A0A077Z661_TRITR Loading...

Glycogen debranching enzyme AlphaSync

AlphaFold DB , UniProt , Accession A0A077Z661, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,538 aa.

						>A0A077Z661_TRITR|A0A077Z661
MEQLYSTFVFTLEPRKDYESMLYFVEKGSKIRFNFHSXWFGQKISLYTTYEPDVQNNVVATDTDIWYPLNLNRGSINKNDDFGQYAELRCVRPGPFKFCLLLGTNSISCPEVIGYFHILPNIATRLNGSNLPLEAIACQSVYANLLGPFSGWAKQFAVTMNSGYNMIHLTPVQKLGQSRDAWSISDQLKLNDEIFGPNANDGFGLLEEFVKKIEKEWNMLTMSDLVLSHTATDSQWLIEHPDCAYNLENSPHLRPAYLLDRVLHHFSRAVASGAYSGKGLSNEPWTHRSLSTMKAILLDEVYPRTKIHELFQVNVETLVKTFKEKIAAEGHPSPSPSEQHVTLHIIQDMEYNRLSSTVDMDLALLLFNQTQDKTIPEAERQQICVQKFQQCLWYLNNEAARKCWDNLRHGVENLANYVSMQQEMENGAKHLKHSNKHPLFPQYFTQPKASTKWEEDEETMHSSEKRKYIMLTNGWVPNEGFPQTTVEPKSRAYFRRDVHCWTHSVKLRYGKCPNDCKFLWERMEKYTRSVAKIFHGINVVDLLSSPIHVCEHMLKLVRKIRPNAYICAKLDADTKNVSRIINQLGLVGIIQSTSWVRQPYELASLLKRYGGKPVGSFLRAPLPLLLPRDIPVFLFDMALDEESPVKRRTPVDVLPTATLLAATRRPYGSCRGVDELVSEKVIFCIDATERHKLYCSWNEGANGVQVNWTAENHCAGYVDAKTGVIRGRQAVNRMHAFLSQGEFTEIQVDQKCENMIVVHRRSPLLAQSVIIAVRNCFWMEDKERREFVAPIVIAGNLEEILYEGALQEKKSPRGQKIQAKTINEKSRASISEESVYVTGQTEYELFLKEMASVSMPKENRIAMSTLRKELARIDVITLPTESLQEIADFRSADIVYHLTNMKRLNNIDHPLCEHLRQGDWLPDYITKRFSATQGTAEVSEWFNYMFEIYKDLPAFAKPCYFDAIINGAYTLMTNAILSKMSSFVQNGGPLVHTLAISSLIFCGPVSSGKLPELSSYLQLPKQEATAVSSDANQMTTIAAGIPNYSAGSLRNWSRDTFIALRGLLLIPGRYTEARYAYLGKAFSLKPTSYGLQLLLCLFRYLILSYAGLMKNGMLPTRVCDHTSARFGCRDSVWWWLLAIKHYTDMVPNGQEIMWDPVIRYCSKESRHKRPYPSDQHLFITIQEAICTIFQGRKVGFLIQQRRSSISERNTDAKQNSGVNEKGFVVEAGVDKQTGFVFGGNQHNAGTWMDKIGSSQICDNRGKAATPRDGSAVEIVAISYAVIKWLNKMANEGQYPYAGVKCKNASREVFWTWETWANKIMAAFEKSFWIPLIKDSEKTPSSTESQPPGNTGYYKDTVNSEVKWSETQLRPNFLIAMVIAPELFDISNATIAVEKAEKKLLGHLGMKTLNEEDWAYNGYYSAAVDSADNKTANGFNLHQGPHTGLKEWVWLMGYFLRAKMQIAMATNNLEIHQATISRVKQILANHWEYINNDPWFSLPAFTNKDGAYCRDACPAQATSIACIMEALYDLSNVMKDDQA
					

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	44.2	Very low	73.1	Confident	132 Å²	132	66.5 Å²	66.5	65%	0.65	33%	0.329	S	S	*	.				0	-68.8	0	-77.9	-59.5	-124.4	0	0	112.9	Q3 L4 Y5	M1-Q3 VanDerWaalsContact C-N 3.31Å; M1-Q3 PolarHBondContact O-N 3.12Å; M1-Q3 VanDerWaalsContact O-N 3.11Å; M1-L4 WeakPolarHBondContact O-CB 3.31Å; M1-L4 PolarHBondContact O-N 3.34Å; M1-Y5 HydrophobicContact CB-CE2 4.42Å; M1-Y5 HydrophobicContact CE-CE2 4.18Å; M1-Y5 WeakPolarHBondContact O-CD2 3.36Å; M1-Y5 PolarHBondContact O-N 2.83Å; M1-Y5 HydrophobicContact SD-CE2 3.99Å
2	E	50.4	Low	74.7	Confident	171 Å²	171	60.9 Å²	60.9	80%	0.799	30%	0.301	S	S	*	.	H	α-helix	trans	-48.7	-44.3	-172.8	-64.2	-178.3	156	0	0	115	L4 Y5 S6	E2-L4 VanDerWaalsContact C-N 3.26Å; E2-L4 PolarHBondContact O-N 3.38Å; E2-Y5 PolarHBondContact O-N 2.58Å; E2-Y5 VanDerWaalsContact O-N 3.08Å; E2-S6 PolarHBondContact O-N 3.05Å; E2-S6 PolarHBondContact O-OG 3.43Å
3	Q	53.3	Low	76	Confident	148 Å²	148	61.3 Å²	61.3	69%	0.692	30%	0.302	S	S	*	.	H	α-helix	trans	-58	-33.1	176.6	-66.1	-173.1	0.4	0	0	114.1	M1 S6 T7	M1-Q3 VanDerWaalsContact C-N 3.31Å; M1-Q3 PolarHBondContact O-N 3.12Å; M1-Q3 VanDerWaalsContact O-N 3.11Å; Q3-S6 WeakPolarHBondContact CA-OG 3.33Å; Q3-S6 PolarHBondContact O-OG 3.24Å; Q3-T7 WeakPolarHBondContact O-CB 3.44Å; Q3-T7 PolarHBondContact O-N 2.73Å; Q3-T7 PolarHBondContact O-OG1 3.41Å
4	L	57.1	Low	76.9	Confident	77 Å²	77	59.9 Å²	59.9	40%	0.403	30%	0.3	S	S	.	.	H	α-helix	trans	-74.2	-35.6	176.7	-65.9	170.4	0	0	0	111.3	M1 E2 L622	M1-L4 WeakPolarHBondContact O-CB 3.31Å; M1-L4 PolarHBondContact O-N 3.34Å; E2-L4 VanDerWaalsContact C-N 3.26Å; E2-L4 PolarHBondContact O-N 3.38Å; L4-L622 HydrophobicContact CD2-CD1 4.21Å; L4-L622 HydrophobicContact CD2-CD2 4.18Å; L4-L622 HydrophobicContact CD2-CG 4.1Å; L4-L622 WeakPolarHBondContact O-CA 3.16Å; L4-L622 PolarHBondContact O-N 3.32Å
5	Y	66.2	Low	77.5	Confident	79 Å²	79	72.7 Å²	72.7	31%	0.31	34%	0.343	S	S	.	.	H	α-helix	trans	-72	-32.4	175.5	-73.3	-75.7	0	0	0	112.1	M1 E2 T7 R619 P621	M1-Y5 HydrophobicContact CB-CE2 4.42Å; M1-Y5 HydrophobicContact CE-CE2 4.18Å; M1-Y5 WeakPolarHBondContact O-CD2 3.36Å; M1-Y5 PolarHBondContact O-N 2.83Å; M1-Y5 HydrophobicContact SD-CE2 3.99Å; E2-Y5 PolarHBondContact O-N 2.58Å; E2-Y5 VanDerWaalsContact O-N 3.08Å; Y5-T7 VanDerWaalsContact C-N 3.31Å; Y5-T7 PolarHBondContact O-N 3.09Å; Y5-R619 HydrophobicContact CD1-CG 4.35Å; Y5-R619 WeakPolarHBondContact CE1-O 3.1Å; Y5-R619 VanDerWaalsContact O-CZ 3.26Å; Y5-R619 PolarHBondContact O-NE 3.39Å; Y5-R619 PolarHBondContact O-NH2 2.93Å; Y5-P621 HydrophobicContact CE1-CG 4.36Å
6	S	79.2	Confident	78.2	Confident	37 Å²	37	72.3 Å²	72.3	26%	0.259	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-3.8	177.2	70.5	0	0	0	0	114.9	E2 Q3 S29 K30	E2-S6 PolarHBondContact O-N 3.05Å; E2-S6 PolarHBondContact O-OG 3.43Å; Q3-S6 WeakPolarHBondContact CA-OG 3.33Å; Q3-S6 PolarHBondContact O-OG 3.24Å; S6-S29 CarbonylContact O-C 3.56Å; S6-S29 VanDerWaalsContact O-CA 3.23Å; S6-S29 WeakPolarHBondContact O-CA 3.38Å; S6-S29 VanDerWaalsContact O-CB 3.31Å; S6-S29 WeakPolarHBondContact O-CB 3.32Å; S6-K30 PolarHBondContact O-N 3.24Å
7	T	88.4	Confident	78.9	Confident	6 Å²	6	71.8 Å²	71.8	4%	0.037	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	112.8	-178.7	-60	0	0	0	0	110.8	Q3 Y5 K30 R32 L622 P623	Q3-T7 WeakPolarHBondContact O-CB 3.44Å; Q3-T7 PolarHBondContact O-N 2.73Å; Q3-T7 PolarHBondContact O-OG1 3.41Å; Y5-T7 VanDerWaalsContact C-N 3.31Å; Y5-T7 PolarHBondContact O-N 3.09Å; T7-K30 HydrophobicContact CG2-CB 3.98Å; T7-R32 HydrophobicContact CG2-CB 4.17Å; T7-L622 HydrophobicContact CG2-CD2 3.66Å; T7-L622 WeakPolarHBondContact O-CA 3.33Å; T7-P623 WeakPolarHBondContact O-CD 3.29Å
8	F	90.7	Very high	79.8	Confident	15 Å²	15	67.8 Å²	67.8	7%	0.066	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	132.4	177.9	-65.6	-92.3	0	0	0	111.7	V25 K30 I31 R32 P623 L625	F8-V25 HydrophobicContact CD2-CG1 4.06Å; F8-V25 HydrophobicContact CE2-CG1 4.4Å; F8-V25 HydrophobicContact CG-CG1 4.46Å; F8-K30 PolarHBondContact N-O 3.27Å; F8-I31 CarbonylContact O-C 3.33Å; F8-I31 WeakPolarHBondContact O-CA 3.06Å; F8-R32 PolarHBondContact O-N 3.03Å; F8-P623 CarbonylContact C-O 3.51Å; F8-P623 WeakPolarHBondContact CA-O 3.21Å; F8-P623 HydrophobicContact CD1-CB 4.18Å; F8-P623 HydrophobicContact CD1-CG 3.69Å; F8-P623 HydrophobicContact CE1-CB 4.39Å; F8-P623 HydrophobicContact CE1-CG 3.91Å; F8-P623 HydrophobicContact CG-CG 4.29Å; F8-L625 HydrophobicContact CB-CB 4.02Å; F8-L625 HydrophobicContact CB-CD1 4.45Å; F8-L625 HydrophobicContact CD1-CD1 4.42Å; F8-L625 HydrophobicContact CG-CD1 4.48Å
9	V	89.9	Confident	80.4	Confident	16 Å²	16	67.8 Å²	67.8	10%	0.097	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	120.9	177.3	178.2	0	0	0	0	110.3	R32 N34 L622 P623 L624 L625	V9-R32 CarbonylContact C-O 3.41Å; V9-R32 WeakPolarHBondContact CA-O 3.13Å; V9-N34 HydrophobicContact CG1-CB 4.49Å; V9-N34 WeakPolarHBondContact CG1-ND2 3.35Å; V9-L622 HydrophobicContact CG2-CB 4.04Å; V9-P623 PolarHBondContact N-O 3.03Å; V9-L624 HydrophobicContact CB-CD2 4.23Å; V9-L624 HydrophobicContact CG1-CD2 4.26Å; V9-L624 CarbonylContact O-C 3.48Å; V9-L624 WeakPolarHBondContact O-CA 3.45Å; V9-L625 PolarHBondContact O-N 2.86Å
10	F	93.6	Very high	80.9	Confident	3 Å²	3	66.3 Å²	66.3	1%	0.013	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	100.2	-177.5	-170.8	-163.4	0	0	0	110.3	L12 Y18 Y23 I31 R32 F33 N34 F98 L625	F10-L12 HydrophobicContact CD1-CD2 4.34Å; F10-L12 HydrophobicContact CE1-CD2 4.17Å; F10-L12 HydrophobicContact CE2-CD2 4.39Å; F10-L12 HydrophobicContact CZ-CD2 4.2Å; F10-Y18 HydrophobicContact CE2-CD1 4.07Å; F10-Y18 AromaticContact CE2-CE1 3.63Å; F10-Y18 HydrophobicContact CE2-CE1 3.63Å; F10-Y18 AromaticContact CZ-CD1 3.74Å; F10-Y18 HydrophobicContact CZ-CD1 3.74Å; F10-Y18 AromaticContact CZ-CE1 3.75Å; F10-Y18 HydrophobicContact CZ-CE1 3.75Å; F10-Y23 HydrophobicContact CD2-CE1 4.29Å; F10-Y23 AromaticContact CE2-CD1 3.89Å; F10-Y23 HydrophobicContact CE2-CD1 3.89Å; F10-Y23 HydrophobicContact CE2-CD2 4.38Å; F10-Y23 AromaticContact CE2-CE1 3.44Å; F10-Y23 HydrophobicContact CE2-CE1 3.44Å; F10-Y23 VanDerWaalsContact CE2-CE1 3.44Å; F10-Y23 HydrophobicContact CE2-CE2 4.03Å; F10-Y23 HydrophobicContact CE2-CG 4.31Å; F10-Y23 AromaticContact CE2-CZ 3.52Å; F10-Y23 HydrophobicContact CZ-CD1 4.01Å; F10-Y23 AromaticContact CZ-CD2 3.8Å; F10-Y23 HydrophobicContact CZ-CD2 3.8Å; F10-Y23 AromaticContact CZ-CE1 3.86Å; F10-Y23 HydrophobicContact CZ-CE1 3.86Å; F10-Y23 AromaticContact CZ-CE2 3.69Å; F10-Y23 HydrophobicContact CZ-CE2 3.69Å; F10-Y23 AromaticContact CZ-CG 3.96Å; F10-Y23 HydrophobicContact CZ-CG 3.96Å; F10-Y23 AromaticContact CZ-CZ 3.7Å; F10-I31 HydrophobicContact CB-CG2 3.89Å; F10-I31 HydrophobicContact CD1-CG2 4.26Å; F10-R32 PolarHBondContact N-O 2.99Å; F10-F33 HydrophobicContact CB-CD1 4.48Å; F10-F33 AromaticContact CD1-CD1 3.76Å; F10-F33 HydrophobicContact CD1-CD1 3.76Å; F10-F33 AromaticContact CD1-CE1 3.49Å; F10-F33 HydrophobicContact CD1-CE1 3.49Å; F10-F33 VanDerWaalsContact CD1-CE1 3.49Å; F10-F33 HydrophobicContact CD1-CZ 4.35Å; F10-F33 HydrophobicContact CE1-CD1 4.47Å; F10-F33 AromaticContact CE1-CE1 3.94Å; F10-F33 HydrophobicContact CE1-CE1 3.94Å; F10-F33 HydrophobicContact CG-CD1 4.43Å; F10-F33 CarbonylContact O-C 3.58Å; F10-F33 VanDerWaalsContact O-CA 3.31Å; F10-F33 WeakPolarHBondContact O-CA 3.44Å; F10-N34 PolarHBondContact O-N 3.26Å; F10-F98 HydrophobicContact CE1-CD1 4.4Å; F10-F98 AromaticContact CE1-CE1 3.65Å; F10-F98 HydrophobicContact CE1-CE1 3.65Å; F10-F98 HydrophobicContact CE1-CE2 4.46Å; F10-F98 AromaticContact CE1-CZ 3.68Å; F10-F98 HydrophobicContact CE1-CZ 3.68Å; F10-F98 HydrophobicContact CZ-CE1 4.04Å; F10-F98 AromaticContact CZ-CZ 3.8Å; F10-F98 HydrophobicContact CZ-CZ 3.8Å; F10-L625 HydrophobicContact CB-CB 3.91Å; F10-L625 HydrophobicContact CB-CD2 4.02Å; F10-L625 HydrophobicContact CB-CG 4.5Å; F10-L625 HydrophobicContact CD1-CD2 3.9Å; F10-L625 HydrophobicContact CD2-CB 4.28Å; F10-L625 HydrophobicContact CD2-CD2 4.47Å; F10-L625 HydrophobicContact CE1-CD2 4.45Å; F10-L625 HydrophobicContact CG-CB 4.19Å; F10-L625 HydrophobicContact CG-CD2 3.91Å; F10-L625 HydrophobicContact CG-CG 4.39Å
