; F605-H614 HydrophobicContact CD2-CB 4.29Å; F605-H614 HydrophobicContact CE1-CB 4.05Å; F605-H614 AromaticContact CE1-ND1 3.88Å; F605-H614 HydrophobicContact CE2-CB 3.81Å; F605-H614 AromaticContact CE2-CD2 3.5Å; F605-H614 AromaticContact CE2-CE1 3.79Å; F605-H614 AromaticContact CE2-CG 3.38Å; F605-H614 AromaticContact CE2-ND1 3.59Å; F605-H614 AromaticContact CE2-NE2 3.77Å; F605-H614 HydrophobicContact CZ-CB 3.69Å; F605-H614 AromaticContact CZ-CD2 3.82Å; F605-H614 AromaticContact CZ-CE1 3.48Å; F605-H614 VanDerWaalsContact CZ-CE1 3.48Å; F605-H614 WeakPolarHBondContact CZ-CE1 3.38Å; F605-H614 AromaticContact CZ-CG 3.26Å; F605-H614 AromaticContact CZ-ND1 3.04Å; F605-H614 WeakPolarHBondContact CZ-ND1 3.35Å; F605-H614 AromaticContact CZ-NE2 3.94Å
606	S	57.3	Low	70.5	Confident	95 Å²	95	55.6 Å²	55.6	66%	0.664	29%	0.294	S	S	*	.	S	Bend	trans	-72.3	24.3	178.6	49.8	0	0	0	0	115.1	L594 I610	L594-S606 CarbonylContact O-C 3.57Å; L594-S606 VanDerWaalsContact O-C 3.31Å; S606-I610 WeakPolarHBondContact OG-CD1 3.43Å
607	G	59.8	Low	70.9	Confident	9 Å²	9	62 Å²	62	9%	0.093	32%	0.322	C	S	.	.	S	Bend	trans	162	157.6	166.2	0	0	0	0	0	113.9	L594 F605 L609 I610 L611	L594-G607 VanDerWaalsContact O-CA 3.31Å; L594-G607 WeakPolarHBondContact O-CA 3.31Å; L594-G607 PolarHBondContact O-N 2.85Å; L594-G607 VanDerWaalsContact O-N 3.09Å; F605-G607 PolarHBondContact O-N 2.9Å; G607-L609 PolarHBondContact O-N 3.28Å; G607-I610 WeakPolarHBondContact O-CA 3.25Å; G607-I610 WeakPolarHBondContact O-CB 3.45Å; G607-I610 PolarHBondContact O-N 2.97Å; G607-L611 PolarHBondContact O-N 3.36Å
608	V	62.5	Low	70.9	Confident	42 Å²	42	62.7 Å²	62.7	26%	0.255	33%	0.325	S	S	.	.	H	α-helix	trans	-58.7	-25.8	-174.6	80.6	0	0	0	0	114.2	C596 I610 K612 V631	C596-V608 PolarHBondContact SG-N 3.26Å; V608-I610 VanDerWaalsContact C-N 3.34Å; V608-K612 WeakPolarHBondContact O-CB 3.38Å; V608-K612 PolarHBondContact O-N 2.95Å; V608-V631 HydrophobicContact CB-CG1 4.31Å; V608-V631 HydrophobicContact CG1-CG1 3.92Å; V608-V631 HydrophobicContact CG2-CG1 4.44Å
609	L	62.3	Low	70.8	Confident	102 Å²	102	65 Å²	65	53%	0.534	34%	0.336	S	S	.	.	H	α-helix	trans	-72.4	-29.6	175	-66.6	177.3	0	0	0	112.5	G607 A613	G607-L609 PolarHBondContact O-N 3.28Å; L609-A613 WeakPolarHBondContact O-CB 3.31Å; L609-A613 PolarHBondContact O-N 2.83Å
610	I	71.1	Confident	70.8	Confident	79 Å²	79	68.6 Å²	68.6	41%	0.405	35%	0.347	S	S	.	.	H	α-helix	trans	-82.1	-41.8	176.9	-52.6	172.6	0	0	0	108.9	F605 S606 G607 V608 K612 A613 H614	F605-I610 HydrophobicContact CB-CB 4.02Å; F605-I610 HydrophobicContact CB-CG2 3.99Å; F605-I610 HydrophobicContact CD1-CB 4.43Å; F605-I610 HydrophobicContact CD1-CG2 3.52Å; F605-I610 HydrophobicContact CE1-CG2 4.45Å; F605-I610 HydrophobicContact CG-CB 4.5Å; F605-I610 HydrophobicContact CG-CG2 4.04Å; S606-I610 WeakPolarHBondContact OG-CD1 3.43Å; G607-I610 WeakPolarHBondContact O-CA 3.25Å; G607-I610 WeakPolarHBondContact O-CB 3.45Å; G607-I610 PolarHBondContact O-N 2.97Å; V608-I610 VanDerWaalsContact C-N 3.34Å; I610-K612 VanDerWaalsContact C-N 3.31Å; I610-K612 PolarHBondContact O-N 3.36Å; I610-A613 PolarHBondContact O-N 3.37Å; I610-H614 VanDerWaalsContact O-CB 3.31Å; I610-H614 WeakPolarHBondContact O-CB 3.1Å; I610-H614 PolarHBondContact O-N 2.77Å
611	L	75.5	Confident	70.4	Confident	14 Å²	14	70 Å²	70	7%	0.073	35%	0.354	C	S	.	.	H	α-helix	trans	-56.4	-45.4	167.5	173.2	62.4	0	0	0	111.1	C596 C598 F605 G607 H614 V615	C596-L611 HydrophobicContact CB-CB 3.82Å; C596-L611 HydrophobicContact CB-CD2 3.72Å; C596-L611 HydrophobicContact CB-CG 4.36Å; C598-L611 HydrophobicContact CB-CD1 3.6Å; F605-L611 HydrophobicContact CB-CB 4.23Å; F605-L611 HydrophobicContact CD2-CB 4.1Å; F605-L611 HydrophobicContact CD2-CD1 3.89Å; F605-L611 HydrophobicContact CE2-CD1 4.32Å; F605-L611 HydrophobicContact CG-CB 4.43Å; G607-L611 PolarHBondContact O-N 3.36Å; L611-H614 CarbonylContact O-C 3.5Å; L611-H614 WeakPolarHBondContact O-CB 3.32Å; L611-H614 PolarHBondContact O-N 2.86Å; L611-V615 HydrophobicContact CD1-CG2 3.75Å; L611-V615 HydrophobicContact CG-CG2 4.25Å; L611-V615 WeakPolarHBondContact O-CG2 3.31Å; L611-V615 PolarHBondContact O-N 3.39Å
612	K	66.4	Low	69.5	Low	39 Å²	39	74.9 Å²	74.9	17%	0.17	37%	0.374	C	S	.	.	H	α-helix	trans	-62.3	-45.2	177.4	-178.3	174.7	-174.6	-68.8	0	112.2	V608 I610 H614 V615 E616 V623 I628	V608-K612 WeakPolarHBondContact O-CB 3.38Å; V608-K612 PolarHBondContact O-N 2.95Å; I610-K612 VanDerWaalsContact C-N 3.31Å; I610-K612 PolarHBondContact O-N 3.36Å; K612-H614 VanDerWaalsContact C-N 3.28Å; K612-H614 PolarHBondContact O-N 3.2Å; K612-V615 PolarHBondContact O-N 2.85Å; K612-E616 HydrophobicContact CG-CG 4.43Å; K612-E616 IonicContact NZ-OE1 3.98Å; K612-E616 PolarHBondContact NZ-OE1 3.04Å; K612-E616 IonicContact NZ-OE2 3.17Å; K612-E616 PolarHBondContact NZ-OE2 3.22Å; K612-E616 WeakPolarHBondContact O-CB 3.27Å; K612-E616 WeakPolarHBondContact O-CG 3.4Å; K612-E616 PolarHBondContact O-N 3.06Å; K612-V623 HydrophobicContact CB-CG2 4.39Å; K612-V623 HydrophobicContact CG-CB 4.45Å; K612-V623 HydrophobicContact CG-CG2 4.17Å; K612-I628 HydrophobicContact CD-CD1 3.75Å
613	A	72.7	Confident	68.8	Low	36 Å²	36	71.1 Å²	71.1	30%	0.298	35%	0.354	S	S	.	.	H	α-helix	trans	-61.2	-39	175.3	0	0	0	0	0	111.7	L609 I610 Q617	L609-A613 WeakPolarHBondContact O-CB 3.31Å; L609-A613 PolarHBondContact O-N 2.83Å; I610-A613 PolarHBondContact O-N 3.37Å; A613-Q617 WeakPolarHBondContact O-CB 2.95Å; A613-Q617 WeakPolarHBondContact O-CG 3.48Å; A613-Q617 PolarHBondContact O-N 3.5Å; A613-Q617 VanDerWaalsContact O-N 3.07Å
614	H	82.3	Confident	68.7	Low	13 Å²	13	70.4 Å²	70.4	6%	0.06	36%	0.356	C	S	.	.	H	α-helix	trans	-65.5	-49.2	174.8	168.6	95.6	0	0	0	112.1	C598 C601 E603 F605 I610 L611 K612 E616 Q617 R618 H619	C598-H614 WeakPolarHBondContact CB-NE2 3.41Å; C598-H614 PolarHBondContact SG-CD2 3.43Å; C598-H614 PolarHBondContact SG-NE2 2.71Å; C601-H614 PolarHBondContact SG-CE1 2.99Å; C601-H614 PolarHBondContact SG-NE2 3.11Å; E603-H614 IonicContact OE2-CE1 3.76Å; E603-H614 PolarHBondContact OE2-CE1 2.76Å; E603-H614 IonicContact OE2-ND1 3.79Å; E603-H614 PolarHBondContact OE2-ND1 3.26Å; F605-H614 HydrophobicContact CD2-CB 4.29Å; F605-H614 HydrophobicContact CE1-CB 4.05Å; F605-H614 AromaticContact CE1-ND1 3.88Å; F605-H614 HydrophobicContact CE2-CB 3.81Å; F605-H614 AromaticContact CE2-CD2 3.5Å; F605-H614 AromaticContact CE2-CE1 3.79Å; F605-H614 AromaticContact CE2-CG 3.38Å; F605-H614 AromaticContact CE2-ND1 3.59Å; F605-H614 AromaticContact CE2-NE2 3.77Å; F605-H614 HydrophobicContact CZ-CB 3.69Å; F605-H614 AromaticContact CZ-CD2 3.82Å; F605-H614 AromaticContact CZ-CE1 3.48Å; F605-H614 VanDerWaalsContact CZ-CE1 3.48Å; F605-H614 WeakPolarHBondContact CZ-CE1 3.38Å; F605-H614 AromaticContact CZ-CG 3.26Å; F605-H614 AromaticContact CZ-ND1 3.04Å; F605-H614 WeakPolarHBondContact CZ-ND1 3.35Å; F605-H614 AromaticContact CZ-NE2 3.94Å; I610-H614 VanDerWaalsContact O-CB 3.31Å; I610-H614 WeakPolarHBondContact O-CB 3.1Å; I610-H614 PolarHBondContact O-N 2.77Å; L611-H614 CarbonylContact O-C 3.5Å; L611-H614 WeakPolarHBondContact O-CB 3.32Å; L611-H614 PolarHBondContact O-N 2.86Å; K612-H614 VanDerWaalsContact C-N 3.28Å; K612-H614 PolarHBondContact O-N 3.2Å; H614-E616 VanDerWaalsContact C-N 3.35Å; H614-E616 PolarHBondContact O-N 3.35Å; H614-Q617 PolarHBondContact O-N 2.08Å; H614-Q617 VanDerWaalsContact O-N 3.11Å; H614-R618 WeakPolarHBondContact O-CB 3.2Å; H614-R618 PolarHBondContact O-N 2.75Å; H614-H619 AromaticContact CD2-CD2 3.75Å; H614-H619 AromaticContact CD2-NE2 3.68Å; H614-H619 AromaticContact CE1-NE2 3.66Å; H614-H619 AromaticContact NE2-CD2 3.46Å; H614-H619 PolarHBondContact NE2-CD2 3.46Å; H614-H619 AromaticContact NE2-NE2 2.9Å; H614-H619 PolarHBondContact NE2-NE2 2.99Å
615	V	72.4	Confident	67.5	Low	1 Å²	1	71.1 Å²	71.1	1%	0.006	36%	0.359	C	S	.	.	I	π-helix	trans	-61.3	-42.8	178.2	175	0	0	0	0	111.2	F600 L611 K612 Q617 H619 H620 E621 V623	F600-V615 HydrophobicContact CD2-CG1 4.31Å; F600-V615 HydrophobicContact CD2-CG2 4.21Å; F600-V615 HydrophobicContact CE2-CG1 3.85Å; F600-V615 HydrophobicContact CE2-CG2 4.28Å; L611-V615 HydrophobicContact CD1-CG2 3.75Å; L611-V615 HydrophobicContact CG-CG2 4.25Å; L611-V615 WeakPolarHBondContact O-CG2 3.31Å; L611-V615 PolarHBondContact O-N 3.39Å; K612-V615 PolarHBondContact O-N 2.85Å; V615-Q617 VanDerWaalsContact C-N 3.3Å; V615-Q617 PolarHBondContact O-N 3.35Å; V615-H619 CarbonylContact O-C 3.6Å; V615-H619 PolarHBondContact O-N 3.21Å; V615-H620 PolarHBondContact O-N 3.22Å; V615-E621 HydrophobicContact CG1-CB 4.12Å; V615-V623 HydrophobicContact CB-CG2 3.85Å; V615-V623 HydrophobicContact CG1-CG2 3.76Å; V615-V623 HydrophobicContact CG2-CG2 4.3Å
616	E	77.2	Confident	67	Low	88 Å²	88	77.4 Å²	77.4	41%	0.411	39%	0.387	S	S	.	.	I	π-helix	trans	-69.6	-19.4	176	-70.7	179.8	139.4	0	0	114.3	K612 H614	K612-E616 HydrophobicContact CG-CG 4.43Å; K612-E616 IonicContact NZ-OE1 3.98Å; K612-E616 PolarHBondContact NZ-OE1 3.04Å; K612-E616 IonicContact NZ-OE2 3.17Å; K612-E616 PolarHBondContact NZ-OE2 3.22Å; K612-E616 WeakPolarHBondContact O-CB 3.27Å; K612-E616 WeakPolarHBondContact O-CG 3.4Å; K612-E616 PolarHBondContact O-N 3.06Å; H614-E616 VanDerWaalsContact C-N 3.35Å; H614-E616 PolarHBondContact O-N 3.35Å
617	Q	71.9	Confident	66.8	Low	148 Å²	148	75 Å²	75	69%	0.692	37%	0.365	S	S	*	.	I	π-helix	trans	-109.6	-28.4	-175.8	-70.8	175.8	12.9	0	0	115.6	A613 H614 V615	A613-Q617 WeakPolarHBondContact O-CB 2.95Å; A613-Q617 WeakPolarHBondContact O-CG 3.48Å; A613-Q617 PolarHBondContact O-N 3.5Å; A613-Q617 VanDerWaalsContact O-N 3.07Å; H614-Q617 PolarHBondContact O-N 2.08Å; H614-Q617 VanDerWaalsContact O-N 3.11Å; V615-Q617 VanDerWaalsContact C-N 3.3Å; V615-Q617 PolarHBondContact O-N 3.35Å
618	R	73.7	Confident	66.6	Low	142 Å²	142	76.5 Å²	76.5	54%	0.536	37%	0.37	S	S	.	.	I	π-helix	trans	-102.8	-34.2	-179.1	-68.7	-71.9	-158.2	72.3	6.9	112.5	E603 H614	E603-R618 VanDerWaalsContact CD-NH1 3.3Å; E603-R618 IonicContact OE1-CZ 3.81Å; E603-R618 IonicContact OE1-NH1 3.63Å; E603-R618 PolarHBondContact OE1-NH1 3.45Å; E603-R618 IonicContact OE1-NH2 2.68Å; E603-R618 PolarHBondContact OE1-NH2 3.09Å; E603-R618 IonicContact OE2-CZ 3.53Å; E603-R618 IonicContact OE2-NH1 3.74Å; E603-R618 PolarHBondContact OE2-NH1 3.13Å; E603-R618 IonicContact OE2-NH2 3.01Å; E603-R618 PolarHBondContact OE2-NH2 3.12Å; H614-R618 WeakPolarHBondContact O-CB 3.2Å; H614-R618 PolarHBondContact O-N 2.75Å
619	H	78.7	Confident	66.5	Low	49 Å²	49	77.6 Å²	77.6	23%	0.227	38%	0.38	C	S	.	.	I	π-helix	trans	-113.6	-7.6	-172.4	-54.4	-54.3	0	0	0	113	C598 F600 C601 H614 V615 E621	C598-H619 VanDerWaalsContact SG-CD2 3.52Å; F600-H619 HydrophobicContact CB-CB 4.25Å; F600-H619 VanDerWaalsContact CB-CG 3.47Å; F600-H619 WeakPolarHBondContact CB-ND1 3.47Å; F600-H619 HydrophobicContact CD2-CB 4.01Å; F600-H619 AromaticContact CD2-CD2 3.82Å; F600-H619 AromaticContact CD2-CG 3.89Å; F600-H619 HydrophobicContact CG-CB 4.15Å; F600-H619 AromaticContact CG-CG 3.86Å; C601-H619 PolarHBondContact SG-NE2 3.46Å; C601-H619 VanDerWaalsContact SG-NE2 3.43Å; H614-H619 AromaticContact CD2-CD2 3.75Å; H614-H619 AromaticContact CD2-NE2 3.68Å; H614-H619 AromaticContact CE1-NE2 3.66Å; H614-H619 AromaticContact NE2-CD2 3.46Å; H614-H619 PolarHBondContact NE2-CD2 3.46Å; H614-H619 AromaticContact NE2-NE2 2.9Å; H614-H619 PolarHBondContact NE2-NE2 2.99Å; V615-H619 CarbonylContact O-C 3.6Å; V615-H619 PolarHBondContact O-N 3.21Å; H619-E621 PolarHBondContact O-N 3.06Å
620	H	67.1	Low	66.6	Low	160 Å²	160	77.1 Å²	77.1	74%	0.741	38%	0.375	S	S	*	.			trans	56.4	5.7	-178.1	-63.3	-61	0	0	0	115.9	V615	V615-H620 PolarHBondContact O-N 3.22Å
621	E	60.2	Low	65.8	Low	107 Å²	107	75.9 Å²	75.9	50%	0.5	37%	0.371	S	S	.	.			trans	-85	153.7	-178.1	-139	173.1	119	0	0	111.8	F600 V615 H619	F600-E621 VanDerWaalsContact CE1-OE2 3.23Å; F600-E621 WeakPolarHBondContact CE1-OE2 3.47Å; F600-E621 HydrophobicContact CZ-CB 4.33Å; F600-E621 VanDerWaalsContact CZ-CD 3.47Å; F600-E621 HydrophobicContact CZ-CG 4.48Å; F600-E621 WeakPolarHBondContact CZ-OE1 3.31Å; F600-E621 VanDerWaalsContact CZ-OE2 3.31Å; F600-E621 WeakPolarHBondContact CZ-OE2 3.37Å; V615-E621 HydrophobicContact CG1-CB 4.12Å; H619-E621 PolarHBondContact O-N 3.06Å
622	M	59.5	Low	65	Low	152 Å²	152	78.7 Å²	78.7	75%	0.749	39%	0.389	S	S	*	.			trans	-100.9	106.1	-179.3	-71.7	-169.7	-65.9	0	0	110.6	P624	M622-P624 VanDerWaalsContact O-CD 3.31Å; M622-P624 WeakPolarHBondContact O-CD 3.45Å; M622-P624 VanDerWaalsContact O-N 3.15Å
623	V	59.4	Low	65	Low	17 Å²	17	79.4 Å²	79.4	10%	0.103	40%	0.402	C	S	.	.			trans	-50.8	118.6	174.2	-178.1	0	0	0	0	110.3	W577 K612 V615 I628	W577-V623 HydrophobicContact CH2-CG1 4.4Å; W577-V623 HydrophobicContact CH2-CG2 4.43Å; W577-V623 HydrophobicContact CZ3-CG1 3.98Å; K612-V623 HydrophobicContact CB-CG2 4.39Å; K612-V623 HydrophobicContact CG-CB 4.45Å; K612-V623 HydrophobicContact CG-CG2 4.17Å; V615-V623 HydrophobicContact CB-CG2 3.85Å; V615-V623 HydrophobicContact CG1-CG2 3.76Å; V615-V623 HydrophobicContact CG2-CG2 4.3Å; V623-I628 HydrophobicContact CB-CD1 4.22Å; V623-I628 HydrophobicContact CG1-CD1 4.11Å; V623-I628 HydrophobicContact CG1-CG1 3.86Å; V623-I628 WeakPolarHBondContact O-CD1 3.44Å
624	P	64.1	Low	64.6	Low	58 Å²	58	80.4 Å²	80.4	38%	0.377	41%	0.411	S	S	.	.			trans	-50.8	134.9	-174.8	-32.5	34.8	0	0	0	115.8	M622 K626 E627 I628	M622-P624 VanDerWaalsContact O-CD 3.31Å; M622-P624 WeakPolarHBondContact O-CD 3.45Å; M622-P624 VanDerWaalsContact O-N 3.15Å; P624-K626 PolarHBondContact O-N 2.74Å; P624-K626 VanDerWaalsContact O-N 3.11Å; P624-E627 HydrophobicContact CB-CG 4.31Å; P624-E627 VanDerWaalsContact CD-OE2 3.26Å; P624-E627 WeakPolarHBondContact CD-OE2 3.1Å; P624-E627 PolarHBondContact O-N 2.81Å; P624-E627 VanDerWaalsContact O-N 3.1Å; P624-I628 PolarHBondContact O-N 3.13Å
625	E	51.2	Low	63.3	Low	114 Å²	114	83 Å²	83	53%	0.533	42%	0.421	S	S	.	.	H	α-helix	trans	-56.7	-31.3	179.2	-173.4	174.3	142.1	0	0	112.6	W518 S629	W518-E625 VanDerWaalsContact NE1-CD 3.27Å; W518-E625 PolarHBondContact NE1-OE1 3.05Å; W518-E625 PolarHBondContact NE1-OE2 3.47Å; E625-S629 VanDerWaalsContact O-CB 3.24Å; E625-S629 WeakPolarHBondContact O-CB 3.3Å; E625-S629 PolarHBondContact O-N 2.75Å; E625-S629 PolarHBondContact O-OG 3.12Å
626	K	62.1	Low	62.8	Low	161 Å²	161	89.8 Å²	89.8	70%	0.7	45%	0.447	S	S	*	.	H	α-helix	trans	-66.4	-40.2	179.5	-158	178.4	-175.6	-173.6	0	112.2	P624 S629 Q630	P624-K626 PolarHBondContact O-N 2.74Å; P624-K626 VanDerWaalsContact O-N 3.11Å; K626-S629 PolarHBondContact O-N 3.48Å; K626-Q630 WeakPolarHBondContact O-CG 3.36Å; K626-Q630 PolarHBondContact O-N 2.99Å
627	E	53.6	Low	62.5	Low	43 Å²	43	92.6 Å²	92.6	20%	0.201	46%	0.458	C	S	.	.	H	α-helix	trans	-76.2	-44.6	-178.2	-68.8	156.8	-166.9	0	0	111.2	P624 S629 Q630 V631	P624-E627 HydrophobicContact CB-CG 4.31Å; P624-E627 VanDerWaalsContact CD-OE2 3.26Å; P624-E627 WeakPolarHBondContact CD-OE2 3.1Å; P624-E627 PolarHBondContact O-N 2.81Å; P624-E627 VanDerWaalsContact O-N 3.1Å; E627-S629 PolarHBondContact O-N 2.73Å; E627-Q630 PolarHBondContact O-N 2.96Å; E627-Q630 VanDerWaalsContact O-N 3.11Å; E627-V631 WeakPolarHBondContact O-CG2 3.5Å; E627-V631 PolarHBondContact O-N 2.94Å
628	I	55	Low	62	Low	41 Å²	41	88.1 Å²	88.1	21%	0.21	45%	0.447	C	S	.	.	H	α-helix	trans	-56.6	-41.9	172	-59.6	171.2	0	0	0	109.8	K612 V623 P624 V631 V632	K612-I628 HydrophobicContact CD-CD1 3.75Å; V623-I628 HydrophobicContact CB-CD1 4.22Å; V623-I628 HydrophobicContact CG1-CD1 4.11Å; V623-I628 HydrophobicContact CG1-CG1 3.86Å; V623-I628 WeakPolarHBondContact O-CD1 3.44Å; P624-I628 PolarHBondContact O-N 3.13Å; I628-V631 PolarHBondContact O-N 3.3Å; I628-V632 HydrophobicContact CG2-CG2 4.43Å; I628-V632 WeakPolarHBondContact O-CB 3.3Å; I628-V632 VanDerWaalsContact O-CG2 3.25Å; I628-V632 WeakPolarHBondContact O-CG2 3.39Å; I628-V632 PolarHBondContact O-N 3.23Å
629	S	59.4	Low	61.3	Low	66 Å²	66	85.8 Å²	85.8	46%	0.462	44%	0.438	S	S	.	.	H	α-helix	trans	-65.1	-40.6	176.9	-62.7	0	0	0	0	112.8	E625 K626 E627 A633	E625-S629 VanDerWaalsContact O-CB 3.24Å; E625-S629 WeakPolarHBondContact O-CB 3.3Å; E625-S629 PolarHBondContact O-N 2.75Å; E625-S629 PolarHBondContact O-OG 3.12Å; K626-S629 PolarHBondContact O-N 3.48Å; E627-S629 PolarHBondContact O-N 2.73Å; S629-A633 VanDerWaalsContact O-CB 3.29Å; S629-A633 WeakPolarHBondContact O-CB 3.14Å; S629-A633 PolarHBondContact O-N 3.12Å
630	Q	65.5	Low	60.8	Low	91 Å²	91	88.1 Å²	88.1	43%	0.425	45%	0.449	S	S	.	.	H	α-helix	trans	-64.4	-46.5	175.3	-77.1	172.6	-7.8	0	0	112	K626 E627 V632 A633 A634	K626-Q630 WeakPolarHBondContact O-CG 3.36Å; K626-Q630 PolarHBondContact O-N 2.99Å; E627-Q630 PolarHBondContact O-N 2.96Å; E627-Q630 VanDerWaalsContact O-N 3.11Å; Q630-V632 PolarHBondContact O-N 3Å; Q630-A633 PolarHBondContact O-N 2.9Å; Q630-A634 WeakPolarHBondContact O-CB 3.46Å; Q630-A634 PolarHBondContact O-N 2.77Å
631	V	53.2	Low	60.9	Low	54 Å²	54	88 Å²	88	33%	0.327	44%	0.442	S	S	.	.	H	α-helix	trans	-64.2	-40.9	178	177.7	0	0	0	0	111.2	V608 E627 I628 A633 A634 F635	V608-V631 HydrophobicContact CB-CG1 4.31Å; V608-V631 HydrophobicContact CG1-CG1 3.92Å; V608-V631 HydrophobicContact CG2-CG1 4.44Å; E627-V631 WeakPolarHBondContact O-CG2 3.5Å; E627-V631 PolarHBondContact O-N 2.94Å; I628-V631 PolarHBondContact O-N 3.3Å; V631-A633 PolarHBondContact O-N 3.15Å; V631-A634 PolarHBondContact O-N 3.1Å; V631-F635 WeakPolarHBondContact O-CB 3.38Å; V631-F635 PolarHBondContact O-N 3.26Å
632	V	59.5	Low	61.1	Low	72 Å²	72	88 Å²	88	44%	0.436	44%	0.441	S	S	.	.	H	α-helix	trans	-65.3	-37.3	174.6	169.3	0	0	0	0	112	I628 Q630 R636	I628-V632 HydrophobicContact CG2-CG2 4.43Å; I628-V632 WeakPolarHBondContact O-CB 3.3Å; I628-V632 VanDerWaalsContact O-CG2 3.25Å; I628-V632 WeakPolarHBondContact O-CG2 3.39Å; I628-V632 PolarHBondContact O-N 3.23Å; Q630-V632 PolarHBondContact O-N 3Å; V632-R636 WeakPolarHBondContact O-CB 3.38Å; V632-R636 PolarHBondContact O-N 3.3Å
633	A	66.3	Low	61.3	Low	55 Å²	55	88 Å²	88	46%	0.455	43%	0.432	S	S	.	.	H	α-helix	trans	-68.4	-43.2	175.5	0	0	0	0	0	112.2	S629 Q630 V631 R636 K637	S629-A633 VanDerWaalsContact O-CB 3.29Å; S629-A633 WeakPolarHBondContact O-CB 3.14Å; S629-A633 PolarHBondContact O-N 3.12Å; Q630-A633 PolarHBondContact O-N 2.9Å; V631-A633 PolarHBondContact O-N 3.15Å; A633-R636 PolarHBondContact O-N 2.82Å; A633-K637 WeakPolarHBondContact O-CB 3.1Å; A633-K637 PolarHBondContact O-N 3.24Å
634	A	65	Low	61.7	Low	57 Å²	57	93 Å²	93	47%	0.471	46%	0.458	S	S	.	.	H	α-helix	trans	-61.3	-45.7	174.5	0	0	0	0	0	111.4	Q630 V631 R636 K637 A638	Q630-A634 WeakPolarHBondContact O-CB 3.46Å; Q630-A634 PolarHBondContact O-N 2.77Å; V631-A634 PolarHBondContact O-N 3.1Å; A634-R636 VanDerWaalsContact C-N 3.34Å; A634-R636 PolarHBondContact O-N 3.11Å; A634-K637 PolarHBondContact O-N 3.4Å; A634-A638 WeakPolarHBondContact O-CB 3.34Å; A634-A638 PolarHBondContact O-N 3.09Å
635	F	53.6	Low	61.6	Low	66 Å²	66	96.2 Å²	96.2	29%	0.289	47%	0.469	S	S	.	.	H	α-helix	trans	-62.5	-39.4	177	-160.2	-82.7	0	0	0	112.1	I529 Y533 V631 A638 Y639	I529-F635 HydrophobicContact CG2-CD1 4.05Å; I529-F635 HydrophobicContact CG2-CE1 3.52Å; I529-F635 HydrophobicContact CG2-CZ 4.39Å; Y533-F635 HydrophobicContact CD2-CE2 4.34Å; Y533-F635 AromaticContact CD2-CZ 3.61Å; Y533-F635 HydrophobicContact CD2-CZ 3.61Å; Y533-F635 HydrophobicContact CE2-CE2 4.31Å; Y533-F635 HydrophobicContact CE2-CZ 4.02Å; Y533-F635 HydrophobicContact CG-CZ 4.16Å; V631-F635 WeakPolarHBondContact O-CB 3.38Å; V631-F635 PolarHBondContact O-N 3.26Å; F635-A638 PolarHBondContact O-N 3.35Å; F635-Y639 VanDerWaalsContact O-CB 3.29Å; F635-Y639 WeakPolarHBondContact O-CB 3.26Å; F635-Y639 PolarHBondContact O-N 2.8Å
636	R	63.2	Low	62	Low	144 Å²	144	94.2 Å²	94.2	54%	0.543	46%	0.46	S	S	.	.	H	α-helix	trans	-61.4	-50.4	172.9	-175.2	-179.7	-63	159.9	2.1	111.5	V632 A633 A634 A638 Y639 E640	V632-R636 WeakPolarHBondContact O-CB 3.38Å; V632-R636 PolarHBondContact O-N 3.3Å; A633-R636 PolarHBondContact O-N 2.82Å; A634-R636 VanDerWaalsContact C-N 3.34Å; A634-R636 PolarHBondContact O-N 3.11Å; R636-A638 VanDerWaalsContact C-N 3.3Å; R636-A638 PolarHBondContact O-N 3.43Å; R636-Y639 PolarHBondContact O-N 3.03Å; R636-E640 HydrophobicContact CG-CG 4.45Å; R636-E640 WeakPolarHBondContact CG-OE1 3.32Å; R636-E640 WeakPolarHBondContact O-CB 3.34Å; R636-E640 WeakPolarHBondContact O-CG 3.35Å; R636-E640 PolarHBondContact O-N 3.36Å
637	K	69.5	Low	61.6	Low	147 Å²	147	90.6 Å²	90.6	64%	0.639	45%	0.446	S	S	*	.	H	α-helix	trans	-60.9	-37.9	179.7	-163.9	172.8	-174.7	177.6	0	111.9	A633 A634 R641	A633-K637 WeakPolarHBondContact O-CB 3.1Å; A633-K637 PolarHBondContact O-N 3.24Å; A634-K637 PolarHBondContact O-N 3.4Å; K637-R641 WeakPolarHBondContact O-CB 3.3Å; K637-R641 PolarHBondContact O-N 2.8Å; K637-R641 VanDerWaalsContact O-N 3.12Å
638	A	62.1	Low	61.6	Low	55 Å²	55	91.8 Å²	91.8	46%	0.455	46%	0.459	S	S	.	.	H	α-helix	trans	-70.1	-43.7	174.6	0	0	0	0	0	112.9	A634 F635 R636 R641 K642	A634-A638 WeakPolarHBondContact O-CB 3.34Å; A634-A638 PolarHBondContact O-N 3.09Å; F635-A638 PolarHBondContact O-N 3.35Å; R636-A638 VanDerWaalsContact C-N 3.3Å; R636-A638 PolarHBondContact O-N 3.43Å; A638-R641 PolarHBondContact O-N 2.94Å; A638-K642 WeakPolarHBondContact O-CB 3.17Å; A638-K642 PolarHBondContact O-N 2.96Å
639	Y	59.2	Low	61.7	Low	92 Å²	92	98.4 Å²	98.4	36%	0.361	48%	0.481	S	S	.	.	H	α-helix	trans	-64.3	-42	177.2	-179.2	-104.7	0	0	0	112.1	F635 R636 K642 R643	F635-Y639 VanDerWaalsContact O-CB 3.29Å; F635-Y639 WeakPolarHBondContact O-CB 3.26Å; F635-Y639 PolarHBondContact O-N 2.8Å; R636-Y639 PolarHBondContact O-N 3.03Å; Y639-K642 PolarHBondContact O-N 3.26Å; Y639-R643 VanDerWaalsContact O-CB 3.27Å; Y639-R643 WeakPolarHBondContact O-CB 3.3Å; Y639-R643 PolarHBondContact O-N 3.34Å
640	E	67.8	Low	61.2	Low	98 Å²	98	99.7 Å²	99.7	46%	0.458	48%	0.482	S	S	.	.	H	α-helix	trans	-64.6	-44.2	176.2	-74	168.8	173.2	0	0	111.5	R636 K642 R643 L644	R636-E640 HydrophobicContact CG-CG 4.45Å; R636-E640 WeakPolarHBondContact CG-OE1 3.32Å; R636-E640 WeakPolarHBondContact O-CB 3.34Å; R636-E640 WeakPolarHBondContact O-CG 3.35Å; R636-E640 PolarHBondContact O-N 3.36Å; E640-K642 PolarHBondContact O-N 3.44Å; E640-R643 PolarHBondContact O-N 3.24Å; E640-L644 WeakPolarHBondContact O-CB 3.06Å; E640-L644 VanDerWaalsContact O-CG 3.31Å; E640-L644 WeakPolarHBondContact O-CG 3.02Å; E640-L644 PolarHBondContact O-N 2.94Å
641	R	70.5	Confident	60.3	Low	157 Å²	157	98.9 Å²	98.9	59%	0.592	48%	0.48	S	S	*	.	H	α-helix	trans	-59.2	-46.1	173.5	-169.5	-173.5	-67.4	164.6	-6.5	112	K637 A638 L644 M645	K637-R641 WeakPolarHBondContact O-CB 3.3Å; K637-R641 PolarHBondContact O-N 2.8Å; K637-R641 VanDerWaalsContact O-N 3.12Å; A638-R641 PolarHBondContact O-N 2.94Å; R641-L644 PolarHBondContact O-N 3.46Å; R641-M645 PolarHBondContact O-N 3.25Å
642	K	63.4	Low	60.1	Low	107 Å²	107	99.1 Å²	99.1	47%	0.465	49%	0.488	S	S	.	.	H	α-helix	trans	-64.7	-39	177.9	-165.6	170	-173.4	172.5	0	111.9	A638 Y639 E640 M645 E646	A638-K642 WeakPolarHBondContact O-CB 3.17Å; A638-K642 PolarHBondContact O-N 2.96Å; Y639-K642 PolarHBondContact O-N 3.26Å; E640-K642 PolarHBondContact O-N 3.44Å; K642-M645 PolarHBondContact O-N 3.49Å; K642-E646 PolarHBondContact O-N 3.42Å
643	R	64.7	Low	59.4	Low	152 Å²	152	99.3 Å²	99.3	57%	0.574	49%	0.489	S	S	*	.	H	α-helix	trans	-65.7	-40.9	174.5	179.4	-179.7	170	-152.6	-7.2	112.2	Y639 E640 E646 Q647	Y639-R643 VanDerWaalsContact O-CB 3.27Å; Y639-R643 WeakPolarHBondContact O-CB 3.3Å; Y639-R643 PolarHBondContact O-N 3.34Å; E640-R643 PolarHBondContact O-N 3.24Å; R643-E646 PolarHBondContact O-N 2.8Å; R643-Q647 VanDerWaalsContact O-CB 3.24Å; R643-Q647 WeakPolarHBondContact O-CB 3.38Å; R643-Q647 PolarHBondContact O-N 2.74Å
644	L	67.5	Low	58.1	Low	123 Å²	123	99 Å²	99	64%	0.644	49%	0.487	S	S	*	.	H	α-helix	trans	-65.6	-39.5	176.6	-73.2	166.3	0	0	0	111.7	E640 R641 Q647 S648	E640-L644 WeakPolarHBondContact O-CB 3.06Å; E640-L644 VanDerWaalsContact O-CG 3.31Å; E640-L644 WeakPolarHBondContact O-CG 3.02Å; E640-L644 PolarHBondContact O-N 2.94Å; R641-L644 PolarHBondContact O-N 3.46Å; L644-Q647 PolarHBondContact O-N 2.96Å; L644-S648 PolarHBondContact O-N 2.83Å; L644-S648 PolarHBondContact O-OG 3.43Å
645	M	61.6	Low	56.7	Low	125 Å²	125	103.3 Å²	103.3	62%	0.616	50%	0.502	S	S	*	.	H	α-helix	trans	-68.5	-35	173.6	-73.7	176.2	156.4	0	0	113.7	R641 K642 S648 R649	R641-M645 PolarHBondContact O-N 3.25Å; K642-M645 PolarHBondContact O-N 3.49Å; M645-S648 PolarHBondContact O-OG 3.03Å; M645-R649 PolarHBondContact O-N 3.4Å
646	E	59.3	Low	55.9	Low	73 Å²	73	105.9 Å²	105.9	34%	0.341	52%	0.523	S	S	.	.	H	α-helix	trans	-70.5	-39.5	173.3	-149.1	90	-128.5	0	0	111	K540 K642 R643 R649 I650	K540-E646 VanDerWaalsContact CE-OE2 3.26Å; K540-E646 WeakPolarHBondContact CE-OE2 3.26Å; K540-E646 IonicContact NZ-OE1 3.08Å; K540-E646 PolarHBondContact NZ-OE1 2.94Å; K540-E646 IonicContact NZ-OE2 2.65Å; K540-E646 PolarHBondContact NZ-OE2 2.66Å; K642-E646 PolarHBondContact O-N 3.42Å; R643-E646 PolarHBondContact O-N 2.8Å; E646-R649 PolarHBondContact O-N 2.78Å; E646-I650 VanDerWaalsContact O-CG1 3.3Å; E646-I650 WeakPolarHBondContact O-CG1 3.4Å; E646-I650 PolarHBondContact O-N 2.9Å
647	Q	54.2	Low	54.5	Low	84 Å²	84	108.5 Å²	108.5	39%	0.393	53%	0.533	S	S	.	.	H	α-helix	trans	-64.7	-46.7	177	-173.8	62.1	59.6	0	0	111.1	R643 L644 R649 I650 D651	R643-Q647 VanDerWaalsContact O-CB 3.24Å; R643-Q647 WeakPolarHBondContact O-CB 3.38Å; R643-Q647 PolarHBondContact O-N 2.74Å; L644-Q647 PolarHBondContact O-N 2.96Å; Q647-R649 VanDerWaalsContact C-N 3.32Å; Q647-R649 PolarHBondContact O-N 3.14Å; Q647-I650 WeakPolarHBondContact O-CB 3.38Å; Q647-I650 PolarHBondContact O-N 2.95Å; Q647-D651 WeakPolarHBondContact CG-OD2 3.09Å; Q647-D651 VanDerWaalsContact NE2-CG 3.26Å; Q647-D651 PolarHBondContact NE2-OD1 3.29Å; Q647-D651 PolarHBondContact NE2-OD2 2.81Å; Q647-D651 VanDerWaalsContact O-CG 3.26Å; Q647-D651 PolarHBondContact O-N 3.41Å
648	S	54.2	Low	52.6	Low	69 Å²	69	108.7 Å²	108.7	48%	0.483	54%	0.541	S	S	.	.	H	α-helix	trans	-65.4	-32.4	176.7	65	0	0	0	0	113	L644 M645 A652	L644-S648 PolarHBondContact O-N 2.83Å; L644-S648 PolarHBondContact O-OG 3.43Å; M645-S648 PolarHBondContact O-OG 3.03Å; S648-A652 WeakPolarHBondContact O-CB 3.31Å; S648-A652 PolarHBondContact O-N 2.76Å
649	R	57.1	Low	50.9	Low	180 Å²	180	111.9 Å²	111.9	68%	0.679	56%	0.558	S	S	*	*	H	α-helix	trans	-65.3	-36.7	168.7	-85.2	-174.2	168.1	-169.7	-2.6	113.1	M645 E646 Q647 T653	M645-R649 PolarHBondContact O-N 3.4Å; E646-R649 PolarHBondContact O-N 2.78Å; Q647-R649 VanDerWaalsContact C-N 3.32Å; Q647-R649 PolarHBondContact O-N 3.14Å; R649-T653 WeakPolarHBondContact O-CB 3.3Å; R649-T653 WeakPolarHBondContact O-CG2 3.44Å; R649-T653 PolarHBondContact O-N 3.26Å; R649-T653 VanDerWaalsContact O-N 3.15Å; R649-T653 PolarHBondContact O-OG1 3.47Å
650	I	48.8	Very low	49.4	Very low	92 Å²	92	116.9 Å²	116.9	47%	0.472	59%	0.585	S	S	.	*	H	α-helix	trans	-69.8	-45.5	176	-70.6	163.2	0	0	0	110.3	E646 Q647 T653 A654	E646-I650 VanDerWaalsContact O-CG1 3.3Å; E646-I650 WeakPolarHBondContact O-CG1 3.4Å; E646-I650 PolarHBondContact O-N 2.9Å; Q647-I650 WeakPolarHBondContact O-CB 3.38Å; Q647-I650 PolarHBondContact O-N 2.95Å; I650-T653 CarbonylContact O-C 3.53Å; I650-T653 PolarHBondContact O-N 2.05Å; I650-T653 VanDerWaalsContact O-N 3.1Å; I650-T653 PolarHBondContact O-OG1 3.13Å; I650-A654 WeakPolarHBondContact O-CB 3.31Å; I650-A654 PolarHBondContact O-N 2.82Å
651	D	46	Very low	47.5	Very low	74 Å²	74	121.2 Å²	121.2	40%	0.396	61%	0.605	S	S	.	*	H	α-helix	trans	-69.9	-36.1	-178.3	-60.1	-30.3	0	0	0	111.3	Q647 T653 A654 N655	Q647-D651 WeakPolarHBondContact CG-OD2 3.09Å; Q647-D651 VanDerWaalsContact NE2-CG 3.26Å; Q647-D651 PolarHBondContact NE2-OD1 3.29Å; Q647-D651 PolarHBondContact NE2-OD2 2.81Å; Q647-D651 VanDerWaalsContact O-CG 3.26Å; Q647-D651 PolarHBondContact O-N 3.41Å; D651-T653 VanDerWaalsContact C-N 3.28Å; D651-T653 PolarHBondContact O-N 3.46Å; D651-A654 PolarHBondContact O-N 3.08Å; D651-N655 PolarHBondContact O-N 3Å
652	A	48.4	Very low	45.5	Very low	59 Å²	59	121.4 Å²	121.4	49%	0.488	62%	0.618	S	S	.	*	H	α-helix	trans	-69.5	-18.2	170.5	0	0	0	0	0	114.2	S648 V656	S648-A652 WeakPolarHBondContact O-CB 3.31Å; S648-A652 PolarHBondContact O-N 2.76Å; A652-V656 VanDerWaalsContact O-CG2 3.24Å; A652-V656 WeakPolarHBondContact O-CG2 3.47Å
653	T	45.9	Very low	43.9	Very low	76 Å²	76	122.5 Å²	122.5	47%	0.466	64%	0.639	S	S	.	*	H	α-helix	trans	-101.7	-4.5	172.8	52.6	0	0	0	0	113.7	R649 I650 D651	R649-T653 WeakPolarHBondContact O-CB 3.3Å; R649-T653 WeakPolarHBondContact O-CG2 3.44Å; R649-T653 PolarHBondContact O-N 3.26Å; R649-T653 VanDerWaalsContact O-N 3.15Å; R649-T653 PolarHBondContact O-OG1 3.47Å; I650-T653 CarbonylContact O-C 3.53Å; I650-T653 PolarHBondContact O-N 2.05Å; I650-T653 VanDerWaalsContact O-N 3.1Å; I650-T653 PolarHBondContact O-OG1 3.13Å; D651-T653 VanDerWaalsContact C-N 3.28Å; D651-T653 PolarHBondContact O-N 3.46Å
654	A	38.6	Very low	42.2	Very low	48 Å²	48	125.6 Å²	125.6	40%	0.397	65%	0.651	S	S	.	*	H	α-helix	trans	-87.5	-47.6	166.8	0	0	0	0	0	111.1	I650 D651 V656 R657	I650-A654 WeakPolarHBondContact O-CB 3.31Å; I650-A654 PolarHBondContact O-N 2.82Å; D651-A654 PolarHBondContact O-N 3.08Å; A654-V656 PolarHBondContact O-N 2.97Å; A654-R657 PolarHBondContact O-N 3.5Å; A654-R657 VanDerWaalsContact O-N 3.1Å
655	N	35.7	Very low	40.4	Very low	148 Å²	148	127.8 Å²	127.8	79%	0.791	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.6	-4	177.8	-80.4	-18.6	0	0	0	114.8	D651	D651-N655 PolarHBondContact O-N 3Å
656	V	36.9	Very low	38.7	Very low	121 Å²	121	130.1 Å²	130.1	73%	0.733	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.7	17.6	178.9	-177	0	0	0	0	111.1	A652 A654	A652-V656 VanDerWaalsContact O-CG2 3.24Å; A652-V656 WeakPolarHBondContact O-CG2 3.47Å; A654-V656 PolarHBondContact O-N 2.97Å
657	R	32.7	Very low	37.4	Very low	199 Å²	199	133.7 Å²	133.7	75%	0.751	69%	0.693	S	S	*	*	S	Bend	trans	-135.3	2.2	-176.1	-71.9	-173.6	171	140.7	-2.2	116.8	A654	A654-R657 PolarHBondContact O-N 3.5Å; A654-R657 VanDerWaalsContact O-N 3.1Å
658	D	30.6	Very low	36.9	Very low	151 Å²	151	134.4 Å²	134.4	81%	0.807	71%	0.705	S	S	*	*	S	Bend	trans	-119.5	43.1	177.4	-81.6	-60.7	0	0	0	111.9
659	C	26	Very low	35.5	Very low	121 Å²	121	140.4 Å²	140.4	82%	0.818	72%	0.718	S	S	*	*	S	Bend	trans	-142.3	159.2	167.6	-84.3	0	0	0	0	111.1
660	E	28.4	Very low	34.1	Very low	198 Å²	198	138.6 Å²	138.6	93%	0.925	72%	0.718	S	S	*	*			trans	68.1	60.3	174.4	-54.9	-157.4	102.4	0	0	118.5
661	E	27	Very low	33.1	Very low	189 Å²	189	139.9 Å²	139.9	88%	0.883	73%	0.73	S	S	*	*			trans	-106.5	58.3	155	-164.4	-174.7	-149.4	0	0	111.1
662	N	27.8	Very low	32.3	Very low	160 Å²	160	144.8 Å²	144.8	86%	0.856	75%	0.751	S	S	*	*			trans	-175.6	95.8	163.4	-103.8	-54.2	0	0	0	113.9
663	S	30.3	Very low	32.5	Very low	130 Å²	130	146.9 Å²	146.9	91%	0.909	76%	0.759	S	S	*	*			trans	-167.8	163.5	144.1	-93.6	0	0	0	0	113
664	R	30	Very low	32.5	Very low	218 Å²	218	148.3 Å²	148.3	82%	0.823	77%	0.77	S	S	*	*			trans	-105.6	139.3	-156.2	-63.4	172.3	177.2	154.6	-3.2	114.2
665	Q	29	Very low	32.2	Very low	169 Å²	169	153.3 Å²	153.3	79%	0.79	79%	0.788	S	S	*	*			trans	62.4	141.6	135.1	-67.5	174.9	-56.5	0	0	121.5
666	L	26.7	Very low	32.1	Very low	173 Å²	173	151.4 Å²	151.4	91%	0.906	79%	0.787	S	S	*	*			trans	84	162.8	160	-66	159.3	0	0	0	118.3
667	N	30.2	Very low	32	Very low	148 Å²	148	149.5 Å²	149.5	79%	0.791	78%	0.784	S	S	*	*			trans	-161	163.4	-153.9	-163.3	30.9	0	0	0	105.7
668	P	43.8	Very low	31.8	Very low	99 Å²	99	149.6 Å²	149.6	64%	0.643	79%	0.79	S	S	*	*			cis	-132.4	-170.1	-4.9	37.8	-17.9	0	0	0	115
669	Y	25.7	Very low	31.9	Very low	195 Å²	195	147 Å²	147	77%	0.765	78%	0.783	S	S	*	*			trans	90.6	145.5	145.2	-137.5	-122	0	0	0	120.9
670	E	26.9	Very low	32.2	Very low	142 Å²	142	147 Å²	147	66%	0.664	78%	0.78	S	S	*	*			trans	55.8	107.4	163.5	-78.4	170.5	158.4	0	0	124.7
671	T	28	Very low	32.4	Very low	119 Å²	119	142 Å²	142	73%	0.73	77%	0.767	S	S	*	*				74.8	107.5	113.3	-50	0	0	0	0	123.8
672	E	30.4	Very low	32.7	Very low	177 Å²	177	138 Å²	138	83%	0.827	76%	0.76	S	S	*	*			trans	70.8	160.1	144.7	-67.1	-68.4	102.2	0	0	122.8
673	P	51.3	Low	32.8	Very low	103 Å²	103	136 Å²	136	67%	0.669	75%	0.753	S	S	*	*			trans	-113.9	-160.6	-163.3	47	-37.5	0	0	0	113.8
674	P	47.2	Very low	32.8	Very low	107 Å²	107	136.5 Å²	136.5	70%	0.695	75%	0.746	S	S	*	*			cis	-137.9	-160.4	-3	32	-5.6	0	0	0	116.7
675	I	31.8	Very low	32.8	Very low	152 Å²	152	131.8 Å²	131.8	78%	0.779	74%	0.741	S	S	*	*			trans	76.5	112.5	155	43.4	175.8	0	0	0	126.7
676	S	33.7	Very low	32.8	Very low	108 Å²	108	132.7 Å²	132.7	76%	0.755	74%	0.743	S	S	*	*				79.3	123.4	122.5	75.8	0	0	0	0	127.2
677	A	34	Very low	33.5	Very low	81 Å²	81	129.3 Å²	129.3	67%	0.669	73%	0.731	S	S	*	*				110.4	150.3	122	0	0	0	0	0	124.3
678	F	29.7	Very low	33.5	Very low	201 Å²	201	127.9 Å²	127.9	88%	0.882	73%	0.733	S	S	*	*			trans	66.4	146.7	171.3	-62	-93.2	0	0	0	119.5
679	S	32.3	Very low	32.9	Very low	96 Å²	96	126.7 Å²	126.7	67%	0.671	74%	0.738	S	S	*	*			cis	-169.1	-168.1	-27.3	-85.8	0	0	0	0	107.5
680	T	32.3	Very low	33	Very low	123 Å²	123	125.5 Å²	125.5	76%	0.755	74%	0.744	S	S	*	*			cis	-153.6	177.8	14.6	55.8	0	0	0	0	111.9
681	S	32.4	Very low	33.2	Very low	93 Å²	93	123.3 Å²	123.3	65%	0.65	75%	0.751	S	S	*	*			trans	46.6	103.7	148.1	57.7	0	0	0	0	120.8
682	S	32.3	Very low	33.4	Very low	104 Å²	104	121.4 Å²	121.4	73%	0.727	75%	0.747	S	S	*	*				83.8	140.9	66	70.7	0	0	0	0	114.3
683	V	31.8	Very low	33.5	Very low	118 Å²	118	119.4 Å²	119.4	72%	0.715	75%	0.747	S	S	*	*			cis	-165.6	167.6	6.4	-110	0	0	0	0	112.2
684	D	29.4	Very low	32.4	Very low	141 Å²	141	121 Å²	121	75%	0.754	75%	0.749	S	S	*	*			trans	61.6	146.2	146	-60.5	-7	0	0	0	122.7
685	T	29.9	Very low	31.8	Very low	118 Å²	118	120.2 Å²	120.2	72%	0.724	75%	0.746	S	S	*	*			cis	-157.2	170.5	-5.2	-114.7	0	0	0	0	114.4
686	F	30	Very low	32	Very low	188 Å²	188	118.3 Å²	118.3	83%	0.825	75%	0.747	S	S	*	*			trans	-57.6	-168.4	-178.7	-67.6	-93.6	0	0	0	118.8
687	P	40.4	Very low	32	Very low	103 Å²	103	117.5 Å²	117.5	67%	0.669	75%	0.747	S	S	*	*				-144.6	-171	-61.9	45.6	-28.3	0	0	0	117.1
688	S	29.8	Very low	31.9	Very low	118 Å²	118	120 Å²	120	83%	0.825	75%	0.753	S	S	*	*			trans	69.1	135.8	141.4	-66.3	0	0	0	0	125.9
689	G	30.8	Very low	31.9	Very low	73 Å²	73	115 Å²	115	75%	0.753	75%	0.749	S	S	*	*			trans	85	163.9	147.6	0	0	0	0	0	119.3
690	L	29.1	Very low	31.7	Very low	170 Å²	170	114.9 Å²	114.9	89%	0.89	75%	0.754	S	S	*	*			cis	-172.1	133.1	-39.3	-122.6	177.8	0	0	0	109.7
691	A	30.6	Very low	31.6	Very low	97 Å²	97	113.6 Å²	113.6	80%	0.802	76%	0.756	S	S	*	*			trans	54.8	-175.7	161.3	0	0	0	0	0	119.5
692	A	31.6	Very low	31.6	Very low	79 Å²	79	114 Å²	114	65%	0.653	77%	0.765	S	S	*	*				-160.8	160	-67.8	0	0	0	0	0	112.2
693	V	32.2	Very low	31.7	Very low	135 Å²	135	113.1 Å²	113.1	82%	0.818	76%	0.764	S	S	*	*			trans	58.5	163.5	160.5	-61	0	0	0	0	118.8
694	D	29.8	Very low	31.8	Very low	135 Å²	135	112.5 Å²	112.5	72%	0.722	77%	0.765	S	S	*	*			cis	-149	161.2	-15.7	-130.8	-43.6	0	0	0	115.4
695	S	34.3	Very low	32.1	Very low	91 Å²	91	112.3 Å²	112.3	64%	0.636	76%	0.763	S	S	*	*			trans	11.5	115.1	148.6	-62.9	0	0	0	0	125.4
696	S	36.7	Very low	32.1	Very low	113 Å²	113	116 Å²	116	79%	0.79	77%	0.769	S	S	*	*				93.1	159.2	107.1	81.3	0	0	0	0	124.9
697	A	33.5	Very low	32.2	Very low	91 Å²	91	112.3 Å²	112.3	75%	0.752	77%	0.766	S	S	*	*			trans	81.3	158.9	161.6	0	0	0	0	0	117.8
698	V	31	Very low	31.9	Very low	133 Å²	133	111.2 Å²	111.2	81%	0.806	77%	0.766	S	S	*	*			cis	-146.7	131.6	13.5	-179.1	0	0	0	0	113.2
699	A	29.9	Very low	32	Very low	96 Å²	96	111 Å²	111	79%	0.793	76%	0.764	S	S	*	*			trans	54.2	177	153.2	0	0	0	0	0	120.7
700	A	28.3	Very low	32.1	Very low	94 Å²	94	112.4 Å²	112.4	78%	0.777	77%	0.769	S	S	*	*			cis	-152.8	159.6	4.2	0	0	0	0	0	115.3
701	A	30.4	Very low	32.4	Very low	95 Å²	95	108.7 Å²	108.7	79%	0.785	76%	0.762	S	S	*	*			trans	32.8	118.7	149.3	0	0	0	0	0	122.1
702	A	32.1	Very low	32.5	Very low	103 Å²	103	111.3 Å²	111.3	85%	0.851	76%	0.763	S	S	*	*				96.5	156	81.4	0	0	0	0	0	113.1
703	A	33.6	Very low	32.4	Very low	84 Å²	84	114.4 Å²	114.4	69%	0.694	77%	0.773	S	S	*	*			cis	-157.6	173.4	2.9	0	0	0	0	0	112.1
704	S	35.1	Very low	32.4	Very low	106 Å²	106	110.7 Å²	110.7	74%	0.741	76%	0.762	S	S	*	*			trans	69.4	158.5	151.3	-63.1	0	0	0	0	120.3
705	L	35.2	Very low	32.5	Very low	137 Å²	137	114.6 Å²	114.6	72%	0.717	77%	0.773	S	S	*	*			cis	-165.6	143.2	-18.7	-100.4	165.6	0	0	0	109.5
706	F	30.8	Very low	32.5	Very low	194 Å²	194	113 Å²	113	85%	0.851	77%	0.771	S	S	*	*			trans	60.5	168.4	158	-83	-125.5	0	0	0	119.6
707	C	32	Very low	32.5	Very low	111 Å²	111	118 Å²	118	75%	0.75	78%	0.779	S	S	*	*			cis	-166.2	171.6	-46	-158.7	0	0	0	0	111.1
708	A	32.9	Very low	32.7	Very low	81 Å²	81	116.7 Å²	116.7	67%	0.669	77%	0.774	S	S	*	*			trans	77	99.6	153.2	0	0	0	0	0	123.7
709	S	32.9	Very low	33.2	Very low	113 Å²	113	117.3 Å²	117.3	79%	0.79	78%	0.778	S	S	*	*				65.5	121.3	120.7	66.6	0	0	0	0	126.2
710	A	32.8	Very low	34.1	Very low	103 Å²	103	117.2 Å²	117.2	85%	0.851	77%	0.769	S	S	*	*				103.1	145.2	120.3	0	0	0	0	0	124.5
711	A	34.2	Very low	34.5	Very low	92 Å²	92	122.1 Å²	122.1	76%	0.76	77%	0.773	S	S	*	*			trans	93.8	100.5	145.2	0	0	0	0	0	124.4
712	N	32.8	Very low	35.4	Very low	152 Å²	152	123 Å²	123	81%	0.813	77%	0.771	S	S	*	*				72.8	146	124.6	-85.6	5.4	0	0	0	127.1
713	V	31.3	Very low	35.9	Very low	144 Å²	144	125.2 Å²	125.2	87%	0.873	77%	0.768	S	S	*	*			trans	60.4	148.3	157.5	-62.7	0	0	0	0	120.9
714	G	31.5	Very low	36.3	Very low	57 Å²	57	128 Å²	128	59%	0.588	77%	0.77	S	S	*	*			cis	173.2	176.2	-6.3	0	0	0	0	0	114.5
715	F	31.7	Very low	36.4	Very low	216 Å²	216	126.3 Å²	126.3	95%	0.947	77%	0.77	S	S	*	*			trans	68.6	155.8	174.4	-58.9	-90.5	0	0	0	118.6
716	G	34.6	Very low	36.5	Very low	58 Å²	58	126.4 Å²	126.4	60%	0.598	77%	0.77	S	S	*	*			cis	171.4	160.6	-10.2	0	0	0	0	0	115.1
717	F	36.3	Very low	37.1	Very low	219 Å²	219	121.7 Å²	121.7	96%	0.961	76%	0.759	S	S	*	*			trans	70.8	145.1	173	-54.1	-87.7	0	0	0	119.8
718	G	37.7	Very low	37.1	Very low	62 Å²	62	124.5 Å²	124.5	64%	0.639	76%	0.759	S	S	*	*			cis	171.7	147.6	-16	0	0	0	0	0	117.4
719	V	40.9	Very low	37.1	Very low	146 Å²	146	127 Å²	127	89%	0.885	76%	0.761	S	S	*	*			trans	66.7	158.6	148.2	-64.5	0	0	0	0	123.5
720	P	49.3	Very low	37.5	Very low	95 Å²	95	126.7 Å²	126.7	62%	0.617	76%	0.756	S	S	*	*			cis	-150.4	178.2	-43.9	44.8	-27.8	0	0	0	118.9
721	F	37.5	Very low	37.4	Very low	196 Å²	196	130.7 Å²	130.7	86%	0.86	75%	0.751	S	S	*	*			trans	61.4	149.3	157.6	-72.8	-73.2	0	0	0	120.1
722	P	48.2	Very low	37.5	Very low	114 Å²	114	133.2 Å²	133.2	74%	0.74	76%	0.757	S	S	*	*			cis	-119.1	-162.7	-0.3	45.7	-31.9	0	0	0	112.1
723	L	42.3	Very low	37.6	Very low	150 Å²	150	132.4 Å²	132.4	79%	0.785	75%	0.751	S	S	*	*			cis	-143.8	-110.8	-0.4	-148	-176.7	0	0	0	111
724	L	41.7	Very low	37.9	Very low	142 Å²	142	131 Å²	131	74%	0.743	75%	0.745	S	S	*	*			trans	-150.8	170.1	-175	-69.3	175.3	0	0	0	109.2	L726	L724-L726 HydrophobicContact CD2-CD1 4.08Å; L724-L726 HydrophobicContact CD2-CG 4.16Å
725	G	37.9	Very low	38.1	Very low	70 Å²	70	135.1 Å²	135.1	72%	0.722	75%	0.754	S	S	*	*			cis	167.7	168.4	-2.1	0	0	0	0	0	112.1
726	L	37.1	Very low	38.5	Very low	140 Å²	140	129.3 Å²	129.3	73%	0.733	74%	0.738	S	S	*	*			cis	-154.1	159.6	-13	-99.9	175.1	0	0	0	110.1	L724 F728	L724-L726 HydrophobicContact CD2-CD1 4.08Å; L724-L726 HydrophobicContact CD2-CG 4.16Å; L726-F728 HydrophobicContact CD2-CE2 4.48Å
727	P	43.4	Very low	38.2	Very low	94 Å²	94	136.3 Å²	136.3	61%	0.61	75%	0.748	S	S	*	*			trans	-130.8	-138.9	-171.6	45.5	-29.5	0	0	0	114.5
728	F	31.3	Very low	37.9	Very low	170 Å²	170	132.4 Å²	132.4	75%	0.746	74%	0.741	S	S	*	*			trans	96.3	137.1	169.2	-60.1	-61.8	0	0	0	117.1	L726	L726-F728 HydrophobicContact CD2-CE2 4.48Å
729	N	33.6	Very low	37.5	Very low	135 Å²	135	134 Å²	134	72%	0.722	75%	0.749	S	S	*	*			cis	91	159.8	35.7	-162.5	46.6	0	0	0	111.7
730	P	41.2	Very low	37	Very low	105 Å²	105	129.9 Å²	129.9	68%	0.682	74%	0.736	S	S	*	*			cis	-129.9	-160.1	-8.8	29.3	-3.7	0	0	0	115.5
731	Y	32	Very low	36	Very low	188 Å²	188	132 Å²	132	74%	0.737	75%	0.746	S	S	*	*			trans	-63.5	154.7	172.6	-63.5	-103.7	0	0	0	117.2	F345	F345-Y731 HydrophobicContact CE1-CD1 4.09Å; F345-Y731 HydrophobicContact CE1-CE1 4.19Å
732	T	35.7	Very low	35.8	Very low	145 Å²	145	127.4 Å²	127.4	89%	0.89	74%	0.739	S	S	*	*			trans	-155.2	161.1	145.9	30.3	0	0	0	0	112.8
733	L	35.4	Very low	35.2	Very low	134 Å²	134	127.6 Å²	127.6	70%	0.702	74%	0.74	S	S	*	*			trans	-92.3	175.7	164.3	-82.8	101.8	0	0	0	110.1	F345	F345-L733 HydrophobicContact CE2-CD1 3.85Å; F345-L733 HydrophobicContact CZ-CD1 3.9Å
734	P	36.6	Very low	34.4	Very low	114 Å²	114	127 Å²	127	74%	0.74	74%	0.737	S	S	*	*			cis	-135.2	-172.9	8.6	43.7	-26.1	0	0	0	116.1
735	N	36.1	Very low	33.7	Very low	144 Å²	144	126.5 Å²	126.5	77%	0.77	74%	0.735	S	S	*	*			trans	-69.6	141.3	154.5	-179	69.8	0	0	0	108.6
736	P	40.8	Very low	33.6	Very low	95 Å²	95	128.1 Å²	128.1	62%	0.617	74%	0.735	S	S	*	*				-154.3	173.2	65.3	42.6	-22.1	0	0	0	119.8
737	Y	27.6	Very low	33.5	Very low	205 Å²	205	126.8 Å²	126.8	80%	0.804	74%	0.735	S	S	*	*			trans	72.1	126.7	143.6	-99	-131.3	0	0	0	120.9
738	V	30.2	Very low	32.8	Very low	136 Å²	136	131 Å²	131	82%	0.824	75%	0.749	S	S	*	*			trans	40.3	143.8	153.7	-87.7	0	0	0	0	120.7
739	A	29.8	Very low	32.7	Very low	96 Å²	96	126.9 Å²	126.9	79%	0.793	75%	0.747	S	S	*	*			cis	-148.3	167.3	-1.6	0	0	0	0	0	107.7
740	G	28.8	Very low	32.4	Very low	60 Å²	60	128.9 Å²	128.9	62%	0.619	75%	0.752	S	S	*	*			cis	164.7	159.7	-3.6	0	0	0	0	0	109.4
741	V	28.3	Very low	31.8	Very low	138 Å²	138	135.3 Å²	135.3	84%	0.836	76%	0.762	S	S	*	*			trans	46.2	125.5	160.3	-51.7	0	0	0	0	118.6
742	S	34.7	Very low	31.9	Very low	101 Å²	101	132.1 Å²	132.1	71%	0.706	76%	0.764	S	S	*	*				54.2	134.7	60.6	-51.3	0	0	0	0	112.1
743	P	34.3	Very low	31.6	Very low	117 Å²	117	132 Å²	132	76%	0.76	76%	0.758	S	S	*	*				-135.6	178.7	64.5	34.3	-12.1	0	0	0	111.7
744	L	26.7	Very low	31.3	Very low	137 Å²	137	132.8 Å²	132.8	72%	0.717	76%	0.763	S	S	*	*			cis	55.6	142.1	46.7	-80.4	74.9	0	0	0	110.4
745	N	26.4	Very low	30.8	Very low	133 Å²	133	134.2 Å²	134.2	71%	0.711	76%	0.761	S	S	*	*			cis	-136.1	174.1	5.2	-91.4	-41.7	0	0	0	107.4
746	S	36.6	Very low	30.6	Very low	103 Å²	103	134.5 Å²	134.5	72%	0.72	76%	0.762	S	S	*	*				47.4	146.5	64.1	-94.3	0	0	0	0	114.7
747	P	35.1	Very low	30	Very low	113 Å²	113	135 Å²	135	73%	0.734	77%	0.768	S	S	*	*			cis	-140.2	-172.2	-13.5	41	-21.1	0	0	0	114.5
748	M	28.7	Very low	30.1	Very low	181 Å²	181	130 Å²	130	89%	0.892	76%	0.763	S	S	*	*			trans	34.4	108.3	136.5	-176.6	175.4	175.6	0	0	120.7
749	A	27.9	Very low	30	Very low	85 Å²	85	130.2 Å²	130.2	70%	0.702	76%	0.759	S	S	*	*				169.7	131.4	127	0	0	0	0	0	115.6
750	Q	26.9	Very low	30.1	Very low	177 Å²	177	129.8 Å²	129.8	83%	0.827	76%	0.755	S	S	*	*			trans	52.7	107.5	135.9	-56.1	174	6.4	0	0	123.3
751	R	29.4	Very low	30.1	Very low	240 Å²	240	133.3 Å²	133.3	91%	0.906	76%	0.76	S	S	*	*			trans	66.1	169.7	135.8	-73.3	178.1	169.1	-178.1	-4.6	119.4
752	P	34.2	Very low	30.1	Very low	120 Å²	120	131.6 Å²	131.6	78%	0.779	75%	0.754	S	S	*	*			cis	-120.2	-152.3	-26	36.4	-18.4	0	0	0	111.9
753	L	29.3	Very low	29.8	Very low	143 Å²	143	131.6 Å²	131.6	75%	0.749	76%	0.755	S	S	*	*			trans	-77.7	156.1	169.1	-65.3	80.8	0	0	0	111.6
754	D	28.5	Very low	29.6	Very low	151 Å²	151	133.4 Å²	133.4	81%	0.807	76%	0.757	S	S	*	*			trans	168.6	165.8	131.2	-91.4	-18.6	0	0	0	109.7
755	M	26.9	Very low	29.8	Very low	144 Å²	144	133 Å²	133	71%	0.709	76%	0.761	S	S	*	*			cis	-170.1	153.2	-40.8	-115.4	-67.4	159.8	0	0	107
756	L	30.7	Very low	29.9	Very low	149 Å²	149	132.6 Å²	132.6	78%	0.78	77%	0.767	S	S	*	*			trans	64.3	139	173.5	-84.1	54.2	0	0	0	116.1
757	S	28.7	Very low	29.6	Very low	107 Å²	107	139.3 Å²	139.3	75%	0.748	78%	0.776	S	S	*	*				70.4	142.8	75.7	-119.1	0	0	0	0	113.4
758	S	29.8	Very low	29.5	Very low	100 Å²	100	139.6 Å²	139.6	70%	0.699	78%	0.781	S	S	*	*			cis	-155.4	140.9	12.2	-101.4	0	0	0	0	109.9
759	N	28.8	Very low	29.7	Very low	139 Å²	139	134.3 Å²	134.3	74%	0.743	77%	0.773	S	S	*	*				60.9	100.9	95.2	-169.6	53.6	0	0	0	118
760	A	32.1	Very low	30	Very low	87 Å²	87	135.2 Å²	135.2	72%	0.719	78%	0.78	S	S	*	*			trans	-165.6	134	151.1	0	0	0	0	0	107.7
761	N	28.4	Very low	30.5	Very low	135 Å²	135	135.9 Å²	135.9	72%	0.722	78%	0.78	S	S	*	*				64.7	126.6	55.3	-65.4	-7.3	0	0	0	112.8
762	S	27.7	Very low	30.6	Very low	101 Å²	101	127.9 Å²	127.9	71%	0.706	76%	0.761	S	S	*	*			cis	-157.6	165.8	-2.4	-92	0	0	0	0	112.5
763	S	28.6	Very low	30.7	Very low	102 Å²	102	132 Å²	132	71%	0.713	76%	0.763	S	S	*	*			trans	-22.3	150.9	150	-39.8	0	0	0	0	116.8
764	L	29.7	Very low	31.3	Very low	155 Å²	155	133.2 Å²	133.2	81%	0.812	77%	0.767	S	S	*	*				177.9	151.9	111.8	-93.1	161.2	0	0	0	115.4
765	T	32.1	Very low	32.2	Very low	129 Å²	129	130.9 Å²	130.9	79%	0.791	76%	0.759	S	S	*	*			trans	59.7	124.5	151.9	47.9	0	0	0	0	122.9
766	C	27.3	Very low	32.5	Very low	124 Å²	124	129.9 Å²	129.9	84%	0.838	76%	0.762	S	S	*	*			trans	-88	154.6	162.1	-39.3	0	0	0	0	111.9
767	R	31.3	Very low	32.6	Very low	244 Å²	244	127.8 Å²	127.8	92%	0.921	76%	0.76	S	S	*	*			trans	-174.9	159.8	145.8	-103.1	176.1	166.6	-162.5	-4.9	108.7
768	S	32	Very low	33	Very low	119 Å²	119	127.2 Å²	127.2	83%	0.832	76%	0.761	S	S	*	*			cis	156.6	124.1	-31.7	-83.9	0	0	0	0	108
769	G	34.1	Very low	33.1	Very low	70 Å²	70	127.7 Å²	127.7	72%	0.722	76%	0.764	S	S	*	*			trans	154.8	124.1	174.2	0	0	0	0	0	110
770	A	34.5	Very low	33.3	Very low	104 Å²	104	126.9 Å²	126.9	86%	0.86	77%	0.765	S	S	*	*				70.1	137	54.5	0	0	0	0	0	112.2
771	K	35.5	Very low	33.3	Very low	190 Å²	190	126.8 Å²	126.8	83%	0.826	76%	0.764	S	S	*	*			cis	-163.3	169.4	3.1	-120	-169.4	175.3	-175	0	106.4
772	S	32.4	Very low	33.7	Very low	73 Å²	73	128 Å²	128	51%	0.51	77%	0.769	S	S	.	*			cis	-165.1	168.7	-27.2	37	0	0	0	0	107
773	Y	35.5	Very low	34	Very low	206 Å²	206	129 Å²	129	81%	0.808	77%	0.771	S	S	*	*				173.2	167.1	100.6	-104.1	-85	0	0	0	113
774	M	42.4	Very low	34.6	Very low	169 Å²	169	129.3 Å²	129.3	83%	0.833	77%	0.77	S	S	*	*			trans	-150.9	-174.3	-179.1	-77.9	-71.5	-177.6	0	0	107.2
775	P	47.1	Very low	34.6	Very low	101 Å²	101	128.2 Å²	128.2	66%	0.656	77%	0.77	S	S	*	*			cis	-148.7	-156.1	13.6	38.3	-12.1	0	0	0	116.6
776	T	33.7	Very low	34.6	Very low	124 Å²	124	126 Å²	126	76%	0.761	77%	0.766	S	S	*	*			trans	74.9	152.7	144	43.5	0	0	0	0	122.4
777	S	32.4	Very low	34.7	Very low	105 Å²	105	127 Å²	127	73%	0.734	77%	0.768	S	S	*	*			cis	-171.8	172	-8.2	45.4	0	0	0	0	114.2
778	A	37	Very low	34.6	Very low	94 Å²	94	119.9 Å²	119.9	78%	0.777	76%	0.755	S	S	*	*			trans	74.6	150.2	167.3	0	0	0	0	0	116.6
779	S	33.2	Very low	34.5	Very low	110 Å²	110	121.6 Å²	121.6	77%	0.769	75%	0.754	S	S	*	*			cis	-169.1	178	-4.8	-110.1	0	0	0	0	109
780	T	31.8	Very low	34.2	Very low	122 Å²	122	128.2 Å²	128.2	75%	0.748	76%	0.764	S	S	*	*			cis	-178.1	160.4	-30.8	-80.7	0	0	0	0	108.8
781	A	32.2	Very low	34.1	Very low	85 Å²	85	127.3 Å²	127.3	70%	0.702	76%	0.756	S	S	*	*			trans	71.4	148.9	174.2	0	0	0	0	0	117.9
782	I	37.4	Very low	34.5	Very low	161 Å²	161	121.9 Å²	121.9	83%	0.826	74%	0.74	S	S	*	*			cis	-147	165.6	-9.9	-108.8	161	0	0	0	110
783	T	33.7	Very low	34.9	Very low	123 Å²	123	126.7 Å²	126.7	76%	0.755	76%	0.755	S	S	*	*			trans	-94.8	-176.2	-170.7	42.4	0	0	0	0	115.1
784	P	41.4	Very low	35.3	Very low	107 Å²	107	125.2 Å²	125.2	70%	0.695	76%	0.755	S	S	*	*			cis	-137.9	-169.3	-34.4	31.4	-9.8	0	0	0	115
785	T	29.4	Very low	35.2	Very low	132 Å²	132	123.6 Å²	123.6	81%	0.81	75%	0.745	S	S	*	*			trans	117.7	147.3	142.6	-40	0	0	0	0	117.3
786	A	31.8	Very low	35	Very low	84 Å²	84	127.4 Å²	127.4	69%	0.694	75%	0.747	S	S	*	*			trans	76.6	86.2	171.7	0	0	0	0	0	119.7
787	T	30.7	Very low	35.4	Very low	144 Å²	144	127.4 Å²	127.4	88%	0.883	74%	0.738	S	S	*	*				36.7	125.6	114.2	-46.3	0	0	0	0	118.8
788	S	28.6	Very low	36.1	Very low	94 Å²	94	129.4 Å²	129.4	66%	0.657	74%	0.736	S	S	*	*			cis	-171.3	177.6	-4.4	-171.7	0	0	0	0	110.8
789	L	29.3	Very low	36.4	Very low	155 Å²	155	131.1 Å²	131.1	81%	0.812	73%	0.728	S	S	*	*			trans	66.8	70.6	160.3	-72	160.1	0	0	0	119.9
790	F	29.3	Very low	36.8	Very low	210 Å²	210	131 Å²	131	92%	0.921	72%	0.715	S	S	*	*			trans	-130.9	151	154.4	-84.7	-92.5	0	0	0	112
791	A	30.9	Very low	37.2	Very low	85 Å²	85	131.3 Å²	131.3	70%	0.702	71%	0.708	S	S	*	*			trans	64.9	145.9	-160.4	0	0	0	0	0	113.1
792	P	44.3	Very low	37.5	Very low	76 Å²	76	133.5 Å²	133.5	49%	0.494	70%	0.704	S	S	.	*			cis	-107.7	115.3	30.1	37	-30.8	0	0	0	115.1	Q794 Q795	P792-Q794 PolarHBondContact O-N 3.2Å; P792-Q795 HydrophobicContact CG-CB 4.21Å
793	Q	40.7	Very low	37.6	Very low	174 Å²	174	130.6 Å²	130.6	81%	0.813	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.3	-14.3	-168.6	-162.4	158.9	-18.6	0	0	115.3
794	Q	43.2	Very low	37.8	Very low	175 Å²	175	129.2 Å²	129.2	82%	0.818	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.7	-34.8	174	-82	-175.4	-13.6	0	0	114.3	P792 Q797	P792-Q794 PolarHBondContact O-N 3.2Å; Q794-Q797 PolarHBondContact O-N 3.39Å
795	Q	40.1	Very low	37.7	Very low	134 Å²	134	131 Å²	131	63%	0.626	67%	0.671	S	S	*	*	H	α-helix	trans	-70.6	-35.9	-179.6	-97.1	-178.8	-14.6	0	0	112.8	P792 Q797 Q798 Q799	P792-Q795 HydrophobicContact CG-CB 4.21Å; Q795-Q797 PolarHBondContact O-N 3.26Å; Q795-Q798 PolarHBondContact O-N 2.94Å; Q795-Q798 VanDerWaalsContact O-N 3.15Å; Q795-Q799 PolarHBondContact O-N 2.81Å
796	R	42.9	Very low	38.1	Very low	182 Å²	182	129.3 Å²	129.3	69%	0.687	65%	0.654	S	S	*	*	H	α-helix	trans	-61	-26.6	175.2	-91.9	-168.5	171	-165.8	-1.1	113.1	Q800	R796-Q800 WeakPolarHBondContact O-CB 3.13Å; R796-Q800 VanDerWaalsContact O-CG 3.24Å; R796-Q800 WeakPolarHBondContact O-CG 3.28Å; R796-Q800 PolarHBondContact O-N 3.46Å
797	Q	43.9	Very low	38.4	Very low	124 Å²	124	132 Å²	132	58%	0.579	65%	0.651	S	S	*	*	H	α-helix	trans	-73.8	-33.9	175.1	-69	-163.1	7.2	0	0	113.3	Q794 Q795 Q801	Q794-Q797 PolarHBondContact O-N 3.39Å; Q795-Q797 PolarHBondContact O-N 3.26Å; Q797-Q801 WeakPolarHBondContact O-CG 3.4Å; Q797-Q801 PolarHBondContact O-N 3.39Å
798	Q	45.5	Very low	38.6	Very low	147 Å²	147	132.5 Å²	132.5	69%	0.687	64%	0.642	S	S	*	*	H	α-helix	trans	-74.4	-41.1	173.7	-67.7	-166.2	7.6	0	0	111.7	Q795 Q800 Q801 Q802	Q795-Q798 PolarHBondContact O-N 2.94Å; Q795-Q798 VanDerWaalsContact O-N 3.15Å; Q798-Q800 VanDerWaalsContact C-N 3.3Å; Q798-Q800 PolarHBondContact O-N 3.39Å; Q798-Q801 PolarHBondContact O-N 3.17Å; Q798-Q801 VanDerWaalsContact O-N 3.14Å; Q798-Q802 PolarHBondContact O-N 2.84Å
799	Q	43.9	Very low	38.6	Very low	129 Å²	129	135.5 Å²	135.5	60%	0.603	64%	0.638	S	S	*	*	H	α-helix	trans	-63.5	-33.4	170.8	-78.9	-168.5	-6	0	0	112.4	Q795 H803	Q795-Q799 PolarHBondContact O-N 2.81Å; Q799-H803 VanDerWaalsContact O-CB 3.25Å; Q799-H803 WeakPolarHBondContact O-CB 3.48Å; Q799-H803 PolarHBondContact O-N 3.43Å; Q799-H803 PolarHBondContact O-ND1 2.86Å
800	Q	41.6	Very low	38.5	Very low	109 Å²	109	132 Å²	132	51%	0.509	63%	0.632	S	S	.	*	H	α-helix	trans	-74.8	-25.1	171.3	-78.9	-175.5	-1.3	0	0	113.6	R796 Q798 Q804	R796-Q800 WeakPolarHBondContact O-CB 3.13Å; R796-Q800 VanDerWaalsContact O-CG 3.24Å; R796-Q800 WeakPolarHBondContact O-CG 3.28Å; R796-Q800 PolarHBondContact O-N 3.46Å; Q798-Q800 VanDerWaalsContact C-N 3.3Å; Q798-Q800 PolarHBondContact O-N 3.39Å; Q800-Q804 WeakPolarHBondContact O-CA 3.47Å; Q800-Q804 WeakPolarHBondContact O-CB 3.26Å; Q800-Q804 VanDerWaalsContact O-CG 3.25Å; Q800-Q804 WeakPolarHBondContact O-CG 3.11Å; Q800-Q804 PolarHBondContact O-N 3.16Å
801	Q	41.1	Very low	38.7	Very low	127 Å²	127	133.2 Å²	133.2	59%	0.593	63%	0.631	S	S	*	*	H	α-helix	trans	-76.5	-33.9	171.4	-76	-173.5	33.3	0	0	112.2	Q797 Q798 Q805	Q797-Q801 WeakPolarHBondContact O-CG 3.4Å; Q797-Q801 PolarHBondContact O-N 3.39Å; Q798-Q801 PolarHBondContact O-N 3.17Å; Q798-Q801 VanDerWaalsContact O-N 3.14Å; Q801-Q805 WeakPolarHBondContact O-CG 3.41Å; Q801-Q805 PolarHBondContact O-N 3.44Å
802	Q	37.4	Very low	39.7	Very low	132 Å²	132	133.2 Å²	133.2	62%	0.617	62%	0.622	S	S	*	*	H	α-helix	trans	-68.4	-50.1	166.6	-68.2	-163.9	5.8	0	0	111.1	Q798 Q804 Q805 Q806	Q798-Q802 PolarHBondContact O-N 2.84Å; Q802-Q804 PolarHBondContact O-N 3.07Å; Q802-Q805 CarbonylContact O-C 3.49Å; Q802-Q805 WeakPolarHBondContact O-CA 3.4Å; Q802-Q805 PolarHBondContact O-N 2.77Å; Q802-Q806 WeakPolarHBondContact O-CG 3.46Å; Q802-Q806 PolarHBondContact O-N 2.81Å
803	H	40.3	Very low	40	Very low	100 Å²	100	139.1 Å²	139.1	46%	0.463	63%	0.634	S	S	.	*	H	α-helix	trans	-61.5	-39.6	176.9	-89.6	91.2	0	0	0	112.8	Q799 Q805 Q806 Q807	Q799-H803 VanDerWaalsContact O-CB 3.25Å; Q799-H803 WeakPolarHBondContact O-CB 3.48Å; Q799-H803 PolarHBondContact O-N 3.43Å; Q799-H803 PolarHBondContact O-ND1 2.86Å; H803-Q805 PolarHBondContact O-N 3.09Å; H803-Q806 CarbonylContact O-C 3.53Å; H803-Q806 PolarHBondContact O-N 3.2Å; H803-Q807 WeakPolarHBondContact O-CA 3.4Å; H803-Q807 WeakPolarHBondContact O-CB 3.29Å; H803-Q807 VanDerWaalsContact O-CG 3.29Å; H803-Q807 WeakPolarHBondContact O-CG 3.44Å; H803-Q807 PolarHBondContact O-N 2.79Å
804	Q	38.3	Very low	41.7	Very low	94 Å²	94	132.3 Å²	132.3	44%	0.439	60%	0.603	S	S	.	*	H	α-helix	trans	-70.3	-16.4	173.7	-75	-164	32.7	0	0	113.6	Q800 Q802 K808	Q800-Q804 WeakPolarHBondContact O-CA 3.47Å; Q800-Q804 WeakPolarHBondContact O-CB 3.26Å; Q800-Q804 VanDerWaalsContact O-CG 3.25Å; Q800-Q804 WeakPolarHBondContact O-CG 3.11Å; Q800-Q804 PolarHBondContact O-N 3.16Å; Q802-Q804 PolarHBondContact O-N 3.07Å; Q804-K808 VanDerWaalsContact O-CB 3.31Å; Q804-K808 WeakPolarHBondContact O-CB 3.49Å; Q804-K808 WeakPolarHBondContact O-CD 3.39Å; Q804-K808 WeakPolarHBondContact O-CG 3.25Å
805	Q	38.9	Very low	43.7	Very low	144 Å²	144	126.6 Å²	126.6	67%	0.673	58%	0.58	S	S	*	*	H	α-helix	trans	-90.8	-14.8	166.6	-68.8	-172.7	48.2	0	0	112.8	Q801 Q802 H803 R809	Q801-Q805 WeakPolarHBondContact O-CG 3.41Å; Q801-Q805 PolarHBondContact O-N 3.44Å; Q802-Q805 CarbonylContact O-C 3.49Å; Q802-Q805 WeakPolarHBondContact O-CA 3.4Å; Q802-Q805 PolarHBondContact O-N 2.77Å; H803-Q805 PolarHBondContact O-N 3.09Å; Q805-R809 WeakPolarHBondContact O-CG 3.46Å
806	Q	37	Very low	45.8	Very low	97 Å²	97	125.1 Å²	125.1	45%	0.453	58%	0.577	S	S	.	*	H	α-helix	trans	-103.7	-9.4	175	-60.1	-152.4	53.9	0	0	114.8	Q802 H803 R809	Q802-Q806 WeakPolarHBondContact O-CG 3.46Å; Q802-Q806 PolarHBondContact O-N 2.81Å; H803-Q806 CarbonylContact O-C 3.53Å; H803-Q806 PolarHBondContact O-N 3.2Å; Q806-R809 WeakPolarHBondContact O-CB 3.4Å
807	Q	38.2	Very low	47.8	Very low	139 Å²	139	122 Å²	122	65%	0.65	57%	0.573	S	S	*	*	S	Bend	trans	-107.2	-8.8	171.5	-66.1	169.1	-24.8	0	0	111.3	H803	H803-Q807 WeakPolarHBondContact O-CA 3.4Å; H803-Q807 WeakPolarHBondContact O-CB 3.29Å; H803-Q807 VanDerWaalsContact O-CG 3.29Å; H803-Q807 WeakPolarHBondContact O-CG 3.44Å; H803-Q807 PolarHBondContact O-N 2.79Å
808	K	36	Very low	49.9	Very low	156 Å²	156	117.9 Å²	117.9	68%	0.678	55%	0.554	S	S	*	*	S	Bend	trans	-94.1	1.7	156.7	-62.2	169.3	-161	154.2	0	111.4	Q804	Q804-K808 VanDerWaalsContact O-CB 3.31Å; Q804-K808 WeakPolarHBondContact O-CB 3.49Å; Q804-K808 WeakPolarHBondContact O-CD 3.39Å; Q804-K808 WeakPolarHBondContact O-CG 3.25Å
809	R	27	Very low	52.1	Low	156 Å²	156	112.9 Å²	112.9	59%	0.589	53%	0.532	S	S	*	.	S	Bend	trans	-76.7	166.1	157.6	-79.3	174.9	-169.2	-175.7	-0.8	109.3	Q805 Q806	Q805-R809 WeakPolarHBondContact O-CG 3.46Å; Q806-R809 WeakPolarHBondContact O-CB 3.4Å
810	A	27.4	Very low	54.2	Low	82 Å²	82	113.9 Å²	113.9	68%	0.678	53%	0.534	S	S	*	.			trans	54.3	105.6	-173.6	0	0	0	0	0	112.9	T812	A810-T812 PolarHBondContact O-N 3.38Å; A810-T812 VanDerWaalsContact O-N 3.13Å
811	R	34.4	Very low	56.5	Low	236 Å²	236	110.4 Å²	110.4	89%	0.891	52%	0.519	S	S	*	.			trans	-57	117.5	140	177.1	-173.2	-172.7	177.9	4.9	104.6	R813	R811-R813 PolarHBondContact O-N 2.75Å
812	T	51.6	Low	59	Low	85 Å²	85	104.3 Å²	104.3	52%	0.521	49%	0.491	S	S	.	.			trans	-46	112.8	-172.2	39.8	0	0	0	0	110.6	A810 I814	A810-T812 PolarHBondContact O-N 3.38Å; A810-T812 VanDerWaalsContact O-N 3.13Å; T812-I814 PolarHBondContact O-N 3.17Å
813	R	50.1	Low	61.4	Low	200 Å²	200	104.7 Å²	104.7	76%	0.755	49%	0.486	S	S	*	.			trans	-79.4	102.1	169.3	179.2	-177.7	174.6	-164.4	-5.5	105.2	R811 T815 D816	R811-R813 PolarHBondContact O-N 2.75Å; R813-T815 PolarHBondContact O-N 3.02Å; R813-D816 IonicContact NH2-OD2 2.66Å; R813-D816 PolarHBondContact NH2-OD2 2.9Å
814	I	76.6	Confident	63.7	Low	31 Å²	31	104.6 Å²	104.6	16%	0.159	49%	0.486	C	S	.	.			trans	-56.8	125.9	164.9	-55	176.1	0	0	0	106.3	T812 Q818 L819 L822 L846 W854	T812-I814 PolarHBondContact O-N 3.17Å; I814-Q818 HydrophobicContact CG2-CB 3.48Å; I814-Q818 VanDerWaalsContact CG2-CB 3.48Å; I814-L819 HydrophobicContact CB-CD2 4.33Å; I814-L819 HydrophobicContact CB-CG 4.32Å; I814-L819 HydrophobicContact CG2-CD2 3.78Å; I814-L819 HydrophobicContact CG2-CG 3.68Å; I814-L822 HydrophobicContact CD1-CD1 3.99Å; I814-L822 HydrophobicContact CG2-CD1 3.76Å; I814-L846 HydrophobicContact CG1-CD1 4.39Å; I814-L846 HydrophobicContact CG2-CD1 4.13Å; I814-W854 VanDerWaalsContact CD1-CD1 3.42Å; I814-W854 HydrophobicContact CD1-CG 4.31Å
815	T	84.7	Confident	66	Low	54 Å²	54	101.2 Å²	101.2	33%	0.331	47%	0.47	S	S	.	.			trans	-69.2	167.1	175.1	74.5	0	0	0	0	110.2	R813 D817 Q818 L819	R813-T815 PolarHBondContact O-N 3.02Å; T815-D817 VanDerWaalsContact C-N 3.28Å; T815-D817 WeakPolarHBondContact CB-OD2 3.4Å; T815-D817 PolarHBondContact O-N 3.21Å; T815-D817 PolarHBondContact OG1-OD2 3.24Å; T815-Q818 PolarHBondContact O-N 3.29Å; T815-Q818 WeakPolarHBondContact OG1-CG 3.44Å; T815-Q818 PolarHBondContact OG1-N 3.46Å; T815-Q818 VanDerWaalsContact OG1-N 3.1Å; T815-L819 WeakPolarHBondContact O-CG 3.48Å; T815-L819 PolarHBondContact O-N 2.8Å
816	D	84.8	Confident	68.3	Low	104 Å²	104	95.6 Å²	95.6	56%	0.556	44%	0.443	S	S	*	.	H	α-helix	trans	-72.8	-26	-178.5	-62.1	-73.1	0	0	0	111	R813 L819 K820	R813-D816 IonicContact NH2-OD2 2.66Å; R813-D816 PolarHBondContact NH2-OD2 2.9Å; D816-L819 CarbonylContact O-C 3.56Å; D816-L819 WeakPolarHBondContact O-CB 3.43Å; D816-L819 PolarHBondContact O-N 2.97Å; D816-K820 PolarHBondContact O-N 3.33Å
817	D	84.8	Confident	70.4	Confident	115 Å²	115	96.3 Å²	96.3	62%	0.615	45%	0.45	S	S	*	.	H	α-helix	trans	-69.6	-44.6	168.4	-19.4	-85.4	0	0	0	111.9	T815 L819 K820 I821	T815-D817 VanDerWaalsContact C-N 3.28Å; T815-D817 WeakPolarHBondContact CB-OD2 3.4Å; T815-D817 PolarHBondContact O-N 3.21Å; T815-D817 PolarHBondContact OG1-OD2 3.24Å; D817-L819 PolarHBondContact O-N 3.5Å; D817-K820 WeakPolarHBondContact O-CA 3.47Å; D817-K820 WeakPolarHBondContact O-CB 3.44Å; D817-K820 PolarHBondContact O-N 3.43Å; D817-I821 PolarHBondContact O-N 3Å; D817-I821 VanDerWaalsContact O-N 3.09Å
818	Q	89	Confident	72.2	Confident	38 Å²	38	94.6 Å²	94.6	18%	0.178	44%	0.444	C	S	.	.	H	α-helix	trans	-62.6	-30.5	172.1	-70.8	176.2	-27.6	0	0	111.6	I814 T815 L822 S844 L846	I814-Q818 HydrophobicContact CG2-CB 3.48Å; I814-Q818 VanDerWaalsContact CG2-CB 3.48Å; T815-Q818 PolarHBondContact O-N 3.29Å; T815-Q818 WeakPolarHBondContact OG1-CG 3.44Å; T815-Q818 PolarHBondContact OG1-N 3.46Å; T815-Q818 VanDerWaalsContact OG1-N 3.1Å; Q818-L822 VanDerWaalsContact O-CB 3.28Å; Q818-L822 WeakPolarHBondContact O-CB 3.44Å; Q818-L822 WeakPolarHBondContact O-CD1 3.48Å; Q818-L822 VanDerWaalsContact O-CG 3.23Å; Q818-L822 WeakPolarHBondContact O-CG 3.43Å; Q818-L822 PolarHBondContact O-N 3.43Å; Q818-S844 WeakPolarHBondContact CG-O 3.42Å; Q818-S844 PolarHBondContact NE2-O 3.27Å; Q818-L846 HydrophobicContact CB-CD1 4.28Å; Q818-L846 HydrophobicContact CG-CG 4.44Å
819	L	90	Very high	73.8	Confident	43 Å²	43	90 Å²	90	23%	0.225	43%	0.427	C	S	.	.	H	α-helix	trans	-73.1	-30.1	170.5	-74.8	174.8	0	0	0	112.8	I814 T815 D816 D817 R823 W854	I814-L819 HydrophobicContact CB-CD2 4.33Å; I814-L819 HydrophobicContact CB-CG 4.32Å; I814-L819 HydrophobicContact CG2-CD2 3.78Å; I814-L819 HydrophobicContact CG2-CG 3.68Å; T815-L819 WeakPolarHBondContact O-CG 3.48Å; T815-L819 PolarHBondContact O-N 2.8Å; D816-L819 CarbonylContact O-C 3.56Å; D816-L819 WeakPolarHBondContact O-CB 3.43Å; D816-L819 PolarHBondContact O-N 2.97Å; D817-L819 PolarHBondContact O-N 3.5Å; L819-R823 WeakPolarHBondContact O-CB 3.39Å; L819-R823 VanDerWaalsContact O-CD 3.29Å; L819-R823 WeakPolarHBondContact O-CD 2.91Å; L819-R823 WeakPolarHBondContact O-CG 3.46Å; L819-R823 PolarHBondContact O-N 2.87Å; L819-W854 HydrophobicContact CD2-CZ2 4.44Å
820	K	89.9	Confident	76.1	Confident	149 Å²	149	85.4 Å²	85.4	65%	0.648	41%	0.414	S	S	*	.	H	α-helix	trans	-61.8	-56	172.4	-171.1	-176.6	177.6	-173.5	0	109.9	D816 D817 L822 R823 E824	D816-K820 PolarHBondContact O-N 3.33Å; D817-K820 WeakPolarHBondContact O-CA 3.47Å; D817-K820 WeakPolarHBondContact O-CB 3.44Å; D817-K820 PolarHBondContact O-N 3.43Å; K820-L822 VanDerWaalsContact C-N 3.29Å; K820-L822 PolarHBondContact O-N 3.03Å; K820-R823 WeakPolarHBondContact O-CB 3.21Å; K820-R823 PolarHBondContact O-N 2.64Å; K820-E824 WeakPolarHBondContact O-CB 3.29Å; K820-E824 PolarHBondContact O-N 3Å
821	I	89.5	Confident	78.7	Confident	36 Å²	36	85.3 Å²	85.3	19%	0.185	41%	0.408	C	S	.	.	H	α-helix	trans	-57.9	-41.5	177.2	-59.3	166.1	0	0	0	111.1	D817 R823 Y825 M840 K843	D817-I821 PolarHBondContact O-N 3Å; D817-I821 VanDerWaalsContact O-N 3.09Å; I821-R823 VanDerWaalsContact C-N 3.27Å; I821-R823 PolarHBondContact O-N 2.79Å; I821-Y825 HydrophobicContact CG2-CD2 4.39Å; I821-Y825 HydrophobicContact CG2-CE2 4.35Å; I821-Y825 WeakPolarHBondContact O-CD2 3.2Å; I821-Y825 PolarHBondContact O-N 3.14Å; I821-M840 WeakPolarHBondContact O-CE 3.33Å; I821-K843 HydrophobicContact CD1-CB 4.48Å; I821-K843 WeakPolarHBondContact CD1-O 3.31Å; I821-K843 HydrophobicContact CG2-CB 4.09Å
822	L	92	Very high	81	Confident	0 Å²	0	75.1 Å²	75.1	0%	0	37%	0.373	C	S	.	.	H	α-helix	trans	-65.9	-26.7	177.2	-81.3	165.8	0	0	0	114.1	I814 Q818 K820 F826 M840 L846 I851 W854 F855	I814-L822 HydrophobicContact CD1-CD1 3.99Å; I814-L822 HydrophobicContact CG2-CD1 3.76Å; Q818-L822 VanDerWaalsContact O-CB 3.28Å; Q818-L822 WeakPolarHBondContact O-CB 3.44Å; Q818-L822 WeakPolarHBondContact O-CD1 3.48Å; Q818-L822 VanDerWaalsContact O-CG 3.23Å; Q818-L822 WeakPolarHBondContact O-CG 3.43Å; Q818-L822 PolarHBondContact O-N 3.43Å; K820-L822 VanDerWaalsContact C-N 3.29Å; K820-L822 PolarHBondContact O-N 3.03Å; L822-F826 WeakPolarHBondContact O-CB 3.08Å; L822-M840 HydrophobicContact CB-CE 4.5Å; L822-M840 HydrophobicContact CD2-CE 3.77Å; L822-M840 HydrophobicContact CG-CE 4.33Å; L822-L846 HydrophobicContact CD1-CD1 3.57Å; L822-L846 HydrophobicContact CG-CD1 4.29Å; L822-I851 HydrophobicContact CD2-CG1 4.32Å; L822-I851 HydrophobicContact CD2-CG2 4.07Å; L822-W854 HydrophobicContact CB-CD2 4.06Å; L822-W854 HydrophobicContact CB-CE3 4.1Å; L822-W854 HydrophobicContact CB-CH2 3.95Å; L822-W854 HydrophobicContact CB-CZ2 3.86Å; L822-W854 HydrophobicContact CB-CZ3 4.06Å; L822-W854 HydrophobicContact CD1-CB 4.47Å; L822-W854 HydrophobicContact CD1-CD2 3.99Å; L822-W854 HydrophobicContact CD1-CG 3.88Å; L822-W854 HydrophobicContact CD2-CB 4.33Å; L822-W854 HydrophobicContact CD2-CD2 3.88Å; L822-W854 HydrophobicContact CD2-CE3 3.76Å; L822-W854 HydrophobicContact CD2-CG 4.14Å; L822-W854 HydrophobicContact CD2-CZ3 4.38Å; L822-W854 HydrophobicContact CG-CD2 4.23Å; L822-W854 HydrophobicContact CG-CE3 4.4Å; L822-W854 WeakPolarHBondContact O-CH2 3.38Å; L822-W854 WeakPolarHBondContact O-CZ3 3.14Å; L822-F855 HydrophobicContact CD2-CD2 4.35Å; L822-F855 HydrophobicContact CD2-CE2 3.88Å