11	T	90.6	Very high	81.5	Confident	47 Å²	47	66 Å²	66	29%	0.288	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	122.5	178.6	-53.3	0	0	0	0	110.4	Y18 N34	T11-Y18 PolarHBondContact O-OH 3.22Å; T11-Y18 VanDerWaalsContact O-OH 3.14Å; T11-N34 HydrophobicContact CG2-CB 4.44Å
12	L	93.3	Very high	83.8	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	132.1	173.9	-59.9	-172.4	0	0	0	109.8	F10 Y18 F33 N34 F35 H36 W39 L46 F98 L100	F10-L12 HydrophobicContact CD1-CD2 4.34Å; F10-L12 HydrophobicContact CE1-CD2 4.17Å; F10-L12 HydrophobicContact CE2-CD2 4.39Å; F10-L12 HydrophobicContact CZ-CD2 4.2Å; L12-Y18 VanDerWaalsContact CA-OH 3.3Å; L12-Y18 WeakPolarHBondContact CA-OH 3.36Å; L12-Y18 HydrophobicContact CD2-CE1 4.17Å; L12-F33 HydrophobicContact CD1-CD1 4.09Å; L12-F33 HydrophobicContact CD2-CD1 4.25Å; L12-F33 HydrophobicContact CG-CD1 4.24Å; L12-N34 PolarHBondContact N-O 3.39Å; L12-F35 HydrophobicContact CD1-CE1 4.39Å; L12-H36 WeakPolarHBondContact O-CB 3.41Å; L12-H36 PolarHBondContact O-N 3.5Å; L12-W39 HydrophobicContact CB-CH2 3.94Å; L12-W39 HydrophobicContact CB-CZ3 3.73Å; L12-W39 WeakPolarHBondContact O-CZ3 3.34Å; L12-L46 HydrophobicContact CD1-CD1 3.75Å; L12-F98 HydrophobicContact CD1-CD2 4.18Å; L12-F98 HydrophobicContact CD1-CE2 4.08Å; L12-F98 HydrophobicContact CD2-CD2 4.22Å; L12-F98 HydrophobicContact CD2-CE2 3.42Å; L12-F98 VanDerWaalsContact CD2-CE2 3.42Å; L12-F98 HydrophobicContact CD2-CZ 3.91Å; L12-F98 HydrophobicContact CG-CE2 4.42Å; L12-L100 HydrophobicContact CD1-CD1 4.08Å
13	E	90.7	Very high	86	Confident	66 Å²	66	51.9 Å²	51.9	31%	0.308	25%	0.249	S	C	.	.			trans	-126.4	143.6	-174.1	-68.1	160.2	-143.2	0	0	109.9	K16 Y18	E13-K16 HydrophobicContact CB-CB 4.44Å; E13-K16 HydrophobicContact CB-CD 4.08Å; E13-K16 IonicContact OE1-NZ 3.68Å; E13-K16 PolarHBondContact OE1-NZ 2.6Å; E13-K16 WeakPolarHBondContact OE2-CD 3.27Å; E13-K16 IonicContact OE2-NZ 2.76Å; E13-K16 PolarHBondContact OE2-NZ 2.58Å; E13-Y18 PolarHBondContact N-OH 2.72Å
14	P	88.5	Confident	87.9	Confident	42 Å²	42	45.1 Å²	45.1	27%	0.273	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	149.4	177.4	29.1	-35.8	0	0	0	111.9	K16 X38 W39	P14-K16 PolarHBondContact O-N 3.27Å; P14-K16 VanDerWaalsContact O-N 3.15Å; P14-A38 HydrophobicContact CG-CB 4.1Å; P14-W39 HydrophobicContact CB-CZ2 4.06Å
15	R	85.8	Confident	89.6	Confident	251 Å²	251	41.5 Å²	41.5	95%	0.947	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.3	13.4	175	-53.4	177.8	179.2	170.1	-0.4	116.6
16	K	88.8	Confident	90.6	Very high	67 Å²	67	41.5 Å²	41.5	29%	0.291	20%	0.201	S	C	.	.			trans	-91.4	132	178.3	-174.8	162.2	178.5	175.5	0	110.8	E13 P14 Y18 M21	E13-K16 HydrophobicContact CB-CB 4.44Å; E13-K16 HydrophobicContact CB-CD 4.08Å; E13-K16 IonicContact OE1-NZ 3.68Å; E13-K16 PolarHBondContact OE1-NZ 2.6Å; E13-K16 WeakPolarHBondContact OE2-CD 3.27Å; E13-K16 IonicContact OE2-NZ 2.76Å; E13-K16 PolarHBondContact OE2-NZ 2.58Å; P14-K16 PolarHBondContact O-N 3.27Å; P14-K16 VanDerWaalsContact O-N 3.15Å; K16-Y18 HydrophobicContact CB-CD2 4.1Å; K16-Y18 HydrophobicContact CB-CE2 3.6Å; K16-Y18 HydrophobicContact CD-CE1 4.27Å; K16-Y18 HydrophobicContact CD-CE2 4.18Å; K16-Y18 HydrophobicContact CG-CD2 4.3Å; K16-Y18 HydrophobicContact CG-CE1 4.4Å; K16-Y18 HydrophobicContact CG-CE2 3.9Å; K16-Y18 WeakPolarHBondContact O-CD2 3.24Å; K16-Y18 PolarHBondContact O-N 3.05Å; K16-M21 HydrophobicContact CG-CE 3.93Å; K16-M21 HydrophobicContact CG-SD 4.16Å
17	D	91	Very high	90.9	Very high	63 Å²	63	43.8 Å²	43.8	34%	0.337	21%	0.207	S	C	.	.			trans	-78.5	84.6	-179.5	-175.9	-7.5	0	0	0	111.1	E19 S20 M21 R579	D17-E19 PolarHBondContact O-N 3.19Å; D17-E19 WeakPolarHBondContact OD1-CA 3.2Å; D17-E19 WeakPolarHBondContact OD1-CB 3.39Å; D17-E19 PolarHBondContact OD1-N 3.08Å; D17-S20 VanDerWaalsContact CG-OG 3.22Å; D17-S20 PolarHBondContact OD1-N 3.46Å; D17-S20 PolarHBondContact OD1-OG 3.17Å; D17-S20 VanDerWaalsContact OD2-CB 3.26Å; D17-S20 WeakPolarHBondContact OD2-CB 3.38Å; D17-S20 PolarHBondContact OD2-OG 3.4Å; D17-M21 WeakPolarHBondContact O-CG 3.22Å; D17-M21 PolarHBondContact O-N 3.12Å; D17-R579 IonicContact OD1-NH2 2.71Å; D17-R579 IonicContact OD2-CZ 2.8Å; D17-R579 IonicContact OD2-NH2 2.61Å; D17-R579 PolarHBondContact OD2-NH2 3.28Å
18	Y	93.9	Very high	90.8	Very high	1 Å²	1	45.7 Å²	45.7	0%	0.004	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-2.8	174.1	-64.3	-87	0	0	0	113.8	F10 T11 L12 E13 K16 Y23 F98 V112 G114 Y115	F10-Y18 HydrophobicContact CE2-CD1 4.07Å; F10-Y18 AromaticContact CE2-CE1 3.63Å; F10-Y18 HydrophobicContact CE2-CE1 3.63Å; F10-Y18 AromaticContact CZ-CD1 3.74Å; F10-Y18 HydrophobicContact CZ-CD1 3.74Å; F10-Y18 AromaticContact CZ-CE1 3.75Å; F10-Y18 HydrophobicContact CZ-CE1 3.75Å; T11-Y18 PolarHBondContact O-OH 3.22Å; T11-Y18 VanDerWaalsContact O-OH 3.14Å; L12-Y18 VanDerWaalsContact CA-OH 3.3Å; L12-Y18 WeakPolarHBondContact CA-OH 3.36Å; L12-Y18 HydrophobicContact CD2-CE1 4.17Å; E13-Y18 PolarHBondContact N-OH 2.72Å; K16-Y18 HydrophobicContact CB-CD2 4.1Å; K16-Y18 HydrophobicContact CB-CE2 3.6Å; K16-Y18 HydrophobicContact CD-CE1 4.27Å; K16-Y18 HydrophobicContact CD-CE2 4.18Å; K16-Y18 HydrophobicContact CG-CD2 4.3Å; K16-Y18 HydrophobicContact CG-CE1 4.4Å; K16-Y18 HydrophobicContact CG-CE2 3.9Å; K16-Y18 WeakPolarHBondContact O-CD2 3.24Å; K16-Y18 PolarHBondContact O-N 3.05Å; Y18-Y23 AromaticContact CD1-CE2 3.72Å; Y18-Y23 HydrophobicContact CD1-CE2 3.72Å; Y18-Y23 AromaticContact CD1-CZ 3.92Å; Y18-Y23 HydrophobicContact CE1-CE2 4.39Å; Y18-Y23 WeakPolarHBondContact CE1-OH 3.36Å; Y18-F98 AromaticContact CD1-CZ 3.86Å; Y18-F98 HydrophobicContact CD1-CZ 3.86Å; Y18-F98 AromaticContact CG-CZ 3.89Å; Y18-F98 HydrophobicContact CG-CZ 3.89Å; Y18-V112 HydrophobicContact CD2-CG1 3.42Å; Y18-V112 VanDerWaalsContact CD2-CG1 3.42Å; Y18-V112 HydrophobicContact CE2-CG1 3.73Å; Y18-V112 HydrophobicContact CG-CG1 4.3Å; Y18-G114 VanDerWaalsContact O-CA 3.3Å; Y18-G114 WeakPolarHBondContact O-CA 3.23Å; Y18-Y115 PolarHBondContact O-N 2.9Å
19	E	91.8	Very high	90.8	Very high	67 Å²	67	45.2 Å²	45.2	31%	0.313	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-30	172.5	-58.5	-168.8	96.6	0	0	111.8	D17 I113 N582	D17-E19 PolarHBondContact O-N 3.19Å; D17-E19 WeakPolarHBondContact OD1-CA 3.2Å; D17-E19 WeakPolarHBondContact OD1-CB 3.39Å; D17-E19 PolarHBondContact OD1-N 3.08Å; E19-I113 HydrophobicContact CG-CG2 4.06Å; E19-N582 PolarHBondContact O-ND2 3.22Å
20	S	90.1	Very high	90.9	Very high	37 Å²	37	47.3 Å²	47.3	26%	0.259	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.8	-13.5	175.6	-58	0	0	0	0	114.2	D17 S578 R579	D17-S20 VanDerWaalsContact CG-OG 3.22Å; D17-S20 PolarHBondContact OD1-N 3.46Å; D17-S20 PolarHBondContact OD1-OG 3.17Å; D17-S20 VanDerWaalsContact OD2-CB 3.26Å; D17-S20 WeakPolarHBondContact OD2-CB 3.38Å; D17-S20 PolarHBondContact OD2-OG 3.4Å; S20-S578 WeakPolarHBondContact O-CB 3.49Å; S20-S578 PolarHBondContact O-OG 3.19Å; S20-R579 PolarHBondContact OG-NE 2.79Å; S20-R579 PolarHBondContact OG-NH2 3.35Å
21	M	93.1	Very high	90.9	Very high	60 Å²	60	47.2 Å²	47.2	30%	0.296	23%	0.233	S	C	.	.	S	Bend	trans	-89.2	143.7	177.3	-70.8	-178.5	-172.3	0	0	111.8	K16 D17 Y23 N582 P627	K16-M21 HydrophobicContact CG-CE 3.93Å; K16-M21 HydrophobicContact CG-SD 4.16Å; D17-M21 WeakPolarHBondContact O-CG 3.22Å; D17-M21 PolarHBondContact O-N 3.12Å; M21-Y23 HydrophobicContact CB-CD2 4.29Å; M21-Y23 HydrophobicContact CB-CE2 3.47Å; M21-Y23 VanDerWaalsContact CB-CE2 3.47Å; M21-Y23 PolarHBondContact SD-OH 3.44Å; M21-N582 PolarHBondContact O-ND2 3.33Å; M21-P627 HydrophobicContact CB-CB 4.4Å
22	L	94.1	Very high	91	Very high	4 Å²	4	47.6 Å²	47.6	2%	0.021	23%	0.229	C	C	.	.			trans	-106.4	114.3	-178	-60.4	179.5	0	0	0	111.3	F24 S578 I581 N582 P627 R628 I630	L22-F24 HydrophobicContact CB-CD2 4.37Å; L22-F24 HydrophobicContact CB-CE2 3.62Å; L22-F24 HydrophobicContact CB-CZ 4.17Å; L22-F24 HydrophobicContact CD1-CE2 4.19Å; L22-F24 HydrophobicContact CD1-CZ 4.33Å; L22-F24 HydrophobicContact CG-CE2 4.44Å; L22-S578 WeakPolarHBondContact CD2-O 3.32Å; L22-I581 HydrophobicContact CD1-CD1 4.01Å; L22-I581 HydrophobicContact CD1-CG2 4.33Å; L22-I581 HydrophobicContact CD2-CB 3.97Å; L22-I581 HydrophobicContact CD2-CG2 3.68Å; L22-N582 VanDerWaalsContact CD2-OD1 3.31Å; L22-N582 WeakPolarHBondContact CD2-OD1 3.15Å; L22-P627 CarbonylContact O-C 3.56Å; L22-P627 WeakPolarHBondContact O-CA 3.4Å; L22-R628 PolarHBondContact O-N 3.39Å; L22-I630 HydrophobicContact CD1-CG1 4.21Å
23	Y	95.3	Very high	91.1	Very high	4 Å²	4	47.6 Å²	47.6	2%	0.016	23%	0.229	C	C	.	.			trans	-113.5	118.8	177.3	-60.8	-83.6	0	0	0	110.3	F10 Y18 M21 Y115 H117 L625 P627	F10-Y23 HydrophobicContact CD2-CE1 4.29Å; F10-Y23 AromaticContact CE2-CD1 3.89Å; F10-Y23 HydrophobicContact CE2-CD1 3.89Å; F10-Y23 HydrophobicContact CE2-CD2 4.38Å; F10-Y23 AromaticContact CE2-CE1 3.44Å; F10-Y23 HydrophobicContact CE2-CE1 3.44Å; F10-Y23 VanDerWaalsContact CE2-CE1 3.44Å; F10-Y23 HydrophobicContact CE2-CE2 4.03Å; F10-Y23 HydrophobicContact CE2-CG 4.31Å; F10-Y23 AromaticContact CE2-CZ 3.52Å; F10-Y23 HydrophobicContact CZ-CD1 4.01Å; F10-Y23 AromaticContact CZ-CD2 3.8Å; F10-Y23 HydrophobicContact CZ-CD2 3.8Å; F10-Y23 AromaticContact CZ-CE1 3.86Å; F10-Y23 HydrophobicContact CZ-CE1 3.86Å; F10-Y23 AromaticContact CZ-CE2 3.69Å; F10-Y23 HydrophobicContact CZ-CE2 3.69Å; F10-Y23 AromaticContact CZ-CG 3.96Å; F10-Y23 HydrophobicContact CZ-CG 3.96Å; F10-Y23 AromaticContact CZ-CZ 3.7Å; Y18-Y23 AromaticContact CD1-CE2 3.72Å; Y18-Y23 HydrophobicContact CD1-CE2 3.72Å; Y18-Y23 AromaticContact CD1-CZ 3.92Å; Y18-Y23 HydrophobicContact CE1-CE2 4.39Å; Y18-Y23 WeakPolarHBondContact CE1-OH 3.36Å; M21-Y23 HydrophobicContact CB-CD2 4.29Å; M21-Y23 HydrophobicContact CB-CE2 3.47Å; M21-Y23 VanDerWaalsContact CB-CE2 3.47Å; M21-Y23 PolarHBondContact SD-OH 3.44Å; Y23-Y115 WeakPolarHBondContact CD2-O 3.08Å; Y23-H117 PolarHBondContact O-N 3.28Å; Y23-L625 HydrophobicContact CD1-CG 4Å; Y23-P627 HydrophobicContact CE1-CB 4.06Å; Y23-P627 HydrophobicContact CE1-CG 4.49Å
24	F	93.2	Very high	91.1	Very high	6 Å²	6	46.7 Å²	46.7	3%	0.026	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	129.5	180	-58.3	-86.9	0	0	0	111.5	L22 H117 L119 I581 R628 P631	L22-F24 HydrophobicContact CB-CD2 4.37Å; L22-F24 HydrophobicContact CB-CE2 3.62Å; L22-F24 HydrophobicContact CB-CZ 4.17Å; L22-F24 HydrophobicContact CD1-CE2 4.19Å; L22-F24 HydrophobicContact CD1-CZ 4.33Å; L22-F24 HydrophobicContact CG-CE2 4.44Å; F24-H117 WeakPolarHBondContact CA-O 3.48Å; F24-H117 HydrophobicContact CD1-CB 3.47Å; F24-H117 VanDerWaalsContact CD1-CB 3.47Å; F24-H117 AromaticContact CD1-CG 3.93Å; F24-H117 HydrophobicContact CE1-CB 3.86Å; F24-H117 AromaticContact CE1-CD2 3.86Å; F24-H117 AromaticContact CE1-CG 3.79Å; F24-H117 HydrophobicContact CG-CB 4.36Å; F24-L119 HydrophobicContact CB-CD1 4.2Å; F24-L119 HydrophobicContact CB-CD2 4.35Å; F24-L119 HydrophobicContact CB-CG 4.19Å; F24-L119 HydrophobicContact CD1-CD2 3.65Å; F24-L119 HydrophobicContact CD1-CG 4.34Å; F24-L119 HydrophobicContact CE1-CD2 4.4Å; F24-L119 HydrophobicContact CG-CD2 4.34Å; F24-I581 HydrophobicContact CZ-CG2 4.22Å; F24-R628 HydrophobicContact CD2-CB 4.01Å; F24-R628 HydrophobicContact CD2-CG 4.23Å; F24-R628 HydrophobicContact CE2-CB 4.47Å; F24-R628 PolarHBondContact O-NE 3.15Å; F24-R628 PolarHBondContact O-NH2 2.91Å; F24-P631 HydrophobicContact CE1-CG 4.4Å; F24-P631 HydrophobicContact CZ-CB 4.35Å; F24-P631 HydrophobicContact CZ-CG 3.83Å
25	V	92.5	Very high	91.2	Very high	1 Å²	1	45.5 Å²	45.5	1%	0.006	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	149.1	173.6	-64.6	0	0	0	0	111.3	F8 I31 C90 H117 I118 L119 L625	F8-V25 HydrophobicContact CD2-CG1 4.06Å; F8-V25 HydrophobicContact CE2-CG1 4.4Å; F8-V25 HydrophobicContact CG-CG1 4.46Å; V25-I31 HydrophobicContact CG1-CD1 4.08Å; V25-I31 HydrophobicContact CG1-CG1 4.01Å; V25-I31 HydrophobicContact CG2-CD1 4.1Å; V25-I31 HydrophobicContact CG2-CG1 4.49Å; V25-C90 HydrophobicContact CG2-CB 4.2Å; V25-H117 PolarHBondContact N-O 3.14Å; V25-I118 HydrophobicContact CG2-CB 4.43Å; V25-I118 HydrophobicContact CG2-CG1 3.85Å; V25-L119 PolarHBondContact O-N 2.84Å; V25-L625 HydrophobicContact CG1-CD1 3.61Å; V25-L625 HydrophobicContact CG1-CD2 4.01Å; V25-L625 HydrophobicContact CG1-CG 4.49Å
26	E	88	Confident	91.4	Very high	79 Å²	79	36 Å²	36	37%	0.369	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	141.1	175.7	-73.1	144.3	-144.2	0	0	110.7	G28 S29	E26-G28 PolarHBondContact O-N 3.03Å; E26-S29 WeakPolarHBondContact O-CB 3.39Å; E26-S29 PolarHBondContact O-N 3.02Å; E26-S29 PolarHBondContact O-OG 3.49Å
27	K	86.5	Confident	91.3	Very high	85 Å²	85	33.1 Å²	33.1	37%	0.37	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	130.1	172.8	177.9	178.7	175.5	-179.2	0	111.1	V91 I118 N121	K27-V91 WeakPolarHBondContact CE-O 3.4Å; K27-V91 WeakPolarHBondContact CG-O 3.26Å; K27-I118 HydrophobicContact CB-CG2 4.29Å; K27-N121 HydrophobicContact CB-CB 4.48Å; K27-N121 HydrophobicContact CD-CB 4.02Å
28	G	84.9	Confident	91.1	Very high	45 Å²	45	32.6 Å²	32.6	46%	0.464	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	100.2	-14.7	-174.5	0	0	0	0	0	114	E26 C90	E26-G28 PolarHBondContact O-N 3.03Å; G28-C90 PolarHBondContact N-O 3.41Å
29	S	90.6	Very high	90.9	Very high	5 Å²	5	32.9 Å²	32.9	4%	0.035	18%	0.177	C	C	.	.			trans	-67.6	167.2	174.5	-53.3	0	0	0	0	112.4	S6 E26 C90	S6-S29 CarbonylContact O-C 3.56Å; S6-S29 VanDerWaalsContact O-CA 3.23Å; S6-S29 WeakPolarHBondContact O-CA 3.38Å; S6-S29 VanDerWaalsContact O-CB 3.31Å; S6-S29 WeakPolarHBondContact O-CB 3.32Å; E26-S29 WeakPolarHBondContact O-CB 3.39Å; E26-S29 PolarHBondContact O-N 3.02Å; E26-S29 PolarHBondContact O-OG 3.49Å; S29-C90 VanDerWaalsContact O-CB 3.32Å; S29-C90 WeakPolarHBondContact O-CB 3.39Å; S29-C90 PolarHBondContact O-N 2.96Å
30	K	92.3	Very high	90.8	Very high	61 Å²	61	30.1 Å²	30.1	27%	0.265	16%	0.164	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	152.6	161.8	-65	-176.5	171	-169.3	0	110.7	S6 T7 F8 E87 L88	S6-K30 PolarHBondContact O-N 3.24Å; T7-K30 HydrophobicContact CG2-CB 3.98Å; F8-K30 PolarHBondContact N-O 3.27Å; K30-E87 IonicContact NZ-OE2 3.3Å; K30-E87 PolarHBondContact NZ-OE2 2.84Å; K30-L88 CarbonylContact C-O 3.22Å; K30-L88 VanDerWaalsContact CA-O 3.23Å; K30-L88 WeakPolarHBondContact CA-O 3.24Å
31	I	94.1	Very high	90.5	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	129.7	163.7	-61.1	171.9	0	0	0	107.5	F8 F10 V25 F33 E87 L88 F116 L625	F8-I31 CarbonylContact O-C 3.33Å; F8-I31 WeakPolarHBondContact O-CA 3.06Å; F10-I31 HydrophobicContact CB-CG2 3.89Å; F10-I31 HydrophobicContact CD1-CG2 4.26Å; V25-I31 HydrophobicContact CG1-CD1 4.08Å; V25-I31 HydrophobicContact CG1-CG1 4.01Å; V25-I31 HydrophobicContact CG2-CD1 4.1Å; V25-I31 HydrophobicContact CG2-CG1 4.49Å; I31-F33 HydrophobicContact CB-CE2 4.2Å; I31-F33 HydrophobicContact CG2-CD1 4.45Å; I31-F33 HydrophobicContact CG2-CD2 3.9Å; I31-F33 HydrophobicContact CG2-CE1 4.23Å; I31-F33 HydrophobicContact CG2-CE2 3.62Å; I31-F33 HydrophobicContact CG2-CG 4.31Å; I31-F33 HydrophobicContact CG2-CZ 3.81Å; I31-E87 CarbonylContact O-C 3.51Å; I31-E87 WeakPolarHBondContact O-CA 3.3Å; I31-L88 PolarHBondContact N-O 2.81Å; I31-L88 PolarHBondContact O-N 2.73Å; I31-F116 HydrophobicContact CD1-CB 4.3Å; I31-F116 HydrophobicContact CD1-CD2 3.62Å; I31-F116 HydrophobicContact CD1-CE2 4.06Å; I31-F116 HydrophobicContact CD1-CG 3.92Å; I31-L625 HydrophobicContact CD1-CD2 4.09Å; I31-L625 HydrophobicContact CG1-CD2 4.18Å; I31-L625 HydrophobicContact CG2-CD2 4.27Å
32	R	93.3	Very high	90.3	Very high	55 Å²	55	29.6 Å²	29.6	21%	0.208	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	105.9	170	179.7	179.7	-68.6	-178.1	-3.8	108.5	T7 F8 V9 F10 Y85 A86 E87	T7-R32 HydrophobicContact CG2-CB 4.17Å; F8-R32 PolarHBondContact O-N 3.03Å; V9-R32 CarbonylContact C-O 3.41Å; V9-R32 WeakPolarHBondContact CA-O 3.13Å; F10-R32 PolarHBondContact N-O 2.99Å; R32-Y85 HydrophobicContact CG-CD2 3.6Å; R32-Y85 HydrophobicContact CG-CE2 4.39Å; R32-Y85 HydrophobicContact CG-CG 3.89Å; R32-A86 CarbonylContact C-O 3.48Å; R32-A86 VanDerWaalsContact CA-O 3.26Å; R32-A86 WeakPolarHBondContact CA-O 3.37Å; R32-E87 HydrophobicContact CB-CG 4Å; R32-E87 HydrophobicContact CG-CG 4.17Å; R32-E87 IonicContact CZ-OE1 3.88Å; R32-E87 VanDerWaalsContact CZ-OE1 3.24Å; R32-E87 IonicContact NE-OE1 3.85Å; R32-E87 PolarHBondContact NE-OE1 3.36Å; R32-E87 IonicContact NH2-OE1 2.72Å; R32-E87 PolarHBondContact NH2-OE1 2.84Å