823	R	89.7	Confident	82.6	Confident	140 Å²	140	73.5 Å²	73.5	53%	0.528	37%	0.365	S	S	.	.	H	α-helix	trans	-84.1	-47.8	178.2	-74.6	165.6	175.8	-78.7	16.4	112	L819 K820 I821 Y825 F826 D827 W854	L819-R823 WeakPolarHBondContact O-CB 3.39Å; L819-R823 VanDerWaalsContact O-CD 3.29Å; L819-R823 WeakPolarHBondContact O-CD 2.91Å; L819-R823 WeakPolarHBondContact O-CG 3.46Å; L819-R823 PolarHBondContact O-N 2.87Å; K820-R823 WeakPolarHBondContact O-CB 3.21Å; K820-R823 PolarHBondContact O-N 2.64Å; I821-R823 VanDerWaalsContact C-N 3.27Å; I821-R823 PolarHBondContact O-N 2.79Å; R823-Y825 VanDerWaalsContact C-N 3.25Å; R823-Y825 PolarHBondContact O-N 2.89Å; R823-F826 CarbonylContact O-C 3.28Å; R823-F826 WeakPolarHBondContact O-CA 3.16Å; R823-F826 WeakPolarHBondContact O-CB 3.5Å; R823-F826 PolarHBondContact O-N 3.5Å; R823-D827 WeakPolarHBondContact O-CB 3.14Å; R823-D827 PolarHBondContact O-N 3.27Å; R823-D827 VanDerWaalsContact O-OD2 3.05Å; R823-W854 HydrophobicContact CG-CH2 4.47Å; R823-W854 HydrophobicContact CG-CZ2 4.5Å
824	E	87.1	Confident	84.3	Confident	98 Å²	98	70.1 Å²	70.1	46%	0.458	36%	0.358	S	S	.	.	H	α-helix	trans	-44.2	-50.9	176	-171.6	175	174.1	0	0	111.7	K820 I828	K820-E824 WeakPolarHBondContact O-CB 3.29Å; K820-E824 PolarHBondContact O-N 3Å; E824-I828 WeakPolarHBondContact O-CD1 3.33Å; E824-I828 VanDerWaalsContact O-CG1 3.24Å; E824-I828 WeakPolarHBondContact O-CG1 3.35Å; E824-I828 PolarHBondContact O-N 3.23Å
825	Y	87.1	Confident	84.8	Confident	23 Å²	23	76 Å²	76	9%	0.09	38%	0.384	C	S	.	.	H	α-helix	trans	-76.1	-19.8	175.3	-76	-105.9	0	0	0	115.3	I821 R823 N829 E839 M840 K843	I821-Y825 HydrophobicContact CG2-CD2 4.39Å; I821-Y825 HydrophobicContact CG2-CE2 4.35Å; I821-Y825 WeakPolarHBondContact O-CD2 3.2Å; I821-Y825 PolarHBondContact O-N 3.14Å; R823-Y825 VanDerWaalsContact C-N 3.25Å; R823-Y825 PolarHBondContact O-N 2.89Å; Y825-N829 CarbonylContact O-C 3.56Å; Y825-N829 VanDerWaalsContact O-C 3.28Å; Y825-N829 VanDerWaalsContact O-CA 3.3Å; Y825-N829 WeakPolarHBondContact O-CA 3.25Å; Y825-N829 PolarHBondContact O-N 3.36Å; Y825-E839 VanDerWaalsContact CE1-OE2 3.3Å; Y825-E839 WeakPolarHBondContact CE1-OE2 3.17Å; Y825-E839 PolarHBondContact OH-OE1 2.95Å; Y825-E839 VanDerWaalsContact OH-OE1 3.08Å; Y825-E839 PolarHBondContact OH-OE2 2.89Å; Y825-M840 VanDerWaalsContact CB-CE 3.42Å; Y825-M840 WeakPolarHBondContact CB-SD 3.46Å; Y825-M840 HydrophobicContact CD1-CE 4.47Å; Y825-M840 HydrophobicContact CD1-CG 3.51Å; Y825-M840 HydrophobicContact CD1-SD 3.7Å; Y825-M840 HydrophobicContact CD2-CE 3.88Å; Y825-M840 HydrophobicContact CD2-CG 3.81Å; Y825-M840 HydrophobicContact CD2-SD 4.16Å; Y825-M840 HydrophobicContact CE1-CG 3.73Å; Y825-M840 HydrophobicContact CE2-CG 4.02Å; Y825-M840 HydrophobicContact CG-CE 3.69Å; Y825-M840 HydrophobicContact CG-CG 3.55Å; Y825-M840 HydrophobicContact CG-SD 3.49Å; Y825-K843 HydrophobicContact CE2-CD 4.27Å; Y825-K843 VanDerWaalsContact OH-CD 3.28Å; Y825-K843 WeakPolarHBondContact OH-CD 3.37Å; Y825-K843 PolarHBondContact OH-NZ 3Å
826	F	88.1	Confident	84.8	Confident	26 Å²	26	75.8 Å²	75.8	11%	0.114	38%	0.38	C	S	.	.	H	α-helix	trans	-79.4	-35.6	175.5	-178.2	-90.9	0	0	0	112.4	L822 R823 N829 N830 W854 F855 T858 L859	L822-F826 WeakPolarHBondContact O-CB 3.08Å; R823-F826 CarbonylContact O-C 3.28Å; R823-F826 WeakPolarHBondContact O-CA 3.16Å; R823-F826 WeakPolarHBondContact O-CB 3.5Å; R823-F826 PolarHBondContact O-N 3.5Å; F826-N829 CarbonylContact O-C 3.52Å; F826-N830 WeakPolarHBondContact CE2-OD1 3.27Å; F826-N830 WeakPolarHBondContact CZ-OD1 3.49Å; F826-N830 PolarHBondContact O-N 3.12Å; F826-W854 HydrophobicContact CB-CH2 3.95Å; F826-W854 HydrophobicContact CB-CZ3 3.85Å; F826-W854 HydrophobicContact CD2-CH2 4.18Å; F826-W854 AromaticContact CD2-CZ3 3.74Å; F826-W854 HydrophobicContact CD2-CZ3 3.74Å; F826-W854 HydrophobicContact CG-CH2 4.06Å; F826-W854 AromaticContact CG-CZ3 3.99Å; F826-W854 HydrophobicContact CG-CZ3 3.99Å; F826-F855 HydrophobicContact CB-CE1 3.8Å; F826-F855 HydrophobicContact CB-CZ 4.21Å; F826-F855 AromaticContact CD2-CD1 3.72Å; F826-F855 HydrophobicContact CD2-CD1 3.72Å; F826-F855 AromaticContact CD2-CE1 3.78Å; F826-F855 HydrophobicContact CD2-CE1 3.78Å; F826-F855 HydrophobicContact CG-CE1 4.28Å; F826-T858 HydrophobicContact CD1-CG2 4.41Å; F826-T858 HydrophobicContact CD2-CG2 4.01Å; F826-T858 HydrophobicContact CE1-CG2 3.93Å; F826-T858 HydrophobicContact CE2-CG2 3.48Å; F826-T858 VanDerWaalsContact CE2-CG2 3.48Å; F826-T858 HydrophobicContact CG-CG2 4.46Å; F826-T858 HydrophobicContact CZ-CG2 3.44Å; F826-T858 VanDerWaalsContact CZ-CG2 3.44Å; F826-L859 HydrophobicContact CE2-CG 4.41Å
827	D	79.4	Confident	85	Confident	112 Å²	112	71 Å²	71	60%	0.599	35%	0.354	S	S	*	.	H	α-helix	trans	-75.9	-33.2	179	-55.6	-31.6	0	0	0	109.4	R823	R823-D827 WeakPolarHBondContact O-CB 3.14Å; R823-D827 PolarHBondContact O-N 3.27Å; R823-D827 VanDerWaalsContact O-OD2 3.05Å
828	I	76.5	Confident	85.2	Confident	103 Å²	103	69.5 Å²	69.5	53%	0.528	34%	0.344	S	S	.	.	H	α-helix	trans	-75.1	-49.7	166.4	-60.5	163.4	0	0	0	112	E824	E824-I828 WeakPolarHBondContact O-CD1 3.33Å; E824-I828 VanDerWaalsContact O-CG1 3.24Å; E824-I828 WeakPolarHBondContact O-CG1 3.35Å; E824-I828 PolarHBondContact O-N 3.23Å
829	N	69.6	Low	85.2	Confident	58 Å²	58	71.1 Å²	71.1	31%	0.31	35%	0.351	S	S	.	.			trans	-139.2	94	-170.3	-101.6	-62.2	0	0	0	112.2	Y825 F826 S831 P832 Q836 F855	Y825-N829 CarbonylContact O-C 3.56Å; Y825-N829 VanDerWaalsContact O-C 3.28Å; Y825-N829 VanDerWaalsContact O-CA 3.3Å; Y825-N829 WeakPolarHBondContact O-CA 3.25Å; Y825-N829 PolarHBondContact O-N 3.36Å; F826-N829 CarbonylContact O-C 3.52Å; N829-S831 PolarHBondContact O-N 3.38Å; N829-P832 WeakPolarHBondContact O-CD 3.27Å; N829-Q836 PolarHBondContact ND2-NE2 2.99Å; N829-F855 WeakPolarHBondContact O-CE1 3.38Å
830	N	76.5	Confident	85.2	Confident	61 Å²	61	69.1 Å²	69.1	33%	0.326	34%	0.34	S	S	.	.	S	Bend	trans	-60.4	-13	-179.6	-159.9	-7	0	0	0	113.6	F826 L859	F826-N830 WeakPolarHBondContact CE2-OD1 3.27Å; F826-N830 WeakPolarHBondContact CZ-OD1 3.49Å; F826-N830 PolarHBondContact O-N 3.12Å; N830-L859 WeakPolarHBondContact O-CD1 3.28Å; N830-L859 WeakPolarHBondContact O-CD2 3.49Å; N830-L859 WeakPolarHBondContact O-CG 3.04Å; N830-L859 WeakPolarHBondContact OD1-CD2 3.37Å; N830-L859 WeakPolarHBondContact OD1-CG 3.27Å
831	S	81.2	Confident	85.2	Confident	80 Å²	80	63.5 Å²	63.5	56%	0.559	32%	0.32	S	S	*	.	S	Bend	trans	-144.3	84.1	171.6	-70.8	0	0	0	0	110.9	N829	N829-S831 PolarHBondContact O-N 3.38Å
832	P	82.6	Confident	85.2	Confident	22 Å²	22	68.7 Å²	68.7	14%	0.143	34%	0.341	C	S	.	.			trans	-70.8	153.3	-169.5	29	-37.2	0	0	0	113.3	N829 Q836 V837 F855	N829-P832 WeakPolarHBondContact O-CD 3.27Å; P832-Q836 HydrophobicContact CB-CB 3.81Å; P832-V837 HydrophobicContact CB-CG2 4.21Å; P832-V837 HydrophobicContact CG-CG2 3.78Å; P832-F855 HydrophobicContact CG-CD1 3.69Å; P832-F855 HydrophobicContact CG-CD2 3.97Å; P832-F855 HydrophobicContact CG-CE1 3.58Å; P832-F855 HydrophobicContact CG-CE2 3.9Å; P832-F855 HydrophobicContact CG-CG 3.88Å; P832-F855 HydrophobicContact CG-CZ 3.71Å
833	S	85.3	Confident	85.1	Confident	51 Å²	51	74.3 Å²	74.3	36%	0.357	37%	0.366	S	S	.	.			trans	-65.5	168.6	178.6	75.9	0	0	0	0	113.1	E835 Q836 V837	S833-E835 PolarHBondContact O-N 3.39Å; S833-Q836 PolarHBondContact O-N 3.08Å; S833-Q836 WeakPolarHBondContact OG-CB 3.44Å; S833-Q836 WeakPolarHBondContact OG-CG 3.47Å; S833-Q836 PolarHBondContact OG-N 2.7Å; S833-V837 WeakPolarHBondContact O-CB 3.43Å; S833-V837 VanDerWaalsContact O-CG2 3.27Å; S833-V837 WeakPolarHBondContact O-CG2 3.35Å; S833-V837 PolarHBondContact O-N 3.19Å
834	E	85.1	Confident	85	Confident	128 Å²	128	68 Å²	68	60%	0.598	34%	0.343	S	S	*	.	H	α-helix	trans	-56.2	-43.2	173.9	-166.5	73.7	-139.9	0	0	110.9	V837 E838 K852	E834-V837 PolarHBondContact O-N 2.85Å; E834-E838 PolarHBondContact O-N 2.91Å; E834-E838 VanDerWaalsContact O-N 3.08Å; E834-K852 IonicContact OE1-NZ 2.58Å; E834-K852 PolarHBondContact OE1-NZ 2.97Å; E834-K852 IonicContact OE2-NZ 3.62Å; E834-K852 PolarHBondContact OE2-NZ 3.06Å
835	E	87.5	Confident	85	Confident	154 Å²	154	66.2 Å²	66.2	72%	0.72	35%	0.351	S	S	*	.	H	α-helix	trans	-68.3	-49.2	177.7	177.8	176.7	-144.8	0	0	112.8	S833 V837 E838 E839	S833-E835 PolarHBondContact O-N 3.39Å; E835-V837 PolarHBondContact O-N 2.7Å; E835-E838 CarbonylContact O-C 3.59Å; E835-E838 WeakPolarHBondContact O-CA 3.27Å; E835-E838 WeakPolarHBondContact O-CB 3.4Å; E835-E838 PolarHBondContact O-N 2.84Å; E835-E839 PolarHBondContact O-N 3.47Å
836	Q	84.4	Confident	85.1	Confident	51 Å²	51	65.5 Å²	65.5	24%	0.238	35%	0.349	C	S	.	.	H	α-helix	trans	-58	-39.2	174.7	-75.1	170.4	-17.8	0	0	110.6	N829 P832 S833 E838 E839 M840	N829-Q836 PolarHBondContact ND2-NE2 2.99Å; P832-Q836 HydrophobicContact CB-CB 3.81Å; S833-Q836 PolarHBondContact O-N 3.08Å; S833-Q836 WeakPolarHBondContact OG-CB 3.44Å; S833-Q836 WeakPolarHBondContact OG-CG 3.47Å; S833-Q836 PolarHBondContact OG-N 2.7Å; Q836-E838 VanDerWaalsContact C-N 3.3Å; Q836-E838 PolarHBondContact O-N 3.14Å; Q836-E839 PolarHBondContact O-N 3.13Å; Q836-M840 VanDerWaalsContact O-CB 3.31Å; Q836-M840 WeakPolarHBondContact O-CB 3.34Å; Q836-M840 WeakPolarHBondContact O-CG 3.31Å; Q836-M840 PolarHBondContact O-N 2.86Å
837	V	90.2	Very high	85.1	Confident	3 Å²	3	68.1 Å²	68.1	2%	0.018	37%	0.368	C	S	.	.	H	α-helix	trans	-65.1	-32	174.1	168	0	0	0	0	112.6	P832 S833 E834 E835 S841 Q848 I851 K852	P832-V837 HydrophobicContact CB-CG2 4.21Å; P832-V837 HydrophobicContact CG-CG2 3.78Å; S833-V837 WeakPolarHBondContact O-CB 3.43Å; S833-V837 VanDerWaalsContact O-CG2 3.27Å; S833-V837 WeakPolarHBondContact O-CG2 3.35Å; S833-V837 PolarHBondContact O-N 3.19Å; E834-V837 PolarHBondContact O-N 2.85Å; E835-V837 PolarHBondContact O-N 2.7Å; V837-S841 VanDerWaalsContact O-CB 3.31Å; V837-S841 WeakPolarHBondContact O-CB 3.41Å; V837-S841 PolarHBondContact O-N 2.88Å; V837-Q848 HydrophobicContact CG1-CB 3.72Å; V837-Q848 HydrophobicContact CG1-CG 3.94Å; V837-I851 HydrophobicContact CG1-CB 4.32Å; V837-I851 HydrophobicContact CG1-CG2 4.19Å; V837-I851 HydrophobicContact CG2-CG2 4.28Å; V837-K852 HydrophobicContact CB-CG 4.47Å; V837-K852 HydrophobicContact CG1-CD 4.25Å; V837-K852 HydrophobicContact CG1-CG 3.7Å; V837-K852 HydrophobicContact CG2-CG 4.05Å
838	E	89.4	Confident	85.5	Confident	84 Å²	84	65.7 Å²	65.7	39%	0.393	35%	0.353	S	S	.	.	H	α-helix	trans	-72.7	-43.8	172	-169.7	177.8	124.9	0	0	112.1	E834 E835 Q836 M840 S841 K842	E834-E838 PolarHBondContact O-N 2.91Å; E834-E838 VanDerWaalsContact O-N 3.08Å; E835-E838 CarbonylContact O-C 3.59Å; E835-E838 WeakPolarHBondContact O-CA 3.27Å; E835-E838 WeakPolarHBondContact O-CB 3.4Å; E835-E838 PolarHBondContact O-N 2.84Å; Q836-E838 VanDerWaalsContact C-N 3.3Å; Q836-E838 PolarHBondContact O-N 3.14Å; E838-M840 VanDerWaalsContact C-N 3.33Å; E838-M840 PolarHBondContact O-N 3.07Å; E838-S841 CarbonylContact O-C 3.41Å; E838-S841 VanDerWaalsContact O-CA 3.32Å; E838-S841 WeakPolarHBondContact O-CA 3.23Å; E838-S841 WeakPolarHBondContact O-CB 3.47Å; E838-S841 PolarHBondContact O-N 3.47Å; E838-K842 WeakPolarHBondContact O-CG 3.48Å; E838-K842 PolarHBondContact O-N 3.23Å; E838-K842 WeakPolarHBondContact OE1-CE 3.36Å; E838-K842 IonicContact OE1-NZ 3.42Å; E838-K842 PolarHBondContact OE1-NZ 3.12Å
839	E	88.7	Confident	86	Confident	72 Å²	72	69.4 Å²	69.4	34%	0.336	37%	0.366	S	S	.	.	H	α-helix	trans	-60.1	-44.5	176.5	-158.8	-151.2	169.1	0	0	111	Y825 E835 Q836 S841 K842 K843	Y825-E839 VanDerWaalsContact CE1-OE2 3.3Å; Y825-E839 WeakPolarHBondContact CE1-OE2 3.17Å; Y825-E839 PolarHBondContact OH-OE1 2.95Å; Y825-E839 VanDerWaalsContact OH-OE1 3.08Å; Y825-E839 PolarHBondContact OH-OE2 2.89Å; E835-E839 PolarHBondContact O-N 3.47Å; Q836-E839 PolarHBondContact O-N 3.13Å; E839-S841 VanDerWaalsContact C-N 3.27Å; E839-S841 PolarHBondContact O-N 3.16Å; E839-K842 WeakPolarHBondContact O-CB 3.4Å; E839-K842 PolarHBondContact O-N 2.99Å; E839-K842 VanDerWaalsContact O-N 3.14Å; E839-K843 HydrophobicContact CG-CD 4.39Å; E839-K843 WeakPolarHBondContact O-CB 2.93Å; E839-K843 PolarHBondContact O-N 3.23Å; E839-K843 VanDerWaalsContact OE1-CE 3.24Å; E839-K843 WeakPolarHBondContact OE1-CE 3.49Å; E839-K843 IonicContact OE1-NZ 2.7Å; E839-K843 PolarHBondContact OE1-NZ 3.16Å
840	M	88.7	Confident	86.9	Confident	0 Å²	0	68.2 Å²	68.2	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-63.6	-30.3	170.1	-67.8	-175.8	84.3	0	0	112.9	I821 L822 Y825 Q836 E838 K842 S844 I851 F855	I821-M840 WeakPolarHBondContact O-CE 3.33Å; L822-M840 HydrophobicContact CB-CE 4.5Å; L822-M840 HydrophobicContact CD2-CE 3.77Å; L822-M840 HydrophobicContact CG-CE 4.33Å; Y825-M840 VanDerWaalsContact CB-CE 3.42Å; Y825-M840 WeakPolarHBondContact CB-SD 3.46Å; Y825-M840 HydrophobicContact CD1-CE 4.47Å; Y825-M840 HydrophobicContact CD1-CG 3.51Å; Y825-M840 HydrophobicContact CD1-SD 3.7Å; Y825-M840 HydrophobicContact CD2-CE 3.88Å; Y825-M840 HydrophobicContact CD2-CG 3.81Å; Y825-M840 HydrophobicContact CD2-SD 4.16Å; Y825-M840 HydrophobicContact CE1-CG 3.73Å; Y825-M840 HydrophobicContact CE2-CG 4.02Å; Y825-M840 HydrophobicContact CG-CE 3.69Å; Y825-M840 HydrophobicContact CG-CG 3.55Å; Y825-M840 HydrophobicContact CG-SD 3.49Å; Q836-M840 VanDerWaalsContact O-CB 3.31Å; Q836-M840 WeakPolarHBondContact O-CB 3.34Å; Q836-M840 WeakPolarHBondContact O-CG 3.31Å; Q836-M840 PolarHBondContact O-N 2.86Å; E838-M840 VanDerWaalsContact C-N 3.33Å; E838-M840 PolarHBondContact O-N 3.07Å; M840-K842 VanDerWaalsContact C-N 3.34Å; M840-S844 VanDerWaalsContact O-CB 3.28Å; M840-S844 WeakPolarHBondContact O-CB 3.34Å; M840-S844 PolarHBondContact O-N 3.03Å; M840-S844 PolarHBondContact O-OG 2.89Å; M840-I851 VanDerWaalsContact C-CD1 3.47Å; M840-I851 HydrophobicContact CB-CD1 3.86Å; M840-I851 HydrophobicContact CB-CG2 4.33Å; M840-I851 HydrophobicContact SD-CG2 4.11Å; M840-F855 HydrophobicContact CE-CE2 3.56Å; M840-F855 HydrophobicContact CE-CZ 3.74Å; M840-F855 HydrophobicContact SD-CE2 3.54Å; M840-F855 VanDerWaalsContact SD-CE2 3.54Å; M840-F855 HydrophobicContact SD-CZ 3.68Å
841	S	91	Very high	87.6	Confident	31 Å²	31	65.3 Å²	65.3	22%	0.217	35%	0.345	C	S	.	.	H	α-helix	trans	-70	-32.5	174.1	-165.1	0	0	0	0	111.7	V837 E838 E839 G845 L846 Q848 I851	V837-S841 VanDerWaalsContact O-CB 3.31Å; V837-S841 WeakPolarHBondContact O-CB 3.41Å; V837-S841 PolarHBondContact O-N 2.88Å; E838-S841 CarbonylContact O-C 3.41Å; E838-S841 VanDerWaalsContact O-CA 3.32Å; E838-S841 WeakPolarHBondContact O-CA 3.23Å; E838-S841 WeakPolarHBondContact O-CB 3.47Å; E838-S841 PolarHBondContact O-N 3.47Å; E839-S841 VanDerWaalsContact C-N 3.27Å; E839-S841 PolarHBondContact O-N 3.16Å; S841-G845 PolarHBondContact O-N 3.34Å; S841-L846 WeakPolarHBondContact CA-O 3.42Å; S841-L846 PolarHBondContact OG-O 3.42Å; S841-Q848 PolarHBondContact OG-N 3.21Å; S841-I851 VanDerWaalsContact CA-CD1 3.46Å; S841-I851 VanDerWaalsContact N-CD1 3.33Å
842	K	90.3	Very high	88	Confident	146 Å²	146	65.4 Å²	65.4	64%	0.635	34%	0.335	S	S	*	.	H	α-helix	trans	-71.9	-55	171.4	-65.7	164.3	-177.3	162.6	0	110.3	E838 E839 M840	E838-K842 WeakPolarHBondContact O-CG 3.48Å; E838-K842 PolarHBondContact O-N 3.23Å; E838-K842 WeakPolarHBondContact OE1-CE 3.36Å; E838-K842 IonicContact OE1-NZ 3.42Å; E838-K842 PolarHBondContact OE1-NZ 3.12Å; E839-K842 WeakPolarHBondContact O-CB 3.4Å; E839-K842 PolarHBondContact O-N 2.99Å; E839-K842 VanDerWaalsContact O-N 3.14Å; M840-K842 VanDerWaalsContact C-N 3.34Å
843	K	89.1	Confident	88.1	Confident	117 Å²	117	68.3 Å²	68.3	51%	0.509	35%	0.347	S	S	.	.	H	α-helix	trans	-62.7	-42.1	-177.7	-78.9	172.2	162.4	170.4	0	114.1	I821 Y825 E839	I821-K843 HydrophobicContact CD1-CB 4.48Å; I821-K843 WeakPolarHBondContact CD1-O 3.31Å; I821-K843 HydrophobicContact CG2-CB 4.09Å; Y825-K843 HydrophobicContact CE2-CD 4.27Å; Y825-K843 VanDerWaalsContact OH-CD 3.28Å; Y825-K843 WeakPolarHBondContact OH-CD 3.37Å; Y825-K843 PolarHBondContact OH-NZ 3Å; E839-K843 HydrophobicContact CG-CD 4.39Å; E839-K843 WeakPolarHBondContact O-CB 2.93Å; E839-K843 PolarHBondContact O-N 3.23Å; E839-K843 VanDerWaalsContact OE1-CE 3.24Å; E839-K843 WeakPolarHBondContact OE1-CE 3.49Å; E839-K843 IonicContact OE1-NZ 2.7Å; E839-K843 PolarHBondContact OE1-NZ 3.16Å
844	S	86.9	Confident	88.4	Confident	8 Å²	8	67.6 Å²	67.6	6%	0.056	34%	0.336	C	S	.	.	H	α-helix	trans	-94.7	-12.3	-176.3	72.2	0	0	0	0	115.1	Q818 M840 L846	Q818-S844 WeakPolarHBondContact CG-O 3.42Å; Q818-S844 PolarHBondContact NE2-O 3.27Å; M840-S844 VanDerWaalsContact O-CB 3.28Å; M840-S844 WeakPolarHBondContact O-CB 3.34Å; M840-S844 PolarHBondContact O-N 3.03Å; M840-S844 PolarHBondContact O-OG 2.89Å; S844-L846 PolarHBondContact O-N 3.34Å; S844-L846 VanDerWaalsContact O-N 3.07Å; S844-L846 WeakPolarHBondContact OG-CB 3.22Å; S844-L846 PolarHBondContact OG-N 3.35Å
845	G	87.3	Confident	88.8	Confident	60 Å²	60	61.8 Å²	61.8	62%	0.619	31%	0.309	S	S	*	.			trans	63	6.6	-170.7	0	0	0	0	0	114.8	S841	S841-G845 PolarHBondContact O-N 3.34Å
846	L	88.5	Confident	88.6	Confident	9 Å²	9	61.3 Å²	61.3	5%	0.047	30%	0.3	C	S	.	.			trans	-83.4	135	173.4	-63.1	173.8	0	0	0	109.4	I814 Q818 L822 S841 S844 Q848 V850 I851	I814-L846 HydrophobicContact CG1-CD1 4.39Å; I814-L846 HydrophobicContact CG2-CD1 4.13Å; Q818-L846 HydrophobicContact CB-CD1 4.28Å; Q818-L846 HydrophobicContact CG-CG 4.44Å; L822-L846 HydrophobicContact CD1-CD1 3.57Å; L822-L846 HydrophobicContact CG-CD1 4.29Å; S841-L846 WeakPolarHBondContact CA-O 3.42Å; S841-L846 PolarHBondContact OG-O 3.42Å; S844-L846 PolarHBondContact O-N 3.34Å; S844-L846 VanDerWaalsContact O-N 3.07Å; S844-L846 WeakPolarHBondContact OG-CB 3.22Å; S844-L846 PolarHBondContact OG-N 3.35Å; L846-Q848 PolarHBondContact O-N 3.28Å; L846-V850 HydrophobicContact CB-CB 4.47Å; L846-V850 HydrophobicContact CD2-CG1 4.41Å; L846-I851 HydrophobicContact CB-CD1 4.22Å; L846-I851 HydrophobicContact CB-CG1 3.95Å; L846-I851 WeakPolarHBondContact O-CD1 3.36Å
847	P	88.3	Confident	88.6	Confident	80 Å²	80	61.3 Å²	61.3	52%	0.519	30%	0.302	S	S	.	.			trans	-57	138	173.4	-23.7	32.5	0	0	0	111.1	K849 V850 I851	P847-K849 PolarHBondContact O-N 2.9Å; P847-V850 HydrophobicContact CB-CG2 4.37Å; P847-V850 HydrophobicContact CG-CG2 4.34Å; P847-V850 WeakPolarHBondContact O-CA 3.46Å; P847-V850 WeakPolarHBondContact O-CB 3.35Å; P847-V850 PolarHBondContact O-N 3Å; P847-I851 PolarHBondContact O-N 3.06Å
848	Q	89.3	Confident	88.4	Confident	61 Å²	61	62.2 Å²	62.2	29%	0.285	31%	0.308	S	S	.	.	H	α-helix	trans	-39.3	-40.3	174	-64.5	-177	-4.9	0	0	113.7	V837 S841 L846 V850 I851 K852	V837-Q848 HydrophobicContact CG1-CB 3.72Å; V837-Q848 HydrophobicContact CG1-CG 3.94Å; S841-Q848 PolarHBondContact OG-N 3.21Å; L846-Q848 PolarHBondContact O-N 3.28Å; Q848-V850 VanDerWaalsContact C-N 3.3Å; Q848-V850 PolarHBondContact O-N 2.62Å; Q848-I851 CarbonylContact O-C 3.41Å; Q848-I851 WeakPolarHBondContact O-CA 3.3Å; Q848-I851 WeakPolarHBondContact O-CB 3.24Å; Q848-I851 PolarHBondContact O-N 2.98Å; Q848-I851 VanDerWaalsContact O-N 3.07Å; Q848-K852 WeakPolarHBondContact O-CG 3.45Å; Q848-K852 PolarHBondContact O-N 3.25Å
849	K	86.8	Confident	87.8	Confident	182 Å²	182	59.2 Å²	59.2	79%	0.791	29%	0.294	S	S	*	.	H	α-helix	trans	-62.8	-29.5	178.2	-168.9	172.6	-170.3	163.4	0	114.5	P847 H853	P847-K849 PolarHBondContact O-N 2.9Å; K849-H853 VanDerWaalsContact O-CB 3.22Å; K849-H853 WeakPolarHBondContact O-CB 3.48Å; K849-H853 PolarHBondContact O-N 3.34Å
850	V	88.6	Confident	86.8	Confident	33 Å²	33	62.2 Å²	62.2	20%	0.2	31%	0.307	C	S	.	.	H	α-helix	trans	-76.7	-40.2	170.8	-179	0	0	0	0	109.9	L846 P847 Q848 H853 W854	L846-V850 HydrophobicContact CB-CB 4.47Å; L846-V850 HydrophobicContact CD2-CG1 4.41Å; P847-V850 HydrophobicContact CB-CG2 4.37Å; P847-V850 HydrophobicContact CG-CG2 4.34Å; P847-V850 WeakPolarHBondContact O-CA 3.46Å; P847-V850 WeakPolarHBondContact O-CB 3.35Å; P847-V850 PolarHBondContact O-N 3Å; Q848-V850 VanDerWaalsContact C-N 3.3Å; Q848-V850 PolarHBondContact O-N 2.62Å; V850-H853 CarbonylContact O-C 3.58Å; V850-H853 PolarHBondContact O-N 3.47Å; V850-W854 WeakPolarHBondContact O-CB 3.4Å; V850-W854 PolarHBondContact O-N 3.27Å
851	I	91	Very high	85.9	Confident	0 Å²	0	68.7 Å²	68.7	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-64.4	-57.9	178.3	-60.1	171.1	0	0	0	110.7	L822 V837 M840 S841 L846 P847 Q848 H853 W854 F855	L822-I851 HydrophobicContact CD2-CG1 4.32Å; L822-I851 HydrophobicContact CD2-CG2 4.07Å; V837-I851 HydrophobicContact CG1-CB 4.32Å; V837-I851 HydrophobicContact CG1-CG2 4.19Å; V837-I851 HydrophobicContact CG2-CG2 4.28Å; M840-I851 VanDerWaalsContact C-CD1 3.47Å; M840-I851 HydrophobicContact CB-CD1 3.86Å; M840-I851 HydrophobicContact CB-CG2 4.33Å; M840-I851 HydrophobicContact SD-CG2 4.11Å; S841-I851 VanDerWaalsContact CA-CD1 3.46Å; S841-I851 VanDerWaalsContact N-CD1 3.33Å; L846-I851 HydrophobicContact CB-CD1 4.22Å; L846-I851 HydrophobicContact CB-CG1 3.95Å; L846-I851 WeakPolarHBondContact O-CD1 3.36Å; P847-I851 PolarHBondContact O-N 3.06Å; Q848-I851 CarbonylContact O-C 3.41Å; Q848-I851 WeakPolarHBondContact O-CA 3.3Å; Q848-I851 WeakPolarHBondContact O-CB 3.24Å; Q848-I851 PolarHBondContact O-N 2.98Å; Q848-I851 VanDerWaalsContact O-N 3.07Å; I851-H853 PolarHBondContact O-N 3.38Å; I851-W854 WeakPolarHBondContact O-CA 3.31Å; I851-W854 WeakPolarHBondContact O-CB 3.48Å; I851-W854 PolarHBondContact O-N 2.77Å; I851-F855 HydrophobicContact CG2-CD2 3.74Å; I851-F855 HydrophobicContact CG2-CE2 3.75Å; I851-F855 WeakPolarHBondContact O-CD2 3.06Å; I851-F855 PolarHBondContact O-N 3.36Å
852	K	89.3	Confident	85	Confident	82 Å²	82	69.8 Å²	69.8	36%	0.357	34%	0.336	S	S	.	.	H	α-helix	trans	-55.6	-26.9	173.8	-58.4	-168.1	-174.3	-177.8	0	112.6	E834 V837 Q848 R856	E834-K852 IonicContact OE1-NZ 2.58Å; E834-K852 PolarHBondContact OE1-NZ 2.97Å; E834-K852 IonicContact OE2-NZ 3.62Å; E834-K852 PolarHBondContact OE2-NZ 3.06Å; V837-K852 HydrophobicContact CB-CG 4.47Å; V837-K852 HydrophobicContact CG1-CD 4.25Å; V837-K852 HydrophobicContact CG1-CG 3.7Å; V837-K852 HydrophobicContact CG2-CG 4.05Å; Q848-K852 WeakPolarHBondContact O-CG 3.45Å; Q848-K852 PolarHBondContact O-N 3.25Å; K852-R856 VanDerWaalsContact O-CB 3.28Å; K852-R856 WeakPolarHBondContact O-CB 3.37Å; K852-R856 PolarHBondContact O-N 3.48Å
853	H	85.1	Confident	82.9	Confident	83 Å²	83	67 Å²	67	38%	0.384	32%	0.322	S	S	.	.	H	α-helix	trans	-81.3	-35.2	173.7	-171.4	47.8	0	0	0	113.3	K849 V850 I851 R856 N857	K849-H853 VanDerWaalsContact O-CB 3.22Å; K849-H853 WeakPolarHBondContact O-CB 3.48Å; K849-H853 PolarHBondContact O-N 3.34Å; V850-H853 CarbonylContact O-C 3.58Å; V850-H853 PolarHBondContact O-N 3.47Å; I851-H853 PolarHBondContact O-N 3.38Å; H853-R856 PolarHBondContact ND1-NH2 2.73Å; H853-N857 PolarHBondContact CD2-ND2 2.91Å; H853-N857 PolarHBondContact CE1-ND2 3.1Å; H853-N857 PolarHBondContact CE1-OD1 2.83Å; H853-N857 VanDerWaalsContact CE1-OD1 3.24Å; H853-N857 PolarHBondContact NE2-ND2 3.18Å; H853-N857 VanDerWaalsContact O-CB 3.23Å; H853-N857 WeakPolarHBondContact O-CB 3.39Å; H853-N857 PolarHBondContact O-N 2.81Å; H853-N857 VanDerWaalsContact O-N 3.08Å; H853-N857 PolarHBondContact O-ND2 2.8Å; H853-N857 PolarHBondContact O-OD1 3.24Å
854	W	91.6	Very high	81	Confident	35 Å²	35	67 Å²	67	13%	0.133	32%	0.324	C	S	.	.	H	α-helix	trans	-64.3	-56.8	173.2	-176.6	97.2	0	0	0	109.6	I814 L819 L822 R823 F826 V850 I851 R856 N857 T858	I814-W854 VanDerWaalsContact CD1-CD1 3.42Å; I814-W854 HydrophobicContact CD1-CG 4.31Å; L819-W854 HydrophobicContact CD2-CZ2 4.44Å; L822-W854 HydrophobicContact CB-CD2 4.06Å; L822-W854 HydrophobicContact CB-CE3 4.1Å; L822-W854 HydrophobicContact CB-CH2 3.95Å; L822-W854 HydrophobicContact CB-CZ2 3.86Å; L822-W854 HydrophobicContact CB-CZ3 4.06Å; L822-W854 HydrophobicContact CD1-CB 4.47Å; L822-W854 HydrophobicContact CD1-CD2 3.99Å; L822-W854 HydrophobicContact CD1-CG 3.88Å; L822-W854 HydrophobicContact CD2-CB 4.33Å; L822-W854 HydrophobicContact CD2-CD2 3.88Å; L822-W854 HydrophobicContact CD2-CE3 3.76Å; L822-W854 HydrophobicContact CD2-CG 4.14Å; L822-W854 HydrophobicContact CD2-CZ3 4.38Å; L822-W854 HydrophobicContact CG-CD2 4.23Å; L822-W854 HydrophobicContact CG-CE3 4.4Å; L822-W854 WeakPolarHBondContact O-CH2 3.38Å; L822-W854 WeakPolarHBondContact O-CZ3 3.14Å; R823-W854 HydrophobicContact CG-CH2 4.47Å; R823-W854 HydrophobicContact CG-CZ2 4.5Å; F826-W854 HydrophobicContact CB-CH2 3.95Å; F826-W854 HydrophobicContact CB-CZ3 3.85Å; F826-W854 HydrophobicContact CD2-CH2 4.18Å; F826-W854 AromaticContact CD2-CZ3 3.74Å; F826-W854 HydrophobicContact CD2-CZ3 3.74Å; F826-W854 HydrophobicContact CG-CH2 4.06Å; F826-W854 AromaticContact CG-CZ3 3.99Å; F826-W854 HydrophobicContact CG-CZ3 3.99Å; V850-W854 WeakPolarHBondContact O-CB 3.4Å; V850-W854 PolarHBondContact O-N 3.27Å; I851-W854 WeakPolarHBondContact O-CA 3.31Å; I851-W854 WeakPolarHBondContact O-CB 3.48Å; I851-W854 PolarHBondContact O-N 2.77Å; W854-R856 PolarHBondContact O-N 2.84Å; W854-N857 CarbonylContact O-C 3.57Å; W854-N857 WeakPolarHBondContact O-CA 3.42Å; W854-N857 WeakPolarHBondContact O-CB 3.15Å; W854-N857 PolarHBondContact O-N 3.09Å; W854-T858 HydrophobicContact CH2-CG2 4.08Å; W854-T858 HydrophobicContact CZ2-CG2 4.37Å; W854-T858 HydrophobicContact CZ3-CG2 4.4Å; W854-T858 PolarHBondContact O-N 3.07Å; W854-T858 PolarHBondContact O-OG1 2.79Å; W854-T858 VanDerWaalsContact O-OG1 3.06Å
855	F	93.9	Very high	79.5	Confident	6 Å²	6	75.5 Å²	75.5	3%	0.026	36%	0.355	C	S	.	.	H	α-helix	trans	-51.5	-54.1	178.6	-87.2	-91.7	0	0	0	111.6	L822 F826 N829 P832 M840 I851 N857 T858 L859	L822-F855 HydrophobicContact CD2-CD2 4.35Å; L822-F855 HydrophobicContact CD2-CE2 3.88Å; F826-F855 HydrophobicContact CB-CE1 3.8Å; F826-F855 HydrophobicContact CB-CZ 4.21Å; F826-F855 AromaticContact CD2-CD1 3.72Å; F826-F855 HydrophobicContact CD2-CD1 3.72Å; F826-F855 AromaticContact CD2-CE1 3.78Å; F826-F855 HydrophobicContact CD2-CE1 3.78Å; F826-F855 HydrophobicContact CG-CE1 4.28Å; N829-F855 WeakPolarHBondContact O-CE1 3.38Å; P832-F855 HydrophobicContact CG-CD1 3.69Å; P832-F855 HydrophobicContact CG-CD2 3.97Å; P832-F855 HydrophobicContact CG-CE1 3.58Å; P832-F855 HydrophobicContact CG-CE2 3.9Å; P832-F855 HydrophobicContact CG-CG 3.88Å; P832-F855 HydrophobicContact CG-CZ 3.71Å; M840-F855 HydrophobicContact CE-CE2 3.56Å; M840-F855 HydrophobicContact CE-CZ 3.74Å; M840-F855 HydrophobicContact SD-CE2 3.54Å; M840-F855 VanDerWaalsContact SD-CE2 3.54Å; M840-F855 HydrophobicContact SD-CZ 3.68Å; I851-F855 HydrophobicContact CG2-CD2 3.74Å; I851-F855 HydrophobicContact CG2-CE2 3.75Å; I851-F855 WeakPolarHBondContact O-CD2 3.06Å; I851-F855 PolarHBondContact O-N 3.36Å; F855-N857 PolarHBondContact O-N 3.29Å; F855-T858 PolarHBondContact O-N 2.84Å; F855-L859 VanDerWaalsContact O-CB 3.26Å; F855-L859 WeakPolarHBondContact O-CB 3.39Å; F855-L859 WeakPolarHBondContact O-CG 3.02Å; F855-L859 PolarHBondContact O-N 3.43Å
856	R	83.1	Confident	77.3	Confident	144 Å²	144	73.6 Å²	73.6	54%	0.543	33%	0.332	S	S	.	.	H	α-helix	trans	-60.6	-30.7	178.3	-162.4	-167.4	70.2	-158.9	-1.5	113.4	K852 H853 W854 F860	K852-R856 VanDerWaalsContact O-CB 3.28Å; K852-R856 WeakPolarHBondContact O-CB 3.37Å; K852-R856 PolarHBondContact O-N 3.48Å; H853-R856 PolarHBondContact ND1-NH2 2.73Å; W854-R856 PolarHBondContact O-N 2.84Å; R856-F860 WeakPolarHBondContact O-CB 3.49Å; R856-F860 PolarHBondContact O-N 2.61Å; R856-F860 VanDerWaalsContact O-N 3.15Å
857	N	84.4	Confident	74.9	Confident	51 Å²	51	78.6 Å²	78.6	27%	0.273	35%	0.353	S	S	.	.	H	α-helix	trans	-80.9	-27.9	175.2	-68.6	-20.1	0	0	0	112.8	H853 W854 F855 K861	H853-N857 PolarHBondContact CD2-ND2 2.91Å; H853-N857 PolarHBondContact CE1-ND2 3.1Å; H853-N857 PolarHBondContact CE1-OD1 2.83Å; H853-N857 VanDerWaalsContact CE1-OD1 3.24Å; H853-N857 PolarHBondContact NE2-ND2 3.18Å; H853-N857 VanDerWaalsContact O-CB 3.23Å; H853-N857 WeakPolarHBondContact O-CB 3.39Å; H853-N857 PolarHBondContact O-N 2.81Å; H853-N857 VanDerWaalsContact O-N 3.08Å; H853-N857 PolarHBondContact O-ND2 2.8Å; H853-N857 PolarHBondContact O-OD1 3.24Å; W854-N857 CarbonylContact O-C 3.57Å; W854-N857 WeakPolarHBondContact O-CA 3.42Å; W854-N857 WeakPolarHBondContact O-CB 3.15Å; W854-N857 PolarHBondContact O-N 3.09Å; F855-N857 PolarHBondContact O-N 3.29Å; N857-K861 VanDerWaalsContact O-CG 3.26Å; N857-K861 WeakPolarHBondContact O-CG 3.3Å; N857-K861 PolarHBondContact O-N 2.75Å; N857-K861 VanDerWaalsContact O-N 3.13Å
858	T	84.7	Confident	72.6	Confident	23 Å²	23	80.6 Å²	80.6	14%	0.141	36%	0.359	C	S	.	.	H	α-helix	trans	-75.7	-53.2	175.4	-53.1	0	0	0	0	109.2	F826 W854 F855 F860 K861 E862	F826-T858 HydrophobicContact CD1-CG2 4.41Å; F826-T858 HydrophobicContact CD2-CG2 4.01Å; F826-T858 HydrophobicContact CE1-CG2 3.93Å; F826-T858 HydrophobicContact CE2-CG2 3.48Å; F826-T858 VanDerWaalsContact CE2-CG2 3.48Å; F826-T858 HydrophobicContact CG-CG2 4.46Å; F826-T858 HydrophobicContact CZ-CG2 3.44Å; F826-T858 VanDerWaalsContact CZ-CG2 3.44Å; W854-T858 HydrophobicContact CH2-CG2 4.08Å; W854-T858 HydrophobicContact CZ2-CG2 4.37Å; W854-T858 HydrophobicContact CZ3-CG2 4.4Å; W854-T858 PolarHBondContact O-N 3.07Å; W854-T858 PolarHBondContact O-OG1 2.79Å; W854-T858 VanDerWaalsContact O-OG1 3.06Å; F855-T858 PolarHBondContact O-N 2.84Å; T858-F860 VanDerWaalsContact C-N 3.26Å; T858-F860 PolarHBondContact O-N 3.42Å; T858-K861 CarbonylContact O-C 3.48Å; T858-K861 WeakPolarHBondContact O-CA 3.46Å; T858-K861 WeakPolarHBondContact O-CB 3.46Å; T858-K861 PolarHBondContact O-N 2.81Å; T858-E862 PolarHBondContact O-N 3.39Å
859	L	77.9	Confident	70	Confident	21 Å²	21	80.9 Å²	80.9	11%	0.11	37%	0.368	C	S	.	.	H	α-helix	trans	-42.3	-50.4	164.9	-82.8	162.4	0	0	0	112.7	F826 N830 F855 K861 E862 R863	F826-L859 HydrophobicContact CE2-CG 4.41Å; N830-L859 WeakPolarHBondContact O-CD1 3.28Å; N830-L859 WeakPolarHBondContact O-CD2 3.49Å; N830-L859 WeakPolarHBondContact O-CG 3.04Å; N830-L859 WeakPolarHBondContact OD1-CD2 3.37Å; N830-L859 WeakPolarHBondContact OD1-CG 3.27Å; F855-L859 VanDerWaalsContact O-CB 3.26Å; F855-L859 WeakPolarHBondContact O-CB 3.39Å; F855-L859 WeakPolarHBondContact O-CG 3.02Å; F855-L859 PolarHBondContact O-N 3.43Å; L859-K861 VanDerWaalsContact C-N 3.33Å; L859-K861 PolarHBondContact O-N 3.01Å; L859-E862 PolarHBondContact O-N 2.78Å; L859-R863 WeakPolarHBondContact O-CB 3.46Å; L859-R863 WeakPolarHBondContact O-CG 3.5Å; L859-R863 PolarHBondContact O-N 2.79Å; L859-R863 VanDerWaalsContact O-N 3.12Å
860	F	67.3	Low	67.8	Low	135 Å²	135	78.1 Å²	78.1	59%	0.592	37%	0.369	S	S	*	.	H	α-helix	trans	-70.8	-26.9	-178.8	-175.6	-92.6	0	0	0	113.3	R856 T858 Q864	R856-F860 WeakPolarHBondContact O-CB 3.49Å; R856-F860 PolarHBondContact O-N 2.61Å; R856-F860 VanDerWaalsContact O-N 3.15Å; T858-F860 VanDerWaalsContact C-N 3.26Å; T858-F860 PolarHBondContact O-N 3.42Å; F860-Q864 HydrophobicContact CE1-CG 4.3Å; F860-Q864 HydrophobicContact CZ-CG 4.49Å; F860-Q864 WeakPolarHBondContact O-CG 3.27Å
861	K	69.7	Low	65.1	Low	135 Å²	135	85 Å²	85	59%	0.587	39%	0.392	S	S	*	.	H	α-helix	trans	-77.1	-38	172.3	-79.5	170.1	177.8	177.7	0	112.1	N857 T858 L859 Q864 R865	N857-K861 VanDerWaalsContact O-CG 3.26Å; N857-K861 WeakPolarHBondContact O-CG 3.3Å; N857-K861 PolarHBondContact O-N 2.75Å; N857-K861 VanDerWaalsContact O-N 3.13Å; T858-K861 CarbonylContact O-C 3.48Å; T858-K861 WeakPolarHBondContact O-CA 3.46Å; T858-K861 WeakPolarHBondContact O-CB 3.46Å; T858-K861 PolarHBondContact O-N 2.81Å; L859-K861 VanDerWaalsContact C-N 3.33Å; L859-K861 PolarHBondContact O-N 3.01Å; K861-Q864 CarbonylContact O-C 3.39Å; K861-Q864 WeakPolarHBondContact O-CA 3.31Å; K861-Q864 WeakPolarHBondContact O-CB 3.39Å; K861-Q864 PolarHBondContact O-N 3.28Å; K861-R865 WeakPolarHBondContact O-CG 3.39Å; K861-R865 PolarHBondContact O-N 3.49Å
862	E	71.7	Confident	62.4	Low	54 Å²	54	87.9 Å²	87.9	25%	0.252	41%	0.408	S	S	.	.	H	α-helix	trans	-68.6	-45.8	-176.8	-137.1	50.4	-133.2	0	0	109.9	T858 L859 Q864 R865 S866	T858-E862 PolarHBondContact O-N 3.39Å; L859-E862 PolarHBondContact O-N 2.78Å; E862-Q864 PolarHBondContact O-N 2.85Å; E862-R865 PolarHBondContact O-N 3.43Å; E862-R865 VanDerWaalsContact OE1-CD 3.31Å; E862-R865 WeakPolarHBondContact OE1-CD 3.32Å; E862-R865 IonicContact OE1-CZ 2.93Å; E862-R865 IonicContact OE1-NE 2.64Å; E862-R865 IonicContact OE1-NH1 3.21Å; E862-R865 PolarHBondContact OE1-NH1 3.3Å; E862-R865 VanDerWaalsContact OE2-CD 3.26Å; E862-R865 WeakPolarHBondContact OE2-CD 3.23Å; E862-R865 IonicContact OE2-CZ 3.06Å; E862-R865 IonicContact OE2-NE 2.66Å; E862-R865 IonicContact OE2-NH1 2.74Å; E862-R865 PolarHBondContact OE2-NH1 2.74Å; E862-S866 PolarHBondContact O-N 2.93Å; E862-S866 PolarHBondContact O-OG 2.66Å
863	R	46.4	Very low	59.4	Low	88 Å²	88	91.3 Å²	91.3	33%	0.332	42%	0.423	S	S	.	.	H	α-helix	trans	-60	1.4	165.3	-59	170.5	-155.5	-100.9	16.1	115.3	L859 F873	L859-R863 WeakPolarHBondContact O-CB 3.46Å; L859-R863 WeakPolarHBondContact O-CG 3.5Å; L859-R863 PolarHBondContact O-N 2.79Å; L859-R863 VanDerWaalsContact O-N 3.12Å; R863-F873 HydrophobicContact CB-CE2 4.29Å; R863-F873 HydrophobicContact CB-CZ 4.12Å; R863-F873 HydrophobicContact CG-CE1 4.42Å; R863-F873 HydrophobicContact CG-CE2 4.12Å; R863-F873 HydrophobicContact CG-CZ 3.8Å
864	Q	50	Low	57.2	Low	118 Å²	118	92.9 Å²	92.9	55%	0.551	44%	0.443	S	S	*	.	H	α-helix	trans	-121.1	-6.8	172.6	-67.5	-69.3	-89.1	0	0	113	F860 K861 E862	F860-Q864 HydrophobicContact CE1-CG 4.3Å; F860-Q864 HydrophobicContact CZ-CG 4.49Å; F860-Q864 WeakPolarHBondContact O-CG 3.27Å; K861-Q864 CarbonylContact O-C 3.39Å; K861-Q864 WeakPolarHBondContact O-CA 3.31Å; K861-Q864 WeakPolarHBondContact O-CB 3.39Å; K861-Q864 PolarHBondContact O-N 3.28Å; E862-Q864 PolarHBondContact O-N 2.85Å
865	R	55.1	Low	54.5	Low	186 Å²	186	97.3 Å²	97.3	70%	0.702	47%	0.468	S	S	*	.	H	α-helix	trans	-91.8	-42.7	167.1	-72	164.4	116.7	-157.6	-9.5	110.1	K861 E862 K867	K861-R865 WeakPolarHBondContact O-CG 3.39Å; K861-R865 PolarHBondContact O-N 3.49Å; E862-R865 PolarHBondContact O-N 3.43Å; E862-R865 VanDerWaalsContact OE1-CD 3.31Å; E862-R865 WeakPolarHBondContact OE1-CD 3.32Å; E862-R865 IonicContact OE1-CZ 2.93Å; E862-R865 IonicContact OE1-NE 2.64Å; E862-R865 IonicContact OE1-NH1 3.21Å; E862-R865 PolarHBondContact OE1-NH1 3.3Å; E862-R865 VanDerWaalsContact OE2-CD 3.26Å; E862-R865 WeakPolarHBondContact OE2-CD 3.23Å; E862-R865 IonicContact OE2-CZ 3.06Å; E862-R865 IonicContact OE2-NE 2.66Å; E862-R865 IonicContact OE2-NH1 2.74Å; E862-R865 PolarHBondContact OE2-NH1 2.74Å; R865-K867 PolarHBondContact O-N 3.18Å; R865-K867 VanDerWaalsContact O-N 3.14Å
866	S	40.9	Very low	51.4	Low	20 Å²	20	101.4 Å²	101.4	14%	0.14	50%	0.495	C	S	.	.	G	3₁₀ helix	trans	-77.8	18.2	176.5	58.7	0	0	0	0	114.6	E862 D868 S869 N872	E862-S866 PolarHBondContact O-N 2.93Å; E862-S866 PolarHBondContact O-OG 2.66Å; S866-D868 PolarHBondContact O-N 2.82Å; S866-D868 VanDerWaalsContact O-N 3.1Å; S866-S869 PolarHBondContact O-N 3.49Å; S866-S869 VanDerWaalsContact O-N 3.14Å; S866-N872 VanDerWaalsContact OG-CB 3.3Å; S866-N872 WeakPolarHBondContact OG-CB 3.18Å
867	K	38.3	Very low	48.8	Very low	114 Å²	114	99.4 Å²	99.4	50%	0.496	50%	0.501	S	S	.	.	G	3₁₀ helix	trans	-64.2	-20.9	-173.5	-154	-151.7	167.8	-135.2	0	113.6	R865	R865-K867 PolarHBondContact O-N 3.18Å; R865-K867 VanDerWaalsContact O-N 3.14Å
868	D	39.2	Very low	46.3	Very low	122 Å²	122	100.7 Å²	100.7	65%	0.652	51%	0.514	S	S	*	.	G	3₁₀ helix	trans	-133.2	37.4	176	-52.4	-78.8	0	0	0	109.7	S866	S866-D868 PolarHBondContact O-N 2.82Å; S866-D868 VanDerWaalsContact O-N 3.1Å
869	S	35.6	Very low	44	Very low	67 Å²	67	105.7 Å²	105.7	47%	0.469	53%	0.534	S	S	.	.	S	Bend	trans	-127.5	138	176.7	177	0	0	0	0	110.9	S866 Y871	S866-S869 PolarHBondContact O-N 3.49Å; S866-S869 VanDerWaalsContact O-N 3.14Å; S869-Y871 VanDerWaalsContact C-N 3.3Å; S869-Y871 PolarHBondContact O-N 3.33Å; S869-Y871 VanDerWaalsContact O-N 3.12Å
870	P	40.6	Very low	42.1	Very low	123 Å²	123	108.5 Å²	108.5	80%	0.799	56%	0.556	S	S	*	*	S	Bend	trans	-66	-14.8	-166.3	-24.7	35.8	0	0	0	117.7
871	Y	32.1	Very low	41.2	Very low	178 Å²	178	106 Å²	106	70%	0.698	55%	0.547	S	S	*	.			trans	-126.3	90	-168.7	-69.2	-87.7	0	0	0	114.3	S869 I875	S869-Y871 VanDerWaalsContact C-N 3.3Å; S869-Y871 PolarHBondContact O-N 3.33Å; S869-Y871 VanDerWaalsContact O-N 3.12Å; Y871-I875 HydrophobicContact CD1-CD1 3.91Å; Y871-I875 HydrophobicContact CE1-CD1 4.04Å
872	N	33.4	Very low	40	Very low	61 Å²	61	104.2 Å²	104.2	33%	0.326	54%	0.544	S	S	.	.	S	Bend	trans	-161.2	30.2	165.2	-139	-115.1	0	0	0	120.4	S866	S866-N872 VanDerWaalsContact OG-CB 3.3Å; S866-N872 WeakPolarHBondContact OG-CB 3.18Å
873	F	26.6	Very low	39	Very low	153 Å²	153	107.6 Å²	107.6	67%	0.671	56%	0.564	S	S	*	*	S	Bend	trans	-140.4	-3.5	177	-90.5	-82.1	0	0	0	118.5	R863	R863-F873 HydrophobicContact CB-CE2 4.29Å; R863-F873 HydrophobicContact CB-CZ 4.12Å; R863-F873 HydrophobicContact CG-CE1 4.42Å; R863-F873 HydrophobicContact CG-CE2 4.12Å; R863-F873 HydrophobicContact CG-CZ 3.8Å
874	S	39.3	Very low	39.5	Very low	116 Å²	116	111.1 Å²	111.1	81%	0.811	58%	0.584	S	S	*	*	S	Bend	trans	-141.3	-6.9	-172.2	-49.4	0	0	0	0	117.7
875	I	33.4	Very low	39.9	Very low	129 Å²	129	111.5 Å²	111.5	66%	0.662	59%	0.586	S	S	*	*			trans	-111.3	124.5	-172.2	-52.4	-177.5	0	0	0	109.8	Y871	Y871-I875 HydrophobicContact CD1-CD1 3.91Å; Y871-I875 HydrophobicContact CE1-CD1 4.04Å
876	P	29.7	Very low	39.7	Very low	91 Å²	91	108.6 Å²	108.6	59%	0.591	58%	0.575	S	S	*	*			trans	-77.6	160.5	170.2	34.2	-34.6	0	0	0	111.2	S878	P876-S878 PolarHBondContact O-N 3.41Å
877	P	28	Very low	40.5	Very low	103 Å²	103	115.7 Å²	115.7	67%	0.669	61%	0.606	S	S	*	*			trans	-69	124.3	169.5	29.7	-32.2	0	0	0	109.7
878	S	33.1	Very low	41.7	Very low	77 Å²	77	119.1 Å²	119.1	54%	0.538	62%	0.621	S	S	.	*			trans	-152.9	123.2	176.7	57.4	0	0	0	0	110.1	P876	P876-S878 PolarHBondContact O-N 3.41Å
879	F	35.7	Very low	42.4	Very low	128 Å²	128	117.1 Å²	117.1	56%	0.561	61%	0.613	S	S	*	*			trans	67.4	116	175.2	-46.7	-71.7	0	0	0	116.3	V894 I895 P896	F879-V894 HydrophobicContact CB-CG1 4.11Å; F879-V894 HydrophobicContact CD1-CG1 3.23Å; F879-V894 HydrophobicContact CD2-CG1 4.12Å; F879-V894 HydrophobicContact CE1-CG1 3.56Å; F879-V894 HydrophobicContact CE2-CG1 4.41Å; F879-V894 HydrophobicContact CG-CG1 3.54Å; F879-V894 HydrophobicContact CZ-CG1 4.16Å; F879-I895 WeakPolarHBondContact CD1-O 3.02Å; F879-P896 HydrophobicContact CE1-CB 4.33Å
880	S	37.8	Very low	42.5	Very low	81 Å²	81	116.6 Å²	116.6	57%	0.566	62%	0.619	S	S	*	*	P	Polyproline II helix	trans	-88.3	117.9	160.8	49	0	0	0	0	109.1
881	I	48.8	Very low	42.5	Very low	82 Å²	82	116.6 Å²	116.6	42%	0.421	61%	0.608	S	S	.	*	P	Polyproline II helix	trans	-88.7	136.4	161.2	-89	172	0	0	0	107.7	A892	I881-A892 HydrophobicContact CD1-CB 4.05Å
882	D	44.9	Very low	42.8	Very low	98 Å²	98	110.9 Å²	110.9	52%	0.524	60%	0.597	S	S	.	*	P	Polyproline II helix	trans	-78.1	124.6	170.8	-160.6	-37.6	0	0	0	109.6	E884 E885 Y886	D882-E884 PolarHBondContact OD1-N 3.37Å; D882-E885 HydrophobicContact CB-CB 4.2Å; D882-Y886 WeakPolarHBondContact O-CB 3.43Å; D882-Y886 PolarHBondContact O-N 3.23Å
883	L	49.9	Very low	43.1	Very low	125 Å²	125	115.1 Å²	115.1	65%	0.654	61%	0.613	S	S	*	*	H	α-helix	trans	-77.8	-31.5	-176.9	-70.1	163.8	0	0	0	111.6	E887	L883-E887 WeakPolarHBondContact O-CG 3.27Å; L883-E887 PolarHBondContact O-N 2.88Å
884	E	57	Low	43.6	Very low	162 Å²	162	111.9 Å²	111.9	76%	0.757	61%	0.606	S	S	*	*	H	α-helix	trans	-80	-17.1	-179.9	-76.3	-177.1	94.1	0	0	112.9	D882	D882-E884 PolarHBondContact OD1-N 3.37Å
885	E	58.1	Low	43.7	Very low	126 Å²	126	111.5 Å²	111.5	59%	0.589	59%	0.593	S	S	*	*	H	α-helix	trans	-89.8	-38.2	170.7	-168.2	170.3	-151.4	0	0	112.2	D882 E887 K888 T889	D882-E885 HydrophobicContact CB-CB 4.2Å; E885-E887 PolarHBondContact O-N 3.36Å; E885-K888 PolarHBondContact O-N 3.45Å; E885-K888 VanDerWaalsContact O-N 3.08Å; E885-T889 HydrophobicContact CG-CG2 4.25Å; E885-T889 PolarHBondContact O-N 3.06Å; E885-T889 PolarHBondContact O-OG1 3.06Å
886	Y	51.2	Low	43.6	Very low	124 Å²	124	110.2 Å²	110.2	49%	0.486	59%	0.593	S	S	.	*	H	α-helix	trans	-63.5	-40.5	177.5	-176	-111.2	0	0	0	112.5	D882 K888 G890 A892	D882-Y886 WeakPolarHBondContact O-CB 3.43Å; D882-Y886 PolarHBondContact O-N 3.23Å; Y886-K888 PolarHBondContact O-N 3.08Å; Y886-K888 VanDerWaalsContact O-N 3.12Å; Y886-G890 PolarHBondContact O-N 3.09Å; Y886-A892 HydrophobicContact CE2-CB 4.41Å
887	E	57.7	Low	43.6	Very low	170 Å²	170	112.3 Å²	112.3	79%	0.794	60%	0.599	S	S	*	*	H	α-helix	trans	-65.8	-8	173.9	-73.7	-172.3	163.7	0	0	114.1	L883 E885	L883-E887 WeakPolarHBondContact O-CG 3.27Å; L883-E887 PolarHBondContact O-N 2.88Å; E885-E887 PolarHBondContact O-N 3.36Å
888	K	62.7	Low	43.8	Very low	185 Å²	185	114.7 Å²	114.7	80%	0.804	61%	0.606	S	S	*	*	H	α-helix	trans	-113.6	-23	179.2	-88.5	176.5	177.7	164.2	0	115.8	E885 Y886	E885-K888 PolarHBondContact O-N 3.45Å; E885-K888 VanDerWaalsContact O-N 3.08Å; Y886-K888 PolarHBondContact O-N 3.08Å; Y886-K888 VanDerWaalsContact O-N 3.12Å
889	T	54.5	Low	43.5	Very low	80 Å²	80	116.7 Å²	116.7	49%	0.491	62%	0.62	S	S	.	*	H	α-helix	trans	-126.3	-21.2	-167.7	60.6	0	0	0	0	114.8	E885 E891	E885-T889 HydrophobicContact CG-CG2 4.25Å; E885-T889 PolarHBondContact O-N 3.06Å; E885-T889 PolarHBondContact O-OG1 3.06Å; T889-E891 PolarHBondContact O-N 2.92Å
890	G	38	Very low	43.2	Very low	56 Å²	56	117.7 Å²	117.7	58%	0.577	63%	0.626	S	S	*	*			trans	69.8	-14.9	-178.8	0	0	0	0	0	116.1	Y886	Y886-G890 PolarHBondContact O-N 3.09Å
891	E	40.4	Very low	42.8	Very low	124 Å²	124	124.6 Å²	124.6	58%	0.579	65%	0.647	S	S	*	*			trans	-85.9	114.5	177	-72.4	-166	173.7	0	0	112.3	T889 K893	T889-E891 PolarHBondContact O-N 2.92Å; E891-K893 PolarHBondContact O-N 3.23Å; E891-K893 IonicContact OE2-NZ 3.11Å; E891-K893 PolarHBondContact OE2-NZ 3.03Å
892	A	39.6	Very low	41.9	Very low	57 Å²	57	124.9 Å²	124.9	47%	0.471	65%	0.652	S	S	.	*			trans	-81.1	77.5	174.2	0	0	0	0	0	111.9	I881 Y886	I881-A892 HydrophobicContact CD1-CB 4.05Å; Y886-A892 HydrophobicContact CE2-CB 4.41Å
893	K	39.9	Very low	41.1	Very low	150 Å²	150	125 Å²	125	65%	0.652	66%	0.661	S	S	*	*			trans	-71.3	127.8	171.1	-75.6	-169.3	174.3	76.6	0	110.9	E891	E891-K893 PolarHBondContact O-N 3.23Å; E891-K893 IonicContact OE2-NZ 3.11Å; E891-K893 PolarHBondContact OE2-NZ 3.03Å
894	V	35.8	Very low	40	Very low	86 Å²	86	129.2 Å²	129.2	52%	0.521	67%	0.674	S	S	.	*			trans	-106.8	112.6	-171	-178.6	0	0	0	0	110.5	F879	F879-V894 HydrophobicContact CB-CG1 4.11Å; F879-V894 HydrophobicContact CD1-CG1 3.23Å; F879-V894 HydrophobicContact CD2-CG1 4.12Å; F879-V894 HydrophobicContact CE1-CG1 3.56Å; F879-V894 HydrophobicContact CE2-CG1 4.41Å; F879-V894 HydrophobicContact CG-CG1 3.54Å; F879-V894 HydrophobicContact CZ-CG1 4.16Å
895	I	40.7	Very low	38.6	Very low	107 Å²	107	125.8 Å²	125.8	55%	0.549	67%	0.673	S	S	.	*			trans	-96.3	116	-175.8	-55.2	176.2	0	0	0	110.9	F879	F879-I895 WeakPolarHBondContact CD1-O 3.02Å
896	P	33	Very low	37.1	Very low	102 Å²	102	124.5 Å²	124.5	66%	0.662	68%	0.684	S	S	*	*			trans	-74.7	143	175	31.4	-34.3	0	0	0	112	F879	F879-P896 HydrophobicContact CE1-CB 4.33Å
897	L	29.8	Very low	36.1	Very low	135 Å²	135	124.4 Å²	124.4	71%	0.707	70%	0.697	S	S	*	*			trans	-131.2	81.5	-177.8	-69.8	177.1	0	0	0	112.5
898	N	30.7	Very low	34.6	Very low	154 Å²	154	126.2 Å²	126.2	82%	0.824	71%	0.705	S	S	*	*	S	Bend	trans	-167.4	125.5	150.5	-103.5	-22	0	0	0	108.3
899	S	26.9	Very low	33	Very low	119 Å²	119	119.8 Å²	119.8	83%	0.832	69%	0.691	S	S	*	*	S	Bend	trans	52.2	117.3	-163.1	45.4	0	0	0	0	113.6
900	E	30.9	Very low	31.8	Very low	148 Å²	148	122.6 Å²	122.6	69%	0.692	70%	0.703	S	S	*	*			cis	-134.1	144.6	16	-67.5	-166.2	85.6	0	0	112.9	T902	E900-T902 WeakPolarHBondContact CB-OG1 3.32Å; E900-T902 WeakPolarHBondContact CG-OG1 3.39Å; E900-T902 VanDerWaalsContact OE1-CB 3.28Å; E900-T902 WeakPolarHBondContact OE1-CB 3.42Å; E900-T902 PolarHBondContact OE1-OG1 3.03Å
901	F	28.6	Very low	31.3	Very low	226 Å²	226	125.8 Å²	125.8	99%	0.991	71%	0.711	S	S	*	*			trans	-125.3	47.8	144.3	-144.4	-72.4	0	0	0	108.6
902	T	29.9	Very low	30.7	Very low	88 Å²	88	123.7 Å²	123.7	54%	0.54	72%	0.723	S	S	.	*			trans	-94.1	144.7	174.7	-4.4	0	0	0	0	109.4	E900	E900-T902 WeakPolarHBondContact CB-OG1 3.32Å; E900-T902 WeakPolarHBondContact CG-OG1 3.39Å; E900-T902 VanDerWaalsContact OE1-CB 3.28Å; E900-T902 WeakPolarHBondContact OE1-CB 3.42Å; E900-T902 PolarHBondContact OE1-OG1 3.03Å
903	S	28.5	Very low	30.5	Very low	102 Å²	102	128 Å²	128	71%	0.713	73%	0.734	S	S	*	*			trans	54.2	95.6	162.5	42	0	0	0	0	119.3
904	K	25.9	Very low	29.9	Very low	213 Å²	213	129.9 Å²	129.9	93%	0.926	75%	0.745	S	S	*	*				-172.4	135.4	116.9	-97.7	158.4	-176.1	179.3	0	109.7
905	A	27.1	Very low	29.8	Very low	89 Å²	89	131 Å²	131	74%	0.736	75%	0.754	S	S	*	*	S	Bend	cis	-151.8	146.5	-13.5	0	0	0	0	0	110.7
906	A	28	Very low	29.5	Very low	99 Å²	99	132.5 Å²	132.5	82%	0.818	77%	0.768	S	S	*	*			trans	-153.9	50.6	165.3	0	0	0	0	0	109.5	H908	A906-H908 PolarHBondContact O-N 3.03Å
907	T	29	Very low	29.7	Very low	123 Å²	123	132.9 Å²	132.9	76%	0.755	77%	0.773	S	S	*	*			trans	-73.9	91.2	178.1	-56.2	0	0	0	0	109.6	G909	T907-G909 PolarHBondContact O-N 2.87Å
908	H	27.8	Very low	29.6	Very low	208 Å²	208	132.4 Å²	132.4	96%	0.963	78%	0.78	S	S	*	*			trans	-72.3	80.2	150.7	-94.5	-62.2	0	0	0	107.9	A906	A906-H908 PolarHBondContact O-N 3.03Å
909	G	28.7	Very low	29.7	Very low	50 Å²	50	131.2 Å²	131.2	52%	0.515	78%	0.778	S	S	.	*			trans	-143.2	92.3	177.1	0	0	0	0	0	107.3	T907	T907-G909 PolarHBondContact O-N 2.87Å
910	N	28	Very low	29.6	Very low	138 Å²	138	137 Å²	137	74%	0.738	78%	0.782	S	S	*	*			trans	-75.5	149.4	-176.8	-167.9	-3.6	0	0	0	110
911	T	27.2	Very low	29.5	Very low	123 Å²	123	133.6 Å²	133.6	76%	0.755	78%	0.778	S	S	*	*	S	Bend	trans	80.6	112.1	175.9	73.2	0	0	0	0	116.9	E913	T911-E913 PolarHBondContact N-OE1 3.19Å
912	G	28	Very low	29.6	Very low	80 Å²	80	130.8 Å²	130.8	83%	0.825	77%	0.774	S	S	*	*			trans	106.8	84.8	169.5	0	0	0	0	0	113.3
913	E	35.6	Very low	29.6	Very low	148 Å²	148	129.8 Å²	129.8	69%	0.692	78%	0.781	S	S	*	*			trans	-131.7	122.3	-154.3	-71.1	147.7	-160.3	0	0	113.2	T911	T911-E913 PolarHBondContact N-OE1 3.19Å
914	E	27	Very low	29.5	Very low	189 Å²	189	134 Å²	134	88%	0.883	79%	0.789	S	S	*	*			trans	-152	161.4	173.7	-98.9	-133.2	95.6	0	0	112
915	P	34.8	Very low	29.6	Very low	111 Å²	111	132.5 Å²	132.5	72%	0.721	79%	0.785	S	S	*	*				-119.5	-171.7	-122.4	43.7	-39	0	0	0	117.8
916	T	34.5	Very low	29.8	Very low	137 Å²	137	132.2 Å²	132.2	84%	0.84	79%	0.791	S	S	*	*			trans	-95.7	154.8	-174.8	49	0	0	0	0	114
917	S	36.7	Very low	30	Very low	111 Å²	111	130.9 Å²	130.9	78%	0.776	79%	0.787	S	S	*	*			trans	-169.6	166.7	132.6	55.8	0	0	0	0	111.7
918	C	28.4	Very low	30	Very low	125 Å²	125	131 Å²	131	85%	0.845	79%	0.787	S	S	*	*			trans	-136.3	135.9	160.3	59.1	0	0	0	0	107.2
919	V	31.5	Very low	30.1	Very low	128 Å²	128	130.2 Å²	130.2	78%	0.776	78%	0.781	S	S	*	*			trans	-146.3	117	-173.7	-175.1	0	0	0	0	112.2
920	R	25.7	Very low	30.1	Very low	242 Å²	242	132.8 Å²	132.8	91%	0.913	79%	0.787	S	S	*	*			trans	-146.9	121.2	136.3	-92.5	-177.4	179.9	157.1	1.5	105
921	A	28.6	Very low	30.1	Very low	76 Å²	76	134.6 Å²	134.6	63%	0.628	79%	0.791	S	S	*	*				72.6	125.3	107.3	0	0	0	0	0	112.5
922	D	30.6	Very low	30.3	Very low	167 Å²	167	136.1 Å²	136.1	89%	0.893	80%	0.795	S	S	*	*			cis	-141.3	174.1	19.2	-88	-55.4	0	0	0	115.2
923	G	30.2	Very low	30.4	Very low	66 Å²	66	138.1 Å²	138.1	68%	0.68	80%	0.796	S	S	*	*			trans	-57.3	158	-163.2	0	0	0	0	0	120.7
924	Q	26.3	Very low	30.7	Very low	190 Å²	190	138.1 Å²	138.1	89%	0.888	80%	0.801	S	S	*	*				-154.1	175.6	97.6	-100.7	-167.9	-86.7	0	0	112.2
925	E	28.1	Very low	31.5	Very low	182 Å²	182	134.6 Å²	134.6	85%	0.85	79%	0.794	S	S	*	*			trans	-90.4	153.8	-148.6	-56.3	162.3	111.2	0	0	117.1
926	G	31	Very low	31.9	Very low	84 Å²	84	135.6 Å²	135.6	87%	0.866	80%	0.798	S	S	*	*			trans	117.5	137.3	140.4	0	0	0	0	0	118.7
927	G	31.5	Very low	31.6	Very low	71 Å²	71	134.5 Å²	134.5	73%	0.732	80%	0.796	S	S	*	*			trans	127.7	27.2	143.8	0	0	0	0	0	123.7
928	V	29.2	Very low	31.4	Very low	125 Å²	125	134.5 Å²	134.5	76%	0.758	80%	0.796	S	S	*	*			trans	43.6	115.7	138.4	-178.6	0	0	0	0	120.4
929	K	30.4	Very low	31.4	Very low	191 Å²	191	135 Å²	135	83%	0.83	80%	0.795	S	S	*	*			trans	69.6	152.9	151.4	-72.5	177.2	-175.4	-179.7	0	119.7
930	T	28.6	Very low	31.5	Very low	105 Å²	105	135.2 Å²	135.2	64%	0.644	80%	0.797	S	S	*	*			cis	-158.4	169.2	-33.4	-25.9	0	0	0	0	108.2
931	E	27	Very low	31.7	Very low	175 Å²	175	128 Å²	128	82%	0.818	79%	0.788	S	S	*	*			trans	79.6	150.9	152.9	-75.5	159.4	-118.2	0	0	120.7
932	N	32.1	Very low	32.4	Very low	156 Å²	156	132.2 Å²	132.2	83%	0.834	80%	0.801	S	S	*	*			trans	-79.4	154.3	-161.6	-52.5	-30.9	0	0	0	114.5
933	S	30	Very low	33	Very low	121 Å²	121	129.6 Å²	129.6	85%	0.846	79%	0.793	S	S	*	*				-178.3	140.1	119.4	32.5	0	0	0	0	115.3
934	D	43.1	Very low	32.9	Very low	148 Å²	148	131.8 Å²	131.8	79%	0.791	80%	0.798	S	S	*	*			trans	-65.4	167.2	155	-80.8	-64.7	0	0	0	111.3
935	P	44.1	Very low	33.3	Very low	115 Å²	115	128.2 Å²	128.2	75%	0.747	79%	0.794	S	S	*	*			cis	-149.5	-176.9	33.6	43.4	-22.3	0	0	0	118.4
936	V	42.6	Very low	33.9	Very low	133 Å²	133	125.1 Å²	125.1	81%	0.806	79%	0.789	S	S	*	*			trans	-66.2	139.3	167.2	174.5	0	0	0	0	112.1
937	S	28.7	Very low	34.1	Very low	113 Å²	113	125.1 Å²	125.1	79%	0.79	78%	0.781	S	S	*	*			trans	-152	156	157	-82.2	0	0	0	0	111.6
938	S	31.9	Very low	34.1	Very low	112 Å²	112	128.1 Å²	128.1	78%	0.783	78%	0.781	S	S	*	*			trans	-85.3	163.9	-179.5	51.9	0	0	0	0	112.5
939	V	29	Very low	34.5	Very low	135 Å²	135	130.6 Å²	130.6	82%	0.818	78%	0.784	S	S	*	*				174.9	153.1	122.9	149.3	0	0	0	0	110.8
940	T	33.1	Very low	34.6	Very low	132 Å²	132	124.9 Å²	124.9	81%	0.81	77%	0.768	S	S	*	*			trans	-71	138.5	174.9	48	0	0	0	0	113.9
941	A	28.9	Very low	34.9	Very low	90 Å²	90	124.1 Å²	124.1	74%	0.744	77%	0.767	S	S	*	*			trans	-154.9	130.1	145.2	0	0	0	0	0	110.2
942	D	44.9	Very low	35.4	Very low	166 Å²	166	121.3 Å²	121.3	89%	0.888	76%	0.764	S	S	*	*			trans	-62.8	137.4	151.9	-66.1	-74.2	0	0	0	107.5
943	P	41.6	Very low	35.1	Very low	112 Å²	112	118.7 Å²	118.7	73%	0.727	75%	0.753	S	S	*	*				-146.6	146.3	115.6	38.2	-24.1	0	0	0	116.1
944	S	28.3	Very low	35	Very low	112 Å²	112	120.2 Å²	120.2	78%	0.783	75%	0.747	S	S	*	*			trans	-13.3	149.8	130.7	-45	0	0	0	0	118.6
945	S	36.1	Very low	34.3	Very low	114 Å²	114	120 Å²	120	80%	0.797	74%	0.739	S	S	*	*			trans	-19.8	154.1	153.9	-55.2	0	0	0	0	117.5
946	P	40.5	Very low	33.8	Very low	117 Å²	117	118.8 Å²	118.8	76%	0.76	74%	0.738	S	S	*	*			cis	-155.2	-179.4	46.2	45.1	-24.6	0	0	0	119.9
947	A	33.6	Very low	33.2	Very low	84 Å²	84	119.5 Å²	119.5	69%	0.694	73%	0.731	S	S	*	*			trans	54.7	131	139.7	0	0	0	0	0	121.1
948	D	32	Very low	33.1	Very low	135 Å²	135	120.3 Å²	120.3	72%	0.722	72%	0.722	S	S	*	*			cis	-152.4	-153.3	-5.9	-132.9	-121.5	0	0	0	108.6	S950	D948-S950 WeakPolarHBondContact OD1-CA 3.44Å
949	E	37.3	Very low	33	Very low	177 Å²	177	120.1 Å²	120.1	83%	0.827	72%	0.721	S	S	*	*			cis	-140.4	160.9	17.3	-93.4	-150.4	68.6	0	0	110.7
950	S	32.7	Very low	33	Very low	70 Å²	70	118.5 Å²	118.5	49%	0.49	72%	0.716	S	S	.	*			cis	-171.4	-42.5	-23	54.6	0	0	0	0	111.7	D948	D948-S950 WeakPolarHBondContact OD1-CA 3.44Å
951	S	35.6	Very low	32.8	Very low	90 Å²	90	118.1 Å²	118.1	63%	0.629	71%	0.713	S	S	*	*			trans	-139.8	146.2	-160.2	-173.7	0	0	0	0	114
952	P	37.7	Very low	32.9	Very low	116 Å²	116	118.5 Å²	118.5	75%	0.753	71%	0.71	S	S	*	*			cis	-91.6	143.6	-5.5	37.7	-34.2	0	0	0	111.6
953	V	26.1	Very low	32.2	Very low	100 Å²	100	116.3 Å²	116.3	61%	0.606	71%	0.707	S	S	*	*				64.4	90	56	-177.9	0	0	0	0	110.7
954	E	27	Very low	31.9	Very low	154 Å²	154	114.6 Å²	114.6	72%	0.72	71%	0.71	S	S	*	*				93.4	162.4	79	-161.6	-176.3	-165.3	0	0	112.2
955	F	29.4	Very low	32.1	Very low	144 Å²	144	119.1 Å²	119.1	63%	0.632	72%	0.716	S	S	*	*			trans	76.3	99.4	-177.4	-66.4	-89.8	0	0	0	113.4	K957	F955-K957 HydrophobicContact CD1-CD 4.43Å; F955-K957 HydrophobicContact CE1-CD 4.38Å
956	A	32.6	Very low	31.8	Very low	88 Å²	88	119 Å²	119	73%	0.727	72%	0.715	S	S	*	*				59.5	156	51.7	0	0	0	0	0	111.1
957	K	29.9	Very low	31.2	Very low	148 Å²	148	119.6 Å²	119.6	64%	0.643	72%	0.722	S	S	*	*			cis	-167.6	177.1	37.4	-133.9	164.2	173.5	-118	0	104.7	F955	F955-K957 HydrophobicContact CD1-CD 4.43Å; F955-K957 HydrophobicContact CE1-CD 4.38Å
958	E	26.9	Very low	31.1	Very low	131 Å²	131	122.6 Å²	122.6	61%	0.612	73%	0.725	S	S	*	*			cis	-166.1	164.1	7.5	-163.2	137.9	-151.7	0	0	106.9
959	S	30	Very low	31.2	Very low	108 Å²	108	121.8 Å²	121.8	76%	0.755	73%	0.725	S	S	*	*			trans	65.1	155.8	149.5	70.9	0	0	0	0	119.9
960	S	28.6	Very low	31.1	Very low	101 Å²	101	119.5 Å²	119.5	71%	0.706	72%	0.719	S	S	*	*			cis	-164.9	147.1	-21.2	47.1	0	0	0	0	112.7
961	V	29.5	Very low	31.2	Very low	124 Å²	124	120.1 Å²	120.1	75%	0.752	72%	0.723	S	S	*	*			trans	59.5	86.6	132.7	-178.3	0	0	0	0	118.5
962	S	30	Very low	31.2	Very low	98 Å²	98	125.2 Å²	125.2	69%	0.685	73%	0.734	S	S	*	*				95.6	167.8	112.1	84	0	0	0	0	122.5
963	S	30.3	Very low	30.7	Very low	119 Å²	119	124.5 Å²	124.5	83%	0.832	73%	0.732	S	S	*	*			trans	80.7	60.5	149.9	-57.6	0	0	0	0	118.9
964	G	34.8	Very low	30.8	Very low	76 Å²	76	127.4 Å²	127.4	78%	0.784	74%	0.743	S	S	*	*			trans	-154	71.4	173.6	0	0	0	0	0	114.7
965	K	32.6	Very low	30.8	Very low	207 Å²	207	125.6 Å²	125.6	90%	0.9	75%	0.747	S	S	*	*			trans	-45.8	146.5	175	-53.9	162.2	-172.7	171.4	0	112.5
966	S	30.2	Very low	30.8	Very low	113 Å²	113	131.1 Å²	131.1	79%	0.79	76%	0.763	S	S	*	*			cis	-176.5	135	-8.9	46.4	0	0	0	0	109.5
967	S	27.7	Very low	30.7	Very low	128 Å²	128	131.3 Å²	131.3	90%	0.895	77%	0.765	S	S	*	*			trans	-155.1	130	162.2	-167.7	0	0	0	0	110
968	L	31.6	Very low	30.5	Very low	147 Å²	147	131.2 Å²	131.2	77%	0.77	77%	0.771	S	S	*	*			trans	-139.3	143	-171	-87.8	169.8	0	0	0	109.9
969	T	35.4	Very low	30.6	Very low	118 Å²	118	129.9 Å²	129.9	72%	0.724	77%	0.772	S	S	*	*			trans	62.1	138.4	149.4	58.3	0	0	0	0	118.3
970	D	33.9	Very low	30.5	Very low	129 Å²	129	131.9 Å²	131.9	69%	0.69	77%	0.774	S	S	*	*			cis	-158.5	169.2	-2.2	-139.2	-69.1	0	0	0	113.5
971	S	35.9	Very low	30.5	Very low	84 Å²	84	131.9 Å²	131.9	59%	0.587	77%	0.773	S	S	*	*			trans	61.5	104.9	146.1	-75.8	0	0	0	0	121.8
972	K	34.9	Very low	30.5	Very low	196 Å²	196	132.3 Å²	132.3	85%	0.852	77%	0.77	S	S	*	*				36.5	132.4	123.3	-58.9	165.7	-177.6	168.2	0	119.4
973	S	26.8	Very low	30.6	Very low	101 Å²	101	132.2 Å²	132.2	71%	0.706	76%	0.759	S	S	*	*			cis	-174	143.2	-12.2	45.9	0	0	0	0	110.1
974	I	28.4	Very low	30.6	Very low	162 Å²	162	131 Å²	131	83%	0.831	74%	0.743	S	S	*	*			trans	73.8	134	170.2	-54.9	172.3	0	0	0	116.3
975	S	28.1	Very low	30.4	Very low	115 Å²	115	134.1 Å²	134.1	80%	0.804	74%	0.736	S	S	*	*			trans	75.7	126.9	174.7	81.6	0	0	0	0	118.2
976	R	28.8	Very low	30.3	Very low	261 Å²	261	127.2 Å²	127.2	99%	0.985	71%	0.713	S	S	*	*			trans	-161.9	161.8	151.6	-128.3	172.7	179.8	139.4	-0.6	109.2
977	A	30.2	Very low	30.3	Very low	92 Å²	92	127.1 Å²	127.1	76%	0.76	70%	0.704	S	S	*	*			trans	-141.5	156	178.9	0	0	0	0	0	111.2
978	N	27.1	Very low	30.5	Very low	145 Å²	145	127.7 Å²	127.7	78%	0.775	70%	0.696	S	S	*	*			trans	78.1	120.7	151.6	-129.8	38.1	0	0	0	119.5
979	V	28	Very low	30.4	Very low	104 Å²	104	125.5 Å²	125.5	63%	0.63	69%	0.689	S	S	*	*			trans	69	142.8	143.2	-63.8	0	0	0	0	124.3
980	D	28.3	Very low	30.1	Very low	149 Å²	149	128.4 Å²	128.4	80%	0.797	69%	0.694	S	S	*	*			trans	69.2	143.5	148.1	-61.3	-20.8	0	0	0	121.4
981	C	27.2	Very low	29.9	Very low	102 Å²	102	125.5 Å²	125.5	69%	0.689	69%	0.694	S	S	*	*			cis	176.9	146.3	-11.2	-172.5	0	0	0	0	108.8
982	L	31.3	Very low	29.5	Very low	132 Å²	132	127.3 Å²	127.3	69%	0.691	70%	0.702	S	S	*	*			trans	72.1	148.3	153.4	-89.5	171.3	0	0	0	125
983	Q	32.2	Very low	29.1	Very low	97 Å²	97	123.5 Å²	123.5	45%	0.453	69%	0.694	S	S	.	*			trans	67.6	148.9	160.3	-80.3	127.6	6.5	0	0	118.1	A1045	Q983-A1045 HydrophobicContact CG-CB 3.73Å
984	D	30.1	Very low	29.1	Very low	93 Å²	93	125.6 Å²	125.6	50%	0.497	70%	0.698	S	S	.	*			cis	-155.2	175.8	21.6	-135.3	-21.5	0	0	0	117.6	A1045	D984-A1045 WeakPolarHBondContact OD1-CA 3.35Å
985	F	29	Very low	29.2	Very low	142 Å²	142	122 Å²	122	62%	0.623	69%	0.687	S	S	*	*			trans	55.1	100.8	155.2	-73.8	-62.6	0	0	0	125.7
986	S	30.5	Very low	29.2	Very low	61 Å²	61	123 Å²	123	43%	0.427	68%	0.683	S	S	.	*				66.7	123	116.2	68.1	0	0	0	0	124.2	A1046	S986-A1046 WeakPolarHBondContact CA-O 3.48Å; S986-A1046 PolarHBondContact N-O 2.83Å
987	N	31.6	Very low	29.2	Very low	112 Å²	112	116.6 Å²	116.6	60%	0.599	67%	0.668	S	S	*	*				-164.6	125.7	112.1	-92.2	-23.5	0	0	0	109.2
988	I	30.4	Very low	29	Very low	140 Å²	140	118.5 Å²	118.5	72%	0.718	67%	0.665	S	S	*	*				69.5	122.7	87.6	-69.9	-178.5	0	0	0	111.4
989	T	30.8	Very low	29.4	Very low	101 Å²	101	119.4 Å²	119.4	62%	0.62	67%	0.67	S	S	*	*			cis	-144.8	145.5	11.9	6.6	0	0	0	0	109.5
990	Q	27.6	Very low	29.4	Very low	179 Å²	179	119 Å²	119	84%	0.836	67%	0.668	S	S	*	*				46.9	136.4	95.5	-48	172.9	11.5	0	0	114.6
991	G	30.1	Very low	29.7	Very low	67 Å²	67	118 Å²	118	69%	0.691	67%	0.667	S	S	*	*			cis	-172.4	-152.4	6.2	0	0	0	0	0	109.1
992	T	28.1	Very low	29.7	Very low	122 Å²	122	118.9 Å²	118.9	75%	0.748	66%	0.664	S	S	*	*			cis	-172.4	147.4	-7.5	0.7	0	0	0	0	108.4
993	V	27.1	Very low	29.8	Very low	116 Å²	116	121 Å²	121	70%	0.703	67%	0.668	S	S	*	*			trans	55.3	163.9	159.8	-54	0	0	0	0	119.5
994	D	27.2	Very low	29.7	Very low	145 Å²	145	120.6 Å²	120.6	78%	0.775	68%	0.675	S	S	*	*			trans	62.8	154.3	155.7	-60.7	-28	0	0	0	119
995	S	30.3	Very low	29.8	Very low	86 Å²	86	125.6 Å²	125.6	60%	0.601	69%	0.687	S	S	*	*			cis	-149.1	156.5	-15.2	-127.5	0	0	0	0	112.2
996	L	28	Very low	30.2	Very low	137 Å²	137	124.7 Å²	124.7	72%	0.717	69%	0.685	S	S	*	*			trans	22.3	132.7	135.8	-60.3	171.8	0	0	0	120.9
997	N	28.2	Very low	30.3	Very low	127 Å²	127	128 Å²	128	68%	0.679	70%	0.697	S	S	*	*			trans	67.3	125	139.1	-58.3	-19.5	0	0	0	121.3
998	N	26.9	Very low	30.5	Very low	131 Å²	131	126.1 Å²	126.1	70%	0.701	71%	0.705	S	S	*	*			trans	59.8	150.4	146.6	-55.4	-41.1	0	0	0	117.9
999	L	34.2	Very low	30.4	Very low	165 Å²	165	128.3 Å²	128.3	86%	0.864	71%	0.709	S	S	*	*			cis	-124.2	152.4	18.8	-58.6	97	0	0	0	110.9
1000	T	28.8	Very low	30.8	Very low	96 Å²	96	127 Å²	127	59%	0.589	71%	0.709	S	S	*	*			cis	87.7	81.9	27.4	-52.6	0	0	0	0	115.2
1001	V	33.3	Very low	31.1	Very low	128 Å²	128	126.5 Å²	126.5	78%	0.776	70%	0.704	S	S	*	*			trans	-144.6	97.7	145.1	-176	0	0	0	0	105.7
1002	L	28.8	Very low	31.4	Very low	120 Å²	120	126.8 Å²	126.8	63%	0.628	71%	0.707	S	S	*	*				56.6	127	99	-57.7	171.3	0	0	0	113.3
1003	F	31.7	Very low	31.6	Very low	176 Å²	176	127.5 Å²	127.5	77%	0.772	71%	0.705	S	S	*	*			cis	-135.3	137	25.3	-74.3	-94.4	0	0	0	111.3
1004	S	31.7	Very low	32	Very low	88 Å²	88	126.3 Å²	126.3	62%	0.615	71%	0.707	S	S	*	*				53.6	137.2	94.7	-65.5	0	0	0	0	115.5
1005	R	30.6	Very low	32.6	Very low	199 Å²	199	123.8 Å²	123.8	75%	0.751	70%	0.698	S	S	*	*			cis	-167.9	170.5	5.4	-120.8	-174.5	153.1	111.2	5.3	108.7
1006	H	38.3	Very low	32.8	Very low	123 Å²	123	127.3 Å²	127.3	57%	0.569	71%	0.71	S	S	*	*			cis	-159.1	-159.9	-0.6	-148.9	-154.9	0	0	0	110.8
1007	D	32.3	Very low	33.1	Very low	129 Å²	129	125.9 Å²	125.9	69%	0.69	71%	0.709	S	S	*	*			trans	-34.6	165.4	170.7	-45.1	-22.7	0	0	0	119.7
1008	G	35.4	Very low	33.1	Very low	73 Å²	73	123.4 Å²	123.4	75%	0.753	71%	0.706	S	S	*	*			cis	175.7	-180	2.6	0	0	0	0	0	110.2
1009	F	29.4	Very low	33.1	Very low	186 Å²	186	124.3 Å²	124.3	82%	0.816	71%	0.71	S	S	*	*			cis	-149.8	173.6	0.2	-167.5	-107.9	0	0	0	110.5
1010	A	39	Very low	32.8	Very low	73 Å²	73	123.9 Å²	123.9	60%	0.603	70%	0.704	S	S	*	*			trans	-74.4	-177.4	-173.9	0	0	0	0	0	113.9
1011	K	34.7	Very low	32.7	Very low	169 Å²	169	128.9 Å²	128.9	74%	0.735	71%	0.713	S	S	*	*			cis	-139.7	166.1	20.2	-100.9	121.8	177.8	-175.4	0	109.1	I1013	K1011-I1013 HydrophobicContact CG-CD1 4.12Å
1012	G	34.4	Very low	32.6	Very low	74 Å²	74	128.3 Å²	128.3	76%	0.763	71%	0.712	S	S	*	*			cis	105.9	162.4	37.4	0	0	0	0	0	109
1013	I	33.6	Very low	32.5	Very low	137 Å²	137	130.3 Å²	130.3	70%	0.703	72%	0.722	S	S	*	*			cis	-153	119.6	2.6	-99.1	154.1	0	0	0	104	K1011	K1011-I1013 HydrophobicContact CG-CD1 4.12Å
1014	A	34.3	Very low	32.2	Very low	90 Å²	90	126 Å²	126	74%	0.744	73%	0.727	S	S	*	*				83.9	-152.6	74.2	0	0	0	0	0	111.4
1015	P	41.3	Very low	32	Very low	92 Å²	92	125.2 Å²	125.2	60%	0.597	73%	0.734	S	S	*	*				-136.5	173.6	-89.5	39.2	-24.3	0	0	0	117.2
1016	L	34.6	Very low	31.8	Very low	160 Å²	160	118.3 Å²	118.3	84%	0.838	72%	0.716	S	S	*	*			trans	64.3	-177.4	145.3	-80.5	166.9	0	0	0	115.9
1017	P	33.7	Very low	31.2	Very low	108 Å²	108	114.7 Å²	114.7	70%	0.701	71%	0.711	S	S	*	*			cis	-126.4	-169.7	-13.3	29.2	-7	0	0	0	113.6
1018	A	28.3	Very low	31	Very low	74 Å²	74	113.4 Å²	113.4	61%	0.612	71%	0.713	S	S	*	*			trans	61.6	127.6	132.2	0	0	0	0	0	122.8
1019	L	26.9	Very low	30.6	Very low	151 Å²	151	112.6 Å²	112.6	79%	0.791	70%	0.704	S	S	*	*			trans	68.8	163	150.3	-54.6	163.3	0	0	0	114.9
1020	Q	27.7	Very low	30.5	Very low	156 Å²	156	113 Å²	113	73%	0.729	71%	0.706	S	S	*	*			cis	-145.1	161.5	1.1	-154.7	152	-75	0	0	110.9
1021	Y	26.1	Very low	29.8	Very low	200 Å²	200	117.4 Å²	117.4	78%	0.784	71%	0.712	S	S	*	*			trans	-65	143.2	166.7	-48.3	-88.9	0	0	0	111
1022	P	30.8	Very low	29.5	Very low	117 Å²	117	115.1 Å²	115.1	76%	0.76	72%	0.717	S	S	*	*				-123.9	136.4	104.1	1	20.2	0	0	0	111.6
1023	L	27	Very low	29.1	Very low	161 Å²	161	116 Å²	116	84%	0.843	71%	0.71	S	S	*	*				69.5	127.7	75.5	-85.2	72.8	0	0	0	114.3
1024	G	26.1	Very low	28.8	Very low	85 Å²	85	114.8 Å²	114.8	88%	0.876	71%	0.712	S	S	*	*			trans	99.3	117.7	176.8	0	0	0	0	0	114.1
1025	G	27.5	Very low	28.5	Very low	73 Å²	73	117.8 Å²	117.8	75%	0.753	72%	0.721	S	S	*	*			cis	152.8	131	-14.9	0	0	0	0	0	114.7
1026	S	26.4	Very low	27.8	Very low	54 Å²	54	116.9 Å²	116.9	38%	0.378	73%	0.728	S	S	.	*			trans	74.2	105.2	133.5	-118.8	0	0	0	0	119.4	Q1039 G1040	S1026-Q1039 VanDerWaalsContact CB-OE1 3.28Å; S1026-Q1039 WeakPolarHBondContact O-CA 3.47Å; S1026-Q1039 VanDerWaalsContact OG-CD 3.31Å; S1026-Q1039 WeakPolarHBondContact OG-CG 3.49Å; S1026-Q1039 PolarHBondContact OG-OE1 3.41Å; S1026-G1040 WeakPolarHBondContact OG-CA 3.39Å
1027	G	26.3	Very low	27.5	Very low	46 Å²	46	114.1 Å²	114.1	47%	0.474	73%	0.728	S	S	.	*			trans	-63.4	-116.2	-174.2	0	0	0	0	0	121.5	Q1039 G1040	G1027-Q1039 VanDerWaalsContact C-C 3.43Å; G1027-Q1039 CarbonylContact O-C 3.5Å; G1027-G1040 VanDerWaalsContact C-N 3.34Å; G1027-G1040 WeakPolarHBondContact CA-O 3.38Å; G1027-G1040 PolarHBondContact N-O 2.64Å
1028	S	27.3	Very low	27.3	Very low	102 Å²	102	116.1 Å²	116.1	71%	0.713	73%	0.732	S	S	*	*			trans	65.6	163.7	-152.4	-80.7	0	0	0	0	115.9	Q1039	S1028-Q1039 WeakPolarHBondContact CB-O 3.34Å; S1028-Q1039 PolarHBondContact OG-O 3.29Å
1029	G	27.9	Very low	27.6	Very low	56 Å²	56	118.2 Å²	118.2	58%	0.577	73%	0.729	S	S	*	*			trans	-133.1	178.1	-175.9	0	0	0	0	0	114.4