33	F	94.3	Very high	89.9	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	121	175.8	-63.8	-93.8	0	0	0	110.1	F10 L12 I31 L46 L69 Y85 A86 L88 F98 F116	F10-F33 HydrophobicContact CB-CD1 4.48Å; F10-F33 AromaticContact CD1-CD1 3.76Å; F10-F33 HydrophobicContact CD1-CD1 3.76Å; F10-F33 AromaticContact CD1-CE1 3.49Å; F10-F33 HydrophobicContact CD1-CE1 3.49Å; F10-F33 VanDerWaalsContact CD1-CE1 3.49Å; F10-F33 HydrophobicContact CD1-CZ 4.35Å; F10-F33 HydrophobicContact CE1-CD1 4.47Å; F10-F33 AromaticContact CE1-CE1 3.94Å; F10-F33 HydrophobicContact CE1-CE1 3.94Å; F10-F33 HydrophobicContact CG-CD1 4.43Å; F10-F33 CarbonylContact O-C 3.58Å; F10-F33 VanDerWaalsContact O-CA 3.31Å; F10-F33 WeakPolarHBondContact O-CA 3.44Å; L12-F33 HydrophobicContact CD1-CD1 4.09Å; L12-F33 HydrophobicContact CD2-CD1 4.25Å; L12-F33 HydrophobicContact CG-CD1 4.24Å; I31-F33 HydrophobicContact CB-CE2 4.2Å; I31-F33 HydrophobicContact CG2-CD1 4.45Å; I31-F33 HydrophobicContact CG2-CD2 3.9Å; I31-F33 HydrophobicContact CG2-CE1 4.23Å; I31-F33 HydrophobicContact CG2-CE2 3.62Å; I31-F33 HydrophobicContact CG2-CG 4.31Å; I31-F33 HydrophobicContact CG2-CZ 3.81Å; F33-L46 HydrophobicContact CB-CD2 3.66Å; F33-L46 HydrophobicContact CD1-CD2 4.1Å; F33-L46 HydrophobicContact CD2-CD2 3.84Å; F33-L46 HydrophobicContact CE2-CD2 4.49Å; F33-L46 HydrophobicContact CG-CD2 3.61Å; F33-L69 HydrophobicContact CD2-CD1 4.22Å; F33-L69 HydrophobicContact CE2-CD1 4.03Å; F33-Y85 CarbonylContact O-C 3.15Å; F33-Y85 WeakPolarHBondContact O-CA 3.44Å; F33-Y85 VanDerWaalsContact O-CB 3.3Å; F33-Y85 WeakPolarHBondContact O-CB 3.48Å; F33-A86 HydrophobicContact CB-CB 4.25Å; F33-A86 HydrophobicContact CD2-CB 4.48Å; F33-A86 PolarHBondContact N-O 3.28Å; F33-A86 PolarHBondContact O-N 3.16Å; F33-L88 HydrophobicContact CE2-CB 4.29Å; F33-F98 HydrophobicContact CE1-CB 4.33Å; F33-F98 HydrophobicContact CE1-CD1 4.39Å; F33-F98 HydrophobicContact CE1-CD2 4.25Å; F33-F98 HydrophobicContact CE1-CG 4.06Å; F33-F98 HydrophobicContact CZ-CB 4.47Å; F33-F116 HydrophobicContact CZ-CD1 4.37Å; F33-F116 HydrophobicContact CZ-CE1 4.21Å
34	N	91.2	Very high	89.7	Confident	48 Å²	48	37.3 Å²	37.3	26%	0.257	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	161.3	171.6	-73.3	11.4	0	0	0	109.7	V9 F10 T11 L12 Y85	V9-N34 HydrophobicContact CG1-CB 4.49Å; V9-N34 WeakPolarHBondContact CG1-ND2 3.35Å; F10-N34 PolarHBondContact O-N 3.26Å; T11-N34 HydrophobicContact CG2-CB 4.44Å; L12-N34 PolarHBondContact N-O 3.39Å; N34-Y85 WeakPolarHBondContact OD1-CB 3.46Å
35	F	91.3	Very high	89.6	Confident	17 Å²	17	38.8 Å²	38.8	8%	0.075	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	144	-173.5	-54	-69.6	0	0	0	111.8	L12 W39 I44 L46 L71 Q84 L100	L12-F35 HydrophobicContact CD1-CE1 4.39Å; F35-W39 HydrophobicContact CB-CE3 4.1Å; F35-W39 HydrophobicContact CD1-CE3 4.46Å; F35-W39 HydrophobicContact CD1-CZ3 4.46Å; F35-I44 HydrophobicContact CB-CD1 4.34Å; F35-I44 HydrophobicContact CD1-CD1 3.82Å; F35-I44 HydrophobicContact CD2-CD1 3.4Å; F35-I44 HydrophobicContact CE1-CD1 3.94Å; F35-I44 HydrophobicContact CE2-CD1 3.53Å; F35-I44 HydrophobicContact CG-CD1 3.55Å; F35-I44 HydrophobicContact CZ-CD1 3.8Å; F35-L46 HydrophobicContact CE1-CD2 4.41Å; F35-L46 HydrophobicContact CZ-CD2 4.31Å; F35-L71 HydrophobicContact CE2-CD2 3.97Å; F35-L71 HydrophobicContact CZ-CD2 3.7Å; F35-Q84 HydrophobicContact CD2-CB 4.41Å; F35-Q84 HydrophobicContact CD2-CG 4.35Å; F35-Q84 HydrophobicContact CE2-CG 4.23Å; F35-L100 HydrophobicContact CD1-CD1 3.65Å; F35-L100 HydrophobicContact CE1-CD1 3.82Å
36	H	90.3	Very high	89.6	Confident	51 Å²	51	38.8 Å²	38.8	24%	0.236	20%	0.204	C	C	.	.			trans	-70.4	153.6	177.4	-161	-103.5	0	0	0	112.4	L12 X38 W39 E1487	L12-H36 WeakPolarHBondContact O-CB 3.41Å; L12-H36 PolarHBondContact O-N 3.5Å; H36-A38 PolarHBondContact ND1-N 3.23Å; H36-A38 PolarHBondContact O-N 3.33Å; H36-A38 VanDerWaalsContact O-N 3.13Å; H36-W39 HydrophobicContact CB-CE3 4.28Å; H36-W39 HydrophobicContact CB-CZ3 4.28Å; H36-W39 PolarHBondContact O-N 3.16Å; H36-E1487 IonicContact CE1-OE2 2.62Å
37	S	86.7	Confident	89.9	Confident	7 Å²	7	37.1 Å²	37.1	5%	0.049	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-46.2	-42.5	175.2	50.5	0	0	0	0	113.1	W39 F40 A1483 E1487	S37-W39 PolarHBondContact O-N 3.42Å; S37-F40 WeakPolarHBondContact O-CB 3.26Å; S37-F40 WeakPolarHBondContact O-CG 3.5Å; S37-F40 PolarHBondContact O-N 2.87Å; S37-A1483 WeakPolarHBondContact O-CB 3.3Å; S37-E1487 PolarHBondContact OG-OE2 2.61Å
38	X	86.7	Confident	90.3	Very high	51 Å²	51	33 Å²	33	42%	0.421	18%	0.177	S	C	.	.	G	3₁₀ helix	trans	-54.2	-22.5	-177.4	0	0	0	0	0	115.6	P14 H36 Q42	P14-A38 HydrophobicContact CG-CB 4.1Å; H36-A38 PolarHBondContact ND1-N 3.23Å; H36-A38 PolarHBondContact O-N 3.33Å; H36-A38 VanDerWaalsContact O-N 3.13Å; A38-Q42 PolarHBondContact O-NE2 3.13Å
39	W	89.5	Confident	90.6	Very high	7 Å²	7	31.9 Å²	31.9	3%	0.027	16%	0.161	C	C	.	.	G	3₁₀ helix	trans	-102.1	0.3	179.3	-54.2	-47.6	0	0	0	114.1	L12 P14 F35 H36 S37 Q42 I44 L100 L102 E111 V112	L12-W39 HydrophobicContact CB-CH2 3.94Å; L12-W39 HydrophobicContact CB-CZ3 3.73Å; L12-W39 WeakPolarHBondContact O-CZ3 3.34Å; P14-W39 HydrophobicContact CB-CZ2 4.06Å; F35-W39 HydrophobicContact CB-CE3 4.1Å; F35-W39 HydrophobicContact CD1-CE3 4.46Å; F35-W39 HydrophobicContact CD1-CZ3 4.46Å; H36-W39 HydrophobicContact CB-CE3 4.28Å; H36-W39 HydrophobicContact CB-CZ3 4.28Å; H36-W39 PolarHBondContact O-N 3.16Å; S37-W39 PolarHBondContact O-N 3.42Å; W39-Q42 VanDerWaalsContact O-CB 3.28Å; W39-Q42 WeakPolarHBondContact O-CB 2.98Å; W39-Q42 PolarHBondContact O-N 3.3Å; W39-I44 HydrophobicContact CB-CG2 3.9Å; W39-L100 HydrophobicContact CD2-CD1 4.46Å; W39-L100 HydrophobicContact CD2-CD2 4.44Å; W39-L100 HydrophobicContact CE3-CD1 3.88Å; W39-L100 HydrophobicContact CH2-CD1 4Å; W39-L100 HydrophobicContact CZ2-CD2 4.46Å; W39-L100 HydrophobicContact CZ3-CD1 3.63Å; W39-L102 HydrophobicContact CB-CD2 4.29Å; W39-L102 HydrophobicContact CG-CD2 4Å; W39-E111 HydrophobicContact CZ2-CG 4.15Å; W39-V112 HydrophobicContact CH2-CG2 3.73Å; W39-V112 HydrophobicContact CZ2-CG2 3.65Å
40	F	88	Confident	90.7	Very high	10 Å²	10	32.1 Å²	32.1	4%	0.044	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	140.2	177	-61.8	-18.3	0	0	0	111.4	S37 Q42 D81 F82 Q1480 A1483 W1486	S37-F40 WeakPolarHBondContact O-CB 3.26Å; S37-F40 WeakPolarHBondContact O-CG 3.5Å; S37-F40 PolarHBondContact O-N 2.87Å; F40-Q42 PolarHBondContact O-N 3.22Å; F40-D81 HydrophobicContact CB-CB 4.31Å; F40-D81 HydrophobicContact CD1-CB 3.94Å; F40-D81 HydrophobicContact CG-CB 4.24Å; F40-F82 AromaticContact CD2-CD1 3.65Å; F40-F82 HydrophobicContact CD2-CD1 3.65Å; F40-F82 AromaticContact CD2-CE1 3.42Å; F40-F82 HydrophobicContact CD2-CE1 3.42Å; F40-F82 VanDerWaalsContact CD2-CE1 3.42Å; F40-F82 HydrophobicContact CD2-CG 4.37Å; F40-F82 AromaticContact CD2-CZ 4Å; F40-F82 HydrophobicContact CD2-CZ 4Å; F40-F82 HydrophobicContact CE2-CB 4.48Å; F40-F82 AromaticContact CE2-CD1 3.23Å; F40-F82 HydrophobicContact CE2-CD1 3.23Å; F40-F82 AromaticContact CE2-CE1 3.48Å; F40-F82 HydrophobicContact CE2-CE1 3.48Å; F40-F82 VanDerWaalsContact CE2-CE1 3.48Å; F40-F82 HydrophobicContact CE2-CG 4.01Å; F40-F82 HydrophobicContact CE2-CZ 4.42Å; F40-F82 HydrophobicContact CZ-CD1 4.07Å; F40-Q1480 VanDerWaalsContact O-CG 3.31Å; F40-Q1480 WeakPolarHBondContact O-CG 3.21Å; F40-A1483 HydrophobicContact CB-CB 4.23Å; F40-A1483 HydrophobicContact CD2-CB 3.8Å; F40-A1483 HydrophobicContact CG-CB 4.44Å; F40-W1486 AromaticContact CE2-CD1 3.65Å; F40-W1486 HydrophobicContact CE2-CG 4.36Å
41	G	84.8	Confident	90.4	Very high	10 Å²	10	32.8 Å²	32.8	10%	0.103	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.6	5.4	-169.7	0	0	0	0	0	114.6	D81 S1476	G41-D81 PolarHBondContact N-OD2 2.74Å; G41-S1476 VanDerWaalsContact O-CB 3.29Å; G41-S1476 WeakPolarHBondContact O-CB 3.29Å; G41-S1476 PolarHBondContact O-OG 2.81Å
42	Q	88	Confident	89.7	Confident	75 Å²	75	33.9 Å²	33.9	35%	0.35	17%	0.173	S	C	.	.	S	Bend	trans	-107.2	151.2	171.6	-50.7	-168.6	43.7	0	0	110.9	X38 W39 F40 I44 L102	A38-Q42 PolarHBondContact O-NE2 3.13Å; W39-Q42 VanDerWaalsContact O-CB 3.28Å; W39-Q42 WeakPolarHBondContact O-CB 2.98Å; W39-Q42 PolarHBondContact O-N 3.3Å; F40-Q42 PolarHBondContact O-N 3.22Å; Q42-I44 PolarHBondContact O-N 3.08Å; Q42-I44 VanDerWaalsContact O-N 3.1Å; Q42-L102 HydrophobicContact CB-CD2 4.47Å
43	K	87.4	Confident	88.8	Confident	156 Å²	156	37.6 Å²	37.6	68%	0.678	20%	0.196	S	C	*	.			trans	-76.3	98.4	173.4	-174.5	-177.7	179.9	-176.2	0	109.5	G103	K43-G103 PolarHBondContact O-N 3.39Å