1030	F	27	Very low	27.9	Very low	195 Å²	195	112.4 Å²	112.4	86%	0.855	71%	0.706	S	S	*	*			trans	68.6	168	-174.7	-59.5	-83.2	0	0	0	115.6
1031	F	24.1	Very low	28.4	Very low	166 Å²	166	109.6 Å²	109.6	73%	0.728	71%	0.71	S	S	*	*			trans	64.9	81.6	174.8	-42.7	-64.9	0	0	0	114.5
1032	S	28.3	Very low	28.8	Very low	120 Å²	120	106.6 Å²	106.6	84%	0.839	72%	0.718	S	S	*	*				-55.1	125.5	68.1	-81.3	0	0	0	0	116.4
1033	P	25.8	Very low	28.9	Very low	94 Å²	94	104 Å²	104	61%	0.61	71%	0.713	S	S	*	*	S	Bend	cis	-66.8	141.5	18.8	27.5	-38	0	0	0	115.3
1034	C	27.1	Very low	29.2	Very low	110 Å²	110	100 Å²	100	74%	0.743	70%	0.703	S	S	*	*	S	Bend	trans	26	108.6	134.3	-46.7	0	0	0	0	117.2
1035	V	28.8	Very low	29.5	Very low	154 Å²	154	98.3 Å²	98.3	93%	0.933	68%	0.681	S	S	*	*			trans	77.5	95.8	155.9	-158.7	0	0	0	0	117.6
1036	G	26.5	Very low	29.9	Very low	73 Å²	73	98.5 Å²	98.5	75%	0.753	68%	0.675	S	S	*	*			trans	156.9	116	156.7	0	0	0	0	0	120.6
1037	A	29	Very low	30.3	Very low	102 Å²	102	98.7 Å²	98.7	84%	0.843	68%	0.68	S	S	*	*			trans	47.2	118.7	142.9	0	0	0	0	0	126.6
1038	L	29.2	Very low	30.6	Very low	150 Å²	150	101.7 Å²	101.7	79%	0.785	69%	0.693	S	S	*	*				75.8	111.5	116.1	-160	72.7	0	0	0	125.5
1039	Q	33.2	Very low	30.9	Very low	117 Å²	117	104.7 Å²	104.7	55%	0.547	70%	0.7	S	S	.	*			trans	60.2	147	151.1	-55.4	-143.2	101.3	0	0	122.6	S1026 G1027 S1028	S1026-Q1039 VanDerWaalsContact CB-OE1 3.28Å; S1026-Q1039 WeakPolarHBondContact O-CA 3.47Å; S1026-Q1039 VanDerWaalsContact OG-CD 3.31Å; S1026-Q1039 WeakPolarHBondContact OG-CG 3.49Å; S1026-Q1039 PolarHBondContact OG-OE1 3.41Å; G1027-Q1039 VanDerWaalsContact C-C 3.43Å; G1027-Q1039 CarbonylContact O-C 3.5Å; S1028-Q1039 WeakPolarHBondContact CB-O 3.34Å; S1028-Q1039 PolarHBondContact OG-O 3.29Å
1040	G	34.9	Very low	31.2	Very low	29 Å²	29	107.5 Å²	107.5	30%	0.299	71%	0.711	S	S	.	*			cis	-166.8	-154.4	14.3	0	0	0	0	0	118.7	S1026 G1027	S1026-G1040 WeakPolarHBondContact OG-CA 3.39Å; G1027-G1040 VanDerWaalsContact C-N 3.34Å; G1027-G1040 WeakPolarHBondContact CA-O 3.38Å; G1027-G1040 PolarHBondContact N-O 2.64Å
1041	A	36.6	Very low	31.6	Very low	98 Å²	98	101.4 Å²	101.4	81%	0.81	70%	0.704	S	S	*	*			trans	79.6	155.4	167.5	0	0	0	0	0	123.7
1042	S	34.6	Very low	32	Very low	136 Å²	136	101.5 Å²	101.5	95%	0.951	71%	0.711	S	S	*	*			trans	-178.2	165.4	174	-75.5	0	0	0	0	115.4
1043	G	33.9	Very low	32.3	Very low	64 Å²	64	101.7 Å²	101.7	66%	0.66	71%	0.707	S	S	*	*			trans	171.9	167	173.8	0	0	0	0	0	118.6
1044	A	33.8	Very low	32.5	Very low	76 Å²	76	102.3 Å²	102.3	63%	0.628	71%	0.714	S	S	*	*			trans	-174.8	172.3	-172.7	0	0	0	0	0	114.2
1045	A	32.5	Very low	32.7	Very low	50 Å²	50	104.9 Å²	104.9	41%	0.413	71%	0.714	S	S	.	*			cis	-178.3	176.9	-27.8	0	0	0	0	0	114.7	Q983 D984	Q983-A1045 HydrophobicContact CG-CB 3.73Å; D984-A1045 WeakPolarHBondContact OD1-CA 3.35Å
1046	A	34	Very low	32.7	Very low	76 Å²	76	104.7 Å²	104.7	63%	0.628	71%	0.707	S	S	*	*			trans	100.4	152.6	153.5	0	0	0	0	0	122.7	S986	S986-A1046 WeakPolarHBondContact CA-O 3.48Å; S986-A1046 PolarHBondContact N-O 2.83Å
1047	A	35.1	Very low	33	Very low	59 Å²	59	107.2 Å²	107.2	49%	0.488	71%	0.713	S	S	.	*			trans	156.4	172.9	152.5	0	0	0	0	0	114.5
1048	S	33.5	Very low	33.1	Very low	108 Å²	108	106.8 Å²	106.8	76%	0.755	71%	0.71	S	S	*	*			trans	-165	-178	-171.4	-64.8	0	0	0	0	115.5
1049	L	34.2	Very low	33.3	Very low	165 Å²	165	104.9 Å²	104.9	86%	0.864	71%	0.707	S	S	*	*			trans	88.9	154.6	171.8	-50.4	172	0	0	0	116.4
1050	S	34.3	Very low	33.1	Very low	115 Å²	115	106.8 Å²	106.8	80%	0.804	72%	0.715	S	S	*	*			cis	-170.6	150.8	-26.2	-92.6	0	0	0	0	111.6
1051	G	34.7	Very low	32.8	Very low	68 Å²	68	112.7 Å²	112.7	70%	0.701	74%	0.735	S	S	*	*			trans	128.3	124.9	175.6	0	0	0	0	0	112.1
1052	L	32.5	Very low	32.4	Very low	167 Å²	167	115.2 Å²	115.2	87%	0.874	73%	0.734	S	S	*	*				65.9	121	51.4	-55.3	-178.5	0	0	0	112.5
1053	V	33.8	Very low	32.1	Very low	124 Å²	124	114.5 Å²	114.5	75%	0.752	73%	0.726	S	S	*	*			cis	-156.1	166.9	-0.2	-102.4	0	0	0	0	111.3
1054	S	30.9	Very low	32	Very low	108 Å²	108	117.5 Å²	117.5	76%	0.755	73%	0.731	S	S	*	*			trans	85.3	135.6	153.1	-69.5	0	0	0	0	121.9
1055	H	30.1	Very low	31.8	Very low	164 Å²	164	119.8 Å²	119.8	76%	0.759	73%	0.733	S	S	*	*			trans	76.5	112	154.6	-86.7	-111.6	0	0	0	122.6
1056	L	28.9	Very low	31.6	Very low	150 Å²	150	124.6 Å²	124.6	79%	0.785	75%	0.751	S	S	*	*			trans	83.9	137.9	139.7	-65.5	164.3	0	0	0	121.2
1057	S	32.9	Very low	31.3	Very low	126 Å²	126	127.6 Å²	127.6	88%	0.881	76%	0.757	S	S	*	*			trans	72.7	142.5	164.9	-60.5	0	0	0	0	118.9
1058	A	30.9	Very low	30.8	Very low	93 Å²	93	130.2 Å²	130.2	77%	0.769	77%	0.77	S	S	*	*			trans	-114.8	-177.6	-171.6	0	0	0	0	0	109.5
1059	P	33.4	Very low	30.5	Very low	110 Å²	110	128.9 Å²	128.9	71%	0.714	77%	0.773	S	S	*	*			cis	-144.6	177.5	9.6	41.9	-21.5	0	0	0	118.5
1060	Q	29.5	Very low	30.1	Very low	157 Å²	157	124.1 Å²	124.1	73%	0.734	76%	0.764	S	S	*	*			trans	83.6	116.2	154.3	-57	-142	31.8	0	0	122.5
1061	Q	29.5	Very low	29.9	Very low	153 Å²	153	123 Å²	123	72%	0.715	76%	0.761	S	S	*	*				99.9	119.5	129.1	-82.3	-168	66.6	0	0	123.9
1062	L	27.1	Very low	29.9	Very low	151 Å²	151	131 Å²	131	79%	0.791	77%	0.771	S	S	*	*			trans	90.1	114.1	149.2	-62.5	173.1	0	0	0	122.6
1063	P	29.5	Very low	29.9	Very low	120 Å²	120	134.3 Å²	134.3	78%	0.779	77%	0.771	S	S	*	*			trans	-129.9	148.4	157.6	38.2	-25.4	0	0	0	115.9
1064	V	30.6	Very low	30.1	Very low	127 Å²	127	133.5 Å²	133.5	77%	0.77	78%	0.778	S	S	*	*			trans	-157.1	168.3	177.5	-121	0	0	0	0	109	L1066	V1064-L1066 HydrophobicContact CG1-CD1 4.18Å
1065	N	29.3	Very low	30.2	Very low	125 Å²	125	135.8 Å²	135.8	67%	0.668	78%	0.781	S	S	*	*			cis	-150.5	115.6	2.1	167.6	22.1	0	0	0	107.4	N1067	N1065-N1067 PolarHBondContact OD1-N 3.26Å
1066	L	28.1	Very low	31	Very low	150 Å²	150	138.5 Å²	138.5	79%	0.785	79%	0.785	S	S	*	*				81.1	10.7	51.2	-54.5	175.4	0	0	0	117.1	V1064	V1064-L1066 HydrophobicContact CG1-CD1 4.18Å
1067	N	28.1	Very low	32.8	Very low	140 Å²	140	134.8 Å²	134.8	75%	0.749	77%	0.769	S	S	*	*			trans	-94	145.5	168.2	-144.2	17.2	0	0	0	110.1	N1065	N1065-N1067 PolarHBondContact OD1-N 3.26Å
1068	C	24.6	Very low	34.8	Very low	114 Å²	114	139.8 Å²	139.8	77%	0.77	77%	0.768	S	S	*	*	S	Bend	cis	-137.4	142.7	25.6	-176.4	0	0	0	0	114.8	G1070	C1068-G1070 VanDerWaalsContact C-N 3.27Å; C1068-G1070 PolarHBondContact O-N 3.03Å
1069	G	27.4	Very low	37.4	Very low	79 Å²	79	137.1 Å²	137.1	81%	0.814	74%	0.739	S	S	*	*			trans	69.4	-8.9	158.4	0	0	0	0	0	119.7	A1071	G1069-A1071 PolarHBondContact O-N 3.23Å
1070	G	25.9	Very low	40.1	Very low	65 Å²	65	134.9 Å²	134.9	67%	0.67	72%	0.724	S	S	*	*			trans	-75.7	98	-167.4	0	0	0	0	0	117.8	C1068	C1068-G1070 VanDerWaalsContact C-N 3.27Å; C1068-G1070 PolarHBondContact O-N 3.03Å
1071	A	29.9	Very low	42.7	Very low	91 Å²	91	136 Å²	136	75%	0.752	73%	0.729	S	S	*	*			trans	17.8	111.1	149	0	0	0	0	0	120.6	G1069	G1069-A1071 PolarHBondContact O-N 3.23Å
1072	R	35.4	Very low	45.4	Very low	238 Å²	238	135.5 Å²	135.5	90%	0.898	73%	0.727	S	S	*	*			trans	-131.3	130.7	155.5	-63.8	-169.7	-175.3	-156.6	1	112.3
1073	R	31.4	Very low	48.4	Very low	236 Å²	236	129.8 Å²	129.8	89%	0.891	70%	0.696	S	S	*	*			trans	-102.9	109.2	167.8	-61.1	-177	-162.7	165	7.3	108.5
1074	A	38.1	Very low	51.3	Low	107 Å²	107	126.3 Å²	126.3	88%	0.884	67%	0.672	S	S	*	*	S	Bend	trans	-73.4	136.5	174.6	0	0	0	0	0	111.4
1075	N	33	Very low	54.2	Low	155 Å²	155	126.1 Å²	126.1	83%	0.829	66%	0.661	S	S	*	*			cis	-148.7	121.9	-22.4	-163.6	-0.9	0	0	0	108.3
1076	R	47.9	Very low	57.1	Low	222 Å²	222	122.2 Å²	122.2	84%	0.838	64%	0.642	S	S	*	*			trans	-127.9	129.9	168.4	-178.8	-173.6	-176.1	-149.2	-0.2	105.8	R1078	R1076-R1078 PolarHBondContact O-N 3.46Å; R1076-R1078 VanDerWaalsContact O-N 3.14Å
1077	T	66.4	Low	60.2	Low	72 Å²	72	115.1 Å²	115.1	44%	0.442	60%	0.604	S	S	.	*			trans	-52.7	120.8	176.5	40.8	0	0	0	0	110.1	F1079 V1115	T1077-F1079 WeakPolarHBondContact OG1-CE2 3.42Å; T1077-V1115 HydrophobicContact CG2-CG1 3.94Å; T1077-V1115 HydrophobicContact CG2-CG2 4.28Å
1078	R	75.7	Confident	63.2	Low	230 Å²	230	113 Å²	113	87%	0.868	59%	0.59	S	S	*	*			trans	-105.7	87.7	175.6	-175.2	-177.4	-174.6	-88.3	-0.2	107.2	R1076	R1076-R1078 PolarHBondContact O-N 3.46Å; R1076-R1078 VanDerWaalsContact O-N 3.14Å
1079	F	85.3	Confident	66.2	Low	38 Å²	38	111.5 Å²	111.5	17%	0.167	57%	0.572	C	S	.	*			trans	-54	146.5	170.8	-52.6	-95.9	0	0	0	110.4	T1077 Q1083 V1084 L1087 L1111 V1115 W1119	T1077-F1079 WeakPolarHBondContact OG1-CE2 3.42Å; F1079-Q1083 VanDerWaalsContact CA-OE1 3.26Å; F1079-Q1083 HydrophobicContact CB-CB 4.24Å; F1079-V1084 HydrophobicContact CB-CG2 3.49Å; F1079-V1084 VanDerWaalsContact CB-CG2 3.49Å; F1079-V1084 HydrophobicContact CG-CG2 4.24Å; F1079-L1087 HydrophobicContact CD1-CD1 3.89Å; F1079-L1087 HydrophobicContact CE1-CD1 3.99Å; F1079-L1111 HydrophobicContact CD1-CD1 3.67Å; F1079-L1111 HydrophobicContact CE1-CD1 3.85Å; F1079-V1115 HydrophobicContact CE1-CG1 3.74Å; F1079-V1115 HydrophobicContact CZ-CG1 3.74Å; F1079-W1119 HydrophobicContact CE1-CB 4.31Å; F1079-W1119 AromaticContact CE1-CD1 3.69Å; F1079-W1119 HydrophobicContact CE1-CG 4.3Å; F1079-W1119 AromaticContact CE2-CD1 3.9Å; F1079-W1119 HydrophobicContact CZ-CB 4.15Å; F1079-W1119 AromaticContact CZ-CD1 3.57Å; F1079-W1119 HydrophobicContact CZ-CG 4.24Å
1080	T	88.7	Confident	69.2	Low	63 Å²	63	108.9 Å²	108.9	39%	0.387	54%	0.538	S	S	.	.			trans	-70.1	166	165.8	67.3	0	0	0	0	110.2	Q1083 V1084	T1080-Q1083 PolarHBondContact O-N 2.75Å; T1080-Q1083 WeakPolarHBondContact OG1-CB 3.41Å; T1080-Q1083 VanDerWaalsContact OG1-CG 3.23Å; T1080-Q1083 WeakPolarHBondContact OG1-CG 3.2Å; T1080-Q1083 PolarHBondContact OG1-N 3.48Å; T1080-V1084 WeakPolarHBondContact O-CG2 3.4Å; T1080-V1084 PolarHBondContact O-N 2.8Å
1081	E	84.6	Confident	72.4	Confident	179 Å²	179	107.3 Å²	107.3	84%	0.836	51%	0.513	S	S	*	.	H	α-helix	trans	-65.8	-42.3	178.1	-169.4	138.8	-139.7	0	0	111.2	V1084 K1085	E1081-V1084 CarbonylContact O-C 3.59Å; E1081-V1084 WeakPolarHBondContact O-CB 3.23Å; E1081-V1084 PolarHBondContact O-N 3.43Å; E1081-V1084 VanDerWaalsContact O-N 3.15Å; E1081-K1085 PolarHBondContact O-N 3.3Å
1082	E	86.3	Confident	75.1	Confident	144 Å²	144	109 Å²	109	67%	0.673	51%	0.505	S	S	*	.	H	α-helix	trans	-56	-49.7	168.5	178	-176.2	-143.1	0	0	113	V1084 K1085 V1086	E1082-V1084 PolarHBondContact O-N 3.43Å; E1082-K1085 WeakPolarHBondContact O-CB 3.2Å; E1082-K1085 PolarHBondContact O-N 3.28Å; E1082-V1086 PolarHBondContact O-N 2.98Å
1083	Q	89.9	Confident	77.4	Confident	31 Å²	31	103.7 Å²	103.7	15%	0.145	49%	0.491	C	S	.	.	H	α-helix	trans	-58.7	-35.9	175.3	-78.8	171.2	-15.4	0	0	111.6	F1079 T1080 L1087 L1109 L1111	F1079-Q1083 VanDerWaalsContact CA-OE1 3.26Å; F1079-Q1083 HydrophobicContact CB-CB 4.24Å; T1080-Q1083 PolarHBondContact O-N 2.75Å; T1080-Q1083 WeakPolarHBondContact OG1-CB 3.41Å; T1080-Q1083 VanDerWaalsContact OG1-CG 3.23Å; T1080-Q1083 WeakPolarHBondContact OG1-CG 3.2Å; T1080-Q1083 PolarHBondContact OG1-N 3.48Å; Q1083-L1087 VanDerWaalsContact O-CB 3.23Å; Q1083-L1087 WeakPolarHBondContact O-CB 3.09Å; Q1083-L1087 VanDerWaalsContact O-CD1 3.29Å; Q1083-L1087 WeakPolarHBondContact O-CD1 3.48Å; Q1083-L1087 WeakPolarHBondContact O-CG 3.35Å; Q1083-L1087 PolarHBondContact O-N 2.95Å; Q1083-L1087 VanDerWaalsContact O-N 3.13Å; Q1083-L1109 HydrophobicContact CB-CD2 4.39Å; Q1083-L1109 HydrophobicContact CG-CB 4.4Å; Q1083-L1109 HydrophobicContact CG-CD2 4.17Å; Q1083-L1109 PolarHBondContact NE2-O 3.25Å; Q1083-L1111 HydrophobicContact CB-CD1 4.4Å; Q1083-L1111 HydrophobicContact CG-CD1 4.19Å
1084	V	91.4	Very high	79.9	Confident	46 Å²	46	96.2 Å²	96.2	28%	0.279	47%	0.468	S	S	.	.	H	α-helix	trans	-75	-29	176.3	168.7	0	0	0	0	112.4	F1079 T1080 E1081 E1082 Q1088	F1079-V1084 HydrophobicContact CB-CG2 3.49Å; F1079-V1084 VanDerWaalsContact CB-CG2 3.49Å; F1079-V1084 HydrophobicContact CG-CG2 4.24Å; T1080-V1084 WeakPolarHBondContact O-CG2 3.4Å; T1080-V1084 PolarHBondContact O-N 2.8Å; E1081-V1084 CarbonylContact O-C 3.59Å; E1081-V1084 WeakPolarHBondContact O-CB 3.23Å; E1081-V1084 PolarHBondContact O-N 3.43Å; E1081-V1084 VanDerWaalsContact O-N 3.15Å; E1082-V1084 PolarHBondContact O-N 3.43Å; V1084-Q1088 WeakPolarHBondContact O-CB 3.16Å; V1084-Q1088 VanDerWaalsContact O-CG 3.32Å; V1084-Q1088 WeakPolarHBondContact O-CG 3.16Å; V1084-Q1088 PolarHBondContact O-N 2.93Å; V1084-Q1088 VanDerWaalsContact O-N 3.12Å; V1084-Q1088 PolarHBondContact O-NE2 3.3Å
1085	K	90.7	Very high	82.3	Confident	124 Å²	124	91.6 Å²	91.6	54%	0.539	43%	0.43	S	S	.	.	H	α-helix	trans	-69.5	-55.8	174.9	-176.2	172.7	-176.5	-72	0	110.5	E1081 E1082 L1087 Q1088 E1089	E1081-K1085 PolarHBondContact O-N 3.3Å; E1082-K1085 WeakPolarHBondContact O-CB 3.2Å; E1082-K1085 PolarHBondContact O-N 3.28Å; K1085-L1087 VanDerWaalsContact C-N 3.33Å; K1085-L1087 PolarHBondContact O-N 3.13Å; K1085-Q1088 CarbonylContact O-C 3.5Å; K1085-Q1088 WeakPolarHBondContact O-CA 3.39Å; K1085-Q1088 WeakPolarHBondContact O-CB 3.44Å; K1085-Q1088 PolarHBondContact O-N 2.89Å; K1085-E1089 WeakPolarHBondContact CE-OE1 3.35Å; K1085-E1089 WeakPolarHBondContact CG-OE1 3.42Å; K1085-E1089 IonicContact NZ-OE1 3.56Å; K1085-E1089 PolarHBondContact NZ-OE1 3.3Å; K1085-E1089 IonicContact NZ-OE2 2.74Å; K1085-E1089 WeakPolarHBondContact O-CG 3.49Å; K1085-E1089 PolarHBondContact O-N 2.86Å
1086	V	90.8	Very high	85	Confident	43 Å²	43	90.2 Å²	90.2	26%	0.261	41%	0.414	S	S	.	.	H	α-helix	trans	-61.6	-39	178.6	176.8	0	0	0	0	111.8	E1082 Q1088 E1089 F1090 L1105 L1109	E1082-V1086 PolarHBondContact O-N 2.98Å; V1086-Q1088 VanDerWaalsContact C-N 3.32Å; V1086-Q1088 PolarHBondContact O-N 3.12Å; V1086-E1089 PolarHBondContact O-N 3.37Å; V1086-F1090 WeakPolarHBondContact O-CB 3.49Å; V1086-F1090 PolarHBondContact O-N 3.14Å; V1086-L1105 HydrophobicContact CG1-CD2 4.26Å; V1086-L1109 HydrophobicContact CB-CD2 3.82Å; V1086-L1109 HydrophobicContact CG1-CD2 3.82Å; V1086-L1109 HydrophobicContact CG2-CD2 4.47Å
1087	L	93.6	Very high	86.8	Confident	0 Å²	0	80.7 Å²	80.7	0%	0	38%	0.381	C	S	.	.	H	α-helix	trans	-65.8	-31.4	173.5	-74.4	169.6	0	0	0	113	F1079 Q1083 K1085 F1091 L1109 L1111 I1116 W1119 F1120	F1079-L1087 HydrophobicContact CD1-CD1 3.89Å; F1079-L1087 HydrophobicContact CE1-CD1 3.99Å; Q1083-L1087 VanDerWaalsContact O-CB 3.23Å; Q1083-L1087 WeakPolarHBondContact O-CB 3.09Å; Q1083-L1087 VanDerWaalsContact O-CD1 3.29Å; Q1083-L1087 WeakPolarHBondContact O-CD1 3.48Å; Q1083-L1087 WeakPolarHBondContact O-CG 3.35Å; Q1083-L1087 PolarHBondContact O-N 2.95Å; Q1083-L1087 VanDerWaalsContact O-N 3.13Å; K1085-L1087 VanDerWaalsContact C-N 3.33Å; K1085-L1087 PolarHBondContact O-N 3.13Å; L1087-F1091 WeakPolarHBondContact O-CB 3.42Å; L1087-F1091 PolarHBondContact O-N 3.47Å; L1087-F1091 VanDerWaalsContact O-N 3.09Å; L1087-L1109 HydrophobicContact CD1-CD1 4.18Å; L1087-L1109 HydrophobicContact CD2-CD1 3.49Å; L1087-L1109 VanDerWaalsContact CD2-CD1 3.49Å; L1087-L1109 HydrophobicContact CG-CD1 3.6Å; L1087-L1111 HydrophobicContact CD1-CD1 4.22Å; L1087-I1116 HydrophobicContact CD2-CG2 3.95Å; L1087-W1119 VanDerWaalsContact C-CH2 3.46Å; L1087-W1119 HydrophobicContact CB-CD2 3.96Å; L1087-W1119 HydrophobicContact CB-CE3 4.01Å; L1087-W1119 HydrophobicContact CB-CH2 3.79Å; L1087-W1119 HydrophobicContact CB-CZ2 3.67Å; L1087-W1119 HydrophobicContact CB-CZ3 3.94Å; L1087-W1119 HydrophobicContact CD1-CB 4.47Å; L1087-W1119 HydrophobicContact CD1-CD2 3.93Å; L1087-W1119 HydrophobicContact CD1-CG 3.84Å; L1087-W1119 HydrophobicContact CD2-CD2 4.43Å; L1087-W1119 HydrophobicContact CD2-CE3 4.28Å; L1087-W1119 HydrophobicContact CG-CD2 4.34Å; L1087-W1119 WeakPolarHBondContact O-CH2 3.41Å; L1087-W1119 VanDerWaalsContact O-CZ3 3.24Å; L1087-W1119 WeakPolarHBondContact O-CZ3 3.11Å; L1087-F1120 HydrophobicContact CD2-CD2 4.43Å; L1087-F1120 HydrophobicContact CD2-CE2 3.7Å
1088	Q	89.4	Confident	87.6	Confident	96 Å²	96	84.4 Å²	84.4	45%	0.449	39%	0.391	S	S	.	.	H	α-helix	trans	-75.1	-45.9	173.7	-82.7	173.9	96.1	0	0	112	V1084 K1085 V1086 F1090 F1091 E1092 W1119	V1084-Q1088 WeakPolarHBondContact O-CB 3.16Å; V1084-Q1088 VanDerWaalsContact O-CG 3.32Å; V1084-Q1088 WeakPolarHBondContact O-CG 3.16Å; V1084-Q1088 PolarHBondContact O-N 2.93Å; V1084-Q1088 VanDerWaalsContact O-N 3.12Å; V1084-Q1088 PolarHBondContact O-NE2 3.3Å; K1085-Q1088 CarbonylContact O-C 3.5Å; K1085-Q1088 WeakPolarHBondContact O-CA 3.39Å; K1085-Q1088 WeakPolarHBondContact O-CB 3.44Å; K1085-Q1088 PolarHBondContact O-N 2.89Å; V1086-Q1088 VanDerWaalsContact C-N 3.32Å; V1086-Q1088 PolarHBondContact O-N 3.12Å; Q1088-F1090 VanDerWaalsContact C-N 3.32Å; Q1088-F1090 PolarHBondContact O-N 3.03Å; Q1088-F1091 CarbonylContact O-C 3.51Å; Q1088-F1091 WeakPolarHBondContact O-CA 3.35Å; Q1088-F1091 WeakPolarHBondContact O-CB 3.19Å; Q1088-F1091 PolarHBondContact O-N 3.26Å; Q1088-E1092 WeakPolarHBondContact O-CG 3.39Å; Q1088-E1092 PolarHBondContact O-N 2.97Å; Q1088-W1119 HydrophobicContact CG-CH2 4.05Å; Q1088-W1119 HydrophobicContact CG-CZ2 4.04Å
1089	E	88.7	Confident	88.1	Confident	82 Å²	82	79.5 Å²	79.5	38%	0.383	38%	0.382	S	S	.	.	H	α-helix	trans	-56.9	-46.8	176.1	-71.1	164	168.9	0	0	110.8	K1085 V1086 F1091 E1092 Q1093	K1085-E1089 WeakPolarHBondContact CE-OE1 3.35Å; K1085-E1089 WeakPolarHBondContact CG-OE1 3.42Å; K1085-E1089 IonicContact NZ-OE1 3.56Å; K1085-E1089 PolarHBondContact NZ-OE1 3.3Å; K1085-E1089 IonicContact NZ-OE2 2.74Å; K1085-E1089 WeakPolarHBondContact O-CG 3.49Å; K1085-E1089 PolarHBondContact O-N 2.86Å; V1086-E1089 PolarHBondContact O-N 3.37Å; E1089-F1091 VanDerWaalsContact C-N 3.32Å; E1089-F1091 PolarHBondContact O-N 3.17Å; E1089-E1092 PolarHBondContact O-N 3.34Å; E1089-Q1093 WeakPolarHBondContact O-CG 3.39Å; E1089-Q1093 PolarHBondContact O-N 3.24Å
1090	F	90.1	Very high	88.2	Confident	24 Å²	24	83.4 Å²	83.4	11%	0.105	40%	0.404	C	S	.	.	H	α-helix	trans	-65.6	-33.8	174.4	-156.6	-76.2	0	0	0	112.6	V1086 Q1088 E1092 Q1093 N1094 P1097 D1101 L1105 F1120	V1086-F1090 WeakPolarHBondContact O-CB 3.49Å; V1086-F1090 PolarHBondContact O-N 3.14Å; Q1088-F1090 VanDerWaalsContact C-N 3.32Å; Q1088-F1090 PolarHBondContact O-N 3.03Å; F1090-E1092 VanDerWaalsContact C-N 3.34Å; F1090-Q1093 PolarHBondContact O-N 3.06Å; F1090-N1094 HydrophobicContact CD1-CB 4.09Å; F1090-N1094 HydrophobicContact CE1-CB 3.53Å; F1090-N1094 HydrophobicContact CZ-CB 4.16Å; F1090-N1094 CarbonylContact O-C 3.02Å; F1090-N1094 VanDerWaalsContact O-C 3.31Å; F1090-N1094 WeakPolarHBondContact O-CA 3.26Å; F1090-N1094 PolarHBondContact O-N 2.82Å; F1090-P1097 HydrophobicContact CE1-CB 3.85Å; F1090-D1101 HydrophobicContact CE1-CB 4.03Å; F1090-D1101 HydrophobicContact CZ-CB 3.62Å; F1090-D1101 WeakPolarHBondContact CZ-OD1 3.38Å; F1090-L1105 HydrophobicContact CB-CD1 4.42Å; F1090-L1105 HydrophobicContact CB-CD2 4.08Å; F1090-L1105 HydrophobicContact CD1-CD1 3.79Å; F1090-L1105 HydrophobicContact CD2-CD1 4.14Å; F1090-L1105 HydrophobicContact CD2-CD2 3.8Å; F1090-L1105 HydrophobicContact CD2-CG 4.13Å; F1090-L1105 HydrophobicContact CE1-CD1 4.09Å; F1090-L1105 HydrophobicContact CE2-CD1 4.41Å; F1090-L1105 HydrophobicContact CE2-CD2 4.49Å; F1090-L1105 HydrophobicContact CE2-CG 4.39Å; F1090-L1105 HydrophobicContact CG-CD1 3.82Å; F1090-L1105 HydrophobicContact CG-CD2 3.93Å; F1090-L1105 HydrophobicContact CG-CG 4.26Å; F1090-L1105 HydrophobicContact CZ-CD1 4.41Å; F1090-F1120 HydrophobicContact CB-CZ 4.27Å; F1090-F1120 HydrophobicContact CD1-CE1 4.2Å; F1090-F1120 AromaticContact CD1-CZ 3.73Å; F1090-F1120 HydrophobicContact CD1-CZ 3.73Å; F1090-F1120 HydrophobicContact CG-CZ 4.38Å
1091	F	92.3	Very high	88.2	Confident	32 Å²	32	81.9 Å²	81.9	14%	0.14	39%	0.394	C	S	.	.	H	α-helix	trans	-68.7	-30.5	175.5	-175.2	-90.8	0	0	0	113.5	L1087 Q1088 E1089 A1095 W1119 F1120 A1123 R1124 A1127 Y1163	L1087-F1091 WeakPolarHBondContact O-CB 3.42Å; L1087-F1091 PolarHBondContact O-N 3.47Å; L1087-F1091 VanDerWaalsContact O-N 3.09Å; Q1088-F1091 CarbonylContact O-C 3.51Å; Q1088-F1091 WeakPolarHBondContact O-CA 3.35Å; Q1088-F1091 WeakPolarHBondContact O-CB 3.19Å; Q1088-F1091 PolarHBondContact O-N 3.26Å; E1089-F1091 VanDerWaalsContact C-N 3.32Å; E1089-F1091 PolarHBondContact O-N 3.17Å; F1091-A1095 HydrophobicContact CD2-CB 4.4Å; F1091-A1095 HydrophobicContact CE2-CB 4.28Å; F1091-A1095 HydrophobicContact CZ-CB 4.48Å; F1091-A1095 PolarHBondContact O-N 3.17Å; F1091-W1119 HydrophobicContact CB-CH2 4.05Å; F1091-W1119 HydrophobicContact CB-CZ3 3.91Å; F1091-W1119 AromaticContact CD2-CZ3 3.92Å; F1091-W1119 HydrophobicContact CD2-CZ3 3.92Å; F1091-W1119 HydrophobicContact CG-CH2 4.39Å; F1091-W1119 HydrophobicContact CG-CZ3 4.17Å; F1091-F1120 HydrophobicContact CB-CE1 4.05Å; F1091-F1120 AromaticContact CD2-CD1 3.72Å; F1091-F1120 HydrophobicContact CD2-CD1 3.72Å; F1091-F1120 AromaticContact CD2-CE1 3.88Å; F1091-F1120 HydrophobicContact CD2-CE1 3.88Å; F1091-F1120 HydrophobicContact CE2-CD1 4.44Å; F1091-F1120 HydrophobicContact CG-CE1 4.45Å; F1091-A1123 HydrophobicContact CD2-CB 3.71Å; F1091-A1123 HydrophobicContact CE2-CB 3.38Å; F1091-A1123 HydrophobicContact CG-CB 4.44Å; F1091-A1123 HydrophobicContact CZ-CB 3.88Å; F1091-R1124 HydrophobicContact CE2-CG 3.71Å; F1091-R1124 HydrophobicContact CZ-CG 4.18Å; F1091-A1127 HydrophobicContact CE1-CB 4.44Å; F1091-A1127 HydrophobicContact CZ-CB 4.23Å; F1091-Y1163 HydrophobicContact CE1-CD1 4.42Å; F1091-Y1163 AromaticContact CE1-CE1 3.91Å; F1091-Y1163 HydrophobicContact CE1-CE1 3.91Å; F1091-Y1163 HydrophobicContact CE2-CE1 4.48Å; F1091-Y1163 HydrophobicContact CZ-CD1 4.37Å; F1091-Y1163 AromaticContact CZ-CE1 3.56Å; F1091-Y1163 HydrophobicContact CZ-CE1 3.56Å
1092	E	87.6	Confident	88.5	Confident	126 Å²	126	73.9 Å²	73.9	59%	0.589	36%	0.357	S	S	*	.	H	α-helix	trans	-81.2	-24.3	175.5	-60.8	-154.5	145.1	0	0	112.8	Q1088 E1089 F1090 K1170	Q1088-E1092 WeakPolarHBondContact O-CG 3.39Å; Q1088-E1092 PolarHBondContact O-N 2.97Å; E1089-E1092 PolarHBondContact O-N 3.34Å; F1090-E1092 VanDerWaalsContact C-N 3.34Å; E1092-K1170 IonicContact OE1-NZ 2.65Å; E1092-K1170 PolarHBondContact OE1-NZ 3.26Å; E1092-K1170 IonicContact OE2-NZ 2.91Å; E1092-K1170 PolarHBondContact OE2-NZ 3.16Å
1093	Q	83.6	Confident	88.6	Confident	128 Å²	128	71.8 Å²	71.8	60%	0.598	35%	0.347	S	S	*	.	H	α-helix	trans	-77	-64.6	167.9	-67.3	169.3	6.4	0	0	111.2	E1089 F1090	E1089-Q1093 WeakPolarHBondContact O-CG 3.39Å; E1089-Q1093 PolarHBondContact O-N 3.24Å; F1090-Q1093 PolarHBondContact O-N 3.06Å
1094	N	84.2	Confident	88.5	Confident	78 Å²	78	74 Å²	74	42%	0.417	36%	0.36	S	S	.	.			trans	-129.7	88.1	-173.2	-78.7	-10.8	0	0	0	110.6	F1090 Y1096 F1120	F1090-N1094 HydrophobicContact CD1-CB 4.09Å; F1090-N1094 HydrophobicContact CE1-CB 3.53Å; F1090-N1094 HydrophobicContact CZ-CB 4.16Å; F1090-N1094 CarbonylContact O-C 3.02Å; F1090-N1094 VanDerWaalsContact O-C 3.31Å; F1090-N1094 WeakPolarHBondContact O-CA 3.26Å; F1090-N1094 PolarHBondContact O-N 2.82Å; N1094-Y1096 PolarHBondContact O-N 2.99Å; N1094-F1120 WeakPolarHBondContact O-CE1 3.34Å
1095	A	87.8	Confident	88.5	Confident	10 Å²	10	72 Å²	72	8%	0.083	35%	0.347	C	S	.	.	S	Bend	trans	-62.9	-10.3	176.5	0	0	0	0	0	114.3	F1091 R1124 Y1163	F1091-A1095 HydrophobicContact CD2-CB 4.4Å; F1091-A1095 HydrophobicContact CE2-CB 4.28Å; F1091-A1095 HydrophobicContact CZ-CB 4.48Å; F1091-A1095 PolarHBondContact O-N 3.17Å; A1095-R1124 WeakPolarHBondContact O-CD 3.18Å; A1095-R1124 PolarHBondContact O-NH1 2.84Å; A1095-Y1163 HydrophobicContact CB-CD1 3.59Å; A1095-Y1163 HydrophobicContact CB-CD2 4.1Å; A1095-Y1163 HydrophobicContact CB-CE1 4.06Å; A1095-Y1163 HydrophobicContact CB-CG 3.64Å
1096	Y	89.9	Confident	88.5	Confident	127 Å²	127	67.3 Å²	67.3	50%	0.498	33%	0.33	S	S	.	.	S	Bend	trans	-130.7	79.4	176.8	-68.5	-108.3	0	0	0	109.6	N1094 Y1163	N1094-Y1096 PolarHBondContact O-N 2.99Å; Y1096-Y1163 HydrophobicContact CD2-CD2 4.48Å; Y1096-Y1163 AromaticContact CE2-CD2 3.64Å; Y1096-Y1163 HydrophobicContact CE2-CD2 3.64Å; Y1096-Y1163 AromaticContact CE2-CE2 3.79Å; Y1096-Y1163 HydrophobicContact CE2-CE2 3.79Å
1097	P	85.6	Confident	88.4	Confident	22 Å²	22	71.8 Å²	71.8	14%	0.143	35%	0.346	C	S	.	.			trans	-60.7	140.8	175.1	24.4	-34.4	0	0	0	111.5	F1090 D1101 L1102 F1120	F1090-P1097 HydrophobicContact CE1-CB 3.85Å; P1097-D1101 WeakPolarHBondContact CA-OD2 3.34Å; P1097-D1101 HydrophobicContact CB-CB 3.49Å; P1097-D1101 VanDerWaalsContact CB-CB 3.49Å; P1097-L1102 HydrophobicContact CB-CG 4.18Å; P1097-L1102 HydrophobicContact CG-CD2 4.16Å; P1097-L1102 HydrophobicContact CG-CG 4.21Å; P1097-F1120 VanDerWaalsContact CD-CD1 3.48Å; P1097-F1120 HydrophobicContact CG-CD1 3.91Å; P1097-F1120 HydrophobicContact CG-CD2 4.15Å; P1097-F1120 HydrophobicContact CG-CE1 3.97Å; P1097-F1120 HydrophobicContact CG-CE2 4.21Å; P1097-F1120 HydrophobicContact CG-CG 4.02Å; P1097-F1120 HydrophobicContact CG-CZ 4.14Å
1098	K	84	Confident	88.2	Confident	150 Å²	150	78.5 Å²	78.5	65%	0.652	38%	0.375	S	S	*	.			trans	-70.9	175.7	164.5	-67.1	-174.1	176.1	-174.2	0	110.9	D1100 D1101 L1102	K1098-D1100 VanDerWaalsContact C-N 3.33Å; K1098-D1101 PolarHBondContact N-OD2 3.31Å; K1098-D1101 WeakPolarHBondContact O-CB 3.34Å; K1098-D1101 PolarHBondContact O-N 3.22Å; K1098-L1102 WeakPolarHBondContact O-CB 3.48Å; K1098-L1102 WeakPolarHBondContact O-CG 3.3Å; K1098-L1102 PolarHBondContact O-N 3.09Å
1099	D	85.7	Confident	88.2	Confident	127 Å²	127	74.4 Å²	74.4	68%	0.679	36%	0.357	S	S	*	.	H	α-helix	trans	-67.4	-32.7	176.1	-68.2	-65.7	0	0	0	112.5	L1102 E1103	D1099-L1102 WeakPolarHBondContact O-CB 3.47Å; D1099-L1102 PolarHBondContact O-N 2.79Å; D1099-E1103 WeakPolarHBondContact O-CG 3.49Å; D1099-E1103 PolarHBondContact O-N 3.1Å
1100	D	87.5	Confident	88.2	Confident	119 Å²	119	77.5 Å²	77.5	64%	0.636	38%	0.376	S	S	*	.	H	α-helix	trans	-63.1	-42.1	170.9	-45.1	-70.3	0	0	0	112.3	K1098 L1102 E1103 L1104	K1098-D1100 VanDerWaalsContact C-N 3.33Å; D1100-L1102 VanDerWaalsContact C-N 3.31Å; D1100-L1102 PolarHBondContact O-N 3.47Å; D1100-E1103 WeakPolarHBondContact O-CB 3.24Å; D1100-E1103 PolarHBondContact O-N 2.68Å; D1100-L1104 VanDerWaalsContact O-CB 3.31Å; D1100-L1104 WeakPolarHBondContact O-CB 3.2Å; D1100-L1104 PolarHBondContact O-N 3.09Å
1101	D	89	Confident	88.1	Confident	32 Å²	32	77.5 Å²	77.5	17%	0.171	38%	0.377	C	S	.	.	H	α-helix	trans	-64	-38.5	174.6	-65.3	-42.7	0	0	0	111	F1090 P1097 K1098 L1104 L1105	F1090-D1101 HydrophobicContact CE1-CB 4.03Å; F1090-D1101 HydrophobicContact CZ-CB 3.62Å; F1090-D1101 WeakPolarHBondContact CZ-OD1 3.38Å; P1097-D1101 WeakPolarHBondContact CA-OD2 3.34Å; P1097-D1101 HydrophobicContact CB-CB 3.49Å; P1097-D1101 VanDerWaalsContact CB-CB 3.49Å; K1098-D1101 PolarHBondContact N-OD2 3.31Å; K1098-D1101 WeakPolarHBondContact O-CB 3.34Å; K1098-D1101 PolarHBondContact O-N 3.22Å; D1101-L1104 PolarHBondContact O-N 3.1Å; D1101-L1105 VanDerWaalsContact O-CB 3.26Å; D1101-L1105 WeakPolarHBondContact O-CB 3.25Å; D1101-L1105 VanDerWaalsContact O-CG 3.22Å; D1101-L1105 WeakPolarHBondContact O-CG 3.25Å; D1101-L1105 PolarHBondContact O-N 3.34Å
1102	L	89.9	Confident	88	Confident	11 Å²	11	79.2 Å²	79.2	6%	0.058	39%	0.393	C	S	.	.	H	α-helix	trans	-68.5	-38.2	177.4	-78.2	164.8	0	0	0	112.1	P1097 K1098 D1099 D1100 S1106 I1116 V1117	P1097-L1102 HydrophobicContact CB-CG 4.18Å; P1097-L1102 HydrophobicContact CG-CD2 4.16Å; P1097-L1102 HydrophobicContact CG-CG 4.21Å; K1098-L1102 WeakPolarHBondContact O-CB 3.48Å; K1098-L1102 WeakPolarHBondContact O-CG 3.3Å; K1098-L1102 PolarHBondContact O-N 3.09Å; D1099-L1102 WeakPolarHBondContact O-CB 3.47Å; D1099-L1102 PolarHBondContact O-N 2.79Å; D1100-L1102 VanDerWaalsContact C-N 3.31Å; D1100-L1102 PolarHBondContact O-N 3.47Å; L1102-S1106 WeakPolarHBondContact O-CB 3.46Å; L1102-S1106 PolarHBondContact O-N 3.03Å; L1102-I1116 HydrophobicContact CD2-CB 4.01Å; L1102-I1116 HydrophobicContact CD2-CG2 3.59Å; L1102-V1117 HydrophobicContact CD1-CG2 3.61Å; L1102-V1117 HydrophobicContact CD2-CG2 3.61Å; L1102-V1117 HydrophobicContact CG-CG2 4.28Å
1103	E	88.4	Confident	88.1	Confident	99 Å²	99	75.6 Å²	75.6	46%	0.463	38%	0.38	S	S	.	.	H	α-helix	trans	-62.6	-49.9	169	-78.1	-105.2	136.8	0	0	111.1	D1099 D1100 L1105 S1106 K1107	D1099-E1103 WeakPolarHBondContact O-CG 3.49Å; D1099-E1103 PolarHBondContact O-N 3.1Å; D1100-E1103 WeakPolarHBondContact O-CB 3.24Å; D1100-E1103 PolarHBondContact O-N 2.68Å; E1103-L1105 PolarHBondContact O-N 2.72Å; E1103-S1106 WeakPolarHBondContact O-CB 3.37Å; E1103-S1106 PolarHBondContact O-N 3.21Å; E1103-S1106 VanDerWaalsContact O-N 3.13Å; E1103-K1107 WeakPolarHBondContact O-CB 3.17Å; E1103-K1107 WeakPolarHBondContact O-CD 3.17Å; E1103-K1107 VanDerWaalsContact O-CG 3.25Å; E1103-K1107 WeakPolarHBondContact O-CG 3.13Å; E1103-K1107 PolarHBondContact O-N 3.36Å; E1103-K1107 WeakPolarHBondContact OE2-CE 3.45Å; E1103-K1107 IonicContact OE2-NZ 2.68Å; E1103-K1107 PolarHBondContact OE2-NZ 3.08Å
1104	L	88.4	Confident	88.4	Confident	78 Å²	78	79 Å²	79	41%	0.408	39%	0.387	S	S	.	.	H	α-helix	trans	-62	-43.3	-179.3	-176.7	61.6	0	0	0	111.8	D1100 D1101 K1108	D1100-L1104 VanDerWaalsContact O-CB 3.31Å; D1100-L1104 WeakPolarHBondContact O-CB 3.2Å; D1100-L1104 PolarHBondContact O-N 3.09Å; D1101-L1104 PolarHBondContact O-N 3.1Å; L1104-K1108 HydrophobicContact CD1-CD 4.28Å; L1104-K1108 HydrophobicContact CG-CD 4.21Å; L1104-K1108 VanDerWaalsContact O-CB 3.3Å; L1104-K1108 WeakPolarHBondContact O-CB 3.31Å; L1104-K1108 VanDerWaalsContact O-CG 3.3Å; L1104-K1108 WeakPolarHBondContact O-CG 3.47Å; L1104-K1108 PolarHBondContact O-N 3.05Å
1105	L	91.3	Very high	88.7	Confident	3 Å²	3	76.9 Å²	76.9	2%	0.016	38%	0.378	C	S	.	.	H	α-helix	trans	-67.6	-37.4	172.6	-72.8	169.3	0	0	0	111.9	V1086 F1090 D1101 E1103 L1109 I1116 F1120	V1086-L1105 HydrophobicContact CG1-CD2 4.26Å; F1090-L1105 HydrophobicContact CB-CD1 4.42Å; F1090-L1105 HydrophobicContact CB-CD2 4.08Å; F1090-L1105 HydrophobicContact CD1-CD1 3.79Å; F1090-L1105 HydrophobicContact CD2-CD1 4.14Å; F1090-L1105 HydrophobicContact CD2-CD2 3.8Å; F1090-L1105 HydrophobicContact CD2-CG 4.13Å; F1090-L1105 HydrophobicContact CE1-CD1 4.09Å; F1090-L1105 HydrophobicContact CE2-CD1 4.41Å; F1090-L1105 HydrophobicContact CE2-CD2 4.49Å; F1090-L1105 HydrophobicContact CE2-CG 4.39Å; F1090-L1105 HydrophobicContact CG-CD1 3.82Å; F1090-L1105 HydrophobicContact CG-CD2 3.93Å; F1090-L1105 HydrophobicContact CG-CG 4.26Å; F1090-L1105 HydrophobicContact CZ-CD1 4.41Å; D1101-L1105 VanDerWaalsContact O-CB 3.26Å; D1101-L1105 WeakPolarHBondContact O-CB 3.25Å; D1101-L1105 VanDerWaalsContact O-CG 3.22Å; D1101-L1105 WeakPolarHBondContact O-CG 3.25Å; D1101-L1105 PolarHBondContact O-N 3.34Å; E1103-L1105 PolarHBondContact O-N 2.72Å; L1105-L1109 HydrophobicContact CB-CD1 4.14Å; L1105-L1109 HydrophobicContact CD2-CD1 4.07Å; L1105-L1109 WeakPolarHBondContact O-CB 3.48Å; L1105-L1109 WeakPolarHBondContact O-CD1 3.34Å; L1105-L1109 WeakPolarHBondContact O-CG 3.29Å; L1105-L1109 PolarHBondContact O-N 3.23Å; L1105-I1116 HydrophobicContact CB-CD1 3.86Å; L1105-I1116 HydrophobicContact CB-CG2 4.35Å; L1105-I1116 HydrophobicContact CD1-CG2 4.09Å; L1105-F1120 HydrophobicContact CD1-CE2 3.88Å; L1105-F1120 HydrophobicContact CD1-CZ 4.07Å
1106	S	90.6	Very high	88.9	Confident	27 Å²	27	76.4 Å²	76.4	19%	0.189	37%	0.374	C	S	.	.	H	α-helix	trans	-61.7	-46.4	176.1	174.6	0	0	0	0	111.4	L1102 E1103 N1110 L1111 P1113 I1116	L1102-S1106 WeakPolarHBondContact O-CB 3.46Å; L1102-S1106 PolarHBondContact O-N 3.03Å; E1103-S1106 WeakPolarHBondContact O-CB 3.37Å; E1103-S1106 PolarHBondContact O-N 3.21Å; E1103-S1106 VanDerWaalsContact O-N 3.13Å; S1106-N1110 WeakPolarHBondContact O-CA 3.26Å; S1106-N1110 PolarHBondContact O-N 3.45Å; S1106-L1111 VanDerWaalsContact CA-O 3.3Å; S1106-L1111 WeakPolarHBondContact CA-O 3.48Å; S1106-L1111 WeakPolarHBondContact CB-O 3.21Å; S1106-L1111 PolarHBondContact O-N 3.04Å; S1106-L1111 PolarHBondContact OG-O 2.99Å; S1106-L1111 VanDerWaalsContact OG-O 3.12Å; S1106-P1113 WeakPolarHBondContact OG-CD 3.39Å; S1106-I1116 VanDerWaalsContact CA-CD1 3.49Å
1107	K	89.2	Confident	89	Confident	137 Å²	137	72.7 Å²	72.7	60%	0.596	36%	0.364	S	S	*	.	H	α-helix	trans	-64.2	-49	176.2	-67.9	162	-170.2	171.3	0	111.3	E1103 L1109	E1103-K1107 WeakPolarHBondContact O-CB 3.17Å; E1103-K1107 WeakPolarHBondContact O-CD 3.17Å; E1103-K1107 VanDerWaalsContact O-CG 3.25Å; E1103-K1107 WeakPolarHBondContact O-CG 3.13Å; E1103-K1107 PolarHBondContact O-N 3.36Å; E1103-K1107 WeakPolarHBondContact OE2-CE 3.45Å; E1103-K1107 IonicContact OE2-NZ 2.68Å; E1103-K1107 PolarHBondContact OE2-NZ 3.08Å; K1107-L1109 PolarHBondContact O-N 3.08Å
1108	K	89	Confident	89.2	Confident	140 Å²	140	74.7 Å²	74.7	61%	0.609	38%	0.376	S	S	*	.	H	α-helix	trans	-65.2	-35.9	178.9	-76.7	178.3	175.7	177.4	0	113.9	L1104	L1104-K1108 HydrophobicContact CD1-CD 4.28Å; L1104-K1108 HydrophobicContact CG-CD 4.21Å; L1104-K1108 VanDerWaalsContact O-CB 3.3Å; L1104-K1108 WeakPolarHBondContact O-CB 3.31Å; L1104-K1108 VanDerWaalsContact O-CG 3.3Å; L1104-K1108 WeakPolarHBondContact O-CG 3.47Å; L1104-K1108 PolarHBondContact O-N 3.05Å
1109	L	88.4	Confident	89.7	Confident	11 Å²	11	69.3 Å²	69.3	6%	0.058	35%	0.351	C	S	.	.	H	α-helix	trans	-99.8	-12.2	-170.8	-59.5	171.4	0	0	0	114.2	Q1083 V1086 L1087 L1105 K1107 L1111 I1116	Q1083-L1109 HydrophobicContact CB-CD2 4.39Å; Q1083-L1109 HydrophobicContact CG-CB 4.4Å; Q1083-L1109 HydrophobicContact CG-CD2 4.17Å; Q1083-L1109 PolarHBondContact NE2-O 3.25Å; V1086-L1109 HydrophobicContact CB-CD2 3.82Å; V1086-L1109 HydrophobicContact CG1-CD2 3.82Å; V1086-L1109 HydrophobicContact CG2-CD2 4.47Å; L1087-L1109 HydrophobicContact CD1-CD1 4.18Å; L1087-L1109 HydrophobicContact CD2-CD1 3.49Å; L1087-L1109 VanDerWaalsContact CD2-CD1 3.49Å; L1087-L1109 HydrophobicContact CG-CD1 3.6Å; L1105-L1109 HydrophobicContact CB-CD1 4.14Å; L1105-L1109 HydrophobicContact CD2-CD1 4.07Å; L1105-L1109 WeakPolarHBondContact O-CB 3.48Å; L1105-L1109 WeakPolarHBondContact O-CD1 3.34Å; L1105-L1109 WeakPolarHBondContact O-CG 3.29Å; L1105-L1109 PolarHBondContact O-N 3.23Å; K1107-L1109 PolarHBondContact O-N 3.08Å; L1109-L1111 VanDerWaalsContact C-N 3.28Å; L1109-L1111 HydrophobicContact CB-CB 4.18Å; L1109-L1111 HydrophobicContact CB-CD1 3.86Å; L1109-L1111 HydrophobicContact CB-CG 3.95Å; L1109-L1111 HydrophobicContact CD1-CD1 4.22Å; L1109-L1111 PolarHBondContact O-N 2.95Å; L1109-I1116 HydrophobicContact CD1-CD1 4.33Å
1110	N	89.6	Confident	90.1	Very high	146 Å²	146	63.4 Å²	63.4	78%	0.781	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.2	45.6	-167.1	-70.3	-76	0	0	0	112.2	S1106	S1106-N1110 WeakPolarHBondContact O-CA 3.26Å; S1106-N1110 PolarHBondContact O-N 3.45Å
1111	L	88.9	Confident	90.1	Very high	24 Å²	24	62.4 Å²	62.4	13%	0.126	31%	0.311	C	S	.	.			trans	-128.7	125.3	179.2	-67.1	174.7	0	0	0	109.6	F1079 Q1083 L1087 S1106 L1109 I1116	F1079-L1111 HydrophobicContact CD1-CD1 3.67Å; F1079-L1111 HydrophobicContact CE1-CD1 3.85Å; Q1083-L1111 HydrophobicContact CB-CD1 4.4Å; Q1083-L1111 HydrophobicContact CG-CD1 4.19Å; L1087-L1111 HydrophobicContact CD1-CD1 4.22Å; S1106-L1111 VanDerWaalsContact CA-O 3.3Å; S1106-L1111 WeakPolarHBondContact CA-O 3.48Å; S1106-L1111 WeakPolarHBondContact CB-O 3.21Å; S1106-L1111 PolarHBondContact O-N 3.04Å; S1106-L1111 PolarHBondContact OG-O 2.99Å; S1106-L1111 VanDerWaalsContact OG-O 3.12Å; L1109-L1111 VanDerWaalsContact C-N 3.28Å; L1109-L1111 HydrophobicContact CB-CB 4.18Å; L1109-L1111 HydrophobicContact CB-CD1 3.86Å; L1109-L1111 HydrophobicContact CB-CG 3.95Å; L1109-L1111 HydrophobicContact CD1-CD1 4.22Å; L1109-L1111 PolarHBondContact O-N 2.95Å; L1111-I1116 HydrophobicContact CB-CD1 4.11Å; L1111-I1116 HydrophobicContact CB-CG1 4Å; L1111-I1116 VanDerWaalsContact O-CD1 3.28Å; L1111-I1116 WeakPolarHBondContact O-CD1 3.47Å
1112	S	89.1	Confident	90.1	Very high	69 Å²	69	65.3 Å²	65.3	48%	0.483	33%	0.327	S	S	.	.			trans	-47.5	138.5	175.3	169.8	0	0	0	0	111.9	R1114 V1115 I1116	S1112-R1114 PolarHBondContact O-N 3.48Å; S1112-V1115 WeakPolarHBondContact O-CA 3.15Å; S1112-V1115 WeakPolarHBondContact O-CB 3.49Å; S1112-V1115 PolarHBondContact O-N 2.95Å; S1112-I1116 PolarHBondContact O-N 2.9Å
1113	P	89.9	Confident	90.1	Very high	49 Å²	49	65.5 Å²	65.5	32%	0.318	33%	0.329	S	S	.	.	H	α-helix	trans	-52.4	-35.6	-179.5	-27.6	34.4	0	0	0	112.5	S1106 V1115 I1116 V1117	S1106-P1113 WeakPolarHBondContact OG-CD 3.39Å; P1113-V1115 VanDerWaalsContact C-N 3.31Å; P1113-V1115 PolarHBondContact O-N 3.13Å; P1113-I1116 CarbonylContact O-C 3.59Å; P1113-I1116 WeakPolarHBondContact O-CB 3.46Å; P1113-I1116 PolarHBondContact O-N 3.03Å; P1113-I1116 VanDerWaalsContact O-N 3.08Å; P1113-V1117 WeakPolarHBondContact O-CG2 3.18Å; P1113-V1117 PolarHBondContact O-N 3.11Å
1114	R	89.3	Confident	90.2	Very high	199 Å²	199	63.3 Å²	63.3	75%	0.751	32%	0.317	S	S	*	.	H	α-helix	trans	-60.5	-35.1	175.2	-173.1	173.3	-171.2	78.4	-4	113.7	S1112 V1118	S1112-R1114 PolarHBondContact O-N 3.48Å; R1114-V1118 WeakPolarHBondContact O-CB 3.31Å; R1114-V1118 WeakPolarHBondContact O-CG2 2.98Å; R1114-V1118 PolarHBondContact O-N 3.44Å; R1114-V1118 VanDerWaalsContact O-N 3.11Å
1115	V	91.2	Very high	89.7	Confident	35 Å²	35	64.4 Å²	64.4	21%	0.212	32%	0.32	C	S	.	.	H	α-helix	trans	-71.6	-36.9	175.3	177.9	0	0	0	0	110.3	T1077 F1079 S1112 P1113 W1119	T1077-V1115 HydrophobicContact CG2-CG1 3.94Å; T1077-V1115 HydrophobicContact CG2-CG2 4.28Å; F1079-V1115 HydrophobicContact CE1-CG1 3.74Å; F1079-V1115 HydrophobicContact CZ-CG1 3.74Å; S1112-V1115 WeakPolarHBondContact O-CA 3.15Å; S1112-V1115 WeakPolarHBondContact O-CB 3.49Å; S1112-V1115 PolarHBondContact O-N 2.95Å; P1113-V1115 VanDerWaalsContact C-N 3.31Å; P1113-V1115 PolarHBondContact O-N 3.13Å; V1115-W1119 WeakPolarHBondContact O-CB 3.48Å; V1115-W1119 PolarHBondContact O-N 2.9Å
1116	I	91.4	Very high	89.3	Confident	0 Å²	0	70.6 Å²	70.6	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-69.1	-51.6	176.9	-61.3	164.8	0	0	0	110.3	L1087 L1102 L1105 S1106 L1109 L1111 S1112 P1113 V1118 W1119 F1120	L1087-I1116 HydrophobicContact CD2-CG2 3.95Å; L1102-I1116 HydrophobicContact CD2-CB 4.01Å; L1102-I1116 HydrophobicContact CD2-CG2 3.59Å; L1105-I1116 HydrophobicContact CB-CD1 3.86Å; L1105-I1116 HydrophobicContact CB-CG2 4.35Å; L1105-I1116 HydrophobicContact CD1-CG2 4.09Å; S1106-I1116 VanDerWaalsContact CA-CD1 3.49Å; L1109-I1116 HydrophobicContact CD1-CD1 4.33Å; L1111-I1116 HydrophobicContact CB-CD1 4.11Å; L1111-I1116 HydrophobicContact CB-CG1 4Å; L1111-I1116 VanDerWaalsContact O-CD1 3.28Å; L1111-I1116 WeakPolarHBondContact O-CD1 3.47Å; S1112-I1116 PolarHBondContact O-N 2.9Å; P1113-I1116 CarbonylContact O-C 3.59Å; P1113-I1116 WeakPolarHBondContact O-CB 3.46Å; P1113-I1116 PolarHBondContact O-N 3.03Å; P1113-I1116 VanDerWaalsContact O-N 3.08Å; I1116-V1118 VanDerWaalsContact C-N 3.25Å; I1116-V1118 PolarHBondContact O-N 3.27Å; I1116-W1119 CarbonylContact O-C 3.6Å; I1116-W1119 WeakPolarHBondContact O-CA 3.33Å; I1116-W1119 WeakPolarHBondContact O-CB 3.37Å; I1116-W1119 PolarHBondContact O-N 3.24Å; I1116-F1120 HydrophobicContact CG2-CD2 3.66Å; I1116-F1120 HydrophobicContact CG2-CE2 3.68Å; I1116-F1120 WeakPolarHBondContact O-CD2 3.35Å; I1116-F1120 PolarHBondContact O-N 3.08Å
1117	V	91.3	Very high	88.7	Confident	48 Å²	48	70.1 Å²	70.1	29%	0.291	34%	0.344	S	S	.	.	H	α-helix	trans	-51.3	-44.9	172.5	172.4	0	0	0	0	111.3	L1102 P1113 F1120 Q1121	L1102-V1117 HydrophobicContact CD1-CG2 3.61Å; L1102-V1117 HydrophobicContact CD2-CG2 3.61Å; L1102-V1117 HydrophobicContact CG-CG2 4.28Å; P1113-V1117 WeakPolarHBondContact O-CG2 3.18Å; P1113-V1117 PolarHBondContact O-N 3.11Å; V1117-F1120 PolarHBondContact O-N 3.36Å; V1117-Q1121 HydrophobicContact CG1-CG 4.42Å; V1117-Q1121 WeakPolarHBondContact O-CB 3.37Å; V1117-Q1121 VanDerWaalsContact O-CG 3.26Å; V1117-Q1121 WeakPolarHBondContact O-CG 3.33Å; V1117-Q1121 PolarHBondContact O-N 2.79Å
1118	V	91.2	Very high	88	Confident	65 Å²	65	69.8 Å²	69.8	39%	0.394	34%	0.339	S	S	.	.	H	α-helix	trans	-68.2	-35.2	176.7	168.4	0	0	0	0	111.9	R1114 I1116 N1122	R1114-V1118 WeakPolarHBondContact O-CB 3.31Å; R1114-V1118 WeakPolarHBondContact O-CG2 2.98Å; R1114-V1118 PolarHBondContact O-N 3.44Å; R1114-V1118 VanDerWaalsContact O-N 3.11Å; I1116-V1118 VanDerWaalsContact C-N 3.25Å; I1116-V1118 PolarHBondContact O-N 3.27Å; V1118-N1122 WeakPolarHBondContact CG1-ND2 3.4Å; V1118-N1122 WeakPolarHBondContact O-CB 3.44Å; V1118-N1122 PolarHBondContact O-N 3.16Å; V1118-N1122 PolarHBondContact O-ND2 3.25Å
1119	W	93.6	Very high	87.2	Confident	37 Å²	37	69 Å²	69	14%	0.14	34%	0.336	C	S	.	.	H	α-helix	trans	-63.4	-50.2	172.2	-173.2	105.1	0	0	0	110.7	F1079 L1087 Q1088 F1091 V1115 I1116 Q1121 N1122 A1123	F1079-W1119 HydrophobicContact CE1-CB 4.31Å; F1079-W1119 AromaticContact CE1-CD1 3.69Å; F1079-W1119 HydrophobicContact CE1-CG 4.3Å; F1079-W1119 AromaticContact CE2-CD1 3.9Å; F1079-W1119 HydrophobicContact CZ-CB 4.15Å; F1079-W1119 AromaticContact CZ-CD1 3.57Å; F1079-W1119 HydrophobicContact CZ-CG 4.24Å; L1087-W1119 VanDerWaalsContact C-CH2 3.46Å; L1087-W1119 HydrophobicContact CB-CD2 3.96Å; L1087-W1119 HydrophobicContact CB-CE3 4.01Å; L1087-W1119 HydrophobicContact CB-CH2 3.79Å; L1087-W1119 HydrophobicContact CB-CZ2 3.67Å; L1087-W1119 HydrophobicContact CB-CZ3 3.94Å; L1087-W1119 HydrophobicContact CD1-CB 4.47Å; L1087-W1119 HydrophobicContact CD1-CD2 3.93Å; L1087-W1119 HydrophobicContact CD1-CG 3.84Å; L1087-W1119 HydrophobicContact CD2-CD2 4.43Å; L1087-W1119 HydrophobicContact CD2-CE3 4.28Å; L1087-W1119 HydrophobicContact CG-CD2 4.34Å; L1087-W1119 WeakPolarHBondContact O-CH2 3.41Å; L1087-W1119 VanDerWaalsContact O-CZ3 3.24Å; L1087-W1119 WeakPolarHBondContact O-CZ3 3.11Å; Q1088-W1119 HydrophobicContact CG-CH2 4.05Å; Q1088-W1119 HydrophobicContact CG-CZ2 4.04Å; F1091-W1119 HydrophobicContact CB-CH2 4.05Å; F1091-W1119 HydrophobicContact CB-CZ3 3.91Å; F1091-W1119 AromaticContact CD2-CZ3 3.92Å; F1091-W1119 HydrophobicContact CD2-CZ3 3.92Å; F1091-W1119 HydrophobicContact CG-CH2 4.39Å; F1091-W1119 HydrophobicContact CG-CZ3 4.17Å; V1115-W1119 WeakPolarHBondContact O-CB 3.48Å; V1115-W1119 PolarHBondContact O-N 2.9Å; I1116-W1119 CarbonylContact O-C 3.6Å; I1116-W1119 WeakPolarHBondContact O-CA 3.33Å; I1116-W1119 WeakPolarHBondContact O-CB 3.37Å; I1116-W1119 PolarHBondContact O-N 3.24Å; W1119-Q1121 PolarHBondContact O-N 3.16Å; W1119-N1122 CarbonylContact O-C 3.57Å; W1119-N1122 PolarHBondContact O-N 2.91Å; W1119-N1122 VanDerWaalsContact O-N 3.11Å; W1119-A1123 HydrophobicContact CE3-CB 3.97Å; W1119-A1123 HydrophobicContact CH2-CB 3.96Å; W1119-A1123 HydrophobicContact CZ3-CB 3.66Å; W1119-A1123 WeakPolarHBondContact O-CB 3.25Å; W1119-A1123 PolarHBondContact O-N 3.05Å
1120	F	95.1	Very high	86.5	Confident	2 Å²	2	72.7 Å²	72.7	1%	0.009	36%	0.355	C	S	.	.	H	α-helix	trans	-61.2	-41.8	178	-86.4	-95.6	0	0	0	112	L1087 F1090 F1091 N1094 P1097 L1105 I1116 V1117 N1122 A1123 R1124	L1087-F1120 HydrophobicContact CD2-CD2 4.43Å; L1087-F1120 HydrophobicContact CD2-CE2 3.7Å; F1090-F1120 HydrophobicContact CB-CZ 4.27Å; F1090-F1120 HydrophobicContact CD1-CE1 4.2Å; F1090-F1120 AromaticContact CD1-CZ 3.73Å; F1090-F1120 HydrophobicContact CD1-CZ 3.73Å; F1090-F1120 HydrophobicContact CG-CZ 4.38Å; F1091-F1120 HydrophobicContact CB-CE1 4.05Å; F1091-F1120 AromaticContact CD2-CD1 3.72Å; F1091-F1120 HydrophobicContact CD2-CD1 3.72Å; F1091-F1120 AromaticContact CD2-CE1 3.88Å; F1091-F1120 HydrophobicContact CD2-CE1 3.88Å; F1091-F1120 HydrophobicContact CE2-CD1 4.44Å; F1091-F1120 HydrophobicContact CG-CE1 4.45Å; N1094-F1120 WeakPolarHBondContact O-CE1 3.34Å; P1097-F1120 VanDerWaalsContact CD-CD1 3.48Å; P1097-F1120 HydrophobicContact CG-CD1 3.91Å; P1097-F1120 HydrophobicContact CG-CD2 4.15Å; P1097-F1120 HydrophobicContact CG-CE1 3.97Å; P1097-F1120 HydrophobicContact CG-CE2 4.21Å; P1097-F1120 HydrophobicContact CG-CG 4.02Å; P1097-F1120 HydrophobicContact CG-CZ 4.14Å; L1105-F1120 HydrophobicContact CD1-CE2 3.88Å; L1105-F1120 HydrophobicContact CD1-CZ 4.07Å; I1116-F1120 HydrophobicContact CG2-CD2 3.66Å; I1116-F1120 HydrophobicContact CG2-CE2 3.68Å; I1116-F1120 WeakPolarHBondContact O-CD2 3.35Å; I1116-F1120 PolarHBondContact O-N 3.08Å; V1117-F1120 PolarHBondContact O-N 3.36Å; F1120-N1122 PolarHBondContact O-N 3.41Å; F1120-A1123 PolarHBondContact O-N 3.05Å; F1120-R1124 WeakPolarHBondContact O-CB 3.49Å; F1120-R1124 WeakPolarHBondContact O-CG 3.28Å; F1120-R1124 PolarHBondContact O-N 3.44Å
1121	Q	86.4	Confident	85.3	Confident	98 Å²	98	68.8 Å²	68.8	46%	0.458	33%	0.33	S	S	.	.	H	α-helix	trans	-61	-42	173.4	-74.5	175.3	9.4	0	0	112.4	V1117 W1119 Q1125	V1117-Q1121 HydrophobicContact CG1-CG 4.42Å; V1117-Q1121 WeakPolarHBondContact O-CB 3.37Å; V1117-Q1121 VanDerWaalsContact O-CG 3.26Å; V1117-Q1121 WeakPolarHBondContact O-CG 3.33Å; V1117-Q1121 PolarHBondContact O-N 2.79Å; W1119-Q1121 PolarHBondContact O-N 3.16Å; Q1121-Q1125 WeakPolarHBondContact O-CG 3.45Å; Q1121-Q1125 PolarHBondContact O-N 2.79Å
1122	N	90.2	Very high	84.2	Confident	94 Å²	94	74.5 Å²	74.5	50%	0.503	36%	0.356	S	S	.	.	H	α-helix	trans	-69.6	-37.8	176.2	-79.7	-70.1	0	0	0	112.1	V1118 W1119 F1120 Q1125 K1126	V1118-N1122 WeakPolarHBondContact CG1-ND2 3.4Å; V1118-N1122 WeakPolarHBondContact O-CB 3.44Å; V1118-N1122 PolarHBondContact O-N 3.16Å; V1118-N1122 PolarHBondContact O-ND2 3.25Å; W1119-N1122 CarbonylContact O-C 3.57Å; W1119-N1122 PolarHBondContact O-N 2.91Å; W1119-N1122 VanDerWaalsContact O-N 3.11Å; F1120-N1122 PolarHBondContact O-N 3.41Å; N1122-Q1125 PolarHBondContact O-N 2.8Å; N1122-K1126 WeakPolarHBondContact O-CB 3.33Å; N1122-K1126 PolarHBondContact O-N 3.36Å
1123	A	89.4	Confident	82.4	Confident	14 Å²	14	76.9 Å²	76.9	12%	0.116	36%	0.363	C	S	.	.	H	α-helix	trans	-64.5	-45.8	174	0	0	0	0	0	110.9	F1091 W1119 F1120 Q1125 K1126 A1127	F1091-A1123 HydrophobicContact CD2-CB 3.71Å; F1091-A1123 HydrophobicContact CE2-CB 3.38Å; F1091-A1123 HydrophobicContact CG-CB 4.44Å; F1091-A1123 HydrophobicContact CZ-CB 3.88Å; W1119-A1123 HydrophobicContact CE3-CB 3.97Å; W1119-A1123 HydrophobicContact CH2-CB 3.96Å; W1119-A1123 HydrophobicContact CZ3-CB 3.66Å; W1119-A1123 WeakPolarHBondContact O-CB 3.25Å; W1119-A1123 PolarHBondContact O-N 3.05Å; F1120-A1123 PolarHBondContact O-N 3.05Å; A1123-Q1125 VanDerWaalsContact C-N 3.28Å; A1123-Q1125 PolarHBondContact O-N 2.83Å; A1123-K1126 WeakPolarHBondContact O-CB 3.3Å; A1123-K1126 PolarHBondContact O-N 2.92Å; A1123-A1127 WeakPolarHBondContact O-CB 3.49Å; A1123-A1127 PolarHBondContact O-N 3.08Å
1124	R	90.5	Very high	80.5	Confident	54 Å²	54	78.2 Å²	78.2	20%	0.204	37%	0.365	C	S	.	.	H	α-helix	trans	-63.6	-27.9	174.4	-69.3	-158	-66.8	-102.8	13.4	113.6	F1091 A1095 F1120 R1128 Y1163	F1091-R1124 HydrophobicContact CE2-CG 3.71Å; F1091-R1124 HydrophobicContact CZ-CG 4.18Å; A1095-R1124 WeakPolarHBondContact O-CD 3.18Å; A1095-R1124 PolarHBondContact O-NH1 2.84Å; F1120-R1124 WeakPolarHBondContact O-CB 3.49Å; F1120-R1124 WeakPolarHBondContact O-CG 3.28Å; F1120-R1124 PolarHBondContact O-N 3.44Å; R1124-R1128 PolarHBondContact O-NE 3.46Å; R1124-Y1163 WeakPolarHBondContact CA-OH 3.4Å; R1124-Y1163 WeakPolarHBondContact CB-OH 3.46Å; R1124-Y1163 HydrophobicContact CG-CE2 4.31Å; R1124-Y1163 PolarHBondContact O-OH 2.98Å
1125	Q	77.1	Confident	78.3	Confident	101 Å²	101	72.2 Å²	72.2	47%	0.472	35%	0.352	S	S	.	.	H	α-helix	trans	-78.8	-34.5	169.5	-74.6	-169.4	18.7	0	0	113.1	Q1121 N1122 A1123 K1129	Q1121-Q1125 WeakPolarHBondContact O-CG 3.45Å; Q1121-Q1125 PolarHBondContact O-N 2.79Å; N1122-Q1125 PolarHBondContact O-N 2.8Å; A1123-Q1125 VanDerWaalsContact C-N 3.28Å; A1123-Q1125 PolarHBondContact O-N 2.83Å; Q1125-K1129 WeakPolarHBondContact O-CB 3.27Å; Q1125-K1129 WeakPolarHBondContact O-CG 3.35Å; Q1125-K1129 PolarHBondContact O-N 2.91Å; Q1125-K1129 VanDerWaalsContact O-N 3.14Å
1126	K	83.1	Confident	76	Confident	132 Å²	132	75 Å²	75	57%	0.574	37%	0.371	S	S	*	.	H	α-helix	trans	-67.4	-46	176.5	-174.2	-164	172.9	-155.8	0	110.9	N1122 A1123 K1129 I1130	N1122-K1126 WeakPolarHBondContact O-CB 3.33Å; N1122-K1126 PolarHBondContact O-N 3.36Å; A1123-K1126 WeakPolarHBondContact O-CB 3.3Å; A1123-K1126 PolarHBondContact O-N 2.92Å; K1126-K1129 PolarHBondContact O-N 2.91Å; K1126-I1130 HydrophobicContact CD-CD1 4.35Å; K1126-I1130 HydrophobicContact CG-CD1 3.87Å; K1126-I1130 WeakPolarHBondContact O-CG1 3.33Å; K1126-I1130 PolarHBondContact O-N 3.45Å
1127	A	78.9	Confident	73.7	Confident	17 Å²	17	80.4 Å²	80.4	14%	0.14	40%	0.399	C	S	.	.	H	α-helix	trans	-58.9	-53.9	178.2	0	0	0	0	0	111.6	F1091 A1123 K1129 I1130 Y1131 Y1163	F1091-A1127 HydrophobicContact CE1-CB 4.44Å; F1091-A1127 HydrophobicContact CZ-CB 4.23Å; A1123-A1127 WeakPolarHBondContact O-CB 3.49Å; A1123-A1127 PolarHBondContact O-N 3.08Å; A1127-K1129 VanDerWaalsContact C-N 3.33Å; A1127-K1129 PolarHBondContact O-N 3.28Å; A1127-I1130 PolarHBondContact O-N 3.05Å; A1127-I1130 VanDerWaalsContact O-N 3.14Å; A1127-Y1131 PolarHBondContact O-N 2.79Å; A1127-Y1163 HydrophobicContact CB-CE1 3.97Å
1128	R	74.5	Confident	71.3	Confident	130 Å²	130	80.6 Å²	80.6	49%	0.491	40%	0.403	S	S	.	.	H	α-helix	trans	-53.7	-47	174.7	-75.5	-168.5	-71.5	173.9	-4.1	112.3	R1124 I1130 Y1131 E1132 Y1162	R1124-R1128 PolarHBondContact O-NE 3.46Å; R1128-I1130 PolarHBondContact O-N 2.77Å; R1128-Y1131 PolarHBondContact O-N 2.84Å; R1128-E1132 WeakPolarHBondContact O-CB 3.23Å; R1128-E1132 PolarHBondContact O-N 2.85Å; R1128-Y1162 HydrophobicContact CG-CD1 4.1Å; R1128-Y1162 HydrophobicContact CG-CE1 4.4Å
1129	K	72.9	Confident	69	Low	123 Å²	123	84.2 Å²	84.2	54%	0.535	42%	0.416	S	S	.	.	H	α-helix	trans	-66.8	-31.9	178.9	-80.3	179.7	174.8	171.4	0	114.6	Q1125 K1126 A1127 N1133	Q1125-K1129 WeakPolarHBondContact O-CB 3.27Å; Q1125-K1129 WeakPolarHBondContact O-CG 3.35Å; Q1125-K1129 PolarHBondContact O-N 2.91Å; Q1125-K1129 VanDerWaalsContact O-N 3.14Å; K1126-K1129 PolarHBondContact O-N 2.91Å; A1127-K1129 VanDerWaalsContact C-N 3.33Å; A1127-K1129 PolarHBondContact O-N 3.28Å; K1129-N1133 WeakPolarHBondContact O-CB 3.38Å; K1129-N1133 PolarHBondContact O-N 2.7Å; K1129-N1133 PolarHBondContact O-ND2 3.43Å
1130	I	73.5	Confident	67	Low	89 Å²	89	87 Å²	87	46%	0.456	43%	0.433	S	S	.	.	H	α-helix	trans	-67.2	-39.5	178.5	-77.6	170.7	0	0	0	110.8	K1126 A1127 R1128 Q1134	K1126-I1130 HydrophobicContact CD-CD1 4.35Å; K1126-I1130 HydrophobicContact CG-CD1 3.87Å; K1126-I1130 WeakPolarHBondContact O-CG1 3.33Å; K1126-I1130 PolarHBondContact O-N 3.45Å; A1127-I1130 PolarHBondContact O-N 3.05Å; A1127-I1130 VanDerWaalsContact O-N 3.14Å; R1128-I1130 PolarHBondContact O-N 2.77Å; I1130-Q1134 WeakPolarHBondContact O-CG 3.45Å
1131	Y	63.5	Low	65.4	Low	65 Å²	65	91.2 Å²	91.2	26%	0.255	45%	0.449	S	S	.	.	H	α-helix	trans	-79.5	-43.7	175.5	-84.7	-91.6	0	0	0	113.1	A1127 R1128 N1133 Q1134 Y1162 I1166	A1127-Y1131 PolarHBondContact O-N 2.79Å; R1128-Y1131 PolarHBondContact O-N 2.84Å; Y1131-N1133 PolarHBondContact O-N 2.82Å; Y1131-Q1134 PolarHBondContact O-N 3.33Å; Y1131-Y1162 WeakPolarHBondContact CB-OH 3.45Å; Y1131-Y1162 WeakPolarHBondContact CD1-OH 3.5Å; Y1131-Y1162 HydrophobicContact CD2-CE1 4.45Å; Y1131-Y1162 WeakPolarHBondContact CD2-OH 3.35Å; Y1131-I1166 HydrophobicContact CD2-CD1 3.96Å; Y1131-I1166 HydrophobicContact CE2-CD1 3.55Å; Y1131-I1166 HydrophobicContact CE2-CG1 3.81Å
1132	E	65.9	Low	64.6	Low	144 Å²	144	89.8 Å²	89.8	67%	0.673	44%	0.442	S	S	*	.	H	α-helix	trans	-63	-12.6	179.1	-170.4	-175.7	-163.2	0	0	113.6	R1128	R1128-E1132 WeakPolarHBondContact O-CB 3.23Å; R1128-E1132 PolarHBondContact O-N 2.85Å
1133	N	52.5	Low	63.5	Low	118 Å²	118	86.7 Å²	86.7	63%	0.631	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124.1	25.9	179.4	-59.1	-104.9	0	0	0	112.7	K1129 Y1131	K1129-N1133 WeakPolarHBondContact O-CB 3.38Å; K1129-N1133 PolarHBondContact O-N 2.7Å; K1129-N1133 PolarHBondContact O-ND2 3.43Å; Y1131-N1133 PolarHBondContact O-N 2.82Å
1134	Q	49.1	Very low	62.4	Low	77 Å²	77	91.1 Å²	91.1	36%	0.36	44%	0.441	S	S	.	.	S	Bend	trans	-72.1	149	159.7	-63.2	-167	9.4	0	0	109.4	I1130 Y1131	I1130-Q1134 WeakPolarHBondContact O-CG 3.45Å; Y1131-Q1134 PolarHBondContact O-N 3.33Å
1135	P	42.7	Very low	61.1	Low	74 Å²	74	90.1 Å²	90.1	48%	0.481	44%	0.441	S	S	.	.			trans	-65.1	158.1	173.6	29.2	-35.2	0	0	0	111.3	D1137	P1135-D1137 PolarHBondContact O-N 2.9Å; P1135-D1137 VanDerWaalsContact O-N 3.12Å
1136	P	43.1	Very low	60	Low	93 Å²	93	91.9 Å²	91.9	60%	0.604	46%	0.461	S	S	*	.	S	Bend	trans	-71.5	-3.2	-169.3	29.8	-36.7	0	0	0	115.3	S1138 E1139	P1136-S1138 PolarHBondContact O-N 2.87Å; P1136-E1139 WeakPolarHBondContact O-CG 3.5Å
1137	D	42.8	Very low	58.7	Low	113 Å²	113	88.1 Å²	88.1	60%	0.604	46%	0.46	S	S	*	.	S	Bend	trans	-72.7	35.6	-173.5	-43.1	-62.3	0	0	0	114.1	P1135 N1605	P1135-D1137 PolarHBondContact O-N 2.9Å; P1135-D1137 VanDerWaalsContact O-N 3.12Å; D1137-N1605 PolarHBondContact OD2-ND2 3.19Å
1138	S	42.1	Very low	57.7	Low	53 Å²	53	92.9 Å²	92.9	37%	0.371	48%	0.483	S	S	.	.			trans	-167.2	58.2	176.3	52.5	0	0	0	0	111.9	P1136 D1140 R1141	P1136-S1138 PolarHBondContact O-N 2.87Å; S1138-D1140 PolarHBondContact O-N 2.88Å; S1138-D1140 VanDerWaalsContact O-N 3.13Å; S1138-R1141 PolarHBondContact OG-NH2 2.76Å
1139	E	41.2	Very low	57.7	Low	140 Å²	140	88.8 Å²	88.8	65%	0.654	47%	0.47	S	S	*	.			trans	-64	-14.4	-176.5	-59.1	-148.8	100.1	0	0	114.5	P1136 K1153	P1136-E1139 WeakPolarHBondContact O-CG 3.5Å; E1139-K1153 PolarHBondContact O-NZ 3.25Å
1140	D	52.7	Low	57.9	Low	96 Å²	96	84.6 Å²	84.6	51%	0.513	45%	0.451	S	S	.	.			trans	-105.9	60.4	-173	-61.6	-51.9	0	0	0	114.4	S1138 K1153	S1138-D1140 PolarHBondContact O-N 2.88Å; S1138-D1140 VanDerWaalsContact O-N 3.13Å; D1140-K1153 HydrophobicContact CB-CD 4.24Å; D1140-K1153 WeakPolarHBondContact OD1-CD 3.19Å; D1140-K1153 IonicContact OD1-NZ 3.43Å; D1140-K1153 PolarHBondContact OD1-NZ 3.22Å
1141	R	61	Low	58.1	Low	91 Å²	91	82 Å²	82	34%	0.343	44%	0.438	S	S	.	.	S	Bend	trans	-126.7	-33.2	168.9	-75	-176	-70.6	166.6	0.6	115.5	S1138 K1153 H1169	S1138-R1141 PolarHBondContact OG-NH2 2.76Å; R1141-K1153 PolarHBondContact O-N 3.33Å; R1141-H1169 PolarHBondContact O-CE1 3.1Å; R1141-H1169 VanDerWaalsContact O-CE1 3.27Å; R1141-H1169 PolarHBondContact O-NE2 2.66Å
1142	F	68.9	Low	59.1	Low	67 Å²	67	79 Å²	79	29%	0.294	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.9	146.9	169	68.6	-84	0	0	0	114.6	Y1150 E1151 Y1162 L1165	F1142-Y1150 HydrophobicContact CD2-CD1 4.21Å; F1142-Y1150 HydrophobicContact CE2-CD1 4.08Å; F1142-E1151 CarbonylContact C-O 3.59Å; F1142-E1151 WeakPolarHBondContact CA-O 3.28Å; F1142-E1151 WeakPolarHBondContact CB-O 3.17Å; F1142-Y1162 HydrophobicContact CE1-CE2 4.38Å; F1142-Y1162 HydrophobicContact CE2-CE2 4.2Å; F1142-Y1162 AromaticContact CZ-CE2 3.98Å; F1142-Y1162 HydrophobicContact CZ-CE2 3.98Å; F1142-L1165 HydrophobicContact CB-CD1 4.05Å; F1142-L1165 HydrophobicContact CB-CD2 3.53Å; F1142-L1165 HydrophobicContact CB-CG 4.41Å; F1142-L1165 HydrophobicContact CD1-CD2 3.86Å; F1142-L1165 HydrophobicContact CD2-CD2 3.89Å; F1142-L1165 HydrophobicContact CG-CD2 3.49Å; F1142-L1165 VanDerWaalsContact CG-CD2 3.49Å
1143	S	68	Low	59.4	Low	30 Å²	30	75.6 Å²	75.6	21%	0.21	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	171	170.2	19.1	0	0	0	0	110.8	E1151	S1143-E1151 WeakPolarHBondContact CB-OE2 3.28Å; S1143-E1151 PolarHBondContact N-O 3.43Å; S1143-E1151 PolarHBondContact O-N 2.94Å; S1143-E1151 PolarHBondContact OG-OE1 2.92Å; S1143-E1151 PolarHBondContact OG-OE2 3.44Å
1144	R	66.5	Low	60.5	Low	107 Å²	107	73.1 Å²	73.1	40%	0.404	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	114.8	168.9	-75.1	178.6	172.7	-82.4	0.2	108.9	N1149 Y1150	R1144-N1149 WeakPolarHBondContact CA-O 3.17Å; R1144-Y1150 VanDerWaalsContact CZ-CE1 3.45Å; R1144-Y1150 PolarHBondContact NH1-OH 3.35Å; R1144-Y1150 VanDerWaalsContact NH2-CE1 3.31Å; R1144-Y1150 PolarHBondContact NH2-OH 2.68Å
1145	T	63.1	Low	62.1	Low	33 Å²	33	71.8 Å²	71.8	20%	0.202	40%	0.399	C	S	.	.			trans	-61.1	151.4	167.6	59.4	0	0	0	0	110.5	G1147 L1148 N1149 V1158	T1145-G1147 PolarHBondContact O-N 3.11Å; T1145-G1147 VanDerWaalsContact O-N 3.08Å; T1145-L1148 PolarHBondContact O-N 3.07Å; T1145-N1149 PolarHBondContact N-O 3.46Å; T1145-N1149 WeakPolarHBondContact OG1-CB 3.15Å; T1145-N1149 PolarHBondContact OG1-N 2.8Å; T1145-N1149 PolarHBondContact OG1-O 3.21Å; T1145-V1158 HydrophobicContact CG2-CG1 3.87Å; T1145-V1158 HydrophobicContact CG2-CG2 3.81Å
1146	P	53.5	Low	63.7	Low	138 Å²	138	74.1 Å²	74.1	90%	0.896	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.2	-31.2	177.8	-29.6	36.4	0	0	0	114.3	L1148	P1146-L1148 PolarHBondContact O-N 3.38Å
1147	G	55.7	Low	65.5	Low	53 Å²	53	74.1 Å²	74.1	55%	0.546	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	21	174	0	0	0	0	0	116	T1145 N1149	T1145-G1147 PolarHBondContact O-N 3.11Å; T1145-G1147 VanDerWaalsContact O-N 3.08Å; G1147-N1149 PolarHBondContact O-N 3.42Å; G1147-N1149 VanDerWaalsContact O-N 3.09Å; G1147-N1149 PolarHBondContact O-ND2 3.33Å
1148	L	59.2	Low	67.4	Low	117 Å²	117	72.2 Å²	72.2	61%	0.613	39%	0.39	S	S	*	.	S	Bend	trans	65.2	-0.9	-179.2	-58.2	174.7	0	0	0	116.9	T1145 P1146	T1145-L1148 PolarHBondContact O-N 3.07Å; P1146-L1148 PolarHBondContact O-N 3.38Å
1149	N	74.9	Confident	69.2	Low	43 Å²	43	71.1 Å²	71.1	23%	0.23	38%	0.379	C	S	.	.			trans	-75.6	164.8	176.1	-48.3	-53.4	0	0	0	112	R1144 T1145 G1147 V1158 L1160	R1144-N1149 WeakPolarHBondContact CA-O 3.17Å; T1145-N1149 PolarHBondContact N-O 3.46Å; T1145-N1149 WeakPolarHBondContact OG1-CB 3.15Å; T1145-N1149 PolarHBondContact OG1-N 2.8Å; T1145-N1149 PolarHBondContact OG1-O 3.21Å; G1147-N1149 PolarHBondContact O-N 3.42Å; G1147-N1149 VanDerWaalsContact O-N 3.09Å; G1147-N1149 PolarHBondContact O-ND2 3.33Å; N1149-V1158 HydrophobicContact CB-CG1 3.53Å; N1149-L1160 WeakPolarHBondContact OD1-CD1 3.4Å; N1149-L1160 WeakPolarHBondContact OD1-CG 3.01Å
1150	Y	76.1	Confident	70.8	Confident	36 Å²	36	70.1 Å²	70.1	14%	0.141	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	124.2	-169	-58.3	-99.3	0	0	0	111.7	F1142 R1144 F1159 Y1162	F1142-Y1150 HydrophobicContact CD2-CD1 4.21Å; F1142-Y1150 HydrophobicContact CE2-CD1 4.08Å; R1144-Y1150 VanDerWaalsContact CZ-CE1 3.45Å; R1144-Y1150 PolarHBondContact NH1-OH 3.35Å; R1144-Y1150 VanDerWaalsContact NH2-CE1 3.31Å; R1144-Y1150 PolarHBondContact NH2-OH 2.68Å; Y1150-F1159 PolarHBondContact N-O 3.48Å; Y1150-F1159 WeakPolarHBondContact O-CA 3.45Å; Y1150-F1159 WeakPolarHBondContact O-CB 3.47Å; Y1150-F1159 WeakPolarHBondContact O-CD2 3.44Å; Y1150-F1159 PolarHBondContact O-N 2.7Å; Y1150-Y1162 AromaticContact CD1-CD2 3.4Å; Y1150-Y1162 HydrophobicContact CD1-CD2 3.4Å; Y1150-Y1162 HydrophobicContact CD1-CE2 4.02Å; Y1150-Y1162 HydrophobicContact CD1-CG 4.39Å; Y1150-Y1162 HydrophobicContact CD2-CD2 4.43Å; Y1150-Y1162 AromaticContact CE1-CD2 3.42Å; Y1150-Y1162 HydrophobicContact CE1-CD2 3.42Å; Y1150-Y1162 VanDerWaalsContact CE1-CD2 3.42Å; Y1150-Y1162 HydrophobicContact CE1-CE2 4.13Å; Y1150-Y1162 HydrophobicContact CE1-CG 4.1Å; Y1150-Y1162 AromaticContact CG-CD2 3.93Å; Y1150-Y1162 HydrophobicContact CG-CD2 3.93Å
1151	E	78.3	Confident	71.8	Confident	35 Å²	35	72.2 Å²	72.2	16%	0.164	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	128.5	-169.9	-179.6	-159.7	156.4	0	0	111.2	F1142 S1143 K1153 H1156 L1157 V1158	F1142-E1151 CarbonylContact C-O 3.59Å; F1142-E1151 WeakPolarHBondContact CA-O 3.28Å; F1142-E1151 WeakPolarHBondContact CB-O 3.17Å; S1143-E1151 WeakPolarHBondContact CB-OE2 3.28Å; S1143-E1151 PolarHBondContact N-O 3.43Å; S1143-E1151 PolarHBondContact O-N 2.94Å; S1143-E1151 PolarHBondContact OG-OE1 2.92Å; S1143-E1151 PolarHBondContact OG-OE2 3.44Å; E1151-K1153 PolarHBondContact O-N 3.14Å; E1151-H1156 IonicContact OE1-CE1 2.76Å; E1151-H1156 IonicContact OE1-CG 3.2Å; E1151-H1156 IonicContact OE1-ND1 3.38Å; E1151-H1156 PolarHBondContact OE1-ND1 2.65Å; E1151-L1157 CarbonylContact C-O 3.56Å; E1151-L1157 VanDerWaalsContact CA-O 3.3Å; E1151-L1157 WeakPolarHBondContact CA-O 3.46Å; E1151-V1158 HydrophobicContact CB-CG2 4.24Å; E1151-V1158 HydrophobicContact CG-CG2 4.1Å
1152	C	84	Confident	72.3	Confident	0 Å²	0	68.7 Å²	68.7	0%	0	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	115.2	173.5	-178.7	0	0	0	0	109.1	S1154 C1155 H1156 L1157 F1159 L1165 H1169 C1173	C1152-S1154 PolarHBondContact O-N 3.1Å; C1152-S1154 PolarHBondContact SG-N 3.14Å; C1152-C1155 PolarHBondContact O-N 3.11Å; C1152-C1155 VanDerWaalsContact O-N 3.12Å; C1152-H1156 WeakPolarHBondContact O-CA 3.02Å; C1152-H1156 PolarHBondContact O-N 2.74Å; C1152-L1157 PolarHBondContact N-O 2.99Å; C1152-F1159 HydrophobicContact CB-CE2 4.17Å; C1152-L1165 HydrophobicContact CB-CD1 3.82Å; C1152-H1169 PolarHBondContact SG-CD2 2.83Å; C1152-H1169 PolarHBondContact SG-NE2 3.33Å; C1152-C1173 WeakPolarHBondContact CB-SG 3.46Å; C1152-C1173 WeakPolarHBondContact SG-CB 3.43Å; C1152-C1173 CovalentContact SG-SG 2.08Å; C1152-C1173 PolarHBondContact SG-SG 3.08Å
1153	K	72.5	Confident	72.4	Confident	74 Å²	74	67 Å²	67	32%	0.322	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-8.8	178.2	-94.1	-172.3	167.2	-170.5	0	114.1	E1139 D1140 R1141 E1151	E1139-K1153 PolarHBondContact O-NZ 3.25Å; D1140-K1153 HydrophobicContact CB-CD 4.24Å; D1140-K1153 WeakPolarHBondContact OD1-CD 3.19Å; D1140-K1153 IonicContact OD1-NZ 3.43Å; D1140-K1153 PolarHBondContact OD1-NZ 3.22Å; R1141-K1153 PolarHBondContact O-N 3.33Å; E1151-K1153 PolarHBondContact O-N 3.14Å
1154	S	75.4	Confident	73	Confident	65 Å²	65	68.4 Å²	68.4	46%	0.455	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103	6.3	178.8	-34	0	0	0	0	113.7	C1152 C1173	C1152-S1154 PolarHBondContact O-N 3.1Å; C1152-S1154 PolarHBondContact SG-N 3.14Å; S1154-C1173 VanDerWaalsContact C-SG 3.59Å
1155	C	82.1	Confident	73.7	Confident	49 Å²	49	63.3 Å²	63.3	33%	0.331	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-158.7	-1.3	171.7	74.9	0	0	0	0	115.3	C1152 L1157 H1168 C1173	C1152-C1155 PolarHBondContact O-N 3.11Å; C1152-C1155 VanDerWaalsContact O-N 3.12Å; C1155-L1157 PolarHBondContact O-N 3.12Å; C1155-L1157 VanDerWaalsContact O-N 3.09Å; C1155-L1157 VanDerWaalsContact SG-CB 3.59Å; C1155-L1157 VanDerWaalsContact SG-CG 3.55Å; C1155-L1157 PolarHBondContact SG-N 3.3Å; C1155-H1168 PolarHBondContact SG-NE2 3.35Å; C1155-C1173 PolarHBondContact SG-SG 3.11Å
1156	H	77.5	Confident	74.4	Confident	124 Å²	124	62.9 Å²	62.9	57%	0.574	34%	0.337	S	S	*	.			trans	59.6	10.4	-177.6	-57.3	-74.2	0	0	0	116.9	E1151 C1152 V1158	E1151-H1156 IonicContact OE1-CE1 2.76Å; E1151-H1156 IonicContact OE1-CG 3.2Å; E1151-H1156 IonicContact OE1-ND1 3.38Å; E1151-H1156 PolarHBondContact OE1-ND1 2.65Å; C1152-H1156 WeakPolarHBondContact O-CA 3.02Å; C1152-H1156 PolarHBondContact O-N 2.74Å; H1156-V1158 PolarHBondContact O-N 3.37Å
1157	L	81	Confident	75.6	Confident	93 Å²	93	62.7 Å²	62.7	49%	0.487	32%	0.322	S	S	.	.			trans	-65.8	124.9	171.7	-68.9	176.6	0	0	0	111.5	E1151 C1152 C1155 F1159	E1151-L1157 CarbonylContact C-O 3.56Å; E1151-L1157 VanDerWaalsContact CA-O 3.3Å; E1151-L1157 WeakPolarHBondContact CA-O 3.46Å; C1152-L1157 PolarHBondContact N-O 2.99Å; C1155-L1157 PolarHBondContact O-N 3.12Å; C1155-L1157 VanDerWaalsContact O-N 3.09Å; C1155-L1157 VanDerWaalsContact SG-CB 3.59Å; C1155-L1157 VanDerWaalsContact SG-CG 3.55Å; C1155-L1157 PolarHBondContact SG-N 3.3Å; L1157-F1159 HydrophobicContact CB-CE1 4.44Å; L1157-F1159 HydrophobicContact CB-CE2 3.77Å; L1157-F1159 HydrophobicContact CB-CZ 3.62Å; L1157-F1159 HydrophobicContact CD1-CZ 4.17Å; L1157-F1159 VanDerWaalsContact O-CD2 3.26Å; L1157-F1159 WeakPolarHBondContact O-CD2 3.24Å; L1157-F1159 WeakPolarHBondContact O-CE2 3.41Å
1158	V	81.1	Confident	76.9	Confident	73 Å²	73	62 Å²	62	44%	0.442	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	124.2	178.5	-177.9	0	0	0	0	110.8	T1145 N1149 E1151 H1156	T1145-V1158 HydrophobicContact CG2-CG1 3.87Å; T1145-V1158 HydrophobicContact CG2-CG2 3.81Å; N1149-V1158 HydrophobicContact CB-CG1 3.53Å; E1151-V1158 HydrophobicContact CB-CG2 4.24Å; E1151-V1158 HydrophobicContact CG-CG2 4.1Å; H1156-V1158 PolarHBondContact O-N 3.37Å
1159	F	80.9	Confident	77.8	Confident	30 Å²	30	58.6 Å²	58.6	13%	0.132	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	121.1	-178.1	-60.2	-75.2	0	0	0	111.2	Y1150 C1152 L1157 R1161 E1164 L1165 H1168	Y1150-F1159 PolarHBondContact N-O 3.48Å; Y1150-F1159 WeakPolarHBondContact O-CA 3.45Å; Y1150-F1159 WeakPolarHBondContact O-CB 3.47Å; Y1150-F1159 WeakPolarHBondContact O-CD2 3.44Å; Y1150-F1159 PolarHBondContact O-N 2.7Å; C1152-F1159 HydrophobicContact CB-CE2 4.17Å; L1157-F1159 HydrophobicContact CB-CE1 4.44Å; L1157-F1159 HydrophobicContact CB-CE2 3.77Å; L1157-F1159 HydrophobicContact CB-CZ 3.62Å; L1157-F1159 HydrophobicContact CD1-CZ 4.17Å; L1157-F1159 VanDerWaalsContact O-CD2 3.26Å; L1157-F1159 WeakPolarHBondContact O-CD2 3.24Å; L1157-F1159 WeakPolarHBondContact O-CE2 3.41Å; F1159-R1161 VanDerWaalsContact C-N 3.27Å; F1159-R1161 PolarHBondContact O-N 3.02Å; F1159-E1164 HydrophobicContact CB-CB 4.01Å; F1159-E1164 HydrophobicContact CD1-CB 3.56Å; F1159-E1164 HydrophobicContact CE1-CB 4.41Å; F1159-E1164 HydrophobicContact CG-CB 4.05Å; F1159-L1165 HydrophobicContact CB-CB 4.22Å; F1159-L1165 HydrophobicContact CD2-CB 3.81Å; F1159-L1165 HydrophobicContact CD2-CD1 3.68Å; F1159-L1165 HydrophobicContact CD2-CG 4.38Å; F1159-L1165 HydrophobicContact CE2-CD1 3.97Å; F1159-L1165 HydrophobicContact CG-CB 4.16Å; F1159-H1168 HydrophobicContact CE1-CB 4.05Å; F1159-H1168 HydrophobicContact CE2-CB 3.97Å; F1159-H1168 AromaticContact CE2-CD2 3.81Å; F1159-H1168 AromaticContact CE2-CG 3.93Å; F1159-H1168 HydrophobicContact CZ-CB 3.48Å; F1159-H1168 VanDerWaalsContact CZ-CB 3.48Å; F1159-H1168 AromaticContact CZ-CD2 3.62Å; F1159-H1168 AromaticContact CZ-CG 3.36Å; F1159-H1168 AromaticContact CZ-ND1 3.93Å
1160	L	75.1	Confident	77.8	Confident	119 Å²	119	62.9 Å²	62.9	62%	0.623	30%	0.302	S	S	*	.	S	Bend	trans	-59.3	-38.5	174.9	-109.6	68.8	0	0	0	111.9	N1149	N1149-L1160 WeakPolarHBondContact OD1-CD1 3.4Å; N1149-L1160 WeakPolarHBondContact OD1-CG 3.01Å
1161	R	73.5	Confident	77.4	Confident	140 Å²	140	65.4 Å²	65.4	53%	0.528	33%	0.325	S	S	.	.	S	Bend	trans	-113.3	131.7	-177	-43.4	-174.9	-174.9	94	-1.7	110.5	F1159 Y1163 E1164	F1159-R1161 VanDerWaalsContact C-N 3.27Å; F1159-R1161 PolarHBondContact O-N 3.02Å; R1161-Y1163 PolarHBondContact O-N 3.29Å; R1161-E1164 WeakPolarHBondContact CA-OE2 3.49Å; R1161-E1164 VanDerWaalsContact CB-CD 3.46Å; R1161-E1164 HydrophobicContact CB-CG 4.32Å; R1161-E1164 WeakPolarHBondContact CB-OE1 3.3Å; R1161-E1164 WeakPolarHBondContact CB-OE2 3.38Å; R1161-E1164 WeakPolarHBondContact CD-OE1 3.44Å; R1161-E1164 WeakPolarHBondContact CG-OE1 3.28Å; R1161-E1164 IonicContact CZ-OE1 2.88Å; R1161-E1164 PolarHBondContact N-OE2 3.16Å; R1161-E1164 IonicContact NE-OE1 2.62Å; R1161-E1164 IonicContact NH1-OE1 3.44Å; R1161-E1164 PolarHBondContact NH1-OE1 2.92Å; R1161-E1164 WeakPolarHBondContact O-CB 3.39Å; R1161-E1164 PolarHBondContact O-N 3.09Å
1162	Y	70.3	Confident	76.5	Confident	17 Å²	17	64.9 Å²	64.9	7%	0.067	33%	0.328	C	S	.	.	H	α-helix	trans	-53.7	-20.9	179.4	-171.2	-118.1	0	0	0	115.6	R1128 Y1131 F1142 Y1150 L1165 I1166	R1128-Y1162 HydrophobicContact CG-CD1 4.1Å; R1128-Y1162 HydrophobicContact CG-CE1 4.4Å; Y1131-Y1162 WeakPolarHBondContact CB-OH 3.45Å; Y1131-Y1162 WeakPolarHBondContact CD1-OH 3.5Å; Y1131-Y1162 HydrophobicContact CD2-CE1 4.45Å; Y1131-Y1162 WeakPolarHBondContact CD2-OH 3.35Å; F1142-Y1162 HydrophobicContact CE1-CE2 4.38Å; F1142-Y1162 HydrophobicContact CE2-CE2 4.2Å; F1142-Y1162 AromaticContact CZ-CE2 3.98Å; F1142-Y1162 HydrophobicContact CZ-CE2 3.98Å; Y1150-Y1162 AromaticContact CD1-CD2 3.4Å; Y1150-Y1162 HydrophobicContact CD1-CD2 3.4Å; Y1150-Y1162 HydrophobicContact CD1-CE2 4.02Å; Y1150-Y1162 HydrophobicContact CD1-CG 4.39Å; Y1150-Y1162 HydrophobicContact CD2-CD2 4.43Å; Y1150-Y1162 AromaticContact CE1-CD2 3.42Å; Y1150-Y1162 HydrophobicContact CE1-CD2 3.42Å; Y1150-Y1162 VanDerWaalsContact CE1-CD2 3.42Å; Y1150-Y1162 HydrophobicContact CE1-CE2 4.13Å; Y1150-Y1162 HydrophobicContact CE1-CG 4.1Å; Y1150-Y1162 AromaticContact CG-CD2 3.93Å; Y1150-Y1162 HydrophobicContact CG-CD2 3.93Å; Y1162-L1165 HydrophobicContact CD2-CD2 4.19Å; Y1162-L1165 HydrophobicContact CE2-CD2 3.91Å; Y1162-I1166 HydrophobicContact CD1-CD1 3.91Å; Y1162-I1166 HydrophobicContact CE1-CD1 3.51Å; Y1162-I1166 HydrophobicContact CE1-CG1 4.31Å; Y1162-I1166 WeakPolarHBondContact O-CG1 3.4Å; Y1162-I1166 PolarHBondContact O-N 2.96Å
1163	Y	72.4	Confident	75.6	Confident	32 Å²	32	66 Å²	66	13%	0.125	34%	0.336	C	S	.	.	H	α-helix	trans	-83.1	-25.1	177.4	-62.7	-88	0	0	0	113.1	F1091 A1095 Y1096 R1124 A1127 R1161 I1166 K1167	F1091-Y1163 HydrophobicContact CE1-CD1 4.42Å; F1091-Y1163 AromaticContact CE1-CE1 3.91Å; F1091-Y1163 HydrophobicContact CE1-CE1 3.91Å; F1091-Y1163 HydrophobicContact CE2-CE1 4.48Å; F1091-Y1163 HydrophobicContact CZ-CD1 4.37Å; F1091-Y1163 AromaticContact CZ-CE1 3.56Å; F1091-Y1163 HydrophobicContact CZ-CE1 3.56Å; A1095-Y1163 HydrophobicContact CB-CD1 3.59Å; A1095-Y1163 HydrophobicContact CB-CD2 4.1Å; A1095-Y1163 HydrophobicContact CB-CE1 4.06Å; A1095-Y1163 HydrophobicContact CB-CG 3.64Å; Y1096-Y1163 HydrophobicContact CD2-CD2 4.48Å; Y1096-Y1163 AromaticContact CE2-CD2 3.64Å; Y1096-Y1163 HydrophobicContact CE2-CD2 3.64Å; Y1096-Y1163 AromaticContact CE2-CE2 3.79Å; Y1096-Y1163 HydrophobicContact CE2-CE2 3.79Å; R1124-Y1163 WeakPolarHBondContact CA-OH 3.4Å; R1124-Y1163 WeakPolarHBondContact CB-OH 3.46Å; R1124-Y1163 HydrophobicContact CG-CE2 4.31Å; R1124-Y1163 PolarHBondContact O-OH 2.98Å; A1127-Y1163 HydrophobicContact CB-CE1 3.97Å; R1161-Y1163 PolarHBondContact O-N 3.29Å; Y1163-I1166 PolarHBondContact O-N 3.18Å; Y1163-K1167 VanDerWaalsContact O-CB 3.27Å; Y1163-K1167 WeakPolarHBondContact O-CB 3.45Å; Y1163-K1167 PolarHBondContact O-N 2.79Å
1164	E	79.6	Confident	74.6	Confident	58 Å²	58	65 Å²	65	27%	0.271	35%	0.347	S	S	.	.	H	α-helix	trans	-69.5	-43.6	173.8	-66.3	142.8	-168.6	0	0	109.4	F1159 R1161 I1166 K1167 H1168	F1159-E1164 HydrophobicContact CB-CB 4.01Å; F1159-E1164 HydrophobicContact CD1-CB 3.56Å; F1159-E1164 HydrophobicContact CE1-CB 4.41Å; F1159-E1164 HydrophobicContact CG-CB 4.05Å; R1161-E1164 WeakPolarHBondContact CA-OE2 3.49Å; R1161-E1164 VanDerWaalsContact CB-CD 3.46Å; R1161-E1164 HydrophobicContact CB-CG 4.32Å; R1161-E1164 WeakPolarHBondContact CB-OE1 3.3Å; R1161-E1164 WeakPolarHBondContact CB-OE2 3.38Å; R1161-E1164 WeakPolarHBondContact CD-OE1 3.44Å; R1161-E1164 WeakPolarHBondContact CG-OE1 3.28Å; R1161-E1164 IonicContact CZ-OE1 2.88Å; R1161-E1164 PolarHBondContact N-OE2 3.16Å; R1161-E1164 IonicContact NE-OE1 2.62Å; R1161-E1164 IonicContact NH1-OE1 3.44Å; R1161-E1164 PolarHBondContact NH1-OE1 2.92Å; R1161-E1164 WeakPolarHBondContact O-CB 3.39Å; R1161-E1164 PolarHBondContact O-N 3.09Å; E1164-I1166 PolarHBondContact O-N 3.38Å; E1164-K1167 CarbonylContact O-C 3.58Å; E1164-K1167 PolarHBondContact O-N 3.38Å; E1164-H1168 VanDerWaalsContact O-CB 3.3Å; E1164-H1168 WeakPolarHBondContact O-CB 3.48Å; E1164-H1168 PolarHBondContact O-N 2.86Å
1165	L	82	Confident	73.2	Confident	1 Å²	1	72.1 Å²	72.1	1%	0.005	36%	0.364	C	S	.	.	H	α-helix	trans	-55	-47.8	168.7	179	75.4	0	0	0	112.2	F1142 C1152 F1159 Y1162 K1167 H1168 H1169	F1142-L1165 HydrophobicContact CB-CD1 4.05Å; F1142-L1165 HydrophobicContact CB-CD2 3.53Å; F1142-L1165 HydrophobicContact CB-CG 4.41Å; F1142-L1165 HydrophobicContact CD1-CD2 3.86Å; F1142-L1165 HydrophobicContact CD2-CD2 3.89Å; F1142-L1165 HydrophobicContact CG-CD2 3.49Å; F1142-L1165 VanDerWaalsContact CG-CD2 3.49Å; C1152-L1165 HydrophobicContact CB-CD1 3.82Å; F1159-L1165 HydrophobicContact CB-CB 4.22Å; F1159-L1165 HydrophobicContact CD2-CB 3.81Å; F1159-L1165 HydrophobicContact CD2-CD1 3.68Å; F1159-L1165 HydrophobicContact CD2-CG 4.38Å; F1159-L1165 HydrophobicContact CE2-CD1 3.97Å; F1159-L1165 HydrophobicContact CG-CB 4.16Å; Y1162-L1165 HydrophobicContact CD2-CD2 4.19Å; Y1162-L1165 HydrophobicContact CE2-CD2 3.91Å; L1165-K1167 PolarHBondContact O-N 2.78Å; L1165-H1168 PolarHBondContact O-N 3.44Å; L1165-H1169 VanDerWaalsContact CD1-NE2 3.34Å; L1165-H1169 WeakPolarHBondContact CD1-NE2 3.32Å; L1165-H1169 PolarHBondContact O-CD2 3.39Å; L1165-H1169 PolarHBondContact O-N 2.83Å
1166	I	77	Confident	71.3	Confident	24 Å²	24	77.9 Å²	77.9	12%	0.123	39%	0.39	C	S	.	.	H	α-helix	trans	-63.8	-41.1	177.5	-69.6	170.1	0	0	0	111.2	Y1131 Y1162 Y1163 E1164 H1168 H1169 K1170	Y1131-I1166 HydrophobicContact CD2-CD1 3.96Å; Y1131-I1166 HydrophobicContact CE2-CD1 3.55Å; Y1131-I1166 HydrophobicContact CE2-CG1 3.81Å; Y1162-I1166 HydrophobicContact CD1-CD1 3.91Å; Y1162-I1166 HydrophobicContact CE1-CD1 3.51Å; Y1162-I1166 HydrophobicContact CE1-CG1 4.31Å; Y1162-I1166 WeakPolarHBondContact O-CG1 3.4Å; Y1162-I1166 PolarHBondContact O-N 2.96Å; Y1163-I1166 PolarHBondContact O-N 3.18Å; E1164-I1166 PolarHBondContact O-N 3.38Å; I1166-H1168 VanDerWaalsContact C-N 3.3Å; I1166-H1168 PolarHBondContact O-N 3.15Å; I1166-H1169 PolarHBondContact O-N 3.33Å; I1166-K1170 WeakPolarHBondContact O-CB 3.39Å; I1166-K1170 PolarHBondContact O-N 2.71Å
1167	K	79.6	Confident	69.3	Low	134 Å²	134	78.6 Å²	78.6	58%	0.583	40%	0.404	S	S	*	.	H	α-helix	trans	-63	-39.5	176.6	-171.9	174.3	-178.8	177.7	0	110.5	Y1163 E1164 L1165 K1170 S1171	Y1163-K1167 VanDerWaalsContact O-CB 3.27Å; Y1163-K1167 WeakPolarHBondContact O-CB 3.45Å; Y1163-K1167 PolarHBondContact O-N 2.79Å; E1164-K1167 CarbonylContact O-C 3.58Å; E1164-K1167 PolarHBondContact O-N 3.38Å; L1165-K1167 PolarHBondContact O-N 2.78Å; K1167-K1170 CarbonylContact O-C 3.31Å; K1167-K1170 PolarHBondContact O-N 3.36Å; K1167-S1171 WeakPolarHBondContact O-CB 3.35Å; K1167-S1171 PolarHBondContact O-N 3.46Å; K1167-S1171 PolarHBondContact O-OG 3.12Å
1168	H	82.4	Confident	67	Low	37 Å²	37	78.2 Å²	78.2	17%	0.171	42%	0.422	C	S	.	.	H	α-helix	trans	-68.4	-42.3	176.8	-173	66	0	0	0	113	C1155 F1159 E1164 L1165 I1166 K1170 S1171 G1172 C1173	C1155-H1168 PolarHBondContact SG-NE2 3.35Å; F1159-H1168 HydrophobicContact CE1-CB 4.05Å; F1159-H1168 HydrophobicContact CE2-CB 3.97Å; F1159-H1168 AromaticContact CE2-CD2 3.81Å; F1159-H1168 AromaticContact CE2-CG 3.93Å; F1159-H1168 HydrophobicContact CZ-CB 3.48Å; F1159-H1168 VanDerWaalsContact CZ-CB 3.48Å; F1159-H1168 AromaticContact CZ-CD2 3.62Å; F1159-H1168 AromaticContact CZ-CG 3.36Å; F1159-H1168 AromaticContact CZ-ND1 3.93Å; E1164-H1168 VanDerWaalsContact O-CB 3.3Å; E1164-H1168 WeakPolarHBondContact O-CB 3.48Å; E1164-H1168 PolarHBondContact O-N 2.86Å; L1165-H1168 PolarHBondContact O-N 3.44Å; I1166-H1168 VanDerWaalsContact C-N 3.3Å; I1166-H1168 PolarHBondContact O-N 3.15Å; H1168-K1170 VanDerWaalsContact C-N 3.32Å; H1168-K1170 PolarHBondContact O-N 3.16Å; H1168-S1171 WeakPolarHBondContact CA-OG 3.37Å; H1168-S1171 PolarHBondContact O-N 2.95Å; H1168-S1171 PolarHBondContact O-OG 3.41Å; H1168-G1172 PolarHBondContact O-N 2.95Å; H1168-C1173 VanDerWaalsContact CD2-CB 3.42Å; H1168-C1173 WeakPolarHBondContact CD2-CB 3.44Å; H1168-C1173 PolarHBondContact CD2-SG 3.42Å; H1168-C1173 VanDerWaalsContact NE2-CB 3.31Å; H1168-C1173 WeakPolarHBondContact NE2-CB 3.48Å; H1168-C1173 PolarHBondContact NE2-SG 2.89Å; H1168-C1173 PolarHBondContact O-N 2.7Å
1169	H	77	Confident	64.7	Low	47 Å²	47	79.6 Å²	79.6	22%	0.218	44%	0.441	C	S	.	.	H	α-helix	trans	-62.7	-37.8	170.3	-67.5	177	0	0	0	112	R1141 C1152 L1165 I1166	R1141-H1169 PolarHBondContact O-CE1 3.1Å; R1141-H1169 VanDerWaalsContact O-CE1 3.27Å; R1141-H1169 PolarHBondContact O-NE2 2.66Å; C1152-H1169 PolarHBondContact SG-CD2 2.83Å; C1152-H1169 PolarHBondContact SG-NE2 3.33Å; L1165-H1169 VanDerWaalsContact CD1-NE2 3.34Å; L1165-H1169 WeakPolarHBondContact CD1-NE2 3.32Å; L1165-H1169 PolarHBondContact O-CD2 3.39Å; L1165-H1169 PolarHBondContact O-N 2.83Å; I1166-H1169 PolarHBondContact O-N 3.33Å
1170	K	75.3	Confident	62.4	Low	132 Å²	132	88 Å²	88	57%	0.574	48%	0.477	S	S	*	.	H	α-helix	trans	-69.8	-34	173.9	-84.1	-165.1	173.7	-162.1	0	113.4	E1092 I1166 K1167 H1168 G1172	E1092-K1170 IonicContact OE1-NZ 2.65Å; E1092-K1170 PolarHBondContact OE1-NZ 3.26Å; E1092-K1170 IonicContact OE2-NZ 2.91Å; E1092-K1170 PolarHBondContact OE2-NZ 3.16Å; I1166-K1170 WeakPolarHBondContact O-CB 3.39Å; I1166-K1170 PolarHBondContact O-N 2.71Å; K1167-K1170 CarbonylContact O-C 3.31Å; K1167-K1170 PolarHBondContact O-N 3.36Å; H1168-K1170 VanDerWaalsContact C-N 3.32Å; H1168-K1170 PolarHBondContact O-N 3.16Å; K1170-G1172 VanDerWaalsContact C-N 3.35Å
1171	S	69.2	Low	60.3	Low	90 Å²	90	90.4 Å²	90.4	63%	0.629	49%	0.487	S	S	*	.	H	α-helix	trans	-83.8	-9.3	179.7	67.5	0	0	0	0	113.6	K1167 H1168	K1167-S1171 WeakPolarHBondContact O-CB 3.35Å; K1167-S1171 PolarHBondContact O-N 3.46Å; K1167-S1171 PolarHBondContact O-OG 3.12Å; H1168-S1171 WeakPolarHBondContact CA-OG 3.37Å; H1168-S1171 PolarHBondContact O-N 2.95Å; H1168-S1171 PolarHBondContact O-OG 3.41Å
1172	G	59	Low	58.5	Low	23 Å²	23	91.8 Å²	91.8	24%	0.237	51%	0.505	C	S	.	.	T	Hydrogen-bonded Turn	trans	107.7	49.1	169.6	0	0	0	0	0	116.1	H1168 K1170 G1174 R1175	H1168-G1172 PolarHBondContact O-N 2.95Å; K1170-G1172 VanDerWaalsContact C-N 3.35Å; G1172-G1174 PolarHBondContact O-N 3.04Å; G1172-R1175 PolarHBondContact O-N 3.39Å
1173	C	64.1	Low	56.7	Low	25 Å²	25	96 Å²	96	17%	0.169	54%	0.537	C	S	.	.	T	Hydrogen-bonded Turn	trans	-43.5	114.8	159	-162.8	0	0	0	0	108.8	C1152 S1154 C1155 H1168	C1152-C1173 WeakPolarHBondContact CB-SG 3.46Å; C1152-C1173 WeakPolarHBondContact SG-CB 3.43Å; C1152-C1173 CovalentContact SG-SG 2.08Å; C1152-C1173 PolarHBondContact SG-SG 3.08Å; S1154-C1173 VanDerWaalsContact C-SG 3.59Å; C1155-C1173 PolarHBondContact SG-SG 3.11Å; H1168-C1173 VanDerWaalsContact CD2-CB 3.42Å; H1168-C1173 WeakPolarHBondContact CD2-CB 3.44Å; H1168-C1173 PolarHBondContact CD2-SG 3.42Å; H1168-C1173 VanDerWaalsContact NE2-CB 3.31Å; H1168-C1173 WeakPolarHBondContact NE2-CB 3.48Å; H1168-C1173 PolarHBondContact NE2-SG 2.89Å; H1168-C1173 PolarHBondContact O-N 2.7Å
1174	G	52.2	Low	55	Low	52 Å²	52	103 Å²	103	54%	0.536	57%	0.568	S	S	.	*	T	Hydrogen-bonded Turn	trans	102.2	6.1	179.2	0	0	0	0	0	118.9	G1172 L1176	G1172-G1174 PolarHBondContact O-N 3.04Å; G1174-L1176 VanDerWaalsContact C-N 3.29Å; G1174-L1176 PolarHBondContact O-N 2.83Å; G1174-L1176 VanDerWaalsContact O-N 3.13Å
1175	R	46.4	Very low	52.7	Low	215 Å²	215	105.6 Å²	105.6	81%	0.811	59%	0.593	S	S	*	*			trans	-82.2	36.2	-179.8	-74.5	-162.2	178.2	-142.1	2.6	116.5	G1172	G1172-R1175 PolarHBondContact O-N 3.39Å
1176	L	40.7	Very low	50.4	Low	170 Å²	170	111.1 Å²	111.1	89%	0.89	62%	0.623	S	S	*	*	S	Bend	trans	-133.4	59.1	177	-72.6	177	0	0	0	112.8	G1174	G1174-L1176 VanDerWaalsContact C-N 3.29Å; G1174-L1176 PolarHBondContact O-N 2.83Å; G1174-L1176 VanDerWaalsContact O-N 3.13Å
1177	T	37.5	Very low	48.3	Very low	139 Å²	139	119.2 Å²	119.2	85%	0.853	66%	0.657	S	S	*	*	S	Bend	trans	-173.6	135.1	156.5	9.4	0	0	0	0	109.5
1178	G	32.6	Very low	46.1	Very low	84 Å²	84	118.6 Å²	118.6	87%	0.866	66%	0.664	S	S	*	*			trans	69.1	111.9	168.2	0	0	0	0	0	116.7
1179	A	31.2	Very low	43.7	Very low	102 Å²	102	119.5 Å²	119.5	84%	0.843	68%	0.684	S	S	*	*			trans	-95.7	137.6	-178.1	0	0	0	0	0	114
1180	K	34	Very low	41.5	Very low	208 Å²	208	125.8 Å²	125.8	90%	0.904	71%	0.713	S	S	*	*			trans	-153.8	126.9	138.3	-120	170.4	-176.9	173.8	0	110.7
1181	M	30.7	Very low	39.6	Very low	168 Å²	168	127.1 Å²	127.1	83%	0.828	73%	0.726	S	S	*	*			trans	-98.2	151.3	169.7	-73.9	-172.2	170.8	0	0	109.5
1182	D	35	Very low	37.8	Very low	170 Å²	170	128 Å²	128	91%	0.909	73%	0.732	S	S	*	*			trans	-146.5	138.8	153.1	-96.4	-51.5	0	0	0	108.7
1183	S	33.8	Very low	36.7	Very low	106 Å²	106	131.8 Å²	131.8	74%	0.741	75%	0.753	S	S	*	*			trans	-121.5	142.6	-165.9	-68.5	0	0	0	0	112.4
1184	K	36.5	Very low	35.3	Very low	178 Å²	178	136.9 Å²	136.9	77%	0.774	78%	0.783	S	S	*	*			trans	-153.8	120.8	160.3	-163.4	71.7	-179.8	147.2	0	111.4	D1186	K1184-D1186 WeakPolarHBondContact CE-OD2 3.4Å; K1184-D1186 IonicContact NZ-OD1 2.72Å; K1184-D1186 IonicContact NZ-OD2 3.06Å; K1184-D1186 PolarHBondContact NZ-OD2 3.21Å
1185	S	31.3	Very low	34.3	Very low	113 Å²	113	139.7 Å²	139.7	79%	0.79	80%	0.801	S	S	*	*			trans	-153.3	118.8	173.4	56.1	0	0	0	0	110
1186	D	33.7	Very low	33.7	Very low	117 Å²	117	133 Å²	133	63%	0.626	80%	0.799	S	S	*	*			trans	-132.4	110.8	174.8	-53.6	-72.5	0	0	0	105.5	K1184	K1184-D1186 WeakPolarHBondContact CE-OD2 3.4Å; K1184-D1186 IonicContact NZ-OD1 2.72Å; K1184-D1186 IonicContact NZ-OD2 3.06Å; K1184-D1186 PolarHBondContact NZ-OD2 3.21Å
1187	F	32	Very low	33.5	Very low	193 Å²	193	130.5 Å²	130.5	85%	0.846	80%	0.796	S	S	*	*				70.2	137.4	89.9	-143.7	-129.5	0	0	0	112.6
1188	V	33.4	Very low	33.2	Very low	121 Å²	121	129 Å²	129	73%	0.733	79%	0.791	S	S	*	*			cis	-147.6	156.8	42.2	-166.6	0	0	0	0	111.4
1189	G	33	Very low	33.3	Very low	57 Å²	57	134.7 Å²	134.7	59%	0.588	79%	0.792	S	S	*	*			trans	141.4	84.7	152.2	0	0	0	0	0	119
1190	E	30.4	Very low	33.4	Very low	178 Å²	178	140 Å²	140	83%	0.832	79%	0.79	S	S	*	*			trans	32	134.3	131.3	-89.3	174.3	104.6	0	0	121.4
1191	L	35.9	Very low	33	Very low	161 Å²	161	135.3 Å²	135.3	84%	0.843	78%	0.782	S	S	*	*			cis	-140.1	177.9	25.3	-88	165.3	0	0	0	114
1192	S	30.1	Very low	32.9	Very low	109 Å²	109	130.7 Å²	130.7	76%	0.762	77%	0.767	S	S	*	*			trans	-107.3	-172.6	-174.1	-121.2	0	0	0	0	112.9
1193	P	37.3	Very low	32.8	Very low	102 Å²	102	125.3 Å²	125.3	66%	0.662	74%	0.742	S	S	*	*			cis	-134.6	-165.1	-33	29.1	-6.3	0	0	0	113.4
1194	T	34.1	Very low	32.5	Very low	132 Å²	132	126.9 Å²	126.9	81%	0.81	74%	0.738	S	S	*	*			trans	115.9	112.3	147.8	68.2	0	0	0	0	120.4
1195	A	31.9	Very low	32.3	Very low	110 Å²	110	123.2 Å²	123.2	91%	0.909	72%	0.724	S	S	*	*			trans	31.4	134.1	143	0	0	0	0	0	123.4
1196	G	33.3	Very low	32.2	Very low	75 Å²	75	124.6 Å²	124.6	77%	0.773	72%	0.721	S	S	*	*			trans	150.4	100.5	150.9	0	0	0	0	0	116
1197	S	35.3	Very low	32.1	Very low	118 Å²	118	127.5 Å²	127.5	83%	0.825	73%	0.725	S	S	*	*			trans	43.5	127.1	160.9	-68.2	0	0	0	0	120.3
1198	S	31.2	Very low	32	Very low	106 Å²	106	126.9 Å²	126.9	74%	0.741	72%	0.717	S	S	*	*				62.7	128.9	64.5	-158.3	0	0	0	0	111.9
1199	K	35.2	Very low	31.8	Very low	205 Å²	205	126.8 Å²	126.8	89%	0.891	71%	0.708	S	S	*	*			cis	-127.4	143.8	35.1	-59.6	176.6	-179.2	-178.9	0	114.9
1200	R	33.3	Very low	31.6	Very low	213 Å²	213	131 Å²	131	80%	0.804	71%	0.712	S	S	*	*			trans	-99.5	152.7	153.3	177.8	-169	-67	-159.8	0.7	106.8
1201	C	25.9	Very low	31.5	Very low	110 Å²	110	131.5 Å²	131.5	74%	0.743	72%	0.715	S	S	*	*			trans	-132.9	133.3	143.1	-139.7	0	0	0	0	109.6
1202	S	29.5	Very low	31.3	Very low	71 Å²	71	127.5 Å²	127.5	50%	0.497	71%	0.713	S	S	.	*			trans	-155.1	-171.8	176.4	-51.9	0	0	0	0	104.7
1203	S	31	Very low	31.4	Very low	56 Å²	56	127.7 Å²	127.7	39%	0.392	71%	0.714	S	S	.	*			trans	64.4	168.4	179.7	-62.6	0	0	0	0	111.5	N178 E1205	N178-S1203 PolarHBondContact ND2-O 2.58Å; S1203-E1205 WeakPolarHBondContact CB-OE1 3.49Å; S1203-E1205 PolarHBondContact OG-OE1 3.4Å
1204	E	29.2	Very low	31	Very low	140 Å²	140	128.7 Å²	128.7	65%	0.654	72%	0.718	S	S	*	*			cis	-133.5	168.3	21	-76.5	170.3	152.6	0	0	111.9	N178 L179	N178-E1204 VanDerWaalsContact CB-O 3.3Å; N178-E1204 WeakPolarHBondContact CB-O 3.2Å; N178-E1204 PolarHBondContact ND2-N 3.34Å; L179-E1204 WeakPolarHBondContact CG-O 3.46Å
1205	E	31.9	Very low	30.5	Very low	101 Å²	101	127.3 Å²	127.3	47%	0.472	71%	0.713	S	S	.	*			cis	-172.1	-163.9	-42.7	-119.6	172.7	-140.3	0	0	108.1	L179 S1203	L179-E1205 WeakPolarHBondContact CD1-O 3.24Å; L179-E1205 WeakPolarHBondContact CD2-O 3.15Å; S1203-E1205 WeakPolarHBondContact CB-OE1 3.49Å; S1203-E1205 PolarHBondContact OG-OE1 3.4Å
1206	L	30	Very low	30.2	Very low	141 Å²	141	127.5 Å²	127.5	74%	0.738	71%	0.708	S	S	*	*			trans	75	146.7	163.1	-38.5	177.8	0	0	0	115.6
1207	Y	29.9	Very low	30.1	Very low	179 Å²	179	129.1 Å²	129.1	70%	0.702	71%	0.705	S	S	*	*			cis	-153.1	128.5	-12.7	-143.2	-109.5	0	0	0	105.3
1208	R	30.2	Very low	29.7	Very low	179 Å²	179	129.1 Å²	129.1	68%	0.675	70%	0.699	S	S	*	*			cis	96	129.4	47	-172	-167.1	-165.3	117.9	4	112.6
1209	Q	28.9	Very low	29.7	Very low	120 Å²	120	129.2 Å²	129.2	56%	0.561	70%	0.7	S	S	*	*			trans	73.2	146.1	159	-80.9	174.3	-78.6	0	0	119.1
1210	E	29.1	Very low	29.5	Very low	144 Å²	144	124.1 Å²	124.1	67%	0.673	68%	0.683	S	S	*	*			cis	-164	167.9	-13.7	-147	149.4	-134	0	0	112.3
1211	E	27.9	Very low	29.6	Very low	190 Å²	190	120.7 Å²	120.7	89%	0.888	69%	0.685	S	S	*	*			trans	61.8	151.2	166.4	-50.8	-159.9	161.4	0	0	120.7
1212	G	32	Very low	29.8	Very low	77 Å²	77	124.7 Å²	124.7	79%	0.794	69%	0.685	S	S	*	*			trans	148.3	90.3	167.4	0	0	0	0	0	119.3
1213	S	33.1	Very low	30.1	Very low	113 Å²	113	129 Å²	129	79%	0.79	70%	0.7	S	S	*	*			trans	12.1	113.9	152.1	-55.5	0	0	0	0	123.6
1214	T	29.3	Very low	30.2	Very low	123 Å²	123	132.3 Å²	132.3	76%	0.755	71%	0.714	S	S	*	*				55	125.6	117.9	-21.5	0	0	0	0	123.3
1215	C	21.9	Very low	30.9	Very low	103 Å²	103	132.4 Å²	132.4	70%	0.696	72%	0.719	S	S	*	*			trans	51.5	121.6	148.8	67.9	0	0	0	0	122.7
1216	S	25.7	Very low	32.3	Very low	114 Å²	114	131.4 Å²	131.4	80%	0.797	71%	0.714	S	S	*	*			trans	68.9	170.6	142.6	-65.8	0	0	0	0	117.8
1217	P	32.9	Very low	33.9	Very low	109 Å²	109	129.2 Å²	129.2	71%	0.708	70%	0.697	S	S	*	*			cis	-131.4	-172.6	-37.1	34.6	-16	0	0	0	113.1
1218	T	26.1	Very low	36.1	Very low	117 Å²	117	123.7 Å²	123.7	72%	0.718	68%	0.682	S	S	*	*			trans	13	128.3	147.8	57.2	0	0	0	0	121.8
1219	S	31.2	Very low	38.5	Very low	109 Å²	109	115.5 Å²	115.5	76%	0.762	65%	0.652	S	S	*	*				-164.5	118.1	108	54.3	0	0	0	0	108.8
1220	D	30.8	Very low	40.6	Very low	98 Å²	98	118 Å²	118	52%	0.524	66%	0.663	S	S	.	*				50.6	110.6	91.3	-77.3	-64.2	0	0	0	111.9	R1222	D1220-R1222 IonicContact OD1-CZ 3.44Å; D1220-R1222 IonicContact OD1-NE 3.64Å; D1220-R1222 IonicContact OD1-NH1 3.22Å; D1220-R1222 PolarHBondContact OD1-NH1 2.9Å; D1220-R1222 IonicContact OD2-NH1 3.18Å; D1220-R1222 PolarHBondContact OD2-NH1 3.47Å
1221	V	36.3	Very low	42.5	Very low	140 Å²	140	116.5 Å²	116.5	85%	0.848	65%	0.651	S	S	*	*				-119.6	137	67	-177.9	0	0	0	0	114.5
1222	R	30	Very low	44.9	Very low	194 Å²	194	109.2 Å²	109.2	73%	0.732	62%	0.621	S	S	*	*			trans	-93.7	140.9	171.6	-60.7	163.9	166	108.4	-14.6	111.6	D1220	D1220-R1222 IonicContact OD1-CZ 3.44Å; D1220-R1222 IonicContact OD1-NE 3.64Å; D1220-R1222 IonicContact OD1-NH1 3.22Å; D1220-R1222 PolarHBondContact OD1-NH1 2.9Å; D1220-R1222 IonicContact OD2-NH1 3.18Å; D1220-R1222 PolarHBondContact OD2-NH1 3.47Å
1223	I	34.1	Very low	46.8	Very low	162 Å²	162	111.6 Å²	111.6	83%	0.831	62%	0.622	S	S	*	*			trans	-137	144.1	151.3	-58.9	-175.8	0	0	0	107.5	D1225	I1223-D1225 PolarHBondContact O-N 3.26Å; I1223-D1225 VanDerWaalsContact O-N 3.09Å
1224	D	33.9	Very low	48.8	Very low	125 Å²	125	107.6 Å²	107.6	67%	0.668	60%	0.596	S	S	*	*			trans	-72.4	90.2	-162	-75	-85.9	0	0	0	117.2	Q1226	D1224-Q1226 VanDerWaalsContact C-N 3.26Å; D1224-Q1226 HydrophobicContact CB-CG 4.26Å; D1224-Q1226 PolarHBondContact O-N 2.9Å; D1224-Q1226 VanDerWaalsContact O-N 3.16Å; D1224-Q1226 PolarHBondContact OD1-NE2 2.78Å
1225	D	45	Very low	51	Low	142 Å²	142	109.3 Å²	109.3	76%	0.759	59%	0.589	S	S	*	*			trans	-82.3	68.8	156	-94.3	-23.3	0	0	0	111.1	I1223	I1223-D1225 PolarHBondContact O-N 3.26Å; I1223-D1225 VanDerWaalsContact O-N 3.09Å
1226	Q	59.5	Low	53.6	Low	81 Å²	81	106.1 Å²	106.1	38%	0.379	56%	0.563	S	S	.	*			trans	-85.6	112.6	171.5	-65.8	-174.6	24.4	0	0	110.4	D1224 V1228	D1224-Q1226 VanDerWaalsContact C-N 3.26Å; D1224-Q1226 HydrophobicContact CB-CG 4.26Å; D1224-Q1226 PolarHBondContact O-N 2.9Å; D1224-Q1226 VanDerWaalsContact O-N 3.16Å; D1224-Q1226 PolarHBondContact OD1-NE2 2.78Å; Q1226-V1228 WeakPolarHBondContact O-CG2 3.4Å; Q1226-V1228 PolarHBondContact O-N 2.87Å
1227	Y	65.4	Low	55.7	Low	95 Å²	95	103.6 Å²	103.6	37%	0.373	56%	0.556	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-69.7	104	179.4	-68.8	-80.6	0	0	0	110.8	F1236 L1242	Y1227-F1236 PolarHBondContact N-O 3.15Å; Y1227-F1236 WeakPolarHBondContact O-CB 3.31Å; Y1227-F1236 WeakPolarHBondContact O-CD2 3.47Å; Y1227-F1236 PolarHBondContact O-N 3.4Å; Y1227-L1242 HydrophobicContact CD1-CD2 4.11Å; Y1227-L1242 HydrophobicContact CG-CD2 4.44Å
1228	V	75.5	Confident	57.8	Low	63 Å²	63	103 Å²	103	38%	0.382	55%	0.546	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	138.5	178.8	-164.4	0	0	0	0	109.8	Q1226 R1235	Q1226-V1228 WeakPolarHBondContact O-CG2 3.4Å; Q1226-V1228 PolarHBondContact O-N 2.87Å; V1228-R1235 HydrophobicContact CG1-CG 4.26Å; V1228-R1235 HydrophobicContact CG2-CG 4.34Å
1229	C	80.5	Confident	60	Low	7 Å²	7	100.3 Å²	100.3	5%	0.047	53%	0.532	C	S	.	.			trans	-74.2	133.7	169.4	-169.6	0	0	0	0	111	W1231 A1234 F1236 L1242 H1245 H1250	C1229-W1231 VanDerWaalsContact C-N 3.25Å; C1229-W1231 PolarHBondContact O-N 3.14Å; C1229-A1234 PolarHBondContact N-O 3Å; C1229-F1236 HydrophobicContact CB-CE2 4.3Å; C1229-L1242 HydrophobicContact CB-CD1 3.92Å; C1229-H1245 WeakPolarHBondContact CB-NE2 3.04Å; C1229-H1250 PolarHBondContact SG-CD2 2.72Å
1230	H	71.9	Confident	62.1	Low	173 Å²	173	102.8 Å²	102.8	80%	0.801	53%	0.531	S	S	*	.	S	Bend	trans	-73	-14	177.3	-78	-72.6	0	0	0	114.3
1231	W	69.9	Low	64.4	Low	111 Å²	111	102 Å²	102	42%	0.42	53%	0.525	S	S	.	.	S	Bend	trans	-113.8	-4.8	-175.1	-55.5	-11.1	0	0	0	114.1	H222 C1229 H1250 Q1253	H222-W1231 AromaticContact CE1-CZ2 3.69Å; C1229-W1231 VanDerWaalsContact C-N 3.25Å; C1229-W1231 PolarHBondContact O-N 3.14Å; W1231-H1250 VanDerWaalsContact C-CE1 3.45Å; W1231-H1250 VanDerWaalsContact CB-CE1 3.42Å; W1231-H1250 WeakPolarHBondContact CB-CE1 3.36Å; W1231-H1250 WeakPolarHBondContact CB-ND1 3.37Å; W1231-H1250 HydrophobicContact CE3-CB 3.57Å; W1231-H1250 AromaticContact CE3-CG 3.81Å; W1231-H1250 AromaticContact CE3-ND1 3.82Å; W1231-H1250 HydrophobicContact CZ3-CB 3.9Å; W1231-H1250 PolarHBondContact O-CE1 3.1Å; W1231-Q1253 HydrophobicContact CZ3-CB 4.37Å
1232	C	77.9	Confident	66.5	Low	37 Å²	37	96.4 Å²	96.4	25%	0.25	49%	0.49	C	S	.	.	S	Bend	trans	-153.4	161	165.6	93.2	0	0	0	0	111.6	A1234 H1245	C1232-A1234 PolarHBondContact O-N 2.9Å; C1232-H1245 PolarHBondContact SG-CE1 2.98Å; C1232-H1245 PolarHBondContact SG-NE2 2.72Å
1233	P	71.8	Confident	68.6	Low	127 Å²	127	90.1 Å²	90.1	83%	0.825	48%	0.476	S	S	*	.	S	Bend	trans	-74.3	18.2	-171.3	32.2	-37.3	0	0	0	115.4
1234	A	74.7	Confident	70.6	Confident	30 Å²	30	89 Å²	89	25%	0.248	46%	0.461	C	S	.	.			trans	-79.5	144.6	179.4	0	0	0	0	0	112.2	C1229 C1232 F1236	C1229-A1234 PolarHBondContact N-O 3Å; C1232-A1234 PolarHBondContact O-N 2.9Å; A1234-F1236 HydrophobicContact CB-CE1 4.47Å; A1234-F1236 HydrophobicContact CB-CE2 3.64Å; A1234-F1236 HydrophobicContact CB-CZ 3.43Å; A1234-F1236 VanDerWaalsContact CB-CZ 3.43Å
1235	R	76.5	Confident	72.7	Confident	158 Å²	158	83.9 Å²	83.9	60%	0.596	43%	0.433	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126	137	-175.3	-58.4	171	75.7	119.9	-1.5	109	V1228	V1228-R1235 HydrophobicContact CG1-CG 4.26Å; V1228-R1235 HydrophobicContact CG2-CG 4.34Å
1236	F	76.7	Confident	74.1	Confident	36 Å²	36	80.8 Å²	80.8	16%	0.158	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	140.4	-170	-59.6	-73.5	0	0	0	111.5	Y1227 C1229 A1234 L1238 Q1241 L1242 H1245	Y1227-F1236 PolarHBondContact N-O 3.15Å; Y1227-F1236 WeakPolarHBondContact O-CB 3.31Å; Y1227-F1236 WeakPolarHBondContact O-CD2 3.47Å; Y1227-F1236 PolarHBondContact O-N 3.4Å; C1229-F1236 HydrophobicContact CB-CE2 4.3Å; A1234-F1236 HydrophobicContact CB-CE1 4.47Å; A1234-F1236 HydrophobicContact CB-CE2 3.64Å; A1234-F1236 HydrophobicContact CB-CZ 3.43Å; A1234-F1236 VanDerWaalsContact CB-CZ 3.43Å; F1236-L1238 VanDerWaalsContact C-N 3.33Å; F1236-Q1241 HydrophobicContact CB-CB 3.89Å; F1236-Q1241 HydrophobicContact CD1-CB 3.9Å; F1236-Q1241 HydrophobicContact CG-CB 4.19Å; F1236-L1242 HydrophobicContact CB-CB 4.25Å; F1236-L1242 HydrophobicContact CD2-CB 4.1Å; F1236-L1242 HydrophobicContact CD2-CD1 3.88Å; F1236-L1242 HydrophobicContact CE2-CD1 4.26Å; F1236-L1242 HydrophobicContact CG-CB 4.36Å; F1236-H1245 HydrophobicContact CD1-CB 4.49Å; F1236-H1245 HydrophobicContact CD2-CB 4.43Å; F1236-H1245 HydrophobicContact CE1-CB 3.79Å; F1236-H1245 HydrophobicContact CE2-CB 3.74Å; F1236-H1245 AromaticContact CE2-CD2 3.34Å; F1236-H1245 WeakPolarHBondContact CE2-CD2 3.42Å; F1236-H1245 AromaticContact CE2-CG 3.46Å; F1236-H1245 VanDerWaalsContact CE2-CG 3.46Å; F1236-H1245 AromaticContact CE2-NE2 3.89Å; F1236-H1245 HydrophobicContact CZ-CB 3.38Å; F1236-H1245 AromaticContact CZ-CD2 3.5Å; F1236-H1245 AromaticContact CZ-CE1 3.86Å; F1236-H1245 AromaticContact CZ-CG 3.13Å; F1236-H1245 AromaticContact CZ-ND1 3.4Å; F1236-H1245 WeakPolarHBondContact CZ-ND1 3.37Å; F1236-H1245 AromaticContact CZ-NE2 3.92Å
1237	G	68.9	Low	74.3	Confident	62 Å²	62	84.5 Å²	84.5	64%	0.639	42%	0.424	S	S	*	.	S	Bend	trans	-85.2	-4.3	-178.7	0	0	0	0	0	114.2
1238	L	77.5	Confident	74.5	Confident	97 Å²	97	85.4 Å²	85.4	51%	0.508	43%	0.432	S	S	.	.	S	Bend	trans	-145.5	143.1	-179.3	-66.1	172.1	0	0	0	109.8	F1236 E1240 Q1241 L1242	F1236-L1238 VanDerWaalsContact C-N 3.33Å; L1238-E1240 PolarHBondContact O-N 3.29Å; L1238-Q1241 HydrophobicContact CB-CB 4.3Å; L1238-Q1241 HydrophobicContact CB-CG 4.08Å; L1238-Q1241 HydrophobicContact CD1-CG 4.47Å; L1238-Q1241 WeakPolarHBondContact O-CA 3.32Å; L1238-Q1241 WeakPolarHBondContact O-CB 3.41Å; L1238-Q1241 PolarHBondContact O-N 3.28Å; L1238-L1242 PolarHBondContact O-N 3.02Å; L1238-L1242 VanDerWaalsContact O-N 3.09Å
1239	S	72.1	Confident	74.2	Confident	60 Å²	60	86.5 Å²	86.5	42%	0.42	44%	0.439	S	S	.	.	H	α-helix	trans	-53.8	-42.1	171.4	174.7	0	0	0	0	111.7	Q1241 L1242 S1243	S1239-Q1241 VanDerWaalsContact C-N 3.26Å; S1239-Q1241 PolarHBondContact O-N 2.82Å; S1239-L1242 PolarHBondContact O-N 2.82Å; S1239-S1243 PolarHBondContact O-N 3.31Å; S1239-S1243 PolarHBondContact O-OG 3Å
1240	E	76	Confident	73.5	Confident	161 Å²	161	86.7 Å²	86.7	75%	0.752	44%	0.439	S	S	*	.	H	α-helix	trans	-61.9	-31.1	176.5	-168.5	176.1	-147.6	0	0	112.8	L1238 R1244	L1238-E1240 PolarHBondContact O-N 3.29Å; E1240-R1244 WeakPolarHBondContact O-CB 3.47Å; E1240-R1244 PolarHBondContact O-N 3.46Å
1241	Q	78.8	Confident	72.7	Confident	82 Å²	82	84.6 Å²	84.6	38%	0.383	42%	0.424	S	S	.	.	H	α-helix	trans	-73.4	-39	172.7	-72	177.4	-1.8	0	0	112.1	F1236 L1238 S1239 R1244 H1245	F1236-Q1241 HydrophobicContact CB-CB 3.89Å; F1236-Q1241 HydrophobicContact CD1-CB 3.9Å; F1236-Q1241 HydrophobicContact CG-CB 4.19Å; L1238-Q1241 HydrophobicContact CB-CB 4.3Å; L1238-Q1241 HydrophobicContact CB-CG 4.08Å; L1238-Q1241 HydrophobicContact CD1-CG 4.47Å; L1238-Q1241 WeakPolarHBondContact O-CA 3.32Å; L1238-Q1241 WeakPolarHBondContact O-CB 3.41Å; L1238-Q1241 PolarHBondContact O-N 3.28Å; S1239-Q1241 VanDerWaalsContact C-N 3.26Å; S1239-Q1241 PolarHBondContact O-N 2.82Å; Q1241-R1244 PolarHBondContact O-N 2.99Å; Q1241-H1245 WeakPolarHBondContact O-CB 3.33Å; Q1241-H1245 PolarHBondContact O-N 3.47Å
1242	L	80.2	Confident	71.6	Confident	21 Å²	21	84.3 Å²	84.3	11%	0.11	43%	0.431	C	S	.	.	H	α-helix	trans	-62.3	-51.6	172.8	172.7	63.4	0	0	0	110.4	Y1227 C1229 F1236 L1238 S1239 R1244 H1245 E1246	Y1227-L1242 HydrophobicContact CD1-CD2 4.11Å; Y1227-L1242 HydrophobicContact CG-CD2 4.44Å; C1229-L1242 HydrophobicContact CB-CD1 3.92Å; F1236-L1242 HydrophobicContact CB-CB 4.25Å; F1236-L1242 HydrophobicContact CD2-CB 4.1Å; F1236-L1242 HydrophobicContact CD2-CD1 3.88Å; F1236-L1242 HydrophobicContact CE2-CD1 4.26Å; F1236-L1242 HydrophobicContact CG-CB 4.36Å; L1238-L1242 PolarHBondContact O-N 3.02Å; L1238-L1242 VanDerWaalsContact O-N 3.09Å; S1239-L1242 PolarHBondContact O-N 2.82Å; L1242-R1244 VanDerWaalsContact C-N 3.27Å; L1242-R1244 PolarHBondContact O-N 2.96Å; L1242-H1245 CarbonylContact O-C 3.4Å; L1242-H1245 WeakPolarHBondContact O-CA 3.38Å; L1242-H1245 WeakPolarHBondContact O-CB 3.38Å; L1242-H1245 PolarHBondContact O-N 3.2Å; L1242-E1246 HydrophobicContact CD1-CG 3.86Å; L1242-E1246 HydrophobicContact CG-CG 4.22Å; L1242-E1246 WeakPolarHBondContact O-CG 3.19Å; L1242-E1246 PolarHBondContact O-N 2.99Å
1243	S	73.4	Confident	70.1	Confident	63 Å²	63	88.1 Å²	88.1	44%	0.441	45%	0.445	S	S	.	.	H	α-helix	trans	-61.7	-35	178.6	-60.5	0	0	0	0	112.5	S1239 W1247	S1239-S1243 PolarHBondContact O-N 3.31Å; S1239-S1243 PolarHBondContact O-OG 3Å; S1243-W1247 VanDerWaalsContact O-CB 3.31Å; S1243-W1247 WeakPolarHBondContact O-CB 3.46Å; S1243-W1247 PolarHBondContact O-N 3.17Å; S1243-W1247 VanDerWaalsContact O-N 3.07Å
1244	R	76.9	Confident	68.2	Low	139 Å²	139	85.7 Å²	85.7	53%	0.525	43%	0.425	S	S	.	.	H	α-helix	trans	-67.2	-39.4	172.1	-139.4	-174.2	80	-121.6	-16.7	111.6	E1240 Q1241 L1242 W1247 E1248	E1240-R1244 WeakPolarHBondContact O-CB 3.47Å; E1240-R1244 PolarHBondContact O-N 3.46Å; Q1241-R1244 PolarHBondContact O-N 2.99Å; L1242-R1244 VanDerWaalsContact C-N 3.27Å; L1242-R1244 PolarHBondContact O-N 2.96Å; R1244-W1247 CarbonylContact O-C 3.54Å; R1244-W1247 PolarHBondContact O-N 3.07Å; R1244-E1248 HydrophobicContact CG-CG 4.4Å; R1244-E1248 IonicContact CZ-OE1 2.65Å; R1244-E1248 IonicContact CZ-OE2 3.92Å; R1244-E1248 IonicContact NE-OE1 3.35Å; R1244-E1248 PolarHBondContact NE-OE1 2.77Å; R1244-E1248 IonicContact NE-OE2 2.79Å; R1244-E1248 PolarHBondContact NE-OE2 2.86Å; R1244-E1248 IonicContact NH2-OE1 3.69Å; R1244-E1248 IonicContact NH2-OE2 3.89Å; R1244-E1248 PolarHBondContact NH2-OE2 2.53Å; R1244-E1248 WeakPolarHBondContact O-CB 3.43Å; R1244-E1248 WeakPolarHBondContact O-CG 3.29Å; R1244-E1248 PolarHBondContact O-N 3.22Å
1245	H	77.4	Confident	66.2	Low	17 Å²	17	90.7 Å²	90.7	8%	0.079	45%	0.447	C	S	.	.	H	α-helix	trans	-67.6	-41.9	175.2	170.4	79.1	0	0	0	113.2	C1229 C1232 F1236 Q1241 L1242 W1247 E1248 V1249 H1250	C1229-H1245 WeakPolarHBondContact CB-NE2 3.04Å; C1232-H1245 PolarHBondContact SG-CE1 2.98Å; C1232-H1245 PolarHBondContact SG-NE2 2.72Å; F1236-H1245 HydrophobicContact CD1-CB 4.49Å; F1236-H1245 HydrophobicContact CD2-CB 4.43Å; F1236-H1245 HydrophobicContact CE1-CB 3.79Å; F1236-H1245 HydrophobicContact CE2-CB 3.74Å; F1236-H1245 AromaticContact CE2-CD2 3.34Å; F1236-H1245 WeakPolarHBondContact CE2-CD2 3.42Å; F1236-H1245 AromaticContact CE2-CG 3.46Å; F1236-H1245 VanDerWaalsContact CE2-CG 3.46Å; F1236-H1245 AromaticContact CE2-NE2 3.89Å; F1236-H1245 HydrophobicContact CZ-CB 3.38Å; F1236-H1245 AromaticContact CZ-CD2 3.5Å; F1236-H1245 AromaticContact CZ-CE1 3.86Å; F1236-H1245 AromaticContact CZ-CG 3.13Å; F1236-H1245 AromaticContact CZ-ND1 3.4Å; F1236-H1245 WeakPolarHBondContact CZ-ND1 3.37Å; F1236-H1245 AromaticContact CZ-NE2 3.92Å; Q1241-H1245 WeakPolarHBondContact O-CB 3.33Å; Q1241-H1245 PolarHBondContact O-N 3.47Å; L1242-H1245 CarbonylContact O-C 3.4Å; L1242-H1245 WeakPolarHBondContact O-CA 3.38Å; L1242-H1245 WeakPolarHBondContact O-CB 3.38Å; L1242-H1245 PolarHBondContact O-N 3.2Å; H1245-W1247 PolarHBondContact O-N 2.97Å; H1245-E1248 PolarHBondContact O-N 3.4Å; H1245-V1249 VanDerWaalsContact ND1-CG2 3.33Å; H1245-V1249 WeakPolarHBondContact ND1-CG2 3.44Å; H1245-V1249 WeakPolarHBondContact O-CB 3.35Å; H1245-V1249 PolarHBondContact O-N 3.48Å; H1245-H1250 AromaticContact CD2-CD2 3.97Å; H1245-H1250 AromaticContact NE2-CD2 3.55Å; H1245-H1250 AromaticContact NE2-NE2 3.5Å; H1245-H1250 PolarHBondContact NE2-NE2 2.7Å
1246	E	75	Confident	64.1	Low	76 Å²	76	89.9 Å²	89.9	36%	0.355	45%	0.454	S	S	.	.	H	α-helix	trans	-59.9	-34.5	173.7	-70.1	175.3	145.3	0	0	111	L1242 H1250 R1251	L1242-E1246 HydrophobicContact CD1-CG 3.86Å; L1242-E1246 HydrophobicContact CG-CG 4.22Å; L1242-E1246 WeakPolarHBondContact O-CG 3.19Å; L1242-E1246 PolarHBondContact O-N 2.99Å; E1246-H1250 CarbonylContact O-C 3.47Å; E1246-H1250 WeakPolarHBondContact O-CA 3.46Å; E1246-H1250 WeakPolarHBondContact O-CB 3.42Å; E1246-H1250 PolarHBondContact O-N 2.75Å; E1246-R1251 PolarHBondContact O-N 3.33Å
1247	W	63.9	Low	61.8	Low	159 Å²	159	91.7 Å²	91.7	60%	0.602	46%	0.459	S	S	*	.	H	α-helix	trans	-80.5	-31.6	174.6	-168.4	-96.7	0	0	0	114.8	S1243 R1244 H1245 R1251	S1243-W1247 VanDerWaalsContact O-CB 3.31Å; S1243-W1247 WeakPolarHBondContact O-CB 3.46Å; S1243-W1247 PolarHBondContact O-N 3.17Å; S1243-W1247 VanDerWaalsContact O-N 3.07Å; R1244-W1247 CarbonylContact O-C 3.54Å; R1244-W1247 PolarHBondContact O-N 3.07Å; H1245-W1247 PolarHBondContact O-N 2.97Å; W1247-R1251 WeakPolarHBondContact O-CB 3.25Å
1248	E	69.2	Low	59.9	Low	115 Å²	115	90.6 Å²	90.6	54%	0.537	44%	0.442	S	S	.	.	H	α-helix	trans	-89.5	-24.9	-177	-75.6	174.9	165.7	0	0	113.7	R1244 H1245	R1244-E1248 HydrophobicContact CG-CG 4.4Å; R1244-E1248 IonicContact CZ-OE1 2.65Å; R1244-E1248 IonicContact CZ-OE2 3.92Å; R1244-E1248 IonicContact NE-OE1 3.35Å; R1244-E1248 PolarHBondContact NE-OE1 2.77Å; R1244-E1248 IonicContact NE-OE2 2.79Å; R1244-E1248 PolarHBondContact NE-OE2 2.86Å; R1244-E1248 IonicContact NH2-OE1 3.69Å; R1244-E1248 IonicContact NH2-OE2 3.89Å; R1244-E1248 PolarHBondContact NH2-OE2 2.53Å; R1244-E1248 WeakPolarHBondContact O-CB 3.43Å; R1244-E1248 WeakPolarHBondContact O-CG 3.29Å; R1244-E1248 PolarHBondContact O-N 3.22Å; H1245-E1248 PolarHBondContact O-N 3.4Å
1249	V	69.1	Low	57.7	Low	85 Å²	85	91.9 Å²	91.9	52%	0.515	45%	0.446	S	S	.	.	H	α-helix	trans	-123.6	-24.3	-172.1	-177	0	0	0	0	113.3	H1245	H1245-V1249 VanDerWaalsContact ND1-CG2 3.33Å; H1245-V1249 WeakPolarHBondContact ND1-CG2 3.44Å; H1245-V1249 WeakPolarHBondContact O-CB 3.35Å; H1245-V1249 PolarHBondContact O-N 3.48Å
1250	H	67.1	Low	56	Low	11 Å²	11	92.2 Å²	92.2	5%	0.051	45%	0.452	C	S	.	.	S	Bend	trans	-119.3	-4.1	-169.5	-75.2	-56.2	0	0	0	115.9	C1229 W1231 H1245 E1246 D1252 Q1253	C1229-H1250 PolarHBondContact SG-CD2 2.72Å; W1231-H1250 VanDerWaalsContact C-CE1 3.45Å; W1231-H1250 VanDerWaalsContact CB-CE1 3.42Å; W1231-H1250 WeakPolarHBondContact CB-CE1 3.36Å; W1231-H1250 WeakPolarHBondContact CB-ND1 3.37Å; W1231-H1250 HydrophobicContact CE3-CB 3.57Å; W1231-H1250 AromaticContact CE3-CG 3.81Å; W1231-H1250 AromaticContact CE3-ND1 3.82Å; W1231-H1250 HydrophobicContact CZ3-CB 3.9Å; W1231-H1250 PolarHBondContact O-CE1 3.1Å; H1245-H1250 AromaticContact CD2-CD2 3.97Å; H1245-H1250 AromaticContact NE2-CD2 3.55Å; H1245-H1250 AromaticContact NE2-NE2 3.5Å; H1245-H1250 PolarHBondContact NE2-NE2 2.7Å; E1246-H1250 CarbonylContact O-C 3.47Å; E1246-H1250 WeakPolarHBondContact O-CA 3.46Å; E1246-H1250 WeakPolarHBondContact O-CB 3.42Å; E1246-H1250 PolarHBondContact O-N 2.75Å; H1250-D1252 VanDerWaalsContact C-N 3.29Å; H1250-D1252 PolarHBondContact O-N 2.83Å; H1250-Q1253 PolarHBondContact O-N 3.1Å
1251	R	53.3	Low	54.3	Low	129 Å²	129	89.1 Å²	89.1	49%	0.487	45%	0.446	S	S	.	.	G	3₁₀ helix	trans	-58.3	-29.5	-177.8	174.8	174.4	156.6	177.9	-5.1	115.3	E1246 W1247 Q1253	E1246-R1251 PolarHBondContact O-N 3.33Å; W1247-R1251 WeakPolarHBondContact O-CB 3.25Å; R1251-Q1253 VanDerWaalsContact C-N 3.32Å; R1251-Q1253 PolarHBondContact O-N 3.44Å
1252	D	46.6	Very low	52.1	Low	105 Å²	105	90.8 Å²	90.8	56%	0.561	46%	0.462	S	S	*	.	G	3₁₀ helix	trans	-78.5	-6.4	-174.6	-75.4	-46.5	0	0	0	114.9	H1250	H1250-D1252 VanDerWaalsContact C-N 3.29Å; H1250-D1252 PolarHBondContact O-N 2.83Å
1253	Q	47.3	Very low	50	Low	117 Å²	117	97.1 Å²	97.1	55%	0.547	49%	0.491	S	S	.	.	G	3₁₀ helix	trans	-89.7	0.8	-174.2	-64.2	-170.2	7.1	0	0	116	W1231 H1250 R1251	W1231-Q1253 HydrophobicContact CZ3-CB 4.37Å; H1250-Q1253 PolarHBondContact O-N 3.1Å; R1251-Q1253 VanDerWaalsContact C-N 3.32Å; R1251-Q1253 PolarHBondContact O-N 3.44Å
1254	N	31.7	Very low	48.2	Very low	76 Å²	76	96.5 Å²	96.5	41%	0.406	49%	0.486	S	S	.	.	G	3₁₀ helix	trans	-112.2	3	-171.5	-110.8	-98.6	0	0	0	116.4	I1256	N1254-I1256 PolarHBondContact O-N 2.89Å
1255	D	32.2	Very low	46	Very low	135 Å²	135	93.8 Å²	93.8	72%	0.722	49%	0.488	S	S	*	.			trans	-101.5	38	-173.1	-135.7	-18.4	0	0	0	113.7
1256	I	33.7	Very low	43.9	Very low	142 Å²	142	94.9 Å²	94.9	73%	0.728	50%	0.5	S	S	*	.			trans	-117.9	77	-179.7	-48.9	-179.6	0	0	0	111	N1254	N1254-I1256 PolarHBondContact O-N 2.89Å
1257	W	27.5	Very low	41.7	Very low	73 Å²	73	96.4 Å²	96.4	28%	0.277	52%	0.52	S	S	.	.			trans	-160.3	92.3	142.9	-95.1	-27.1	0	0	0	115.1	R223 C246 G247 T249 Q250	R223-W1257 HydrophobicContact CB-CH2 3.82Å; R223-W1257 HydrophobicContact CB-CZ3 3.89Å; R223-W1257 HydrophobicContact CG-CH2 4.09Å; R223-W1257 VanDerWaalsContact CZ-CH2 3.49Å; R223-W1257 VanDerWaalsContact NH2-CZ2 3.33Å; R223-W1257 WeakPolarHBondContact O-CZ3 3.31Å; C246-W1257 VanDerWaalsContact C-CE3 3.43Å; C246-W1257 VanDerWaalsContact C-CZ3 3.48Å; C246-W1257 HydrophobicContact CB-CE3 4.24Å; C246-W1257 HydrophobicContact CB-CH2 3.88Å; C246-W1257 HydrophobicContact CB-CZ3 3.52Å; C246-W1257 WeakPolarHBondContact SG-CZ3 3.47Å; G247-W1257 VanDerWaalsContact C-NE1 3.3Å; G247-W1257 VanDerWaalsContact CA-CE2 3.46Å; G247-W1257 VanDerWaalsContact N-CE2 3.31Å; G247-W1257 PolarHBondContact O-NE1 2.85Å; T249-W1257 CarbonylContact C-O 3.33Å; T249-W1257 WeakPolarHBondContact CA-O 3.41Å; T249-W1257 PolarHBondContact N-O 3.31Å; Q250-W1257 PolarHBondContact N-O 2.84Å; Q250-W1257 VanDerWaalsContact N-O 3.09Å
1258	S	29.7	Very low	40.2	Very low	40 Å²	40	93.4 Å²	93.4	28%	0.28	53%	0.529	S	S	.	.			trans	-166.3	161.3	143.5	-156.8	0	0	0	0	112.4	Q250	Q250-S1258 VanDerWaalsContact CB-CB 3.42Å; Q250-S1258 WeakPolarHBondContact CB-OG 3.47Å; Q250-S1258 PolarHBondContact N-OG 3.22Å; Q250-S1258 VanDerWaalsContact OE1-CB 3.24Å; Q250-S1258 PolarHBondContact OE1-OG 2.89Å
1259	Q	30.6	Very low	38.4	Very low	124 Å²	124	97 Å²	97	58%	0.579	55%	0.545	S	S	*	.			trans	64	142.9	169.1	-49.8	-168.9	55.7	0	0	115.9
1260	A	37.4	Very low	36.6	Very low	67 Å²	67	101.9 Å²	101.9	55%	0.554	56%	0.563	S	S	*	*			cis	-151.1	-100.8	-28.1	0	0	0	0	0	107.3
1261	P	38.8	Very low	34.8	Very low	96 Å²	96	106.2 Å²	106.2	62%	0.623	59%	0.594	S	S	*	*				-133.3	147.1	-52.3	14.3	9	0	0	0	116.4
1262	T	34.3	Very low	33.7	Very low	117 Å²	117	105 Å²	105	72%	0.718	60%	0.601	S	S	*	*			trans	68.4	178	137.4	70	0	0	0	0	118.8
1263	Q	34.2	Very low	32.9	Very low	154 Å²	154	109.1 Å²	109.1	72%	0.72	61%	0.614	S	S	*	*			cis	-155.8	169.9	10	-143.3	160.6	112.5	0	0	114.9
1264	S	35.6	Very low	32.1	Very low	49 Å²	49	108.3 Å²	108.3	34%	0.343	62%	0.622	S	S	.	*			trans	65	158.9	138.2	65.4	0	0	0	0	124.1	S304 N308	S304-S1264 CarbonylContact C-O 3.19Å; S304-S1264 VanDerWaalsContact CB-O 3.3Å; S304-S1264 WeakPolarHBondContact CB-O 3.33Å; N308-S1264 PolarHBondContact ND2-O 3.5Å; N308-S1264 PolarHBondContact OD1-O 3.47Å
1265	S	31	Very low	32	Very low	82 Å²	82	109.1 Å²	109.1	57%	0.573	64%	0.639	S	S	*	*				175.9	136.6	-67	51.6	0	0	0	0	116.7	S304 N308	S304-S1265 WeakPolarHBondContact OG-CA 3.33Å; N308-S1265 PolarHBondContact OD1-N 2.89Å
1266	A	33.9	Very low	31.9	Very low	40 Å²	40	107.7 Å²	107.7	33%	0.331	65%	0.646	S	S	.	*			trans	-155.3	168	164.2	0	0	0	0	0	109.7	I307	I307-A1266 HydrophobicContact CB-CB 4.34Å; I307-A1266 HydrophobicContact CD1-CB 3.89Å; I307-A1266 HydrophobicContact CG2-CB 3.67Å
1267	S	29.4	Very low	31.9	Very low	109 Å²	109	105.8 Å²	105.8	76%	0.762	65%	0.651	S	S	*	*			cis	84.9	140.6	17.5	-50.1	0	0	0	0	115
1268	A	32.2	Very low	32.3	Very low	95 Å²	95	108.2 Å²	108.2	79%	0.785	68%	0.68	S	S	*	*			cis	-107.5	-107.1	6.5	0	0	0	0	0	116.4
1269	E	30.5	Very low	32.4	Very low	191 Å²	191	109.7 Å²	109.7	89%	0.893	70%	0.701	S	S	*	*			cis	-154	-169.9	10.7	-60.2	169.7	103.5	0	0	112
1270	E	31	Very low	32.6	Very low	188 Å²	188	109.9 Å²	109.9	88%	0.879	72%	0.716	S	S	*	*			trans	-121	165.7	-170.5	-76.9	-165.1	150.7	0	0	114.4
1271	S	29.7	Very low	32.4	Very low	102 Å²	102	112.5 Å²	112.5	71%	0.713	73%	0.73	S	S	*	*			cis	-157.9	169	-12.9	53.5	0	0	0	0	114.1
1272	T	30.3	Very low	32	Very low	103 Å²	103	111.8 Å²	111.8	63%	0.632	74%	0.74	S	S	*	*			trans	-5.6	145.3	158.2	-31.5	0	0	0	0	119.5
1273	F	30.3	Very low	31.8	Very low	191 Å²	191	113.8 Å²	113.8	84%	0.838	75%	0.746	S	S	*	*				-151.9	158.7	55.4	-88.2	-106.6	0	0	0	111.1
1274	S	29.9	Very low	31.5	Very low	101 Å²	101	114 Å²	114	71%	0.706	75%	0.748	S	S	*	*			cis	80.4	137.1	37.5	-64.9	0	0	0	0	114.7
1275	A	30.2	Very low	31.2	Very low	92 Å²	92	117.2 Å²	117.2	76%	0.76	77%	0.77	S	S	*	*			cis	-168.3	-179	-11.4	0	0	0	0	0	112
1276	A	30.4	Very low	31.2	Very low	105 Å²	105	120.3 Å²	120.3	87%	0.868	78%	0.775	S	S	*	*			trans	66.1	157.8	166.1	0	0	0	0	0	118.4
1277	A	34	Very low	31.3	Very low	102 Å²	102	128.9 Å²	128.9	84%	0.843	80%	0.799	S	S	*	*			cis	-135.1	-161.5	-1.5	0	0	0	0	0	110.3
1278	S	34	Very low	31.2	Very low	125 Å²	125	135.8 Å²	135.8	87%	0.874	81%	0.808	S	S	*	*			trans	-164.5	141.6	176.4	63.7	0	0	0	0	117.4
1279	G	32.3	Very low	31.3	Very low	70 Å²	70	138.4 Å²	138.4	72%	0.722	80%	0.804	S	S	*	*			trans	-132.5	141.5	155.5	0	0	0	0	0	108.6
1280	S	36.1	Very low	31.6	Very low	128 Å²	128	140.3 Å²	140.3	90%	0.895	80%	0.803	S	S	*	*				69.7	122.9	66.3	-160.1	0	0	0	0	112.2
1281	S	31.9	Very low	33.1	Very low	122 Å²	122	136.3 Å²	136.3	85%	0.853	79%	0.792	S	S	*	*			cis	-145	175.3	10.1	56.4	0	0	0	0	112.4
1282	G	31.3	Very low	34.7	Very low	81 Å²	81	136.6 Å²	136.6	84%	0.835	78%	0.78	S	S	*	*			trans	160	141.1	174.6	0	0	0	0	0	113
1283	D	28.6	Very low	37.1	Very low	159 Å²	159	133.8 Å²	133.8	85%	0.85	76%	0.761	S	S	*	*			trans	-104.1	126.1	-173.7	-175.4	21.1	0	0	0	112.6
1284	E	28.6	Very low	39.6	Very low	160 Å²	160	125.7 Å²	125.7	75%	0.748	73%	0.728	S	S	*	*			trans	-162.1	153.2	154.8	-130.3	-150.7	90.4	0	0	113.8	Q1286	E1284-Q1286 PolarHBondContact O-N 3.34Å
1285	S	29	Very low	42	Very low	116 Å²	116	124.9 Å²	124.9	81%	0.811	72%	0.72	S	S	*	*			trans	-92.9	51	-151.5	66.5	0	0	0	0	116.8
1286	Q	31.7	Very low	44.5	Very low	146 Å²	146	126.6 Å²	126.6	68%	0.682	71%	0.713	S	S	*	*			trans	-73.4	146.9	-170.7	-67.8	-160.4	4.3	0	0	117.3	E1284	E1284-Q1286 PolarHBondContact O-N 3.34Å
1287	R	36.3	Very low	47.3	Very low	220 Å²	220	123.2 Å²	123.2	83%	0.83	68%	0.68	S	S	*	*			trans	-60.7	140.8	179.5	-58.6	171.4	-174.7	164.7	3.1	111	H1289	R1287-H1289 PolarHBondContact O-N 3Å; R1287-H1289 PolarHBondContact O-ND1 3.48Å
1288	R	26.9	Very low	49.9	Very low	254 Å²	254	120.5 Å²	120.5	96%	0.958	65%	0.653	S	S	*	*			trans	-48.3	104	179.9	-70	-173.8	-175	173.6	3.5	112.1
1289	H	34.6	Very low	52.4	Low	150 Å²	150	120 Å²	120	69%	0.694	64%	0.636	S	S	*	*			trans	-59	136.3	176	-91.7	66.1	0	0	0	110.9	R1287 T1291	R1287-H1289 PolarHBondContact O-N 3Å; R1287-H1289 PolarHBondContact O-ND1 3.48Å; H1289-T1291 PolarHBondContact O-N 3.27Å; H1289-T1291 VanDerWaalsContact O-N 3.13Å
1290	R	36.8	Very low	55	Low	231 Å²	231	121.5 Å²	121.5	87%	0.872	62%	0.623	S	S	*	*			trans	-69.8	107.6	165	174.8	-178	-78.9	-167.6	-1.9	107.1	K1292	R1290-K1292 PolarHBondContact O-N 3Å
1291	T	62.8	Low	57.7	Low	105 Å²	105	115.4 Å²	115.4	64%	0.644	58%	0.58	S	S	*	*			trans	-54.1	114.3	175.3	41.9	0	0	0	0	110.4	H1289	H1289-T1291 PolarHBondContact O-N 3.27Å; H1289-T1291 VanDerWaalsContact O-N 3.13Å
1292	K	63.6	Low	60.5	Low	108 Å²	108	113.3 Å²	113.3	47%	0.47	56%	0.559	S	S	.	*	P	Polyproline II helix	trans	-82.4	134.4	168.3	-68.1	-177.5	178.3	-178.9	0	107.8	R1290	R1290-K1292 PolarHBondContact O-N 3Å
1293	I	80	Confident	63.3	Low	44 Å²	44	112.1 Å²	112.1	23%	0.226	54%	0.542	C	S	.	.	P	Polyproline II helix	trans	-85.5	134	170.3	-62.1	172.3	0	0	0	106.6	N1297 V1298 L1301 I1325 V1329 W1333	I1293-N1297 HydrophobicContact CG2-CB 3.78Å; I1293-V1298 HydrophobicContact CB-CG2 4Å; I1293-V1298 HydrophobicContact CG2-CG2 3.51Å; I1293-L1301 HydrophobicContact CG2-CD1 4.35Å; I1293-I1325 HydrophobicContact CB-CD1 4.35Å; I1293-I1325 HydrophobicContact CG1-CD1 4.23Å; I1293-I1325 HydrophobicContact CG2-CD1 3.65Å; I1293-V1329 HydrophobicContact CD1-CG1 3.85Å; I1293-V1329 HydrophobicContact CG1-CG1 4.07Å; I1293-W1333 HydrophobicContact CD1-CB 4.38Å; I1293-W1333 HydrophobicContact CD1-CG 4.32Å
1294	S	82.2	Confident	66.2	Low	21 Å²	21	106.1 Å²	106.1	15%	0.147	51%	0.508	C	S	.	.	P	Polyproline II helix	trans	-60.4	145.5	175.5	-167.3	0	0	0	0	110.4	Q1296 N1297 V1298	S1294-Q1296 VanDerWaalsContact C-N 3.34Å; S1294-Q1296 PolarHBondContact O-N 3.44Å; S1294-Q1296 PolarHBondContact OG-OE1 3.14Å; S1294-N1297 CarbonylContact O-C 3.43Å; S1294-N1297 WeakPolarHBondContact O-CA 3.44Å; S1294-N1297 WeakPolarHBondContact O-CB 3.33Å; S1294-N1297 PolarHBondContact O-N 2.98Å; S1294-V1298 PolarHBondContact O-N 3.05Å
1295	P	81.5	Confident	69.2	Low	83 Å²	83	99.7 Å²	99.7	54%	0.539	48%	0.478	S	S	.	.	H	α-helix	trans	-50.5	-51.1	175.8	-27.9	36.3	0	0	0	112.8	N1297 V1298 E1299	P1295-N1297 PolarHBondContact O-N 2.89Å; P1295-V1298 CarbonylContact O-C 3.34Å; P1295-V1298 WeakPolarHBondContact O-CA 3.26Å; P1295-V1298 WeakPolarHBondContact O-CB 3.42Å; P1295-V1298 PolarHBondContact O-N 2.75Å; P1295-E1299 VanDerWaalsContact C-CD 3.47Å; P1295-E1299 WeakPolarHBondContact CB-OE1 3.34Å; P1295-E1299 VanDerWaalsContact O-CD 3.28Å; P1295-E1299 PolarHBondContact O-N 3.42Å
1296	Q	82.8	Confident	72	Confident	129 Å²	129	99.5 Å²	99.5	60%	0.603	48%	0.475	S	S	*	.	H	α-helix	trans	-48.5	-37.6	172.5	-62.7	152.6	-43	0	0	113.4	S1294 E1299 K1300	S1294-Q1296 VanDerWaalsContact C-N 3.34Å; S1294-Q1296 PolarHBondContact O-N 3.44Å; S1294-Q1296 PolarHBondContact OG-OE1 3.14Å; Q1296-E1299 VanDerWaalsContact CA-OE2 3.31Å; Q1296-E1299 WeakPolarHBondContact CA-OE2 3.49Å; Q1296-E1299 PolarHBondContact O-N 3.18Å; Q1296-K1300 PolarHBondContact O-N 3.22Å
1297	N	87.8	Confident	74.5	Confident	34 Å²	34	100.7 Å²	100.7	18%	0.182	48%	0.478	C	S	.	.	H	α-helix	trans	-82.8	-26.1	-179.2	-67.4	18.7	0	0	0	111.7	I1293 S1294 P1295 L1301 V1323 I1325	I1293-N1297 HydrophobicContact CG2-CB 3.78Å; S1294-N1297 CarbonylContact O-C 3.43Å; S1294-N1297 WeakPolarHBondContact O-CA 3.44Å; S1294-N1297 WeakPolarHBondContact O-CB 3.33Å; S1294-N1297 PolarHBondContact O-N 2.98Å; P1295-N1297 PolarHBondContact O-N 2.89Å; N1297-L1301 VanDerWaalsContact O-CB 3.29Å; N1297-L1301 WeakPolarHBondContact O-CB 3.18Å; N1297-L1301 VanDerWaalsContact O-CD1 3.28Å; N1297-L1301 WeakPolarHBondContact O-CD1 3.31Å; N1297-L1301 WeakPolarHBondContact O-CG 3.25Å; N1297-L1301 PolarHBondContact O-N 2.73Å; N1297-L1301 VanDerWaalsContact O-N 3.14Å; N1297-V1323 HydrophobicContact CB-CG1 3.45Å; N1297-V1323 VanDerWaalsContact CB-CG1 3.45Å; N1297-V1323 PolarHBondContact ND2-O 3.4Å; N1297-I1325 HydrophobicContact CB-CD1 3.69Å; N1297-I1325 WeakPolarHBondContact ND2-CD1 3.18Å
1298	V	89.8	Confident	76.8	Confident	45 Å²	45	94.2 Å²	94.2	27%	0.273	46%	0.46	S	S	.	.	H	α-helix	trans	-70.5	-39.9	166	-177.4	0	0	0	0	110.3	I1293 S1294 P1295 L1301 L1302 W1333	I1293-V1298 HydrophobicContact CB-CG2 4Å; I1293-V1298 HydrophobicContact CG2-CG2 3.51Å; S1294-V1298 PolarHBondContact O-N 3.05Å; P1295-V1298 CarbonylContact O-C 3.34Å; P1295-V1298 WeakPolarHBondContact O-CA 3.26Å; P1295-V1298 WeakPolarHBondContact O-CB 3.42Å; P1295-V1298 PolarHBondContact O-N 2.75Å; V1298-L1301 CarbonylContact O-C 3.59Å; V1298-L1301 PolarHBondContact O-N 3.08Å; V1298-L1302 HydrophobicContact CG1-CD1 3.98Å; V1298-L1302 HydrophobicContact CG1-CG 4.27Å; V1298-L1302 WeakPolarHBondContact O-CB 3.17Å; V1298-L1302 VanDerWaalsContact O-CG 3.28Å; V1298-L1302 WeakPolarHBondContact O-CG 3.4Å; V1298-L1302 PolarHBondContact O-N 3.22Å; V1298-W1333 HydrophobicContact CG1-CZ2 4.49Å
1299	E	86.7	Confident	79.7	Confident	113 Å²	113	85.1 Å²	85.1	53%	0.528	43%	0.433	S	S	.	.	H	α-helix	trans	-62.3	-50.2	177	-72.3	137.7	-140	0	0	111.4	P1295 Q1296 L1301 L1302 A1303	P1295-E1299 VanDerWaalsContact C-CD 3.47Å; P1295-E1299 WeakPolarHBondContact CB-OE1 3.34Å; P1295-E1299 VanDerWaalsContact O-CD 3.28Å; P1295-E1299 PolarHBondContact O-N 3.42Å; Q1296-E1299 VanDerWaalsContact CA-OE2 3.31Å; Q1296-E1299 WeakPolarHBondContact CA-OE2 3.49Å; Q1296-E1299 PolarHBondContact O-N 3.18Å; E1299-L1301 PolarHBondContact O-N 3.34Å; E1299-L1302 PolarHBondContact O-N 2.85Å; E1299-L1302 VanDerWaalsContact O-N 3.15Å; E1299-A1303 PolarHBondContact O-N 3.36Å
1300	K	86.8	Confident	82.2	Confident	102 Å²	102	82.7 Å²	82.7	44%	0.443	43%	0.426	S	S	.	.	H	α-helix	trans	-54.3	-49.5	170	-74.9	-174.9	169.8	-176.4	0	111.8	Q1296 L1302 A1303 H1304 E1322 V1323	Q1296-K1300 PolarHBondContact O-N 3.22Å; K1300-L1302 VanDerWaalsContact C-N 3.28Å; K1300-L1302 PolarHBondContact O-N 3.29Å; K1300-A1303 WeakPolarHBondContact O-CB 3.48Å; K1300-A1303 PolarHBondContact O-N 3.1Å; K1300-A1303 VanDerWaalsContact O-N 3.14Å; K1300-H1304 PolarHBondContact O-CD2 2.84Å; K1300-H1304 PolarHBondContact O-N 3.47Å; K1300-E1322 PolarHBondContact NZ-O 3.35Å; K1300-V1323 HydrophobicContact CB-CG2 3.77Å; K1300-V1323 HydrophobicContact CD-CG2 3.97Å
1301	L	92.7	Very high	84.7	Confident	0 Å²	0	72 Å²	72	0%	0	39%	0.386	C	S	.	.	H	α-helix	trans	-61.4	-33.7	178.9	-77.1	168.2	0	0	0	113	I1293 N1297 V1298 E1299 Y1305 I1319 V1323 V1330 W1333 Y1334	I1293-L1301 HydrophobicContact CG2-CD1 4.35Å; N1297-L1301 VanDerWaalsContact O-CB 3.29Å; N1297-L1301 WeakPolarHBondContact O-CB 3.18Å; N1297-L1301 VanDerWaalsContact O-CD1 3.28Å; N1297-L1301 WeakPolarHBondContact O-CD1 3.31Å; N1297-L1301 WeakPolarHBondContact O-CG 3.25Å; N1297-L1301 PolarHBondContact O-N 2.73Å; N1297-L1301 VanDerWaalsContact O-N 3.14Å; V1298-L1301 CarbonylContact O-C 3.59Å; V1298-L1301 PolarHBondContact O-N 3.08Å; E1299-L1301 PolarHBondContact O-N 3.34Å; L1301-Y1305 VanDerWaalsContact O-CB 3.3Å; L1301-Y1305 WeakPolarHBondContact O-CB 3.5Å; L1301-Y1305 PolarHBondContact O-N 3.35Å; L1301-I1319 HydrophobicContact CD2-CG2 3.59Å; L1301-V1323 HydrophobicContact CG-CG1 4.36Å; L1301-V1330 HydrophobicContact CD2-CG1 3.92Å; L1301-V1330 HydrophobicContact CD2-CG2 4.24Å; L1301-W1333 VanDerWaalsContact C-CH2 3.43Å; L1301-W1333 HydrophobicContact CB-CD2 3.98Å; L1301-W1333 HydrophobicContact CB-CE3 3.93Å; L1301-W1333 HydrophobicContact CB-CH2 3.78Å; L1301-W1333 HydrophobicContact CB-CZ2 3.79Å; L1301-W1333 HydrophobicContact CB-CZ3 3.82Å; L1301-W1333 HydrophobicContact CD1-CB 4.42Å; L1301-W1333 HydrophobicContact CD1-CD2 3.96Å; L1301-W1333 HydrophobicContact CD1-CE3 4.4Å; L1301-W1333 HydrophobicContact CD1-CG 3.93Å; L1301-W1333 HydrophobicContact CD2-CE3 4.17Å; L1301-W1333 HydrophobicContact CG-CD2 4.39Å; L1301-W1333 HydrophobicContact CG-CE3 4.41Å; L1301-W1333 WeakPolarHBondContact O-CH2 3.47Å; L1301-W1333 WeakPolarHBondContact O-CZ3 3.33Å; L1301-Y1334 HydrophobicContact CD2-CE2 4.06Å
1302	L	91.1	Very high	85.9	Confident	79 Å²	79	69.8 Å²	69.8	41%	0.414	38%	0.375	S	S	.	.	H	α-helix	trans	-69.9	-43	172.7	-74.2	168.2	0	0	0	111.5	V1298 E1299 K1300 H1304 Y1305 C1306 W1333	V1298-L1302 HydrophobicContact CG1-CD1 3.98Å; V1298-L1302 HydrophobicContact CG1-CG 4.27Å; V1298-L1302 WeakPolarHBondContact O-CB 3.17Å; V1298-L1302 VanDerWaalsContact O-CG 3.28Å; V1298-L1302 WeakPolarHBondContact O-CG 3.4Å; V1298-L1302 PolarHBondContact O-N 3.22Å; E1299-L1302 PolarHBondContact O-N 2.85Å; E1299-L1302 VanDerWaalsContact O-N 3.15Å; K1300-L1302 VanDerWaalsContact C-N 3.28Å; K1300-L1302 PolarHBondContact O-N 3.29Å; L1302-H1304 PolarHBondContact O-N 2.85Å; L1302-Y1305 CarbonylContact O-C 3.56Å; L1302-Y1305 WeakPolarHBondContact O-CA 3.46Å; L1302-Y1305 WeakPolarHBondContact O-CB 3.17Å; L1302-Y1305 PolarHBondContact O-N 2.97Å; L1302-C1306 PolarHBondContact O-N 3.42Å; L1302-C1306 PolarHBondContact O-SG 3.09Å; L1302-C1306 VanDerWaalsContact O-SG 3.33Å; L1302-W1333 HydrophobicContact CD2-CH2 3.98Å; L1302-W1333 HydrophobicContact CD2-CZ2 3.89Å; L1302-W1333 HydrophobicContact CG-CH2 4.25Å; L1302-W1333 HydrophobicContact CG-CZ2 4Å
1303	A	88.5	Confident	87	Confident	56 Å²	56	67.9 Å²	67.9	46%	0.463	38%	0.375	S	S	.	.	H	α-helix	trans	-59.4	-44.5	176	0	0	0	0	0	111.9	E1299 K1300 Y1305 C1306 K1307	E1299-A1303 PolarHBondContact O-N 3.36Å; K1300-A1303 WeakPolarHBondContact O-CB 3.48Å; K1300-A1303 PolarHBondContact O-N 3.1Å; K1300-A1303 VanDerWaalsContact O-N 3.14Å; A1303-Y1305 VanDerWaalsContact C-N 3.32Å; A1303-Y1305 PolarHBondContact O-N 3.25Å; A1303-C1306 PolarHBondContact O-N 3.01Å; A1303-K1307 PolarHBondContact O-N 3.41Å
1304	H	90.4	Very high	87.4	Confident	32 Å²	32	72.5 Å²	72.5	15%	0.148	40%	0.396	C	S	.	.	H	α-helix	trans	-68.2	-28.5	172	-62.4	-79.5	0	0	0	113	K1300 L1302 D1308 I1319 E1322 Y1334	K1300-H1304 PolarHBondContact O-CD2 2.84Å; K1300-H1304 PolarHBondContact O-N 3.47Å; L1302-H1304 PolarHBondContact O-N 2.85Å; H1304-D1308 CarbonylContact O-C 3.53Å; H1304-D1308 PolarHBondContact O-N 2.93Å; H1304-I1319 HydrophobicContact CB-CD1 3.69Å; H1304-I1319 HydrophobicContact CB-CG1 4.15Å; H1304-E1322 IonicContact CE1-OE1 3.64Å; H1304-E1322 IonicContact CE1-OE2 3.83Å; H1304-E1322 PolarHBondContact CE1-OE2 3.49Å; H1304-E1322 IonicContact NE2-OE2 2.74Å; H1304-Y1334 VanDerWaalsContact CB-OH 3.26Å; H1304-Y1334 WeakPolarHBondContact CB-OH 3.34Å; H1304-Y1334 PolarHBondContact O-OH 2.63Å
1305	Y	92.2	Very high	87.6	Confident	26 Å²	26	73.6 Å²	73.6	10%	0.102	40%	0.402	C	S	.	.	H	α-helix	trans	-71.8	-34.9	176.5	-165.3	-86.3	0	0	0	112.8	L1301 L1302 A1303 D1308 P1309 W1333 Y1334 T1337 R1338 E1341	L1301-Y1305 VanDerWaalsContact O-CB 3.3Å; L1301-Y1305 WeakPolarHBondContact O-CB 3.5Å; L1301-Y1305 PolarHBondContact O-N 3.35Å; L1302-Y1305 CarbonylContact O-C 3.56Å; L1302-Y1305 WeakPolarHBondContact O-CA 3.46Å; L1302-Y1305 WeakPolarHBondContact O-CB 3.17Å; L1302-Y1305 PolarHBondContact O-N 2.97Å; A1303-Y1305 VanDerWaalsContact C-N 3.32Å; A1303-Y1305 PolarHBondContact O-N 3.25Å; Y1305-D1308 CarbonylContact O-C 3.59Å; Y1305-D1308 VanDerWaalsContact O-C 3.31Å; Y1305-P1309 HydrophobicContact CD1-CB 4.31Å; Y1305-P1309 HydrophobicContact CE1-CB 3.99Å; Y1305-P1309 HydrophobicContact CE2-CB 4.42Å; Y1305-P1309 WeakPolarHBondContact O-CD 3.44Å; Y1305-P1309 VanDerWaalsContact O-N 3.16Å; Y1305-W1333 HydrophobicContact CD2-CH2 4.03Å; Y1305-W1333 AromaticContact CD2-CZ3 3.64Å; Y1305-W1333 HydrophobicContact CD2-CZ3 3.64Å; Y1305-W1333 HydrophobicContact CE2-CZ3 4.5Å; Y1305-W1333 HydrophobicContact CG-CH2 4.19Å; Y1305-W1333 HydrophobicContact CG-CZ3 4.18Å; Y1305-Y1334 AromaticContact CD2-CD1 3.55Å; Y1305-Y1334 HydrophobicContact CD2-CD1 3.55Å; Y1305-Y1334 AromaticContact CD2-CE1 3.42Å; Y1305-Y1334 HydrophobicContact CD2-CE1 3.42Å; Y1305-Y1334 VanDerWaalsContact CD2-CE1 3.42Å; Y1305-Y1334 HydrophobicContact CD2-CG 4.45Å; Y1305-Y1334 AromaticContact CE2-CD1 3.87Å; Y1305-Y1334 HydrophobicContact CE2-CD1 3.87Å; Y1305-Y1334 HydrophobicContact CE2-CE1 4.15Å; Y1305-Y1334 HydrophobicContact CG-CE1 4.24Å; Y1305-Y1334 PolarHBondContact N-OH 2.91Å; Y1305-T1337 HydrophobicContact CD1-CG2 4.28Å; Y1305-T1337 HydrophobicContact CD2-CG2 3.89Å; Y1305-T1337 HydrophobicContact CE1-CG2 3.91Å; Y1305-T1337 HydrophobicContact CE2-CG2 3.47Å; Y1305-T1337 VanDerWaalsContact CE2-CG2 3.47Å; Y1305-T1337 HydrophobicContact CG-CG2 4.27Å; Y1305-T1337 VanDerWaalsContact CZ-CG2 3.47Å; Y1305-R1338 HydrophobicContact CE2-CG 3.95Å; Y1305-R1338 WeakPolarHBondContact OH-CA 3.48Å; Y1305-R1338 WeakPolarHBondContact OH-CG 3.29Å; Y1305-R1338 PolarHBondContact OH-N 3.18Å; Y1305-E1341 PolarHBondContact OH-OE2 2.82Å
1306	C	86.6	Confident	88	Confident	112 Å²	112	70.8 Å²	70.8	76%	0.757	38%	0.382	S	S	*	.	H	α-helix	trans	-71.9	-32.7	175.3	-65.1	0	0	0	0	112.1	L1302 A1303	L1302-C1306 PolarHBondContact O-N 3.42Å; L1302-C1306 PolarHBondContact O-SG 3.09Å; L1302-C1306 VanDerWaalsContact O-SG 3.33Å; A1303-C1306 PolarHBondContact O-N 3.01Å
1307	K	85.3	Confident	88.4	Confident	170 Å²	170	69.2 Å²	69.2	74%	0.739	37%	0.374	S	S	*	.	H	α-helix	trans	-70.7	-54.7	169.5	-68.1	179.1	179.2	-175.1	0	111.3	A1303	A1303-K1307 PolarHBondContact O-N 3.41Å
1308	D	84.3	Confident	88.4	Confident	85 Å²	85	72.2 Å²	72.2	46%	0.455	39%	0.387	S	S	.	.			trans	-135.5	104.6	-177.9	-94.6	-56.2	0	0	0	110.7	H1304 Y1305 N1310 P1311 Y1334	H1304-D1308 CarbonylContact O-C 3.53Å; H1304-D1308 PolarHBondContact O-N 2.93Å; Y1305-D1308 CarbonylContact O-C 3.59Å; Y1305-D1308 VanDerWaalsContact O-C 3.31Å; D1308-N1310 PolarHBondContact O-N 3.01Å; D1308-P1311 HydrophobicContact CB-CB 4.45Å; D1308-P1311 WeakPolarHBondContact O-CD 2.9Å; D1308-Y1334 WeakPolarHBondContact O-CE1 3.3Å
1309	P	86.4	Confident	88.4	Confident	62 Å²	62	70.2 Å²	70.2	40%	0.403	37%	0.374	S	S	.	.	S	Bend	trans	-74	-8.7	171	28.8	-34.1	0	0	0	112.2	Y1305 R1338	Y1305-P1309 HydrophobicContact CD1-CB 4.31Å; Y1305-P1309 HydrophobicContact CE1-CB 3.99Å; Y1305-P1309 HydrophobicContact CE2-CB 4.42Å; Y1305-P1309 WeakPolarHBondContact O-CD 3.44Å; Y1305-P1309 VanDerWaalsContact O-N 3.16Å; P1309-R1338 WeakPolarHBondContact O-CD 3.23Å; P1309-R1338 PolarHBondContact O-NH1 3.4Å
1310	N	88.2	Confident	88.7	Confident	100 Å²	100	65.4 Å²	65.4	54%	0.535	35%	0.354	S	S	.	.	S	Bend	trans	-136.9	63.2	177.4	-168.9	59.7	0	0	0	113.9	D1308 R1338	D1308-N1310 PolarHBondContact O-N 3.01Å; N1310-R1338 PolarHBondContact OD1-NH1 3.32Å
1311	P	89	Confident	88.8	Confident	6 Å²	6	67 Å²	67	4%	0.039	36%	0.363	C	S	.	.			trans	-62.1	153.6	-179.9	27.9	-36.2	0	0	0	111.9	D1308 V1315 M1316 I1319 Y1334	D1308-P1311 HydrophobicContact CB-CB 4.45Å; D1308-P1311 WeakPolarHBondContact O-CD 2.9Å; P1311-V1315 HydrophobicContact CB-CB 3.9Å; P1311-V1315 HydrophobicContact CB-CG1 3.61Å; P1311-M1316 HydrophobicContact CB-CG 4.2Å; P1311-M1316 HydrophobicContact CG-CG 3.71Å; P1311-I1319 HydrophobicContact CB-CD1 4.23Å; P1311-I1319 HydrophobicContact CG-CD1 4.39Å; P1311-Y1334 HydrophobicContact CG-CD1 3.99Å; P1311-Y1334 HydrophobicContact CG-CD2 4.49Å; P1311-Y1334 HydrophobicContact CG-CE1 3.59Å; P1311-Y1334 HydrophobicContact CG-CE2 4.14Å; P1311-Y1334 HydrophobicContact CG-CG 4.43Å
1312	S	89.1	Confident	88.5	Confident	59 Å²	59	71.9 Å²	71.9	41%	0.413	39%	0.386	S	S	.	.			trans	-66.4	174.1	176.9	86.9	0	0	0	0	112.1	E1314 V1315 M1316	S1312-E1314 PolarHBondContact O-N 3Å; S1312-E1314 WeakPolarHBondContact OG-CB 3.23Å; S1312-E1314 PolarHBondContact OG-N 3.02Å; S1312-E1314 VanDerWaalsContact OG-N 3.09Å; S1312-V1315 PolarHBondContact OG-N 2.74Å; S1312-M1316 VanDerWaalsContact O-CB 3.31Å; S1312-M1316 WeakPolarHBondContact O-CB 3.49Å; S1312-M1316 WeakPolarHBondContact O-CE 3.47Å; S1312-M1316 WeakPolarHBondContact O-CG 3.12Å; S1312-M1316 PolarHBondContact O-N 2.83Å
1313	S	85.7	Confident	88.2	Confident	67 Å²	67	68.4 Å²	68.4	47%	0.469	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-36.5	170.7	-176.1	0	0	0	0	111.5	H1317 K1327	S1313-H1317 PolarHBondContact O-N 3.45Å; S1313-K1327 WeakPolarHBondContact O-CE 3.22Å; S1313-K1327 PolarHBondContact O-NZ 3.5Å; S1313-K1327 PolarHBondContact OG-NZ 3.33Å
1314	E	87.9	Confident	88.1	Confident	142 Å²	142	69 Å²	69	66%	0.664	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-43.8	-174.4	-171	157.4	-138.8	0	0	111.8	S1312 M1316 H1317 Q1318	S1312-E1314 PolarHBondContact O-N 3Å; S1312-E1314 WeakPolarHBondContact OG-CB 3.23Å; S1312-E1314 PolarHBondContact OG-N 3.02Å; S1312-E1314 VanDerWaalsContact OG-N 3.09Å; E1314-M1316 VanDerWaalsContact C-N 3.29Å; E1314-M1316 PolarHBondContact O-N 3.23Å; E1314-H1317 VanDerWaalsContact O-CA 3.29Å; E1314-H1317 WeakPolarHBondContact O-CA 3.15Å; E1314-H1317 WeakPolarHBondContact O-CB 3.15Å; E1314-H1317 PolarHBondContact O-N 2.82Å; E1314-Q1318 PolarHBondContact O-N 3.12Å