44	I	90.1	Very high	87.4	Confident	15 Å²	15	41.6 Å²	41.6	8%	0.077	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	145.1	174.9	62.9	168.3	0	0	0	111.6	F35 W39 Q42 L71 L102	F35-I44 HydrophobicContact CB-CD1 4.34Å; F35-I44 HydrophobicContact CD1-CD1 3.82Å; F35-I44 HydrophobicContact CD2-CD1 3.4Å; F35-I44 HydrophobicContact CE1-CD1 3.94Å; F35-I44 HydrophobicContact CE2-CD1 3.53Å; F35-I44 HydrophobicContact CG-CD1 3.55Å; F35-I44 HydrophobicContact CZ-CD1 3.8Å; W39-I44 HydrophobicContact CB-CG2 3.9Å; Q42-I44 PolarHBondContact O-N 3.08Å; Q42-I44 VanDerWaalsContact O-N 3.1Å; I44-L71 HydrophobicContact CD1-CD1 4.1Å; I44-L71 HydrophobicContact CG1-CD1 3.78Å; I44-L102 HydrophobicContact CG2-CD2 3.86Å
45	S	91.1	Very high	86	Confident	36 Å²	36	46 Å²	46	25%	0.252	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	131.9	167.4	-51.6	0	0	0	0	109.4	L100 L101	S45-L100 WeakPolarHBondContact O-CA 3.43Å; S45-L101 PolarHBondContact N-O 3.41Å; S45-L101 PolarHBondContact O-N 2.72Å
46	L	93.4	Very high	84.5	Confident	2 Å²	2	48.5 Å²	48.5	1%	0.01	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	129.6	-179.5	-175.3	71.7	0	0	0	109.9	L12 F33 F35 L69 L71 A86 L100	L12-L46 HydrophobicContact CD1-CD1 3.75Å; F33-L46 HydrophobicContact CB-CD2 3.66Å; F33-L46 HydrophobicContact CD1-CD2 4.1Å; F33-L46 HydrophobicContact CD2-CD2 3.84Å; F33-L46 HydrophobicContact CE2-CD2 4.49Å; F33-L46 HydrophobicContact CG-CD2 3.61Å; F35-L46 HydrophobicContact CE1-CD2 4.41Å; F35-L46 HydrophobicContact CZ-CD2 4.31Å; L46-L69 HydrophobicContact CD2-CB 4.42Å; L46-L69 HydrophobicContact CD2-CD1 3.77Å; L46-L69 HydrophobicContact CG-CD1 4.19Å; L46-L69 PolarHBondContact O-N 3.29Å; L46-L71 HydrophobicContact CB-CD2 4.36Å; L46-A86 HydrophobicContact CD2-CB 3.68Å; L46-L100 HydrophobicContact CD1-CB 4.34Å
47	Y	93.5	Very high	83.7	Confident	43 Å²	43	53.2 Å²	53.2	17%	0.169	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	156	177.2	-69	-101.5	0	0	0	111	V59 W66 Y67 P68 F98 C99 L101 I107	Y47-V59 HydrophobicContact CE1-CG2 4.08Å; Y47-W66 HydrophobicContact CD1-CB 4.24Å; Y47-Y67 CarbonylContact C-O 3.54Å; Y47-Y67 VanDerWaalsContact CA-O 3.3Å; Y47-Y67 WeakPolarHBondContact CA-O 3.36Å; Y47-P68 HydrophobicContact CD1-CB 3.98Å; Y47-P68 HydrophobicContact CE1-CB 3.65Å; Y47-P68 HydrophobicContact CE1-CG 4.21Å; Y47-F98 CarbonylContact O-C 3.47Å; Y47-F98 VanDerWaalsContact O-CA 3.23Å; Y47-F98 WeakPolarHBondContact O-CA 3.34Å; Y47-C99 PolarHBondContact N-O 3.16Å; Y47-C99 PolarHBondContact O-N 3.4Å; Y47-L101 HydrophobicContact CD2-CD1 3.79Å; Y47-L101 HydrophobicContact CD2-CG 4.11Å; Y47-L101 HydrophobicContact CE2-CD1 3.52Å; Y47-L101 HydrophobicContact CE2-CG 4.2Å; Y47-I107 HydrophobicContact CD1-CD1 4.02Å; Y47-I107 HydrophobicContact CE1-CD1 4.32Å; Y47-I107 HydrophobicContact CG-CD1 4.22Å
48	T	94.1	Very high	83.6	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	156.6	173.4	-178.9	0	0	0	0	111.5	Y50 Y67 L69 K97	T48-Y50 VanDerWaalsContact C-N 3.27Å; T48-Y50 VanDerWaalsContact CG2-O 3.28Å; T48-Y50 WeakPolarHBondContact CG2-O 3.38Å; T48-Y50 PolarHBondContact OG1-N 3.49Å; T48-Y50 VanDerWaalsContact OG1-N 3.15Å; T48-Y67 PolarHBondContact N-O 3.08Å; T48-Y67 PolarHBondContact O-N 3.23Å; T48-L69 HydrophobicContact CG2-CD1 3.85Å; T48-L69 HydrophobicContact CG2-CD2 3.75Å; T48-L69 HydrophobicContact CG2-CG 3.78Å; T48-K97 CarbonylContact C-O 3.49Å; T48-K97 WeakPolarHBondContact CA-O 3.45Å; T48-K97 WeakPolarHBondContact CB-O 3.43Å; T48-K97 PolarHBondContact OG1-O 3.3Å
49	T	92.8	Very high	83.5	Confident	20 Å²	20	56.4 Å²	56.4	12%	0.123	29%	0.294	C	S	.	.	S	Bend	trans	-85.7	0.1	169.7	65.1	0	0	0	0	113.2	D64 I65 W66 K97	T49-D64 HydrophobicContact CG2-CB 3.75Å; T49-I65 WeakPolarHBondContact CA-O 3.21Å; T49-W66 HydrophobicContact CG2-CD2 3.85Å; T49-W66 HydrophobicContact CG2-CE3 3.91Å; T49-W66 HydrophobicContact CG2-CG 4.47Å; T49-W66 HydrophobicContact CG2-CH2 4.17Å; T49-W66 HydrophobicContact CG2-CZ2 4.08Å; T49-W66 HydrophobicContact CG2-CZ3 4.07Å; T49-K97 HydrophobicContact CG2-CB 3.94Å; T49-K97 HydrophobicContact CG2-CG 4.45Å; T49-K97 PolarHBondContact N-O 2.74Å; T49-K97 PolarHBondContact OG1-N 2.85Å
50	Y	91.4	Very high	83.2	Confident	11 Å²	11	59.9 Å²	59.9	4%	0.043	32%	0.324	C	S	.	.	S	Bend	trans	-82.1	120.8	168.4	-173	-80	0	0	0	110.3	T48 P52 L88 R89 V91 R92 F96 I118	T48-Y50 VanDerWaalsContact C-N 3.27Å; T48-Y50 VanDerWaalsContact CG2-O 3.28Å; T48-Y50 WeakPolarHBondContact CG2-O 3.38Å; T48-Y50 PolarHBondContact OG1-N 3.49Å; T48-Y50 VanDerWaalsContact OG1-N 3.15Å; Y50-P52 VanDerWaalsContact O-CD 3.27Å; Y50-P52 WeakPolarHBondContact O-CD 3.26Å; Y50-L88 HydrophobicContact CD1-CD1 3.4Å; Y50-L88 VanDerWaalsContact CD1-CD1 3.4Å; Y50-L88 HydrophobicContact CD1-CD2 4.02Å; Y50-L88 HydrophobicContact CD1-CG 3.99Å; Y50-L88 HydrophobicContact CE1-CD1 3.89Å; Y50-L88 HydrophobicContact CE1-CG 4.38Å; Y50-L88 HydrophobicContact CG-CD1 4.23Å; Y50-L88 HydrophobicContact CG-CD2 4.01Å; Y50-L88 HydrophobicContact CG-CG 4.47Å; Y50-R89 WeakPolarHBondContact CE1-O 3.33Å; Y50-R89 PolarHBondContact OH-O 3.36Å; Y50-V91 PolarHBondContact OH-N 2.94Å; Y50-R92 HydrophobicContact CE2-CB 3.85Å; Y50-R92 PolarHBondContact OH-N 3.2Å; Y50-R92 VanDerWaalsContact OH-N 3.17Å; Y50-F96 AromaticContact CD2-CD1 3.96Å; Y50-F96 HydrophobicContact CD2-CD1 3.96Å; Y50-F96 AromaticContact CD2-CD2 3.78Å; Y50-F96 HydrophobicContact CD2-CD2 3.78Å; Y50-F96 AromaticContact CD2-CE1 3.91Å; Y50-F96 HydrophobicContact CD2-CE1 3.91Å; Y50-F96 AromaticContact CD2-CE2 3.71Å; Y50-F96 HydrophobicContact CD2-CE2 3.71Å; Y50-F96 AromaticContact CD2-CG 3.91Å; Y50-F96 HydrophobicContact CD2-CG 3.91Å; Y50-F96 AromaticContact CD2-CZ 3.78Å; Y50-F96 HydrophobicContact CD2-CZ 3.78Å; Y50-F96 HydrophobicContact CE2-CE2 4.2Å; Y50-F96 HydrophobicContact CE2-CZ 4.27Å; Y50-F96 HydrophobicContact CG-CD1 4.37Å; Y50-F96 HydrophobicContact CG-CG 4.42Å; Y50-I118 HydrophobicContact CD2-CD1 3.6Å; Y50-I118 HydrophobicContact CE2-CD1 3.35Å
51	E	87	Confident	82.9	Confident	74 Å²	74	61.9 Å²	61.9	35%	0.346	34%	0.338	S	S	.	.	P	Polyproline II helix	trans	-66.6	117.1	176.2	-178.9	169.6	-157	0	0	111	Q55 Y67	E51-Q55 PolarHBondContact OE1-NE2 3.21Å; E51-Y67 HydrophobicContact CB-CD2 4.41Å; E51-Y67 HydrophobicContact CB-CE1 4.04Å; E51-Y67 HydrophobicContact CB-CE2 3.92Å; E51-Y67 HydrophobicContact CG-CD1 4.33Å; E51-Y67 HydrophobicContact CG-CE1 3.75Å
52	P	79	Confident	82.3	Confident	24 Å²	24	69.9 Å²	69.9	16%	0.156	38%	0.378	C	S	.	.	P	Polyproline II helix	trans	-81.9	163.5	178	34.7	-34.5	0	0	0	111.7	Y50 V54 Y67 L69 L88	Y50-P52 VanDerWaalsContact O-CD 3.27Å; Y50-P52 WeakPolarHBondContact O-CD 3.26Å; P52-V54 PolarHBondContact O-N 3.08Å; P52-Y67 VanDerWaalsContact CD-CB 3.45Å; P52-L69 HydrophobicContact CB-CD2 4.2Å; P52-L88 HydrophobicContact CB-CD1 4.46Å
53	D	73.9	Confident	81.7	Confident	133 Å²	133	71.3 Å²	71.3	71%	0.711	39%	0.392	S	S	*	.	S	Bend	trans	-62.6	-14.1	-179.1	-60.9	-34.4	0	0	0	114.1
54	V	65.4	Low	81.6	Confident	83 Å²	83	64.7 Å²	64.7	50%	0.503	36%	0.364	S	S	.	.	S	Bend	trans	-123.5	117	-179.4	-178.5	0	0	0	0	109.8	P52 N56	P52-V54 PolarHBondContact O-N 3.08Å; V54-N56 PolarHBondContact O-N 3.06Å
55	Q	60.8	Low	81.7	Confident	142 Å²	142	68.1 Å²	68.1	66%	0.664	38%	0.382	S	S	*	.			trans	-84.6	113.2	-178.2	-69.6	179.7	-16.7	0	0	111.6	E51	E51-Q55 PolarHBondContact OE1-NE2 3.21Å
56	N	61.5	Low	81.7	Confident	69 Å²	69	67 Å²	67	37%	0.369	37%	0.372	S	S	.	.			trans	-107.4	180	170.4	-82.4	-19.3	0	0	0	110	V54 V58 P68 N70	V54-N56 PolarHBondContact O-N 3.06Å; N56-V58 VanDerWaalsContact O-CG2 3.32Å; N56-V58 WeakPolarHBondContact O-CG2 3.01Å; N56-V58 PolarHBondContact O-N 3.38Å; N56-P68 HydrophobicContact CB-CG 3.68Å; N56-N70 PolarHBondContact ND2-OD1 2.86Å
57	N	73.6	Confident	81.7	Confident	150 Å²	150	68.2 Å²	68.2	80%	0.802	38%	0.377	S	S	*	.			trans	-49.3	101.9	175.6	-72.4	-9.1	0	0	0	112.8	P68	N57-P68 WeakPolarHBondContact O-CD 3.38Å
58	V	83.3	Confident	81.6	Confident	70 Å²	70	67.4 Å²	67.4	42%	0.424	38%	0.377	S	S	.	.			trans	-78.1	141.4	179.7	-177.4	0	0	0	0	110.2	N56 I65 W66 Y67	N56-V58 VanDerWaalsContact O-CG2 3.32Å; N56-V58 WeakPolarHBondContact O-CG2 3.01Å; N56-V58 PolarHBondContact O-N 3.38Å; V58-I65 HydrophobicContact CG1-CG2 3.25Å; V58-W66 WeakPolarHBondContact CG1-O 3.21Å; V58-Y67 HydrophobicContact CG1-CD1 4.4Å; V58-Y67 HydrophobicContact CG1-CE1 4.31Å; V58-Y67 HydrophobicContact CG2-CD1 3.81Å; V58-Y67 HydrophobicContact CG2-CE1 3.89Å
59	V	84.7	Confident	81.4	Confident	55 Å²	55	68 Å²	68	33%	0.333	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	115	173.1	-175.4	0	0	0	0	109.2	Y47 W66 I107	Y47-V59 HydrophobicContact CE1-CG2 4.08Å; V59-W66 HydrophobicContact CB-CB 4.48Å; V59-W66 PolarHBondContact N-O 3.38Å; V59-W66 WeakPolarHBondContact O-CB 3.37Å; V59-W66 PolarHBondContact O-N 3.03Å; V59-I107 HydrophobicContact CB-CD1 3.7Å; V59-I107 HydrophobicContact CG1-CD1 3.73Å; V59-I107 HydrophobicContact CG2-CD1 4.17Å
60	A	83.7	Confident	81.2	Confident	79 Å²	79	71 Å²	71	65%	0.653	40%	0.395	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.8	138.7	172.6	0	0	0	0	0	110.6
61	T	81.9	Confident	81	Confident	53 Å²	53	73 Å²	73	33%	0.325	41%	0.406	S	S	.	.			trans	-117.8	170	166.1	63	0	0	0	0	108.8	T63 D64 I107	T61-T63 PolarHBondContact O-N 3.18Å; T61-D64 PolarHBondContact N-O 3.13Å; T61-D64 PolarHBondContact OG1-N 3.47Å; T61-D64 PolarHBondContact OG1-O 3.4Å; T61-I107 HydrophobicContact CG2-CG2 4.18Å
62	D	72.7	Confident	80.9	Confident	178 Å²	178	72.8 Å²	72.8	95%	0.952	41%	0.407	S	S	*	.	S	Bend	trans	-57.9	-21	-179.6	-58.2	-30.6	0	0	0	114.2
63	T	74.8	Confident	80.7	Confident	104 Å²	104	76.4 Å²	76.4	64%	0.638	42%	0.418	S	S	*	.	S	Bend	trans	-117.2	-36.2	-172.9	51.6	0	0	0	0	114.4	T61	T61-T63 PolarHBondContact O-N 3.18Å
64	D	86.1	Confident	80.6	Confident	17 Å²	17	72.7 Å²	72.7	9%	0.091	41%	0.411	C	S	.	.			trans	-141.4	155.8	-175.8	-64.2	-56	0	0	0	112.8	T49 T61 K97 K555	T49-D64 HydrophobicContact CG2-CB 3.75Å; T61-D64 PolarHBondContact N-O 3.13Å; T61-D64 PolarHBondContact OG1-N 3.47Å; T61-D64 PolarHBondContact OG1-O 3.4Å; D64-K97 WeakPolarHBondContact OD2-CD 3.32Å; D64-K97 VanDerWaalsContact OD2-CE 3.24Å; D64-K97 WeakPolarHBondContact OD2-CE 3.22Å; D64-K97 IonicContact OD2-NZ 3.23Å; D64-K97 PolarHBondContact OD2-NZ 2.99Å; D64-K555 IonicContact OD1-NZ 3.66Å; D64-K555 PolarHBondContact OD1-NZ 3.26Å
65	I	90.2	Very high	81.1	Confident	88 Å²	88	69.6 Å²	69.6	45%	0.451	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	127.5	175.5	-59.7	177	0	0	0	108.4	T49 V58 Y67	T49-I65 WeakPolarHBondContact CA-O 3.21Å; V58-I65 HydrophobicContact CG1-CG2 3.25Å; I65-Y67 HydrophobicContact CB-CE2 4.37Å; I65-Y67 HydrophobicContact CG2-CE1 4.49Å; I65-Y67 HydrophobicContact CG2-CE2 3.82Å
66	W	92.5	Very high	81.6	Confident	11 Å²	11	69 Å²	69	4%	0.042	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	127.8	-174.1	-63.4	86.2	0	0	0	112	Y47 T49 V58 V59 K97 C99 I107 I113	Y47-W66 HydrophobicContact CD1-CB 4.24Å; T49-W66 HydrophobicContact CG2-CD2 3.85Å; T49-W66 HydrophobicContact CG2-CE3 3.91Å; T49-W66 HydrophobicContact CG2-CG 4.47Å; T49-W66 HydrophobicContact CG2-CH2 4.17Å; T49-W66 HydrophobicContact CG2-CZ2 4.08Å; T49-W66 HydrophobicContact CG2-CZ3 4.07Å; V58-W66 WeakPolarHBondContact CG1-O 3.21Å; V59-W66 HydrophobicContact CB-CB 4.48Å; V59-W66 PolarHBondContact N-O 3.38Å; V59-W66 WeakPolarHBondContact O-CB 3.37Å; V59-W66 PolarHBondContact O-N 3.03Å; W66-K97 HydrophobicContact CH2-CB 3.58Å; W66-K97 HydrophobicContact CH2-CD 4.19Å; W66-K97 HydrophobicContact CZ2-CB 4.36Å; W66-K97 HydrophobicContact CZ2-CD 4.24Å; W66-K97 HydrophobicContact CZ3-CB 3.98Å; W66-C99 HydrophobicContact CH2-CB 4.15Å; W66-C99 HydrophobicContact CZ3-CB 3.91Å; W66-C99 VanDerWaalsContact CZ3-SG 3.52Å; W66-I107 HydrophobicContact CB-CD1 3.6Å; W66-I107 HydrophobicContact CD2-CD1 4.38Å; W66-I107 HydrophobicContact CD2-CG2 3.99Å; W66-I107 HydrophobicContact CG-CD1 3.76Å; W66-I107 HydrophobicContact CG-CG2 4.08Å; W66-I107 HydrophobicContact CZ2-CG2 4.22Å; W66-I113 HydrophobicContact CH2-CD1 4.26Å
67	Y	92.4	Very high	82	Confident	29 Å²	29	67.1 Å²	67.1	11%	0.114	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	128.2	-179.6	-57.1	-94.5	0	0	0	109.6	Y47 T48 E51 P52 V58 I65	Y47-Y67 CarbonylContact C-O 3.54Å; Y47-Y67 VanDerWaalsContact CA-O 3.3Å; Y47-Y67 WeakPolarHBondContact CA-O 3.36Å; T48-Y67 PolarHBondContact N-O 3.08Å; T48-Y67 PolarHBondContact O-N 3.23Å; E51-Y67 HydrophobicContact CB-CD2 4.41Å; E51-Y67 HydrophobicContact CB-CE1 4.04Å; E51-Y67 HydrophobicContact CB-CE2 3.92Å; E51-Y67 HydrophobicContact CG-CD1 4.33Å; E51-Y67 HydrophobicContact CG-CE1 3.75Å; P52-Y67 VanDerWaalsContact CD-CB 3.45Å; V58-Y67 HydrophobicContact CG1-CD1 4.4Å; V58-Y67 HydrophobicContact CG1-CE1 4.31Å; V58-Y67 HydrophobicContact CG2-CD1 3.81Å; V58-Y67 HydrophobicContact CG2-CE1 3.89Å; I65-Y67 HydrophobicContact CB-CE2 4.37Å; I65-Y67 HydrophobicContact CG2-CE1 4.49Å; I65-Y67 HydrophobicContact CG2-CE2 3.82Å
68	P	91.3	Very high	81.8	Confident	26 Å²	26	64.6 Å²	64.6	17%	0.169	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	136.6	174.1	29.1	-33.2	0	0	0	110.5	Y47 N56 N57	Y47-P68 HydrophobicContact CD1-CB 3.98Å; Y47-P68 HydrophobicContact CE1-CB 3.65Å; Y47-P68 HydrophobicContact CE1-CG 4.21Å; N56-P68 HydrophobicContact CB-CG 3.68Å; N57-P68 WeakPolarHBondContact O-CD 3.38Å
69	L	90.3	Very high	81.2	Confident	12 Å²	12	62.1 Å²	62.1	6%	0.063	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-92.9	132.8	174.1	-66.2	178.3	0	0	0	110.8	F33 L46 T48 P52 L71 A86 L88	F33-L69 HydrophobicContact CD2-CD1 4.22Å; F33-L69 HydrophobicContact CE2-CD1 4.03Å; L46-L69 HydrophobicContact CD2-CB 4.42Å; L46-L69 HydrophobicContact CD2-CD1 3.77Å; L46-L69 HydrophobicContact CG-CD1 4.19Å; L46-L69 PolarHBondContact O-N 3.29Å; T48-L69 HydrophobicContact CG2-CD1 3.85Å; T48-L69 HydrophobicContact CG2-CD2 3.75Å; T48-L69 HydrophobicContact CG2-CG 3.78Å; P52-L69 HydrophobicContact CB-CD2 4.2Å; L69-L71 PolarHBondContact O-N 3.32Å; L69-A86 HydrophobicContact CB-CB 4.05Å; L69-A86 HydrophobicContact CD1-CB 4.47Å; L69-L88 HydrophobicContact CD2-CD1 3.92Å
70	N	88.5	Confident	80.7	Confident	84 Å²	84	60 Å²	60	45%	0.449	34%	0.336	S	S	.	.	P	Polyproline II helix	trans	-65.5	126	175.7	-71	-28.9	0	0	0	110.3	N56 N72	N56-N70 PolarHBondContact ND2-OD1 2.86Å; N70-N72 PolarHBondContact O-N 2.98Å
71	L	87.5	Confident	80.4	Confident	53 Å²	53	56.7 Å²	56.7	28%	0.277	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	104.6	176.6	-57.4	-178.1	0	0	0	109.3	F35 I44 L46 L69 Q84 Y85 A86	F35-L71 HydrophobicContact CE2-CD2 3.97Å; F35-L71 HydrophobicContact CZ-CD2 3.7Å; I44-L71 HydrophobicContact CD1-CD1 4.1Å; I44-L71 HydrophobicContact CG1-CD1 3.78Å; L46-L71 HydrophobicContact CB-CD2 4.36Å; L69-L71 PolarHBondContact O-N 3.32Å; L71-Q84 HydrophobicContact CB-CG 4.3Å; L71-Q84 VanDerWaalsContact CD1-NE2 3.34Å; L71-Y85 CarbonylContact C-O 3.59Å; L71-A86 HydrophobicContact CD2-CB 4.02Å
72	N	85.9	Confident	80.3	Confident	68 Å²	68	55 Å²	55	36%	0.364	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	161	171.4	-62.4	-42.5	0	0	0	110.5	N70 Y85	N70-N72 PolarHBondContact O-N 2.98Å; N72-Y85 WeakPolarHBondContact CA-O 3.38Å; N72-Y85 HydrophobicContact CB-CD1 4.47Å; N72-Y85 HydrophobicContact CB-CD2 4.02Å; N72-Y85 HydrophobicContact CB-CE1 4.08Å; N72-Y85 HydrophobicContact CB-CE2 3.61Å; N72-Y85 HydrophobicContact CB-CG 4.45Å; N72-Y85 PolarHBondContact N-O 2.95Å; N72-Y85 PolarHBondContact O-N 2.97Å; N72-Y85 VanDerWaalsContact O-O 3.12Å
73	R	74.4	Confident	80.5	Confident	101 Å²	101	47 Å²	47	38%	0.381	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	134.9	174.7	-70.1	176.7	168.4	169.3	-14.9	109.3	S75 K78	R73-S75 PolarHBondContact O-N 2.75Å; R73-K78 VanDerWaalsContact NH1-CA 3.31Å; R73-K78 PolarHBondContact NH1-O 3.07Å; R73-K78 PolarHBondContact NH2-O 3.32Å
74	G	70.9	Confident	81	Confident	55 Å²	55	43.2 Å²	43.2	57%	0.567	23%	0.23	S	C	*	.	S	Bend	trans	-77.2	-4.7	176.8	0	0	0	0	0	114.3	G83	G74-G83 PolarHBondContact N-O 3.41Å
75	S	75.4	Confident	81.2	Confident	17 Å²	17	44.5 Å²	44.5	12%	0.119	23%	0.233	C	C	.	.	S	Bend	trans	-134.2	163.6	-177.9	68	0	0	0	0	111.2	R73 N77 D80 N986 G987	R73-S75 PolarHBondContact O-N 2.75Å; S75-N77 VanDerWaalsContact C-N 3.31Å; S75-D80 VanDerWaalsContact CB-OD2 3.27Å; S75-D80 WeakPolarHBondContact CB-OD2 3.44Å; S75-D80 WeakPolarHBondContact OG-CB 3.43Å; S75-D80 VanDerWaalsContact OG-CG 3.29Å; S75-D80 PolarHBondContact OG-OD2 3.48Å; S75-N986 WeakPolarHBondContact CB-O 3.14Å; S75-G987 WeakPolarHBondContact CB-O 2.94Å
76	I	71.7	Confident	81.3	Confident	131 Å²	131	40.3 Å²	40.3	67%	0.672	21%	0.212	S	C	*	.	S	Bend	trans	-77.8	-22.1	177.7	-55.5	-173.2	0	0	0	110.9	K78 N986	I76-K78 PolarHBondContact O-N 3.02Å; I76-N986 HydrophobicContact CB-CB 4.29Å; I76-N986 HydrophobicContact CD1-CB 4.08Å; I76-N986 WeakPolarHBondContact CD1-OD1 3.29Å; I76-N986 HydrophobicContact CG1-CB 4.14Å; I76-N986 PolarHBondContact N-O 3.01Å
77	N	69.9	Low	81.2	Confident	29 Å²	29	42.1 Å²	42.1	16%	0.155	22%	0.221	C	C	.	.			trans	-71	115.8	-178.5	-175.8	-4.9	0	0	0	111.3	S75 N79 D80 S1530	S75-N77 VanDerWaalsContact C-N 3.31Å; N77-N79 PolarHBondContact O-N 3.3Å; N77-N79 VanDerWaalsContact O-N 3.15Å; N77-N79 PolarHBondContact OD1-N 3.15Å; N77-D80 HydrophobicContact CB-CB 4.16Å; N77-D80 WeakPolarHBondContact O-CB 3.17Å; N77-D80 PolarHBondContact O-N 2.82Å; N77-D80 VanDerWaalsContact O-N 3.12Å; N77-S1530 WeakPolarHBondContact ND2-CB 3.24Å; N77-S1530 PolarHBondContact ND2-OG 3.11Å