1315	V	87.4	Confident	88	Confident	44 Å²	44	68.6 Å²	68.6	27%	0.267	38%	0.378	S	S	.	.	H	α-helix	trans	-63.2	-35.7	170.4	179.1	0	0	0	0	110.7	P1311 S1312 H1317 Q1318 I1319	P1311-V1315 HydrophobicContact CB-CB 3.9Å; P1311-V1315 HydrophobicContact CB-CG1 3.61Å; S1312-V1315 PolarHBondContact OG-N 2.74Å; V1315-H1317 PolarHBondContact O-N 2.78Å; V1315-Q1318 PolarHBondContact O-N 3.03Å; V1315-I1319 HydrophobicContact CG1-CD1 3.71Å; V1315-I1319 HydrophobicContact CG1-CG1 4.22Å; V1315-I1319 WeakPolarHBondContact O-CB 3.05Å; V1315-I1319 WeakPolarHBondContact O-CG1 3.16Å; V1315-I1319 PolarHBondContact O-N 3.02Å
1316	M	90.2	Very high	87.9	Confident	24 Å²	24	70.9 Å²	70.9	12%	0.118	40%	0.398	C	S	.	.	H	α-helix	trans	-68.1	-6.8	167.6	-78.9	-170.5	-79.5	0	0	114.8	P1311 S1312 E1314 A1320 K1327 Q1331	P1311-M1316 HydrophobicContact CB-CG 4.2Å; P1311-M1316 HydrophobicContact CG-CG 3.71Å; S1312-M1316 VanDerWaalsContact O-CB 3.31Å; S1312-M1316 WeakPolarHBondContact O-CB 3.49Å; S1312-M1316 WeakPolarHBondContact O-CE 3.47Å; S1312-M1316 WeakPolarHBondContact O-CG 3.12Å; S1312-M1316 PolarHBondContact O-N 2.83Å; E1314-M1316 VanDerWaalsContact C-N 3.29Å; E1314-M1316 PolarHBondContact O-N 3.23Å; M1316-A1320 WeakPolarHBondContact O-CB 3.23Å; M1316-K1327 WeakPolarHBondContact O-CG 3.34Å; M1316-Q1331 HydrophobicContact SD-CB 4.21Å; M1316-Q1331 HydrophobicContact SD-CG 4.29Å
1317	H	90.4	Very high	88.1	Confident	96 Å²	96	68 Å²	68	44%	0.444	37%	0.373	S	S	.	.	H	α-helix	trans	-90.4	-49.4	167.4	-152.7	-76.5	0	0	0	110.7	S1313 E1314 V1315 I1319 A1320 E1321 K1327	S1313-H1317 PolarHBondContact O-N 3.45Å; E1314-H1317 VanDerWaalsContact O-CA 3.29Å; E1314-H1317 WeakPolarHBondContact O-CA 3.15Å; E1314-H1317 WeakPolarHBondContact O-CB 3.15Å; E1314-H1317 PolarHBondContact O-N 2.82Å; V1315-H1317 PolarHBondContact O-N 2.78Å; H1317-I1319 PolarHBondContact O-N 3.24Å; H1317-A1320 CarbonylContact O-C 3.54Å; H1317-A1320 WeakPolarHBondContact O-CA 3.35Å; H1317-A1320 VanDerWaalsContact O-CB 3.26Å; H1317-A1320 WeakPolarHBondContact O-CB 3.21Å; H1317-A1320 PolarHBondContact O-N 3.05Å; H1317-E1321 IonicContact CE1-OE2 2.71Å; H1317-E1321 PolarHBondContact CE1-OE2 2.78Å; H1317-E1321 IonicContact ND1-OE2 3.71Å; H1317-E1321 PolarHBondContact ND1-OE2 3.27Å; H1317-E1321 PolarHBondContact O-N 3.31Å; H1317-K1327 HydrophobicContact CB-CD 4.12Å
1318	Q	88.6	Confident	88.2	Confident	97 Å²	97	68.6 Å²	68.6	45%	0.453	37%	0.37	S	S	.	.	H	α-helix	trans	-54.3	-50.9	175.2	-68.2	161.8	-24.7	0	0	110.9	E1314 V1315 A1320 E1321 E1322	E1314-Q1318 PolarHBondContact O-N 3.12Å; V1315-Q1318 PolarHBondContact O-N 3.03Å; Q1318-A1320 PolarHBondContact O-N 2.85Å; Q1318-A1320 VanDerWaalsContact O-N 3.16Å; Q1318-E1321 CarbonylContact O-C 3.57Å; Q1318-E1321 WeakPolarHBondContact O-CA 2.89Å; Q1318-E1321 WeakPolarHBondContact O-CB 3.15Å; Q1318-E1321 PolarHBondContact O-N 3.42Å; Q1318-E1322 WeakPolarHBondContact O-CB 3.18Å; Q1318-E1322 WeakPolarHBondContact O-CG 3.2Å; Q1318-E1322 PolarHBondContact O-N 2.83Å
1319	I	89.8	Confident	88.4	Confident	2 Å²	2	66.3 Å²	66.3	1%	0.01	36%	0.359	C	S	.	.	H	α-helix	trans	-59.8	-29.3	173.5	-63	168.5	0	0	0	112.6	L1301 H1304 P1311 V1315 H1317 V1323 V1330 Y1334	L1301-I1319 HydrophobicContact CD2-CG2 3.59Å; H1304-I1319 HydrophobicContact CB-CD1 3.69Å; H1304-I1319 HydrophobicContact CB-CG1 4.15Å; P1311-I1319 HydrophobicContact CB-CD1 4.23Å; P1311-I1319 HydrophobicContact CG-CD1 4.39Å; V1315-I1319 HydrophobicContact CG1-CD1 3.71Å; V1315-I1319 HydrophobicContact CG1-CG1 4.22Å; V1315-I1319 WeakPolarHBondContact O-CB 3.05Å; V1315-I1319 WeakPolarHBondContact O-CG1 3.16Å; V1315-I1319 PolarHBondContact O-N 3.02Å; H1317-I1319 PolarHBondContact O-N 3.24Å; I1319-V1323 HydrophobicContact CG2-CG2 4.13Å; I1319-V1323 WeakPolarHBondContact O-CB 3.36Å; I1319-V1323 WeakPolarHBondContact O-CG2 3.3Å; I1319-V1323 PolarHBondContact O-N 3.02Å; I1319-V1330 HydrophobicContact CB-CG1 4.48Å; I1319-V1330 HydrophobicContact CG2-CG1 3.89Å; I1319-Y1334 HydrophobicContact CD1-CE2 4.33Å
1320	A	91.8	Very high	88.7	Confident	12 Å²	12	63.4 Å²	63.4	10%	0.099	34%	0.34	C	S	.	.	H	α-helix	trans	-74.8	-32.5	176.4	0	0	0	0	0	112.5	M1316 H1317 Q1318 G1324 I1325 K1327 V1330	M1316-A1320 WeakPolarHBondContact O-CB 3.23Å; H1317-A1320 CarbonylContact O-C 3.54Å; H1317-A1320 WeakPolarHBondContact O-CA 3.35Å; H1317-A1320 VanDerWaalsContact O-CB 3.26Å; H1317-A1320 WeakPolarHBondContact O-CB 3.21Å; H1317-A1320 PolarHBondContact O-N 3.05Å; Q1318-A1320 PolarHBondContact O-N 2.85Å; Q1318-A1320 VanDerWaalsContact O-N 3.16Å; A1320-G1324 PolarHBondContact O-N 3.1Å; A1320-I1325 VanDerWaalsContact CA-O 3.23Å; A1320-I1325 WeakPolarHBondContact CA-O 3.5Å; A1320-I1325 WeakPolarHBondContact CB-O 3.32Å; A1320-I1325 PolarHBondContact O-N 3.37Å; A1320-K1327 HydrophobicContact CB-CB 3.92Å; A1320-V1330 HydrophobicContact CB-CG2 4.05Å
1321	E	88.6	Confident	88.9	Confident	135 Å²	135	60.8 Å²	60.8	63%	0.631	33%	0.325	S	S	*	.	H	α-helix	trans	-72.3	-58.2	173.2	-114.1	155.6	127.2	0	0	111.3	H1317 Q1318 V1323 G1324	H1317-E1321 IonicContact CE1-OE2 2.71Å; H1317-E1321 PolarHBondContact CE1-OE2 2.78Å; H1317-E1321 IonicContact ND1-OE2 3.71Å; H1317-E1321 PolarHBondContact ND1-OE2 3.27Å; H1317-E1321 PolarHBondContact O-N 3.31Å; Q1318-E1321 CarbonylContact O-C 3.57Å; Q1318-E1321 WeakPolarHBondContact O-CA 2.89Å; Q1318-E1321 WeakPolarHBondContact O-CB 3.15Å; Q1318-E1321 PolarHBondContact O-N 3.42Å; E1321-V1323 PolarHBondContact O-N 3.44Å; E1321-V1323 VanDerWaalsContact O-N 3.07Å; E1321-G1324 PolarHBondContact O-N 3.03Å
1322	E	86.9	Confident	88.9	Confident	104 Å²	104	63.6 Å²	63.6	49%	0.486	34%	0.342	S	S	.	.	H	α-helix	trans	-56.6	-27.2	-179.2	-69.5	173.4	-111.4	0	0	113.8	K1300 H1304 Q1318	K1300-E1322 PolarHBondContact NZ-O 3.35Å; H1304-E1322 IonicContact CE1-OE1 3.64Å; H1304-E1322 IonicContact CE1-OE2 3.83Å; H1304-E1322 PolarHBondContact CE1-OE2 3.49Å; H1304-E1322 IonicContact NE2-OE2 2.74Å; Q1318-E1322 WeakPolarHBondContact O-CB 3.18Å; Q1318-E1322 WeakPolarHBondContact O-CG 3.2Å; Q1318-E1322 PolarHBondContact O-N 2.83Å
1323	V	84.3	Confident	89.1	Confident	6 Å²	6	62 Å²	62	4%	0.036	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103	-8.4	-179.2	-173	0	0	0	0	111.9	N1297 K1300 L1301 I1319 E1321 I1325	N1297-V1323 HydrophobicContact CB-CG1 3.45Å; N1297-V1323 VanDerWaalsContact CB-CG1 3.45Å; N1297-V1323 PolarHBondContact ND2-O 3.4Å; K1300-V1323 HydrophobicContact CB-CG2 3.77Å; K1300-V1323 HydrophobicContact CD-CG2 3.97Å; L1301-V1323 HydrophobicContact CG-CG1 4.36Å; I1319-V1323 HydrophobicContact CG2-CG2 4.13Å; I1319-V1323 WeakPolarHBondContact O-CB 3.36Å; I1319-V1323 WeakPolarHBondContact O-CG2 3.3Å; I1319-V1323 PolarHBondContact O-N 3.02Å; E1321-V1323 PolarHBondContact O-N 3.44Å; E1321-V1323 VanDerWaalsContact O-N 3.07Å; V1323-I1325 VanDerWaalsContact C-N 3.27Å; V1323-I1325 HydrophobicContact CG1-CB 4.31Å; V1323-I1325 HydrophobicContact CG1-CD1 3.94Å; V1323-I1325 HydrophobicContact CG1-CG1 4.1Å; V1323-I1325 PolarHBondContact O-N 3.47Å
1324	G	87.7	Confident	89.6	Confident	69 Å²	69	58.9 Å²	58.9	71%	0.711	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.4	33.3	-177	0	0	0	0	0	113.5	A1320 E1321	A1320-G1324 PolarHBondContact O-N 3.1Å; E1321-G1324 PolarHBondContact O-N 3.03Å
1325	I	88.2	Confident	89.5	Confident	23 Å²	23	57 Å²	57	12%	0.118	30%	0.296	C	S	.	.			trans	-131.4	124.5	-175	-72.5	-174	0	0	0	109.8	I1293 N1297 A1320 V1323 K1327 V1329 V1330	I1293-I1325 HydrophobicContact CB-CD1 4.35Å; I1293-I1325 HydrophobicContact CG1-CD1 4.23Å; I1293-I1325 HydrophobicContact CG2-CD1 3.65Å; N1297-I1325 HydrophobicContact CB-CD1 3.69Å; N1297-I1325 WeakPolarHBondContact ND2-CD1 3.18Å; A1320-I1325 VanDerWaalsContact CA-O 3.23Å; A1320-I1325 WeakPolarHBondContact CA-O 3.5Å; A1320-I1325 WeakPolarHBondContact CB-O 3.32Å; A1320-I1325 PolarHBondContact O-N 3.37Å; V1323-I1325 VanDerWaalsContact C-N 3.27Å; V1323-I1325 HydrophobicContact CG1-CB 4.31Å; V1323-I1325 HydrophobicContact CG1-CD1 3.94Å; V1323-I1325 HydrophobicContact CG1-CG1 4.1Å; V1323-I1325 PolarHBondContact O-N 3.47Å; I1325-K1327 PolarHBondContact O-N 2.96Å; I1325-V1329 HydrophobicContact CG2-CB 3.57Å; I1325-V1329 HydrophobicContact CG2-CG1 3.51Å; I1325-V1330 HydrophobicContact CB-CG2 4.35Å; I1325-V1330 HydrophobicContact CG2-CG2 3.98Å; I1325-V1330 WeakPolarHBondContact O-CG2 3.29Å
1326	S	90.2	Very high	89.5	Confident	74 Å²	74	59.2 Å²	59.2	52%	0.517	31%	0.306	S	S	.	.			trans	-46.6	136.5	-177.7	72.2	0	0	0	0	113.7	R1328 V1329 V1330	S1326-R1328 CarbonylContact O-C 3.59Å; S1326-R1328 PolarHBondContact O-N 2.9Å; S1326-V1329 WeakPolarHBondContact O-CA 3.34Å; S1326-V1329 PolarHBondContact O-N 2.85Å; S1326-V1330 PolarHBondContact O-N 3.22Å; S1326-V1330 VanDerWaalsContact O-N 3.09Å
1327	K	89.2	Confident	89.5	Confident	50 Å²	50	59 Å²	59	22%	0.217	31%	0.306	C	S	.	.	H	α-helix	trans	-51.1	-18.8	177	178.7	164.9	176.8	172.3	0	114.4	S1313 M1316 H1317 A1320 I1325 Q1331	S1313-K1327 WeakPolarHBondContact O-CE 3.22Å; S1313-K1327 PolarHBondContact O-NZ 3.5Å; S1313-K1327 PolarHBondContact OG-NZ 3.33Å; M1316-K1327 WeakPolarHBondContact O-CG 3.34Å; H1317-K1327 HydrophobicContact CB-CD 4.12Å; A1320-K1327 HydrophobicContact CB-CB 3.92Å; I1325-K1327 PolarHBondContact O-N 2.96Å; K1327-Q1331 WeakPolarHBondContact O-CB 3.33Å; K1327-Q1331 PolarHBondContact O-N 2.92Å; K1327-Q1331 VanDerWaalsContact O-N 3.15Å
1328	R	88.6	Confident	89.4	Confident	184 Å²	184	57 Å²	57	69%	0.694	30%	0.295	S	S	*	.	H	α-helix	trans	-75.9	-42.5	170.9	-166.3	179.3	-168.4	107.1	4.6	112.6	S1326 V1332	S1326-R1328 CarbonylContact O-C 3.59Å; S1326-R1328 PolarHBondContact O-N 2.9Å; R1328-V1332 WeakPolarHBondContact O-CB 3.43Å; R1328-V1332 VanDerWaalsContact O-CG2 3.27Å; R1328-V1332 WeakPolarHBondContact O-CG2 3.31Å; R1328-V1332 PolarHBondContact O-N 2.95Å
1329	V	88.9	Confident	88.8	Confident	37 Å²	37	53.3 Å²	53.3	22%	0.224	28%	0.281	C	S	.	.	H	α-helix	trans	-70.7	-41.2	176.8	174.4	0	0	0	0	110.4	I1293 I1325 S1326 V1332 W1333	I1293-V1329 HydrophobicContact CD1-CG1 3.85Å; I1293-V1329 HydrophobicContact CG1-CG1 4.07Å; I1325-V1329 HydrophobicContact CG2-CB 3.57Å; I1325-V1329 HydrophobicContact CG2-CG1 3.51Å; S1326-V1329 WeakPolarHBondContact O-CA 3.34Å; S1326-V1329 PolarHBondContact O-N 2.85Å; V1329-V1332 PolarHBondContact O-N 3.35Å; V1329-W1333 WeakPolarHBondContact O-CB 3.41Å; V1329-W1333 PolarHBondContact O-N 2.88Å
1330	V	92.7	Very high	88.2	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-56.9	-50.6	170.9	177.5	0	0	0	0	111	L1301 I1319 A1320 I1325 S1326 V1332 W1333 Y1334	L1301-V1330 HydrophobicContact CD2-CG1 3.92Å; L1301-V1330 HydrophobicContact CD2-CG2 4.24Å; I1319-V1330 HydrophobicContact CB-CG1 4.48Å; I1319-V1330 HydrophobicContact CG2-CG1 3.89Å; A1320-V1330 HydrophobicContact CB-CG2 4.05Å; I1325-V1330 HydrophobicContact CB-CG2 4.35Å; I1325-V1330 HydrophobicContact CG2-CG2 3.98Å; I1325-V1330 WeakPolarHBondContact O-CG2 3.29Å; S1326-V1330 PolarHBondContact O-N 3.22Å; S1326-V1330 VanDerWaalsContact O-N 3.09Å; V1330-V1332 VanDerWaalsContact C-N 3.33Å; V1330-V1332 PolarHBondContact O-N 3Å; V1330-W1333 WeakPolarHBondContact O-CB 3.26Å; V1330-W1333 PolarHBondContact O-N 3.11Å; V1330-W1333 VanDerWaalsContact O-N 3.16Å; V1330-Y1334 HydrophobicContact CG1-CD2 3.82Å; V1330-Y1334 HydrophobicContact CG1-CE2 4.03Å; V1330-Y1334 PolarHBondContact O-N 3.39Å
1331	Q	91.1	Very high	87.4	Confident	46 Å²	46	64.3 Å²	64.3	22%	0.215	32%	0.323	C	S	.	.	H	α-helix	trans	-60.4	-39.5	178	-175.4	179.4	21.1	0	0	112.9	M1316 K1327 Q1335	M1316-Q1331 HydrophobicContact SD-CB 4.21Å; M1316-Q1331 HydrophobicContact SD-CG 4.29Å; K1327-Q1331 WeakPolarHBondContact O-CB 3.33Å; K1327-Q1331 PolarHBondContact O-N 2.92Å; K1327-Q1331 VanDerWaalsContact O-N 3.15Å; Q1331-Q1335 WeakPolarHBondContact O-CB 3.15Å; Q1331-Q1335 VanDerWaalsContact O-CG 3.26Å; Q1331-Q1335 WeakPolarHBondContact O-CG 3.44Å; Q1331-Q1335 PolarHBondContact O-N 3.03Å
1332	V	90.2	Very high	86.4	Confident	64 Å²	64	65.3 Å²	65.3	39%	0.388	32%	0.321	S	S	.	.	H	α-helix	trans	-70.3	-36.8	176.2	166.8	0	0	0	0	111.5	R1328 V1329 V1330 Q1335 N1336	R1328-V1332 WeakPolarHBondContact O-CB 3.43Å; R1328-V1332 VanDerWaalsContact O-CG2 3.27Å; R1328-V1332 WeakPolarHBondContact O-CG2 3.31Å; R1328-V1332 PolarHBondContact O-N 2.95Å; V1329-V1332 PolarHBondContact O-N 3.35Å; V1330-V1332 VanDerWaalsContact C-N 3.33Å; V1330-V1332 PolarHBondContact O-N 3Å; V1332-Q1335 PolarHBondContact O-N 3.18Å; V1332-N1336 WeakPolarHBondContact CG1-ND2 3.46Å; V1332-N1336 VanDerWaalsContact O-CB 3.3Å; V1332-N1336 WeakPolarHBondContact O-CB 3.5Å; V1332-N1336 VanDerWaalsContact O-CG 3.24Å; V1332-N1336 PolarHBondContact O-N 3.5Å; V1332-N1336 PolarHBondContact O-ND2 3.44Å
1333	W	92.6	Very high	85.3	Confident	27 Å²	27	69.4 Å²	69.4	10%	0.102	33%	0.332	C	S	.	.	H	α-helix	trans	-62	-54.4	173	-175.3	96.8	0	0	0	110.1	I1293 V1298 L1301 L1302 Y1305 V1329 V1330 Q1335 N1336 T1337	I1293-W1333 HydrophobicContact CD1-CB 4.38Å; I1293-W1333 HydrophobicContact CD1-CG 4.32Å; V1298-W1333 HydrophobicContact CG1-CZ2 4.49Å; L1301-W1333 VanDerWaalsContact C-CH2 3.43Å; L1301-W1333 HydrophobicContact CB-CD2 3.98Å; L1301-W1333 HydrophobicContact CB-CE3 3.93Å; L1301-W1333 HydrophobicContact CB-CH2 3.78Å; L1301-W1333 HydrophobicContact CB-CZ2 3.79Å; L1301-W1333 HydrophobicContact CB-CZ3 3.82Å; L1301-W1333 HydrophobicContact CD1-CB 4.42Å; L1301-W1333 HydrophobicContact CD1-CD2 3.96Å; L1301-W1333 HydrophobicContact CD1-CE3 4.4Å; L1301-W1333 HydrophobicContact CD1-CG 3.93Å; L1301-W1333 HydrophobicContact CD2-CE3 4.17Å; L1301-W1333 HydrophobicContact CG-CD2 4.39Å; L1301-W1333 HydrophobicContact CG-CE3 4.41Å; L1301-W1333 WeakPolarHBondContact O-CH2 3.47Å; L1301-W1333 WeakPolarHBondContact O-CZ3 3.33Å; L1302-W1333 HydrophobicContact CD2-CH2 3.98Å; L1302-W1333 HydrophobicContact CD2-CZ2 3.89Å; L1302-W1333 HydrophobicContact CG-CH2 4.25Å; L1302-W1333 HydrophobicContact CG-CZ2 4Å; Y1305-W1333 HydrophobicContact CD2-CH2 4.03Å; Y1305-W1333 AromaticContact CD2-CZ3 3.64Å; Y1305-W1333 HydrophobicContact CD2-CZ3 3.64Å; Y1305-W1333 HydrophobicContact CE2-CZ3 4.5Å; Y1305-W1333 HydrophobicContact CG-CH2 4.19Å; Y1305-W1333 HydrophobicContact CG-CZ3 4.18Å; V1329-W1333 WeakPolarHBondContact O-CB 3.41Å; V1329-W1333 PolarHBondContact O-N 2.88Å; V1330-W1333 WeakPolarHBondContact O-CB 3.26Å; V1330-W1333 PolarHBondContact O-N 3.11Å; V1330-W1333 VanDerWaalsContact O-N 3.16Å; W1333-Q1335 VanDerWaalsContact C-N 3.27Å; W1333-Q1335 PolarHBondContact O-N 3.4Å; W1333-N1336 CarbonylContact O-C 3.31Å; W1333-N1336 WeakPolarHBondContact O-CA 3.44Å; W1333-N1336 PolarHBondContact O-N 3.17Å; W1333-T1337 HydrophobicContact CH2-CG2 4.18Å; W1333-T1337 HydrophobicContact CZ2-CG2 4.49Å; W1333-T1337 PolarHBondContact O-N 3.46Å; W1333-T1337 PolarHBondContact O-OG1 2.96Å; W1333-T1337 VanDerWaalsContact O-OG1 3.09Å
1334	Y	95.2	Very high	83.8	Confident	0 Å²	0	71.7 Å²	71.7	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-58.7	-33.8	176	-93.1	-88.2	0	0	0	113.4	L1301 H1304 Y1305 D1308 P1311 I1319 V1330 R1338	L1301-Y1334 HydrophobicContact CD2-CE2 4.06Å; H1304-Y1334 VanDerWaalsContact CB-OH 3.26Å; H1304-Y1334 WeakPolarHBondContact CB-OH 3.34Å; H1304-Y1334 PolarHBondContact O-OH 2.63Å; Y1305-Y1334 AromaticContact CD2-CD1 3.55Å; Y1305-Y1334 HydrophobicContact CD2-CD1 3.55Å; Y1305-Y1334 AromaticContact CD2-CE1 3.42Å; Y1305-Y1334 HydrophobicContact CD2-CE1 3.42Å; Y1305-Y1334 VanDerWaalsContact CD2-CE1 3.42Å; Y1305-Y1334 HydrophobicContact CD2-CG 4.45Å; Y1305-Y1334 AromaticContact CE2-CD1 3.87Å; Y1305-Y1334 HydrophobicContact CE2-CD1 3.87Å; Y1305-Y1334 HydrophobicContact CE2-CE1 4.15Å; Y1305-Y1334 HydrophobicContact CG-CE1 4.24Å; Y1305-Y1334 PolarHBondContact N-OH 2.91Å; D1308-Y1334 WeakPolarHBondContact O-CE1 3.3Å; P1311-Y1334 HydrophobicContact CG-CD1 3.99Å; P1311-Y1334 HydrophobicContact CG-CD2 4.49Å; P1311-Y1334 HydrophobicContact CG-CE1 3.59Å; P1311-Y1334 HydrophobicContact CG-CE2 4.14Å; P1311-Y1334 HydrophobicContact CG-CG 4.43Å; I1319-Y1334 HydrophobicContact CD1-CE2 4.33Å; V1330-Y1334 HydrophobicContact CG1-CD2 3.82Å; V1330-Y1334 HydrophobicContact CG1-CE2 4.03Å; V1330-Y1334 PolarHBondContact O-N 3.39Å; Y1334-R1338 WeakPolarHBondContact O-CB 3.33Å; Y1334-R1338 WeakPolarHBondContact O-CG 3.11Å; Y1334-R1338 PolarHBondContact O-N 3.3Å; Y1334-R1338 PolarHBondContact O-NE 3.16Å
1335	Q	87	Confident	82.3	Confident	102 Å²	102	71.7 Å²	71.7	48%	0.477	33%	0.333	S	S	.	.	H	α-helix	trans	-69.3	-39.9	172.4	-77.9	177.5	13.7	0	0	112.6	Q1331 V1332 W1333 A1339	Q1331-Q1335 WeakPolarHBondContact O-CB 3.15Å; Q1331-Q1335 VanDerWaalsContact O-CG 3.26Å; Q1331-Q1335 WeakPolarHBondContact O-CG 3.44Å; Q1331-Q1335 PolarHBondContact O-N 3.03Å; V1332-Q1335 PolarHBondContact O-N 3.18Å; W1333-Q1335 VanDerWaalsContact C-N 3.27Å; W1333-Q1335 PolarHBondContact O-N 3.4Å; Q1335-A1339 VanDerWaalsContact O-CB 3.23Å; Q1335-A1339 WeakPolarHBondContact O-CB 3.43Å; Q1335-A1339 PolarHBondContact O-N 3.4Å
1336	N	88	Confident	80	Confident	92 Å²	92	73.3 Å²	73.3	49%	0.492	36%	0.356	S	S	.	.	H	α-helix	trans	-75	-37.3	179.6	-75.3	-30.1	0	0	0	112.6	V1332 W1333 A1339 R1340	V1332-N1336 WeakPolarHBondContact CG1-ND2 3.46Å; V1332-N1336 VanDerWaalsContact O-CB 3.3Å; V1332-N1336 WeakPolarHBondContact O-CB 3.5Å; V1332-N1336 VanDerWaalsContact O-CG 3.24Å; V1332-N1336 PolarHBondContact O-N 3.5Å; V1332-N1336 PolarHBondContact O-ND2 3.44Å; W1333-N1336 CarbonylContact O-C 3.31Å; W1333-N1336 WeakPolarHBondContact O-CA 3.44Å; W1333-N1336 PolarHBondContact O-N 3.17Å; N1336-A1339 CarbonylContact O-C 3.56Å; N1336-A1339 PolarHBondContact O-N 3.01Å; N1336-A1339 VanDerWaalsContact O-N 3.14Å; N1336-R1340 WeakPolarHBondContact O-CB 3.42Å; N1336-R1340 PolarHBondContact O-N 2.87Å
1337	T	88.4	Confident	77.6	Confident	19 Å²	19	75 Å²	75	12%	0.117	36%	0.363	C	S	.	.	H	α-helix	trans	-63.3	-51.5	173.4	-53.6	0	0	0	0	109.6	Y1305 W1333 A1339 R1340 E1341	Y1305-T1337 HydrophobicContact CD1-CG2 4.28Å; Y1305-T1337 HydrophobicContact CD2-CG2 3.89Å; Y1305-T1337 HydrophobicContact CE1-CG2 3.91Å; Y1305-T1337 HydrophobicContact CE2-CG2 3.47Å; Y1305-T1337 VanDerWaalsContact CE2-CG2 3.47Å; Y1305-T1337 HydrophobicContact CG-CG2 4.27Å; Y1305-T1337 VanDerWaalsContact CZ-CG2 3.47Å; W1333-T1337 HydrophobicContact CH2-CG2 4.18Å; W1333-T1337 HydrophobicContact CZ2-CG2 4.49Å; W1333-T1337 PolarHBondContact O-N 3.46Å; W1333-T1337 PolarHBondContact O-OG1 2.96Å; W1333-T1337 VanDerWaalsContact O-OG1 3.09Å; T1337-A1339 PolarHBondContact O-N 2.85Å; T1337-A1339 VanDerWaalsContact O-N 3.1Å; T1337-R1340 WeakPolarHBondContact O-CA 3.37Å; T1337-R1340 WeakPolarHBondContact O-CB 3.26Å; T1337-R1340 PolarHBondContact O-N 3Å; T1337-E1341 WeakPolarHBondContact O-CB 3.35Å; T1337-E1341 PolarHBondContact O-N 3.3Å
1338	R	88.7	Confident	75.4	Confident	53 Å²	53	78 Å²	78	20%	0.2	38%	0.377	C	S	.	.	H	α-helix	trans	-62.3	-17.8	170.8	-72.8	177.5	-72.2	-156.2	11.7	114.6	Y1305 P1309 N1310 Y1334 R1342	Y1305-R1338 HydrophobicContact CE2-CG 3.95Å; Y1305-R1338 WeakPolarHBondContact OH-CA 3.48Å; Y1305-R1338 WeakPolarHBondContact OH-CG 3.29Å; Y1305-R1338 PolarHBondContact OH-N 3.18Å; P1309-R1338 WeakPolarHBondContact O-CD 3.23Å; P1309-R1338 PolarHBondContact O-NH1 3.4Å; N1310-R1338 PolarHBondContact OD1-NH1 3.32Å; Y1334-R1338 WeakPolarHBondContact O-CB 3.33Å; Y1334-R1338 WeakPolarHBondContact O-CG 3.11Å; Y1334-R1338 PolarHBondContact O-N 3.3Å; Y1334-R1338 PolarHBondContact O-NE 3.16Å; R1338-R1342 WeakPolarHBondContact O-CB 3.46Å; R1338-R1342 VanDerWaalsContact O-CG 3.23Å; R1338-R1342 WeakPolarHBondContact O-CG 3.37Å; R1338-R1342 PolarHBondContact O-N 3.17Å; R1338-R1342 PolarHBondContact O-NE 3.03Å
1339	A	76.5	Confident	73	Confident	20 Å²	20	76.9 Å²	76.9	17%	0.165	38%	0.378	C	S	.	.	H	α-helix	trans	-87.8	-27.3	172.8	0	0	0	0	0	112.9	Q1335 N1336 T1337 R1343	Q1335-A1339 VanDerWaalsContact O-CB 3.23Å; Q1335-A1339 WeakPolarHBondContact O-CB 3.43Å; Q1335-A1339 PolarHBondContact O-N 3.4Å; N1336-A1339 CarbonylContact O-C 3.56Å; N1336-A1339 PolarHBondContact O-N 3.01Å; N1336-A1339 VanDerWaalsContact O-N 3.14Å; T1337-A1339 PolarHBondContact O-N 2.85Å; T1337-A1339 VanDerWaalsContact O-N 3.1Å; A1339-R1343 WeakPolarHBondContact O-CD 3.28Å; A1339-R1343 VanDerWaalsContact O-CG 3.25Å; A1339-R1343 WeakPolarHBondContact O-CG 3.38Å; A1339-R1343 PolarHBondContact O-N 3.28Å
1340	R	76.4	Confident	70.4	Confident	172 Å²	172	79 Å²	79	65%	0.649	41%	0.407	S	S	*	.	H	α-helix	trans	-73.3	-46.3	170.4	-165.2	-165.8	-49.8	-98.2	3.8	110.1	N1336 T1337 R1343 A1344	N1336-R1340 WeakPolarHBondContact O-CB 3.42Å; N1336-R1340 PolarHBondContact O-N 2.87Å; T1337-R1340 WeakPolarHBondContact O-CA 3.37Å; T1337-R1340 WeakPolarHBondContact O-CB 3.26Å; T1337-R1340 PolarHBondContact O-N 3Å; R1340-R1343 WeakPolarHBondContact O-CA 3.43Å; R1340-R1343 WeakPolarHBondContact O-CB 3.42Å; R1340-R1343 PolarHBondContact O-N 2.7Å; R1340-A1344 PolarHBondContact O-N 2.76Å
1341	E	75.2	Confident	67.7	Low	74 Å²	74	85.4 Å²	85.4	35%	0.346	44%	0.437	S	S	.	.	H	α-helix	trans	-60	-47.7	175.1	-166.1	-162.2	137.8	0	0	111.5	Y1305 T1337 R1343 A1344 Q1345	Y1305-E1341 PolarHBondContact OH-OE2 2.82Å; T1337-E1341 WeakPolarHBondContact O-CB 3.35Å; T1337-E1341 PolarHBondContact O-N 3.3Å; E1341-R1343 PolarHBondContact O-N 2.82Å; E1341-R1343 VanDerWaalsContact O-N 3.16Å; E1341-A1344 PolarHBondContact O-N 3.42Å; E1341-A1344 VanDerWaalsContact O-N 3.16Å; E1341-Q1345 WeakPolarHBondContact O-CB 3.34Å; E1341-Q1345 WeakPolarHBondContact O-CG 3.46Å; E1341-Q1345 PolarHBondContact O-N 3.21Å; E1341-Q1345 PolarHBondContact OE1-NE2 3.35Å
1342	R	67.5	Low	65.5	Low	156 Å²	156	93.7 Å²	93.7	59%	0.589	47%	0.466	S	S	*	.	H	α-helix	trans	-67.8	-8.7	172.6	-73.8	-179.6	-60.7	110.1	1.8	115.1	R1338 G1346	R1338-R1342 WeakPolarHBondContact O-CB 3.46Å; R1338-R1342 VanDerWaalsContact O-CG 3.23Å; R1338-R1342 WeakPolarHBondContact O-CG 3.37Å; R1338-R1342 PolarHBondContact O-N 3.17Å; R1338-R1342 PolarHBondContact O-NE 3.03Å; R1342-G1346 PolarHBondContact O-N 2.93Å
1343	R	63.7	Low	63.6	Low	190 Å²	190	94.6 Å²	94.6	72%	0.717	48%	0.475	S	S	*	.	H	α-helix	trans	-89.6	-42	168.5	-79.5	168.5	174.3	154.9	-4.2	110.6	A1339 R1340 E1341 G1346 T1347	A1339-R1343 WeakPolarHBondContact O-CD 3.28Å; A1339-R1343 VanDerWaalsContact O-CG 3.25Å; A1339-R1343 WeakPolarHBondContact O-CG 3.38Å; A1339-R1343 PolarHBondContact O-N 3.28Å; R1340-R1343 WeakPolarHBondContact O-CA 3.43Å; R1340-R1343 WeakPolarHBondContact O-CB 3.42Å; R1340-R1343 PolarHBondContact O-N 2.7Å; E1341-R1343 PolarHBondContact O-N 2.82Å; E1341-R1343 VanDerWaalsContact O-N 3.16Å; R1343-G1346 CarbonylContact O-C 3.58Å; R1343-G1346 VanDerWaalsContact O-CA 3.27Å; R1343-G1346 WeakPolarHBondContact O-CA 3.42Å; R1343-G1346 PolarHBondContact O-N 3.18Å; R1343-T1347 PolarHBondContact O-N 3.35Å
1344	A	54.6	Low	62.1	Low	54 Å²	54	94.2 Å²	94.2	45%	0.446	47%	0.474	S	S	.	.	H	α-helix	trans	-62.1	-53	172.1	0	0	0	0	0	111.8	R1340 E1341 G1346 T1347 H1348	R1340-A1344 PolarHBondContact O-N 2.76Å; E1341-A1344 PolarHBondContact O-N 3.42Å; E1341-A1344 VanDerWaalsContact O-N 3.16Å; A1344-G1346 PolarHBondContact O-N 3.44Å; A1344-T1347 PolarHBondContact O-N 3.35Å; A1344-T1347 PolarHBondContact O-OG1 2.87Å; A1344-H1348 PolarHBondContact O-N 3.04Å
1345	Q	54.7	Low	60.9	Low	69 Å²	69	95.5 Å²	95.5	32%	0.322	48%	0.481	S	S	.	.	H	α-helix	trans	-63.9	-6.4	167.3	-63.4	-178.4	14.9	0	0	113.5	E1341 K1349	E1341-Q1345 WeakPolarHBondContact O-CB 3.34Å; E1341-Q1345 WeakPolarHBondContact O-CG 3.46Å; E1341-Q1345 PolarHBondContact O-N 3.21Å; E1341-Q1345 PolarHBondContact OE1-NE2 3.35Å; Q1345-K1349 HydrophobicContact CB-CD 4.34Å; Q1345-K1349 WeakPolarHBondContact O-CB 3.26Å; Q1345-K1349 WeakPolarHBondContact O-CD 3.42Å
1346	G	40.7	Very low	60.5	Low	57 Å²	57	91.6 Å²	91.6	59%	0.588	46%	0.462	S	S	*	.	H	α-helix	trans	-87.9	-16.8	174.3	0	0	0	0	0	112.9	R1342 R1343 A1344	R1342-G1346 PolarHBondContact O-N 2.93Å; R1343-G1346 CarbonylContact O-C 3.58Å; R1343-G1346 VanDerWaalsContact O-CA 3.27Å; R1343-G1346 WeakPolarHBondContact O-CA 3.42Å; R1343-G1346 PolarHBondContact O-N 3.18Å; A1344-G1346 PolarHBondContact O-N 3.44Å
1347	T	40.5	Very low	60.2	Low	110 Å²	110	92.2 Å²	92.2	68%	0.675	46%	0.458	S	S	*	.	H	α-helix	trans	-118.9	-13.3	176.6	55.7	0	0	0	0	113.2	R1343 A1344	R1343-T1347 PolarHBondContact O-N 3.35Å; A1344-T1347 PolarHBondContact O-N 3.35Å; A1344-T1347 PolarHBondContact O-OG1 2.87Å
1348	H	41.4	Very low	60.1	Low	112 Å²	112	91.3 Å²	91.3	52%	0.519	45%	0.452	S	S	.	.			trans	-124	82	170.1	-61.9	-80.1	0	0	0	109.9	A1344 E1351	A1344-H1348 PolarHBondContact O-N 3.04Å; H1348-E1351 IonicContact CE1-OE2 3.89Å; H1348-E1351 IonicContact CG-OE2 3.78Å; H1348-E1351 IonicContact ND1-OE2 3.82Å; H1348-E1351 PolarHBondContact ND1-OE2 3.44Å
1349	K	38.6	Very low	59.6	Low	161 Å²	161	91.9 Å²	91.9	70%	0.7	46%	0.463	S	S	*	.	S	Bend	trans	-136.4	15.9	170	-126.4	168.2	-174.3	156.2	0	115.9	Q1345	Q1345-K1349 HydrophobicContact CB-CD 4.34Å; Q1345-K1349 WeakPolarHBondContact O-CB 3.26Å; Q1345-K1349 WeakPolarHBondContact O-CD 3.42Å
1350	G	33.8	Very low	59.9	Low	81 Å²	81	93.1 Å²	93.1	84%	0.835	47%	0.465	S	S	*	.	S	Bend	trans	-100.1	-36.7	154.4	0	0	0	0	0	111.6	R1352	G1350-R1352 PolarHBondContact O-N 2.74Å
1351	E	36.4	Very low	60.3	Low	134 Å²	134	87.6 Å²	87.6	63%	0.626	45%	0.452	S	S	*	.			trans	-82.1	98.6	178.4	-61.7	166.1	132.6	0	0	111.7	H1348	H1348-E1351 IonicContact CE1-OE2 3.89Å; H1348-E1351 IonicContact CG-OE2 3.78Å; H1348-E1351 IonicContact ND1-OE2 3.82Å; H1348-E1351 PolarHBondContact ND1-OE2 3.44Å
1352	R	45.3	Very low	60.5	Low	221 Å²	221	85.6 Å²	85.6	83%	0.834	45%	0.451	S	S	*	.				-69	137.7	124.7	-84.6	177.1	161.6	171.3	-10.8	105.9	G1350 F1354	G1350-R1352 PolarHBondContact O-N 2.74Å; R1352-F1354 VanDerWaalsContact C-N 3.29Å; R1352-F1354 PolarHBondContact O-N 3.41Å
1353	S	50.8	Low	61	Low	83 Å²	83	82.3 Å²	82.3	58%	0.58	44%	0.444	S	S	*	.			trans	-61.4	98	163.5	43.5	0	0	0	0	107.2	N1355	S1353-N1355 PolarHBondContact O-N 2.81Å
1354	F	61.1	Low	61.8	Low	18 Å²	18	76.2 Å²	76.2	8%	0.079	43%	0.426	C	S	.	.			trans	-75.1	81.4	-179.6	178.9	-88.9	0	0	0	106.6	R1352 K1356 F1365 H1366 K1368 M1371 I1390	R1352-F1354 VanDerWaalsContact C-N 3.29Å; R1352-F1354 PolarHBondContact O-N 3.41Å; F1354-K1356 VanDerWaalsContact C-N 3.31Å; F1354-K1356 HydrophobicContact CD1-CB 4.32Å; F1354-K1356 HydrophobicContact CD2-CD 4.07Å; F1354-K1356 HydrophobicContact CD2-CG 4.21Å; F1354-K1356 HydrophobicContact CE1-CB 3.86Å; F1354-K1356 HydrophobicContact CE1-CG 4.42Å; F1354-K1356 HydrophobicContact CE2-CB 4.24Å; F1354-K1356 HydrophobicContact CE2-CD 3.68Å; F1354-K1356 HydrophobicContact CE2-CG 4.08Å; F1354-K1356 HydrophobicContact CG-CG 4.46Å; F1354-K1356 HydrophobicContact CZ-CB 3.82Å; F1354-K1356 HydrophobicContact CZ-CD 4.07Å; F1354-K1356 HydrophobicContact CZ-CG 4.17Å; F1354-K1356 PolarHBondContact O-N 2.79Å; F1354-F1365 HydrophobicContact CE1-CB 4.16Å; F1354-F1365 CarbonylContact O-C 3.46Å; F1354-H1366 CarbonylContact O-C 3.53Å; F1354-H1366 WeakPolarHBondContact O-CA 3.42Å; F1354-K1368 HydrophobicContact CD1-CB 4.4Å; F1354-K1368 VanDerWaalsContact CD1-N 3.33Å; F1354-K1368 HydrophobicContact CD2-CB 3.74Å; F1354-K1368 HydrophobicContact CD2-CG 4.28Å; F1354-K1368 HydrophobicContact CE1-CB 4.41Å; F1354-K1368 HydrophobicContact CE2-CB 3.72Å; F1354-K1368 HydrophobicContact CE2-CD 4.32Å; F1354-K1368 HydrophobicContact CE2-CG 3.81Å; F1354-K1368 HydrophobicContact CG-CB 4.1Å; F1354-K1368 HydrophobicContact CZ-CB 4.08Å; F1354-K1368 HydrophobicContact CZ-CG 4.18Å; F1354-M1371 HydrophobicContact CE1-CB 3.74Å; F1354-M1371 HydrophobicContact CE1-CE 4.34Å; F1354-M1371 HydrophobicContact CE1-CG 4.38Å; F1354-M1371 HydrophobicContact CE1-SD 3.78Å; F1354-M1371 HydrophobicContact CZ-CB 4.09Å; F1354-M1371 HydrophobicContact CZ-CE 3.74Å; F1354-M1371 HydrophobicContact CZ-SD 3.8Å; F1354-I1390 HydrophobicContact CE2-CG2 3.61Å; F1354-I1390 HydrophobicContact CZ-CG2 3.58Å
1355	N	69	Low	63	Low	27 Å²	27	74.6 Å²	74.6	14%	0.144	41%	0.409	C	S	.	.			trans	-97.4	56.1	-176.6	-71.4	5	0	0	0	108.8	S1353 A1396 E1397	S1353-N1355 PolarHBondContact O-N 2.81Å; N1355-A1396 WeakPolarHBondContact O-CB 3.43Å; N1355-A1396 PolarHBondContact O-N 2.86Å; N1355-E1397 PolarHBondContact ND2-OE1 2.72Å
1356	K	79.9	Confident	64	Low	20 Å²	20	76.4 Å²	76.4	9%	0.087	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	143.6	-170.6	-58.7	-165.4	-177.5	-57.3	0	111.8	F1354 F1365 M1371 I1390 L1393 D1395	F1354-K1356 VanDerWaalsContact C-N 3.31Å; F1354-K1356 HydrophobicContact CD1-CB 4.32Å; F1354-K1356 HydrophobicContact CD2-CD 4.07Å; F1354-K1356 HydrophobicContact CD2-CG 4.21Å; F1354-K1356 HydrophobicContact CE1-CB 3.86Å; F1354-K1356 HydrophobicContact CE1-CG 4.42Å; F1354-K1356 HydrophobicContact CE2-CB 4.24Å; F1354-K1356 HydrophobicContact CE2-CD 3.68Å; F1354-K1356 HydrophobicContact CE2-CG 4.08Å; F1354-K1356 HydrophobicContact CG-CG 4.46Å; F1354-K1356 HydrophobicContact CZ-CB 3.82Å; F1354-K1356 HydrophobicContact CZ-CD 4.07Å; F1354-K1356 HydrophobicContact CZ-CG 4.17Å; F1354-K1356 PolarHBondContact O-N 2.79Å; K1356-F1365 PolarHBondContact N-O 3.28Å; K1356-F1365 PolarHBondContact O-N 3.2Å; K1356-M1371 HydrophobicContact CB-SD 4.24Å; K1356-I1390 WeakPolarHBondContact CD-O 3.28Å; K1356-L1393 HydrophobicContact CD-CB 4.11Å; K1356-L1393 WeakPolarHBondContact CD-O 3.4Å; K1356-L1393 VanDerWaalsContact CE-O 3.29Å; K1356-L1393 WeakPolarHBondContact CE-O 3.48Å; K1356-L1393 PolarHBondContact NZ-O 3.06Å; K1356-D1395 WeakPolarHBondContact CE-OD1 3.43Å; K1356-D1395 VanDerWaalsContact CG-OD1 3.23Å; K1356-D1395 WeakPolarHBondContact CG-OD1 3.44Å; K1356-D1395 IonicContact NZ-OD1 2.77Å; K1356-D1395 PolarHBondContact NZ-OD1 2.74Å; K1356-D1395 IonicContact NZ-OD2 2.86Å; K1356-D1395 PolarHBondContact NZ-OD2 2.74Å
1357	R	81.5	Confident	65.6	Low	105 Å²	105	77.2 Å²	77.2	40%	0.396	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	141.4	175.5	-65.5	-178.9	-177.7	-85.6	4.8	110.6	G1362 I1363 L1364 A1396	R1357-G1362 WeakPolarHBondContact CD-O 3.42Å; R1357-G1362 WeakPolarHBondContact CG-O 3.32Å; R1357-G1362 PolarHBondContact NH1-O 3.44Å; R1357-I1363 CarbonylContact C-O 3.53Å; R1357-I1363 VanDerWaalsContact CA-O 3.3Å; R1357-I1363 WeakPolarHBondContact CA-O 3.29Å; R1357-L1364 HydrophobicContact CG-CD1 4.24Å; R1357-A1396 HydrophobicContact CG-CB 4.12Å
1358	C	85.6	Confident	67.5	Low	0 Å²	0	75.2 Å²	75.2	0%	0	39%	0.39	C	S	.	.			trans	-63.8	127	166.3	172.7	0	0	0	0	109.2	F1360 C1361 G1362 I1363 F1365 M1371 H1374	C1358-F1360 PolarHBondContact O-N 3.46Å; C1358-C1361 PolarHBondContact O-N 3.4Å; C1358-C1361 VanDerWaalsContact SG-SG 3.64Å; C1358-G1362 WeakPolarHBondContact O-CA 3.47Å; C1358-G1362 PolarHBondContact O-N 2.82Å; C1358-I1363 PolarHBondContact N-O 2.98Å; C1358-F1365 HydrophobicContact CB-CD2 4.08Å; C1358-F1365 HydrophobicContact CB-CE2 3.65Å; C1358-M1371 HydrophobicContact CB-CG 4.36Å; C1358-H1374 VanDerWaalsContact SG-CD2 3.6Å; C1358-H1374 PolarHBondContact SG-NE2 3.29Å; C1358-H1374 VanDerWaalsContact SG-NE2 3.45Å
1359	P	78.8	Confident	69.2	Low	66 Å²	66	76.6 Å²	76.6	43%	0.429	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-12.9	-174.3	29.4	-36	0	0	0	113.7	V1388 L1393	P1359-V1388 HydrophobicContact CG-CG1 3.82Å; P1359-V1388 HydrophobicContact CG-CG2 3.9Å; P1359-L1393 HydrophobicContact CB-CD2 4.21Å; P1359-L1393 HydrophobicContact CG-CD1 4.37Å; P1359-L1393 HydrophobicContact CG-CD2 4.49Å
1360	F	82.7	Confident	71.1	Confident	46 Å²	46	72 Å²	72	20%	0.202	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.9	-15.2	-176.1	-52.9	-65	0	0	0	114.1	C1358 I1375 H1379 Q1382 V1388	C1358-F1360 PolarHBondContact O-N 3.46Å; F1360-I1375 HydrophobicContact CD2-CG1 4.32Å; F1360-I1375 HydrophobicContact CE2-CG1 4.44Å; F1360-I1375 HydrophobicContact CE2-CG2 4.01Å; F1360-H1379 HydrophobicContact CB-CB 4.14Å; F1360-H1379 VanDerWaalsContact CB-CE1 3.46Å; F1360-H1379 WeakPolarHBondContact CB-CE1 3.1Å; F1360-H1379 VanDerWaalsContact CB-CG 3.45Å; F1360-H1379 WeakPolarHBondContact CB-ND1 3.48Å; F1360-H1379 HydrophobicContact CD2-CB 3.48Å; F1360-H1379 VanDerWaalsContact CD2-CB 3.48Å; F1360-H1379 AromaticContact CD2-CG 3.67Å; F1360-H1379 HydrophobicContact CE2-CB 4.07Å; F1360-H1379 HydrophobicContact CG-CB 3.98Å; F1360-H1379 AromaticContact CG-CG 3.85Å; F1360-H1379 AromaticContact CG-ND1 3.98Å; F1360-Q1382 HydrophobicContact CD1-CB 3.71Å; F1360-Q1382 HydrophobicContact CD1-CG 4.41Å; F1360-Q1382 HydrophobicContact CE1-CB 3.57Å; F1360-Q1382 HydrophobicContact CE2-CB 4.43Å; F1360-Q1382 HydrophobicContact CG-CB 4.21Å; F1360-Q1382 HydrophobicContact CZ-CB 3.95Å; F1360-V1388 HydrophobicContact CE1-CG2 4.35Å; F1360-V1388 HydrophobicContact CE2-CG2 3.94Å; F1360-V1388 HydrophobicContact CZ-CG2 3.52Å
1361	C	84.9	Confident	73.4	Confident	55 Å²	55	68.1 Å²	68.1	37%	0.372	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-145	-4	-178	68.3	0	0	0	0	115.2	C1358 I1363 H1374	C1358-C1361 PolarHBondContact O-N 3.4Å; C1358-C1361 VanDerWaalsContact SG-SG 3.64Å; C1361-I1363 HydrophobicContact CB-CG1 4.43Å; C1361-I1363 PolarHBondContact O-N 2.96Å; C1361-I1363 VanDerWaalsContact O-N 3.12Å; C1361-I1363 VanDerWaalsContact SG-CG1 3.57Å; C1361-H1374 PolarHBondContact SG-NE2 3.48Å
1362	G	78.1	Confident	75.6	Confident	32 Å²	32	65.6 Å²	65.6	33%	0.33	33%	0.33	S	S	.	.			trans	73.1	-4.9	178.5	0	0	0	0	0	116.3	R1357 C1358 L1364	R1357-G1362 WeakPolarHBondContact CD-O 3.42Å; R1357-G1362 WeakPolarHBondContact CG-O 3.32Å; R1357-G1362 PolarHBondContact NH1-O 3.44Å; C1358-G1362 WeakPolarHBondContact O-CA 3.47Å; C1358-G1362 PolarHBondContact O-N 2.82Å; G1362-L1364 PolarHBondContact O-N 3.14Å
1363	I	79	Confident	77.3	Confident	88 Å²	88	55.6 Å²	55.6	45%	0.451	30%	0.297	S	S	.	.	P	Polyproline II helix	trans	-58.1	131.8	177.8	-63.6	173.7	0	0	0	109.6	R1357 C1358 C1361 F1365	R1357-I1363 CarbonylContact C-O 3.53Å; R1357-I1363 VanDerWaalsContact CA-O 3.3Å; R1357-I1363 WeakPolarHBondContact CA-O 3.29Å; C1358-I1363 PolarHBondContact N-O 2.98Å; C1361-I1363 HydrophobicContact CB-CG1 4.43Å; C1361-I1363 PolarHBondContact O-N 2.96Å; C1361-I1363 VanDerWaalsContact O-N 3.12Å; C1361-I1363 VanDerWaalsContact SG-CG1 3.57Å; I1363-F1365 HydrophobicContact CB-CE2 3.7Å; I1363-F1365 HydrophobicContact CB-CZ 4.06Å; I1363-F1365 HydrophobicContact CG2-CD2 4.27Å; I1363-F1365 HydrophobicContact CG2-CE1 4.34Å; I1363-F1365 HydrophobicContact CG2-CE2 3.52Å; I1363-F1365 HydrophobicContact CG2-CZ 3.53Å; I1363-F1365 VanDerWaalsContact O-CD2 3.24Å; I1363-F1365 WeakPolarHBondContact O-CD2 3.38Å; I1363-F1365 WeakPolarHBondContact O-CE2 3.29Å
1364	L	79.8	Confident	79	Confident	62 Å²	62	52.6 Å²	52.6	33%	0.325	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	120.1	179	179	63.4	0	0	0	110.5	R1357 G1362 A1396	R1357-L1364 HydrophobicContact CG-CD1 4.24Å; G1362-L1364 PolarHBondContact O-N 3.14Å; L1364-A1396 HydrophobicContact CD1-CB 3.52Å
1365	F	79.6	Confident	80.1	Confident	20 Å²	20	51.8 Å²	51.8	9%	0.088	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	143.8	172.7	-67.3	-86.5	0	0	0	109.7	F1354 K1356 C1358 I1363 V1370 M1371 H1374	F1354-F1365 HydrophobicContact CE1-CB 4.16Å; F1354-F1365 CarbonylContact O-C 3.46Å; K1356-F1365 PolarHBondContact N-O 3.28Å; K1356-F1365 PolarHBondContact O-N 3.2Å; C1358-F1365 HydrophobicContact CB-CD2 4.08Å; C1358-F1365 HydrophobicContact CB-CE2 3.65Å; I1363-F1365 HydrophobicContact CB-CE2 3.7Å; I1363-F1365 HydrophobicContact CB-CZ 4.06Å; I1363-F1365 HydrophobicContact CG2-CD2 4.27Å; I1363-F1365 HydrophobicContact CG2-CE1 4.34Å; I1363-F1365 HydrophobicContact CG2-CE2 3.52Å; I1363-F1365 HydrophobicContact CG2-CZ 3.53Å; I1363-F1365 VanDerWaalsContact O-CD2 3.24Å; I1363-F1365 WeakPolarHBondContact O-CD2 3.38Å; I1363-F1365 WeakPolarHBondContact O-CE2 3.29Å; F1365-V1370 HydrophobicContact CD1-CB 4.13Å; F1365-V1370 HydrophobicContact CD1-CG1 3.77Å; F1365-V1370 HydrophobicContact CE1-CG1 3.96Å; F1365-M1371 HydrophobicContact CB-CB 3.66Å; F1365-M1371 HydrophobicContact CB-CG 4.04Å; F1365-M1371 HydrophobicContact CB-SD 4.29Å; F1365-M1371 HydrophobicContact CD1-CB 4.17Å; F1365-M1371 HydrophobicContact CD2-CB 3.93Å; F1365-M1371 HydrophobicContact CD2-CG 3.5Å; F1365-M1371 VanDerWaalsContact CD2-CG 3.5Å; F1365-M1371 HydrophobicContact CD2-SD 4.04Å; F1365-M1371 HydrophobicContact CE2-CG 4.18Å; F1365-M1371 HydrophobicContact CG-CB 3.61Å; F1365-M1371 HydrophobicContact CG-CG 3.76Å; F1365-M1371 HydrophobicContact CG-SD 4.44Å; F1365-H1374 HydrophobicContact CE1-CB 3.65Å; F1365-H1374 AromaticContact CE1-CG 3.89Å; F1365-H1374 HydrophobicContact CE2-CB 4.33Å; F1365-H1374 AromaticContact CE2-CD2 3.42Å; F1365-H1374 VanDerWaalsContact CE2-CD2 3.42Å; F1365-H1374 WeakPolarHBondContact CE2-CD2 3.13Å; F1365-H1374 AromaticContact CE2-CG 3.86Å; F1365-H1374 AromaticContact CE2-NE2 3.93Å; F1365-H1374 HydrophobicContact CZ-CB 3.49Å; F1365-H1374 VanDerWaalsContact CZ-CB 3.49Å; F1365-H1374 AromaticContact CZ-CD2 3.27Å; F1365-H1374 WeakPolarHBondContact CZ-CD2 3.39Å; F1365-H1374 AromaticContact CZ-CG 3.18Å; F1365-H1374 AromaticContact CZ-ND1 3.75Å; F1365-H1374 AromaticContact CZ-NE2 3.86Å
1366	H	76.3	Confident	80.7	Confident	106 Å²	106	54.1 Å²	54.1	49%	0.491	29%	0.285	S	S	.	.	S	Bend	trans	-104.9	-1.9	178.4	-65.6	88	0	0	0	112.6	F1354	F1354-H1366 CarbonylContact O-C 3.53Å; F1354-H1366 WeakPolarHBondContact O-CA 3.42Å
1367	N	74.5	Confident	80.6	Confident	75 Å²	75	58.1 Å²	58.1	40%	0.401	30%	0.304	S	S	.	.	S	Bend	trans	-144.8	131	-177	177.1	-9.2	0	0	0	109.6	H1369 V1370 M1371	N1367-H1369 VanDerWaalsContact C-N 3.31Å; N1367-H1369 PolarHBondContact O-N 2.98Å; N1367-H1369 PolarHBondContact OD1-N 2.96Å; N1367-V1370 HydrophobicContact CB-CB 4.37Å; N1367-V1370 HydrophobicContact CB-CG2 3.89Å; N1367-V1370 PolarHBondContact O-N 2.86Å; N1367-M1371 PolarHBondContact O-N 2.77Å; N1367-M1371 VanDerWaalsContact O-N 3.14Å
1368	K	81.5	Confident	80.6	Confident	68 Å²	68	62.2 Å²	62.2	30%	0.296	32%	0.32	S	S	.	.	H	α-helix	trans	-57.7	-39.7	-179.3	-174.4	172.2	-179.9	175.4	0	113	F1354 M1371 M1372 I1390 D1391	F1354-K1368 HydrophobicContact CD1-CB 4.4Å; F1354-K1368 VanDerWaalsContact CD1-N 3.33Å; F1354-K1368 HydrophobicContact CD2-CB 3.74Å; F1354-K1368 HydrophobicContact CD2-CG 4.28Å; F1354-K1368 HydrophobicContact CE1-CB 4.41Å; F1354-K1368 HydrophobicContact CE2-CB 3.72Å; F1354-K1368 HydrophobicContact CE2-CD 4.32Å; F1354-K1368 HydrophobicContact CE2-CG 3.81Å; F1354-K1368 HydrophobicContact CG-CB 4.1Å; F1354-K1368 HydrophobicContact CZ-CB 4.08Å; F1354-K1368 HydrophobicContact CZ-CG 4.18Å; K1368-M1371 PolarHBondContact O-N 3.09Å; K1368-M1372 HydrophobicContact CG-CG 4.45Å; K1368-M1372 WeakPolarHBondContact O-CG 3.34Å; K1368-M1372 PolarHBondContact O-N 2.77Å; K1368-I1390 HydrophobicContact CD-CG2 4.2Å; K1368-I1390 HydrophobicContact CG-CG2 3.85Å; K1368-D1391 IonicContact NZ-OD1 3.84Å; K1368-D1391 PolarHBondContact NZ-OD1 2.89Å; K1368-D1391 IonicContact NZ-OD2 2.87Å; K1368-D1391 PolarHBondContact NZ-OD2 2.86Å
1369	H	77.1	Confident	80.4	Confident	140 Å²	140	63.1 Å²	63.1	65%	0.648	32%	0.324	S	S	*	.	H	α-helix	trans	-68.1	-38.2	179.5	-87	-88.1	0	0	0	112.4	N1367 M1371 M1372 G1373	N1367-H1369 VanDerWaalsContact C-N 3.31Å; N1367-H1369 PolarHBondContact O-N 2.98Å; N1367-H1369 PolarHBondContact OD1-N 2.96Å; H1369-M1371 VanDerWaalsContact C-N 3.34Å; H1369-M1371 PolarHBondContact O-N 3.41Å; H1369-M1372 WeakPolarHBondContact O-CB 3.48Å; H1369-M1372 PolarHBondContact O-N 3.22Å; H1369-G1373 PolarHBondContact O-N 3.15Å
1370	V	78.5	Confident	80.3	Confident	65 Å²	65	61.2 Å²	61.2	39%	0.394	31%	0.314	S	S	.	.	H	α-helix	trans	-69.7	-34.6	178.4	-171.6	0	0	0	0	110.7	F1365 N1367 H1374	F1365-V1370 HydrophobicContact CD1-CB 4.13Å; F1365-V1370 HydrophobicContact CD1-CG1 3.77Å; F1365-V1370 HydrophobicContact CE1-CG1 3.96Å; N1367-V1370 HydrophobicContact CB-CB 4.37Å; N1367-V1370 HydrophobicContact CB-CG2 3.89Å; N1367-V1370 PolarHBondContact O-N 2.86Å; V1370-H1374 VanDerWaalsContact O-CB 3.24Å; V1370-H1374 WeakPolarHBondContact O-CB 3.09Å; V1370-H1374 PolarHBondContact O-N 3.14Å
1371	M	82	Confident	79.8	Confident	0 Å²	0	66.8 Å²	66.8	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-69.8	-37	171.6	-160.3	172.7	93.9	0	0	112.6	F1354 K1356 C1358 F1365 N1367 K1368 H1369 I1375 I1390 L1393	F1354-M1371 HydrophobicContact CE1-CB 3.74Å; F1354-M1371 HydrophobicContact CE1-CE 4.34Å; F1354-M1371 HydrophobicContact CE1-CG 4.38Å; F1354-M1371 HydrophobicContact CE1-SD 3.78Å; F1354-M1371 HydrophobicContact CZ-CB 4.09Å; F1354-M1371 HydrophobicContact CZ-CE 3.74Å; F1354-M1371 HydrophobicContact CZ-SD 3.8Å; K1356-M1371 HydrophobicContact CB-SD 4.24Å; C1358-M1371 HydrophobicContact CB-CG 4.36Å; F1365-M1371 HydrophobicContact CB-CB 3.66Å; F1365-M1371 HydrophobicContact CB-CG 4.04Å; F1365-M1371 HydrophobicContact CB-SD 4.29Å; F1365-M1371 HydrophobicContact CD1-CB 4.17Å; F1365-M1371 HydrophobicContact CD2-CB 3.93Å; F1365-M1371 HydrophobicContact CD2-CG 3.5Å; F1365-M1371 VanDerWaalsContact CD2-CG 3.5Å; F1365-M1371 HydrophobicContact CD2-SD 4.04Å; F1365-M1371 HydrophobicContact CE2-CG 4.18Å; F1365-M1371 HydrophobicContact CG-CB 3.61Å; F1365-M1371 HydrophobicContact CG-CG 3.76Å; F1365-M1371 HydrophobicContact CG-SD 4.44Å; N1367-M1371 PolarHBondContact O-N 2.77Å; N1367-M1371 VanDerWaalsContact O-N 3.14Å; K1368-M1371 PolarHBondContact O-N 3.09Å; H1369-M1371 VanDerWaalsContact C-N 3.34Å; H1369-M1371 PolarHBondContact O-N 3.41Å; M1371-I1375 HydrophobicContact CE-CD1 3.92Å; M1371-I1375 HydrophobicContact CG-CD1 3.89Å; M1371-I1375 HydrophobicContact CG-CG1 4.42Å; M1371-I1375 VanDerWaalsContact O-CB 3.27Å; M1371-I1375 WeakPolarHBondContact O-CB 3.32Å; M1371-I1375 WeakPolarHBondContact O-CD1 3.4Å; M1371-I1375 WeakPolarHBondContact O-CG1 3.26Å; M1371-I1375 PolarHBondContact O-N 2.95Å; M1371-I1390 HydrophobicContact CE-CB 4.25Å; M1371-I1390 HydrophobicContact CE-CG1 3.89Å; M1371-I1390 HydrophobicContact CE-CG2 3.7Å; M1371-L1393 HydrophobicContact CE-CD1 3.53Å
1372	M	81.4	Confident	79.4	Confident	80 Å²	80	68.2 Å²	68.2	39%	0.394	34%	0.341	S	S	.	.	H	α-helix	trans	-59.9	-54	172.4	-65.9	-107.8	-65.9	0	0	110.5	K1368 H1369 H1374 I1375 T1376 I1390	K1368-M1372 HydrophobicContact CG-CG 4.45Å; K1368-M1372 WeakPolarHBondContact O-CG 3.34Å; K1368-M1372 PolarHBondContact O-N 2.77Å; H1369-M1372 WeakPolarHBondContact O-CB 3.48Å; H1369-M1372 PolarHBondContact O-N 3.22Å; M1372-H1374 PolarHBondContact O-N 3.41Å; M1372-I1375 PolarHBondContact O-N 3.32Å; M1372-I1375 VanDerWaalsContact O-N 3.09Å; M1372-T1376 PolarHBondContact O-N 2.83Å; M1372-T1376 PolarHBondContact O-OG1 3.06Å; M1372-I1390 HydrophobicContact CG-CD1 3.84Å; M1372-I1390 HydrophobicContact SD-CD1 3.47Å; M1372-I1390 WeakPolarHBondContact SD-CD1 3.13Å
1373	G	81.3	Confident	79.3	Confident	12 Å²	12	70.2 Å²	70.2	12%	0.124	34%	0.341	C	S	.	.	H	α-helix	trans	-54.2	-53.3	178.8	0	0	0	0	0	111.8	H1369 I1375 T1376 E1377	H1369-G1373 PolarHBondContact O-N 3.15Å; G1373-I1375 VanDerWaalsContact C-N 3.32Å; G1373-I1375 PolarHBondContact O-N 2.8Å; G1373-T1376 WeakPolarHBondContact CA-OG1 3.42Å; G1373-T1376 CarbonylContact O-C 3.56Å; G1373-T1376 PolarHBondContact O-N 3.36Å; G1373-T1376 PolarHBondContact O-OG1 3.21Å; G1373-E1377 WeakPolarHBondContact O-CB 3.38Å; G1373-E1377 WeakPolarHBondContact O-CG 3.44Å; G1373-E1377 PolarHBondContact O-N 3.04Å
1374	H	85.8	Confident	78.9	Confident	20 Å²	20	75.6 Å²	75.6	9%	0.093	36%	0.356	C	S	.	.	H	α-helix	trans	-56.7	-41.1	175.2	167.8	75.3	0	0	0	113.6	C1358 C1361 F1365 V1370 M1372 E1377 R1378 H1379	C1358-H1374 VanDerWaalsContact SG-CD2 3.6Å; C1358-H1374 PolarHBondContact SG-NE2 3.29Å; C1358-H1374 VanDerWaalsContact SG-NE2 3.45Å; C1361-H1374 PolarHBondContact SG-NE2 3.48Å; F1365-H1374 HydrophobicContact CE1-CB 3.65Å; F1365-H1374 AromaticContact CE1-CG 3.89Å; F1365-H1374 HydrophobicContact CE2-CB 4.33Å; F1365-H1374 AromaticContact CE2-CD2 3.42Å; F1365-H1374 VanDerWaalsContact CE2-CD2 3.42Å; F1365-H1374 WeakPolarHBondContact CE2-CD2 3.13Å; F1365-H1374 AromaticContact CE2-CG 3.86Å; F1365-H1374 AromaticContact CE2-NE2 3.93Å; F1365-H1374 HydrophobicContact CZ-CB 3.49Å; F1365-H1374 VanDerWaalsContact CZ-CB 3.49Å; F1365-H1374 AromaticContact CZ-CD2 3.27Å; F1365-H1374 WeakPolarHBondContact CZ-CD2 3.39Å; F1365-H1374 AromaticContact CZ-CG 3.18Å; F1365-H1374 AromaticContact CZ-ND1 3.75Å; F1365-H1374 AromaticContact CZ-NE2 3.86Å; V1370-H1374 VanDerWaalsContact O-CB 3.24Å; V1370-H1374 WeakPolarHBondContact O-CB 3.09Å; V1370-H1374 PolarHBondContact O-N 3.14Å; M1372-H1374 PolarHBondContact O-N 3.41Å; H1374-E1377 PolarHBondContact O-N 2.98Å; H1374-R1378 WeakPolarHBondContact O-CB 3.23Å; H1374-R1378 PolarHBondContact O-N 2.94Å; H1374-H1379 AromaticContact CD2-CD2 3.97Å; H1374-H1379 AromaticContact CE1-CD2 3.88Å; H1374-H1379 AromaticContact CE1-NE2 3.63Å; H1374-H1379 AromaticContact NE2-CD2 3.36Å; H1374-H1379 PolarHBondContact NE2-CD2 3.42Å; H1374-H1379 AromaticContact NE2-NE2 3.27Å; H1374-H1379 PolarHBondContact NE2-NE2 2.83Å
1375	I	84.2	Confident	78.4	Confident	1 Å²	1	78.1 Å²	78.1	1%	0.005	37%	0.374	C	S	.	.	H	α-helix	trans	-66.4	-39.7	175.9	-75.2	170.7	0	0	0	110.7	F1360 M1371 M1372 G1373 H1379 A1380 F1383 I1390	F1360-I1375 HydrophobicContact CD2-CG1 4.32Å; F1360-I1375 HydrophobicContact CE2-CG1 4.44Å; F1360-I1375 HydrophobicContact CE2-CG2 4.01Å; M1371-I1375 HydrophobicContact CE-CD1 3.92Å; M1371-I1375 HydrophobicContact CG-CD1 3.89Å; M1371-I1375 HydrophobicContact CG-CG1 4.42Å; M1371-I1375 VanDerWaalsContact O-CB 3.27Å; M1371-I1375 WeakPolarHBondContact O-CB 3.32Å; M1371-I1375 WeakPolarHBondContact O-CD1 3.4Å; M1371-I1375 WeakPolarHBondContact O-CG1 3.26Å; M1371-I1375 PolarHBondContact O-N 2.95Å; M1372-I1375 PolarHBondContact O-N 3.32Å; M1372-I1375 VanDerWaalsContact O-N 3.09Å; G1373-I1375 VanDerWaalsContact C-N 3.32Å; G1373-I1375 PolarHBondContact O-N 2.8Å; I1375-H1379 CarbonylContact O-C 3.54Å; I1375-H1379 VanDerWaalsContact O-CA 3.26Å; I1375-H1379 WeakPolarHBondContact O-CA 3.38Å; I1375-H1379 WeakPolarHBondContact O-CB 3.37Å; I1375-H1379 PolarHBondContact O-N 2.85Å; I1375-H1379 VanDerWaalsContact O-N 3.14Å; I1375-A1380 PolarHBondContact O-N 2.73Å; I1375-F1383 HydrophobicContact CG2-CB 3.59Å; I1375-F1383 HydrophobicContact CG2-CD1 4.2Å; I1375-F1383 HydrophobicContact CG2-CD2 3.42Å; I1375-F1383 VanDerWaalsContact CG2-CD2 3.42Å; I1375-F1383 HydrophobicContact CG2-CE2 4.11Å; I1375-F1383 HydrophobicContact CG2-CG 3.47Å; I1375-F1383 VanDerWaalsContact CG2-CG 3.47Å; I1375-I1390 HydrophobicContact CD1-CD1 4.43Å
1376	T	81.7	Confident	77.7	Confident	76 Å²	76	80 Å²	80	47%	0.466	39%	0.388	S	S	.	.	H	α-helix	trans	-74.8	-24.8	177.5	47.5	0	0	0	0	114.3	M1372 G1373 A1380 F1383	M1372-T1376 PolarHBondContact O-N 2.83Å; M1372-T1376 PolarHBondContact O-OG1 3.06Å; G1373-T1376 WeakPolarHBondContact CA-OG1 3.42Å; G1373-T1376 CarbonylContact O-C 3.56Å; G1373-T1376 PolarHBondContact O-N 3.36Å; G1373-T1376 PolarHBondContact O-OG1 3.21Å; T1376-A1380 WeakPolarHBondContact O-CB 3.36Å; T1376-F1383 HydrophobicContact CG2-CD1 4.24Å; T1376-F1383 HydrophobicContact CG2-CE1 4.25Å
1377	E	79.6	Confident	76.9	Confident	103 Å²	103	84.6 Å²	84.6	48%	0.481	41%	0.409	S	S	.	.	H	α-helix	trans	-86.5	-61.6	175.1	-71.6	-175.6	126.7	0	0	112.2	G1373 H1374	G1373-E1377 WeakPolarHBondContact O-CB 3.38Å; G1373-E1377 WeakPolarHBondContact O-CG 3.44Å; G1373-E1377 PolarHBondContact O-N 3.04Å; H1374-E1377 PolarHBondContact O-N 2.98Å
1378	R	79.9	Confident	76.5	Confident	192 Å²	192	82.3 Å²	82.3	73%	0.725	40%	0.398	S	S	*	.	H	α-helix	trans	-84.9	-22.8	-170	-66.9	-68.8	-175.4	140.2	-2.1	113.3	H1374	H1374-R1378 WeakPolarHBondContact O-CB 3.23Å; H1374-R1378 PolarHBondContact O-N 2.94Å
1379	H	82.5	Confident	75.9	Confident	18 Å²	18	83.6 Å²	83.6	8%	0.083	41%	0.408	C	S	.	.	S	Bend	trans	-125.4	25.9	-175	-57.4	-67.4	0	0	0	111.9	F1360 H1374 I1375 Q1381 Q1382 F1383	F1360-H1379 HydrophobicContact CB-CB 4.14Å; F1360-H1379 VanDerWaalsContact CB-CE1 3.46Å; F1360-H1379 WeakPolarHBondContact CB-CE1 3.1Å; F1360-H1379 VanDerWaalsContact CB-CG 3.45Å; F1360-H1379 WeakPolarHBondContact CB-ND1 3.48Å; F1360-H1379 HydrophobicContact CD2-CB 3.48Å; F1360-H1379 VanDerWaalsContact CD2-CB 3.48Å; F1360-H1379 AromaticContact CD2-CG 3.67Å; F1360-H1379 HydrophobicContact CE2-CB 4.07Å; F1360-H1379 HydrophobicContact CG-CB 3.98Å; F1360-H1379 AromaticContact CG-CG 3.85Å; F1360-H1379 AromaticContact CG-ND1 3.98Å; H1374-H1379 AromaticContact CD2-CD2 3.97Å; H1374-H1379 AromaticContact CE1-CD2 3.88Å; H1374-H1379 AromaticContact CE1-NE2 3.63Å; H1374-H1379 AromaticContact NE2-CD2 3.36Å; H1374-H1379 PolarHBondContact NE2-CD2 3.42Å; H1374-H1379 AromaticContact NE2-NE2 3.27Å; H1374-H1379 PolarHBondContact NE2-NE2 2.83Å; I1375-H1379 CarbonylContact O-C 3.54Å; I1375-H1379 VanDerWaalsContact O-CA 3.26Å; I1375-H1379 WeakPolarHBondContact O-CA 3.38Å; I1375-H1379 WeakPolarHBondContact O-CB 3.37Å; I1375-H1379 PolarHBondContact O-N 2.85Å; I1375-H1379 VanDerWaalsContact O-N 3.14Å; H1379-Q1381 CarbonylContact O-C 3.45Å; H1379-Q1381 PolarHBondContact O-N 3.29Å; H1379-Q1382 HydrophobicContact CB-CB 4.39Å; H1379-Q1382 PolarHBondContact ND1-OE1 2.95Å; H1379-Q1382 PolarHBondContact O-N 2.96Å; H1379-F1383 WeakPolarHBondContact O-CB 3.35Å; H1379-F1383 PolarHBondContact O-N 3.38Å
1380	A	75.5	Confident	75.6	Confident	27 Å²	27	77.4 Å²	77.4	22%	0.223	38%	0.38	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.1	-27.6	-173.7	0	0	0	0	0	115.1	I1375 T1376 R1384	I1375-A1380 PolarHBondContact O-N 2.73Å; T1376-A1380 WeakPolarHBondContact O-CB 3.36Å; A1380-R1384 PolarHBondContact O-NE 3Å; A1380-R1384 PolarHBondContact O-NH2 3.24Å
1381	Q	73.9	Confident	75.2	Confident	162 Å²	162	78.9 Å²	78.9	76%	0.757	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-52.4	172.2	-73.2	175.4	-33	0	0	111	H1379 F1383 R1384 T1385	H1379-Q1381 CarbonylContact O-C 3.45Å; H1379-Q1381 PolarHBondContact O-N 3.29Å; Q1381-F1383 VanDerWaalsContact C-N 3.25Å; Q1381-F1383 PolarHBondContact O-N 3.13Å; Q1381-R1384 WeakPolarHBondContact O-CA 3.46Å; Q1381-R1384 PolarHBondContact O-N 3.45Å; Q1381-T1385 PolarHBondContact O-N 2.94Å
1382	Q	75.2	Confident	74.8	Confident	85 Å²	85	83.5 Å²	83.5	40%	0.397	42%	0.416	S	S	.	.	H	α-helix	trans	-62.3	-29.8	-177	-59.4	174.9	-76.8	0	0	113.1	F1360 H1379 T1385 T1386	F1360-Q1382 HydrophobicContact CD1-CB 3.71Å; F1360-Q1382 HydrophobicContact CD1-CG 4.41Å; F1360-Q1382 HydrophobicContact CE1-CB 3.57Å; F1360-Q1382 HydrophobicContact CE2-CB 4.43Å; F1360-Q1382 HydrophobicContact CG-CB 4.21Å; F1360-Q1382 HydrophobicContact CZ-CB 3.95Å; H1379-Q1382 HydrophobicContact CB-CB 4.39Å; H1379-Q1382 PolarHBondContact ND1-OE1 2.95Å; H1379-Q1382 PolarHBondContact O-N 2.96Å; Q1382-T1385 WeakPolarHBondContact CA-OG1 3.4Å; Q1382-T1385 PolarHBondContact O-OG1 3.15Å; Q1382-T1385 VanDerWaalsContact O-OG1 3.13Å; Q1382-T1386 WeakPolarHBondContact O-CB 3.31Å; Q1382-T1386 PolarHBondContact O-N 3.01Å; Q1382-T1386 VanDerWaalsContact O-N 3.09Å; Q1382-T1386 PolarHBondContact O-OG1 2.86Å
1383	F	75.5	Confident	74.2	Confident	75 Å²	75	81.5 Å²	81.5	33%	0.329	41%	0.407	S	S	.	.	H	α-helix	trans	-72.8	-32.7	172.4	-174.5	-120.7	0	0	0	112.9	I1375 T1376 H1379 Q1381	I1375-F1383 HydrophobicContact CG2-CB 3.59Å; I1375-F1383 HydrophobicContact CG2-CD1 4.2Å; I1375-F1383 HydrophobicContact CG2-CD2 3.42Å; I1375-F1383 VanDerWaalsContact CG2-CD2 3.42Å; I1375-F1383 HydrophobicContact CG2-CE2 4.11Å; I1375-F1383 HydrophobicContact CG2-CG 3.47Å; I1375-F1383 VanDerWaalsContact CG2-CG 3.47Å; T1376-F1383 HydrophobicContact CG2-CD1 4.24Å; T1376-F1383 HydrophobicContact CG2-CE1 4.25Å; H1379-F1383 WeakPolarHBondContact O-CB 3.35Å; H1379-F1383 PolarHBondContact O-N 3.38Å; Q1381-F1383 VanDerWaalsContact C-N 3.25Å; Q1381-F1383 PolarHBondContact O-N 3.13Å
1384	R	72.4	Confident	73.7	Confident	201 Å²	201	84.1 Å²	84.1	76%	0.758	42%	0.422	S	S	*	.	H	α-helix	trans	-75.7	-23.6	174.2	-87	-178.7	-85.3	-156.3	-6.9	113.1	A1380 Q1381	A1380-R1384 PolarHBondContact O-NE 3Å; A1380-R1384 PolarHBondContact O-NH2 3.24Å; Q1381-R1384 WeakPolarHBondContact O-CA 3.46Å; Q1381-R1384 PolarHBondContact O-N 3.45Å
1385	T	68.4	Low	72.6	Confident	114 Å²	114	85.4 Å²	85.4	70%	0.699	43%	0.429	S	S	*	.	H	α-helix	trans	-92.6	-10.1	173.8	61.9	0	0	0	0	114	Q1381 Q1382	Q1381-T1385 PolarHBondContact O-N 2.94Å; Q1382-T1385 WeakPolarHBondContact CA-OG1 3.4Å; Q1382-T1385 PolarHBondContact O-OG1 3.15Å; Q1382-T1385 VanDerWaalsContact O-OG1 3.13Å
1386	T	64.6	Low	71.6	Confident	61 Å²	61	86.2 Å²	86.2	37%	0.374	44%	0.436	S	S	.	.	S	Bend	trans	-145.3	111.9	-170.1	-22.8	0	0	0	0	111.9	Q1382 V1388	Q1382-T1386 WeakPolarHBondContact O-CB 3.31Å; Q1382-T1386 PolarHBondContact O-N 3.01Å; Q1382-T1386 VanDerWaalsContact O-N 3.09Å; Q1382-T1386 PolarHBondContact O-OG1 2.86Å; T1386-V1388 PolarHBondContact O-N 3.45Å
1387	E	60	Low	70.3	Confident	201 Å²	201	90.4 Å²	90.4	94%	0.939	45%	0.45	S	S	*	.			trans	-67.9	95.5	174.7	-68.4	-165.6	162.7	0	0	111.6	N1389	E1387-N1389 PolarHBondContact O-N 3.42Å
1388	V	65.7	Low	69.1	Low	27 Å²	27	92.1 Å²	92.1	16%	0.164	46%	0.459	C	S	.	.			trans	-88.2	104.7	174.2	176.6	0	0	0	0	109.7	P1359 F1360 T1386 I1390 L1393	P1359-V1388 HydrophobicContact CG-CG1 3.82Å; P1359-V1388 HydrophobicContact CG-CG2 3.9Å; F1360-V1388 HydrophobicContact CE1-CG2 4.35Å; F1360-V1388 HydrophobicContact CE2-CG2 3.94Å; F1360-V1388 HydrophobicContact CZ-CG2 3.52Å; T1386-V1388 PolarHBondContact O-N 3.45Å; V1388-I1390 HydrophobicContact CG1-CG1 4.11Å; V1388-I1390 PolarHBondContact O-N 3.12Å; V1388-L1393 HydrophobicContact CG1-CD1 3.86Å; V1388-L1393 HydrophobicContact CG1-CG 4.43Å
1389	N	68.1	Low	67.5	Low	96 Å²	96	86.4 Å²	86.4	51%	0.513	45%	0.445	S	S	.	.			trans	-74.3	97.5	167.7	-170	-25.8	0	0	0	110.4	E1387 D1391 C1392 L1393	E1387-N1389 PolarHBondContact O-N 3.42Å; N1389-D1391 PolarHBondContact O-N 3.31Å; N1389-D1391 PolarHBondContact OD1-N 3.14Å; N1389-D1391 VanDerWaalsContact OD1-N 3.13Å; N1389-C1392 HydrophobicContact CB-CB 4.1Å; N1389-C1392 VanDerWaalsContact CG-SG 3.52Å; N1389-C1392 WeakPolarHBondContact O-CB 3.43Å; N1389-C1392 PolarHBondContact O-N 3.42Å; N1389-L1393 PolarHBondContact O-N 2.82Å
1390	I	70.8	Confident	65.5	Low	10 Å²	10	91.2 Å²	91.2	5%	0.051	48%	0.478	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-26.2	-175.8	-70.4	166.6	0	0	0	113.4	F1354 K1356 K1368 M1371 M1372 I1375 V1388 C1392	F1354-I1390 HydrophobicContact CE2-CG2 3.61Å; F1354-I1390 HydrophobicContact CZ-CG2 3.58Å; K1356-I1390 WeakPolarHBondContact CD-O 3.28Å; K1368-I1390 HydrophobicContact CD-CG2 4.2Å; K1368-I1390 HydrophobicContact CG-CG2 3.85Å; M1371-I1390 HydrophobicContact CE-CB 4.25Å; M1371-I1390 HydrophobicContact CE-CG1 3.89Å; M1371-I1390 HydrophobicContact CE-CG2 3.7Å; M1372-I1390 HydrophobicContact CG-CD1 3.84Å; M1372-I1390 HydrophobicContact SD-CD1 3.47Å; M1372-I1390 WeakPolarHBondContact SD-CD1 3.13Å; I1375-I1390 HydrophobicContact CD1-CD1 4.43Å; V1388-I1390 HydrophobicContact CG1-CG1 4.11Å; V1388-I1390 PolarHBondContact O-N 3.12Å; I1390-C1392 VanDerWaalsContact C-N 3.31Å
1391	D	71	Confident	63.7	Low	95 Å²	95	94.9 Å²	94.9	51%	0.508	50%	0.498	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-11.8	176.3	-63.6	-54.1	0	0	0	113.2	K1368 N1389	K1368-D1391 IonicContact NZ-OD1 3.84Å; K1368-D1391 PolarHBondContact NZ-OD1 2.89Å; K1368-D1391 IonicContact NZ-OD2 2.87Å; K1368-D1391 PolarHBondContact NZ-OD2 2.86Å; N1389-D1391 PolarHBondContact O-N 3.31Å; N1389-D1391 PolarHBondContact OD1-N 3.14Å; N1389-D1391 VanDerWaalsContact OD1-N 3.13Å
1392	C	73.1	Confident	61.7	Low	97 Å²	97	94.5 Å²	94.5	66%	0.655	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.3	-6	-178.5	-65.8	0	0	0	0	114.6	N1389 I1390	N1389-C1392 HydrophobicContact CB-CB 4.1Å; N1389-C1392 VanDerWaalsContact CG-SG 3.52Å; N1389-C1392 WeakPolarHBondContact O-CB 3.43Å; N1389-C1392 PolarHBondContact O-N 3.42Å; I1390-C1392 VanDerWaalsContact C-N 3.31Å
1393	L	69.6	Low	59.4	Low	38 Å²	38	95.8 Å²	95.8	20%	0.199	52%	0.518	C	S	.	.	S	Bend	trans	-67	139.7	170.5	-70.1	164.6	0	0	0	109.8	K1356 P1359 M1371 V1388 N1389	K1356-L1393 HydrophobicContact CD-CB 4.11Å; K1356-L1393 WeakPolarHBondContact CD-O 3.4Å; K1356-L1393 VanDerWaalsContact CE-O 3.29Å; K1356-L1393 WeakPolarHBondContact CE-O 3.48Å; K1356-L1393 PolarHBondContact NZ-O 3.06Å; P1359-L1393 HydrophobicContact CB-CD2 4.21Å; P1359-L1393 HydrophobicContact CG-CD1 4.37Å; P1359-L1393 HydrophobicContact CG-CD2 4.49Å; M1371-L1393 HydrophobicContact CE-CD1 3.53Å; V1388-L1393 HydrophobicContact CG1-CD1 3.86Å; V1388-L1393 HydrophobicContact CG1-CG 4.43Å; N1389-L1393 PolarHBondContact O-N 2.82Å
1394	P	70.8	Confident	57.3	Low	68 Å²	68	97.3 Å²	97.3	44%	0.442	53%	0.533	S	S	.	.	P	Polyproline II helix	trans	-63.7	154	177.7	27.4	-34.8	0	0	0	111.4	V1399	P1394-V1399 HydrophobicContact CB-CG2 4Å; P1394-V1399 HydrophobicContact CG-CG2 3.77Å
1395	D	61.9	Low	55.3	Low	46 Å²	46	97 Å²	97	25%	0.246	54%	0.538	C	S	.	.	B	Isolated β-bridge	trans	-74.6	145.1	170	-74.6	-44.1	0	0	0	109.8	K1356 E1397 E1398	K1356-D1395 WeakPolarHBondContact CE-OD1 3.43Å; K1356-D1395 VanDerWaalsContact CG-OD1 3.23Å; K1356-D1395 WeakPolarHBondContact CG-OD1 3.44Å; K1356-D1395 IonicContact NZ-OD1 2.77Å; K1356-D1395 PolarHBondContact NZ-OD1 2.74Å; K1356-D1395 IonicContact NZ-OD2 2.86Å; K1356-D1395 PolarHBondContact NZ-OD2 2.74Å; D1395-E1397 PolarHBondContact O-N 2.8Å; D1395-E1398 HydrophobicContact CB-CG 4.36Å; D1395-E1398 PolarHBondContact N-OE2 3.09Å; D1395-E1398 WeakPolarHBondContact O-CB 3.48Å; D1395-E1398 PolarHBondContact O-N 3.48Å
1396	A	63.5	Low	53.5	Low	18 Å²	18	97 Å²	97	15%	0.149	54%	0.542	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-6.8	-168.4	0	0	0	0	0	114.6	N1355 R1357 L1364	N1355-A1396 WeakPolarHBondContact O-CB 3.43Å; N1355-A1396 PolarHBondContact O-N 2.86Å; R1357-A1396 HydrophobicContact CG-CB 4.12Å; L1364-A1396 HydrophobicContact CD1-CB 3.52Å
1397	E	53.9	Low	51.8	Low	164 Å²	164	101 Å²	101	77%	0.766	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.4	-13	171	-67.4	168.7	-131.1	0	0	111.9	N1355 D1395	N1355-E1397 PolarHBondContact ND2-OE1 2.72Å; D1395-E1397 PolarHBondContact O-N 2.8Å
1398	E	54.5	Low	50.3	Low	140 Å²	140	97.2 Å²	97.2	65%	0.654	55%	0.553	S	S	*	*	S	Bend	trans	-93.3	-6.5	178.5	-56.7	-178.7	134.2	0	0	113.1	D1395	D1395-E1398 HydrophobicContact CB-CG 4.36Å; D1395-E1398 PolarHBondContact N-OE2 3.09Å; D1395-E1398 WeakPolarHBondContact O-CB 3.48Å; D1395-E1398 PolarHBondContact O-N 3.48Å
1399	V	46.6	Very low	48.6	Very low	72 Å²	72	101 Å²	101	44%	0.436	58%	0.576	S	S	.	*	S	Bend	trans	-111.3	108.3	178.9	-176.6	0	0	0	0	110.3	P1394 T1401	P1394-V1399 HydrophobicContact CB-CG2 4Å; P1394-V1399 HydrophobicContact CG-CG2 3.77Å; V1399-T1401 PolarHBondContact O-N 3.17Å
1400	P	40.6	Very low	46.7	Very low	118 Å²	118	107.7 Å²	107.7	77%	0.766	60%	0.596	S	S	*	*			trans	-61.3	110.6	174.3	-21.7	33.4	0	0	0	110.5	I1402	P1400-I1402 PolarHBondContact O-N 2.74Å
1401	T	37.1	Very low	44.8	Very low	105 Å²	105	114.1 Å²	114.1	64%	0.644	63%	0.63	S	S	*	*			trans	-76.3	108.3	173.3	-57	0	0	0	0	108.2	V1399 S1403	V1399-T1401 PolarHBondContact O-N 3.17Å; T1401-S1403 PolarHBondContact O-N 3.11Å
1402	I	31.9	Very low	42.8	Very low	154 Å²	154	117.4 Å²	117.4	79%	0.79	65%	0.646	S	S	*	*			trans	-58.6	125.1	179.8	-61.8	171.9	0	0	0	109.1	P1400	P1400-I1402 PolarHBondContact O-N 2.74Å
1403	S	28.6	Very low	40.7	Very low	112 Å²	112	117.2 Å²	117.2	78%	0.783	65%	0.652	S	S	*	*			trans	-111.8	87.5	-176.6	171.6	0	0	0	0	110.8	T1401	T1401-S1403 PolarHBondContact O-N 3.11Å
1404	T	29.8	Very low	38.7	Very low	107 Å²	107	119.5 Å²	119.5	66%	0.656	68%	0.677	S	S	*	*			trans	-166.1	168.1	163.1	-1.6	0	0	0	0	110.7
1405	F	31.3	Very low	36.7	Very low	195 Å²	195	122.6 Å²	122.6	86%	0.855	69%	0.694	S	S	*	*			trans	63.9	80.7	-174.3	-53.5	-75.8	0	0	0	113
1406	S	30	Very low	35	Very low	113 Å²	113	126.2 Å²	126.2	79%	0.79	72%	0.718	S	S	*	*				71.1	118.4	67.9	-160.4	0	0	0	0	113.8
1407	L	29.5	Very low	33.3	Very low	146 Å²	146	130 Å²	130	76%	0.764	74%	0.744	S	S	*	*			trans	-57	154.1	154.8	-80.2	155.2	0	0	0	109.6
1408	P	27.8	Very low	31.9	Very low	121 Å²	121	133.5 Å²	133.5	79%	0.786	75%	0.75	S	S	*	*				-134.8	147.9	87	36.6	-25.1	0	0	0	115.5
1409	T	30.6	Very low	30.5	Very low	106 Å²	106	131.6 Å²	131.6	65%	0.65	75%	0.752	S	S	*	*			trans	-54.5	135.8	158.8	-52.7	0	0	0	0	111.8
1410	Y	28.1	Very low	29.5	Very low	237 Å²	237	135 Å²	135	93%	0.929	76%	0.763	S	S	*	*			trans	-154	163.1	135	-108.9	-73.2	0	0	0	110.7
1411	L	31.5	Very low	28.9	Very low	145 Å²	145	137.7 Å²	137.7	76%	0.759	76%	0.759	S	S	*	*			trans	-114.7	165	-170.5	-77.9	168.5	0	0	0	112.4
1412	L	28.4	Very low	28.5	Very low	163 Å²	163	140.9 Å²	140.9	85%	0.853	77%	0.767	S	S	*	*			trans	75.5	163.7	158	-105	68.3	0	0	0	118.5
1413	A	29	Very low	28.4	Very low	94 Å²	94	142 Å²	142	78%	0.777	77%	0.769	S	S	*	*			trans	58	106	-172.3	0	0	0	0	0	114.1
1414	A	27.6	Very low	28.7	Very low	86 Å²	86	140.6 Å²	140.6	71%	0.711	76%	0.764	S	S	*	*			cis	72.1	133.6	30.3	0	0	0	0	0	115.6
1415	T	27.4	Very low	28.6	Very low	132 Å²	132	139.9 Å²	139.9	81%	0.81	77%	0.769	S	S	*	*			trans	81.7	143.8	169.3	71.8	0	0	0	0	119.3
1416	T	27.2	Very low	28.8	Very low	122 Å²	122	138.7 Å²	138.7	75%	0.748	77%	0.77	S	S	*	*			trans	54	106.4	155	20.6	0	0	0	0	118.5
1417	S	27	Very low	28.8	Very low	98 Å²	98	138.3 Å²	138.3	69%	0.685	76%	0.763	S	S	*	*				99.4	119.8	81.1	61.3	0	0	0	0	111.2
1418	R	26.2	Very low	28.8	Very low	237 Å²	237	138.1 Å²	138.1	89%	0.894	76%	0.763	S	S	*	*				73.8	126.7	64.5	-177	-164.8	168.8	167.5	0.3	112.2
1419	S	24.6	Very low	28.8	Very low	101 Å²	101	138.4 Å²	138.4	71%	0.706	76%	0.758	S	S	*	*			trans	71.6	155.8	176	-125.4	0	0	0	0	112
1420	Q	25.5	Very low	28.8	Very low	143 Å²	143	139.3 Å²	139.3	67%	0.668	76%	0.755	S	S	*	*			cis	-124.7	-162.8	10.8	-62.7	162.1	-9.1	0	0	108.2
1421	Y	27.7	Very low	28.8	Very low	175 Å²	175	134.9 Å²	134.9	69%	0.686	74%	0.742	S	S	*	*			cis	-160.5	148.2	13.9	-21.9	-116	0	0	0	108
1422	E	28.8	Very low	28.6	Very low	172 Å²	172	137.7 Å²	137.7	80%	0.804	74%	0.743	S	S	*	*			trans	55.2	152.9	150.6	-70.2	128.3	-173.5	0	0	120.6
1423	E	30.1	Very low	28.6	Very low	177 Å²	177	133.7 Å²	133.7	83%	0.827	73%	0.729	S	S	*	*			cis	-150.9	175.9	1.2	-138.8	179.9	121.2	0	0	112.2
1424	A	34.5	Very low	28.8	Very low	82 Å²	82	137.5 Å²	137.5	68%	0.678	73%	0.73	S	S	*	*			trans	27.7	115.5	164.1	0	0	0	0	0	120
1425	A	28.8	Very low	29	Very low	92 Å²	92	137.8 Å²	137.8	76%	0.76	73%	0.727	S	S	*	*				71	109.1	50.4	0	0	0	0	0	115.6
1426	L	34.5	Very low	29.3	Very low	170 Å²	170	135.7 Å²	135.7	89%	0.89	72%	0.723	S	S	*	*			trans	164	144.6	147.5	-90.8	167.8	0	0	0	108.4
1427	V	30.7	Very low	29.6	Very low	105 Å²	105	134.9 Å²	134.9	64%	0.636	72%	0.72	S	S	*	*			cis	-179.1	133.9	-47.1	138	0	0	0	0	105.9
1428	D	28	Very low	29.6	Very low	143 Å²	143	136.4 Å²	136.4	77%	0.765	72%	0.72	S	S	*	*			trans	58.1	160.9	174.1	-54.1	-22.4	0	0	0	115.2
1429	N	29.4	Very low	29.6	Very low	126 Å²	126	131.4 Å²	131.4	67%	0.674	71%	0.707	S	S	*	*			cis	-158.1	161.6	19.4	-141	17.2	0	0	0	106.8
1430	E	30.3	Very low	29.7	Very low	125 Å²	125	133.5 Å²	133.5	58%	0.584	71%	0.705	S	S	*	*			cis	-164.5	143.4	-4.6	-153.4	168.9	168.7	0	0	108.9
1431	Q	27.3	Very low	29.7	Very low	144 Å²	144	131.3 Å²	131.3	67%	0.673	71%	0.706	S	S	*	*			trans	56	152.5	154.3	-73.3	168.4	42.5	0	0	119.1
1432	R	28.4	Very low	29.7	Very low	204 Å²	204	128.9 Å²	128.9	77%	0.77	71%	0.714	S	S	*	*			cis	-160.2	167.7	14.5	-149.8	-179.4	169	132	-9	109.8
1433	S	28.8	Very low	29.7	Very low	79 Å²	79	124.8 Å²	124.8	55%	0.552	71%	0.71	S	S	*	*			trans	31	135.9	144.8	54.3	0	0	0	0	120.9
1434	E	32.6	Very low	29.6	Very low	175 Å²	175	121.4 Å²	121.4	82%	0.818	71%	0.705	S	S	*	*			cis	-162	-166.1	16.3	-128.3	159.8	112.3	0	0	112.3
1435	S	31.9	Very low	29.2	Very low	92 Å²	92	126.1 Å²	126.1	64%	0.643	71%	0.713	S	S	*	*			trans	-30.2	146.1	169.2	54.3	0	0	0	0	115.9
1436	A	32.6	Very low	29.3	Very low	88 Å²	88	126 Å²	126	73%	0.727	71%	0.712	S	S	*	*				55.6	155.2	60.1	0	0	0	0	0	112.2
1437	P	34.2	Very low	29.1	Very low	105 Å²	105	125 Å²	125	68%	0.682	71%	0.708	S	S	*	*			cis	-147.1	-161.1	24.5	41.1	-17.1	0	0	0	115.1
1438	L	27	Very low	28.9	Very low	130 Å²	130	124.9 Å²	124.9	68%	0.681	71%	0.711	S	S	*	*			trans	27	127.4	130.9	-65.1	170.7	0	0	0	118.9
1439	Q	26.7	Very low	29.1	Very low	132 Å²	132	121.6 Å²	121.6	62%	0.617	71%	0.711	S	S	*	*				89.7	160.3	80.4	-159.9	-178	45.5	0	0	112.3
1440	Q	26.3	Very low	29.3	Very low	145 Å²	145	122.6 Å²	122.6	68%	0.678	72%	0.716	S	S	*	*			trans	62.7	129.1	174.3	-73.3	117.1	20.5	0	0	115.9
1441	S	26.5	Very low	29.5	Very low	97 Å²	97	122.7 Å²	122.7	68%	0.678	73%	0.725	S	S	*	*			cis	80.1	155.7	40.1	83.8	0	0	0	0	114.6
1442	S	26.9	Very low	29.8	Very low	123 Å²	123	119.5 Å²	119.5	86%	0.86	73%	0.732	S	S	*	*			trans	70.2	146.8	-171.6	82.6	0	0	0	0	113.7
1443	A	29.2	Very low	29.9	Very low	86 Å²	86	112.9 Å²	112.9	71%	0.711	73%	0.727	S	S	*	*			cis	-144.7	162.7	-22.6	0	0	0	0	0	106.1
1444	C	27.4	Very low	30.2	Very low	107 Å²	107	116.9 Å²	116.9	72%	0.723	74%	0.741	S	S	*	*			cis	-152.7	154.9	25.4	39.8	0	0	0	0	106.8
1445	E	26.7	Very low	30	Very low	181 Å²	181	113.9 Å²	113.9	85%	0.846	74%	0.74	S	S	*	*				44.7	107.9	73.7	-51.1	170.7	123	0	0	110.1
1446	A	31.3	Very low	30.1	Very low	90 Å²	90	112.5 Å²	112.5	74%	0.744	74%	0.739	S	S	*	*				-144.9	149.5	52.4	0	0	0	0	0	111
1447	N	28.9	Very low	30.3	Very low	149 Å²	149	115.6 Å²	115.6	80%	0.797	74%	0.744	S	S	*	*				54.4	104.8	83.7	-120.2	21	0	0	0	111.8
1448	S	26.3	Very low	30.2	Very low	102 Å²	102	118.7 Å²	118.7	71%	0.713	75%	0.749	S	S	*	*				83.4	117.8	92.6	70.7	0	0	0	0	113.1
1449	G	33.3	Very low	30.5	Very low	74 Å²	74	116.5 Å²	116.5	76%	0.763	75%	0.75	S	S	*	*			trans	154.6	72.3	-171.4	0	0	0	0	0	109.6
1450	D	32.6	Very low	31.1	Very low	147 Å²	147	115.5 Å²	115.5	79%	0.786	76%	0.755	S	S	*	*				84.2	140.7	58.5	-168	28.6	0	0	0	112.7
1451	T	34.3	Very low	31.5	Very low	126 Å²	126	116.6 Å²	116.6	77%	0.773	76%	0.764	S	S	*	*			trans	59.4	149.1	-172.1	65.6	0	0	0	0	115
1452	G	33.4	Very low	31.6	Very low	78 Å²	78	118.7 Å²	118.7	80%	0.804	77%	0.768	S	S	*	*			cis	105.3	127.7	16.1	0	0	0	0	0	109.6
1453	G	31.7	Very low	31.7	Very low	65 Å²	65	119.2 Å²	119.2	67%	0.67	76%	0.761	S	S	*	*			cis	-177.5	-147.7	-0.9	0	0	0	0	0	108.4
1454	L	34.1	Very low	31.8	Very low	163 Å²	163	120.2 Å²	120.2	85%	0.853	76%	0.763	S	S	*	*			trans	63.9	106.2	155.9	-52.7	-178.6	0	0	0	116.6
1455	S	28.8	Very low	31.8	Very low	112 Å²	112	122.7 Å²	122.7	78%	0.783	77%	0.768	S	S	*	*				71.7	129.5	75	73.4	0	0	0	0	114.9
1456	G	35.1	Very low	31.7	Very low	62 Å²	62	119.1 Å²	119.1	64%	0.639	76%	0.763	S	S	*	*			trans	147.6	82	170.9	0	0	0	0	0	116.2
1457	D	35.2	Very low	31.5	Very low	153 Å²	153	120.6 Å²	120.6	82%	0.818	76%	0.762	S	S	*	*				53.3	123.9	123.8	-46.5	-24.2	0	0	0	123.5
1458	E	32.9	Very low	31.6	Very low	170 Å²	170	122.2 Å²	122.2	79%	0.794	76%	0.762	S	S	*	*			trans	63.9	110.1	131	-59.8	-54.5	96.7	0	0	124.5
1459	A	33.6	Very low	31.7	Very low	85 Å²	85	123.9 Å²	123.9	70%	0.702	76%	0.762	S	S	*	*			trans	74.1	175.6	133.7	0	0	0	0	0	119.2
1460	P	39.4	Very low	31.5	Very low	111 Å²	111	127.8 Å²	127.8	72%	0.721	76%	0.76	S	S	*	*				-133.8	179.1	-67.7	41.1	-28	0	0	0	115.4
1461	L	33.6	Very low	31.3	Very low	167 Å²	167	125.5 Å²	125.5	87%	0.874	75%	0.748	S	S	*	*			trans	73.9	122	157.7	-73.5	165.1	0	0	0	121.8
1462	D	28.4	Very low	31.1	Very low	142 Å²	142	124.5 Å²	124.5	76%	0.759	75%	0.746	S	S	*	*			trans	81.6	157.4	137.1	-147.6	16.8	0	0	0	122.8
1463	L	30	Very low	30.7	Very low	134 Å²	134	123.9 Å²	123.9	70%	0.702	73%	0.729	S	S	*	*			trans	60.4	101.3	160.9	-77.1	161.2	0	0	0	122
1464	S	31.5	Very low	30.6	Very low	107 Å²	107	131.3 Å²	131.3	75%	0.748	74%	0.738	S	S	*	*				81	145.4	124.8	79.8	0	0	0	0	122.8
1465	L	25.9	Very low	30.5	Very low	158 Å²	158	126.9 Å²	126.9	83%	0.827	73%	0.732	S	S	*	*			trans	-29.5	130.3	164.2	-65.3	141.8	0	0	0	117.4
1466	S	26	Very low	30.7	Very low	106 Å²	106	127.5 Å²	127.5	74%	0.741	73%	0.731	S	S	*	*				164.7	130.4	108.1	-74.9	0	0	0	0	117.8
1467	V	26.9	Very low	30.5	Very low	121 Å²	121	129.3 Å²	129.3	73%	0.733	73%	0.734	S	S	*	*			trans	38.6	116.5	133.6	-167.7	0	0	0	0	121.9
1468	K	31.7	Very low	30.2	Very low	184 Å²	184	127.1 Å²	127.1	80%	0.8	73%	0.731	S	S	*	*			trans	-175.5	137.4	130.8	-96.5	145	-171.9	178.1	0	109.2
1469	L	27.8	Very low	30.2	Very low	137 Å²	137	127.6 Å²	127.6	72%	0.717	73%	0.733	S	S	*	*				66.2	140	71	-69.5	156	0	0	0	112.3
1470	H	29.2	Very low	30	Very low	156 Å²	156	128 Å²	128	72%	0.722	73%	0.731	S	S	*	*			cis	-148.5	177.2	9.5	-145.7	-163.6	0	0	0	108.5
1471	N	27.5	Very low	29.4	Very low	99 Å²	99	129.3 Å²	129.3	53%	0.529	73%	0.731	S	S	.	*			cis	-130.3	-106.2	1.7	-176.8	7.6	0	0	0	110.5	C1473	N1471-C1473 PolarHBondContact ND2-SG 3.03Å
1472	S	29.8	Very low	29.2	Very low	105 Å²	105	128.2 Å²	128.2	73%	0.734	73%	0.726	S	S	*	*			cis	-171.9	149	-13.3	-132	0	0	0	0	108.4
1473	C	26.2	Very low	29.3	Very low	64 Å²	64	124.2 Å²	124.2	43%	0.432	72%	0.718	S	S	.	*			cis	-160.7	137.8	-28.2	-128	0	0	0	0	111.4	N1471	N1471-C1473 PolarHBondContact ND2-SG 3.03Å
1474	Y	29	Very low	29.3	Very low	221 Å²	221	128.3 Å²	128.3	87%	0.867	73%	0.726	S	S	*	*			trans	54.9	150	163.4	-48.5	-57	0	0	0	119.4
1475	G	32.1	Very low	29	Very low	70 Å²	70	131.9 Å²	131.9	72%	0.722	73%	0.728	S	S	*	*			cis	-174.8	-169.8	-3	0	0	0	0	0	108.7
1476	T	33	Very low	29.1	Very low	125 Å²	125	134.3 Å²	134.3	77%	0.767	73%	0.727	S	S	*	*			cis	-155.2	165.2	-1.2	47.1	0	0	0	0	110.3
1477	S	31.3	Very low	29.1	Very low	101 Å²	101	135.2 Å²	135.2	71%	0.706	72%	0.723	S	S	*	*			trans	53.3	114.4	154.5	50.2	0	0	0	0	119.6
1478	S	28.9	Very low	29.1	Very low	107 Å²	107	135.5 Å²	135.5	75%	0.748	73%	0.725	S	S	*	*				68.5	114.2	66.1	-164	0	0	0	0	112.2
1479	Q	33.3	Very low	29	Very low	180 Å²	180	130.1 Å²	130.1	84%	0.841	72%	0.715	S	S	*	*				175.3	162.8	93.2	-91	-173.5	56.7	0	0	108.4
1480	S	29.1	Very low	28.9	Very low	94 Å²	94	131 Å²	131	66%	0.657	72%	0.715	S	S	*	*			cis	-161.5	-174.2	-11.1	-165.2	0	0	0	0	110
1481	L	27.5	Very low	28.9	Very low	137 Å²	137	130.1 Å²	130.1	72%	0.717	71%	0.711	S	S	*	*			trans	-36.3	160.4	158	-76.6	60.2	0	0	0	113.8
1482	D	27.9	Very low	29.1	Very low	144 Å²	144	130.5 Å²	130.5	77%	0.77	71%	0.713	S	S	*	*			cis	-157.8	171.9	-0.7	-107.8	-26.3	0	0	0	105.7
1483	G	32	Very low	29	Very low	58 Å²	58	134.6 Å²	134.6	60%	0.598	71%	0.713	S	S	*	*			cis	145.2	-168.4	26.8	0	0	0	0	0	107.7
1484	Y	28.5	Very low	29.1	Very low	220 Å²	220	136.7 Å²	136.7	86%	0.863	72%	0.716	S	S	*	*			trans	35.8	95.3	163	-71	-91.1	0	0	0	118.7
1485	F	26.6	Very low	29	Very low	182 Å²	182	134.7 Å²	134.7	80%	0.798	71%	0.712	S	S	*	*				56.7	134.6	70.4	-129.4	-40.9	0	0	0	114.1
1486	R	27.5	Very low	28.9	Very low	210 Å²	210	135.2 Å²	135.2	79%	0.792	71%	0.709	S	S	*	*			trans	72.9	156.4	165	-65.1	-171.4	174.2	157.6	-1.4	115.6
1487	N	25.8	Very low	28.6	Very low	124 Å²	124	134.1 Å²	134.1	66%	0.663	71%	0.707	S	S	*	*			cis	-170.1	171.7	-17.4	-109.5	1.7	0	0	0	107.4
1488	V	26.6	Very low	28.5	Very low	128 Å²	128	135 Å²	135	78%	0.776	71%	0.708	S	S	*	*			trans	69.4	142.8	144.2	152.5	0	0	0	0	116.1
1489	A	28.6	Very low	28.4	Very low	71 Å²	71	135 Å²	135	59%	0.587	71%	0.708	S	S	*	*			cis	-160.2	-141.5	-24	0	0	0	0	0	106.5
1490	Q	26.7	Very low	28.2	Very low	155 Å²	155	132.2 Å²	132.2	72%	0.724	70%	0.703	S	S	*	*			trans	38.6	107.3	139.4	-73.7	168.5	-104	0	0	115.7
1491	E	28	Very low	28.1	Very low	138 Å²	138	133.6 Å²	133.6	65%	0.645	71%	0.708	S	S	*	*				157.4	170.9	62.8	-104.3	166.2	-134.3	0	0	104.8
1492	N	31.9	Very low	28.1	Very low	107 Å²	107	131.3 Å²	131.3	57%	0.572	70%	0.703	S	S	*	*			cis	-133	152.5	-1.7	-106.9	-44	0	0	0	106.1
1493	R	28.7	Very low	28.2	Very low	191 Å²	191	133.8 Å²	133.8	72%	0.721	70%	0.702	S	S	*	*				46.4	139.3	79.7	-62.4	-177.5	157.9	-137.6	19.8	113.4
1494	Q	28.9	Very low	28.2	Very low	108 Å²	108	136 Å²	136	51%	0.505	70%	0.7	S	S	.	*			cis	-170.9	-176.9	-1.7	-115.9	167.9	-36.4	0	0	108.9
1495	F	26.5	Very low	28.3	Very low	179 Å²	179	133.6 Å²	133.6	79%	0.785	70%	0.697	S	S	*	*			trans	73.2	151.7	158.1	-56.6	-55.7	0	0	0	117
1496	A	29.1	Very low	28.8	Very low	80 Å²	80	131 Å²	131	66%	0.661	69%	0.691	S	S	*	*			cis	-147.2	131.7	-6.9	0	0	0	0	0	108.6
1497	S	28	Very low	29	Very low	102 Å²	102	128.1 Å²	128.1	71%	0.713	69%	0.69	S	S	*	*				80.1	156.8	98	-48.3	0	0	0	0	113.2
1498	T	28.7	Very low	29.1	Very low	120 Å²	120	128.3 Å²	128.3	74%	0.736	69%	0.691	S	S	*	*			cis	-157.2	144.6	13.7	-27.4	0	0	0	0	112.1
1499	S	26.6	Very low	29.2	Very low	106 Å²	106	130.1 Å²	130.1	74%	0.741	69%	0.691	S	S	*	*			trans	62.6	168.4	151.5	63.5	0	0	0	0	118
1500	V	29.6	Very low	29.4	Very low	123 Å²	123	131.9 Å²	131.9	75%	0.745	69%	0.694	S	S	*	*			cis	-135.4	165.2	16.6	-178.3	0	0	0	0	111.5
1501	T	26.6	Very low	29.5	Very low	123 Å²	123	130.2 Å²	130.2	76%	0.755	70%	0.695	S	S	*	*			trans	-52.3	172	173	57.8	0	0	0	0	114.6
1502	S	27.8	Very low	29.4	Very low	88 Å²	88	128.3 Å²	128.3	62%	0.615	70%	0.696	S	S	*	*			cis	-162.4	156.4	31.1	-124.3	0	0	0	0	109.8
1503	R	29.3	Very low	29.3	Very low	197 Å²	197	126.1 Å²	126.1	74%	0.743	70%	0.699	S	S	*	*				59.6	143.6	91.5	-59.3	-171.7	69	129.7	14.9	115
1504	D	31.4	Very low	29.3	Very low	105 Å²	105	125.4 Å²	125.4	56%	0.561	70%	0.704	S	S	*	*			cis	-160.1	168.3	22.7	-113.3	-22.9	0	0	0	111.7
1505	E	31.6	Very low	29.3	Very low	169 Å²	169	127.3 Å²	127.3	79%	0.79	72%	0.718	S	S	*	*			trans	32	146.1	150.5	-40.6	-63.9	62.6	0	0	122.8
1506	D	36.5	Very low	29.5	Very low	128 Å²	128	125.8 Å²	125.8	68%	0.684	71%	0.713	S	S	*	*			cis	-138.7	-107.8	-15.2	-177.7	23.1	0	0	0	109.7
1507	L	31.7	Very low	29.4	Very low	148 Å²	148	129.2 Å²	129.2	78%	0.775	72%	0.715	S	S	*	*			cis	-153.2	153.3	-6.1	-173	58.7	0	0	0	112.1
1508	N	29.2	Very low	29.5	Very low	128 Å²	128	129.7 Å²	129.7	68%	0.684	71%	0.714	S	S	*	*			trans	-64	172.4	172.3	-65.3	-77.8	0	0	0	112.9
1509	H	27.7	Very low	29.6	Very low	166 Å²	166	128.6 Å²	128.6	77%	0.769	70%	0.702	S	S	*	*			cis	-169.9	170.1	45.4	-171.3	-99.7	0	0	0	113.4
1510	V	34.1	Very low	29.7	Very low	108 Å²	108	129 Å²	129	66%	0.655	71%	0.705	S	S	*	*			trans	-75.7	166.7	172.6	170.2	0	0	0	0	111.5
1511	V	28.6	Very low	29.7	Very low	121 Å²	121	133.2 Å²	133.2	73%	0.733	71%	0.707	S	S	*	*			trans	156.6	103	150.4	155.7	0	0	0	0	104.7
1512	S	26.1	Very low	29.9	Very low	97 Å²	97	132.1 Å²	132.1	68%	0.678	71%	0.705	S	S	*	*				77.7	118.6	60.9	-62.7	0	0	0	0	112.2
1513	G	28.7	Very low	29.9	Very low	61 Å²	61	134.3 Å²	134.3	63%	0.629	72%	0.719	S	S	*	*			trans	72.1	170.9	175.1	0	0	0	0	0	114.9
1514	E	29	Very low	29.9	Very low	176 Å²	176	129.8 Å²	129.8	82%	0.822	72%	0.717	S	S	*	*			cis	-160	137.7	-18.2	-124.7	142.2	-147.8	0	0	107.6
1515	D	29.1	Very low	30	Very low	148 Å²	148	130.5 Å²	130.5	79%	0.791	73%	0.727	S	S	*	*			trans	61.6	166.2	169.3	-55	-29	0	0	0	116.3
1516	H	29.8	Very low	29.9	Very low	147 Å²	147	127.9 Å²	127.9	68%	0.681	73%	0.728	S	S	*	*			cis	-132.6	159.7	4.8	-150.8	-74.7	0	0	0	111.3
1517	E	27.8	Very low	29.6	Very low	152 Å²	152	126.8 Å²	126.8	71%	0.71	73%	0.728	S	S	*	*			trans	-50.9	163.4	159.1	-48.4	178.5	100.7	0	0	110.5
1518	V	29.6	Very low	29.8	Very low	113 Å²	113	124.6 Å²	124.6	69%	0.685	73%	0.725	S	S	*	*				-163.1	117.5	93	143.1	0	0	0	0	111.8
1519	I	30.2	Very low	29.9	Very low	97 Å²	97	121.7 Å²	121.7	50%	0.497	71%	0.714	S	S	.	*			trans	49.3	104	131.8	-52.7	174	0	0	0	116.3
1520	S	29	Very low	30.2	Very low	114 Å²	114	122 Å²	122	80%	0.797	72%	0.716	S	S	*	*				55	76.5	60.4	-54.7	0	0	0	0	116.4
1521	R	31	Very low	30.2	Very low	211 Å²	211	124.4 Å²	124.4	80%	0.796	72%	0.721	S	S	*	*			trans	-142.1	109.7	142.9	-82.8	107.9	-163.8	-109.4	7.5	108.8
1522	S	29.4	Very low	30.4	Very low	101 Å²	101	128.2 Å²	128.2	71%	0.706	72%	0.722	S	S	*	*				66.2	97.7	60.4	83.2	0	0	0	0	113.8
1523	C	29.2	Very low	30.6	Very low	134 Å²	134	132.1 Å²	132.1	91%	0.905	73%	0.727	S	S	*	*			trans	-141.8	116.4	141	-157.8	0	0	0	0	108.7
1524	S	29.3	Very low	30.9	Very low	102 Å²	102	135.7 Å²	135.7	71%	0.713	73%	0.731	S	S	*	*			trans	-97.7	-166.5	-168.7	-53.1	0	0	0	0	110.6
1525	P	33.4	Very low	31.1	Very low	119 Å²	119	129.4 Å²	129.4	77%	0.773	71%	0.709	S	S	*	*				-122.9	135.5	-97.4	34	-17.6	0	0	0	113.7
1526	S	29.1	Very low	31.3	Very low	114 Å²	114	124.8 Å²	124.8	80%	0.797	69%	0.691	S	S	*	*			trans	-96.6	118.6	170.1	-165.8	0	0	0	0	111.4	S1528	S1526-S1528 PolarHBondContact O-N 3.14Å
1527	P	30.4	Very low	31.4	Very low	105 Å²	105	125.1 Å²	125.1	68%	0.682	70%	0.697	S	S	*	*			trans	-82.5	74.5	-165.5	32.9	-37.2	0	0	0	114.2	S1529	P1527-S1529 WeakPolarHBondContact CA-OG 3.42Å; P1527-S1529 WeakPolarHBondContact CB-OG 3.5Å; P1527-S1529 PolarHBondContact O-N 2.91Å; P1527-S1529 VanDerWaalsContact O-N 3.13Å
1528	S	34.6	Very low	31.5	Very low	102 Å²	102	121.4 Å²	121.4	71%	0.713	69%	0.692	S	S	*	*			trans	-83.6	55.7	160.3	-76.3	0	0	0	0	111.3	S1526	S1526-S1528 PolarHBondContact O-N 3.14Å
1529	S	31	Very low	31.8	Very low	67 Å²	67	124.9 Å²	124.9	47%	0.469	69%	0.693	S	S	.	*			trans	-74.8	139.3	-152.9	-59.7	0	0	0	0	117	P1527 Q1531	P1527-S1529 WeakPolarHBondContact CA-OG 3.42Å; P1527-S1529 WeakPolarHBondContact CB-OG 3.5Å; P1527-S1529 PolarHBondContact O-N 2.91Å; P1527-S1529 VanDerWaalsContact O-N 3.13Å; S1529-Q1531 VanDerWaalsContact C-N 3.27Å; S1529-Q1531 PolarHBondContact O-N 3.15Å
1530	Q	35.1	Very low	32	Very low	172 Å²	172	126.6 Å²	126.6	80%	0.804	71%	0.71	S	S	*	*	S	Bend		55.7	-9.8	129.2	-65.7	167.2	-37.8	0	0	122.1	R1532	Q1530-R1532 PolarHBondContact O-N 3.24Å
1531	Q	33.4	Very low	32.1	Very low	160 Å²	160	127.7 Å²	127.7	75%	0.748	70%	0.703	S	S	*	*	H	α-helix	trans	-69.1	-18.6	161.6	-82.2	-165.2	-6.2	0	0	111.9	S1529 F1533 A1535	S1529-Q1531 VanDerWaalsContact C-N 3.27Å; S1529-Q1531 PolarHBondContact O-N 3.15Å; Q1531-F1533 PolarHBondContact O-N 2.9Å; Q1531-A1535 WeakPolarHBondContact O-CA 3.15Å; Q1531-A1535 WeakPolarHBondContact O-CB 3.29Å; Q1531-A1535 PolarHBondContact O-N 3.43Å
1532	R	33.4	Very low	32	Very low	200 Å²	200	122.5 Å²	122.5	76%	0.755	69%	0.686	S	S	*	*	H	α-helix	trans	-76.6	-12.9	-173.2	-71.6	-173.3	-176	133	3.2	116.6	Q1530 A1536	Q1530-R1532 PolarHBondContact O-N 3.24Å; R1532-A1536 WeakPolarHBondContact O-CB 3.19Å; R1532-A1536 PolarHBondContact O-N 3.5Å
1533	F	30.9	Very low	32	Very low	180 Å²	180	129.2 Å²	129.2	79%	0.789	70%	0.696	S	S	*	*	H	α-helix	trans	-90.4	-35	171.5	-130.6	-102.1	0	0	0	112.6	Q1531 A1536	Q1531-F1533 PolarHBondContact O-N 2.9Å; F1533-A1536 WeakPolarHBondContact O-CB 3.36Å; F1533-A1536 PolarHBondContact O-N 3.11Å
1534	L	34.1	Very low	32.3	Very low	136 Å²	136	130.2 Å²	130.2	71%	0.712	69%	0.685	S	S	*	*	H	α-helix	trans	-72.9	-28.3	165.3	-64.9	178.5	0	0	0	112.2	L1537 A1538	L1534-L1537 CarbonylContact O-C 3.38Å; L1534-L1537 WeakPolarHBondContact O-CB 3.34Å; L1534-L1537 PolarHBondContact O-N 3.49Å; L1534-A1538 PolarHBondContact O-N 3.26Å; L1534-A1538 VanDerWaalsContact O-N 3.12Å
1535	A	32.9	Very low	33	Very low	44 Å²	44	136.3 Å²	136.3	36%	0.364	69%	0.693	S	S	.	*	T	Hydrogen-bonded Turn	trans	-85.4	-5.5	171.1	0	0	0	0	0	114.3	Q1531 L1537 A1538 R1539	Q1531-A1535 WeakPolarHBondContact O-CA 3.15Å; Q1531-A1535 WeakPolarHBondContact O-CB 3.29Å; Q1531-A1535 PolarHBondContact O-N 3.43Å; A1535-L1537 VanDerWaalsContact C-N 3.26Å; A1535-A1538 CarbonylContact O-C 3.49Å; A1535-A1538 PolarHBondContact O-N 2.96Å; A1535-R1539 WeakPolarHBondContact O-CG 3.45Å; A1535-R1539 PolarHBondContact O-N 3.43Å; A1535-R1539 VanDerWaalsContact O-N 3.1Å
1536	A	33.4	Very low	34.8	Very low	50 Å²	50	134.6 Å²	134.6	41%	0.413	68%	0.68	S	S	.	*	T	Hydrogen-bonded Turn	trans	-65.3	-37.8	158.6	0	0	0	0	0	109.8	R1532 F1533	R1532-A1536 WeakPolarHBondContact O-CB 3.19Å; R1532-A1536 PolarHBondContact O-N 3.5Å; F1533-A1536 WeakPolarHBondContact O-CB 3.36Å; F1533-A1536 PolarHBondContact O-N 3.11Å
1537	L	32.6	Very low	37	Very low	154 Å²	154	136.1 Å²	136.1	81%	0.806	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.8	-16.8	172.3	-58.4	173.2	0	0	0	113.6	L1534 A1535	L1534-L1537 CarbonylContact O-C 3.38Å; L1534-L1537 WeakPolarHBondContact O-CB 3.34Å; L1534-L1537 PolarHBondContact O-N 3.49Å; A1535-L1537 VanDerWaalsContact C-N 3.26Å
1538	A	29.8	Very low	39.4	Very low	74 Å²	74	133.1 Å²	133.1	61%	0.612	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.5	15.7	-179.9	0	0	0	0	0	115.7	L1534 A1535	L1534-A1538 PolarHBondContact O-N 3.26Å; L1534-A1538 VanDerWaalsContact O-N 3.12Å; A1535-A1538 CarbonylContact O-C 3.49Å; A1535-A1538 PolarHBondContact O-N 2.96Å
1539	R	36.2	Very low	41.9	Very low	187 Å²	187	130.7 Å²	130.7	71%	0.706	63%	0.633	S	S	*	*	S	Bend	trans	-58.3	142.9	167.3	-67.3	-170.9	177.3	-166.6	-0.1	109.5	A1535 Q1541	A1535-R1539 WeakPolarHBondContact O-CG 3.45Å; A1535-R1539 PolarHBondContact O-N 3.43Å; A1535-R1539 VanDerWaalsContact O-N 3.1Å; R1539-Q1541 PolarHBondContact O-N 3.33Å
1540	P	33	Very low	44.4	Very low	132 Å²	132	132.5 Å²	132.5	86%	0.857	64%	0.643	S	S	*	*			trans	-72.4	70.2	167.8	31.6	-34.9	0	0	0	110.1	K1542	P1540-K1542 PolarHBondContact O-N 3Å
1541	Q	32.5	Very low	46.8	Very low	137 Å²	137	127.2 Å²	127.2	64%	0.64	63%	0.625	S	S	*	*			trans	-42.4	131.5	166.5	-85.4	-75.3	4.8	0	0	108.8	R1539 R1543	R1539-Q1541 PolarHBondContact O-N 3.33Å; Q1541-R1543 VanDerWaalsContact C-N 3.32Å; Q1541-R1543 PolarHBondContact O-N 2.89Å
1542	K	28.4	Very low	49.5	Very low	103 Å²	103	120.8 Å²	120.8	45%	0.448	60%	0.595	S	S	.	*			trans	-58.1	100.1	172.4	-68.5	178.9	-177.2	179.5	0	106.5	P1540 F1544	P1540-K1542 PolarHBondContact O-N 3Å; K1542-F1544 WeakPolarHBondContact O-CA 3.37Å; K1542-F1544 PolarHBondContact O-N 2.61Å
1543	R	28.8	Very low	52.2	Low	241 Å²	241	113 Å²	113	91%	0.909	57%	0.57	S	S	*	*			trans	-43.9	104.7	-165.5	-174.1	-175.3	-65.7	-166.9	-1.1	109.6	Q1541 R1545	Q1541-R1543 VanDerWaalsContact C-N 3.32Å; Q1541-R1543 PolarHBondContact O-N 2.89Å; R1543-R1545 PolarHBondContact O-N 2.87Å
1544	F	35.1	Very low	55	Low	155 Å²	155	107.7 Å²	107.7	68%	0.68	55%	0.547	S	S	*	.			trans	-57.1	128	-169.3	-104.7	-100	0	0	0	107.8	K1542 T1546	K1542-F1544 WeakPolarHBondContact O-CA 3.37Å; K1542-F1544 PolarHBondContact O-N 2.61Å; F1544-T1546 PolarHBondContact O-N 3.25Å
1545	R	45.8	Very low	57.7	Low	231 Å²	231	101.4 Å²	101.4	87%	0.872	51%	0.514	S	S	*	.			trans	-69.4	108.7	175	-171	-179	-164.9	-169.9	2.6	105.7	R1543 H1547	R1543-R1545 PolarHBondContact O-N 2.87Å; R1545-H1547 PolarHBondContact O-N 2.72Å
1546	T	70.3	Confident	60.5	Low	82 Å²	82	99.3 Å²	99.3	50%	0.503	50%	0.497	S	S	.	.			trans	-46.4	111.8	178.2	48.8	0	0	0	0	109	F1544 L1548 V1584	F1544-T1546 PolarHBondContact O-N 3.25Å; T1546-L1548 WeakPolarHBondContact O-CD1 3.48Å; T1546-L1548 PolarHBondContact O-N 2.88Å; T1546-V1584 HydrophobicContact CG2-CG2 4.2Å
1547	H	74.5	Confident	63.2	Low	147 Å²	147	103.9 Å²	103.9	68%	0.681	50%	0.503	S	S	*	.			trans	-85.6	109.5	-178.7	-166.9	-90.2	0	0	0	107.4	R1545	R1545-H1547 PolarHBondContact O-N 2.72Å
1548	L	81.6	Confident	65.9	Low	42 Å²	42	99.5 Å²	99.5	22%	0.22	48%	0.476	C	S	.	.			trans	-79	129.4	177.9	-74	61.5	0	0	0	107.8	T1546 V1553 M1556 L1580 V1584	T1546-L1548 WeakPolarHBondContact O-CD1 3.48Å; T1546-L1548 PolarHBondContact O-N 2.88Å; L1548-V1553 HydrophobicContact CB-CG2 3.66Å; L1548-V1553 HydrophobicContact CD2-CG2 4.05Å; L1548-M1556 HydrophobicContact CD2-CE 3.68Å; L1548-L1580 HydrophobicContact CD2-CD1 4.26Å; L1548-L1580 HydrophobicContact CG-CD1 3.91Å; L1548-L1580 HydrophobicContact CG-CD2 4.34Å; L1548-V1584 HydrophobicContact CD1-CG1 3.91Å; L1548-V1584 HydrophobicContact CD2-CG1 4.49Å; L1548-V1584 HydrophobicContact CG-CG1 4.42Å
1549	T	86.8	Confident	68.6	Low	51 Å²	51	96 Å²	96	31%	0.313	45%	0.447	S	S	.	.			trans	-68.8	155.3	176.9	69.2	0	0	0	0	110.8	S1551 Q1552 V1553	T1549-S1551 PolarHBondContact O-N 3.33Å; T1549-S1551 PolarHBondContact OG1-OG 3.06Å; T1549-Q1552 PolarHBondContact O-N 2.84Å; T1549-Q1552 VanDerWaalsContact O-N 3.17Å; T1549-Q1552 WeakPolarHBondContact OG1-CB 3.16Å; T1549-Q1552 VanDerWaalsContact OG1-CG 3.24Å; T1549-Q1552 WeakPolarHBondContact OG1-CG 3.3Å; T1549-Q1552 PolarHBondContact OG1-N 3.21Å; T1549-V1553 WeakPolarHBondContact O-CG2 3.08Å; T1549-V1553 PolarHBondContact O-N 2.85Å
1550	P	83.4	Confident	71.3	Confident	104 Å²	104	88.5 Å²	88.5	68%	0.675	42%	0.42	S	S	*	.	H	α-helix	trans	-56	-34.8	174.1	-27.1	36.1	0	0	0	113	V1553 K1554	P1550-V1553 PolarHBondContact O-N 3.35Å; P1550-K1554 WeakPolarHBondContact O-CG 3.31Å; P1550-K1554 PolarHBondContact O-N 3.44Å
1551	S	85.5	Confident	73.9	Confident	61 Å²	61	89.7 Å²	89.7	43%	0.427	41%	0.414	S	S	.	.	H	α-helix	trans	-66.2	-47.7	174.5	49	0	0	0	0	112.5	T1549 V1553 K1554 V1555	T1549-S1551 PolarHBondContact O-N 3.33Å; T1549-S1551 PolarHBondContact OG1-OG 3.06Å; S1551-V1553 VanDerWaalsContact C-N 3.26Å; S1551-V1553 PolarHBondContact O-N 3.49Å; S1551-K1554 PolarHBondContact O-N 2.71Å; S1551-K1554 VanDerWaalsContact O-N 3.08Å; S1551-V1555 WeakPolarHBondContact O-CG2 3.22Å; S1551-V1555 PolarHBondContact O-N 3.33Å
1552	Q	90.1	Very high	76.1	Confident	26 Å²	26	86.5 Å²	86.5	12%	0.121	40%	0.401	C	S	.	.	H	α-helix	trans	-56.3	-39.8	174	-74.4	166.6	-14.5	0	0	112.1	T1549 M1556 I1578 L1580	T1549-Q1552 PolarHBondContact O-N 2.84Å; T1549-Q1552 VanDerWaalsContact O-N 3.17Å; T1549-Q1552 WeakPolarHBondContact OG1-CB 3.16Å; T1549-Q1552 VanDerWaalsContact OG1-CG 3.24Å; T1549-Q1552 WeakPolarHBondContact OG1-CG 3.3Å; T1549-Q1552 PolarHBondContact OG1-N 3.21Å; Q1552-M1556 WeakPolarHBondContact O-CG 3.26Å; Q1552-M1556 PolarHBondContact O-N 2.67Å; Q1552-M1556 VanDerWaalsContact O-N 3.11Å; Q1552-I1578 HydrophobicContact CG-CB 4.28Å; Q1552-I1578 HydrophobicContact CG-CG1 4.44Å; Q1552-I1578 WeakPolarHBondContact CG-O 3.3Å; Q1552-I1578 PolarHBondContact NE2-O 3.21Å; Q1552-L1580 HydrophobicContact CB-CD1 4.07Å; Q1552-L1580 HydrophobicContact CG-CD1 4.19Å; Q1552-L1580 HydrophobicContact CG-CG 4.29Å
1553	V	91	Very high	78.9	Confident	37 Å²	37	83.4 Å²	83.4	22%	0.224	39%	0.387	C	S	.	.	H	α-helix	trans	-77	-24	178.3	-178.9	0	0	0	0	113	L1548 T1549 P1550 S1551 R1557	L1548-V1553 HydrophobicContact CB-CG2 3.66Å; L1548-V1553 HydrophobicContact CD2-CG2 4.05Å; T1549-V1553 WeakPolarHBondContact O-CG2 3.08Å; T1549-V1553 PolarHBondContact O-N 2.85Å; P1550-V1553 PolarHBondContact O-N 3.35Å; S1551-V1553 VanDerWaalsContact C-N 3.26Å; S1551-V1553 PolarHBondContact O-N 3.49Å; V1553-R1557 WeakPolarHBondContact O-CB 3.43Å; V1553-R1557 WeakPolarHBondContact O-CG 3.47Å; V1553-R1557 PolarHBondContact O-N 2.79Å; V1553-R1557 PolarHBondContact O-NE 3.2Å
1554	K	89.3	Confident	81.7	Confident	68 Å²	68	76.1 Å²	76.1	30%	0.296	36%	0.362	S	S	.	.	H	α-helix	trans	-72.3	-48.6	168.4	-79.4	-177.8	172	-172.3	0	110.5	P1550 S1551 M1556 R1557 Y1558 I1656	P1550-K1554 WeakPolarHBondContact O-CG 3.31Å; P1550-K1554 PolarHBondContact O-N 3.44Å; S1551-K1554 PolarHBondContact O-N 2.71Å; S1551-K1554 VanDerWaalsContact O-N 3.08Å; K1554-M1556 PolarHBondContact O-N 3.17Å; K1554-R1557 PolarHBondContact O-N 2.84Å; K1554-R1557 VanDerWaalsContact O-N 3.08Å; K1554-Y1558 PolarHBondContact O-N 3.19Å; K1554-I1656 HydrophobicContact CB-CD1 3.57Å; K1554-I1656 HydrophobicContact CB-CG1 3.95Å; K1554-I1656 HydrophobicContact CB-CG2 4.01Å; K1554-I1656 HydrophobicContact CD-CG1 4.33Å; K1554-I1656 HydrophobicContact CD-CG2 3.7Å
1555	V	90.1	Very high	84.2	Confident	4 Å²	4	71.8 Å²	71.8	2%	0.024	35%	0.348	C	S	.	.	H	α-helix	trans	-57	-51.6	179.1	176.9	0	0	0	0	110.7	S1551 R1557 Y1558 L1559 L1574 I1578 I1649 V1652 K1653 I1656	S1551-V1555 WeakPolarHBondContact O-CG2 3.22Å; S1551-V1555 PolarHBondContact O-N 3.33Å; V1555-R1557 VanDerWaalsContact C-N 3.25Å; V1555-R1557 PolarHBondContact O-N 3.4Å; V1555-Y1558 PolarHBondContact O-N 2.99Å; V1555-L1559 HydrophobicContact CG1-CD1 3.87Å; V1555-L1559 HydrophobicContact CG1-CG 4.46Å; V1555-L1559 WeakPolarHBondContact O-CG 3.49Å; V1555-L1559 PolarHBondContact O-N 3.06Å; V1555-L1559 VanDerWaalsContact O-N 3.12Å; V1555-L1574 HydrophobicContact CG1-CD1 4.26Å; V1555-I1578 HydrophobicContact CB-CG2 4.35Å; V1555-I1578 HydrophobicContact CG1-CG2 3.86Å; V1555-I1649 HydrophobicContact CG1-CG2 4.24Å; V1555-V1652 HydrophobicContact CB-CG1 4.32Å; V1555-V1652 HydrophobicContact CG1-CG1 4.09Å; V1555-V1652 HydrophobicContact CG2-CG1 4.21Å; V1555-K1653 HydrophobicContact CG2-CG 4.25Å; V1555-I1656 HydrophobicContact CB-CD1 4.21Å; V1555-I1656 HydrophobicContact CG2-CD1 3.55Å
1556	M	91.4	Very high	86.2	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-65	-26.1	179.2	-69.1	-172	-69.8	0	0	113.4	L1548 Q1552 K1554 F1560 L1574 I1578 L1580 V1585 W1588 F1589	L1548-M1556 HydrophobicContact CD2-CE 3.68Å; Q1552-M1556 WeakPolarHBondContact O-CG 3.26Å; Q1552-M1556 PolarHBondContact O-N 2.67Å; Q1552-M1556 VanDerWaalsContact O-N 3.11Å; K1554-M1556 PolarHBondContact O-N 3.17Å; M1556-F1560 WeakPolarHBondContact O-CB 3.46Å; M1556-F1560 PolarHBondContact O-N 2.81Å; M1556-F1560 VanDerWaalsContact O-N 3.08Å; M1556-L1574 HydrophobicContact CG-CD2 4.31Å; M1556-I1578 HydrophobicContact CE-CD1 4.36Å; M1556-I1578 HydrophobicContact CG-CD1 3.72Å; M1556-I1578 HydrophobicContact SD-CD1 3.83Å; M1556-L1580 HydrophobicContact CE-CD1 3.73Å; M1556-L1580 HydrophobicContact SD-CD1 4.36Å; M1556-V1585 HydrophobicContact SD-CG1 4.23Å; M1556-V1585 HydrophobicContact SD-CG2 4.26Å; M1556-W1588 VanDerWaalsContact C-CH2 3.48Å; M1556-W1588 HydrophobicContact CB-CD2 3.98Å; M1556-W1588 HydrophobicContact CB-CE3 3.84Å; M1556-W1588 HydrophobicContact CB-CH2 3.83Å; M1556-W1588 HydrophobicContact CB-CZ2 3.93Å; M1556-W1588 HydrophobicContact CB-CZ3 3.78Å; M1556-W1588 HydrophobicContact CE-CB 4.35Å; M1556-W1588 HydrophobicContact CE-CD2 4.05Å; M1556-W1588 HydrophobicContact CE-CG 3.77Å; M1556-W1588 VanDerWaalsContact O-CH2 3.23Å; M1556-W1588 WeakPolarHBondContact O-CH2 3.27Å; M1556-W1588 VanDerWaalsContact O-CZ3 3.32Å; M1556-W1588 WeakPolarHBondContact O-CZ3 3.4Å; M1556-W1588 HydrophobicContact SD-CB 4.11Å; M1556-W1588 HydrophobicContact SD-CD2 3.95Å; M1556-W1588 HydrophobicContact SD-CE3 4.21Å; M1556-W1588 HydrophobicContact SD-CG 3.89Å; M1556-F1589 HydrophobicContact CB-CE2 4.37Å; M1556-F1589 HydrophobicContact CG-CE2 4.29Å; M1556-F1589 HydrophobicContact SD-CE2 4.48Å
1557	R	90.3	Very high	87	Confident	146 Å²	146	60.1 Å²	60.1	55%	0.551	30%	0.303	S	S	*	.	H	α-helix	trans	-72.9	-40.9	173	-89.1	-170.3	-76.8	172.9	-6.2	112.9	V1553 K1554 V1555 F1560 Q1561 W1588	V1553-R1557 WeakPolarHBondContact O-CB 3.43Å; V1553-R1557 WeakPolarHBondContact O-CG 3.47Å; V1553-R1557 PolarHBondContact O-N 2.79Å; V1553-R1557 PolarHBondContact O-NE 3.2Å; K1554-R1557 PolarHBondContact O-N 2.84Å; K1554-R1557 VanDerWaalsContact O-N 3.08Å; V1555-R1557 VanDerWaalsContact C-N 3.25Å; V1555-R1557 PolarHBondContact O-N 3.4Å; R1557-F1560 PolarHBondContact O-N 3.02Å; R1557-Q1561 PolarHBondContact O-N 2.87Å; R1557-Q1561 VanDerWaalsContact O-N 3.16Å; R1557-W1588 HydrophobicContact CG-CH2 4Å; R1557-W1588 HydrophobicContact CG-CZ2 3.9Å
1558	Y	89.4	Confident	87.4	Confident	62 Å²	62	57.3 Å²	57.3	24%	0.243	29%	0.291	C	S	.	.	H	α-helix	trans	-58.9	-54.3	175.4	-170.7	-84.2	0	0	0	110.2	K1554 V1555 F1560 Q1561 L1628 H1648 V1652	K1554-Y1558 PolarHBondContact O-N 3.19Å; V1555-Y1558 PolarHBondContact O-N 2.99Å; Y1558-F1560 VanDerWaalsContact C-N 3.25Å; Y1558-F1560 PolarHBondContact O-N 2.88Å; Y1558-Q1561 WeakPolarHBondContact O-CB 3.34Å; Y1558-Q1561 PolarHBondContact O-N 2.78Å; Y1558-L1628 HydrophobicContact CD2-CD1 4.46Å; Y1558-L1628 HydrophobicContact CE1-CD1 3.92Å; Y1558-L1628 HydrophobicContact CE2-CD1 3.78Å; Y1558-L1628 HydrophobicContact CE2-CG 4.32Å; Y1558-L1628 VanDerWaalsContact CZ-CD1 3.48Å; Y1558-L1628 WeakPolarHBondContact OH-CG 3.26Å; Y1558-H1648 AromaticContact CE1-NE2 3.78Å; Y1558-V1652 HydrophobicContact CD1-CG1 4.12Å; Y1558-V1652 HydrophobicContact CD1-CG2 3.63Å; Y1558-V1652 HydrophobicContact CE1-CG2 3.83Å; Y1558-V1652 HydrophobicContact CG-CG1 4.04Å; Y1558-V1652 HydrophobicContact CG-CG2 4.31Å
1559	L	88.3	Confident	87.7	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-62.6	-30.4	179.5	-57.1	171.6	0	0	0	112.9	V1555 Q1561 Y1563 L1574 F1589 I1643 H1648 I1649	V1555-L1559 HydrophobicContact CG1-CD1 3.87Å; V1555-L1559 HydrophobicContact CG1-CG 4.46Å; V1555-L1559 WeakPolarHBondContact O-CG 3.49Å; V1555-L1559 PolarHBondContact O-N 3.06Å; V1555-L1559 VanDerWaalsContact O-N 3.12Å; L1559-Q1561 VanDerWaalsContact C-N 3.34Å; L1559-Y1563 CarbonylContact O-C 3.1Å; L1559-Y1563 WeakPolarHBondContact O-CA 3.13Å; L1559-Y1563 PolarHBondContact O-N 3.35Å; L1559-L1574 HydrophobicContact CD1-CD1 3.31Å; L1559-L1574 HydrophobicContact CD1-CD2 3.66Å; L1559-L1574 HydrophobicContact CD1-CG 4.13Å; L1559-F1589 HydrophobicContact CB-CZ 4.45Å; L1559-I1643 HydrophobicContact CD2-CG2 3.51Å; L1559-H1648 WeakPolarHBondContact CD2-NE2 3.15Å; L1559-I1649 HydrophobicContact CD1-CG1 4.48Å
1560	F	91.9	Very high	87.8	Confident	30 Å²	30	57 Å²	57	13%	0.132	29%	0.293	C	S	.	.	H	α-helix	trans	-71.7	-24.9	174.7	-175.4	-98.3	0	0	0	113.8	M1556 R1557 Y1558 K1564 W1588 F1589 A1592 R1593 E1596	M1556-F1560 WeakPolarHBondContact O-CB 3.46Å; M1556-F1560 PolarHBondContact O-N 2.81Å; M1556-F1560 VanDerWaalsContact O-N 3.08Å; R1557-F1560 PolarHBondContact O-N 3.02Å; Y1558-F1560 VanDerWaalsContact C-N 3.25Å; Y1558-F1560 PolarHBondContact O-N 2.88Å; F1560-K1564 HydrophobicContact CD2-CB 4.32Å; F1560-K1564 HydrophobicContact CD2-CG 4.28Å; F1560-K1564 HydrophobicContact CE1-CG 4.3Å; F1560-K1564 HydrophobicContact CE2-CB 3.9Å; F1560-K1564 HydrophobicContact CE2-CG 3.99Å; F1560-K1564 HydrophobicContact CZ-CB 4.29Å; F1560-K1564 HydrophobicContact CZ-CD 4.48Å; F1560-K1564 HydrophobicContact CZ-CG 4Å; F1560-K1564 WeakPolarHBondContact O-CG 3.13Å; F1560-W1588 HydrophobicContact CB-CH2 4.03Å; F1560-W1588 HydrophobicContact CB-CZ3 3.92Å; F1560-W1588 HydrophobicContact CD2-CZ3 4.24Å; F1560-W1588 HydrophobicContact CG-CH2 4.38Å; F1560-W1588 HydrophobicContact CG-CZ3 4.2Å; F1560-F1589 HydrophobicContact CB-CE1 4Å; F1560-F1589 AromaticContact CD2-CD1 3.68Å; F1560-F1589 HydrophobicContact CD2-CD1 3.68Å; F1560-F1589 AromaticContact CD2-CE1 3.8Å; F1560-F1589 HydrophobicContact CD2-CE1 3.8Å; F1560-F1589 HydrophobicContact CE2-CD1 4.4Å; F1560-F1589 HydrophobicContact CG-CE1 4.42Å; F1560-A1592 HydrophobicContact CD1-CB 4.48Å; F1560-A1592 HydrophobicContact CD2-CB 3.78Å; F1560-A1592 HydrophobicContact CE1-CB 4.23Å; F1560-A1592 HydrophobicContact CE2-CB 3.5Å; F1560-A1592 HydrophobicContact CG-CB 4.27Å; F1560-A1592 HydrophobicContact CZ-CB 3.75Å; F1560-R1593 HydrophobicContact CE2-CG 3.9Å; F1560-R1593 HydrophobicContact CZ-CG 4.31Å; F1560-E1596 HydrophobicContact CZ-CB 4.39Å; F1560-E1596 WeakPolarHBondContact CZ-OE2 3.44Å
1561	Q	86.7	Confident	88.1	Confident	156 Å²	156	52.2 Å²	52.2	73%	0.729	26%	0.262	S	S	*	.	H	α-helix	trans	-71.8	-43	178.6	-171.5	158.4	-20.6	0	0	110.6	R1557 Y1558 L1559	R1557-Q1561 PolarHBondContact O-N 2.87Å; R1557-Q1561 VanDerWaalsContact O-N 3.16Å; Y1558-Q1561 WeakPolarHBondContact O-CB 3.34Å; Y1558-Q1561 PolarHBondContact O-N 2.78Å; L1559-Q1561 VanDerWaalsContact C-N 3.34Å
1562	D	80.7	Confident	88.4	Confident	70 Å²	70	54 Å²	54	37%	0.374	26%	0.263	S	S	.	.	H	α-helix	trans	-82.6	-39.1	177.9	-63.7	-11.8	0	0	0	112.8	I1643	D1562-I1643 HydrophobicContact CB-CD1 3.47Å; D1562-I1643 VanDerWaalsContact CB-CD1 3.47Å
1563	Y	86	Confident	88.2	Confident	39 Å²	39	57.5 Å²	57.5	15%	0.153	28%	0.281	C	S	.	.			trans	-141.6	105.2	-177.8	-167.1	-108.9	0	0	0	114.6	L1559 T1565 Q1640 F1644	L1559-Y1563 CarbonylContact O-C 3.1Å; L1559-Y1563 WeakPolarHBondContact O-CA 3.13Å; L1559-Y1563 PolarHBondContact O-N 3.35Å; Y1563-T1565 VanDerWaalsContact CE1-C 3.41Å; Y1563-T1565 WeakPolarHBondContact CE1-O 3.23Å; Y1563-T1565 VanDerWaalsContact CZ-OG1 3.3Å; Y1563-T1565 PolarHBondContact O-N 3.16Å; Y1563-T1565 PolarHBondContact OH-O 2.97Å; Y1563-T1565 PolarHBondContact OH-OG1 2.7Å; Y1563-Q1640 HydrophobicContact CE1-CG 4.01Å; Y1563-Q1640 HydrophobicContact CE2-CG 4.03Å; Y1563-Q1640 PolarHBondContact OH-NE2 2.94Å; Y1563-F1644 AromaticContact CD1-CE2 3.51Å; Y1563-F1644 HydrophobicContact CD1-CE2 3.51Å; Y1563-F1644 AromaticContact CD1-CZ 3.84Å; Y1563-F1644 HydrophobicContact CD1-CZ 3.84Å; Y1563-F1644 HydrophobicContact CE1-CE2 4.02Å; Y1563-F1644 HydrophobicContact CG-CE2 4.37Å
1564	K	88.6	Confident	88.2	Confident	87 Å²	87	55.7 Å²	55.7	38%	0.378	27%	0.27	S	S	.	.	S	Bend	trans	-82.4	-12.6	-169.4	-64.6	170.9	-174.9	-169.9	0	114.7	F1560 P1566 R1593 E1596	F1560-K1564 HydrophobicContact CD2-CB 4.32Å; F1560-K1564 HydrophobicContact CD2-CG 4.28Å; F1560-K1564 HydrophobicContact CE1-CG 4.3Å; F1560-K1564 HydrophobicContact CE2-CB 3.9Å; F1560-K1564 HydrophobicContact CE2-CG 3.99Å; F1560-K1564 HydrophobicContact CZ-CB 4.29Å; F1560-K1564 HydrophobicContact CZ-CD 4.48Å; F1560-K1564 HydrophobicContact CZ-CG 4Å; F1560-K1564 WeakPolarHBondContact O-CG 3.13Å; K1564-P1566 VanDerWaalsContact C-CD 3.46Å; K1564-R1593 VanDerWaalsContact O-CD 3.24Å; K1564-R1593 WeakPolarHBondContact O-CD 3.27Å; K1564-R1593 PolarHBondContact O-NE 3.27Å; K1564-E1596 WeakPolarHBondContact CD-OE1 3.28Å; K1564-E1596 VanDerWaalsContact CE-OE1 3.26Å; K1564-E1596 WeakPolarHBondContact CE-OE1 3.12Å; K1564-E1596 IonicContact NZ-OE1 3.94Å; K1564-E1596 PolarHBondContact NZ-OE1 3.15Å
1565	T	87.3	Confident	88.2	Confident	64 Å²	64	52.5 Å²	52.5	39%	0.393	26%	0.257	S	S	.	.			trans	-127.7	50.5	-162.6	49.1	0	0	0	0	115	Y1563 T1567	Y1563-T1565 VanDerWaalsContact CE1-C 3.41Å; Y1563-T1565 WeakPolarHBondContact CE1-O 3.23Å; Y1563-T1565 VanDerWaalsContact CZ-OG1 3.3Å; Y1563-T1565 PolarHBondContact O-N 3.16Å; Y1563-T1565 PolarHBondContact OH-O 2.97Å; Y1563-T1565 PolarHBondContact OH-OG1 2.7Å; T1565-T1567 PolarHBondContact O-N 2.79Å
1566	P	86.3	Confident	88.2	Confident	10 Å²	10	56.3 Å²	56.3	7%	0.065	29%	0.288	C	S	.	.			trans	-59.2	134.7	178.4	25.1	-34.1	0	0	0	112.9	K1564 E1570 F1589 F1644	K1564-P1566 VanDerWaalsContact C-CD 3.46Å; P1566-E1570 WeakPolarHBondContact CA-OE2 3.31Å; P1566-E1570 HydrophobicContact CB-CB 3.9Å; P1566-F1589 HydrophobicContact CG-CB 3.98Å; P1566-F1589 HydrophobicContact CG-CD1 3.34Å; P1566-F1589 HydrophobicContact CG-CD2 3.81Å; P1566-F1589 HydrophobicContact CG-CE1 3.66Å; P1566-F1589 HydrophobicContact CG-CE2 4.12Å; P1566-F1589 HydrophobicContact CG-CG 3.43Å; P1566-F1589 VanDerWaalsContact CG-CG 3.43Å; P1566-F1589 HydrophobicContact CG-CZ 4.04Å; P1566-F1644 HydrophobicContact CB-CE1 4.35Å; P1566-F1644 HydrophobicContact CB-CZ 3.88Å
1567	T	87.7	Confident	88	Confident	58 Å²	58	58.3 Å²	58.3	36%	0.356	30%	0.297	S	S	.	.			trans	-63.9	175.7	168.5	62.6	0	0	0	0	111.6	T1565 S1569 E1570 C1571	T1565-T1567 PolarHBondContact O-N 2.79Å; T1567-S1569 VanDerWaalsContact C-N 3.34Å; T1567-S1569 PolarHBondContact OG1-OG 2.95Å; T1567-E1570 VanDerWaalsContact CB-OE2 3.25Å; T1567-E1570 WeakPolarHBondContact CB-OE2 3.33Å; T1567-E1570 VanDerWaalsContact CG2-OE2 3.25Å; T1567-E1570 WeakPolarHBondContact CG2-OE2 3.49Å; T1567-E1570 PolarHBondContact N-OE2 3.01Å; T1567-E1570 WeakPolarHBondContact OG1-CB 3.4Å; T1567-E1570 VanDerWaalsContact OG1-CD 3.28Å; T1567-E1570 VanDerWaalsContact OG1-CG 3.26Å; T1567-E1570 WeakPolarHBondContact OG1-CG 3.45Å; T1567-E1570 PolarHBondContact OG1-N 3.38Å; T1567-E1570 PolarHBondContact OG1-OE2 3.16Å; T1567-C1571 WeakPolarHBondContact O-CB 3.26Å; T1567-C1571 PolarHBondContact O-N 2.88Å; T1567-C1571 PolarHBondContact O-SG 3.41Å
1568	M	82.9	Confident	87.9	Confident	88 Å²	88	52.1 Å²	52.1	43%	0.433	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-29.1	179.6	-66.8	-55.2	-52.6	0	0	113.5	E1572 K1582 Q1586	M1568-E1572 PolarHBondContact O-N 3.34Å; M1568-K1582 HydrophobicContact CE-CD 4.48Å; M1568-K1582 HydrophobicContact CE-CG 4.4Å; M1568-K1582 WeakPolarHBondContact O-CE 3.44Å; M1568-Q1586 HydrophobicContact CE-CG 4.43Å; M1568-Q1586 HydrophobicContact SD-CG 4.19Å; M1568-Q1586 PolarHBondContact SD-NE2 3.09Å
1569	S	87.4	Confident	87.8	Confident	74 Å²	74	52.1 Å²	52.1	52%	0.517	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-45.6	175.2	38.9	0	0	0	0	111.4	T1567 C1571 E1572 M1573	T1567-S1569 VanDerWaalsContact C-N 3.34Å; T1567-S1569 PolarHBondContact OG1-OG 2.95Å; S1569-C1571 VanDerWaalsContact C-N 3.32Å; S1569-C1571 PolarHBondContact O-N 2.85Å; S1569-E1572 WeakPolarHBondContact O-CA 3.4Å; S1569-E1572 WeakPolarHBondContact O-CB 3.38Å; S1569-E1572 PolarHBondContact O-N 2.93Å; S1569-M1573 PolarHBondContact O-N 3.15Å
1570	E	88.8	Confident	87.9	Confident	14 Å²	14	52.9 Å²	52.9	7%	0.065	30%	0.298	C	S	.	.	H	α-helix	trans	-60	-41.4	174.2	-67.8	163.9	129.5	0	0	111.5	P1566 T1567 E1572 M1573 L1574 Q1640 F1644	P1566-E1570 WeakPolarHBondContact CA-OE2 3.31Å; P1566-E1570 HydrophobicContact CB-CB 3.9Å; T1567-E1570 VanDerWaalsContact CB-OE2 3.25Å; T1567-E1570 WeakPolarHBondContact CB-OE2 3.33Å; T1567-E1570 VanDerWaalsContact CG2-OE2 3.25Å; T1567-E1570 WeakPolarHBondContact CG2-OE2 3.49Å; T1567-E1570 PolarHBondContact N-OE2 3.01Å; T1567-E1570 WeakPolarHBondContact OG1-CB 3.4Å; T1567-E1570 VanDerWaalsContact OG1-CD 3.28Å; T1567-E1570 VanDerWaalsContact OG1-CG 3.26Å; T1567-E1570 WeakPolarHBondContact OG1-CG 3.45Å; T1567-E1570 PolarHBondContact OG1-N 3.38Å; T1567-E1570 PolarHBondContact OG1-OE2 3.16Å; E1570-E1572 PolarHBondContact O-N 3.04Å; E1570-M1573 PolarHBondContact O-N 2.78Å; E1570-L1574 WeakPolarHBondContact O-CB 3.31Å; E1570-L1574 PolarHBondContact O-N 3.21Å; E1570-Q1640 VanDerWaalsContact OE1-CB 3.28Å; E1570-Q1640 WeakPolarHBondContact OE1-CB 3.25Å; E1570-Q1640 VanDerWaalsContact OE1-CG 3.3Å; E1570-Q1640 WeakPolarHBondContact OE1-CG 3.45Å; E1570-F1644 HydrophobicContact CB-CD1 3.95Å; E1570-F1644 HydrophobicContact CB-CD2 3.94Å; E1570-F1644 HydrophobicContact CB-CE1 4.03Å; E1570-F1644 HydrophobicContact CB-CE2 4.02Å; E1570-F1644 HydrophobicContact CB-CG 3.92Å; E1570-F1644 HydrophobicContact CB-CZ 4.08Å; E1570-F1644 VanDerWaalsContact CD-CD2 3.5Å; E1570-F1644 VanDerWaalsContact CD-CE2 3.46Å; E1570-F1644 HydrophobicContact CG-CB 4.36Å; E1570-F1644 HydrophobicContact CG-CD1 4.34Å; E1570-F1644 HydrophobicContact CG-CD2 3.5Å; E1570-F1644 VanDerWaalsContact CG-CD2 3.5Å; E1570-F1644 HydrophobicContact CG-CE2 3.85Å; E1570-F1644 HydrophobicContact CG-CG 3.78Å; E1570-F1644 HydrophobicContact CG-CZ 4.42Å; E1570-F1644 WeakPolarHBondContact OE1-CD2 3.26Å; E1570-F1644 WeakPolarHBondContact OE1-CE2 3.42Å
1571	C	90.7	Very high	87.8	Confident	2 Å²	2	57.6 Å²	57.6	1%	0.014	32%	0.32	C	S	.	.	H	α-helix	trans	-62.5	-24.5	172.6	-73.6	0	0	0	0	113.8	T1567 S1569 G1575 V1585	T1567-C1571 WeakPolarHBondContact O-CB 3.26Å; T1567-C1571 PolarHBondContact O-N 2.88Å; T1567-C1571 PolarHBondContact O-SG 3.41Å; S1569-C1571 VanDerWaalsContact C-N 3.32Å; S1569-C1571 PolarHBondContact O-N 2.85Å; C1571-G1575 PolarHBondContact O-N 2.9Å; C1571-V1585 HydrophobicContact CB-CG1 4.31Å
1572	E	91	Very high	88	Confident	99 Å²	99	52.7 Å²	52.7	46%	0.463	30%	0.297	S	S	.	.	H	α-helix	trans	-84.4	-47.2	178.3	-168	153.8	-119.5	0	0	111.2	M1568 S1569 E1570 G1575 A1576 K1582	M1568-E1572 PolarHBondContact O-N 3.34Å; S1569-E1572 WeakPolarHBondContact O-CA 3.4Å; S1569-E1572 WeakPolarHBondContact O-CB 3.38Å; S1569-E1572 PolarHBondContact O-N 2.93Å; E1570-E1572 PolarHBondContact O-N 3.04Å; E1572-G1575 WeakPolarHBondContact O-CA 3.45Å; E1572-G1575 PolarHBondContact O-N 3Å; E1572-A1576 PolarHBondContact O-N 2.82Å; E1572-K1582 HydrophobicContact CB-CB 4.44Å; E1572-K1582 HydrophobicContact CB-CD 3.78Å; E1572-K1582 HydrophobicContact CB-CG 4.18Å; E1572-K1582 HydrophobicContact CG-CD 3.87Å; E1572-K1582 WeakPolarHBondContact OE1-CD 3.3Å; E1572-K1582 IonicContact OE1-NZ 2.7Å; E1572-K1582 PolarHBondContact OE1-NZ 2.72Å; E1572-K1582 IonicContact OE2-NZ 3.73Å; E1572-K1582 PolarHBondContact OE2-NZ 2.88Å
1573	M	87.4	Confident	88.4	Confident	99 Å²	99	56.4 Å²	56.4	49%	0.488	31%	0.305	S	S	.	.	H	α-helix	trans	-61.2	-50	176.2	-164.7	-168	-50.8	0	0	111.1	S1569 E1570 G1575 A1576 Q1577 F1644	S1569-M1573 PolarHBondContact O-N 3.15Å; E1570-M1573 PolarHBondContact O-N 2.78Å; M1573-G1575 VanDerWaalsContact C-N 3.26Å; M1573-G1575 PolarHBondContact O-N 3.35Å; M1573-A1576 PolarHBondContact O-N 3.47Å; M1573-Q1577 WeakPolarHBondContact O-CB 3.13Å; M1573-Q1577 PolarHBondContact O-N 2.85Å; M1573-F1644 HydrophobicContact SD-CB 4.41Å
1574	L	90.2	Very high	88.7	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-59.9	-39.4	174	177.1	56.6	0	0	0	111.4	V1555 M1556 L1559 E1570 Q1577 I1578 V1585 F1589 F1644 I1649	V1555-L1574 HydrophobicContact CG1-CD1 4.26Å; M1556-L1574 HydrophobicContact CG-CD2 4.31Å; L1559-L1574 HydrophobicContact CD1-CD1 3.31Å; L1559-L1574 HydrophobicContact CD1-CD2 3.66Å; L1559-L1574 HydrophobicContact CD1-CG 4.13Å; E1570-L1574 WeakPolarHBondContact O-CB 3.31Å; E1570-L1574 PolarHBondContact O-N 3.21Å; L1574-Q1577 PolarHBondContact O-N 3.32Å; L1574-I1578 HydrophobicContact CD1-CD1 4.18Å; L1574-I1578 HydrophobicContact CD1-CG2 3.83Å; L1574-I1578 HydrophobicContact CG-CD1 4.15Å; L1574-I1578 VanDerWaalsContact O-CG1 3.3Å; L1574-I1578 WeakPolarHBondContact O-CG1 3.41Å; L1574-I1578 PolarHBondContact O-N 3.07Å; L1574-V1585 HydrophobicContact CD2-CG1 3.86Å; L1574-V1585 HydrophobicContact CG-CG1 4.21Å; L1574-F1589 HydrophobicContact CD2-CE2 3.72Å; L1574-F1589 HydrophobicContact CD2-CZ 4.09Å; L1574-F1644 HydrophobicContact CB-CD1 4.36Å; L1574-F1644 HydrophobicContact CB-CE1 4.47Å; L1574-F1644 HydrophobicContact CD2-CE1 4.18Å; L1574-I1649 HydrophobicContact CD1-CD1 4.04Å; L1574-I1649 HydrophobicContact CD1-CG2 4.34Å
1575	G	90.1	Very high	88.8	Confident	1 Å²	1	51.7 Å²	51.7	1%	0.01	29%	0.288	C	S	.	.	H	α-helix	trans	-61.3	-50	177.3	0	0	0	0	0	113.3	C1571 E1572 M1573 Q1577 I1578 G1579 L1580	C1571-G1575 PolarHBondContact O-N 2.9Å; E1572-G1575 WeakPolarHBondContact O-CA 3.45Å; E1572-G1575 PolarHBondContact O-N 3Å; M1573-G1575 VanDerWaalsContact C-N 3.26Å; M1573-G1575 PolarHBondContact O-N 3.35Å; G1575-Q1577 VanDerWaalsContact C-N 3.3Å; G1575-Q1577 PolarHBondContact O-N 3.48Å; G1575-I1578 PolarHBondContact O-N 2.74Å; G1575-G1579 PolarHBondContact O-N 2.9Å; G1575-L1580 CarbonylContact C-O 3.52Å; G1575-L1580 WeakPolarHBondContact CA-O 3.46Å; G1575-L1580 PolarHBondContact O-N 2.83Å
1576	A	89.5	Confident	89	Confident	83 Å²	83	51 Å²	51	69%	0.686	28%	0.28	S	S	*	.	H	α-helix	trans	-57.4	-45.4	172.7	0	0	0	0	0	110.9	E1572 M1573 I1578 G1579	E1572-A1576 PolarHBondContact O-N 2.82Å; M1573-A1576 PolarHBondContact O-N 3.47Å; A1576-I1578 VanDerWaalsContact C-N 3.33Å; A1576-I1578 PolarHBondContact O-N 2.95Å; A1576-G1579 PolarHBondContact O-N 3.42Å
1577	Q	87.2	Confident	89.3	Confident	42 Å²	42	53.5 Å²	53.5	20%	0.196	30%	0.295	C	S	.	.	H	α-helix	trans	-69.7	-24.9	-174.4	-157.9	57.7	22.7	0	0	114	M1573 L1574 G1575 I1649 D1650 K1653	M1573-Q1577 WeakPolarHBondContact O-CB 3.13Å; M1573-Q1577 PolarHBondContact O-N 2.85Å; L1574-Q1577 PolarHBondContact O-N 3.32Å; G1575-Q1577 VanDerWaalsContact C-N 3.3Å; G1575-Q1577 PolarHBondContact O-N 3.48Å; Q1577-I1649 HydrophobicContact CB-CD1 4.24Å; Q1577-I1649 HydrophobicContact CB-CG2 4.14Å; Q1577-I1649 HydrophobicContact CG-CB 3.97Å; Q1577-I1649 HydrophobicContact CG-CD1 4.2Å; Q1577-I1649 HydrophobicContact CG-CG2 3.56Å; Q1577-D1650 PolarHBondContact NE2-OD1 3.02Å; Q1577-D1650 PolarHBondContact NE2-OD2 3.12Å; Q1577-K1653 WeakPolarHBondContact O-CE 3.32Å; Q1577-K1653 PolarHBondContact O-NZ 2.91Å
1578	I	86.8	Confident	89.6	Confident	16 Å²	16	52.9 Å²	52.9	8%	0.082	29%	0.286	C	S	.	.	H	α-helix	trans	-108.9	3.3	177.4	74.8	-168.7	0	0	0	114.5	Q1552 V1555 M1556 L1574 G1575 A1576 L1580 V1585 I1649	Q1552-I1578 HydrophobicContact CG-CB 4.28Å; Q1552-I1578 HydrophobicContact CG-CG1 4.44Å; Q1552-I1578 WeakPolarHBondContact CG-O 3.3Å; Q1552-I1578 PolarHBondContact NE2-O 3.21Å; V1555-I1578 HydrophobicContact CB-CG2 4.35Å; V1555-I1578 HydrophobicContact CG1-CG2 3.86Å; M1556-I1578 HydrophobicContact CE-CD1 4.36Å; M1556-I1578 HydrophobicContact CG-CD1 3.72Å; M1556-I1578 HydrophobicContact SD-CD1 3.83Å; L1574-I1578 HydrophobicContact CD1-CD1 4.18Å; L1574-I1578 HydrophobicContact CD1-CG2 3.83Å; L1574-I1578 HydrophobicContact CG-CD1 4.15Å; L1574-I1578 VanDerWaalsContact O-CG1 3.3Å; L1574-I1578 WeakPolarHBondContact O-CG1 3.41Å; L1574-I1578 PolarHBondContact O-N 3.07Å; G1575-I1578 PolarHBondContact O-N 2.74Å; A1576-I1578 VanDerWaalsContact C-N 3.33Å; A1576-I1578 PolarHBondContact O-N 2.95Å; I1578-L1580 HydrophobicContact CD1-CB 4.35Å; I1578-L1580 HydrophobicContact CD1-CD1 3.87Å; I1578-L1580 HydrophobicContact CD1-CG 4.34Å; I1578-L1580 HydrophobicContact CG1-CB 3.98Å; I1578-L1580 HydrophobicContact CG1-CD1 4.12Å; I1578-L1580 HydrophobicContact CG1-CG 4.03Å; I1578-V1585 HydrophobicContact CD1-CG2 4.25Å; I1578-I1649 HydrophobicContact CG2-CG2 4.39Å
1579	G	89.2	Confident	90.1	Very high	62 Å²	62	48.7 Å²	48.7	64%	0.639	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.9	33.9	-178.1	0	0	0	0	0	114.2	G1575 A1576	G1575-G1579 PolarHBondContact O-N 2.9Å; A1576-G1579 PolarHBondContact O-N 3.42Å
1580	L	90.2	Very high	90.1	Very high	16 Å²	16	49.6 Å²	49.6	8%	0.084	26%	0.262	C	S	.	.			trans	-123.9	128.3	174.9	-70.7	-179.6	0	0	0	111.1	L1548 Q1552 M1556 G1575 I1578 K1582 V1584 V1585	L1548-L1580 HydrophobicContact CD2-CD1 4.26Å; L1548-L1580 HydrophobicContact CG-CD1 3.91Å; L1548-L1580 HydrophobicContact CG-CD2 4.34Å; Q1552-L1580 HydrophobicContact CB-CD1 4.07Å; Q1552-L1580 HydrophobicContact CG-CD1 4.19Å; Q1552-L1580 HydrophobicContact CG-CG 4.29Å; M1556-L1580 HydrophobicContact CE-CD1 3.73Å; M1556-L1580 HydrophobicContact SD-CD1 4.36Å; G1575-L1580 CarbonylContact C-O 3.52Å; G1575-L1580 WeakPolarHBondContact CA-O 3.46Å; G1575-L1580 PolarHBondContact O-N 2.83Å; I1578-L1580 HydrophobicContact CD1-CB 4.35Å; I1578-L1580 HydrophobicContact CD1-CD1 3.87Å; I1578-L1580 HydrophobicContact CD1-CG 4.34Å; I1578-L1580 HydrophobicContact CG1-CB 3.98Å; I1578-L1580 HydrophobicContact CG1-CD1 4.12Å; I1578-L1580 HydrophobicContact CG1-CG 4.03Å; L1580-K1582 PolarHBondContact O-N 3.3Å; L1580-V1584 HydrophobicContact CD1-CG1 4.35Å; L1580-V1584 HydrophobicContact CD2-CG1 4.37Å; L1580-V1585 HydrophobicContact CB-CG2 3.97Å
1581	H	89	Confident	90.2	Very high	129 Å²	129	53.8 Å²	53.8	60%	0.597	28%	0.284	S	S	*	.			trans	-54.6	128.5	175	175.9	12.2	0	0	0	111.2	R1583 V1584	H1581-R1583 PolarHBondContact O-N 2.87Å; H1581-V1584 HydrophobicContact CB-CG2 4.39Å; H1581-V1584 WeakPolarHBondContact O-CA 3.47Å; H1581-V1584 VanDerWaalsContact O-CB 3.3Å; H1581-V1584 WeakPolarHBondContact O-CB 3.38Å; H1581-V1584 PolarHBondContact O-N 2.79Å
1582	K	90.9	Very high	90.1	Very high	54 Å²	54	54.4 Å²	54.4	24%	0.235	29%	0.29	C	S	.	.	H	α-helix	trans	-22.4	-50.3	171.8	177	173.3	-175.2	159.8	0	116.2	M1568 E1572 L1580 V1584 V1585 Q1586	M1568-K1582 HydrophobicContact CE-CD 4.48Å; M1568-K1582 HydrophobicContact CE-CG 4.4Å; M1568-K1582 WeakPolarHBondContact O-CE 3.44Å; E1572-K1582 HydrophobicContact CB-CB 4.44Å; E1572-K1582 HydrophobicContact CB-CD 3.78Å; E1572-K1582 HydrophobicContact CB-CG 4.18Å; E1572-K1582 HydrophobicContact CG-CD 3.87Å; E1572-K1582 WeakPolarHBondContact OE1-CD 3.3Å; E1572-K1582 IonicContact OE1-NZ 2.7Å; E1572-K1582 PolarHBondContact OE1-NZ 2.72Å; E1572-K1582 IonicContact OE2-NZ 3.73Å; E1572-K1582 PolarHBondContact OE2-NZ 2.88Å; L1580-K1582 PolarHBondContact O-N 3.3Å; K1582-V1584 VanDerWaalsContact C-N 3.35Å; K1582-V1584 PolarHBondContact O-N 3.38Å; K1582-V1585 PolarHBondContact O-N 3.27Å; K1582-Q1586 WeakPolarHBondContact O-CB 3.34Å; K1582-Q1586 PolarHBondContact O-N 2.85Å
1583	R	89.4	Confident	90.1	Very high	147 Å²	147	53.3 Å²	53.3	56%	0.555	28%	0.282	S	S	*	.	H	α-helix	trans	-65.4	-31.8	-179.6	-177.4	172.2	-73.9	139.8	-3.3	113.7	H1581 V1587	H1581-R1583 PolarHBondContact O-N 2.87Å; R1583-V1587 HydrophobicContact CG-CG2 4.45Å; R1583-V1587 VanDerWaalsContact O-CB 3.25Å; R1583-V1587 WeakPolarHBondContact O-CB 3.45Å; R1583-V1587 WeakPolarHBondContact O-CG2 3.21Å; R1583-V1587 PolarHBondContact O-N 3.11Å
1584	V	91.4	Very high	89.8	Confident	27 Å²	27	50.5 Å²	50.5	16%	0.164	27%	0.274	C	S	.	.	H	α-helix	trans	-68.1	-46.2	174	-177.2	0	0	0	0	110.1	T1546 L1548 L1580 H1581 K1582 V1587 W1588	T1546-V1584 HydrophobicContact CG2-CG2 4.2Å; L1548-V1584 HydrophobicContact CD1-CG1 3.91Å; L1548-V1584 HydrophobicContact CD2-CG1 4.49Å; L1548-V1584 HydrophobicContact CG-CG1 4.42Å; L1580-V1584 HydrophobicContact CD1-CG1 4.35Å; L1580-V1584 HydrophobicContact CD2-CG1 4.37Å; H1581-V1584 HydrophobicContact CB-CG2 4.39Å; H1581-V1584 WeakPolarHBondContact O-CA 3.47Å; H1581-V1584 VanDerWaalsContact O-CB 3.3Å; H1581-V1584 WeakPolarHBondContact O-CB 3.38Å; H1581-V1584 PolarHBondContact O-N 2.79Å; K1582-V1584 VanDerWaalsContact C-N 3.35Å; K1582-V1584 PolarHBondContact O-N 3.38Å; V1584-V1587 PolarHBondContact O-N 2.79Å; V1584-W1588 WeakPolarHBondContact O-CB 3.37Å; V1584-W1588 PolarHBondContact O-N 3.46Å
1585	V	91.9	Very high	89.4	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-62.6	-50.3	176	-178.3	0	0	0	0	110.7	M1556 C1571 L1574 I1578 L1580 K1582 V1587 W1588 F1589	M1556-V1585 HydrophobicContact SD-CG1 4.23Å; M1556-V1585 HydrophobicContact SD-CG2 4.26Å; C1571-V1585 HydrophobicContact CB-CG1 4.31Å; L1574-V1585 HydrophobicContact CD2-CG1 3.86Å; L1574-V1585 HydrophobicContact CG-CG1 4.21Å; I1578-V1585 HydrophobicContact CD1-CG2 4.25Å; L1580-V1585 HydrophobicContact CB-CG2 3.97Å; K1582-V1585 PolarHBondContact O-N 3.27Å; V1585-V1587 VanDerWaalsContact C-N 3.32Å; V1585-V1587 PolarHBondContact O-N 2.91Å; V1585-W1588 WeakPolarHBondContact O-CA 3.29Å; V1585-W1588 WeakPolarHBondContact O-CB 3.37Å; V1585-W1588 PolarHBondContact O-N 3.08Å; V1585-F1589 HydrophobicContact CG1-CD2 3.83Å; V1585-F1589 HydrophobicContact CG1-CE2 3.9Å; V1585-F1589 WeakPolarHBondContact O-CD2 3.44Å; V1585-F1589 PolarHBondContact O-N 3.28Å
1586	Q	91.4	Very high	88.9	Confident	51 Å²	51	60.7 Å²	60.7	24%	0.238	32%	0.319	C	S	.	.	H	α-helix	trans	-54	-46.7	175.7	-171.4	-162.8	19.8	0	0	112	M1568 K1582 W1588 F1589 Q1590	M1568-Q1586 HydrophobicContact CE-CG 4.43Å; M1568-Q1586 HydrophobicContact SD-CG 4.19Å; M1568-Q1586 PolarHBondContact SD-NE2 3.09Å; K1582-Q1586 WeakPolarHBondContact O-CB 3.34Å; K1582-Q1586 PolarHBondContact O-N 2.85Å; Q1586-W1588 VanDerWaalsContact C-N 3.35Å; Q1586-F1589 PolarHBondContact O-N 3.22Å; Q1586-Q1590 WeakPolarHBondContact O-CB 3.23Å; Q1586-Q1590 VanDerWaalsContact O-CG 3.26Å; Q1586-Q1590 WeakPolarHBondContact O-CG 3.39Å; Q1586-Q1590 PolarHBondContact O-N 3.2Å
1587	V	91.2	Very high	88.2	Confident	62 Å²	62	64.8 Å²	64.8	38%	0.376	32%	0.317	S	S	.	.	H	α-helix	trans	-70	-31	177.3	167.8	0	0	0	0	111.7	R1583 V1584 V1585 N1591	R1583-V1587 HydrophobicContact CG-CG2 4.45Å; R1583-V1587 VanDerWaalsContact O-CB 3.25Å; R1583-V1587 WeakPolarHBondContact O-CB 3.45Å; R1583-V1587 WeakPolarHBondContact O-CG2 3.21Å; R1583-V1587 PolarHBondContact O-N 3.11Å; V1584-V1587 PolarHBondContact O-N 2.79Å; V1585-V1587 VanDerWaalsContact C-N 3.32Å; V1585-V1587 PolarHBondContact O-N 2.91Å; V1587-N1591 VanDerWaalsContact CG1-ND2 3.31Å; V1587-N1591 WeakPolarHBondContact CG1-ND2 3.26Å; V1587-N1591 WeakPolarHBondContact O-CB 3.22Å; V1587-N1591 VanDerWaalsContact O-CG 3.26Å; V1587-N1591 PolarHBondContact O-N 2.87Å; V1587-N1591 PolarHBondContact O-ND2 2.9Å
1588	W	94.1	Very high	87.4	Confident	44 Å²	44	69.9 Å²	69.9	17%	0.167	34%	0.338	C	S	.	.	H	α-helix	trans	-64.9	-50.9	173.1	-170.7	100	0	0	0	110.7	M1556 R1557 F1560 V1584 V1585 Q1586 Q1590 N1591 A1592	M1556-W1588 VanDerWaalsContact C-CH2 3.48Å; M1556-W1588 HydrophobicContact CB-CD2 3.98Å; M1556-W1588 HydrophobicContact CB-CE3 3.84Å; M1556-W1588 HydrophobicContact CB-CH2 3.83Å; M1556-W1588 HydrophobicContact CB-CZ2 3.93Å; M1556-W1588 HydrophobicContact CB-CZ3 3.78Å; M1556-W1588 HydrophobicContact CE-CB 4.35Å; M1556-W1588 HydrophobicContact CE-CD2 4.05Å; M1556-W1588 HydrophobicContact CE-CG 3.77Å; M1556-W1588 VanDerWaalsContact O-CH2 3.23Å; M1556-W1588 WeakPolarHBondContact O-CH2 3.27Å; M1556-W1588 VanDerWaalsContact O-CZ3 3.32Å; M1556-W1588 WeakPolarHBondContact O-CZ3 3.4Å; M1556-W1588 HydrophobicContact SD-CB 4.11Å; M1556-W1588 HydrophobicContact SD-CD2 3.95Å; M1556-W1588 HydrophobicContact SD-CE3 4.21Å; M1556-W1588 HydrophobicContact SD-CG 3.89Å; R1557-W1588 HydrophobicContact CG-CH2 4Å; R1557-W1588 HydrophobicContact CG-CZ2 3.9Å; F1560-W1588 HydrophobicContact CB-CH2 4.03Å; F1560-W1588 HydrophobicContact CB-CZ3 3.92Å; F1560-W1588 HydrophobicContact CD2-CZ3 4.24Å; F1560-W1588 HydrophobicContact CG-CH2 4.38Å; F1560-W1588 HydrophobicContact CG-CZ3 4.2Å; V1584-W1588 WeakPolarHBondContact O-CB 3.37Å; V1584-W1588 PolarHBondContact O-N 3.46Å; V1585-W1588 WeakPolarHBondContact O-CA 3.29Å; V1585-W1588 WeakPolarHBondContact O-CB 3.37Å; V1585-W1588 PolarHBondContact O-N 3.08Å; Q1586-W1588 VanDerWaalsContact C-N 3.35Å; W1588-Q1590 VanDerWaalsContact C-N 3.34Å; W1588-Q1590 PolarHBondContact O-N 2.94Å; W1588-N1591 CarbonylContact O-C 3.54Å; W1588-N1591 PolarHBondContact O-N 3.04Å; W1588-N1591 VanDerWaalsContact O-N 3.12Å; W1588-A1592 HydrophobicContact CE3-CB 4.17Å; W1588-A1592 HydrophobicContact CH2-CB 4.23Å; W1588-A1592 HydrophobicContact CZ3-CB 3.87Å; W1588-A1592 WeakPolarHBondContact O-CB 2.96Å; W1588-A1592 PolarHBondContact O-N 2.87Å
1589	F	94.6	Very high	86.4	Confident	0 Å²	0	72.2 Å²	72.2	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-66.6	-31.3	177.8	-84	-93.2	0	0	0	113.3	M1556 L1559 F1560 P1566 L1574 V1585 Q1586 R1593	M1556-F1589 HydrophobicContact CB-CE2 4.37Å; M1556-F1589 HydrophobicContact CG-CE2 4.29Å; M1556-F1589 HydrophobicContact SD-CE2 4.48Å; L1559-F1589 HydrophobicContact CB-CZ 4.45Å; F1560-F1589 HydrophobicContact CB-CE1 4Å; F1560-F1589 AromaticContact CD2-CD1 3.68Å; F1560-F1589 HydrophobicContact CD2-CD1 3.68Å; F1560-F1589 AromaticContact CD2-CE1 3.8Å; F1560-F1589 HydrophobicContact CD2-CE1 3.8Å; F1560-F1589 HydrophobicContact CE2-CD1 4.4Å; F1560-F1589 HydrophobicContact CG-CE1 4.42Å; P1566-F1589 HydrophobicContact CG-CB 3.98Å; P1566-F1589 HydrophobicContact CG-CD1 3.34Å; P1566-F1589 HydrophobicContact CG-CD2 3.81Å; P1566-F1589 HydrophobicContact CG-CE1 3.66Å; P1566-F1589 HydrophobicContact CG-CE2 4.12Å; P1566-F1589 HydrophobicContact CG-CG 3.43Å; P1566-F1589 VanDerWaalsContact CG-CG 3.43Å; P1566-F1589 HydrophobicContact CG-CZ 4.04Å; L1574-F1589 HydrophobicContact CD2-CE2 3.72Å; L1574-F1589 HydrophobicContact CD2-CZ 4.09Å; V1585-F1589 HydrophobicContact CG1-CD2 3.83Å; V1585-F1589 HydrophobicContact CG1-CE2 3.9Å; V1585-F1589 WeakPolarHBondContact O-CD2 3.44Å; V1585-F1589 PolarHBondContact O-N 3.28Å; Q1586-F1589 PolarHBondContact O-N 3.22Å; F1589-R1593 WeakPolarHBondContact O-CB 3.5Å; F1589-R1593 WeakPolarHBondContact O-CG 3.46Å; F1589-R1593 PolarHBondContact O-N 2.85Å; F1589-R1593 PolarHBondContact O-NE 3.12Å
1590	Q	87.7	Confident	85	Confident	94 Å²	94	74.4 Å²	74.4	44%	0.439	36%	0.356	S	S	.	.	H	α-helix	trans	-66.2	-43.2	169.6	-75.8	173.4	6.5	0	0	111.8	Q1586 W1588 A1594	Q1586-Q1590 WeakPolarHBondContact O-CB 3.23Å; Q1586-Q1590 VanDerWaalsContact O-CG 3.26Å; Q1586-Q1590 WeakPolarHBondContact O-CG 3.39Å; Q1586-Q1590 PolarHBondContact O-N 3.2Å; W1588-Q1590 VanDerWaalsContact C-N 3.34Å; W1588-Q1590 PolarHBondContact O-N 2.94Å; Q1590-A1594 WeakPolarHBondContact O-CB 3.35Å; Q1590-A1594 PolarHBondContact O-N 3.01Å
1591	N	89.4	Confident	82.9	Confident	101 Å²	101	82.9 Å²	82.9	54%	0.54	39%	0.392	S	S	.	.	H	α-helix	trans	-70.1	-33	176.4	-75.4	-49.1	0	0	0	112.5	V1587 W1588 A1594 K1595	V1587-N1591 VanDerWaalsContact CG1-ND2 3.31Å; V1587-N1591 WeakPolarHBondContact CG1-ND2 3.26Å; V1587-N1591 WeakPolarHBondContact O-CB 3.22Å; V1587-N1591 VanDerWaalsContact O-CG 3.26Å; V1587-N1591 PolarHBondContact O-N 2.87Å; V1587-N1591 PolarHBondContact O-ND2 2.9Å; W1588-N1591 CarbonylContact O-C 3.54Å; W1588-N1591 PolarHBondContact O-N 3.04Å; W1588-N1591 VanDerWaalsContact O-N 3.12Å; N1591-A1594 CarbonylContact O-C 3.55Å; N1591-A1594 PolarHBondContact O-N 3.32Å; N1591-K1595 WeakPolarHBondContact O-CB 3.41Å; N1591-K1595 PolarHBondContact O-N 3.04Å
1592	A	88.6	Confident	81	Confident	16 Å²	16	82.8 Å²	82.8	13%	0.132	40%	0.401	C	S	.	.	H	α-helix	trans	-63.6	-54.8	173.9	0	0	0	0	0	110.5	F1560 W1588 A1594 K1595 E1596	F1560-A1592 HydrophobicContact CD1-CB 4.48Å; F1560-A1592 HydrophobicContact CD2-CB 3.78Å; F1560-A1592 HydrophobicContact CE1-CB 4.23Å; F1560-A1592 HydrophobicContact CE2-CB 3.5Å; F1560-A1592 HydrophobicContact CG-CB 4.27Å; F1560-A1592 HydrophobicContact CZ-CB 3.75Å; W1588-A1592 HydrophobicContact CE3-CB 4.17Å; W1588-A1592 HydrophobicContact CH2-CB 4.23Å; W1588-A1592 HydrophobicContact CZ3-CB 3.87Å; W1588-A1592 WeakPolarHBondContact O-CB 2.96Å; W1588-A1592 PolarHBondContact O-N 2.87Å; A1592-A1594 PolarHBondContact O-N 3.34Å; A1592-K1595 PolarHBondContact O-N 3.14Å; A1592-E1596 WeakPolarHBondContact O-CB 3.46Å; A1592-E1596 PolarHBondContact O-N 2.98Å
1593	R	91.9	Very high	78.7	Confident	76 Å²	76	82.9 Å²	82.9	29%	0.287	42%	0.417	S	S	.	.	H	α-helix	trans	-59.9	-24.5	172.6	-72.6	-174.8	-83.6	178.4	-14.3	114.1	F1560 K1564 F1589 R1597	F1560-R1593 HydrophobicContact CE2-CG 3.9Å; F1560-R1593 HydrophobicContact CZ-CG 4.31Å; K1564-R1593 VanDerWaalsContact O-CD 3.24Å; K1564-R1593 WeakPolarHBondContact O-CD 3.27Å; K1564-R1593 PolarHBondContact O-NE 3.27Å; F1589-R1593 WeakPolarHBondContact O-CB 3.5Å; F1589-R1593 WeakPolarHBondContact O-CG 3.46Å; F1589-R1593 PolarHBondContact O-N 2.85Å; F1589-R1593 PolarHBondContact O-NE 3.12Å; R1593-R1597 WeakPolarHBondContact O-CB 3.49Å; R1593-R1597 WeakPolarHBondContact O-CG 3.17Å; R1593-R1597 PolarHBondContact O-N 3.41Å; R1593-R1597 PolarHBondContact O-NE 3.38Å; R1593-R1597 VanDerWaalsContact O-NE 3.13Å
1594	A	81.1	Confident	75.9	Confident	40 Å²	40	78 Å²	78	33%	0.331	41%	0.413	S	S	.	.	H	α-helix	trans	-86.5	-20.3	174.5	0	0	0	0	0	113.7	Q1590 N1591 A1592 K1598	Q1590-A1594 WeakPolarHBondContact O-CB 3.35Å; Q1590-A1594 PolarHBondContact O-N 3.01Å; N1591-A1594 CarbonylContact O-C 3.55Å; N1591-A1594 PolarHBondContact O-N 3.32Å; A1592-A1594 PolarHBondContact O-N 3.34Å; A1594-K1598 WeakPolarHBondContact O-CD 3.46Å; A1594-K1598 VanDerWaalsContact O-CG 3.3Å; A1594-K1598 WeakPolarHBondContact O-CG 3.42Å
1595	K	81.8	Confident	73.1	Confident	167 Å²	167	81.9 Å²	81.9	73%	0.726	43%	0.432	S	S	*	.	H	α-helix	trans	-82.4	-44.5	170.1	-170.7	-161.9	174.5	-155	0	110.2	N1591 A1592 K1598 A1599	N1591-K1595 WeakPolarHBondContact O-CB 3.41Å; N1591-K1595 PolarHBondContact O-N 3.04Å; A1592-K1595 PolarHBondContact O-N 3.14Å; K1595-K1598 WeakPolarHBondContact O-CB 3.37Å; K1595-K1598 PolarHBondContact O-N 2.91Å; K1595-A1599 PolarHBondContact O-N 2.89Å
1596	E	79.6	Confident	70.2	Confident	48 Å²	48	88.8 Å²	88.8	22%	0.224	47%	0.469	C	S	.	.	H	α-helix	trans	-59.3	-53.3	176.1	178.8	179.7	-135.8	0	0	111.6	F1560 K1564 A1592 K1598 A1599 I1600	F1560-E1596 HydrophobicContact CZ-CB 4.39Å; F1560-E1596 WeakPolarHBondContact CZ-OE2 3.44Å; K1564-E1596 WeakPolarHBondContact CD-OE1 3.28Å; K1564-E1596 VanDerWaalsContact CE-OE1 3.26Å; K1564-E1596 WeakPolarHBondContact CE-OE1 3.12Å; K1564-E1596 IonicContact NZ-OE1 3.94Å; K1564-E1596 PolarHBondContact NZ-OE1 3.15Å; A1592-E1596 WeakPolarHBondContact O-CB 3.46Å; A1592-E1596 PolarHBondContact O-N 2.98Å; E1596-K1598 PolarHBondContact O-N 3.49Å; E1596-A1599 WeakPolarHBondContact O-CA 3.48Å; E1596-A1599 WeakPolarHBondContact O-CB 3.46Å; E1596-A1599 PolarHBondContact O-N 3.21Å; E1596-I1600 HydrophobicContact CG-CD1 3.93Å; E1596-I1600 WeakPolarHBondContact O-CG1 3.13Å; E1596-I1600 PolarHBondContact O-N 2.94Å
1597	R	75.7	Confident	67.5	Low	169 Å²	169	91 Å²	91	64%	0.638	49%	0.491	S	S	*	.	H	α-helix	trans	-59.1	-23.5	175.8	-76.9	-174.7	-69.5	178.7	-3.2	113.9	R1593 F1601	R1593-R1597 WeakPolarHBondContact O-CB 3.49Å; R1593-R1597 WeakPolarHBondContact O-CG 3.17Å; R1593-R1597 PolarHBondContact O-N 3.41Å; R1593-R1597 PolarHBondContact O-NE 3.38Å; R1593-R1597 VanDerWaalsContact O-NE 3.13Å; R1597-F1601 WeakPolarHBondContact O-CB 3.41Å; R1597-F1601 PolarHBondContact O-N 2.85Å
1598	K	69.8	Low	64.7	Low	149 Å²	149	94 Å²	94	65%	0.648	50%	0.504	S	S	*	.	H	α-helix	trans	-80.1	-39.8	170.8	-73.8	179.5	178	-165.1	0	112.6	A1594 K1595 E1596 I1600 F1601 T1602	A1594-K1598 WeakPolarHBondContact O-CD 3.46Å; A1594-K1598 VanDerWaalsContact O-CG 3.3Å; A1594-K1598 WeakPolarHBondContact O-CG 3.42Å; K1595-K1598 WeakPolarHBondContact O-CB 3.37Å; K1595-K1598 PolarHBondContact O-N 2.91Å; E1596-K1598 PolarHBondContact O-N 3.49Å; K1598-I1600 VanDerWaalsContact C-N 3.3Å; K1598-I1600 PolarHBondContact O-N 3.44Å; K1598-F1601 CarbonylContact O-C 3.58Å; K1598-F1601 PolarHBondContact O-N 3.37Å; K1598-T1602 VanDerWaalsContact O-CB 3.25Å; K1598-T1602 WeakPolarHBondContact O-CB 3.46Å; K1598-T1602 PolarHBondContact O-N 3.12Å; K1598-T1602 PolarHBondContact O-OG1 3.39Å
1599	A	66.1	Low	61.5	Low	65 Å²	65	96.2 Å²	96.2	54%	0.537	54%	0.539	S	S	.	.	H	α-helix	trans	-60.3	-42.2	174.3	0	0	0	0	0	111.2	K1595 E1596 T1602 G1603	K1595-A1599 PolarHBondContact O-N 2.89Å; E1596-A1599 WeakPolarHBondContact O-CA 3.48Å; E1596-A1599 WeakPolarHBondContact O-CB 3.46Å; E1596-A1599 PolarHBondContact O-N 3.21Å; A1599-T1602 CarbonylContact O-C 3.6Å; A1599-T1602 PolarHBondContact O-N 2.84Å; A1599-G1603 PolarHBondContact O-N 2.88Å
1600	I	59.7	Low	58.5	Low	108 Å²	108	100.6 Å²	100.6	55%	0.554	57%	0.57	S	S	*	*	H	α-helix	trans	-63.3	-52.4	175.1	-62.4	166.6	0	0	0	110.5	E1596 K1598 T1602 G1603 G1604	E1596-I1600 HydrophobicContact CG-CD1 3.93Å; E1596-I1600 WeakPolarHBondContact O-CG1 3.13Å; E1596-I1600 PolarHBondContact O-N 2.94Å; K1598-I1600 VanDerWaalsContact C-N 3.3Å; K1598-I1600 PolarHBondContact O-N 3.44Å; I1600-T1602 PolarHBondContact O-N 3.5Å; I1600-T1602 VanDerWaalsContact O-N 3.09Å; I1600-G1603 PolarHBondContact O-N 2.82Å; I1600-G1604 PolarHBondContact O-N 3.32Å
1601	F	45	Very low	55.6	Low	194 Å²	194	101.1 Å²	101.1	85%	0.851	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.1	3.1	-179.9	-128.9	-83.4	0	0	0	114.9	R1597 K1598	R1597-F1601 WeakPolarHBondContact O-CB 3.41Å; R1597-F1601 PolarHBondContact O-N 2.85Å; K1598-F1601 CarbonylContact O-C 3.58Å; K1598-F1601 PolarHBondContact O-N 3.37Å
1602	T	50	Low	52.8	Low	126 Å²	126	107 Å²	107	77%	0.773	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-131.6	14.5	176.5	-49	0	0	0	0	111	K1598 A1599 I1600	K1598-T1602 VanDerWaalsContact O-CB 3.25Å; K1598-T1602 WeakPolarHBondContact O-CB 3.46Å; K1598-T1602 PolarHBondContact O-N 3.12Å; K1598-T1602 PolarHBondContact O-OG1 3.39Å; A1599-T1602 CarbonylContact O-C 3.6Å; A1599-T1602 PolarHBondContact O-N 2.84Å; I1600-T1602 PolarHBondContact O-N 3.5Å; I1600-T1602 VanDerWaalsContact O-N 3.09Å