78	K	69.7	Low	81.1	Confident	97 Å²	97	41 Å²	41	42%	0.422	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-11.1	178.1	-75.6	172	-179	168.1	0	114.2	R73 I76 M1533 Q1537	R73-K78 VanDerWaalsContact NH1-CA 3.31Å; R73-K78 PolarHBondContact NH1-O 3.07Å; R73-K78 PolarHBondContact NH2-O 3.32Å; I76-K78 PolarHBondContact O-N 3.02Å; K78-M1533 HydrophobicContact CB-CE 3.66Å; K78-M1533 HydrophobicContact CB-SD 3.5Å; K78-M1533 VanDerWaalsContact CB-SD 3.5Å; K78-M1533 HydrophobicContact CD-CE 3.93Å; K78-M1533 HydrophobicContact CG-CE 4.47Å; K78-Q1537 VanDerWaalsContact NZ-NE2 3.11Å
79	N	71	Confident	81.1	Confident	18 Å²	18	46.6 Å²	46.6	10%	0.096	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98	1	173.9	-85.5	-22.4	0	0	0	114.2	N77 D81 K1479 L1529 M1533	N77-N79 PolarHBondContact O-N 3.3Å; N77-N79 VanDerWaalsContact O-N 3.15Å; N77-N79 PolarHBondContact OD1-N 3.15Å; N79-D81 PolarHBondContact O-N 2.71Å; N79-K1479 WeakPolarHBondContact O-CE 3.44Å; N79-K1479 PolarHBondContact O-NZ 3.09Å; N79-L1529 HydrophobicContact CB-CD1 4.35Å; N79-L1529 HydrophobicContact CB-CG 4.35Å; N79-M1533 HydrophobicContact CB-SD 3.93Å; N79-M1533 VanDerWaalsContact ND2-CG 3.32Å; N79-M1533 WeakPolarHBondContact ND2-CG 3.34Å; N79-M1533 PolarHBondContact ND2-SD 3.38Å; N79-M1533 VanDerWaalsContact ND2-SD 3.44Å
80	D	74.6	Confident	81.1	Confident	10 Å²	10	46 Å²	46	5%	0.053	23%	0.231	C	C	.	.			trans	-84.1	99.3	175.2	175.5	35.2	0	0	0	111.8	S75 N77 F82 G83 G988	S75-D80 VanDerWaalsContact CB-OD2 3.27Å; S75-D80 WeakPolarHBondContact CB-OD2 3.44Å; S75-D80 WeakPolarHBondContact OG-CB 3.43Å; S75-D80 VanDerWaalsContact OG-CG 3.29Å; S75-D80 PolarHBondContact OG-OD2 3.48Å; N77-D80 HydrophobicContact CB-CB 4.16Å; N77-D80 WeakPolarHBondContact O-CB 3.17Å; N77-D80 PolarHBondContact O-N 2.82Å; N77-D80 VanDerWaalsContact O-N 3.12Å; D80-F82 WeakPolarHBondContact OD1-CA 3.3Å; D80-F82 VanDerWaalsContact OD1-CB 3.26Å; D80-F82 WeakPolarHBondContact OD1-CB 3.34Å; D80-F82 WeakPolarHBondContact OD1-CD2 3.19Å; D80-F82 PolarHBondContact OD1-N 3.18Å; D80-G83 PolarHBondContact OD1-N 3.37Å; D80-G83 PolarHBondContact OD2-N 2.71Å; D80-G988 WeakPolarHBondContact OD2-CA 3.36Å
81	D	77.3	Confident	81.1	Confident	9 Å²	9	45.1 Å²	45.1	5%	0.048	23%	0.229	C	C	.	.			trans	-82.9	-18.7	171.7	-60.2	-1.8	0	0	0	111.3	F40 G41 N79 G83 Q84 K1479	F40-D81 HydrophobicContact CB-CB 4.31Å; F40-D81 HydrophobicContact CD1-CB 3.94Å; F40-D81 HydrophobicContact CG-CB 4.24Å; G41-D81 PolarHBondContact N-OD2 2.74Å; N79-D81 PolarHBondContact O-N 2.71Å; D81-G83 VanDerWaalsContact C-N 3.26Å; D81-G83 PolarHBondContact O-N 2.91Å; D81-Q84 VanDerWaalsContact O-CB 3.31Å; D81-Q84 WeakPolarHBondContact O-CB 3.3Å; D81-Q84 PolarHBondContact O-N 3.37Å; D81-Q84 VanDerWaalsContact O-N 3.13Å; D81-K1479 HydrophobicContact CB-CD 4.32Å; D81-K1479 VanDerWaalsContact CG-CD 3.48Å; D81-K1479 IonicContact OD1-NZ 3.36Å; D81-K1479 PolarHBondContact OD1-NZ 3.15Å; D81-K1479 WeakPolarHBondContact OD2-CD 3.18Å; D81-K1479 IonicContact OD2-NZ 3.85Å; D81-K1479 PolarHBondContact OD2-NZ 2.97Å; D81-K1479 VanDerWaalsContact OD2-NZ 3.17Å
82	F	79.3	Confident	81.2	Confident	19 Å²	19	47.6 Å²	47.6	8%	0.083	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-26.7	-178	-52.5	-94.1	0	0	0	112.2	F40 D80 P989 L990 L1482 W1486	F40-F82 AromaticContact CD2-CD1 3.65Å; F40-F82 HydrophobicContact CD2-CD1 3.65Å; F40-F82 AromaticContact CD2-CE1 3.42Å; F40-F82 HydrophobicContact CD2-CE1 3.42Å; F40-F82 VanDerWaalsContact CD2-CE1 3.42Å; F40-F82 HydrophobicContact CD2-CG 4.37Å; F40-F82 AromaticContact CD2-CZ 4Å; F40-F82 HydrophobicContact CD2-CZ 4Å; F40-F82 HydrophobicContact CE2-CB 4.48Å; F40-F82 AromaticContact CE2-CD1 3.23Å; F40-F82 HydrophobicContact CE2-CD1 3.23Å; F40-F82 AromaticContact CE2-CE1 3.48Å; F40-F82 HydrophobicContact CE2-CE1 3.48Å; F40-F82 VanDerWaalsContact CE2-CE1 3.48Å; F40-F82 HydrophobicContact CE2-CG 4.01Å; F40-F82 HydrophobicContact CE2-CZ 4.42Å; F40-F82 HydrophobicContact CZ-CD1 4.07Å; D80-F82 WeakPolarHBondContact OD1-CA 3.3Å; D80-F82 VanDerWaalsContact OD1-CB 3.26Å; D80-F82 WeakPolarHBondContact OD1-CB 3.34Å; D80-F82 WeakPolarHBondContact OD1-CD2 3.19Å; D80-F82 PolarHBondContact OD1-N 3.18Å; F82-P989 WeakPolarHBondContact O-CG 3.49Å; F82-L990 HydrophobicContact CB-CB 4.24Å; F82-L990 HydrophobicContact CD1-CB 3.93Å; F82-L990 HydrophobicContact CD1-CD2 3.93Å; F82-L990 HydrophobicContact CD2-CB 4.33Å; F82-L990 HydrophobicContact CD2-CD2 4.2Å; F82-L990 HydrophobicContact CE1-CB 4.46Å; F82-L990 HydrophobicContact CE1-CD2 3.59Å; F82-L990 HydrophobicContact CE2-CD2 3.88Å; F82-L990 HydrophobicContact CG-CB 3.9Å; F82-L990 HydrophobicContact CG-CD2 4.26Å; F82-L990 HydrophobicContact CZ-CD2 3.59Å; F82-L1482 HydrophobicContact CE2-CB 4.49Å; F82-L1482 HydrophobicContact CZ-CB 3.69Å; F82-W1486 HydrophobicContact CD1-CB 3.85Å; F82-W1486 HydrophobicContact CD1-CD2 4.1Å; F82-W1486 AromaticContact CD1-CG 3.7Å; F82-W1486 HydrophobicContact CD1-CG 3.7Å; F82-W1486 HydrophobicContact CE1-CB 3.69Å; F82-W1486 HydrophobicContact CE1-CG 4.05Å
83	G	76.2	Confident	81.4	Confident	8 Å²	8	44.7 Å²	44.7	8%	0.082	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.9	8.5	173.8	0	0	0	0	0	115.1	G74 D80 D81 Y85	G74-G83 PolarHBondContact N-O 3.41Å; D80-G83 PolarHBondContact OD1-N 3.37Å; D80-G83 PolarHBondContact OD2-N 2.71Å; D81-G83 VanDerWaalsContact C-N 3.26Å; D81-G83 PolarHBondContact O-N 2.91Å; G83-Y85 WeakPolarHBondContact O-CD1 3.34Å
84	Q	86.3	Confident	82.2	Confident	26 Å²	26	40.1 Å²	40.1	12%	0.121	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	134.8	-174.2	-166.1	172.4	25.2	0	0	112.6	F35 L71 D81	F35-Q84 HydrophobicContact CD2-CB 4.41Å; F35-Q84 HydrophobicContact CD2-CG 4.35Å; F35-Q84 HydrophobicContact CE2-CG 4.23Å; L71-Q84 HydrophobicContact CB-CG 4.3Å; L71-Q84 VanDerWaalsContact CD1-NE2 3.34Å; D81-Q84 VanDerWaalsContact O-CB 3.31Å; D81-Q84 WeakPolarHBondContact O-CB 3.3Å; D81-Q84 PolarHBondContact O-N 3.37Å; D81-Q84 VanDerWaalsContact O-N 3.13Å
85	Y	90.4	Very high	83.3	Confident	44 Å²	44	39.3 Å²	39.3	17%	0.173	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	159.1	177.2	66.4	-90.7	0	0	0	112.4	R32 F33 N34 L71 N72 G83 E87	R32-Y85 HydrophobicContact CG-CD2 3.6Å; R32-Y85 HydrophobicContact CG-CE2 4.39Å; R32-Y85 HydrophobicContact CG-CG 3.89Å; F33-Y85 CarbonylContact O-C 3.15Å; F33-Y85 WeakPolarHBondContact O-CA 3.44Å; F33-Y85 VanDerWaalsContact O-CB 3.3Å; F33-Y85 WeakPolarHBondContact O-CB 3.48Å; N34-Y85 WeakPolarHBondContact OD1-CB 3.46Å; L71-Y85 CarbonylContact C-O 3.59Å; N72-Y85 WeakPolarHBondContact CA-O 3.38Å; N72-Y85 HydrophobicContact CB-CD1 4.47Å; N72-Y85 HydrophobicContact CB-CD2 4.02Å; N72-Y85 HydrophobicContact CB-CE1 4.08Å; N72-Y85 HydrophobicContact CB-CE2 3.61Å; N72-Y85 HydrophobicContact CB-CG 4.45Å; N72-Y85 PolarHBondContact N-O 2.95Å; N72-Y85 PolarHBondContact O-N 2.97Å; N72-Y85 VanDerWaalsContact O-O 3.12Å; G83-Y85 WeakPolarHBondContact O-CD1 3.34Å; Y85-E87 HydrophobicContact CD2-CG 4.08Å; Y85-E87 HydrophobicContact CE2-CG 3.93Å
86	A	91.1	Very high	84.2	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	146.8	166.1	0	0	0	0	0	110.4	R32 F33 L46 L69 L71	R32-A86 CarbonylContact C-O 3.48Å; R32-A86 VanDerWaalsContact CA-O 3.26Å; R32-A86 WeakPolarHBondContact CA-O 3.37Å; F33-A86 HydrophobicContact CB-CB 4.25Å; F33-A86 HydrophobicContact CD2-CB 4.48Å; F33-A86 PolarHBondContact N-O 3.28Å; F33-A86 PolarHBondContact O-N 3.16Å; L46-A86 HydrophobicContact CD2-CB 3.68Å; L69-A86 HydrophobicContact CB-CB 4.05Å; L69-A86 HydrophobicContact CD1-CB 4.47Å; L71-A86 HydrophobicContact CD2-CB 4.02Å
87	E	90.5	Very high	85.3	Confident	48 Å²	48	34.6 Å²	34.6	22%	0.224	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	139.5	175.2	-97.8	-175	-146.5	0	0	112.4	K30 I31 R32 Y85	K30-E87 IonicContact NZ-OE2 3.3Å; K30-E87 PolarHBondContact NZ-OE2 2.84Å; I31-E87 CarbonylContact O-C 3.51Å; I31-E87 WeakPolarHBondContact O-CA 3.3Å; R32-E87 HydrophobicContact CB-CG 4Å; R32-E87 HydrophobicContact CG-CG 4.17Å; R32-E87 IonicContact CZ-OE1 3.88Å; R32-E87 VanDerWaalsContact CZ-OE1 3.24Å; R32-E87 IonicContact NE-OE1 3.85Å; R32-E87 PolarHBondContact NE-OE1 3.36Å; R32-E87 IonicContact NH2-OE1 2.72Å; R32-E87 PolarHBondContact NH2-OE1 2.84Å; Y85-E87 HydrophobicContact CD2-CG 4.08Å; Y85-E87 HydrophobicContact CE2-CG 3.93Å