1603	G	41.3	Very low	50	Low	57 Å²	57	115.1 Å²	115.1	59%	0.588	63%	0.634	S	S	*	*	S	Bend	trans	-140.8	15.2	176.5	0	0	0	0	0	113.3	A1599 I1600	A1599-G1603 PolarHBondContact O-N 2.88Å; I1600-G1603 PolarHBondContact O-N 2.82Å
1604	G	32.5	Very low	47.1	Very low	44 Å²	44	117.4 Å²	117.4	45%	0.454	66%	0.656	S	S	.	*			trans	-79.1	-27.5	-178.3	0	0	0	0	0	114.7	I1600 N1606	I1600-G1604 PolarHBondContact O-N 3.32Å; G1604-N1606 VanDerWaalsContact C-N 3.32Å; G1604-N1606 PolarHBondContact O-N 3.48Å; G1604-N1606 VanDerWaalsContact O-N 3.16Å
1605	N	31.9	Very low	44.4	Very low	108 Å²	108	121.5 Å²	121.5	58%	0.578	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.3	62.4	-177.8	-69.3	16.1	0	0	0	110.8	D1137	D1137-N1605 PolarHBondContact OD2-ND2 3.19Å
1606	N	30.7	Very low	41.8	Very low	145 Å²	145	123 Å²	123	78%	0.775	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-161.1	41.7	159	-121.3	-18.9	0	0	0	113.1	G1604	G1604-N1606 VanDerWaalsContact C-N 3.32Å; G1604-N1606 PolarHBondContact O-N 3.48Å; G1604-N1606 VanDerWaalsContact O-N 3.16Å
1607	S	35.8	Very low	39.3	Very low	99 Å²	99	126 Å²	126	69%	0.692	70%	0.704	S	S	*	*	S	Bend	trans	-146.5	100.2	169.2	57	0	0	0	0	111.2	G1609	S1607-G1609 PolarHBondContact O-N 3.42Å
1608	I	31.5	Very low	37	Very low	125 Å²	125	122.6 Å²	122.6	64%	0.641	70%	0.696	S	S	*	*			trans	-11.8	114.4	154.4	-72.2	165.5	0	0	0	113.7	S1610	I1608-S1610 VanDerWaalsContact CG2-N 3.3Å; I1608-S1610 PolarHBondContact O-N 3.38Å
1609	G	26.8	Very low	35	Very low	89 Å²	89	121 Å²	121	92%	0.918	70%	0.703	S	S	*	*			trans	-76.9	92.2	148.3	0	0	0	0	0	108.2	S1607	S1607-G1609 PolarHBondContact O-N 3.42Å
1610	S	31	Very low	33.4	Very low	92 Å²	92	121.7 Å²	121.7	64%	0.643	72%	0.717	S	S	*	*			trans	-118.3	114.4	165.2	179	0	0	0	0	107.2	I1608 R1612	I1608-S1610 VanDerWaalsContact CG2-N 3.3Å; I1608-S1610 PolarHBondContact O-N 3.38Å; S1610-R1612 PolarHBondContact O-N 3.12Å
1611	S	27.6	Very low	32	Very low	105 Å²	105	125.2 Å²	125.2	73%	0.734	72%	0.723	S	S	*	*			trans	-77	113.6	175.5	-172.9	0	0	0	0	109.1
1612	R	30.5	Very low	32	Very low	224 Å²	224	120 Å²	120	85%	0.845	71%	0.711	S	S	*	*			trans	-131	112.3	151.1	-93.5	-171.1	167.4	-179.8	-4.7	109.2	S1610 V1614	S1610-R1612 PolarHBondContact O-N 3.12Å; R1612-V1614 PolarHBondContact O-N 2.89Å; R1612-V1614 VanDerWaalsContact O-N 3.15Å
1613	Q	28.8	Very low	31.9	Very low	187 Å²	187	117.2 Å²	117.2	87%	0.874	70%	0.697	S	S	*	*			trans	-63.6	108.3	169.3	-63.1	152.8	-84.6	0	0	108.8
1614	V	31	Very low	32.7	Very low	125 Å²	125	119.4 Å²	119.4	76%	0.758	70%	0.699	S	S	*	*			trans	-137.5	140	160.8	-173	0	0	0	0	109.3	R1612	R1612-V1614 PolarHBondContact O-N 2.89Å; R1612-V1614 VanDerWaalsContact O-N 3.15Å
1615	T	26.2	Very low	34.4	Very low	125 Å²	125	124.3 Å²	124.3	77%	0.767	70%	0.704	S	S	*	*			trans	-62.7	140.3	-179.1	49	0	0	0	0	114
1616	R	25.3	Very low	36.5	Very low	198 Å²	198	119.2 Å²	119.2	75%	0.747	68%	0.677	S	S	*	*			trans	28.3	107.1	138.1	-174.7	-173.1	177.5	-166	-5.1	117.8	E1618	R1616-E1618 IonicContact CZ-OE2 2.75Å; R1616-E1618 IonicContact NE-OE2 3.21Å; R1616-E1618 PolarHBondContact NE-OE2 2.77Å; R1616-E1618 IonicContact NH2-OE2 3.58Å; R1616-E1618 PolarHBondContact NH2-OE2 3.29Å
1617	S	27.8	Very low	38.6	Very low	111 Å²	111	115.9 Å²	115.9	78%	0.776	67%	0.669	S	S	*	*			trans	-159.6	73.6	147	-80.8	0	0	0	0	108.7	S1619	S1617-S1619 VanDerWaalsContact C-N 3.28Å; S1617-S1619 PolarHBondContact O-N 3.16Å
1618	E	27.9	Very low	40.6	Very low	98 Å²	98	114 Å²	114	46%	0.458	65%	0.651	S	S	.	*				70.3	12.1	84.9	-156	100.5	-100.6	0	0	114.9	R1616 R1621	R1616-E1618 IonicContact CZ-OE2 2.75Å; R1616-E1618 IonicContact NE-OE2 3.21Å; R1616-E1618 PolarHBondContact NE-OE2 2.77Å; R1616-E1618 IonicContact NH2-OE2 3.58Å; R1616-E1618 PolarHBondContact NH2-OE2 3.29Å; E1618-R1621 IonicContact OE1-CZ 3.06Å; E1618-R1621 IonicContact OE1-NE 2.76Å; E1618-R1621 IonicContact OE1-NH1 3.66Å; E1618-R1621 PolarHBondContact OE1-NH1 2.78Å
1619	S	28.5	Very low	42.9	Very low	115 Å²	115	108.7 Å²	108.7	80%	0.804	62%	0.624	S	S	*	*	S	Bend	trans	-125.7	103.6	165.5	60.6	0	0	0	0	111.7	S1617	S1617-S1619 VanDerWaalsContact C-N 3.28Å; S1617-S1619 PolarHBondContact O-N 3.16Å
1620	G	31.1	Very low	45.3	Very low	80 Å²	80	109.7 Å²	109.7	83%	0.825	61%	0.609	S	S	*	*	S	Bend	trans	133.1	-7.2	-177.4	0	0	0	0	0	115.3
1621	R	30.9	Very low	47.2	Very low	182 Å²	182	108.9 Å²	108.9	69%	0.687	60%	0.596	S	S	*	*	S	Bend	trans	-49.8	142.2	158.4	-84.1	177.8	158.7	177.1	-12.2	109	E1618 S1623	E1618-R1621 IonicContact OE1-CZ 3.06Å; E1618-R1621 IonicContact OE1-NE 2.76Å; E1618-R1621 IonicContact OE1-NH1 3.66Å; E1618-R1621 PolarHBondContact OE1-NH1 2.78Å; R1621-S1623 WeakPolarHBondContact O-CA 3.05Å; R1621-S1623 PolarHBondContact O-N 3.2Å
1622	S	43.8	Very low	49.2	Very low	85 Å²	85	106.6 Å²	106.6	59%	0.594	58%	0.584	S	S	*	*	S	Bend	trans	-37.8	108.5	175.4	48.6	0	0	0	0	110.3	T1624	S1622-T1624 PolarHBondContact O-N 2.81Å
1623	S	48.5	Very low	50.9	Low	68 Å²	68	97.8 Å²	97.8	48%	0.476	55%	0.551	S	S	.	*			trans	-44.6	112.1	-161.2	176.1	0	0	0	0	110.4	R1621 R1625 Y1633	R1621-S1623 WeakPolarHBondContact O-CA 3.05Å; R1621-S1623 PolarHBondContact O-N 3.2Å; S1623-R1625 CarbonylContact C-O 3.58Å; S1623-R1625 WeakPolarHBondContact CB-O 3.39Å; S1623-R1625 CarbonylContact O-C 3.51Å; S1623-R1625 VanDerWaalsContact O-C 3.27Å; S1623-R1625 PolarHBondContact O-N 2.77Å; S1623-R1625 PolarHBondContact OG-O 3Å; S1623-Y1633 WeakPolarHBondContact O-CD2 3.35Å; S1623-Y1633 WeakPolarHBondContact O-CE2 3.47Å
1624	T	57.6	Low	52.3	Low	103 Å²	103	92.2 Å²	92.2	63%	0.632	53%	0.53	S	S	*	.	S	Bend	trans	-62.4	-10.1	-167.9	47.9	0	0	0	0	113.4	S1622 A1632 Y1633	S1622-T1624 PolarHBondContact O-N 2.81Å; T1624-A1632 CarbonylContact O-C 3.47Å; T1624-A1632 WeakPolarHBondContact O-CA 3.42Å; T1624-Y1633 PolarHBondContact O-N 3.44Å
1625	R	68.3	Low	53.5	Low	147 Å²	147	93.2 Å²	93.2	56%	0.555	54%	0.542	S	S	*	.	B	Isolated β-bridge	trans	-120.5	144.9	158.3	66.3	-172.2	-179.2	173.3	0.5	110.8	S1623 A1627 I1631	S1623-R1625 CarbonylContact C-O 3.58Å; S1623-R1625 WeakPolarHBondContact CB-O 3.39Å; S1623-R1625 CarbonylContact O-C 3.51Å; S1623-R1625 VanDerWaalsContact O-C 3.27Å; S1623-R1625 PolarHBondContact O-N 2.77Å; S1623-R1625 PolarHBondContact OG-O 3Å; R1625-A1627 PolarHBondContact O-N 2.99Å; R1625-I1631 CarbonylContact C-O 3.56Å; R1625-I1631 VanDerWaalsContact CA-O 3.26Å; R1625-I1631 WeakPolarHBondContact CA-O 3.23Å
1626	C	76.7	Confident	54.7	Low	1 Å²	1	90.3 Å²	90.3	1%	0.007	54%	0.537	C	S	.	.			trans	-65.5	124.8	166.2	170.9	0	0	0	0	110.6	L1628 C1629 N1630 I1631 H1642 H1648	C1626-L1628 VanDerWaalsContact C-N 3.32Å; C1626-L1628 PolarHBondContact O-N 3.13Å; C1626-C1629 HydrophobicContact CB-CB 3.91Å; C1626-C1629 PolarHBondContact O-N 3.07Å; C1626-C1629 VanDerWaalsContact SG-SG 3.67Å; C1626-N1630 WeakPolarHBondContact O-CA 3.16Å; C1626-N1630 PolarHBondContact O-N 3.17Å; C1626-I1631 PolarHBondContact N-O 3.32Å; C1626-H1642 WeakPolarHBondContact CB-NE2 3.45Å; C1626-H1642 PolarHBondContact SG-NE2 2.92Å; C1626-H1648 PolarHBondContact SG-CE1 2.94Å; C1626-H1648 PolarHBondContact SG-ND1 3.22Å; C1626-H1648 VanDerWaalsContact SG-ND1 3.44Å
1627	A	75.1	Confident	56.1	Low	74 Å²	74	86.4 Å²	86.4	61%	0.612	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-32.4	-174.4	0	0	0	0	0	114.8	R1625	R1625-A1627 PolarHBondContact O-N 2.99Å
1628	L	77.2	Confident	57.7	Low	61 Å²	61	85.4 Å²	85.4	32%	0.319	51%	0.512	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-11.1	176.4	-72.3	174.7	0	0	0	114	Y1558 C1626 V1652 A1655	Y1558-L1628 HydrophobicContact CD2-CD1 4.46Å; Y1558-L1628 HydrophobicContact CE1-CD1 3.92Å; Y1558-L1628 HydrophobicContact CE2-CD1 3.78Å; Y1558-L1628 HydrophobicContact CE2-CG 4.32Å; Y1558-L1628 VanDerWaalsContact CZ-CD1 3.48Å; Y1558-L1628 WeakPolarHBondContact OH-CG 3.26Å; C1626-L1628 VanDerWaalsContact C-N 3.32Å; C1626-L1628 PolarHBondContact O-N 3.13Å; L1628-V1652 HydrophobicContact CD1-CB 4.26Å; L1628-V1652 HydrophobicContact CD1-CG2 3.64Å; L1628-A1655 HydrophobicContact CD1-CB 4.38Å; L1628-A1655 HydrophobicContact CD2-CB 3.75Å
1629	C	81.1	Confident	59.8	Low	12 Å²	12	83.3 Å²	83.3	8%	0.081	50%	0.504	C	S	.	.	T	Hydrogen-bonded Turn	trans	-124.3	-17.5	-168	-61.4	0	0	0	0	114.7	C1626 I1631 H1642 R1651	C1626-C1629 HydrophobicContact CB-CB 3.91Å; C1626-C1629 PolarHBondContact O-N 3.07Å; C1626-C1629 VanDerWaalsContact SG-SG 3.67Å; C1629-I1631 HydrophobicContact CB-CB 4.4Å; C1629-I1631 HydrophobicContact CB-CD1 4.35Å; C1629-I1631 HydrophobicContact CB-CG1 4.42Å; C1629-I1631 PolarHBondContact O-N 3.25Å; C1629-H1642 VanDerWaalsContact CB-CE1 3.48Å; C1629-H1642 WeakPolarHBondContact CB-CE1 3.11Å; C1629-H1642 WeakPolarHBondContact CB-NE2 3.36Å; C1629-H1642 VanDerWaalsContact SG-CE1 3.56Å; C1629-R1651 PolarHBondContact O-NH1 2.99Å; C1629-R1651 PolarHBondContact SG-NE 2.78Å; C1629-R1651 VanDerWaalsContact SG-NE 3.42Å; C1629-R1651 PolarHBondContact SG-NH2 3.03Å
1630	N	76.3	Confident	61.8	Low	110 Å²	110	80.8 Å²	80.8	59%	0.588	48%	0.479	S	S	*	.			trans	49	14.8	-168.9	-74.2	-31.4	0	0	0	115.4	C1626 A1632	C1626-N1630 WeakPolarHBondContact O-CA 3.16Å; C1626-N1630 PolarHBondContact O-N 3.17Å; N1630-A1632 PolarHBondContact O-N 2.8Å
1631	I	71.2	Confident	63.9	Low	75 Å²	75	81.1 Å²	81.1	39%	0.385	46%	0.462	S	S	.	.			trans	-75.3	119.5	172.2	-74.6	167.8	0	0	0	107.7	R1625 C1626 C1629	R1625-I1631 CarbonylContact C-O 3.56Å; R1625-I1631 VanDerWaalsContact CA-O 3.26Å; R1625-I1631 WeakPolarHBondContact CA-O 3.23Å; C1626-I1631 PolarHBondContact N-O 3.32Å; C1629-I1631 HydrophobicContact CB-CB 4.4Å; C1629-I1631 HydrophobicContact CB-CD1 4.35Å; C1629-I1631 HydrophobicContact CB-CG1 4.42Å; C1629-I1631 PolarHBondContact O-N 3.25Å
1632	A	68.9	Low	66.4	Low	58 Å²	58	73.1 Å²	73.1	48%	0.479	43%	0.433	S	S	.	.	B	Isolated β-bridge	trans	-71.3	133.6	174.5	0	0	0	0	0	110.7	T1624 N1630 T1634	T1624-A1632 CarbonylContact O-C 3.47Å; T1624-A1632 WeakPolarHBondContact O-CA 3.42Å; N1630-A1632 PolarHBondContact O-N 2.8Å; A1632-T1634 PolarHBondContact O-N 3.25Å; A1632-T1634 VanDerWaalsContact O-N 3.15Å
1633	Y	65.9	Low	68.3	Low	39 Å²	39	69.1 Å²	69.1	15%	0.153	40%	0.404	C	S	.	.			trans	-78.1	91.6	166.6	-55.9	-60.1	0	0	0	107.9	S1623 T1624 I1639 H1642 I1643	S1623-Y1633 WeakPolarHBondContact O-CD2 3.35Å; S1623-Y1633 WeakPolarHBondContact O-CE2 3.47Å; T1624-Y1633 PolarHBondContact O-N 3.44Å; Y1633-I1639 HydrophobicContact CD1-CB 4.44Å; Y1633-I1639 HydrophobicContact CD1-CG1 3.86Å; Y1633-I1639 HydrophobicContact CD2-CG1 4.35Å; Y1633-I1639 HydrophobicContact CE1-CB 4.43Å; Y1633-I1639 HydrophobicContact CE1-CG1 4.23Å; Y1633-I1639 HydrophobicContact CE1-CG2 4.28Å; Y1633-I1639 HydrophobicContact CG-CG1 3.94Å; Y1633-H1642 HydrophobicContact CD1-CB 4.49Å; Y1633-H1642 HydrophobicContact CE1-CB 3.96Å; Y1633-H1642 AromaticContact CE1-CD2 3.69Å; Y1633-I1643 HydrophobicContact CE1-CG1 4.4Å; Y1633-I1643 WeakPolarHBondContact OH-CD1 3.19Å; Y1633-I1643 WeakPolarHBondContact OH-CG1 3.43Å
1634	T	59.6	Low	69.9	Low	70 Å²	70	66 Å²	66	43%	0.429	38%	0.383	S	S	.	.			trans	-67.2	156.5	169.9	65.1	0	0	0	0	109.5	A1632 G1636 Q1637	A1632-T1634 PolarHBondContact O-N 3.25Å; A1632-T1634 VanDerWaalsContact O-N 3.15Å; T1634-G1636 PolarHBondContact O-N 3.09Å; T1634-Q1637 PolarHBondContact O-N 3.41Å; T1634-Q1637 VanDerWaalsContact O-N 3.1Å; T1634-Q1637 PolarHBondContact OG1-N 3.22Å; T1634-Q1637 PolarHBondContact OG1-OE1 2.86Å
1635	S	56.1	Low	71.2	Confident	145 Å²	145	63.6 Å²	63.6	100%	1.014	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-10	-175.6	-40.8	0	0	0	0	115.3
1636	G	50.8	Low	71.9	Confident	64 Å²	64	63 Å²	63	66%	0.66	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.2	-10.4	176.7	0	0	0	0	0	115.6	T1634	T1634-G1636 PolarHBondContact O-N 3.09Å
1637	Q	55.5	Low	72.3	Confident	117 Å²	117	70.9 Å²	70.9	55%	0.547	40%	0.403	S	S	.	.	S	Bend	trans	-82.1	118.8	167.8	-106.2	70	68.5	0	0	108.8	T1634 I1639	T1634-Q1637 PolarHBondContact O-N 3.41Å; T1634-Q1637 VanDerWaalsContact O-N 3.1Å; T1634-Q1637 PolarHBondContact OG1-N 3.22Å; T1634-Q1637 PolarHBondContact OG1-OE1 2.86Å; Q1637-I1639 PolarHBondContact O-N 3.19Å
1638	I	61.5	Low	72.8	Confident	89 Å²	89	67.3 Å²	67.3	46%	0.456	37%	0.374	S	S	.	.			trans	-68.1	133.3	178.7	-42.3	179.9	0	0	0	107.5	Q1640 D1641	I1638-Q1640 HydrophobicContact CB-CB 4.26Å; I1638-Q1640 HydrophobicContact CG2-CB 3.75Å; I1638-Q1640 HydrophobicContact CG2-CG 3.75Å; I1638-Q1640 PolarHBondContact O-N 3.35Å; I1638-D1641 WeakPolarHBondContact CB-OD2 3.42Å; I1638-D1641 WeakPolarHBondContact CG1-OD2 3.38Å; I1638-D1641 PolarHBondContact N-OD2 2.78Å; I1638-D1641 VanDerWaalsContact N-OD2 3.12Å; I1638-D1641 WeakPolarHBondContact O-CB 3.45Å; I1638-D1641 PolarHBondContact O-N 3.45Å
1639	I	71.8	Confident	73.2	Confident	54 Å²	54	64.5 Å²	64.5	28%	0.277	36%	0.359	S	S	.	.	H	α-helix	trans	-52.2	-31.5	176.2	-70.5	172.4	0	0	0	111.2	Y1633 Q1637 I1643	Y1633-I1639 HydrophobicContact CD1-CB 4.44Å; Y1633-I1639 HydrophobicContact CD1-CG1 3.86Å; Y1633-I1639 HydrophobicContact CD2-CG1 4.35Å; Y1633-I1639 HydrophobicContact CE1-CB 4.43Å; Y1633-I1639 HydrophobicContact CE1-CG1 4.23Å; Y1633-I1639 HydrophobicContact CE1-CG2 4.28Å; Y1633-I1639 HydrophobicContact CG-CG1 3.94Å; Q1637-I1639 PolarHBondContact O-N 3.19Å; I1639-I1643 HydrophobicContact CG2-CD1 3.43Å; I1639-I1643 VanDerWaalsContact CG2-CD1 3.43Å; I1639-I1643 HydrophobicContact CG2-CG1 4.26Å; I1639-I1643 WeakPolarHBondContact O-CB 3.16Å; I1639-I1643 VanDerWaalsContact O-CG1 3.29Å; I1639-I1643 WeakPolarHBondContact O-CG1 3.46Å; I1639-I1643 PolarHBondContact O-N 2.92Å
1640	Q	69.9	Low	73.4	Confident	62 Å²	62	66.1 Å²	66.1	29%	0.29	37%	0.367	S	S	.	.	H	α-helix	trans	-52.8	-53.3	169.7	-64.9	170.6	10.9	0	0	112.9	Y1563 E1570 I1638 H1642 I1643 F1644	Y1563-Q1640 HydrophobicContact CE1-CG 4.01Å; Y1563-Q1640 HydrophobicContact CE2-CG 4.03Å; Y1563-Q1640 PolarHBondContact OH-NE2 2.94Å; E1570-Q1640 VanDerWaalsContact OE1-CB 3.28Å; E1570-Q1640 WeakPolarHBondContact OE1-CB 3.25Å; E1570-Q1640 VanDerWaalsContact OE1-CG 3.3Å; E1570-Q1640 WeakPolarHBondContact OE1-CG 3.45Å; I1638-Q1640 HydrophobicContact CB-CB 4.26Å; I1638-Q1640 HydrophobicContact CG2-CB 3.75Å; I1638-Q1640 HydrophobicContact CG2-CG 3.75Å; I1638-Q1640 PolarHBondContact O-N 3.35Å; Q1640-H1642 VanDerWaalsContact C-N 3.32Å; Q1640-H1642 PolarHBondContact O-N 3.24Å; Q1640-I1643 PolarHBondContact O-N 2.94Å; Q1640-F1644 WeakPolarHBondContact O-CD2 3.42Å; Q1640-F1644 PolarHBondContact O-N 2.97Å; Q1640-F1644 VanDerWaalsContact O-N 3.14Å
1641	D	75	Confident	73.9	Confident	87 Å²	87	65 Å²	65	47%	0.465	35%	0.354	S	S	.	.	H	α-helix	trans	-56.1	-47.2	-174	-60.9	-38.6	0	0	0	111.1	I1638 T1645	I1638-D1641 WeakPolarHBondContact CB-OD2 3.42Å; I1638-D1641 WeakPolarHBondContact CG1-OD2 3.38Å; I1638-D1641 PolarHBondContact N-OD2 2.78Å; I1638-D1641 VanDerWaalsContact N-OD2 3.12Å; I1638-D1641 WeakPolarHBondContact O-CB 3.45Å; I1638-D1641 PolarHBondContact O-N 3.45Å; D1641-T1645 WeakPolarHBondContact O-CG2 3.43Å
1642	H	83.2	Confident	74.5	Confident	15 Å²	15	61.4 Å²	61.4	7%	0.069	34%	0.336	C	S	.	.	H	α-helix	trans	-69.9	-53.1	-179.4	175.4	53.2	0	0	0	112.4	C1626 C1629 Y1633 Q1640 F1644 T1645 H1648	C1626-H1642 WeakPolarHBondContact CB-NE2 3.45Å; C1626-H1642 PolarHBondContact SG-NE2 2.92Å; C1629-H1642 VanDerWaalsContact CB-CE1 3.48Å; C1629-H1642 WeakPolarHBondContact CB-CE1 3.11Å; C1629-H1642 WeakPolarHBondContact CB-NE2 3.36Å; C1629-H1642 VanDerWaalsContact SG-CE1 3.56Å; Y1633-H1642 HydrophobicContact CD1-CB 4.49Å; Y1633-H1642 HydrophobicContact CE1-CB 3.96Å; Y1633-H1642 AromaticContact CE1-CD2 3.69Å; Q1640-H1642 VanDerWaalsContact C-N 3.32Å; Q1640-H1642 PolarHBondContact O-N 3.24Å; H1642-F1644 VanDerWaalsContact C-N 3.32Å; H1642-F1644 PolarHBondContact O-N 2.63Å; H1642-T1645 WeakPolarHBondContact O-CB 3.36Å; H1642-T1645 PolarHBondContact O-N 3.38Å; H1642-T1645 PolarHBondContact O-OG1 3.11Å; H1642-H1648 AromaticContact CD2-ND1 3.62Å; H1642-H1648 AromaticContact CE1-ND1 3.7Å; H1642-H1648 AromaticContact NE2-CE1 3.97Å; H1642-H1648 AromaticContact NE2-CG 3.88Å; H1642-H1648 AromaticContact NE2-ND1 2.99Å; H1642-H1648 PolarHBondContact NE2-ND1 3.3Å; H1642-H1648 VanDerWaalsContact O-CB 3.27Å; H1642-H1648 WeakPolarHBondContact O-CB 3.3Å
1643	I	84.1	Confident	75.3	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-65.8	-35.2	-168.3	-70.5	-178.3	0	0	0	111.9	L1559 D1562 Y1633 I1639 Q1640 H1648	L1559-I1643 HydrophobicContact CD2-CG2 3.51Å; D1562-I1643 HydrophobicContact CB-CD1 3.47Å; D1562-I1643 VanDerWaalsContact CB-CD1 3.47Å; Y1633-I1643 HydrophobicContact CE1-CG1 4.4Å; Y1633-I1643 WeakPolarHBondContact OH-CD1 3.19Å; Y1633-I1643 WeakPolarHBondContact OH-CG1 3.43Å; I1639-I1643 HydrophobicContact CG2-CD1 3.43Å; I1639-I1643 VanDerWaalsContact CG2-CD1 3.43Å; I1639-I1643 HydrophobicContact CG2-CG1 4.26Å; I1639-I1643 WeakPolarHBondContact O-CB 3.16Å; I1639-I1643 VanDerWaalsContact O-CG1 3.29Å; I1639-I1643 WeakPolarHBondContact O-CG1 3.46Å; I1639-I1643 PolarHBondContact O-N 2.92Å; Q1640-I1643 PolarHBondContact O-N 2.94Å; I1643-H1648 PolarHBondContact O-CD2 3.39Å
1644	F	83	Confident	76.1	Confident	4 Å²	4	65.7 Å²	65.7	2%	0.018	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86	-4.1	175.9	-65.3	-73.3	0	0	0	114	Y1563 P1566 E1570 M1573 L1574 Q1640 H1642 K1646 I1649	Y1563-F1644 AromaticContact CD1-CE2 3.51Å; Y1563-F1644 HydrophobicContact CD1-CE2 3.51Å; Y1563-F1644 AromaticContact CD1-CZ 3.84Å; Y1563-F1644 HydrophobicContact CD1-CZ 3.84Å; Y1563-F1644 HydrophobicContact CE1-CE2 4.02Å; Y1563-F1644 HydrophobicContact CG-CE2 4.37Å; P1566-F1644 HydrophobicContact CB-CE1 4.35Å; P1566-F1644 HydrophobicContact CB-CZ 3.88Å; E1570-F1644 HydrophobicContact CB-CD1 3.95Å; E1570-F1644 HydrophobicContact CB-CD2 3.94Å; E1570-F1644 HydrophobicContact CB-CE1 4.03Å; E1570-F1644 HydrophobicContact CB-CE2 4.02Å; E1570-F1644 HydrophobicContact CB-CG 3.92Å; E1570-F1644 HydrophobicContact CB-CZ 4.08Å; E1570-F1644 VanDerWaalsContact CD-CD2 3.5Å; E1570-F1644 VanDerWaalsContact CD-CE2 3.46Å; E1570-F1644 HydrophobicContact CG-CB 4.36Å; E1570-F1644 HydrophobicContact CG-CD1 4.34Å; E1570-F1644 HydrophobicContact CG-CD2 3.5Å; E1570-F1644 VanDerWaalsContact CG-CD2 3.5Å; E1570-F1644 HydrophobicContact CG-CE2 3.85Å; E1570-F1644 HydrophobicContact CG-CG 3.78Å; E1570-F1644 HydrophobicContact CG-CZ 4.42Å; E1570-F1644 WeakPolarHBondContact OE1-CD2 3.26Å; E1570-F1644 WeakPolarHBondContact OE1-CE2 3.42Å; M1573-F1644 HydrophobicContact SD-CB 4.41Å; L1574-F1644 HydrophobicContact CB-CD1 4.36Å; L1574-F1644 HydrophobicContact CB-CE1 4.47Å; L1574-F1644 HydrophobicContact CD2-CE1 4.18Å; Q1640-F1644 WeakPolarHBondContact O-CD2 3.42Å; Q1640-F1644 PolarHBondContact O-N 2.97Å; Q1640-F1644 VanDerWaalsContact O-N 3.14Å; H1642-F1644 VanDerWaalsContact C-N 3.32Å; H1642-F1644 PolarHBondContact O-N 2.63Å; F1644-K1646 PolarHBondContact O-N 2.95Å; F1644-I1649 WeakPolarHBondContact O-CD1 3.34Å
1645	T	84.2	Confident	77.2	Confident	51 Å²	51	63.2 Å²	63.2	31%	0.313	34%	0.336	S	S	.	.	S	Bend	trans	-55.3	140.8	173.5	60.6	0	0	0	0	111.4	D1641 H1642 K1647 H1648 I1649	D1641-T1645 WeakPolarHBondContact O-CG2 3.43Å; H1642-T1645 WeakPolarHBondContact O-CB 3.36Å; H1642-T1645 PolarHBondContact O-N 3.38Å; H1642-T1645 PolarHBondContact O-OG1 3.11Å; T1645-K1647 PolarHBondContact O-N 3.44Å; T1645-K1647 VanDerWaalsContact O-N 3.13Å; T1645-H1648 PolarHBondContact O-N 2.95Å; T1645-H1648 VanDerWaalsContact OG1-CB 3.31Å; T1645-H1648 WeakPolarHBondContact OG1-CB 3.36Å; T1645-H1648 PolarHBondContact OG1-N 3.18Å; T1645-I1649 PolarHBondContact O-N 2.86Å
1646	K	83.3	Confident	78.3	Confident	135 Å²	135	57.1 Å²	57.1	59%	0.587	29%	0.292	S	S	*	.	H	α-helix	trans	-46.9	-42.4	168.4	-166.4	-176.5	-178.9	-172.8	0	111.8	F1644 H1648 I1649 D1650	F1644-K1646 PolarHBondContact O-N 2.95Å; K1646-H1648 PolarHBondContact O-N 2.96Å; K1646-I1649 PolarHBondContact O-N 3.13Å; K1646-D1650 WeakPolarHBondContact CG-OD2 3.26Å; K1646-D1650 VanDerWaalsContact O-CB 3.32Å; K1646-D1650 WeakPolarHBondContact O-CB 3.43Å; K1646-D1650 VanDerWaalsContact O-CG 3.3Å; K1646-D1650 PolarHBondContact O-N 2.88Å
1647	K	84.5	Confident	79.4	Confident	166 Å²	166	55.2 Å²	55.2	72%	0.722	27%	0.273	S	S	*	.	H	α-helix	trans	-66.1	-30.2	178.3	-65.8	-175.4	179.2	-179.2	0	114.4	T1645 R1651	T1645-K1647 PolarHBondContact O-N 3.44Å; T1645-K1647 VanDerWaalsContact O-N 3.13Å; K1647-R1651 PolarHBondContact O-NE 2.79Å
1648	H	86.6	Confident	80.2	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-76.8	-53.1	171.8	177.3	108.9	0	0	0	109.8	Y1558 L1559 C1626 H1642 I1643 T1645 K1646 D1650 R1651 V1652	Y1558-H1648 AromaticContact CE1-NE2 3.78Å; L1559-H1648 WeakPolarHBondContact CD2-NE2 3.15Å; C1626-H1648 PolarHBondContact SG-CE1 2.94Å; C1626-H1648 PolarHBondContact SG-ND1 3.22Å; C1626-H1648 VanDerWaalsContact SG-ND1 3.44Å; H1642-H1648 AromaticContact CD2-ND1 3.62Å; H1642-H1648 AromaticContact CE1-ND1 3.7Å; H1642-H1648 AromaticContact NE2-CE1 3.97Å; H1642-H1648 AromaticContact NE2-CG 3.88Å; H1642-H1648 AromaticContact NE2-ND1 2.99Å; H1642-H1648 PolarHBondContact NE2-ND1 3.3Å; H1642-H1648 VanDerWaalsContact O-CB 3.27Å; H1642-H1648 WeakPolarHBondContact O-CB 3.3Å; I1643-H1648 PolarHBondContact O-CD2 3.39Å; T1645-H1648 PolarHBondContact O-N 2.95Å; T1645-H1648 VanDerWaalsContact OG1-CB 3.31Å; T1645-H1648 WeakPolarHBondContact OG1-CB 3.36Å; T1645-H1648 PolarHBondContact OG1-N 3.18Å; K1646-H1648 PolarHBondContact O-N 2.96Å; H1648-D1650 VanDerWaalsContact C-N 3.27Å; H1648-D1650 PolarHBondContact O-N 3.2Å; H1648-R1651 PolarHBondContact O-N 2.62Å; H1648-V1652 WeakPolarHBondContact NE2-CG2 3.23Å; H1648-V1652 WeakPolarHBondContact O-CG2 3.45Å; H1648-V1652 PolarHBondContact O-N 3.47Å
1649	I	84.7	Confident	80.4	Confident	1 Å²	1	55.7 Å²	55.7	1%	0.005	28%	0.275	C	S	.	.	H	α-helix	trans	-59.5	-37.9	-176.4	-59	169.7	0	0	0	111.4	V1555 L1559 L1574 Q1577 I1578 F1644 T1645 K1646 V1652 K1653	V1555-I1649 HydrophobicContact CG1-CG2 4.24Å; L1559-I1649 HydrophobicContact CD1-CG1 4.48Å; L1574-I1649 HydrophobicContact CD1-CD1 4.04Å; L1574-I1649 HydrophobicContact CD1-CG2 4.34Å; Q1577-I1649 HydrophobicContact CB-CD1 4.24Å; Q1577-I1649 HydrophobicContact CB-CG2 4.14Å; Q1577-I1649 HydrophobicContact CG-CB 3.97Å; Q1577-I1649 HydrophobicContact CG-CD1 4.2Å; Q1577-I1649 HydrophobicContact CG-CG2 3.56Å; I1578-I1649 HydrophobicContact CG2-CG2 4.39Å; F1644-I1649 WeakPolarHBondContact O-CD1 3.34Å; T1645-I1649 PolarHBondContact O-N 2.86Å; K1646-I1649 PolarHBondContact O-N 3.13Å; I1649-V1652 WeakPolarHBondContact O-CB 3.31Å; I1649-V1652 PolarHBondContact O-N 3.32Å; I1649-K1653 WeakPolarHBondContact O-CG 3.5Å; I1649-K1653 PolarHBondContact O-N 2.86Å
1650	D	85.7	Confident	80.1	Confident	47 Å²	47	56 Å²	56	25%	0.251	28%	0.279	S	S	.	.	H	α-helix	trans	-72.5	-31.1	177.6	-69	-21.8	0	0	0	112.9	Q1577 K1646 H1648 K1653 L1654	Q1577-D1650 PolarHBondContact NE2-OD1 3.02Å; Q1577-D1650 PolarHBondContact NE2-OD2 3.12Å; K1646-D1650 WeakPolarHBondContact CG-OD2 3.26Å; K1646-D1650 VanDerWaalsContact O-CB 3.32Å; K1646-D1650 WeakPolarHBondContact O-CB 3.43Å; K1646-D1650 VanDerWaalsContact O-CG 3.3Å; K1646-D1650 PolarHBondContact O-N 2.88Å; H1648-D1650 VanDerWaalsContact C-N 3.27Å; H1648-D1650 PolarHBondContact O-N 3.2Å; D1650-K1653 WeakPolarHBondContact O-CB 3.41Å; D1650-K1653 PolarHBondContact O-N 2.86Å; D1650-K1653 WeakPolarHBondContact OD1-CD 3.5Å; D1650-K1653 VanDerWaalsContact OD1-CE 3.28Å; D1650-K1653 WeakPolarHBondContact OD1-CE 3.31Å; D1650-K1653 IonicContact OD1-NZ 2.86Å; D1650-K1653 PolarHBondContact OD1-NZ 3.42Å; D1650-L1654 WeakPolarHBondContact O-CG 3.17Å; D1650-L1654 PolarHBondContact O-N 3.13Å
1651	R	86.4	Confident	79.5	Confident	85 Å²	85	56.8 Å²	56.8	32%	0.321	29%	0.285	S	S	.	.	H	α-helix	trans	-68.1	-38.6	168.2	-79.9	-178.7	-77.4	-173.4	2.3	112.3	C1629 K1647 H1648 K1653 L1654 A1655	C1629-R1651 PolarHBondContact O-NH1 2.99Å; C1629-R1651 PolarHBondContact SG-NE 2.78Å; C1629-R1651 VanDerWaalsContact SG-NE 3.42Å; C1629-R1651 PolarHBondContact SG-NH2 3.03Å; K1647-R1651 PolarHBondContact O-NE 2.79Å; H1648-R1651 PolarHBondContact O-N 2.62Å; R1651-K1653 VanDerWaalsContact C-N 3.33Å; R1651-K1653 PolarHBondContact O-N 2.69Å; R1651-L1654 PolarHBondContact O-N 3.48Å; R1651-A1655 PolarHBondContact O-N 3.2Å
1652	V	84.6	Confident	78.3	Confident	1 Å²	1	55.5 Å²	55.5	1%	0.006	28%	0.283	C	S	.	.	H	α-helix	trans	-60.5	-41.7	171.3	176.3	0	0	0	0	111.1	V1555 Y1558 L1628 H1648 I1649 I1656	V1555-V1652 HydrophobicContact CB-CG1 4.32Å; V1555-V1652 HydrophobicContact CG1-CG1 4.09Å; V1555-V1652 HydrophobicContact CG2-CG1 4.21Å; Y1558-V1652 HydrophobicContact CD1-CG1 4.12Å; Y1558-V1652 HydrophobicContact CD1-CG2 3.63Å; Y1558-V1652 HydrophobicContact CE1-CG2 3.83Å; Y1558-V1652 HydrophobicContact CG-CG1 4.04Å; Y1558-V1652 HydrophobicContact CG-CG2 4.31Å; L1628-V1652 HydrophobicContact CD1-CB 4.26Å; L1628-V1652 HydrophobicContact CD1-CG2 3.64Å; H1648-V1652 WeakPolarHBondContact NE2-CG2 3.23Å; H1648-V1652 WeakPolarHBondContact O-CG2 3.45Å; H1648-V1652 PolarHBondContact O-N 3.47Å; I1649-V1652 WeakPolarHBondContact O-CB 3.31Å; I1649-V1652 PolarHBondContact O-N 3.32Å; V1652-I1656 HydrophobicContact CG1-CD1 3.68Å; V1652-I1656 WeakPolarHBondContact O-CB 3.48Å; V1652-I1656 VanDerWaalsContact O-CD1 3.29Å; V1652-I1656 WeakPolarHBondContact O-CD1 3.43Å; V1652-I1656 WeakPolarHBondContact O-CG1 3.24Å; V1652-I1656 PolarHBondContact O-N 2.75Å
1653	K	84.8	Confident	76.8	Confident	75 Å²	75	59.9 Å²	59.9	33%	0.326	31%	0.311	S	S	.	.	H	α-helix	trans	-62.5	-44.4	173.4	-70.4	174	-169.2	166.7	0	112.5	V1555 Q1577 I1649 D1650 R1651 I1656 G1657	V1555-K1653 HydrophobicContact CG2-CG 4.25Å; Q1577-K1653 WeakPolarHBondContact O-CE 3.32Å; Q1577-K1653 PolarHBondContact O-NZ 2.91Å; I1649-K1653 WeakPolarHBondContact O-CG 3.5Å; I1649-K1653 PolarHBondContact O-N 2.86Å; D1650-K1653 WeakPolarHBondContact O-CB 3.41Å; D1650-K1653 PolarHBondContact O-N 2.86Å; D1650-K1653 WeakPolarHBondContact OD1-CD 3.5Å; D1650-K1653 VanDerWaalsContact OD1-CE 3.28Å; D1650-K1653 WeakPolarHBondContact OD1-CE 3.31Å; D1650-K1653 IonicContact OD1-NZ 2.86Å; D1650-K1653 PolarHBondContact OD1-NZ 3.42Å; R1651-K1653 VanDerWaalsContact C-N 3.33Å; R1651-K1653 PolarHBondContact O-N 2.69Å; K1653-I1656 PolarHBondContact O-N 3.03Å; K1653-G1657 PolarHBondContact O-N 3.15Å
1654	L	83.5	Confident	75	Confident	111 Å²	111	68.5 Å²	68.5	58%	0.581	34%	0.344	S	S	*	.	H	α-helix	trans	-62.2	-52.5	-179.6	-74.6	167.6	0	0	0	110.9	D1650 R1651 I1656 G1657 E1658	D1650-L1654 WeakPolarHBondContact O-CG 3.17Å; D1650-L1654 PolarHBondContact O-N 3.13Å; R1651-L1654 PolarHBondContact O-N 3.48Å; L1654-I1656 VanDerWaalsContact C-N 3.28Å; L1654-I1656 PolarHBondContact O-N 2.78Å; L1654-G1657 CarbonylContact O-C 3.58Å; L1654-G1657 WeakPolarHBondContact O-CA 3.2Å; L1654-G1657 PolarHBondContact O-N 2.79Å; L1654-E1658 WeakPolarHBondContact O-CG 3.11Å; L1654-E1658 PolarHBondContact O-N 2.83Å
1655	A	81.7	Confident	73.2	Confident	18 Å²	18	77.1 Å²	77.1	15%	0.149	38%	0.376	C	S	.	.	H	α-helix	trans	-58.5	-38.3	176.2	0	0	0	0	0	112.7	L1628 R1651 G1657 I1659	L1628-A1655 HydrophobicContact CD1-CB 4.38Å; L1628-A1655 HydrophobicContact CD2-CB 3.75Å; R1651-A1655 PolarHBondContact O-N 3.2Å; A1655-G1657 VanDerWaalsContact C-N 3.34Å; A1655-I1659 WeakPolarHBondContact O-CB 3.15Å; A1655-I1659 WeakPolarHBondContact O-CD1 2.99Å; A1655-I1659 WeakPolarHBondContact O-CG1 3.05Å; A1655-I1659 PolarHBondContact O-N 3.46Å
1656	I	78.8	Confident	71.1	Confident	17 Å²	17	81.3 Å²	81.3	9%	0.087	40%	0.397	C	S	.	.	H	α-helix	trans	-66.9	-35.7	173.3	-74	164.7	0	0	0	112	K1554 V1555 V1652 K1653 L1654 V1660	K1554-I1656 HydrophobicContact CB-CD1 3.57Å; K1554-I1656 HydrophobicContact CB-CG1 3.95Å; K1554-I1656 HydrophobicContact CB-CG2 4.01Å; K1554-I1656 HydrophobicContact CD-CG1 4.33Å; K1554-I1656 HydrophobicContact CD-CG2 3.7Å; V1555-I1656 HydrophobicContact CB-CD1 4.21Å; V1555-I1656 HydrophobicContact CG2-CD1 3.55Å; V1652-I1656 HydrophobicContact CG1-CD1 3.68Å; V1652-I1656 WeakPolarHBondContact O-CB 3.48Å; V1652-I1656 VanDerWaalsContact O-CD1 3.29Å; V1652-I1656 WeakPolarHBondContact O-CD1 3.43Å; V1652-I1656 WeakPolarHBondContact O-CG1 3.24Å; V1652-I1656 PolarHBondContact O-N 2.75Å; K1653-I1656 PolarHBondContact O-N 3.03Å; L1654-I1656 VanDerWaalsContact C-N 3.28Å; L1654-I1656 PolarHBondContact O-N 2.78Å; I1656-V1660 WeakPolarHBondContact O-CB 3.34Å; I1656-V1660 VanDerWaalsContact O-CG2 3.25Å; I1656-V1660 WeakPolarHBondContact O-CG2 3.47Å; I1656-V1660 PolarHBondContact O-N 3.05Å; I1656-V1660 VanDerWaalsContact O-N 3.1Å
1657	G	74.4	Confident	69	Low	25 Å²	25	79.2 Å²	79.2	26%	0.258	40%	0.399	S	S	.	.	H	α-helix	trans	-67.6	-45.3	175.4	0	0	0	0	0	112	K1653 L1654 A1655 V1660 N1661	K1653-G1657 PolarHBondContact O-N 3.15Å; L1654-G1657 CarbonylContact O-C 3.58Å; L1654-G1657 WeakPolarHBondContact O-CA 3.2Å; L1654-G1657 PolarHBondContact O-N 2.79Å; A1655-G1657 VanDerWaalsContact C-N 3.34Å; G1657-V1660 CarbonylContact O-C 3.51Å; G1657-V1660 PolarHBondContact O-N 3.33Å; G1657-N1661 VanDerWaalsContact O-CB 3.27Å; G1657-N1661 WeakPolarHBondContact O-CB 3.33Å; G1657-N1661 PolarHBondContact O-N 3.41Å; G1657-N1661 PolarHBondContact O-ND2 3.08Å
1658	E	72.9	Confident	66.5	Low	119 Å²	119	80.4 Å²	80.4	56%	0.556	41%	0.405	S	S	*	.	H	α-helix	trans	-59	-50.3	173.9	-72.4	159.9	-179.9	0	0	110.9	L1654 V1660 N1661 S1662	L1654-E1658 WeakPolarHBondContact O-CG 3.11Å; L1654-E1658 PolarHBondContact O-N 2.83Å; E1658-V1660 VanDerWaalsContact C-N 3.26Å; E1658-V1660 PolarHBondContact O-N 3.44Å; E1658-N1661 PolarHBondContact O-N 3.45Å; E1658-N1661 VanDerWaalsContact O-N 3.08Å; E1658-S1662 PolarHBondContact O-N 3.09Å; E1658-S1662 PolarHBondContact O-OG 3.25Å; E1658-S1662 VanDerWaalsContact O-OG 3.13Å
1659	I	66.4	Low	64	Low	97 Å²	97	90 Å²	90	50%	0.497	45%	0.449	S	S	.	.	H	α-helix	trans	-56.7	-38.8	174.9	-68.3	163.7	0	0	0	111.8	A1655 T1663	A1655-I1659 WeakPolarHBondContact O-CB 3.15Å; A1655-I1659 WeakPolarHBondContact O-CD1 2.99Å; A1655-I1659 WeakPolarHBondContact O-CG1 3.05Å; A1655-I1659 PolarHBondContact O-N 3.46Å; I1659-T1663 PolarHBondContact O-N 3.15Å; I1659-T1663 PolarHBondContact O-OG1 3.45Å
1660	V	64.8	Low	61.6	Low	60 Å²	60	93.5 Å²	93.5	36%	0.364	49%	0.486	S	S	.	.	H	α-helix	trans	-78.1	-27.4	179	169.9	0	0	0	0	112.7	I1656 G1657 E1658 R1664	I1656-V1660 WeakPolarHBondContact O-CB 3.34Å; I1656-V1660 VanDerWaalsContact O-CG2 3.25Å; I1656-V1660 WeakPolarHBondContact O-CG2 3.47Å; I1656-V1660 PolarHBondContact O-N 3.05Å; I1656-V1660 VanDerWaalsContact O-N 3.1Å; G1657-V1660 CarbonylContact O-C 3.51Å; G1657-V1660 PolarHBondContact O-N 3.33Å; E1658-V1660 VanDerWaalsContact C-N 3.26Å; E1658-V1660 PolarHBondContact O-N 3.44Å; V1660-R1664 WeakPolarHBondContact O-CG 3.48Å
1661	N	56.5	Low	59	Low	78 Å²	78	97.5 Å²	97.5	42%	0.417	52%	0.515	S	S	.	.	H	α-helix	trans	-81.5	-33.5	177.9	-73.3	-17.4	0	0	0	111.9	G1657 E1658 R1664 R1665	G1657-N1661 VanDerWaalsContact O-CB 3.27Å; G1657-N1661 WeakPolarHBondContact O-CB 3.33Å; G1657-N1661 PolarHBondContact O-N 3.41Å; G1657-N1661 PolarHBondContact O-ND2 3.08Å; E1658-N1661 PolarHBondContact O-N 3.45Å; E1658-N1661 VanDerWaalsContact O-N 3.08Å; N1661-R1664 CarbonylContact O-C 3.6Å; N1661-R1664 WeakPolarHBondContact O-CA 3.33Å; N1661-R1664 PolarHBondContact O-N 2.88Å; N1661-R1665 WeakPolarHBondContact O-CG 3.46Å; N1661-R1665 PolarHBondContact O-N 2.68Å
1662	S	51.3	Low	56.3	Low	60 Å²	60	98.6 Å²	98.6	42%	0.42	54%	0.535	S	S	.	.	H	α-helix	trans	-60.8	-49.6	170.8	-57.5	0	0	0	0	110.1	E1658 R1664 R1665 D1666	E1658-S1662 PolarHBondContact O-N 3.09Å; E1658-S1662 PolarHBondContact O-OG 3.25Å; E1658-S1662 VanDerWaalsContact O-OG 3.13Å; S1662-R1664 PolarHBondContact O-N 3.24Å; S1662-R1665 PolarHBondContact O-N 3.12Å; S1662-R1665 VanDerWaalsContact O-N 3.16Å; S1662-D1666 PolarHBondContact O-N 2.94Å
1663	T	50.4	Low	53.7	Low	108 Å²	108	108.4 Å²	108.4	66%	0.663	58%	0.578	S	S	*	*	H	α-helix	trans	-67.7	20.7	170.9	-29.4	0	0	0	0	114.5	I1659	I1659-T1663 PolarHBondContact O-N 3.15Å; I1659-T1663 PolarHBondContact O-OG1 3.45Å
1664	R	47.3	Very low	51.1	Low	180 Å²	180	109.6 Å²	109.6	68%	0.679	60%	0.601	S	S	*	*	H	α-helix	trans	-137.3	-23.7	172.5	-82.2	-175	161	-151.6	-8.8	113.9	V1660 N1661 S1662	V1660-R1664 WeakPolarHBondContact O-CG 3.48Å; N1661-R1664 CarbonylContact O-C 3.6Å; N1661-R1664 WeakPolarHBondContact O-CA 3.33Å; N1661-R1664 PolarHBondContact O-N 2.88Å; S1662-R1664 PolarHBondContact O-N 3.24Å
1665	R	45	Very low	48.4	Very low	186 Å²	186	114.6 Å²	114.6	70%	0.702	61%	0.613	S	S	*	*	H	α-helix	trans	-74.3	-35.4	173.2	-72.7	-175.4	-159.9	154.8	4.1	111.5	N1661 S1662 S1667 F1668	N1661-R1665 WeakPolarHBondContact O-CG 3.46Å; N1661-R1665 PolarHBondContact O-N 2.68Å; S1662-R1665 PolarHBondContact O-N 3.12Å; S1662-R1665 VanDerWaalsContact O-N 3.16Å; R1665-S1667 PolarHBondContact O-N 3.3Å; R1665-F1668 PolarHBondContact O-N 2.73Å
1666	D	39	Very low	45.9	Very low	139 Å²	139	119.9 Å²	119.9	74%	0.743	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.2	31.5	172.5	-50.7	-27.1	0	0	0	112.7	S1662	S1662-D1666 PolarHBondContact O-N 2.94Å
1667	S	40.6	Very low	43.7	Very low	91 Å²	91	125.4 Å²	125.4	64%	0.636	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-160.1	1.9	-173	-58.6	0	0	0	0	115	R1665	R1665-S1667 PolarHBondContact O-N 3.3Å
1668	F	32.2	Very low	41.5	Very low	190 Å²	190	131 Å²	131	83%	0.833	69%	0.688	S	S	*	*			trans	-147.2	29.4	-168.2	-117.5	-79.8	0	0	0	119	R1665	R1665-F1668 PolarHBondContact O-N 2.73Å
1669	E	34.2	Very low	39.5	Very low	201 Å²	201	133.5 Å²	133.5	94%	0.939	69%	0.692	S	S	*	*			trans	-137.4	126.2	158.5	-62.1	-177.8	154.4	0	0	105.6
1670	G	32.4	Very low	37.8	Very low	75 Å²	75	133.1 Å²	133.1	77%	0.773	69%	0.694	S	S	*	*			cis	167.5	-170.4	9.4	0	0	0	0	0	105.5
1671	P	31.6	Very low	36.2	Very low	132 Å²	132	134.5 Å²	134.5	86%	0.857	70%	0.697	S	S	*	*			cis	-116.1	-173.5	-7.6	41.7	-29	0	0	0	112.6
1672	S	29.2	Very low	34.9	Very low	108 Å²	108	136.8 Å²	136.8	76%	0.755	71%	0.705	S	S	*	*			trans	-114.2	141.2	178.9	-46.8	0	0	0	0	112.5
1673	K	30.9	Very low	33.8	Very low	207 Å²	207	140.6 Å²	140.6	90%	0.9	72%	0.72	S	S	*	*			trans	156.6	154.6	138.8	-87.6	160.6	-176.5	-179.8	0	112.1
1674	A	30.1	Very low	33	Very low	99 Å²	99	141.7 Å²	141.7	82%	0.818	73%	0.727	S	S	*	*			trans	58.2	121.3	176.4	0	0	0	0	0	115.7
1675	R	27.3	Very low	32	Very low	217 Å²	217	140.4 Å²	140.4	82%	0.819	73%	0.734	S	S	*	*			cis	93.7	128.3	39.3	-175.9	175.5	172.5	173.3	-1.3	112.3
1676	E	29.5	Very low	31.2	Very low	129 Å²	129	136.6 Å²	136.6	60%	0.603	74%	0.742	S	S	*	*			trans	73.9	119	173.6	-114.3	77.1	-117.8	0	0	119
1677	N	31.7	Very low	30.6	Very low	133 Å²	133	138.1 Å²	138.1	71%	0.711	74%	0.744	S	S	*	*			trans	65.6	106.7	142.9	-63.9	-19.2	0	0	0	124.9
1678	N	29	Very low	29.9	Very low	143 Å²	143	138 Å²	138	77%	0.765	74%	0.74	S	S	*	*				66.1	82.1	125.5	-70.7	-41.6	0	0	0	122.3
1679	R	30.7	Very low	29.7	Very low	171 Å²	171	135.5 Å²	135.5	65%	0.645	74%	0.735	S	S	*	*				53.6	101.1	117.8	-167.2	173.4	-175.3	167.7	3.3	118.2	Q1681 N1715	R1679-Q1681 VanDerWaalsContact NE-OE1 3.09Å; R1679-N1715 PolarHBondContact O-ND2 3.19Å
1680	V	30.2	Very low	29.3	Very low	89 Å²	89	135.3 Å²	135.3	54%	0.539	73%	0.726	S	S	.	*			trans	-116.4	147.5	170.5	-69.8	0	0	0	0	112.7	T1713 Q1714 N1715	V1680-T1713 HydrophobicContact CG1-CG2 4.33Å; V1680-Q1714 HydrophobicContact CB-CB 3.69Å; V1680-Q1714 HydrophobicContact CB-CG 4.27Å; V1680-Q1714 HydrophobicContact CG1-CB 4.1Å; V1680-N1715 VanDerWaalsContact CA-ND2 3.3Å; V1680-N1715 WeakPolarHBondContact CA-ND2 3.41Å
1681	Q	31	Very low	29.1	Very low	88 Å²	88	138 Å²	138	41%	0.411	72%	0.722	S	S	.	*			trans	-159	130.4	177.9	-35.4	162.6	148.7	0	0	107.8	R1679 Q1714 N1715	R1679-Q1681 VanDerWaalsContact NE-OE1 3.09Å; Q1681-Q1714 WeakPolarHBondContact O-CA 3.36Å; Q1681-Q1714 WeakPolarHBondContact O-CB 3.45Å; Q1681-Q1714 WeakPolarHBondContact O-CG 3.28Å; Q1681-N1715 VanDerWaalsContact CB-OD1 3.26Å; Q1681-N1715 WeakPolarHBondContact CB-OD1 3.26Å; Q1681-N1715 WeakPolarHBondContact CG-OD1 3.3Å; Q1681-N1715 VanDerWaalsContact N-CG 3.29Å; Q1681-N1715 PolarHBondContact N-ND2 3.28Å; Q1681-N1715 PolarHBondContact N-OD1 3.3Å; Q1681-N1715 PolarHBondContact NE2-OD1 3.33Å; Q1681-N1715 PolarHBondContact O-OD1 2.97Å
1682	Q	30	Very low	28.9	Very low	127 Å²	127	138 Å²	138	59%	0.593	71%	0.711	S	S	*	*			trans	145.1	120.4	170.4	-158.9	160.2	39.2	0	0	115.9	Q1714	Q1682-Q1714 HydrophobicContact CB-CG 3.94Å; Q1682-Q1714 VanDerWaalsContact N-CG 3.26Å; Q1682-Q1714 VanDerWaalsContact O-CG 3.31Å; Q1682-Q1714 WeakPolarHBondContact O-CG 3.22Å; Q1682-Q1714 PolarHBondContact O-NE2 3.47Å
1683	N	28.6	Very low	28.8	Very low	139 Å²	139	141.1 Å²	141.1	74%	0.743	72%	0.717	S	S	*	*			trans	46.9	97.2	150.4	-59.4	7.1	0	0	0	123.9
1684	T	32.3	Very low	28.6	Very low	131 Å²	131	140.5 Å²	140.5	80%	0.804	71%	0.709	S	S	*	*				-142.3	132.9	113.9	24.2	0	0	0	0	105.7
1685	N	26.3	Very low	28.3	Very low	153 Å²	153	140.2 Å²	140.2	82%	0.818	70%	0.701	S	S	*	*				60.4	134.3	68	-78.9	-7.9	0	0	0	114
1686	A	27.9	Very low	28.2	Very low	106 Å²	106	138.3 Å²	138.3	88%	0.876	70%	0.701	S	S	*	*			trans	63.2	162.5	174.4	0	0	0	0	0	115.8
1687	H	26.7	Very low	28	Very low	171 Å²	171	137.7 Å²	137.7	79%	0.792	71%	0.711	S	S	*	*			cis	-157.7	170.3	-33.8	-175.3	-106.8	0	0	0	107.9
1688	V	26.8	Very low	27.7	Very low	88 Å²	88	140.9 Å²	140.9	53%	0.533	72%	0.719	S	S	.	*			trans	-35.6	135.8	177	-176.6	0	0	0	0	116	R1690	V1688-R1690 HydrophobicContact CG1-CB 4.28Å
1689	D	26.8	Very low	27.6	Very low	139 Å²	139	138.6 Å²	138.6	74%	0.743	71%	0.713	S	S	*	*				-176.6	135.8	125.7	-88.1	-19.7	0	0	0	109
1690	R	27.2	Very low	27.5	Very low	196 Å²	196	138.2 Å²	138.2	74%	0.74	72%	0.719	S	S	*	*			cis	62.3	92.2	14.1	-161.4	-174.3	-173.7	-167.9	1.3	115.7	V1688	V1688-R1690 HydrophobicContact CG1-CB 4.28Å
1691	L	27.6	Very low	27.3	Very low	132 Å²	132	141.8 Å²	141.8	69%	0.691	73%	0.732	S	S	*	*			trans	58.5	104.8	154.5	-59.1	169.2	0	0	0	116.7
1692	Q	27.1	Very low	27.6	Very low	133 Å²	133	141.9 Å²	141.9	62%	0.621	74%	0.74	S	S	*	*			trans	-154.9	103.9	134.3	-134.9	81.1	-95.8	0	0	112	R1694	Q1692-R1694 HydrophobicContact CG-CB 4.07Å; Q1692-R1694 HydrophobicContact CG-CG 4.29Å; Q1692-R1694 VanDerWaalsContact OE1-CG 3.29Å
1693	I	26.7	Very low	27.6	Very low	172 Å²	172	144.5 Å²	144.5	88%	0.882	75%	0.754	S	S	*	*				-119.6	79.8	127.2	-59.8	-176.9	0	0	0	105.4
1694	R	26.3	Very low	27.7	Very low	194 Å²	194	141.5 Å²	141.5	73%	0.732	75%	0.749	S	S	*	*			trans	-86.8	102.8	146.8	-71.9	169.7	82.3	164.2	0.5	104.5	Q1692 E1696	Q1692-R1694 HydrophobicContact CG-CB 4.07Å; Q1692-R1694 HydrophobicContact CG-CG 4.29Å; Q1692-R1694 VanDerWaalsContact OE1-CG 3.29Å; R1694-E1696 VanDerWaalsContact C-N 3.29Å; R1694-E1696 PolarHBondContact O-N 3.05Å
1695	S	25.3	Very low	27.5	Very low	94 Å²	94	142.8 Å²	142.8	66%	0.657	75%	0.751	S	S	*	*			trans	-77.8	94	138.1	52.2	0	0	0	0	104.4
1696	E	24.9	Very low	27.7	Very low	177 Å²	177	140 Å²	140	83%	0.827	75%	0.749	S	S	*	*				71.7	102.4	89.6	-73.9	-177.3	158.4	0	0	110.6	R1694	R1694-E1696 VanDerWaalsContact C-N 3.29Å; R1694-E1696 PolarHBondContact O-N 3.05Å
1697	S	25.9	Very low	27.9	Very low	116 Å²	116	139 Å²	139	81%	0.811	74%	0.741	S	S	*	*			trans	-151.1	84.5	172.2	-66.1	0	0	0	0	107.7
1698	F	25.4	Very low	28.1	Very low	199 Å²	199	137.9 Å²	137.9	87%	0.873	74%	0.74	S	S	*	*			trans	74.1	147.4	160.3	-108.5	-118.7	0	0	0	121.2
1699	C	25.2	Very low	28.1	Very low	95 Å²	95	139 Å²	139	64%	0.642	75%	0.747	S	S	*	*			trans	63.4	134.4	167.7	-60.8	0	0	0	0	119.3
1700	E	28.5	Very low	28.1	Very low	164 Å²	164	137.1 Å²	137.1	77%	0.766	75%	0.745	S	S	*	*			cis	-166.6	116.8	-19.7	-134.4	166.9	129.4	0	0	112.8
1701	M	27.9	Very low	28.2	Very low	164 Å²	164	132.5 Å²	132.5	81%	0.808	74%	0.743	S	S	*	*			trans	56.7	175.2	145.2	-58.6	-63.2	-82.2	0	0	120.2
1702	P	35.4	Very low	28.4	Very low	89 Å²	89	132.7 Å²	132.7	58%	0.578	74%	0.744	S	S	*	*				-137.8	-173.4	-73.4	43	-26.6	0	0	0	115.4
1703	M	30.4	Very low	28.6	Very low	182 Å²	182	130 Å²	130	90%	0.897	74%	0.736	S	S	*	*			trans	71.8	147.3	163.5	-56.6	-70.9	179.9	0	0	117.2
1704	A	32.1	Very low	28.7	Very low	77 Å²	77	125.6 Å²	125.6	64%	0.636	71%	0.712	S	S	*	*			cis	-159.7	166.8	-16.1	0	0	0	0	0	111.4
1705	D	28	Very low	28.9	Very low	157 Å²	157	119 Å²	119	84%	0.84	69%	0.691	S	S	*	*			trans	53.7	113.7	151.7	-68.7	-22.5	0	0	0	123.9
1706	A	30.1	Very low	29.1	Very low	96 Å²	96	118.6 Å²	118.6	79%	0.793	68%	0.681	S	S	*	*				88.6	159.5	118.4	0	0	0	0	0	122.7
1707	A	31.4	Very low	29.3	Very low	84 Å²	84	117.2 Å²	117.2	69%	0.694	68%	0.678	S	S	*	*			trans	79.7	116.2	158.1	0	0	0	0	0	120.9
1708	L	30.1	Very low	29.7	Very low	147 Å²	147	116.5 Å²	116.5	77%	0.77	67%	0.671	S	S	*	*			trans	61	92.4	130.7	-58.2	177.2	0	0	0	117.6
1709	T	27.3	Very low	29.8	Very low	111 Å²	111	116.8 Å²	116.8	68%	0.681	67%	0.667	S	S	*	*				69.5	138.5	85.2	62.9	0	0	0	0	116.1
1710	S	27.4	Very low	29.8	Very low	101 Å²	101	119.6 Å²	119.6	71%	0.706	67%	0.674	S	S	*	*			trans	69.9	111.1	144.5	-67	0	0	0	0	117.2
1711	S	28.7	Very low	30	Very low	99 Å²	99	122 Å²	122	69%	0.692	68%	0.678	S	S	*	*				100	169.3	88	-71.8	0	0	0	0	111.5
1712	L	32	Very low	30.5	Very low	136 Å²	136	119.8 Å²	119.8	71%	0.712	68%	0.676	S	S	*	*			cis	-138.5	126.9	-12.8	-139.5	61.4	0	0	0	104.9
1713	T	31.2	Very low	30.2	Very low	75 Å²	75	120.3 Å²	120.3	46%	0.46	69%	0.688	S	S	.	*				58.3	125.2	117.6	70	0	0	0	0	117.7	V1680	V1680-T1713 HydrophobicContact CG1-CG2 4.33Å
1714	Q	28.9	Very low	30	Very low	81 Å²	81	115 Å²	115	38%	0.379	68%	0.679	S	S	.	*				60.7	130.3	64.6	-57.3	127.8	32.2	0	0	111.3	V1680 Q1681 Q1682	V1680-Q1714 HydrophobicContact CB-CB 3.69Å; V1680-Q1714 HydrophobicContact CB-CG 4.27Å; V1680-Q1714 HydrophobicContact CG1-CB 4.1Å; Q1681-Q1714 WeakPolarHBondContact O-CA 3.36Å; Q1681-Q1714 WeakPolarHBondContact O-CB 3.45Å; Q1681-Q1714 WeakPolarHBondContact O-CG 3.28Å; Q1682-Q1714 HydrophobicContact CB-CG 3.94Å; Q1682-Q1714 VanDerWaalsContact N-CG 3.26Å; Q1682-Q1714 VanDerWaalsContact O-CG 3.31Å; Q1682-Q1714 WeakPolarHBondContact O-CG 3.22Å; Q1682-Q1714 PolarHBondContact O-NE2 3.47Å
1715	N	30.1	Very low	30	Very low	55 Å²	55	118.4 Å²	118.4	29%	0.294	69%	0.692	S	S	.	*			cis	-159.1	-165.2	28.8	-157.8	1.9	0	0	0	108	R1679 V1680 Q1681	R1679-N1715 PolarHBondContact O-ND2 3.19Å; V1680-N1715 VanDerWaalsContact CA-ND2 3.3Å; V1680-N1715 WeakPolarHBondContact CA-ND2 3.41Å; Q1681-N1715 VanDerWaalsContact CB-OD1 3.26Å; Q1681-N1715 WeakPolarHBondContact CB-OD1 3.26Å; Q1681-N1715 WeakPolarHBondContact CG-OD1 3.3Å; Q1681-N1715 VanDerWaalsContact N-CG 3.29Å; Q1681-N1715 PolarHBondContact N-ND2 3.28Å; Q1681-N1715 PolarHBondContact N-OD1 3.3Å; Q1681-N1715 PolarHBondContact NE2-OD1 3.33Å; Q1681-N1715 PolarHBondContact O-OD1 2.97Å
1716	L	30.5	Very low	30.2	Very low	85 Å²	85	119.1 Å²	119.1	45%	0.445	69%	0.692	S	S	.	*			cis	-165.7	-171	7.3	-149.8	169.5	0	0	0	108.6
1717	I	29.4	Very low	30.6	Very low	149 Å²	149	119.6 Å²	119.6	76%	0.764	69%	0.687	S	S	*	*			trans	60.9	177.7	168.1	15.2	82.4	0	0	0	118.8
1718	P	34.1	Very low	30.6	Very low	101 Å²	101	122.2 Å²	122.2	66%	0.656	69%	0.694	S	S	*	*			trans	-118.6	-158.1	-153.6	40.7	-20.4	0	0	0	114.1
1719	Y	26.3	Very low	30.7	Very low	204 Å²	204	118.4 Å²	118.4	80%	0.8	68%	0.684	S	S	*	*			trans	90.7	138.3	169.8	-71.7	-82.4	0	0	0	119.7
1720	I	26.1	Very low	31.1	Very low	154 Å²	154	122.9 Å²	122.9	79%	0.79	69%	0.69	S	S	*	*			trans	73.9	117.5	139.9	-70.1	164.5	0	0	0	120.4
1721	Y	33.6	Very low	31.3	Very low	216 Å²	216	127.6 Å²	127.6	85%	0.847	69%	0.694	S	S	*	*			trans	-56.2	155	157	-94.7	-99.1	0	0	0	111.7
1722	P	37.1	Very low	31.4	Very low	117 Å²	117	127.4 Å²	127.4	76%	0.76	69%	0.692	S	S	*	*				-158	179.8	63.5	42.6	-20.6	0	0	0	119.4
1723	A	28.7	Very low	31.6	Very low	100 Å²	100	124.7 Å²	124.7	83%	0.826	70%	0.697	S	S	*	*			trans	10.6	143.7	151.3	0	0	0	0	0	123
1724	G	27.8	Very low	32	Very low	69 Å²	69	129.1 Å²	129.1	71%	0.711	72%	0.717	S	S	*	*			trans	166	96.5	150.9	0	0	0	0	0	119.5
1725	V	30.8	Very low	32.3	Very low	149 Å²	149	131 Å²	131	90%	0.903	74%	0.736	S	S	*	*			trans	65.5	147.8	142.9	-148.9	0	0	0	0	121.4
1726	M	33.6	Very low	32.8	Very low	172 Å²	172	132.2 Å²	132.2	85%	0.847	75%	0.754	S	S	*	*			trans	-81.5	-163	169.6	-68.1	-84.3	-177.6	0	0	110
1727	P	38.4	Very low	33.4	Very low	106 Å²	106	133.2 Å²	133.2	69%	0.688	77%	0.766	S	S	*	*			cis	-148.8	-175.4	6.9	45.5	-24.4	0	0	0	118.4
1728	V	30.3	Very low	33.7	Very low	139 Å²	139	134 Å²	134	84%	0.842	77%	0.768	S	S	*	*			trans	55	132.5	136.3	158.2	0	0	0	0	118.9
1729	A	32.9	Very low	33.8	Very low	68 Å²	68	133.8 Å²	133.8	56%	0.562	77%	0.765	S	S	*	*				-175.7	168.8	64.2	0	0	0	0	0	116
1730	Y	34.3	Very low	34.1	Very low	205 Å²	205	133.9 Å²	133.9	80%	0.804	77%	0.765	S	S	*	*			trans	58	131.6	159.4	-63.6	-72	0	0	0	119.8
1731	Y	32	Very low	34.4	Very low	200 Å²	200	130.7 Å²	130.7	78%	0.784	76%	0.757	S	S	*	*			cis	-151.7	-143.2	-16.1	-149.3	-135.7	0	0	0	113.9
1732	S	31.5	Very low	34.3	Very low	94 Å²	94	126.5 Å²	126.5	66%	0.657	75%	0.749	S	S	*	*			trans	-146.9	157.4	-136.1	-51.9	0	0	0	0	115.9
1733	G	35	Very low	34	Very low	80 Å²	80	127.4 Å²	127.4	83%	0.825	75%	0.747	S	S	*	*			trans	-164.5	115.5	171	0	0	0	0	0	112.8
1734	L	39.6	Very low	34.1	Very low	168 Å²	168	132 Å²	132	88%	0.88	75%	0.749	S	S	*	*			trans	-106.6	176.9	-179.7	-87.5	162.4	0	0	0	109.9
1735	P	36.6	Very low	34.4	Very low	120 Å²	120	132.1 Å²	132.1	78%	0.779	74%	0.743	S	S	*	*			cis	-141.5	179.1	20	43.8	-24.5	0	0	0	118.4
1736	A	40.9	Very low	34.4	Very low	80 Å²	80	128 Å²	128	66%	0.661	73%	0.731	S	S	*	*			trans	-102	-162.5	159.1	0	0	0	0	0	110
1737	P	42.5	Very low	34.4	Very low	106 Å²	106	129.2 Å²	129.2	69%	0.688	73%	0.732	S	S	*	*				-162.3	-174.4	77.4	44.6	-23.4	0	0	0	118.7
1738	M	36	Very low	34.3	Very low	167 Å²	167	129.7 Å²	129.7	82%	0.823	74%	0.735	S	S	*	*			trans	69.5	164.7	158.9	-66	-161.4	-67.8	0	0	117.7
1739	V	36.1	Very low	34.4	Very low	96 Å²	96	128.8 Å²	128.8	58%	0.582	73%	0.734	S	S	*	*			cis	-152.3	170.1	-43.6	-84.8	0	0	0	0	106.1
1740	Y	33.2	Very low	34.2	Very low	205 Å²	205	130.4 Å²	130.4	80%	0.804	75%	0.748	S	S	*	*			cis	-127.2	169.4	5.7	-69.1	-80.4	0	0	0	108.5
1741	S	31.6	Very low	34.1	Very low	88 Å²	88	124.2 Å²	124.2	62%	0.615	75%	0.746	S	S	*	*			cis	83.7	131.2	25.3	-67.4	0	0	0	0	116.7
1742	N	30.6	Very low	34	Very low	127 Å²	127	122.4 Å²	122.4	68%	0.679	75%	0.75	S	S	*	*			cis	-154.4	152.6	-6.3	-97.8	-4.7	0	0	0	108.5
1743	N	32.2	Very low	34.3	Very low	137 Å²	137	125.2 Å²	125.2	73%	0.733	76%	0.757	S	S	*	*			cis	-120.4	-82.9	-13	-93.9	-55.8	0	0	0	109.9
1744	F	30.3	Very low	34.6	Very low	196 Å²	196	129.4 Å²	129.4	86%	0.86	76%	0.76	S	S	*	*			cis	-167.7	137.7	-23.7	-170.9	-93.2	0	0	0	107.3
1745	A	33.6	Very low	34.9	Very low	72 Å²	72	127.1 Å²	127.1	60%	0.595	74%	0.74	S	S	*	*			cis	-161.4	176.9	-23.9	0	0	0	0	0	108.2
1746	G	32	Very low	35.7	Very low	62 Å²	62	124.5 Å²	124.5	64%	0.639	72%	0.72	S	S	*	*			trans	79.6	60.2	169.5	0	0	0	0	0	116.2
1747	F	33	Very low	36.7	Very low	198 Å²	198	123 Å²	123	87%	0.868	70%	0.703	S	S	*	*				78.5	144.5	90.1	-83.8	-79.9	0	0	0	115.3
1748	P	35.7	Very low	37.7	Very low	116 Å²	116	121.5 Å²	121.5	75%	0.753	69%	0.689	S	S	*	*				-135.6	178.6	-92.8	45.1	-31.4	0	0	0	118.1
1749	S	32.5	Very low	39	Very low	119 Å²	119	116.5 Å²	116.5	83%	0.832	67%	0.665	S	S	*	*			trans	-33	132.7	168.2	162.8	0	0	0	0	120
1750	A	29.3	Very low	40.4	Very low	103 Å²	103	114.7 Å²	114.7	85%	0.851	65%	0.653	S	S	*	*				-169	144.6	120.9	0	0	0	0	0	111.4
1751	G	31.3	Very low	42.5	Very low	74 Å²	74	105 Å²	105	76%	0.763	62%	0.615	S	S	*	*			trans	141.8	16.1	165.5	0	0	0	0	0	121.1	L1753	G1751-L1753 PolarHBondContact O-N 2.88Å; G1751-L1753 VanDerWaalsContact O-N 3.08Å
1752	N	31.5	Very low	44.9	Very low	163 Å²	163	102.7 Å²	102.7	87%	0.872	60%	0.597	S	S	*	*			trans	-80.3	89.6	-174	-83.9	-12.4	0	0	0	115.2
1753	L	36	Very low	47.5	Very low	153 Å²	153	98.8 Å²	98.8	80%	0.801	58%	0.579	S	S	*	*	S	Bend	trans	-136.3	126.4	155.6	-71.1	176	0	0	0	110.3	G1751	G1751-L1753 PolarHBondContact O-N 2.88Å; G1751-L1753 VanDerWaalsContact O-N 3.08Å
1754	L	41.9	Very low	50	Low	167 Å²	167	92.3 Å²	92.3	87%	0.874	54%	0.544	S	S	*	.			trans	63.8	57.3	173.5	-57.7	175.7	0	0	0	117.8
1755	Y	46.9	Very low	52.3	Low	121 Å²	121	86.5 Å²	86.5	48%	0.475	53%	0.528	S	S	.	.			trans	-98.5	120.6	153.9	173.7	-101.9	0	0	0	109.2	P1757 N1760 G1761	Y1755-P1757 HydrophobicContact CD1-CG 4.08Å; Y1755-P1757 HydrophobicContact CE1-CB 4.26Å; Y1755-P1757 HydrophobicContact CE1-CG 3.87Å; Y1755-P1757 WeakPolarHBondContact O-CD 3.48Å; Y1755-N1760 HydrophobicContact CD2-CB 4.46Å; Y1755-N1760 HydrophobicContact CE2-CB 3.96Å; Y1755-G1761 PolarHBondContact OH-O 2.95Å
1756	D	53	Low	54.6	Low	65 Å²	65	87.7 Å²	87.7	35%	0.348	53%	0.528	S	S	.	.			trans	-102.5	107.8	172.9	-173.9	-8.3	0	0	0	110.3	N1758 I1759 N1760	D1756-N1758 PolarHBondContact O-N 2.87Å; D1756-N1758 VanDerWaalsContact O-N 3.14Å; D1756-N1758 VanDerWaalsContact OD1-CB 3.29Å; D1756-N1758 WeakPolarHBondContact OD1-CB 3.41Å; D1756-N1758 PolarHBondContact OD1-N 2.88Å; D1756-N1758 PolarHBondContact OD1-ND2 3.35Å; D1756-I1759 HydrophobicContact CB-CD1 4.4Å; D1756-I1759 HydrophobicContact CB-CG1 4.46Å; D1756-I1759 PolarHBondContact O-N 2.79Å; D1756-I1759 WeakPolarHBondContact OD2-CD1 3.37Å; D1756-N1760 PolarHBondContact O-N 3.48Å
1757	P	62.1	Low	56.8	Low	48 Å²	48	86.6 Å²	86.6	31%	0.312	51%	0.507	S	S	.	.	H	α-helix	trans	-59.6	-24.5	179.4	-21.9	32.5	0	0	0	113.7	Y1755 I1759 G1761	Y1755-P1757 HydrophobicContact CD1-CG 4.08Å; Y1755-P1757 HydrophobicContact CE1-CB 4.26Å; Y1755-P1757 HydrophobicContact CE1-CG 3.87Å; Y1755-P1757 WeakPolarHBondContact O-CD 3.48Å; P1757-I1759 VanDerWaalsContact C-N 3.32Å; P1757-I1759 PolarHBondContact O-N 2.72Å; P1757-G1761 WeakPolarHBondContact O-CA 3.48Å; P1757-G1761 PolarHBondContact O-N 2.9Å; P1757-G1761 VanDerWaalsContact O-N 3.14Å
1758	N	63.6	Low	59	Low	74 Å²	74	86.6 Å²	86.6	40%	0.396	51%	0.51	S	S	.	.	H	α-helix	trans	-76.2	-20	-175.6	-57	-81.8	0	0	0	113.3	D1756 Q1836	D1756-N1758 PolarHBondContact O-N 2.87Å; D1756-N1758 VanDerWaalsContact O-N 3.14Å; D1756-N1758 VanDerWaalsContact OD1-CB 3.29Å; D1756-N1758 WeakPolarHBondContact OD1-CB 3.41Å; D1756-N1758 PolarHBondContact OD1-N 2.88Å; D1756-N1758 PolarHBondContact OD1-ND2 3.35Å; N1758-Q1836 WeakPolarHBondContact O-CG 3.43Å; N1758-Q1836 PolarHBondContact OD1-NE2 2.84Å
1759	I	62.9	Low	61.1	Low	62 Å²	62	82.5 Å²	82.5	32%	0.318	48%	0.481	S	S	.	.	H	α-helix	trans	-107.5	-43.1	-177.2	-57.3	177.5	0	0	0	110.5	D1756 P1757 F1844	D1756-I1759 HydrophobicContact CB-CD1 4.4Å; D1756-I1759 HydrophobicContact CB-CG1 4.46Å; D1756-I1759 PolarHBondContact O-N 2.79Å; D1756-I1759 WeakPolarHBondContact OD2-CD1 3.37Å; P1757-I1759 VanDerWaalsContact C-N 3.32Å; P1757-I1759 PolarHBondContact O-N 2.72Å; I1759-F1844 HydrophobicContact CG2-CE2 3.58Å; I1759-F1844 HydrophobicContact CG2-CZ 3.89Å
1760	N	65.8	Low	63.3	Low	59 Å²	59	79 Å²	79	32%	0.316	46%	0.456	S	S	.	.	H	α-helix	trans	-89.4	-26.3	-174.2	-69.8	29.1	0	0	0	113	Y1755 D1756 T1829	Y1755-N1760 HydrophobicContact CD2-CB 4.46Å; Y1755-N1760 HydrophobicContact CE2-CB 3.96Å; D1756-N1760 PolarHBondContact O-N 3.48Å; N1760-T1829 WeakPolarHBondContact O-CG2 3.39Å
1761	G	75.7	Confident	65.7	Low	2 Å²	2	80.8 Å²	80.8	2%	0.021	45%	0.446	C	S	.	.			trans	72.7	154.9	-173.3	0	0	0	0	0	113.1	Y1755 P1757 V1830 F1831	Y1755-G1761 PolarHBondContact OH-O 2.95Å; P1757-G1761 WeakPolarHBondContact O-CA 3.48Å; P1757-G1761 PolarHBondContact O-N 2.9Å; P1757-G1761 VanDerWaalsContact O-N 3.14Å; G1761-V1830 CarbonylContact C-O 3.56Å; G1761-V1830 VanDerWaalsContact CA-O 3.23Å; G1761-V1830 WeakPolarHBondContact CA-O 3.31Å; G1761-F1831 VanDerWaalsContact CA-CE1 3.48Å
1762	T	83.9	Confident	68.1	Low	39 Å²	39	80 Å²	80	24%	0.239	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	120.3	176	-55.7	0	0	0	0	109.3	V1766 L1767 V1830	T1762-V1766 HydrophobicContact CG2-CB 4Å; T1762-V1766 HydrophobicContact CG2-CG1 3.91Å; T1762-L1767 HydrophobicContact CG2-CD2 4.12Å; T1762-V1830 PolarHBondContact N-O 3.1Å; T1762-V1830 WeakPolarHBondContact O-CA 3.28Å; T1762-V1830 WeakPolarHBondContact O-CB 3.43Å; T1762-V1830 WeakPolarHBondContact O-CG2 3.14Å; T1762-V1830 PolarHBondContact O-N 3.4Å
1763	P	84.3	Confident	70.6	Confident	44 Å²	44	72.3 Å²	72.3	29%	0.286	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	146.5	178	27.5	-34	0	0	0	111	S1765 V1766 V1828	P1763-S1765 PolarHBondContact O-N 2.85Å; P1763-V1766 HydrophobicContact CG-CB 4.13Å; P1763-V1766 HydrophobicContact CG-CG2 3.77Å; P1763-V1766 PolarHBondContact O-N 3.23Å; P1763-V1828 WeakPolarHBondContact CA-O 3.37Å
1764	V	83.8	Confident	73	Confident	2 Å²	2	68.3 Å²	68.3	1%	0.012	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-25.2	-176.2	172.4	0	0	0	0	113	V1766 R1774 I1777 I1778 L1781 V1828 V1830	V1764-V1766 VanDerWaalsContact C-N 3.33Å; V1764-V1766 PolarHBondContact O-N 3.29Å; V1764-R1774 HydrophobicContact CG1-CG 3.92Å; V1764-R1774 PolarHBondContact O-NE 3.1Å; V1764-I1777 HydrophobicContact CG1-CG2 4Å; V1764-I1777 HydrophobicContact CG2-CG2 4.33Å; V1764-I1778 HydrophobicContact CG1-CD1 4.46Å; V1764-I1778 HydrophobicContact CG1-CG1 4.16Å; V1764-L1781 HydrophobicContact CG2-CD1 4.26Å; V1764-V1828 HydrophobicContact CB-CG1 4.05Å; V1764-V1828 HydrophobicContact CG2-CG1 3.97Å; V1764-V1828 PolarHBondContact N-O 3.15Å; V1764-V1828 VanDerWaalsContact N-O 3.1Å; V1764-V1830 HydrophobicContact CG2-CG2 3.6Å
1765	S	80.2	Confident	75.1	Confident	74 Å²	74	66 Å²	66	52%	0.517	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-25.1	173.7	52.2	0	0	0	0	114.9	P1763 R1774	P1763-S1765 PolarHBondContact O-N 2.85Å; S1765-R1774 PolarHBondContact O-NH2 3.18Å
1766	V	81.4	Confident	76.9	Confident	97 Å²	97	65.5 Å²	65.5	59%	0.588	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.7	-9.1	-177.7	173.2	0	0	0	0	112.1	T1762 P1763 V1764 Q1768	T1762-V1766 HydrophobicContact CG2-CB 4Å; T1762-V1766 HydrophobicContact CG2-CG1 3.91Å; P1763-V1766 HydrophobicContact CG-CB 4.13Å; P1763-V1766 HydrophobicContact CG-CG2 3.77Å; P1763-V1766 PolarHBondContact O-N 3.23Å; V1764-V1766 VanDerWaalsContact C-N 3.33Å; V1764-V1766 PolarHBondContact O-N 3.29Å; V1766-Q1768 PolarHBondContact O-N 3.41Å
1767	L	78.3	Confident	78.5	Confident	39 Å²	39	62.5 Å²	62.5	20%	0.204	33%	0.328	C	S	.	.	S	Bend	trans	-63.9	134.6	173.5	-64	-179.4	0	0	0	111.7	T1762 I1769 R1774 V1830 L1854	T1762-L1767 HydrophobicContact CG2-CD2 4.12Å; L1767-I1769 HydrophobicContact CB-CD1 3.95Å; L1767-I1769 HydrophobicContact CB-CG1 3.83Å; L1767-I1769 HydrophobicContact CB-CG2 4.48Å; L1767-I1769 HydrophobicContact CD1-CD1 4.09Å; L1767-I1769 PolarHBondContact O-N 2.92Å; L1767-R1774 PolarHBondContact O-NH2 2.87Å; L1767-R1774 VanDerWaalsContact O-NH2 3.09Å; L1767-V1830 HydrophobicContact CD1-CG2 4.14Å; L1767-L1854 HydrophobicContact CD1-CD1 4.49Å
1768	Q	79.2	Confident	79.6	Confident	198 Å²	198	63.3 Å²	63.3	93%	0.925	33%	0.329	S	S	*	.	S	Bend	trans	-78	66.9	174.7	-64.7	-177.9	-2.6	0	0	110.8	V1766	V1766-Q1768 PolarHBondContact O-N 3.41Å
1769	I	78.6	Confident	80.7	Confident	30 Å²	30	62.6 Å²	62.6	15%	0.154	33%	0.333	C	S	.	.	S	Bend	trans	-129.8	153.1	179.2	55.2	175.7	0	0	0	109.9	L1767 V1773 R1774 I1777 F1791	L1767-I1769 HydrophobicContact CB-CD1 3.95Å; L1767-I1769 HydrophobicContact CB-CG1 3.83Å; L1767-I1769 HydrophobicContact CB-CG2 4.48Å; L1767-I1769 HydrophobicContact CD1-CD1 4.09Å; L1767-I1769 PolarHBondContact O-N 2.92Å; I1769-V1773 HydrophobicContact CB-CB 4.4Å; I1769-V1773 HydrophobicContact CB-CG1 4.31Å; I1769-V1773 HydrophobicContact CD1-CG1 4.19Å; I1769-R1774 HydrophobicContact CD1-CB 4.02Å; I1769-R1774 HydrophobicContact CG1-CB 4.29Å; I1769-I1777 HydrophobicContact CD1-CD1 3.75Å; I1769-F1791 HydrophobicContact CG2-CE2 4.37Å
1770	P	79.8	Confident	81.8	Confident	46 Å²	46	60.6 Å²	60.6	30%	0.299	33%	0.326	S	S	.	.			trans	-56.5	149.1	174.5	-23.7	33.1	0	0	0	112.5	S1772 V1773 R1774 Q1793	P1770-S1772 VanDerWaalsContact C-N 3.3Å; P1770-S1772 PolarHBondContact O-N 2.99Å; P1770-V1773 HydrophobicContact CB-CB 4.48Å; P1770-V1773 HydrophobicContact CB-CG2 4.12Å; P1770-V1773 HydrophobicContact CG-CG2 4.09Å; P1770-V1773 WeakPolarHBondContact O-CA 3.48Å; P1770-V1773 WeakPolarHBondContact O-CB 3.41Å; P1770-V1773 PolarHBondContact O-N 2.98Å; P1770-R1774 PolarHBondContact O-N 3.04Å; P1770-Q1793 WeakPolarHBondContact CD-O 3.48Å; P1770-Q1793 VanDerWaalsContact CG-O 3.28Å; P1770-Q1793 WeakPolarHBondContact CG-O 3.41Å
1771	Q	80.3	Confident	82.8	Confident	140 Å²	140	58.5 Å²	58.5	65%	0.654	32%	0.315	S	S	*	.	H	α-helix	trans	-55.3	-44.5	178.1	-73.6	173.7	-24.3	0	0	111.7	V1773 R1774 E1775	Q1771-V1773 PolarHBondContact O-N 3.22Å; Q1771-V1773 VanDerWaalsContact O-N 3.14Å; Q1771-R1774 WeakPolarHBondContact O-CA 3.37Å; Q1771-R1774 WeakPolarHBondContact O-CB 3.29Å; Q1771-R1774 PolarHBondContact O-N 3.12Å; Q1771-E1775 WeakPolarHBondContact O-CG 3.49Å; Q1771-E1775 PolarHBondContact O-N 3.08Å
1772	S	81.2	Confident	83.2	Confident	58 Å²	58	66.7 Å²	66.7	41%	0.406	35%	0.35	S	S	.	.	H	α-helix	trans	-65.1	-15.4	175.8	67.7	0	0	0	0	114.9	P1770 R1776	P1770-S1772 VanDerWaalsContact C-N 3.3Å; P1770-S1772 PolarHBondContact O-N 2.99Å; S1772-R1776 PolarHBondContact O-NE 3.32Å; S1772-R1776 PolarHBondContact O-NH2 3.06Å; S1772-R1776 VanDerWaalsContact O-NH2 3.15Å
1773	V	84.1	Confident	83.2	Confident	1 Å²	1	68.1 Å²	68.1	1%	0.006	36%	0.356	C	S	.	.	H	α-helix	trans	-87.9	-42.4	169.9	177.3	0	0	0	0	109.9	I1769 P1770 Q1771 E1775 R1776 I1777 F1791 G1795	I1769-V1773 HydrophobicContact CB-CB 4.4Å; I1769-V1773 HydrophobicContact CB-CG1 4.31Å; I1769-V1773 HydrophobicContact CD1-CG1 4.19Å; P1770-V1773 HydrophobicContact CB-CB 4.48Å; P1770-V1773 HydrophobicContact CB-CG2 4.12Å; P1770-V1773 HydrophobicContact CG-CG2 4.09Å; P1770-V1773 WeakPolarHBondContact O-CA 3.48Å; P1770-V1773 WeakPolarHBondContact O-CB 3.41Å; P1770-V1773 PolarHBondContact O-N 2.98Å; Q1771-V1773 PolarHBondContact O-N 3.22Å; Q1771-V1773 VanDerWaalsContact O-N 3.14Å; V1773-E1775 VanDerWaalsContact C-N 3.33Å; V1773-E1775 PolarHBondContact O-N 2.84Å; V1773-R1776 PolarHBondContact O-N 3.49Å; V1773-I1777 HydrophobicContact CG1-CD1 4.03Å; V1773-I1777 WeakPolarHBondContact O-CG1 3.4Å; V1773-I1777 PolarHBondContact O-N 3.2Å; V1773-F1791 HydrophobicContact CG1-CB 3.64Å; V1773-F1791 HydrophobicContact CG1-CD2 3.68Å; V1773-F1791 HydrophobicContact CG1-CE2 4.47Å; V1773-F1791 HydrophobicContact CG1-CG 3.7Å; V1773-G1795 VanDerWaalsContact CG2-CA 3.48Å
1774	R	86.7	Confident	82.7	Confident	68 Å²	68	69.8 Å²	69.8	26%	0.257	37%	0.369	S	S	.	.	H	α-helix	trans	-57.1	-44.8	174.7	-170.4	-176	-70.1	162.7	0.9	111.8	V1764 S1765 L1767 I1769 P1770 Q1771 I1777 I1778	V1764-R1774 HydrophobicContact CG1-CG 3.92Å; V1764-R1774 PolarHBondContact O-NE 3.1Å; S1765-R1774 PolarHBondContact O-NH2 3.18Å; L1767-R1774 PolarHBondContact O-NH2 2.87Å; L1767-R1774 VanDerWaalsContact O-NH2 3.09Å; I1769-R1774 HydrophobicContact CD1-CB 4.02Å; I1769-R1774 HydrophobicContact CG1-CB 4.29Å; P1770-R1774 PolarHBondContact O-N 3.04Å; Q1771-R1774 WeakPolarHBondContact O-CA 3.37Å; Q1771-R1774 WeakPolarHBondContact O-CB 3.29Å; Q1771-R1774 PolarHBondContact O-N 3.12Å; R1774-I1777 PolarHBondContact O-N 2.9Å; R1774-I1778 HydrophobicContact CG-CD1 4.05Å; R1774-I1778 VanDerWaalsContact O-CG1 3.31Å; R1774-I1778 WeakPolarHBondContact O-CG1 3.45Å; R1774-I1778 PolarHBondContact O-N 3.29Å
1775	E	85.1	Confident	82.6	Confident	118 Å²	118	78.1 Å²	78.1	55%	0.551	41%	0.405	S	S	*	.	H	α-helix	trans	-62	-44.7	176.6	-74.2	155.6	-167.3	0	0	112.2	Q1771 V1773 I1777 I1778 A1779	Q1771-E1775 WeakPolarHBondContact O-CG 3.49Å; Q1771-E1775 PolarHBondContact O-N 3.08Å; V1773-E1775 VanDerWaalsContact C-N 3.33Å; V1773-E1775 PolarHBondContact O-N 2.84Å; E1775-I1777 PolarHBondContact O-N 2.91Å; E1775-I1778 PolarHBondContact O-N 3.04Å; E1775-A1779 WeakPolarHBondContact O-CB 3.38Å; E1775-A1779 PolarHBondContact O-N 3.38Å
1776	R	83.9	Confident	82.7	Confident	111 Å²	111	76.6 Å²	76.6	42%	0.419	39%	0.393	S	S	.	.	H	α-helix	trans	-64.4	-38	174.9	-84.7	177.5	-71.9	178	-7.8	112.9	S1772 V1773 A1779 A1780 G1795	S1772-R1776 PolarHBondContact O-NE 3.32Å; S1772-R1776 PolarHBondContact O-NH2 3.06Å; S1772-R1776 VanDerWaalsContact O-NH2 3.15Å; V1773-R1776 PolarHBondContact O-N 3.49Å; R1776-A1779 PolarHBondContact O-N 2.89Å; R1776-A1780 WeakPolarHBondContact O-CB 3.1Å; R1776-A1780 PolarHBondContact O-N 3.36Å; R1776-G1795 VanDerWaalsContact CZ-O 3.29Å; R1776-G1795 PolarHBondContact NH1-O 3.43Å; R1776-G1795 PolarHBondContact NH2-O 3Å
1777	I	86.7	Confident	82.8	Confident	2 Å²	2	77 Å²	77	1%	0.01	39%	0.387	C	S	.	.	H	α-helix	trans	-64.6	-43.3	173.8	-69.4	169.5	0	0	0	110.2	V1764 I1769 V1773 R1774 E1775 A1780 L1781 A1789 F1791 L1854	V1764-I1777 HydrophobicContact CG1-CG2 4Å; V1764-I1777 HydrophobicContact CG2-CG2 4.33Å; I1769-I1777 HydrophobicContact CD1-CD1 3.75Å; V1773-I1777 HydrophobicContact CG1-CD1 4.03Å; V1773-I1777 WeakPolarHBondContact O-CG1 3.4Å; V1773-I1777 PolarHBondContact O-N 3.2Å; R1774-I1777 PolarHBondContact O-N 2.9Å; E1775-I1777 PolarHBondContact O-N 2.91Å; I1777-A1780 PolarHBondContact O-N 3.32Å; I1777-L1781 HydrophobicContact CG2-CD1 3.86Å; I1777-L1781 HydrophobicContact CG2-CG 4.42Å; I1777-L1781 WeakPolarHBondContact O-CB 3.24Å; I1777-L1781 WeakPolarHBondContact O-CG 3.46Å; I1777-L1781 PolarHBondContact O-N 3.44Å; I1777-A1789 HydrophobicContact CG1-CB 4.23Å; I1777-F1791 HydrophobicContact CD1-CD1 3.91Å; I1777-F1791 HydrophobicContact CD1-CE1 3.87Å; I1777-F1791 HydrophobicContact CD1-CG 4.45Å; I1777-F1791 HydrophobicContact CD1-CZ 4.37Å; I1777-F1791 HydrophobicContact CG1-CD1 4.32Å; I1777-L1854 HydrophobicContact CD1-CD2 4.33Å; I1777-L1854 HydrophobicContact CG1-CD2 4.32Å; I1777-L1854 HydrophobicContact CG2-CD2 3.85Å
1778	I	86.9	Confident	83.3	Confident	65 Å²	65	77.9 Å²	77.9	33%	0.333	39%	0.394	S	S	.	.	H	α-helix	trans	-66.7	-37.8	177	-68.9	166.5	0	0	0	111.7	V1764 R1774 E1775 L1781 K1782	V1764-I1778 HydrophobicContact CG1-CD1 4.46Å; V1764-I1778 HydrophobicContact CG1-CG1 4.16Å; R1774-I1778 HydrophobicContact CG-CD1 4.05Å; R1774-I1778 VanDerWaalsContact O-CG1 3.31Å; R1774-I1778 WeakPolarHBondContact O-CG1 3.45Å; R1774-I1778 PolarHBondContact O-N 3.29Å; E1775-I1778 PolarHBondContact O-N 3.04Å; I1778-L1781 PolarHBondContact O-N 3.42Å; I1778-K1782 WeakPolarHBondContact O-CG 3.13Å; I1778-K1782 PolarHBondContact O-N 3.15Å
1779	A	86.5	Confident	83.7	Confident	59 Å²	59	68.9 Å²	68.9	49%	0.488	35%	0.353	S	S	.	.	H	α-helix	trans	-65.4	-46.4	175.3	0	0	0	0	0	111.6	E1775 R1776 L1781 K1782 D1783	E1775-A1779 WeakPolarHBondContact O-CB 3.38Å; E1775-A1779 PolarHBondContact O-N 3.38Å; R1776-A1779 PolarHBondContact O-N 2.89Å; A1779-L1781 PolarHBondContact O-N 3Å; A1779-K1782 WeakPolarHBondContact O-CB 3.33Å; A1779-K1782 PolarHBondContact O-N 3.13Å; A1779-K1782 VanDerWaalsContact O-N 3.1Å; A1779-D1783 PolarHBondContact O-N 3.05Å; A1779-D1783 VanDerWaalsContact O-N 3.11Å
1780	A	86.3	Confident	84.1	Confident	20 Å²	20	75.4 Å²	75.4	17%	0.165	38%	0.376	C	S	.	.	H	α-helix	trans	-67	-34.3	176.5	0	0	0	0	0	112.3	R1776 I1777 K1782 D1783 T1786 A1789 F1852	R1776-A1780 WeakPolarHBondContact O-CB 3.1Å; R1776-A1780 PolarHBondContact O-N 3.36Å; I1777-A1780 PolarHBondContact O-N 3.32Å; A1780-K1782 PolarHBondContact O-N 3.06Å; A1780-D1783 PolarHBondContact O-N 3.12Å; A1780-D1783 VanDerWaalsContact O-N 3.12Å; A1780-T1786 PolarHBondContact O-OG1 2.69Å; A1780-A1789 HydrophobicContact CB-CB 4.41Å; A1780-F1852 HydrophobicContact CB-CE2 4.22Å; A1780-F1852 HydrophobicContact CB-CZ 3.67Å; A1780-F1852 WeakPolarHBondContact O-CE2 3.25Å
1781	L	85.4	Confident	84.3	Confident	15 Å²	15	73.9 Å²	73.9	8%	0.079	37%	0.365	C	S	.	.	H	α-helix	trans	-63.3	-24.3	171.6	-77.2	167.8	0	0	0	113.4	V1764 I1777 I1778 A1779 R1825 V1828 F1852	V1764-L1781 HydrophobicContact CG2-CD1 4.26Å; I1777-L1781 HydrophobicContact CG2-CD1 3.86Å; I1777-L1781 HydrophobicContact CG2-CG 4.42Å; I1777-L1781 WeakPolarHBondContact O-CB 3.24Å; I1777-L1781 WeakPolarHBondContact O-CG 3.46Å; I1777-L1781 PolarHBondContact O-N 3.44Å; I1778-L1781 PolarHBondContact O-N 3.42Å; A1779-L1781 PolarHBondContact O-N 3Å; L1781-R1825 HydrophobicContact CD2-CG 3.8Å; L1781-R1825 WeakPolarHBondContact O-CG 3.38Å; L1781-V1828 HydrophobicContact CD1-CG1 4.31Å; L1781-F1852 HydrophobicContact CD2-CB 3.86Å; L1781-F1852 HydrophobicContact CD2-CD1 3.69Å; L1781-F1852 HydrophobicContact CD2-CD2 3.89Å; L1781-F1852 HydrophobicContact CD2-CE1 4.13Å; L1781-F1852 HydrophobicContact CD2-CE2 4.31Å; L1781-F1852 HydrophobicContact CD2-CG 3.55Å; L1781-F1852 HydrophobicContact CD2-CZ 4.42Å; L1781-F1852 HydrophobicContact CG-CD1 4.37Å; L1781-F1852 HydrophobicContact CG-CE1 4.32Å; L1781-F1852 HydrophobicContact CG-CZ 4.45Å
1782	K	84	Confident	84.4	Confident	174 Å²	174	67.6 Å²	67.6	76%	0.757	34%	0.336	S	S	*	.	H	α-helix	trans	-84.7	-24.6	172.2	-69.3	175.3	178	-172.5	0	113.2	I1778 A1779 A1780 S1784	I1778-K1782 WeakPolarHBondContact O-CG 3.13Å; I1778-K1782 PolarHBondContact O-N 3.15Å; A1779-K1782 WeakPolarHBondContact O-CB 3.33Å; A1779-K1782 PolarHBondContact O-N 3.13Å; A1779-K1782 VanDerWaalsContact O-N 3.1Å; A1780-K1782 PolarHBondContact O-N 3.06Å; K1782-S1784 PolarHBondContact O-N 3.37Å
1783	D	84.9	Confident	84	Confident	69 Å²	69	68.6 Å²	68.6	37%	0.369	33%	0.334	S	S	.	.			trans	-77.2	107.2	176.9	-175	-15.5	0	0	0	110.4	A1779 A1780 K1785 T1786 R1825	A1779-D1783 PolarHBondContact O-N 3.05Å; A1779-D1783 VanDerWaalsContact O-N 3.11Å; A1780-D1783 PolarHBondContact O-N 3.12Å; A1780-D1783 VanDerWaalsContact O-N 3.12Å; D1783-K1785 PolarHBondContact O-N 3.44Å; D1783-K1785 VanDerWaalsContact O-N 3.11Å; D1783-K1785 WeakPolarHBondContact OD1-CB 3.28Å; D1783-K1785 PolarHBondContact OD1-N 3.08Å; D1783-T1786 HydrophobicContact CB-CG2 4.15Å; D1783-T1786 PolarHBondContact O-N 2.9Å; D1783-T1786 VanDerWaalsContact O-N 3.1Å; D1783-T1786 PolarHBondContact O-OG1 2.91Å; D1783-T1786 WeakPolarHBondContact OD2-CG2 3.44Å; D1783-R1825 PolarHBondContact O-NH2 3Å
1784	S	73.5	Confident	83.5	Confident	80 Å²	80	70.5 Å²	70.5	56%	0.559	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-27.2	-179.4	61.1	0	0	0	0	113.5	K1782 R1825	K1782-S1784 PolarHBondContact O-N 3.37Å; S1784-R1825 VanDerWaalsContact C-NH2 3.28Å; S1784-R1825 PolarHBondContact O-NH1 3.27Å; S1784-R1825 PolarHBondContact O-NH2 2.76Å
1785	K	80.9	Confident	82.9	Confident	176 Å²	176	67.7 Å²	67.7	77%	0.765	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-17.5	-177.9	-58.1	178.2	-179	177.8	0	113.5	D1783	D1783-K1785 PolarHBondContact O-N 3.44Å; D1783-K1785 VanDerWaalsContact O-N 3.11Å; D1783-K1785 WeakPolarHBondContact OD1-CB 3.28Å; D1783-K1785 PolarHBondContact OD1-N 3.08Å
1786	T	82.6	Confident	82.4	Confident	42 Å²	42	67 Å²	67	26%	0.258	33%	0.331	S	S	.	.			trans	-97.7	127	-178.1	72.3	0	0	0	0	112.2	A1780 D1783 R1825 F1852	A1780-T1786 PolarHBondContact O-OG1 2.69Å; D1783-T1786 HydrophobicContact CB-CG2 4.15Å; D1783-T1786 PolarHBondContact O-N 2.9Å; D1783-T1786 VanDerWaalsContact O-N 3.1Å; D1783-T1786 PolarHBondContact O-OG1 2.91Å; D1783-T1786 WeakPolarHBondContact OD2-CG2 3.44Å; T1786-R1825 PolarHBondContact O-NH2 2.75Å; T1786-F1852 VanDerWaalsContact O-CD2 3.24Å; T1786-F1852 WeakPolarHBondContact O-CD2 3.32Å; T1786-F1852 WeakPolarHBondContact O-CE2 3.18Å
1787	F	84.6	Confident	81.7	Confident	105 Å²	105	64.7 Å²	64.7	46%	0.461	33%	0.33	S	S	.	.			trans	-109.5	-4.1	178.1	-54.6	-67.4	0	0	0	113.1	P1850 K1853	F1787-P1850 HydrophobicContact CD1-CG 3.67Å; F1787-P1850 HydrophobicContact CE1-CG 3.48Å; F1787-P1850 VanDerWaalsContact CE1-CG 3.48Å; F1787-K1853 PolarHBondContact O-N 3.4Å
1788	V	88.1	Confident	80.9	Confident	59 Å²	59	67 Å²	67	36%	0.358	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	120.1	-177	-170.2	0	0	0	0	110.1	K1853 V1855	V1788-K1853 CarbonylContact C-O 3.58Å; V1788-K1853 WeakPolarHBondContact CA-O 3.24Å; V1788-K1853 HydrophobicContact CG1-CB 4.37Å; V1788-K1853 HydrophobicContact CG2-CB 4.23Å; V1788-V1855 HydrophobicContact CG1-CB 4.22Å; V1788-V1855 HydrophobicContact CG1-CG2 3.61Å
1789	A	86.9	Confident	80.3	Confident	9 Å²	9	67.3 Å²	67.3	7%	0.074	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	122	164	0	0	0	0	0	109.9	I1777 A1780 F1852 K1853 L1854 V1855	I1777-A1789 HydrophobicContact CG1-CB 4.23Å; A1780-A1789 HydrophobicContact CB-CB 4.41Å; A1789-F1852 HydrophobicContact CB-CE1 3.54Å; A1789-F1852 HydrophobicContact CB-CZ 3.77Å; A1789-K1853 PolarHBondContact N-O 2.74Å; A1789-L1854 HydrophobicContact CB-CD2 4.08Å; A1789-V1855 PolarHBondContact O-N 3.41Å
1790	R	86.7	Confident	79.9	Confident	166 Å²	166	67.3 Å²	67.3	63%	0.626	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.1	132.9	167.4	-74.5	-176.3	170.7	93.6	-0.8	110.5	D1817 V1855	R1790-D1817 IonicContact CZ-OD2 3.21Å; R1790-D1817 IonicContact NE-OD1 3.91Å; R1790-D1817 IonicContact NE-OD2 2.73Å; R1790-D1817 PolarHBondContact NE-OD2 2.99Å; R1790-D1817 IonicContact NH2-OD2 3.83Å; R1790-D1817 PolarHBondContact NH2-OD2 3.13Å; R1790-D1817 VanDerWaalsContact NH2-OD2 3.08Å; R1790-V1855 CarbonylContact C-O 3.5Å; R1790-V1855 VanDerWaalsContact CA-O 3.32Å; R1790-V1855 WeakPolarHBondContact CA-O 3.48Å; R1790-V1855 HydrophobicContact CG-CB 4.14Å; R1790-V1855 HydrophobicContact CG-CG1 4.16Å
1791	F	85.8	Confident	79.1	Confident	15 Å²	15	66.8 Å²	66.8	7%	0.066	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	158.4	176	60.5	-86.8	0	0	0	112.7	I1769 V1773 I1777 V1820 L1854 V1855 Q1856 T1857	I1769-F1791 HydrophobicContact CG2-CE2 4.37Å; V1773-F1791 HydrophobicContact CG1-CB 3.64Å; V1773-F1791 HydrophobicContact CG1-CD2 3.68Å; V1773-F1791 HydrophobicContact CG1-CE2 4.47Å; V1773-F1791 HydrophobicContact CG1-CG 3.7Å; I1777-F1791 HydrophobicContact CD1-CD1 3.91Å; I1777-F1791 HydrophobicContact CD1-CE1 3.87Å; I1777-F1791 HydrophobicContact CD1-CG 4.45Å; I1777-F1791 HydrophobicContact CD1-CZ 4.37Å; I1777-F1791 HydrophobicContact CG1-CD1 4.32Å; F1791-V1820 HydrophobicContact CZ-CG2 4.03Å; F1791-L1854 HydrophobicContact CE1-CB 4.17Å; F1791-V1855 WeakPolarHBondContact CD1-O 3.43Å; F1791-V1855 PolarHBondContact N-O 2.75Å; F1791-Q1856 HydrophobicContact CD2-CB 4.48Å; F1791-Q1856 HydrophobicContact CD2-CG 4.45Å; F1791-Q1856 HydrophobicContact CE2-CB 4Å; F1791-Q1856 HydrophobicContact CE2-CG 4.17Å; F1791-Q1856 HydrophobicContact CZ-CB 4.2Å; F1791-Q1856 CarbonylContact O-C 3.6Å; F1791-Q1856 VanDerWaalsContact O-CA 3.24Å; F1791-Q1856 WeakPolarHBondContact O-CA 3.28Å; F1791-T1857 PolarHBondContact O-N 2.66Å
1792	T	82.1	Confident	78.6	Confident	8 Å²	8	68.8 Å²	68.8	5%	0.049	35%	0.351	C	S	.	.			trans	-103.6	159.3	171.4	47.4	0	0	0	0	109.3	D1794 G1795 K1796 Y1859	T1792-D1794 VanDerWaalsContact C-N 3.3Å; T1792-D1794 WeakPolarHBondContact CB-OD1 3.43Å; T1792-D1794 PolarHBondContact O-N 3.23Å; T1792-D1794 PolarHBondContact OG1-OD1 3.05Å; T1792-G1795 PolarHBondContact O-N 3.39Å; T1792-G1795 VanDerWaalsContact OG1-C 3.27Å; T1792-G1795 VanDerWaalsContact OG1-CA 3.29Å; T1792-G1795 WeakPolarHBondContact OG1-CA 3.45Å; T1792-G1795 PolarHBondContact OG1-N 3.39Å; T1792-K1796 WeakPolarHBondContact CG2-O 3.46Å; T1792-K1796 PolarHBondContact OG1-N 3.17Å; T1792-K1796 PolarHBondContact OG1-O 3.26Å; T1792-Y1859 HydrophobicContact CG2-CE2 4.49Å
1793	Q	73.3	Confident	78.3	Confident	79 Å²	79	67.4 Å²	67.4	37%	0.369	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-31.8	-177.6	-161.8	-176.6	0.2	0	0	112.4	P1770 A1869	P1770-Q1793 WeakPolarHBondContact CD-O 3.48Å; P1770-Q1793 VanDerWaalsContact CG-O 3.28Å; P1770-Q1793 WeakPolarHBondContact CG-O 3.41Å; Q1793-A1869 HydrophobicContact CB-CB 4.02Å; Q1793-A1869 WeakPolarHBondContact CB-O 3.3Å
1794	D	73.6	Confident	77.7	Confident	41 Å²	41	66.8 Å²	66.8	22%	0.219	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.6	-1.8	175.4	64.2	-8.1	0	0	0	113.4	T1792 K1796 Q1871	T1792-D1794 VanDerWaalsContact C-N 3.3Å; T1792-D1794 WeakPolarHBondContact CB-OD1 3.43Å; T1792-D1794 PolarHBondContact O-N 3.23Å; T1792-D1794 PolarHBondContact OG1-OD1 3.05Å; D1794-K1796 PolarHBondContact O-N 3.41Å; D1794-K1796 PolarHBondContact OD1-N 2.84Å; D1794-Q1871 WeakPolarHBondContact OD2-CG 3.08Å
1795	G	73	Confident	77.4	Confident	8 Å²	8	63.6 Å²	63.6	8%	0.082	32%	0.322	C	S	.	.			trans	72.6	-1.4	175.9	0	0	0	0	0	116.1	V1773 R1776 T1792	V1773-G1795 VanDerWaalsContact CG2-CA 3.48Å; R1776-G1795 VanDerWaalsContact CZ-O 3.29Å; R1776-G1795 PolarHBondContact NH1-O 3.43Å; R1776-G1795 PolarHBondContact NH2-O 3Å; T1792-G1795 PolarHBondContact O-N 3.39Å; T1792-G1795 VanDerWaalsContact OG1-C 3.27Å; T1792-G1795 VanDerWaalsContact OG1-CA 3.29Å; T1792-G1795 WeakPolarHBondContact OG1-CA 3.45Å; T1792-G1795 PolarHBondContact OG1-N 3.39Å
1796	K	74.1	Confident	77.1	Confident	104 Å²	104	57.7 Å²	57.7	45%	0.452	30%	0.303	S	S	.	.			trans	-77.2	151.6	177.4	-64.6	177.3	-179.1	-174.3	0	110.9	T1792 D1794	T1792-K1796 WeakPolarHBondContact CG2-O 3.46Å; T1792-K1796 PolarHBondContact OG1-N 3.17Å; T1792-K1796 PolarHBondContact OG1-O 3.26Å; D1794-K1796 PolarHBondContact O-N 3.41Å; D1794-K1796 PolarHBondContact OD1-N 2.84Å
1797	T	70.3	Confident	76.8	Confident	63 Å²	63	59.3 Å²	59.3	39%	0.387	32%	0.321	S	S	.	.			trans	-73.9	159.1	177.9	75.9	0	0	0	0	111.1	S1799 D1800 L1801	T1797-S1799 PolarHBondContact O-N 2.93Å; T1797-S1799 WeakPolarHBondContact OG1-CB 3.34Å; T1797-S1799 PolarHBondContact OG1-N 2.91Å; T1797-D1800 VanDerWaalsContact CB-OD2 3.32Å; T1797-D1800 WeakPolarHBondContact CB-OD2 3.46Å; T1797-D1800 WeakPolarHBondContact CG2-OD2 3.49Å; T1797-D1800 PolarHBondContact N-OD2 2.89Å; T1797-D1800 PolarHBondContact O-N 3.26Å; T1797-D1800 VanDerWaalsContact O-N 3.13Å; T1797-D1800 PolarHBondContact OG1-N 3.1Å; T1797-D1800 VanDerWaalsContact OG1-N 3.15Å; T1797-D1800 PolarHBondContact OG1-OD1 3.38Å; T1797-D1800 PolarHBondContact OG1-OD2 3.25Å; T1797-L1801 PolarHBondContact O-N 2.58Å
1798	V	69.8	Low	76	Confident	50 Å²	50	61.1 Å²	61.1	30%	0.303	33%	0.328	S	S	.	.	H	α-helix	trans	-58.7	-37.9	171.1	-178.1	0	0	0	0	110.3	D1800 L1801 V1802 T1857 Y1859	V1798-D1800 VanDerWaalsContact C-N 3.27Å; V1798-D1800 PolarHBondContact O-N 3.46Å; V1798-L1801 PolarHBondContact O-N 2.89Å; V1798-V1802 HydrophobicContact CG1-CG2 4.33Å; V1798-V1802 WeakPolarHBondContact O-CG2 3.46Å; V1798-V1802 PolarHBondContact O-N 3.3Å; V1798-T1857 HydrophobicContact CG2-CG2 4.13Å; V1798-Y1859 HydrophobicContact CG1-CE1 4.45Å; V1798-Y1859 HydrophobicContact CG2-CE1 4.22Å
1799	S	74.6	Confident	75.1	Confident	71 Å²	71	58.5 Å²	58.5	50%	0.497	31%	0.312	S	S	.	.	H	α-helix	trans	-58.8	-35	175.8	-47.8	0	0	0	0	112.8	T1797 V1802 K1803	T1797-S1799 PolarHBondContact O-N 2.93Å; T1797-S1799 WeakPolarHBondContact OG1-CB 3.34Å; T1797-S1799 PolarHBondContact OG1-N 2.91Å; S1799-V1802 PolarHBondContact O-N 3.17Å; S1799-K1803 VanDerWaalsContact O-CG 3.22Å; S1799-K1803 WeakPolarHBondContact O-CG 3.41Å; S1799-K1803 PolarHBondContact O-N 3.21Å
1800	D	76.5	Confident	74.6	Confident	59 Å²	59	63.7 Å²	63.7	32%	0.316	33%	0.33	S	S	.	.	H	α-helix	trans	-74.1	-32.8	-179.6	-54.7	-43.4	0	0	0	112.5	T1797 V1798 K1803 S1804	T1797-D1800 VanDerWaalsContact CB-OD2 3.32Å; T1797-D1800 WeakPolarHBondContact CB-OD2 3.46Å; T1797-D1800 WeakPolarHBondContact CG2-OD2 3.49Å; T1797-D1800 PolarHBondContact N-OD2 2.89Å; T1797-D1800 PolarHBondContact O-N 3.26Å; T1797-D1800 VanDerWaalsContact O-N 3.13Å; T1797-D1800 PolarHBondContact OG1-N 3.1Å; T1797-D1800 VanDerWaalsContact OG1-N 3.15Å; T1797-D1800 PolarHBondContact OG1-OD1 3.38Å; T1797-D1800 PolarHBondContact OG1-OD2 3.25Å; V1798-D1800 VanDerWaalsContact C-N 3.27Å; V1798-D1800 PolarHBondContact O-N 3.46Å; D1800-K1803 IonicContact OD1-NZ 2.63Å; D1800-K1803 PolarHBondContact OD1-NZ 3.12Å; D1800-S1804 PolarHBondContact O-N 2.92Å; D1800-S1804 PolarHBondContact O-OG 3.48Å
1801	L	69.7	Low	74.2	Confident	10 Å²	10	61.6 Å²	61.6	5%	0.052	34%	0.335	C	S	.	.	H	α-helix	trans	-69.3	-42.8	168.1	-177.5	56.4	0	0	0	111.4	T1797 V1798 K1803 S1804 L1805 L1813 Y1859 Q1871	T1797-L1801 PolarHBondContact O-N 2.58Å; V1798-L1801 PolarHBondContact O-N 2.89Å; L1801-K1803 VanDerWaalsContact C-N 3.25Å; L1801-K1803 PolarHBondContact O-N 2.94Å; L1801-S1804 PolarHBondContact O-N 3.32Å; L1801-S1804 VanDerWaalsContact O-N 3.13Å; L1801-S1804 PolarHBondContact O-OG 2.98Å; L1801-S1804 VanDerWaalsContact O-OG 3.06Å; L1801-L1805 HydrophobicContact CD1-CD1 4.19Å; L1801-L1805 HydrophobicContact CD1-CD2 4.28Å; L1801-L1805 HydrophobicContact CD1-CG 3.97Å; L1801-L1805 HydrophobicContact CG-CD1 3.94Å; L1801-L1805 HydrophobicContact CG-CG 4.21Å; L1801-L1805 WeakPolarHBondContact O-CG 3.23Å; L1801-L1805 PolarHBondContact O-N 3.34Å; L1801-L1805 VanDerWaalsContact O-N 3.08Å; L1801-L1813 HydrophobicContact CD2-CD1 4.21Å; L1801-L1813 HydrophobicContact CD2-CD2 3.96Å; L1801-L1813 HydrophobicContact CG-CD2 4.26Å; L1801-Y1859 HydrophobicContact CB-CE1 4.19Å; L1801-Y1859 HydrophobicContact CD2-CD1 3.47Å; L1801-Y1859 VanDerWaalsContact CD2-CD1 3.47Å; L1801-Y1859 HydrophobicContact CD2-CD2 3.81Å; L1801-Y1859 HydrophobicContact CD2-CE1 3.48Å; L1801-Y1859 VanDerWaalsContact CD2-CE1 3.48Å; L1801-Y1859 HydrophobicContact CD2-CE2 3.82Å; L1801-Y1859 HydrophobicContact CD2-CG 3.62Å; L1801-Y1859 HydrophobicContact CG-CE1 4.46Å; L1801-Q1871 HydrophobicContact CD1-CG 4.07Å
1802	V	75.2	Confident	73.5	Confident	57 Å²	57	61.2 Å²	61.2	35%	0.345	34%	0.335	S	S	.	.	H	α-helix	trans	-61.7	-34.4	178.7	170.9	0	0	0	0	111.7	V1798 S1799 R1810 L1813	V1798-V1802 HydrophobicContact CG1-CG2 4.33Å; V1798-V1802 WeakPolarHBondContact O-CG2 3.46Å; V1798-V1802 PolarHBondContact O-N 3.3Å; S1799-V1802 PolarHBondContact O-N 3.17Å; V1802-R1810 HydrophobicContact CG1-CG 4.21Å; V1802-R1810 WeakPolarHBondContact O-CD 3.16Å; V1802-R1810 PolarHBondContact O-NE 3.04Å; V1802-L1813 HydrophobicContact CG2-CD2 4.19Å
1803	K	79	Confident	73.2	Confident	144 Å²	144	62.2 Å²	62.2	63%	0.626	34%	0.34	S	S	*	.	H	α-helix	trans	-63.3	-44.6	172	-71	165	-157.9	164.5	0	112.5	S1799 D1800 L1801 R1810	S1799-K1803 VanDerWaalsContact O-CG 3.22Å; S1799-K1803 WeakPolarHBondContact O-CG 3.41Å; S1799-K1803 PolarHBondContact O-N 3.21Å; D1800-K1803 IonicContact OD1-NZ 2.63Å; D1800-K1803 PolarHBondContact OD1-NZ 3.12Å; L1801-K1803 VanDerWaalsContact C-N 3.25Å; L1801-K1803 PolarHBondContact O-N 2.94Å; K1803-R1810 PolarHBondContact O-NH2 2.81Å
1804	S	71.1	Confident	73.5	Confident	57 Å²	57	60 Å²	60	40%	0.399	33%	0.333	S	S	.	.	H	α-helix	trans	-78.9	-15.7	-175.4	63.7	0	0	0	0	114.8	D1800 L1801	D1800-S1804 PolarHBondContact O-N 2.92Å; D1800-S1804 PolarHBondContact O-OG 3.48Å; L1801-S1804 PolarHBondContact O-N 3.32Å; L1801-S1804 VanDerWaalsContact O-N 3.13Å; L1801-S1804 PolarHBondContact O-OG 2.98Å; L1801-S1804 VanDerWaalsContact O-OG 3.06Å
1805	L	67.7	Low	73.8	Confident	13 Å²	13	61 Å²	61	7%	0.068	35%	0.347	C	S	.	.	S	Bend	trans	-81.4	149	177.4	-72.7	176.4	0	0	0	113.2	L1801 D1809 R1810 L1813 I1883	L1801-L1805 HydrophobicContact CD1-CD1 4.19Å; L1801-L1805 HydrophobicContact CD1-CD2 4.28Å; L1801-L1805 HydrophobicContact CD1-CG 3.97Å; L1801-L1805 HydrophobicContact CG-CD1 3.94Å; L1801-L1805 HydrophobicContact CG-CG 4.21Å; L1801-L1805 WeakPolarHBondContact O-CG 3.23Å; L1801-L1805 PolarHBondContact O-N 3.34Å; L1801-L1805 VanDerWaalsContact O-N 3.08Å; L1805-D1809 HydrophobicContact CB-CB 4.15Å; L1805-D1809 HydrophobicContact CD2-CB 3.98Å; L1805-D1809 HydrophobicContact CG-CB 4.44Å; L1805-R1810 HydrophobicContact CB-CG 3.92Å; L1805-R1810 VanDerWaalsContact O-CZ 3.32Å; L1805-R1810 PolarHBondContact O-NE 2.94Å; L1805-R1810 PolarHBondContact O-NH2 2.87Å; L1805-L1813 HydrophobicContact CD1-CB 4.25Å; L1805-L1813 HydrophobicContact CD1-CD1 4.16Å; L1805-L1813 HydrophobicContact CD1-CD2 3.8Å; L1805-L1813 HydrophobicContact CD1-CG 4.28Å; L1805-I1883 HydrophobicContact CD2-CG2 3.76Å
1806	S	75.3	Confident	74.2	Confident	52 Å²	52	62.2 Å²	62.2	36%	0.364	35%	0.354	S	S	.	.			trans	-64.2	157.3	170.3	84.1	0	0	0	0	111.3	K1808 D1809 R1810	S1806-K1808 PolarHBondContact O-N 3.05Å; S1806-K1808 VanDerWaalsContact O-N 3.16Å; S1806-K1808 PolarHBondContact OG-N 3.32Å; S1806-D1809 WeakPolarHBondContact CB-OD2 3.42Å; S1806-D1809 PolarHBondContact O-N 2.76Å; S1806-D1809 PolarHBondContact OG-N 3.17Å; S1806-D1809 PolarHBondContact OG-OD2 3.36Å; S1806-R1810 WeakPolarHBondContact O-CG 3.41Å; S1806-R1810 PolarHBondContact O-N 3Å
1807	A	75.1	Confident	74.7	Confident	75 Å²	75	60.1 Å²	60.1	62%	0.62	35%	0.348	S	S	*	.	H	α-helix	trans	-56.1	-34.2	178.6	0	0	0	0	0	113
1808	K	67.8	Low	75.3	Confident	144 Å²	144	60.7 Å²	60.7	63%	0.626	35%	0.348	S	S	*	.	H	α-helix	trans	-67.5	-41.3	174.9	-171.2	-166.7	177	-152.2	0	111.8	S1806 S1812 S1882	S1806-K1808 PolarHBondContact O-N 3.05Å; S1806-K1808 VanDerWaalsContact O-N 3.16Å; S1806-K1808 PolarHBondContact OG-N 3.32Å; K1808-S1812 PolarHBondContact O-N 2.8Å; K1808-S1882 PolarHBondContact NZ-OG 2.58Å
1809	D	69.5	Low	76.1	Confident	4 Å²	4	63.5 Å²	63.5	2%	0.021	36%	0.358	C	S	.	.	H	α-helix	trans	-78.3	-29.7	-175.1	-57.4	-40.6	0	0	0	112.7	L1805 S1806 V1811 S1812 L1813 G1884	L1805-D1809 HydrophobicContact CB-CB 4.15Å; L1805-D1809 HydrophobicContact CD2-CB 3.98Å; L1805-D1809 HydrophobicContact CG-CB 4.44Å; S1806-D1809 WeakPolarHBondContact CB-OD2 3.42Å; S1806-D1809 PolarHBondContact O-N 2.76Å; S1806-D1809 PolarHBondContact OG-N 3.17Å; S1806-D1809 PolarHBondContact OG-OD2 3.36Å; D1809-V1811 VanDerWaalsContact C-N 3.31Å; D1809-V1811 PolarHBondContact O-N 3.48Å; D1809-S1812 WeakPolarHBondContact CA-OG 3.11Å; D1809-S1812 CarbonylContact O-C 3.34Å; D1809-S1812 WeakPolarHBondContact O-CA 3.31Å; D1809-S1812 WeakPolarHBondContact O-CB 3.4Å; D1809-S1812 PolarHBondContact O-N 3.27Å; D1809-S1812 PolarHBondContact O-OG 3.36Å; D1809-L1813 PolarHBondContact O-N 3.43Å; D1809-G1884 PolarHBondContact OD2-N 3.25Å
1810	R	76.9	Confident	76.4	Confident	117 Å²	117	63.3 Å²	63.3	44%	0.442	35%	0.354	S	S	.	.	H	α-helix	trans	-55.9	-44.7	172	-68.5	171.7	-157.1	-176.7	-0	111.7	V1802 K1803 L1805 S1806 S1812 L1813	V1802-R1810 HydrophobicContact CG1-CG 4.21Å; V1802-R1810 WeakPolarHBondContact O-CD 3.16Å; V1802-R1810 PolarHBondContact O-NE 3.04Å; K1803-R1810 PolarHBondContact O-NH2 2.81Å; L1805-R1810 HydrophobicContact CB-CG 3.92Å; L1805-R1810 VanDerWaalsContact O-CZ 3.32Å; L1805-R1810 PolarHBondContact O-NE 2.94Å; L1805-R1810 PolarHBondContact O-NH2 2.87Å; S1806-R1810 WeakPolarHBondContact O-CG 3.41Å; S1806-R1810 PolarHBondContact O-N 3Å; R1810-S1812 PolarHBondContact O-N 3.23Å; R1810-L1813 PolarHBondContact O-N 3.47Å
1811	V	77.6	Confident	76.9	Confident	122 Å²	122	60.6 Å²	60.6	74%	0.739	34%	0.339	S	S	*	.	H	α-helix	trans	-67.5	-25.4	175.7	-177.7	0	0	0	0	111.7	D1809 L1813	D1809-V1811 VanDerWaalsContact C-N 3.31Å; D1809-V1811 PolarHBondContact O-N 3.48Å; V1811-L1813 VanDerWaalsContact C-N 3.32Å
1812	S	71.9	Confident	77.9	Confident	8 Å²	8	62 Å²	62	6%	0.056	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83	-2.1	175.4	85.8	0	0	0	0	114.5	K1808 D1809 R1810 C1861 T1862	K1808-S1812 PolarHBondContact O-N 2.8Å; D1809-S1812 WeakPolarHBondContact CA-OG 3.11Å; D1809-S1812 CarbonylContact O-C 3.34Å; D1809-S1812 WeakPolarHBondContact O-CA 3.31Å; D1809-S1812 WeakPolarHBondContact O-CB 3.4Å; D1809-S1812 PolarHBondContact O-N 3.27Å; D1809-S1812 PolarHBondContact O-OG 3.36Å; R1810-S1812 PolarHBondContact O-N 3.23Å; S1812-C1861 CarbonylContact O-C 3.52Å; S1812-C1861 VanDerWaalsContact O-CA 3.29Å; S1812-C1861 WeakPolarHBondContact O-CA 3.48Å; S1812-T1862 WeakPolarHBondContact CA-OG1 3.11Å; S1812-T1862 PolarHBondContact O-N 2.87Å; S1812-T1862 PolarHBondContact O-OG1 2.92Å
1813	L	75.2	Confident	78.5	Confident	28 Å²	28	59.2 Å²	59.2	15%	0.147	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	135.5	-174.8	-164.2	81.4	0	0	0	111.6	L1801 V1802 L1805 D1809 R1810 V1811 Y1859 F1868	L1801-L1813 HydrophobicContact CD2-CD1 4.21Å; L1801-L1813 HydrophobicContact CD2-CD2 3.96Å; L1801-L1813 HydrophobicContact CG-CD2 4.26Å; V1802-L1813 HydrophobicContact CG2-CD2 4.19Å; L1805-L1813 HydrophobicContact CD1-CB 4.25Å; L1805-L1813 HydrophobicContact CD1-CD1 4.16Å; L1805-L1813 HydrophobicContact CD1-CD2 3.8Å; L1805-L1813 HydrophobicContact CD1-CG 4.28Å; D1809-L1813 PolarHBondContact O-N 3.43Å; R1810-L1813 PolarHBondContact O-N 3.47Å; V1811-L1813 VanDerWaalsContact C-N 3.32Å; L1813-Y1859 HydrophobicContact CD2-CD1 4.48Å; L1813-F1868 HydrophobicContact CD1-CZ 3.9Å
1814	S	78.8	Confident	78.9	Confident	33 Å²	33	52.4 Å²	52.4	23%	0.231	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	144.9	169.4	52.6	0	0	0	0	110	Q1860	S1814-Q1860 PolarHBondContact N-O 3.14Å; S1814-Q1860 PolarHBondContact O-N 2.81Å; S1814-Q1860 PolarHBondContact OG-O 3.11Å
1815	A	80.5	Confident	79.5	Confident	63 Å²	63	51.1 Å²	51.1	52%	0.521	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	135.4	172.7	0	0	0	0	0	109.4	T1857	A1815-T1857 HydrophobicContact CB-CG2 3.9Å
1816	C	80.9	Confident	80.2	Confident	32 Å²	32	55.7 Å²	55.7	22%	0.216	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	97.8	-177.8	-161	0	0	0	0	110.4	Y1858 Q1860 R1867	C1816-Y1858 PolarHBondContact N-O 3.11Å; C1816-Y1858 PolarHBondContact O-N 2.58Å; C1816-Q1860 HydrophobicContact CB-CB 4.17Å; C1816-R1867 PolarHBondContact O-NH2 3.02Å; C1816-R1867 PolarHBondContact SG-NH1 2.95Å; C1816-R1867 PolarHBondContact SG-NH2 3.14Å
1817	D	85.6	Confident	80.5	Confident	61 Å²	61	55.8 Å²	55.8	33%	0.326	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.6	144.3	176.3	-81.1	-6.8	0	0	0	111.8	R1790 V1855 T1857 R1867	R1790-D1817 IonicContact CZ-OD2 3.21Å; R1790-D1817 IonicContact NE-OD1 3.91Å; R1790-D1817 IonicContact NE-OD2 2.73Å; R1790-D1817 PolarHBondContact NE-OD2 2.99Å; R1790-D1817 IonicContact NH2-OD2 3.83Å; R1790-D1817 PolarHBondContact NH2-OD2 3.13Å; R1790-D1817 VanDerWaalsContact NH2-OD2 3.08Å; D1817-V1855 HydrophobicContact CB-CG1 3.55Å; D1817-V1855 VanDerWaalsContact CG-CG1 3.42Å; D1817-T1857 WeakPolarHBondContact OD1-CB 3.46Å; D1817-T1857 PolarHBondContact OD1-OG1 2.83Å; D1817-R1867 PolarHBondContact O-NH2 3.42Å
1818	L	82.7	Confident	81	Confident	75 Å²	75	55.1 Å²	55.1	39%	0.393	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	132.6	173.4	-173.3	70.5	0	0	0	109.1	V1820 V1855 Q1856 Y1858	L1818-V1820 PolarHBondContact O-N 3.03Å; L1818-V1855 CarbonylContact O-C 3.53Å; L1818-V1855 WeakPolarHBondContact O-CA 3.37Å; L1818-Q1856 PolarHBondContact N-O 3.36Å; L1818-Q1856 PolarHBondContact O-N 3.27Å; L1818-Y1858 HydrophobicContact CB-CD2 3.91Å; L1818-Y1858 HydrophobicContact CB-CE2 3.87Å; L1818-Y1858 HydrophobicContact CD2-CD2 4.28Å; L1818-Y1858 HydrophobicContact CD2-CE2 3.55Å; L1818-Y1858 HydrophobicContact CG-CE2 4.36Å
1819	E	86.7	Confident	82	Confident	108 Å²	108	49.1 Å²	49.1	51%	0.505	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	119.1	177.1	-48	-165.5	-179.4	0	0	109.3	K1853	E1819-K1853 WeakPolarHBondContact OE1-CE 3.47Å; E1819-K1853 IonicContact OE1-NZ 2.61Å; E1819-K1853 PolarHBondContact OE1-NZ 3.41Å; E1819-K1853 WeakPolarHBondContact OE2-CE 3.38Å; E1819-K1853 IonicContact OE2-NZ 2.64Å; E1819-K1853 PolarHBondContact OE2-NZ 2.97Å
1820	V	81.8	Confident	82.8	Confident	68 Å²	68	49.6 Å²	49.6	41%	0.412	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	-32.5	-173.1	-168	0	0	0	0	111.8	F1791 L1818 L1854 Q1856	F1791-V1820 HydrophobicContact CZ-CG2 4.03Å; L1818-V1820 PolarHBondContact O-N 3.03Å; V1820-L1854 HydrophobicContact CB-CB 4.35Å; V1820-L1854 PolarHBondContact N-O 2.8Å; V1820-Q1856 HydrophobicContact CG2-CB 3.38Å
1821	G	86.9	Confident	83.4	Confident	2 Å²	2	44.1 Å²	44.1	2%	0.021	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	169.2	-179.6	-177.9	0	0	0	0	0	112.8	F1831 L1854	G1821-F1831 CarbonylContact C-O 3.01Å; G1821-F1831 WeakPolarHBondContact CA-O 3.38Å; G1821-L1854 PolarHBondContact O-N 3.1Å
1822	W	90.4	Very high	83.7	Confident	38 Å²	38	44.8 Å²	44.8	14%	0.144	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	117.3	-176.5	-63.6	81.6	0	0	0	108.2	F1831 S1833 E1834 F1837 A1851 F1852 K1853	W1822-F1831 PolarHBondContact N-O 3.07Å; W1822-F1831 WeakPolarHBondContact O-CD2 3.47Å; W1822-F1831 PolarHBondContact O-N 2.99Å; W1822-S1833 VanDerWaalsContact CD1-C 3.43Å; W1822-E1834 VanDerWaalsContact CD1-N 3.25Å; W1822-E1834 HydrophobicContact CD2-CB 4.06Å; W1822-E1834 HydrophobicContact CD2-CG 4.38Å; W1822-E1834 HydrophobicContact CE3-CG 4.44Å; W1822-E1834 HydrophobicContact CG-CB 4.39Å; W1822-E1834 HydrophobicContact CH2-CB 4.43Å; W1822-E1834 HydrophobicContact CH2-CG 4.24Å; W1822-E1834 HydrophobicContact CZ2-CB 3.97Å; W1822-E1834 HydrophobicContact CZ2-CG 4.27Å; W1822-E1834 HydrophobicContact CZ3-CG 4.35Å; W1822-F1837 HydrophobicContact CB-CB 4.08Å; W1822-A1851 HydrophobicContact CE3-CB 3.51Å; W1822-A1851 HydrophobicContact CZ3-CB 3.85Å; W1822-F1852 CarbonylContact C-O 3.48Å; W1822-F1852 WeakPolarHBondContact CA-O 3.04Å; W1822-K1853 HydrophobicContact CE3-CB 4.22Å; W1822-K1853 HydrophobicContact CE3-CG 4.42Å; W1822-K1853 HydrophobicContact CH2-CD 4.16Å; W1822-K1853 HydrophobicContact CZ2-CD 4.39Å; W1822-K1853 HydrophobicContact CZ3-CB 4.23Å; W1822-K1853 HydrophobicContact CZ3-CD 4.38Å; W1822-K1853 HydrophobicContact CZ3-CG 4.39Å
1823	S	87.3	Confident	84.3	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	139.1	-176.6	48.5	0	0	0	0	112	T1829 F1852	S1823-T1829 CarbonylContact C-O 3.49Å; S1823-T1829 VanDerWaalsContact CA-O 3.24Å; S1823-T1829 WeakPolarHBondContact CA-O 3.3Å; S1823-F1852 PolarHBondContact N-O 2.98Å; S1823-F1852 WeakPolarHBondContact O-CB 3.21Å; S1823-F1852 PolarHBondContact O-N 2.81Å; S1823-F1852 WeakPolarHBondContact OG-CD1 3.44Å; S1823-F1852 PolarHBondContact OG-O 3.22Å
1824	C	87.5	Confident	84.9	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	28%	0.275	C	S	.	.			trans	-83.7	123.2	170.7	-175.2	0	0	0	0	110.1	C1827 V1828 T1829 F1831 F1837 C1845 T1847	C1824-C1827 HydrophobicContact CB-CB 4.16Å; C1824-C1827 PolarHBondContact SG-N 3.07Å; C1824-V1828 VanDerWaalsContact O-CA 3.26Å; C1824-V1828 WeakPolarHBondContact O-CA 3.37Å; C1824-V1828 PolarHBondContact O-N 3.15Å; C1824-T1829 PolarHBondContact N-O 3.3Å; C1824-F1831 HydrophobicContact CB-CE2 4.19Å; C1824-F1837 HydrophobicContact CB-CD2 4.15Å; C1824-F1837 HydrophobicContact CB-CE2 3.99Å; C1824-C1845 PolarHBondContact SG-SG 3.08Å; C1824-T1847 WeakPolarHBondContact SG-CG2 3.39Å
1825	R	84.4	Confident	85.1	Confident	30 Å²	30	55.8 Å²	55.8	11%	0.113	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-49.7	175.7	-80.3	-177.4	175.1	169.3	1.6	112.1	L1781 D1783 S1784 T1786 E1849 F1852	L1781-R1825 HydrophobicContact CD2-CG 3.8Å; L1781-R1825 WeakPolarHBondContact O-CG 3.38Å; D1783-R1825 PolarHBondContact O-NH2 3Å; S1784-R1825 VanDerWaalsContact C-NH2 3.28Å; S1784-R1825 PolarHBondContact O-NH1 3.27Å; S1784-R1825 PolarHBondContact O-NH2 2.76Å; T1786-R1825 PolarHBondContact O-NH2 2.75Å; R1825-E1849 VanDerWaalsContact CB-OE2 3.3Å; R1825-E1849 WeakPolarHBondContact CB-OE2 3.33Å; R1825-E1849 WeakPolarHBondContact CD-OE1 3.36Å; R1825-E1849 IonicContact CZ-OE1 3.08Å; R1825-E1849 IonicContact NE-OE1 3.9Å; R1825-E1849 IonicContact NH1-OE1 2.77Å; R1825-E1849 PolarHBondContact NH1-OE1 3.34Å; R1825-F1852 HydrophobicContact CG-CB 4.38Å
1826	Q	81.7	Confident	85.3	Confident	109 Å²	109	54 Å²	54	51%	0.509	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-40.9	-177.4	-60.3	-173.3	-7.2	0	0	113.6	T1847	Q1826-T1847 HydrophobicContact CB-CG2 3.82Å; Q1826-T1847 HydrophobicContact CG-CG2 3.84Å
1827	C	81.4	Confident	85.7	Confident	54 Å²	54	52.7 Å²	52.7	37%	0.365	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.2	-7.7	-176.9	-73.4	0	0	0	0	114.6	C1824 T1829 H1840 C1845	C1824-C1827 HydrophobicContact CB-CB 4.16Å; C1824-C1827 PolarHBondContact SG-N 3.07Å; C1827-T1829 HydrophobicContact CB-CG2 4.46Å; C1827-T1829 WeakPolarHBondContact CB-OG1 3.4Å; C1827-T1829 PolarHBondContact O-N 2.89Å; C1827-H1840 WeakPolarHBondContact CB-NE2 3.36Å; C1827-C1845 HydrophobicContact CB-CB 4.28Å; C1827-C1845 WeakPolarHBondContact CB-SG 3.23Å; C1827-C1845 WeakPolarHBondContact SG-CB 3.24Å; C1827-C1845 CovalentContact SG-SG 2.05Å; C1827-C1845 PolarHBondContact SG-SG 3.39Å
1828	V	86.5	Confident	85.6	Confident	61 Å²	61	52.1 Å²	52.1	37%	0.37	27%	0.265	S	S	.	.			trans	52.1	27.7	-178.7	-156.5	0	0	0	0	113.5	P1763 V1764 L1781 C1824	P1763-V1828 WeakPolarHBondContact CA-O 3.37Å; V1764-V1828 HydrophobicContact CB-CG1 4.05Å; V1764-V1828 HydrophobicContact CG2-CG1 3.97Å; V1764-V1828 PolarHBondContact N-O 3.15Å; V1764-V1828 VanDerWaalsContact N-O 3.1Å; L1781-V1828 HydrophobicContact CD1-CG1 4.31Å; C1824-V1828 VanDerWaalsContact O-CA 3.26Å; C1824-V1828 WeakPolarHBondContact O-CA 3.37Å; C1824-V1828 PolarHBondContact O-N 3.15Å
1829	T	87	Confident	85.6	Confident	18 Å²	18	51 Å²	51	11%	0.11	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	140.3	-178.8	39.3	0	0	0	0	111.1	N1760 S1823 C1824 C1827 F1831 H1840	N1760-T1829 WeakPolarHBondContact O-CG2 3.39Å; S1823-T1829 CarbonylContact C-O 3.49Å; S1823-T1829 VanDerWaalsContact CA-O 3.24Å; S1823-T1829 WeakPolarHBondContact CA-O 3.3Å; C1824-T1829 PolarHBondContact N-O 3.3Å; C1827-T1829 HydrophobicContact CB-CG2 4.46Å; C1827-T1829 WeakPolarHBondContact CB-OG1 3.4Å; C1827-T1829 PolarHBondContact O-N 2.89Å; T1829-F1831 WeakPolarHBondContact O-CE2 3.37Å; T1829-F1831 WeakPolarHBondContact OG1-CE2 3.41Å; T1829-H1840 PolarHBondContact OG1-NE2 2.89Å
1830	V	87.7	Confident	85.5	Confident	14 Å²	14	46.5 Å²	46.5	9%	0.085	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	130.1	-178.4	-171.2	0	0	0	0	110.9	G1761 T1762 V1764 L1767 L1854	G1761-V1830 CarbonylContact C-O 3.56Å; G1761-V1830 VanDerWaalsContact CA-O 3.23Å; G1761-V1830 WeakPolarHBondContact CA-O 3.31Å; T1762-V1830 PolarHBondContact N-O 3.1Å; T1762-V1830 WeakPolarHBondContact O-CA 3.28Å; T1762-V1830 WeakPolarHBondContact O-CB 3.43Å; T1762-V1830 WeakPolarHBondContact O-CG2 3.14Å; T1762-V1830 PolarHBondContact O-N 3.4Å; V1764-V1830 HydrophobicContact CG2-CG2 3.6Å; L1767-V1830 HydrophobicContact CD1-CG2 4.14Å; V1830-L1854 HydrophobicContact CB-CD1 4.43Å; V1830-L1854 HydrophobicContact CG1-CD1 3.67Å; V1830-L1854 HydrophobicContact CG2-CD1 3.83Å
1831	F	89.1	Confident	85.6	Confident	2 Å²	2	45.6 Å²	45.6	1%	0.009	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	147.2	-178.3	-59.5	-82.1	0	0	0	110.3	G1761 G1821 W1822 C1824 T1829 S1833 Q1836 F1837 H1840	G1761-F1831 VanDerWaalsContact CA-CE1 3.48Å; G1821-F1831 CarbonylContact C-O 3.01Å; G1821-F1831 WeakPolarHBondContact CA-O 3.38Å; W1822-F1831 PolarHBondContact N-O 3.07Å; W1822-F1831 WeakPolarHBondContact O-CD2 3.47Å; W1822-F1831 PolarHBondContact O-N 2.99Å; C1824-F1831 HydrophobicContact CB-CE2 4.19Å; T1829-F1831 WeakPolarHBondContact O-CE2 3.37Å; T1829-F1831 WeakPolarHBondContact OG1-CE2 3.41Å; F1831-S1833 PolarHBondContact O-N 2.74Å; F1831-Q1836 HydrophobicContact CB-CB 3.8Å; F1831-Q1836 HydrophobicContact CD1-CB 4.03Å; F1831-Q1836 HydrophobicContact CG-CB 4.27Å; F1831-F1837 HydrophobicContact CB-CB 4.21Å; F1831-F1837 HydrophobicContact CD2-CB 3.95Å; F1831-F1837 HydrophobicContact CD2-CD2 4.32Å; F1831-F1837 HydrophobicContact CG-CB 4.21Å; F1831-H1840 HydrophobicContact CD1-CB 4.45Å; F1831-H1840 HydrophobicContact CE1-CB 3.7Å; F1831-H1840 AromaticContact CE1-CG 3.86Å; F1831-H1840 HydrophobicContact CE2-CB 4.08Å; F1831-H1840 AromaticContact CE2-CD2 3.41Å; F1831-H1840 VanDerWaalsContact CE2-CD2 3.41Å; F1831-H1840 WeakPolarHBondContact CE2-CD2 3.27Å; F1831-H1840 AromaticContact CE2-CG 3.76Å; F1831-H1840 AromaticContact CE2-NE2 3.86Å; F1831-H1840 HydrophobicContact CZ-CB 3.52Å; F1831-H1840 AromaticContact CZ-CD2 3.32Å; F1831-H1840 WeakPolarHBondContact CZ-CD2 3.31Å; F1831-H1840 AromaticContact CZ-CE1 3.75Å; F1831-H1840 AromaticContact CZ-CG 3.2Å; F1831-H1840 AromaticContact CZ-ND1 3.49Å; F1831-H1840 WeakPolarHBondContact CZ-ND1 3.39Å; F1831-H1840 AromaticContact CZ-NE2 3.66Å
1832	Q	84.1	Confident	85.3	Confident	137 Å²	137	54.8 Å²	54.8	64%	0.64	27%	0.267	S	S	*	.	S	Bend	trans	-75.9	-12	-176.6	-59.3	-178.9	2	0	0	112.8
1833	S	83.9	Confident	84.7	Confident	42 Å²	42	56.2 Å²	56.2	29%	0.294	28%	0.277	S	S	.	.	S	Bend	trans	-153	155.5	179.2	56.9	0	0	0	0	111.8	W1822 F1831 H1835 Q1836 F1837	W1822-S1833 VanDerWaalsContact CD1-C 3.43Å; F1831-S1833 PolarHBondContact O-N 2.74Å; S1833-H1835 PolarHBondContact O-N 2.97Å; S1833-Q1836 WeakPolarHBondContact O-CB 3.34Å; S1833-Q1836 PolarHBondContact O-N 3.37Å; S1833-Q1836 WeakPolarHBondContact OG-CG 3.29Å; S1833-Q1836 PolarHBondContact OG-N 2.79Å; S1833-F1837 PolarHBondContact O-N 3.28Å; S1833-F1837 VanDerWaalsContact O-N 3.14Å
1834	E	88.2	Confident	84.3	Confident	110 Å²	110	60.6 Å²	60.6	51%	0.514	30%	0.296	S	S	.	.	H	α-helix	trans	-55	-42.2	175.1	-167.7	172	-161.8	0	0	111.1	W1822 Q1836 F1837 D1838	W1822-E1834 VanDerWaalsContact CD1-N 3.25Å; W1822-E1834 HydrophobicContact CD2-CB 4.06Å; W1822-E1834 HydrophobicContact CD2-CG 4.38Å; W1822-E1834 HydrophobicContact CE3-CG 4.44Å; W1822-E1834 HydrophobicContact CG-CB 4.39Å; W1822-E1834 HydrophobicContact CH2-CB 4.43Å; W1822-E1834 HydrophobicContact CH2-CG 4.24Å; W1822-E1834 HydrophobicContact CZ2-CB 3.97Å; W1822-E1834 HydrophobicContact CZ2-CG 4.27Å; W1822-E1834 HydrophobicContact CZ3-CG 4.35Å; E1834-Q1836 VanDerWaalsContact C-N 3.32Å; E1834-Q1836 PolarHBondContact O-N 3.1Å; E1834-F1837 WeakPolarHBondContact O-CB 3.2Å; E1834-F1837 PolarHBondContact O-N 2.63Å; E1834-D1838 WeakPolarHBondContact O-CB 3.15Å; E1834-D1838 PolarHBondContact O-N 2.9Å
1835	H	83.3	Confident	83.7	Confident	148 Å²	148	61.3 Å²	61.3	69%	0.685	30%	0.301	S	S	*	.	H	α-helix	trans	-60.4	-34.7	175.6	176.9	-88.7	0	0	0	113.8	S1833 C1839	S1833-H1835 PolarHBondContact O-N 2.97Å; H1835-C1839 WeakPolarHBondContact O-CB 3.24Å; H1835-C1839 PolarHBondContact O-N 2.94Å
1836	Q	84.9	Confident	83	Confident	26 Å²	26	70.7 Å²	70.7	12%	0.121	34%	0.336	C	S	.	.	H	α-helix	trans	-71.1	-44	174.4	-77.8	176	-7.1	0	0	111.4	N1758 F1831 S1833 E1834 D1838 C1839 H1840	N1758-Q1836 WeakPolarHBondContact O-CG 3.43Å; N1758-Q1836 PolarHBondContact OD1-NE2 2.84Å; F1831-Q1836 HydrophobicContact CB-CB 3.8Å; F1831-Q1836 HydrophobicContact CD1-CB 4.03Å; F1831-Q1836 HydrophobicContact CG-CB 4.27Å; S1833-Q1836 WeakPolarHBondContact O-CB 3.34Å; S1833-Q1836 PolarHBondContact O-N 3.37Å; S1833-Q1836 WeakPolarHBondContact OG-CG 3.29Å; S1833-Q1836 PolarHBondContact OG-N 2.79Å; E1834-Q1836 VanDerWaalsContact C-N 3.32Å; E1834-Q1836 PolarHBondContact O-N 3.1Å; Q1836-D1838 VanDerWaalsContact C-N 3.27Å; Q1836-D1838 PolarHBondContact O-N 3.29Å; Q1836-C1839 WeakPolarHBondContact O-CB 3.39Å; Q1836-C1839 PolarHBondContact O-N 2.84Å; Q1836-H1840 PolarHBondContact O-N 3.09Å
1837	F	88.1	Confident	82.4	Confident	4 Å²	4	66 Å²	66	2%	0.018	32%	0.315	C	S	.	.	H	α-helix	trans	-56.7	-43.7	171.2	163.1	-91.4	0	0	0	111	W1822 C1824 F1831 S1833 E1834 C1839 H1840 K1841 A1851	W1822-F1837 HydrophobicContact CB-CB 4.08Å; C1824-F1837 HydrophobicContact CB-CD2 4.15Å; C1824-F1837 HydrophobicContact CB-CE2 3.99Å; F1831-F1837 HydrophobicContact CB-CB 4.21Å; F1831-F1837 HydrophobicContact CD2-CB 3.95Å; F1831-F1837 HydrophobicContact CD2-CD2 4.32Å; F1831-F1837 HydrophobicContact CG-CB 4.21Å; S1833-F1837 PolarHBondContact O-N 3.28Å; S1833-F1837 VanDerWaalsContact O-N 3.14Å; E1834-F1837 WeakPolarHBondContact O-CB 3.2Å; E1834-F1837 PolarHBondContact O-N 2.63Å; F1837-C1839 VanDerWaalsContact C-N 3.33Å; F1837-C1839 PolarHBondContact O-N 3.32Å; F1837-H1840 CarbonylContact O-C 3.59Å; F1837-H1840 WeakPolarHBondContact O-CB 3.28Å; F1837-H1840 PolarHBondContact O-N 3.46Å; F1837-H1840 VanDerWaalsContact O-N 3.14Å; F1837-K1841 HydrophobicContact CE1-CB 4.42Å; F1837-K1841 HydrophobicContact CE1-CD 3.85Å; F1837-K1841 HydrophobicContact CZ-CB 4.45Å; F1837-K1841 HydrophobicContact CZ-CD 3.93Å; F1837-K1841 WeakPolarHBondContact O-CB 3.49Å; F1837-K1841 PolarHBondContact O-N 3.26Å; F1837-A1851 HydrophobicContact CD1-CB 3.5Å; F1837-A1851 HydrophobicContact CE1-CB 3.38Å; F1837-A1851 HydrophobicContact CE2-CB 4.44Å; F1837-A1851 HydrophobicContact CG-CB 4.11Å; F1837-A1851 HydrophobicContact CZ-CB 3.89Å
1838	D	84.4	Confident	81.9	Confident	48 Å²	48	69.5 Å²	69.5	26%	0.257	33%	0.329	S	S	.	.	H	α-helix	trans	-69.8	-32.8	-178.1	-140.2	39.5	0	0	0	111.8	E1834 Q1836 R1842	E1834-D1838 WeakPolarHBondContact O-CB 3.15Å; E1834-D1838 PolarHBondContact O-N 2.9Å; Q1836-D1838 VanDerWaalsContact C-N 3.27Å; Q1836-D1838 PolarHBondContact O-N 3.29Å; D1838-R1842 VanDerWaalsContact O-CB 3.32Å; D1838-R1842 WeakPolarHBondContact O-CB 3.49Å; D1838-R1842 VanDerWaalsContact O-CD 3.31Å; D1838-R1842 WeakPolarHBondContact O-CD 3.14Å; D1838-R1842 WeakPolarHBondContact O-CG 3.25Å; D1838-R1842 PolarHBondContact O-N 3.47Å; D1838-R1842 IonicContact OD2-CZ 2.83Å; D1838-R1842 IonicContact OD2-NE 2.72Å; D1838-R1842 PolarHBondContact OD2-NE 2.74Å; D1838-R1842 IonicContact OD2-NH2 2.67Å; D1838-R1842 PolarHBondContact OD2-NH2 2.9Å
1839	C	82.3	Confident	81.2	Confident	53 Å²	53	69.4 Å²	69.4	36%	0.358	33%	0.325	S	S	.	.	H	α-helix	trans	-63.9	-45	169	-149.1	0	0	0	0	111.3	H1835 Q1836 F1837 R1842 L1843	H1835-C1839 WeakPolarHBondContact O-CB 3.24Å; H1835-C1839 PolarHBondContact O-N 2.94Å; Q1836-C1839 WeakPolarHBondContact O-CB 3.39Å; Q1836-C1839 PolarHBondContact O-N 2.84Å; F1837-C1839 VanDerWaalsContact C-N 3.33Å; F1837-C1839 PolarHBondContact O-N 3.32Å; C1839-R1842 PolarHBondContact O-N 3.41Å; C1839-L1843 VanDerWaalsContact O-CB 3.27Å; C1839-L1843 WeakPolarHBondContact O-CB 3.37Å; C1839-L1843 VanDerWaalsContact O-CG 3.31Å; C1839-L1843 WeakPolarHBondContact O-CG 3.41Å; C1839-L1843 PolarHBondContact O-N 3Å
1840	H	85.1	Confident	80.8	Confident	13 Å²	13	71.9 Å²	71.9	6%	0.06	34%	0.341	C	S	.	.	H	α-helix	trans	-63.9	-42.2	176.4	171.6	79.4	0	0	0	112.8	C1827 T1829 F1831 Q1836 F1837 F1844 C1845	C1827-H1840 WeakPolarHBondContact CB-NE2 3.36Å; T1829-H1840 PolarHBondContact OG1-NE2 2.89Å; F1831-H1840 HydrophobicContact CD1-CB 4.45Å; F1831-H1840 HydrophobicContact CE1-CB 3.7Å; F1831-H1840 AromaticContact CE1-CG 3.86Å; F1831-H1840 HydrophobicContact CE2-CB 4.08Å; F1831-H1840 AromaticContact CE2-CD2 3.41Å; F1831-H1840 VanDerWaalsContact CE2-CD2 3.41Å; F1831-H1840 WeakPolarHBondContact CE2-CD2 3.27Å; F1831-H1840 AromaticContact CE2-CG 3.76Å; F1831-H1840 AromaticContact CE2-NE2 3.86Å; F1831-H1840 HydrophobicContact CZ-CB 3.52Å; F1831-H1840 AromaticContact CZ-CD2 3.32Å; F1831-H1840 WeakPolarHBondContact CZ-CD2 3.31Å; F1831-H1840 AromaticContact CZ-CE1 3.75Å; F1831-H1840 AromaticContact CZ-CG 3.2Å; F1831-H1840 AromaticContact CZ-ND1 3.49Å; F1831-H1840 WeakPolarHBondContact CZ-ND1 3.39Å; F1831-H1840 AromaticContact CZ-NE2 3.66Å; Q1836-H1840 PolarHBondContact O-N 3.09Å; F1837-H1840 CarbonylContact O-C 3.59Å; F1837-H1840 WeakPolarHBondContact O-CB 3.28Å; F1837-H1840 PolarHBondContact O-N 3.46Å; F1837-H1840 VanDerWaalsContact O-N 3.14Å; H1840-F1844 PolarHBondContact O-N 3.02Å; H1840-C1845 WeakPolarHBondContact NE2-CB 3.41Å; H1840-C1845 PolarHBondContact O-N 3.39Å
1841	K	83.3	Confident	80.4	Confident	49 Å²	49	72.1 Å²	72.1	21%	0.213	34%	0.344	C	S	.	.	I	π-helix	trans	-59.2	-47.5	174.3	-174.2	171.8	-173.5	173	0	111.4	F1837 R1846 T1847 I1848 E1849	F1837-K1841 HydrophobicContact CE1-CB 4.42Å; F1837-K1841 HydrophobicContact CE1-CD 3.85Å; F1837-K1841 HydrophobicContact CZ-CB 4.45Å; F1837-K1841 HydrophobicContact CZ-CD 3.93Å; F1837-K1841 WeakPolarHBondContact O-CB 3.49Å; F1837-K1841 PolarHBondContact O-N 3.26Å; K1841-R1846 PolarHBondContact O-N 2.9Å; K1841-T1847 WeakPolarHBondContact CE-O 3.39Å; K1841-T1847 WeakPolarHBondContact CE-OG1 3.47Å; K1841-I1848 PolarHBondContact NZ-O 2.61Å; K1841-E1849 PolarHBondContact NZ-O 2.65Å
1842	R	81	Confident	80.3	Confident	194 Å²	194	72.1 Å²	72.1	73%	0.732	34%	0.344	S	S	*	.	I	π-helix	trans	-75	-26.5	-178.3	-66.2	167.5	-167.3	-151.7	4.9	114.6	D1838 C1839	D1838-R1842 VanDerWaalsContact O-CB 3.32Å; D1838-R1842 WeakPolarHBondContact O-CB 3.49Å; D1838-R1842 VanDerWaalsContact O-CD 3.31Å; D1838-R1842 WeakPolarHBondContact O-CD 3.14Å; D1838-R1842 WeakPolarHBondContact O-CG 3.25Å; D1838-R1842 PolarHBondContact O-N 3.47Å; D1838-R1842 IonicContact OD2-CZ 2.83Å; D1838-R1842 IonicContact OD2-NE 2.72Å; D1838-R1842 PolarHBondContact OD2-NE 2.74Å; D1838-R1842 IonicContact OD2-NH2 2.67Å; D1838-R1842 PolarHBondContact OD2-NH2 2.9Å; C1839-R1842 PolarHBondContact O-N 3.41Å
1843	L	78	Confident	80.6	Confident	69 Å²	69	67.2 Å²	67.2	36%	0.361	32%	0.321	S	S	.	.	I	π-helix	trans	-109	-30.8	-173.2	-63.6	179.5	0	0	0	115.1	M302 C1839	M302-L1843 HydrophobicContact CE-CD2 4.24Å; C1839-L1843 VanDerWaalsContact O-CB 3.27Å; C1839-L1843 WeakPolarHBondContact O-CB 3.37Å; C1839-L1843 VanDerWaalsContact O-CG 3.31Å; C1839-L1843 WeakPolarHBondContact O-CG 3.41Å; C1839-L1843 PolarHBondContact O-N 3Å
1844	F	78.1	Confident	80.9	Confident	91 Å²	91	65.3 Å²	65.3	40%	0.399	31%	0.307	S	S	.	.	I	π-helix	trans	-127.9	-61.7	-168.6	-60.9	-80.4	0	0	0	113.3	I1759 H1840	I1759-F1844 HydrophobicContact CG2-CE2 3.58Å; I1759-F1844 HydrophobicContact CG2-CZ 3.89Å; H1840-F1844 PolarHBondContact O-N 3.02Å
1845	C	75.7	Confident	81	Confident	16 Å²	16	60.4 Å²	60.4	11%	0.108	29%	0.285	C	S	.	.	I	π-helix	trans	-83.6	-15.2	-164	-156.1	0	0	0	0	114.4	C1824 C1827 H1840 T1847	C1824-C1845 PolarHBondContact SG-SG 3.08Å; C1827-C1845 HydrophobicContact CB-CB 4.28Å; C1827-C1845 WeakPolarHBondContact CB-SG 3.23Å; C1827-C1845 WeakPolarHBondContact SG-CB 3.24Å; C1827-C1845 CovalentContact SG-SG 2.05Å; C1827-C1845 PolarHBondContact SG-SG 3.39Å; H1840-C1845 WeakPolarHBondContact NE2-CB 3.41Å; H1840-C1845 PolarHBondContact O-N 3.39Å; C1845-T1847 HydrophobicContact CB-CG2 3.88Å; C1845-T1847 PolarHBondContact O-N 2.71Å; C1845-T1847 VanDerWaalsContact SG-CG2 3.58Å
1846	R	68.8	Low	81.2	Confident	226 Å²	226	54.4 Å²	54.4	85%	0.853	26%	0.257	S	S	*	.			trans	53.6	18.6	179.6	-61.1	-171.1	177.7	-168.1	2.8	116.2	K1841	K1841-R1846 PolarHBondContact O-N 2.9Å
1847	T	69.6	Low	81.2	Confident	10 Å²	10	53.8 Å²	53.8	6%	0.061	26%	0.255	C	S	.	.			trans	-60.1	149.9	-176.3	84.7	0	0	0	0	111.4	C1824 Q1826 K1841 C1845 E1849	C1824-T1847 WeakPolarHBondContact SG-CG2 3.39Å; Q1826-T1847 HydrophobicContact CB-CG2 3.82Å; Q1826-T1847 HydrophobicContact CG-CG2 3.84Å; K1841-T1847 WeakPolarHBondContact CE-O 3.39Å; K1841-T1847 WeakPolarHBondContact CE-OG1 3.47Å; C1845-T1847 HydrophobicContact CB-CG2 3.88Å; C1845-T1847 PolarHBondContact O-N 2.71Å; C1845-T1847 VanDerWaalsContact SG-CG2 3.58Å; T1847-E1849 PolarHBondContact OG1-O 2.98Å
1848	I	70	Confident	80.9	Confident	129 Å²	129	56.1 Å²	56.1	66%	0.662	26%	0.264	S	S	*	.			trans	-92.2	-38.6	166.3	-58.7	178.6	0	0	0	109.2	L422 K1841	L422-I1848 HydrophobicContact CD2-CG2 4.17Å; K1841-I1848 PolarHBondContact NZ-O 2.61Å
1849	E	72.4	Confident	80.8	Confident	59 Å²	59	53.9 Å²	53.9	28%	0.276	25%	0.252	S	S	.	.	S	Bend	trans	-49	147.9	-176.9	-62.2	-172.2	95.3	0	0	115.6	R1825 K1841 T1847	R1825-E1849 VanDerWaalsContact CB-OE2 3.3Å; R1825-E1849 WeakPolarHBondContact CB-OE2 3.33Å; R1825-E1849 WeakPolarHBondContact CD-OE1 3.36Å; R1825-E1849 IonicContact CZ-OE1 3.08Å; R1825-E1849 IonicContact NE-OE1 3.9Å; R1825-E1849 IonicContact NH1-OE1 2.77Å; R1825-E1849 PolarHBondContact NH1-OE1 3.34Å; K1841-E1849 PolarHBondContact NZ-O 2.65Å; T1847-E1849 PolarHBondContact OG1-O 2.98Å
1850	P	78	Confident	80.7	Confident	70 Å²	70	52.2 Å²	52.2	46%	0.455	24%	0.239	S	C	.	.	P	Polyproline II helix	trans	-65.6	164	174.9	29.8	-36.1	0	0	0	112.5	F1787 F1852	F1787-P1850 HydrophobicContact CD1-CG 3.67Å; F1787-P1850 HydrophobicContact CE1-CG 3.48Å; F1787-P1850 VanDerWaalsContact CE1-CG 3.48Å; P1850-F1852 PolarHBondContact O-N 3.26Å
1851	A	79.2	Confident	80.4	Confident	19 Å²	19	51.7 Å²	51.7	16%	0.157	24%	0.237	C	C	.	.	P	Polyproline II helix	trans	-69.4	124.5	178.1	0	0	0	0	0	110.7	W1822 F1837	W1822-A1851 HydrophobicContact CE3-CB 3.51Å; W1822-A1851 HydrophobicContact CZ3-CB 3.85Å; F1837-A1851 HydrophobicContact CD1-CB 3.5Å; F1837-A1851 HydrophobicContact CE1-CB 3.38Å; F1837-A1851 HydrophobicContact CE2-CB 4.44Å; F1837-A1851 HydrophobicContact CG-CB 4.11Å; F1837-A1851 HydrophobicContact CZ-CB 3.89Å
1852	F	88.4	Confident	80.1	Confident	1 Å²	1	52 Å²	52	0%	0.004	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	132.7	175.7	-172.6	-75.6	0	0	0	109.7	A1780 L1781 T1786 A1789 W1822 S1823 R1825 P1850 L1854	A1780-F1852 HydrophobicContact CB-CE2 4.22Å; A1780-F1852 HydrophobicContact CB-CZ 3.67Å; A1780-F1852 WeakPolarHBondContact O-CE2 3.25Å; L1781-F1852 HydrophobicContact CD2-CB 3.86Å; L1781-F1852 HydrophobicContact CD2-CD1 3.69Å; L1781-F1852 HydrophobicContact CD2-CD2 3.89Å; L1781-F1852 HydrophobicContact CD2-CE1 4.13Å; L1781-F1852 HydrophobicContact CD2-CE2 4.31Å; L1781-F1852 HydrophobicContact CD2-CG 3.55Å; L1781-F1852 HydrophobicContact CD2-CZ 4.42Å; L1781-F1852 HydrophobicContact CG-CD1 4.37Å; L1781-F1852 HydrophobicContact CG-CE1 4.32Å; L1781-F1852 HydrophobicContact CG-CZ 4.45Å; T1786-F1852 VanDerWaalsContact O-CD2 3.24Å; T1786-F1852 WeakPolarHBondContact O-CD2 3.32Å; T1786-F1852 WeakPolarHBondContact O-CE2 3.18Å; A1789-F1852 HydrophobicContact CB-CE1 3.54Å; A1789-F1852 HydrophobicContact CB-CZ 3.77Å; W1822-F1852 CarbonylContact C-O 3.48Å; W1822-F1852 WeakPolarHBondContact CA-O 3.04Å; S1823-F1852 PolarHBondContact N-O 2.98Å; S1823-F1852 WeakPolarHBondContact O-CB 3.21Å; S1823-F1852 PolarHBondContact O-N 2.81Å; S1823-F1852 WeakPolarHBondContact OG-CD1 3.44Å; S1823-F1852 PolarHBondContact OG-O 3.22Å; R1825-F1852 HydrophobicContact CG-CB 4.38Å; P1850-F1852 PolarHBondContact O-N 3.26Å; F1852-L1854 HydrophobicContact CD1-CD2 4.18Å; F1852-L1854 HydrophobicContact CE1-CD2 3.95Å
1853	K	90.8	Very high	79.8	Confident	35 Å²	35	47.5 Å²	47.5	15%	0.152	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	131.8	-170.1	-170.4	175.9	-179.5	163.3	0	112.5	F1787 V1788 A1789 E1819 W1822 V1855	F1787-K1853 PolarHBondContact O-N 3.4Å; V1788-K1853 CarbonylContact C-O 3.58Å; V1788-K1853 WeakPolarHBondContact CA-O 3.24Å; V1788-K1853 HydrophobicContact CG1-CB 4.37Å; V1788-K1853 HydrophobicContact CG2-CB 4.23Å; A1789-K1853 PolarHBondContact N-O 2.74Å; E1819-K1853 WeakPolarHBondContact OE1-CE 3.47Å; E1819-K1853 IonicContact OE1-NZ 2.61Å; E1819-K1853 PolarHBondContact OE1-NZ 3.41Å; E1819-K1853 WeakPolarHBondContact OE2-CE 3.38Å; E1819-K1853 IonicContact OE2-NZ 2.64Å; E1819-K1853 PolarHBondContact OE2-NZ 2.97Å; W1822-K1853 HydrophobicContact CE3-CB 4.22Å; W1822-K1853 HydrophobicContact CE3-CG 4.42Å; W1822-K1853 HydrophobicContact CH2-CD 4.16Å; W1822-K1853 HydrophobicContact CZ2-CD 4.39Å; W1822-K1853 HydrophobicContact CZ3-CB 4.23Å; W1822-K1853 HydrophobicContact CZ3-CD 4.38Å; W1822-K1853 HydrophobicContact CZ3-CG 4.39Å; K1853-V1855 HydrophobicContact CD-CG2 4.28Å; K1853-V1855 HydrophobicContact CG-CG2 4.07Å
1854	L	90.2	Very high	79.6	Confident	2 Å²	2	45.2 Å²	45.2	1%	0.01	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	122.2	174.2	-61.9	-174.5	0	0	0	110.3	L1767 I1777 A1789 F1791 V1820 G1821 V1830 F1852	L1767-L1854 HydrophobicContact CD1-CD1 4.49Å; I1777-L1854 HydrophobicContact CD1-CD2 4.33Å; I1777-L1854 HydrophobicContact CG1-CD2 4.32Å; I1777-L1854 HydrophobicContact CG2-CD2 3.85Å; A1789-L1854 HydrophobicContact CB-CD2 4.08Å; F1791-L1854 HydrophobicContact CE1-CB 4.17Å; V1820-L1854 HydrophobicContact CB-CB 4.35Å; V1820-L1854 PolarHBondContact N-O 2.8Å; G1821-L1854 PolarHBondContact O-N 3.1Å; V1830-L1854 HydrophobicContact CB-CD1 4.43Å; V1830-L1854 HydrophobicContact CG1-CD1 3.67Å; V1830-L1854 HydrophobicContact CG2-CD1 3.83Å; F1852-L1854 HydrophobicContact CD1-CD2 4.18Å; F1852-L1854 HydrophobicContact CE1-CD2 3.95Å
1855	V	89.4	Confident	79.6	Confident	7 Å²	7	45.5 Å²	45.5	4%	0.042	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	122.7	-178	176.9	0	0	0	0	109.9	V1788 A1789 R1790 F1791 D1817 L1818 K1853	V1788-V1855 HydrophobicContact CG1-CB 4.22Å; V1788-V1855 HydrophobicContact CG1-CG2 3.61Å; A1789-V1855 PolarHBondContact O-N 3.41Å; R1790-V1855 CarbonylContact C-O 3.5Å; R1790-V1855 VanDerWaalsContact CA-O 3.32Å; R1790-V1855 WeakPolarHBondContact CA-O 3.48Å; R1790-V1855 HydrophobicContact CG-CB 4.14Å; R1790-V1855 HydrophobicContact CG-CG1 4.16Å; F1791-V1855 WeakPolarHBondContact CD1-O 3.43Å; F1791-V1855 PolarHBondContact N-O 2.75Å; D1817-V1855 HydrophobicContact CB-CG1 3.55Å; D1817-V1855 VanDerWaalsContact CG-CG1 3.42Å; L1818-V1855 CarbonylContact O-C 3.53Å; L1818-V1855 WeakPolarHBondContact O-CA 3.37Å; K1853-V1855 HydrophobicContact CD-CG2 4.28Å; K1853-V1855 HydrophobicContact CG-CG2 4.07Å
1856	Q	87.5	Confident	79.5	Confident	22 Å²	22	46.3 Å²	46.3	10%	0.103	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	116.8	173.3	-177.5	-179.6	13.8	0	0	109.1	F1791 L1818 V1820 Y1858	F1791-Q1856 HydrophobicContact CD2-CB 4.48Å; F1791-Q1856 HydrophobicContact CD2-CG 4.45Å; F1791-Q1856 HydrophobicContact CE2-CB 4Å; F1791-Q1856 HydrophobicContact CE2-CG 4.17Å; F1791-Q1856 HydrophobicContact CZ-CB 4.2Å; F1791-Q1856 CarbonylContact O-C 3.6Å; F1791-Q1856 VanDerWaalsContact O-CA 3.24Å; F1791-Q1856 WeakPolarHBondContact O-CA 3.28Å; L1818-Q1856 PolarHBondContact N-O 3.36Å; L1818-Q1856 PolarHBondContact O-N 3.27Å; V1820-Q1856 HydrophobicContact CG2-CB 3.38Å; Q1856-Y1858 HydrophobicContact CB-CD2 4.47Å; Q1856-Y1858 HydrophobicContact CB-CE2 3.98Å; Q1856-Y1858 HydrophobicContact CG-CD2 4.02Å; Q1856-Y1858 HydrophobicContact CG-CE2 3.54Å; Q1856-Y1858 PolarHBondContact NE2-OH 3.08Å; Q1856-Y1858 WeakPolarHBondContact O-CD2 3.36Å; Q1856-Y1858 PolarHBondContact O-N 2.89Å; Q1856-Y1858 PolarHBondContact OE1-OH 3.35Å
1857	T	84.2	Confident	79.8	Confident	12 Å²	12	39.4 Å²	39.4	7%	0.074	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	115.9	175	-53.6	0	0	0	0	109	F1791 V1798 A1815 D1817	F1791-T1857 PolarHBondContact O-N 2.66Å; V1798-T1857 HydrophobicContact CG2-CG2 4.13Å; A1815-T1857 HydrophobicContact CB-CG2 3.9Å; D1817-T1857 WeakPolarHBondContact OD1-CB 3.46Å; D1817-T1857 PolarHBondContact OD1-OG1 2.83Å
1858	Y	83	Confident	80	Confident	54 Å²	54	39.6 Å²	39.6	21%	0.212	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	147	171.9	-75.2	-110.8	0	0	0	110	C1816 L1818 Q1856 R1867 A1869	C1816-Y1858 PolarHBondContact N-O 3.11Å; C1816-Y1858 PolarHBondContact O-N 2.58Å; L1818-Y1858 HydrophobicContact CB-CD2 3.91Å; L1818-Y1858 HydrophobicContact CB-CE2 3.87Å; L1818-Y1858 HydrophobicContact CD2-CD2 4.28Å; L1818-Y1858 HydrophobicContact CD2-CE2 3.55Å; L1818-Y1858 HydrophobicContact CG-CE2 4.36Å; Q1856-Y1858 HydrophobicContact CB-CD2 4.47Å; Q1856-Y1858 HydrophobicContact CB-CE2 3.98Å; Q1856-Y1858 HydrophobicContact CG-CD2 4.02Å; Q1856-Y1858 HydrophobicContact CG-CE2 3.54Å; Q1856-Y1858 PolarHBondContact NE2-OH 3.08Å; Q1856-Y1858 WeakPolarHBondContact O-CD2 3.36Å; Q1856-Y1858 PolarHBondContact O-N 2.89Å; Q1856-Y1858 PolarHBondContact OE1-OH 3.35Å; Y1858-R1867 HydrophobicContact CD1-CB 4.31Å; Y1858-A1869 HydrophobicContact CD1-CB 3.85Å; Y1858-A1869 HydrophobicContact CE1-CB 3.69Å
1859	Y	80.9	Confident	79.8	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	128	168.8	-55.3	-63.6	0	0	0	109.1	T1792 V1798 L1801 L1813 R1867 F1868 Q1871	T1792-Y1859 HydrophobicContact CG2-CE2 4.49Å; V1798-Y1859 HydrophobicContact CG1-CE1 4.45Å; V1798-Y1859 HydrophobicContact CG2-CE1 4.22Å; L1801-Y1859 HydrophobicContact CB-CE1 4.19Å; L1801-Y1859 HydrophobicContact CD2-CD1 3.47Å; L1801-Y1859 VanDerWaalsContact CD2-CD1 3.47Å; L1801-Y1859 HydrophobicContact CD2-CD2 3.81Å; L1801-Y1859 HydrophobicContact CD2-CE1 3.48Å; L1801-Y1859 VanDerWaalsContact CD2-CE1 3.48Å; L1801-Y1859 HydrophobicContact CD2-CE2 3.82Å; L1801-Y1859 HydrophobicContact CD2-CG 3.62Å; L1801-Y1859 HydrophobicContact CG-CE1 4.46Å; L1813-Y1859 HydrophobicContact CD2-CD1 4.48Å; Y1859-R1867 CarbonylContact O-C 3.57Å; Y1859-R1867 VanDerWaalsContact O-CA 3.28Å; Y1859-R1867 WeakPolarHBondContact O-CA 3.46Å; Y1859-F1868 HydrophobicContact CD2-CD2 4.21Å; Y1859-F1868 HydrophobicContact CD2-CE2 4.11Å; Y1859-F1868 HydrophobicContact CG-CE2 4.13Å; Y1859-F1868 PolarHBondContact N-O 2.9Å; Y1859-F1868 WeakPolarHBondContact O-CD1 3.47Å; Y1859-F1868 PolarHBondContact O-N 3.07Å; Y1859-Q1871 HydrophobicContact CE2-CG 4.48Å
1860	Q	81.1	Confident	79.2	Confident	19 Å²	19	35.5 Å²	35.5	9%	0.089	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	125.5	178.4	-174.5	174.3	37.8	0	0	109.9	S1814 C1816 T1862 K1865 V1866 R1867	S1814-Q1860 PolarHBondContact N-O 3.14Å; S1814-Q1860 PolarHBondContact O-N 2.81Å; S1814-Q1860 PolarHBondContact OG-O 3.11Å; C1816-Q1860 HydrophobicContact CB-CB 4.17Å; Q1860-T1862 PolarHBondContact O-N 3.37Å; Q1860-K1865 WeakPolarHBondContact CG-O 3.49Å; Q1860-K1865 PolarHBondContact NE2-O 2.8Å; Q1860-V1866 WeakPolarHBondContact CA-O 3.15Å; Q1860-R1867 HydrophobicContact CB-CG 4.09Å; Q1860-R1867 HydrophobicContact CG-CG 4Å
1861	C	78.6	Confident	78.2	Confident	2 Å²	2	34 Å²	34	1%	0.014	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	126.3	171	-178.9	0	0	0	0	109.7	S1812 L1863 K1865 V1866	S1812-C1861 CarbonylContact O-C 3.52Å; S1812-C1861 VanDerWaalsContact O-CA 3.29Å; S1812-C1861 WeakPolarHBondContact O-CA 3.48Å; C1861-L1863 VanDerWaalsContact C-N 3.26Å; C1861-L1863 PolarHBondContact O-N 3.02Å; C1861-K1865 WeakPolarHBondContact O-CA 3.45Å; C1861-K1865 PolarHBondContact O-N 3.45Å; C1861-V1866 PolarHBondContact N-O 2.77Å; C1861-V1866 VanDerWaalsContact N-O 3.11Å
1862	T	76.6	Confident	76.9	Confident	56 Å²	56	37.2 Å²	37.2	34%	0.344	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-33.2	179.5	57.3	0	0	0	0	111.9	S1812 Q1860	S1812-T1862 WeakPolarHBondContact CA-OG1 3.11Å; S1812-T1862 PolarHBondContact O-N 2.87Å; S1812-T1862 PolarHBondContact O-OG1 2.92Å; Q1860-T1862 PolarHBondContact O-N 3.37Å
1863	L	74.6	Confident	75	Confident	98 Å²	98	39.7 Å²	39.7	51%	0.513	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-37.8	-176.2	-56.3	176.1	0	0	0	113.9	C1861 Y1880	C1861-L1863 VanDerWaalsContact C-N 3.26Å; C1861-L1863 PolarHBondContact O-N 3.02Å; L1863-Y1880 HydrophobicContact CB-CD2 3.93Å; L1863-Y1880 HydrophobicContact CB-CE2 4.32Å; L1863-Y1880 WeakPolarHBondContact O-CE2 3.42Å
1864	C	75.1	Confident	72.8	Confident	22 Å²	22	38.1 Å²	38.1	15%	0.149	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-121.5	3.3	-178.3	66.2	0	0	0	0	115	V1866 C1878 Y1880	C1864-V1866 HydrophobicContact CB-CG2 4.32Å; C1864-V1866 PolarHBondContact O-N 3.29Å; C1864-C1878 VanDerWaalsContact SG-SG 3.62Å; C1864-Y1880 HydrophobicContact CB-CD2 3.86Å; C1864-Y1880 HydrophobicContact CB-CE2 4Å
1865	K	77.1	Confident	70.8	Confident	97 Å²	97	43.4 Å²	43.4	42%	0.422	22%	0.224	S	C	.	.			trans	55.8	0.6	-179.5	-63.9	-72.5	-177.2	163.4	0	116.6	Q1860 C1861 R1867	Q1860-K1865 WeakPolarHBondContact CG-O 3.49Å; Q1860-K1865 PolarHBondContact NE2-O 2.8Å; C1861-K1865 WeakPolarHBondContact O-CA 3.45Å; C1861-K1865 PolarHBondContact O-N 3.45Å; K1865-R1867 PolarHBondContact O-N 2.92Å
1866	V	73	Confident	68.8	Low	32 Å²	32	50.6 Å²	50.6	19%	0.194	26%	0.262	C	S	.	.			trans	-57.7	125	173.2	174.7	0	0	0	0	110.3	Q1860 C1861 C1864 R1877	Q1860-V1866 WeakPolarHBondContact CA-O 3.15Å; C1861-V1866 PolarHBondContact N-O 2.77Å; C1861-V1866 VanDerWaalsContact N-O 3.11Å; C1864-V1866 HydrophobicContact CB-CG2 4.32Å; C1864-V1866 PolarHBondContact O-N 3.29Å; V1866-R1877 HydrophobicContact CG1-CB 4.12Å
1867	R	75.8	Confident	67.1	Low	81 Å²	81	58.1 Å²	58.1	31%	0.306	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	130.8	173.5	-62.9	174.2	79.8	152.1	2.6	109.5	C1816 D1817 Y1858 Y1859 Q1860 K1865	C1816-R1867 PolarHBondContact O-NH2 3.02Å; C1816-R1867 PolarHBondContact SG-NH1 2.95Å; C1816-R1867 PolarHBondContact SG-NH2 3.14Å; D1817-R1867 PolarHBondContact O-NH2 3.42Å; Y1858-R1867 HydrophobicContact CD1-CB 4.31Å; Y1859-R1867 CarbonylContact O-C 3.57Å; Y1859-R1867 VanDerWaalsContact O-CA 3.28Å; Y1859-R1867 WeakPolarHBondContact O-CA 3.46Å; Q1860-R1867 HydrophobicContact CB-CG 4.09Å; Q1860-R1867 HydrophobicContact CG-CG 4Å; K1865-R1867 PolarHBondContact O-N 2.92Å
1868	F	74.3	Confident	65.8	Low	15 Å²	15	58.3 Å²	58.3	7%	0.066	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	146.1	175.9	57.1	-82.4	0	0	0	110.4	L1813 Y1859 I1883	L1813-F1868 HydrophobicContact CD1-CZ 3.9Å; Y1859-F1868 HydrophobicContact CD2-CD2 4.21Å; Y1859-F1868 HydrophobicContact CD2-CE2 4.11Å; Y1859-F1868 HydrophobicContact CG-CE2 4.13Å; Y1859-F1868 PolarHBondContact N-O 2.9Å; Y1859-F1868 WeakPolarHBondContact O-CD1 3.47Å; Y1859-F1868 PolarHBondContact O-N 3.07Å; F1868-I1883 HydrophobicContact CE1-CD1 4.04Å; F1868-I1883 HydrophobicContact CZ-CD1 4.01Å
1869	A	65.2	Low	64.3	Low	13 Å²	13	63.6 Å²	63.6	11%	0.107	31%	0.311	C	S	.	.	S	Bend	trans	-117.1	-20	-169.5	0	0	0	0	0	113.9	Q1793 Y1858	Q1793-A1869 HydrophobicContact CB-CB 4.02Å; Q1793-A1869 WeakPolarHBondContact CB-O 3.3Å; Y1858-A1869 HydrophobicContact CD1-CB 3.85Å; Y1858-A1869 HydrophobicContact CE1-CB 3.69Å
1870	M	61.3	Low	63.1	Low	88 Å²	88	70.3 Å²	70.3	43%	0.433	34%	0.337	S	S	.	.	S	Bend	trans	-115.1	135.2	171.9	-64.7	174	64.6	0	0	109.2	S1873	M1870-S1873 PolarHBondContact O-N 2.82Å
1871	Q	56.7	Low	61.7	Low	38 Å²	38	72.8 Å²	72.8	18%	0.178	37%	0.368	C	S	.	.	G	3₁₀ helix	trans	-53.7	-40	-179.7	-76.8	175.3	1.6	0	0	114.9	D1794 L1801 Y1859 S1873	D1794-Q1871 WeakPolarHBondContact OD2-CG 3.08Å; L1801-Q1871 HydrophobicContact CD1-CG 4.07Å; Y1859-Q1871 HydrophobicContact CE2-CG 4.48Å; Q1871-S1873 VanDerWaalsContact C-N 3.32Å; Q1871-S1873 PolarHBondContact O-N 3.13Å
1872	P	51.6	Low	60.5	Low	87 Å²	87	74.3 Å²	74.3	57%	0.565	38%	0.378	S	S	*	.	G	3₁₀ helix	trans	-67.1	-27.3	176.3	-23.4	35.5	0	0	0	114.5	G1874 K1875	P1872-G1874 VanDerWaalsContact C-N 3.33Å; P1872-G1874 PolarHBondContact O-N 2.95Å; P1872-K1875 PolarHBondContact O-N 2.6Å
1873	S	47.5	Very low	59.1	Low	53 Å²	53	73.3 Å²	73.3	37%	0.371	37%	0.37	S	S	.	.	G	3₁₀ helix	trans	-79.3	-12	-170.7	-53.2	0	0	0	0	114.6	M1870 Q1871 K1875	M1870-S1873 PolarHBondContact O-N 2.82Å; Q1871-S1873 VanDerWaalsContact C-N 3.32Å; Q1871-S1873 PolarHBondContact O-N 3.13Å; S1873-K1875 VanDerWaalsContact C-N 3.32Å
1874	G	45.8	Very low	57.4	Low	3 Å²	3	70.3 Å²	70.3	3%	0.031	36%	0.363	C	S	.	.	G	3₁₀ helix	trans	-68.2	-31.3	172.5	0	0	0	0	0	113	P1872 N1876 R1877	P1872-G1874 VanDerWaalsContact C-N 3.33Å; P1872-G1874 PolarHBondContact O-N 2.95Å; G1874-N1876 VanDerWaalsContact C-N 3.3Å; G1874-N1876 PolarHBondContact O-N 2.66Å; G1874-R1877 PolarHBondContact O-N 3.15Å
1875	K	47	Very low	55.3	Low	112 Å²	112	75 Å²	75	49%	0.487	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-39.6	-172.1	-65.4	-173.2	174.5	-172.4	0	113.2	P1872 S1873	P1872-K1875 PolarHBondContact O-N 2.6Å; S1873-K1875 VanDerWaalsContact C-N 3.32Å
1876	N	48	Very low	53.2	Low	158 Å²	158	75.1 Å²	75.1	85%	0.845	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.8	6.2	-171.8	-63.4	9.5	0	0	0	114.9	G1874	G1874-N1876 VanDerWaalsContact C-N 3.3Å; G1874-N1876 PolarHBondContact O-N 2.66Å
1877	R	52.6	Low	51	Low	181 Å²	181	79.5 Å²	79.5	68%	0.683	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.3	-9.7	-177.9	-71.7	-174	175.7	175.6	0.3	115.1	V1866 G1874 R1879	V1866-R1877 HydrophobicContact CG1-CB 4.12Å; G1874-R1877 PolarHBondContact O-N 3.15Å; R1877-R1879 PolarHBondContact O-N 3.22Å
1878	C	56.1	Low	48.9	Very low	15 Å²	15	89.4 Å²	89.4	10%	0.101	47%	0.468	C	S	.	.			trans	-82.5	108.8	173.4	-177.8	0	0	0	0	110.7	C1864 Y1880 G1881 I1883	C1864-C1878 VanDerWaalsContact SG-SG 3.62Å; C1878-Y1880 PolarHBondContact O-N 3.29Å; C1878-G1881 PolarHBondContact O-N 3.01Å; C1878-I1883 HydrophobicContact CB-CD1 4.18Å
1879	R	52.5	Low	47.6	Very low	166 Å²	166	93.1 Å²	93.1	63%	0.626	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-12.5	177.4	-72.4	-167.7	-172.5	-129.3	11.9	114.5	T99 D100 R1877	T99-R1879 PolarHBondContact O-NH1 3.04Å; T99-R1879 PolarHBondContact O-NH2 2.93Å; D100-R1879 IonicContact OD1-CZ 3.38Å; D100-R1879 IonicContact OD1-NH2 3.87Å; D100-R1879 PolarHBondContact OD1-NH2 3.34Å; D100-R1879 IonicContact OD2-NH2 2.73Å; R1877-R1879 PolarHBondContact O-N 3.22Å
1880	Y	54.8	Low	46.7	Very low	141 Å²	141	97.3 Å²	97.3	55%	0.553	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.6	5.4	178	-66.3	-68.9	0	0	0	114.8	L1863 C1864 C1878 S1882	L1863-Y1880 HydrophobicContact CB-CD2 3.93Å; L1863-Y1880 HydrophobicContact CB-CE2 4.32Å; L1863-Y1880 WeakPolarHBondContact O-CE2 3.42Å; C1864-Y1880 HydrophobicContact CB-CD2 3.86Å; C1864-Y1880 HydrophobicContact CB-CE2 4Å; C1878-Y1880 PolarHBondContact O-N 3.29Å; Y1880-S1882 PolarHBondContact O-N 3.28Å; Y1880-S1882 PolarHBondContact O-OG 2.64Å
1881	G	52.3	Low	45.9	Very low	71 Å²	71	97.8 Å²	97.8	73%	0.732	51%	0.512	S	S	*	.			trans	54	19.2	166	0	0	0	0	0	116.9	C1878	C1878-G1881 PolarHBondContact O-N 3.01Å
1882	S	52.8	Low	45.2	Very low	33 Å²	33	101.4 Å²	101.4	23%	0.231	53%	0.532	C	S	.	.			trans	-98.3	-28.1	-165.2	-70.4	0	0	0	0	114.7	K1808 Y1880 G1884	K1808-S1882 PolarHBondContact NZ-OG 2.58Å; Y1880-S1882 PolarHBondContact O-N 3.28Å; Y1880-S1882 PolarHBondContact O-OG 2.64Å; S1882-G1884 PolarHBondContact O-N 2.99Å
1883	I	46.3	Very low	44.8	Very low	36 Å²	36	102.3 Å²	102.3	19%	0.185	53%	0.53	C	S	.	.	S	Bend	trans	-61.6	104.5	-172.6	-57.7	178	0	0	0	109.4	L1805 F1868 C1878	L1805-I1883 HydrophobicContact CD2-CG2 3.76Å; F1868-I1883 HydrophobicContact CE1-CD1 4.04Å; F1868-I1883 HydrophobicContact CZ-CD1 4.01Å; C1878-I1883 HydrophobicContact CB-CD1 4.18Å
1884	G	40.7	Very low	44.7	Very low	35 Å²	35	105.5 Å²	105.5	36%	0.361	54%	0.54	S	S	.	.			trans	-64.1	155.6	-158.4	0	0	0	0	0	117.1	D1809 S1882	D1809-G1884 PolarHBondContact OD2-N 3.25Å; S1882-G1884 PolarHBondContact O-N 2.99Å
1885	T	30.2	Very low	44.6	Very low	120 Å²	120	112.9 Å²	112.9	74%	0.736	58%	0.577	S	S	*	*			trans	-70.3	126	172.3	46.6	0	0	0	0	111.9
1886	V	32.8	Very low	44.4	Very low	99 Å²	99	112.9 Å²	112.9	60%	0.6	58%	0.583	S	S	*	*			trans	-132.5	132.7	147.4	-173.2	0	0	0	0	106.1
1887	D	26.8	Very low	44.1	Very low	125 Å²	125	109.2 Å²	109.2	67%	0.668	56%	0.562	S	S	*	*			trans	-98.8	125.7	178.1	-62.1	-61.7	0	0	0	109.8
1888	F	31.3	Very low	43.3	Very low	288 Å²	288	102.6 Å²	102.6	100%	1.263	55%	0.551	S	S	*	*			trans	-173.7	0	153	-97.2	-63.2	0	0	0	108.6

Retrieved 1,888 of 1,888 residues in 1205.4 ms (Link to these results)

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