88	L	90.9	Very high	86.5	Confident	5 Å²	5	33.2 Å²	33.2	3%	0.026	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	127.1	178.1	-173.4	66.6	0	0	0	110.6	K30 I31 F33 Y50 P52 L69 F116	K30-L88 CarbonylContact C-O 3.22Å; K30-L88 VanDerWaalsContact CA-O 3.23Å; K30-L88 WeakPolarHBondContact CA-O 3.24Å; I31-L88 PolarHBondContact N-O 2.81Å; I31-L88 PolarHBondContact O-N 2.73Å; F33-L88 HydrophobicContact CE2-CB 4.29Å; Y50-L88 HydrophobicContact CD1-CD1 3.4Å; Y50-L88 VanDerWaalsContact CD1-CD1 3.4Å; Y50-L88 HydrophobicContact CD1-CD2 4.02Å; Y50-L88 HydrophobicContact CD1-CG 3.99Å; Y50-L88 HydrophobicContact CE1-CD1 3.89Å; Y50-L88 HydrophobicContact CE1-CG 4.38Å; Y50-L88 HydrophobicContact CG-CD1 4.23Å; Y50-L88 HydrophobicContact CG-CD2 4.01Å; Y50-L88 HydrophobicContact CG-CG 4.47Å; P52-L88 HydrophobicContact CB-CD1 4.46Å; L69-L88 HydrophobicContact CD2-CD1 3.92Å; L88-F116 HydrophobicContact CD2-CE1 4.31Å; L88-F116 HydrophobicContact CD2-CE2 3.87Å; L88-F116 HydrophobicContact CD2-CZ 3.42Å; L88-F116 VanDerWaalsContact CD2-CZ 3.42Å
89	R	91.1	Very high	87.7	Confident	145 Å²	145	28.6 Å²	28.6	55%	0.547	13%	0.133	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	118.5	174.7	-167.1	-174.8	-175.8	-177.6	0.9	110.5	Y50 V91	Y50-R89 WeakPolarHBondContact CE1-O 3.33Å; Y50-R89 PolarHBondContact OH-O 3.36Å; R89-V91 HydrophobicContact CG-CG2 3.89Å; R89-V91 PolarHBondContact O-N 3.19Å
90	C	90.4	Very high	88.8	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	13%	0.129	C	C	.	.			trans	-90.2	83.9	-170.8	-65.3	0	0	0	0	111.8	V25 G28 S29 I118	V25-C90 HydrophobicContact CG2-CB 4.2Å; G28-C90 PolarHBondContact N-O 3.41Å; S29-C90 VanDerWaalsContact O-CB 3.32Å; S29-C90 WeakPolarHBondContact O-CB 3.39Å; S29-C90 PolarHBondContact O-N 2.96Å; C90-I118 HydrophobicContact CB-CD1 3.5Å; C90-I118 VanDerWaalsContact CB-CD1 3.5Å; C90-I118 HydrophobicContact CB-CG1 3.78Å; C90-I118 HydrophobicContact CB-CG2 4.18Å
91	V	88.2	Confident	89.7	Confident	65 Å²	65	27.8 Å²	27.8	39%	0.394	13%	0.129	S	C	.	.			trans	-102.5	-39.4	-176.1	-172.1	0	0	0	0	112.7	K27 Y50 R89	K27-V91 WeakPolarHBondContact CE-O 3.4Å; K27-V91 WeakPolarHBondContact CG-O 3.26Å; Y50-V91 PolarHBondContact OH-N 2.94Å; R89-V91 HydrophobicContact CG-CG2 3.89Å; R89-V91 PolarHBondContact O-N 3.19Å
92	R	89.1	Confident	90.3	Very high	104 Å²	104	28.2 Å²	28.2	39%	0.392	13%	0.131	S	C	.	.	S	Bend	trans	-88.5	121.2	179.1	-178.3	175.6	61.9	173.9	-0.5	110.6	Y50 F96 I118	Y50-R92 HydrophobicContact CE2-CB 3.85Å; Y50-R92 PolarHBondContact OH-N 3.2Å; Y50-R92 VanDerWaalsContact OH-N 3.17Å; R92-F96 HydrophobicContact CG-CZ 4.22Å; R92-F96 VanDerWaalsContact O-CE2 3.31Å; R92-F96 WeakPolarHBondContact O-CE2 3.37Å; R92-I118 WeakPolarHBondContact O-CB 3.27Å; R92-I118 WeakPolarHBondContact O-CD1 3.24Å
93	P	90.7	Very high	90.6	Very high	7 Å²	7	29.4 Å²	29.4	5%	0.045	15%	0.149	C	C	.	.			trans	-70.5	154.4	175.7	32.4	-38.7	0	0	0	112.5	I118 P120 P562	P93-I118 CarbonylContact C-O 3.17Å; P93-I118 VanDerWaalsContact CA-O 3.26Å; P93-I118 WeakPolarHBondContact CA-O 3.46Å; P93-I118 WeakPolarHBondContact CB-O 3.3Å; P93-P120 HydrophobicContact CB-CB 4.38Å; P93-P562 VanDerWaalsContact CG-C 3.49Å; P93-P562 HydrophobicContact CG-CB 3.79Å; P93-P562 VanDerWaalsContact CG-O 3.24Å; P93-P562 WeakPolarHBondContact CG-O 3.38Å
94	G	91.4	Very high	90.8	Very high	5 Å²	5	35.8 Å²	35.8	5%	0.052	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	136.2	175	178.7	0	0	0	0	0	113.7	F96 H117 I118	G94-F96 VanDerWaalsContact O-CD2 3.29Å; G94-F96 WeakPolarHBondContact O-CD2 3.47Å; G94-F96 VanDerWaalsContact O-CE2 3.25Å; G94-F96 WeakPolarHBondContact O-CE2 3.47Å; G94-H117 WeakPolarHBondContact O-CA 3.27Å; G94-I118 PolarHBondContact N-O 3.43Å; G94-I118 PolarHBondContact O-N 2.7Å
95	P	93.6	Very high	90.7	Very high	39 Å²	39	37.6 Å²	37.6	25%	0.253	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	137.6	167.9	33.2	-33.6	0	0	0	110.2
96	F	94.7	Very high	90.5	Very high	15 Å²	15	38.4 Å²	38.4	7%	0.066	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	145.2	173.9	-60.5	-75.9	0	0	0	110.1	Y50 R92 G94 Y115 F116 I118	Y50-F96 AromaticContact CD2-CD1 3.96Å; Y50-F96 HydrophobicContact CD2-CD1 3.96Å; Y50-F96 AromaticContact CD2-CD2 3.78Å; Y50-F96 HydrophobicContact CD2-CD2 3.78Å; Y50-F96 AromaticContact CD2-CE1 3.91Å; Y50-F96 HydrophobicContact CD2-CE1 3.91Å; Y50-F96 AromaticContact CD2-CE2 3.71Å; Y50-F96 HydrophobicContact CD2-CE2 3.71Å; Y50-F96 AromaticContact CD2-CG 3.91Å; Y50-F96 HydrophobicContact CD2-CG 3.91Å; Y50-F96 AromaticContact CD2-CZ 3.78Å; Y50-F96 HydrophobicContact CD2-CZ 3.78Å; Y50-F96 HydrophobicContact CE2-CE2 4.2Å; Y50-F96 HydrophobicContact CE2-CZ 4.27Å; Y50-F96 HydrophobicContact CG-CD1 4.37Å; Y50-F96 HydrophobicContact CG-CG 4.42Å; R92-F96 HydrophobicContact CG-CZ 4.22Å; R92-F96 VanDerWaalsContact O-CE2 3.31Å; R92-F96 WeakPolarHBondContact O-CE2 3.37Å; G94-F96 VanDerWaalsContact O-CD2 3.29Å; G94-F96 WeakPolarHBondContact O-CD2 3.47Å; G94-F96 VanDerWaalsContact O-CE2 3.25Å; G94-F96 WeakPolarHBondContact O-CE2 3.47Å; F96-Y115 CarbonylContact O-C 3.58Å; F96-Y115 WeakPolarHBondContact O-CA 3.36Å; F96-F116 HydrophobicContact CB-CD1 4.44Å; F96-F116 HydrophobicContact CB-CD2 4.3Å; F96-F116 HydrophobicContact CB-CE1 3.88Å; F96-F116 HydrophobicContact CB-CE2 3.73Å; F96-F116 HydrophobicContact CB-CZ 3.49Å; F96-F116 VanDerWaalsContact CB-CZ 3.49Å; F96-F116 HydrophobicContact CD2-CE2 4Å; F96-F116 HydrophobicContact CG-CE2 4.2Å; F96-F116 HydrophobicContact CG-CZ 4.25Å; F96-F116 PolarHBondContact N-O 2.9Å; F96-F116 PolarHBondContact O-N 3.11Å; F96-I118 HydrophobicContact CD2-CD1 3.88Å; F96-I118 HydrophobicContact CD2-CG1 4.15Å; F96-I118 HydrophobicContact CE2-CB 4.35Å; F96-I118 HydrophobicContact CE2-CD1 3.79Å; F96-I118 HydrophobicContact CE2-CG1 4.2Å
97	K	95.2	Very high	90.3	Very high	33 Å²	33	39.6 Å²	39.6	14%	0.143	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	154	176.2	-55.7	178.6	-172.7	178.1	0	109.6	T48 T49 D64 W66 G114 Y115	T48-K97 CarbonylContact C-O 3.49Å; T48-K97 WeakPolarHBondContact CA-O 3.45Å; T48-K97 WeakPolarHBondContact CB-O 3.43Å; T48-K97 PolarHBondContact OG1-O 3.3Å; T49-K97 HydrophobicContact CG2-CB 3.94Å; T49-K97 HydrophobicContact CG2-CG 4.45Å; T49-K97 PolarHBondContact N-O 2.74Å; T49-K97 PolarHBondContact OG1-N 2.85Å; D64-K97 WeakPolarHBondContact OD2-CD 3.32Å; D64-K97 VanDerWaalsContact OD2-CE 3.24Å; D64-K97 WeakPolarHBondContact OD2-CE 3.22Å; D64-K97 IonicContact OD2-NZ 3.23Å; D64-K97 PolarHBondContact OD2-NZ 2.99Å; W66-K97 HydrophobicContact CH2-CB 3.58Å; W66-K97 HydrophobicContact CH2-CD 4.19Å; W66-K97 HydrophobicContact CZ2-CB 4.36Å; W66-K97 HydrophobicContact CZ2-CD 4.24Å; W66-K97 HydrophobicContact CZ3-CB 3.98Å; K97-G114 CarbonylContact C-O 3.29Å; K97-G114 VanDerWaalsContact CA-O 3.26Å; K97-G114 WeakPolarHBondContact CA-O 3.5Å; K97-Y115 HydrophobicContact CD-CE1 4.19Å; K97-Y115 VanDerWaalsContact CE-OH 3.32Å; K97-Y115 WeakPolarHBondContact CE-OH 3.44Å; K97-Y115 HydrophobicContact CG-CD1 3.95Å; K97-Y115 HydrophobicContact CG-CE1 3.66Å
98	F	95.3	Very high	90	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	150	164	67.4	-84.2	0	0	0	109.4	F10 L12 Y18 F33 Y47 V112 I113 G114 F116	F10-F98 HydrophobicContact CE1-CD1 4.4Å; F10-F98 AromaticContact CE1-CE1 3.65Å; F10-F98 HydrophobicContact CE1-CE1 3.65Å; F10-F98 HydrophobicContact CE1-CE2 4.46Å; F10-F98 AromaticContact CE1-CZ 3.68Å; F10-F98 HydrophobicContact CE1-CZ 3.68Å; F10-F98 HydrophobicContact CZ-CE1 4.04Å; F10-F98 AromaticContact CZ-CZ 3.8Å; F10-F98 HydrophobicContact CZ-CZ 3.8Å; L12-F98 HydrophobicContact CD1-CD2 4.18Å; L12-F98 HydrophobicContact CD1-CE2 4.08Å; L12-F98 HydrophobicContact CD2-CD2 4.22Å; L12-F98 HydrophobicContact CD2-CE2 3.42Å; L12-F98 VanDerWaalsContact CD2-CE2 3.42Å; L12-F98 HydrophobicContact CD2-CZ 3.91Å; L12-F98 HydrophobicContact CG-CE2 4.42Å; Y18-F98 AromaticContact CD1-CZ 3.86Å; Y18-F98 HydrophobicContact CD1-CZ 3.86Å; Y18-F98 AromaticContact CG-CZ 3.89Å; Y18-F98 HydrophobicContact CG-CZ 3.89Å; F33-F98 HydrophobicContact CE1-CB 4.33Å; F33-F98 HydrophobicContact CE1-CD1 4.39Å; F33-F98 HydrophobicContact CE1-CD2 4.25Å; F33-F98 HydrophobicContact CE1-CG 4.06Å; F33-F98 HydrophobicContact CZ-CB 4.47Å; Y47-F98 CarbonylContact O-C 3.47Å; Y47-F98 VanDerWaalsContact O-CA 3.23Å; Y47-F98 WeakPolarHBondContact O-CA 3.34Å; F98-V112 HydrophobicContact CE2-CG1 4.07Å; F98-I113 WeakPolarHBondContact O-CA 3.25Å; F98-G114 VanDerWaalsContact CD1-C 3.49Å; F98-G114 VanDerWaalsContact CD1-O 3.32Å; F98-G114 WeakPolarHBondContact CD1-O 3.21Å; F98-G114 PolarHBondContact N-O 3.36Å; F98-G114 PolarHBondContact O-N 2.94Å; F98-F116 HydrophobicContact CB-CE1 4.4Å; F98-F116 AromaticContact CD1-CD1 3.92Å; F98-F116 HydrophobicContact CD1-CD1 3.92Å; F98-F116 HydrophobicContact CD1-CE1 4.48Å
99	C	94.4	Very high	89.8	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	146	170.5	72	0	0	0	0	112.1	Y47 W66 P110 V112 I113	Y47-C99 PolarHBondContact N-O 3.16Å; Y47-C99 PolarHBondContact O-N 3.4Å; W66-C99 HydrophobicContact CH2-CB 4.15Å; W66-C99 HydrophobicContact CZ3-CB 3.91Å; W66-C99 VanDerWaalsContact CZ3-SG 3.52Å; C99-P110 HydrophobicContact CB-CB 3.86Å; C99-P110 HydrophobicContact CB-CG 4.4Å; C99-V112 CarbonylContact C-O 3.43Å; C99-V112 WeakPolarHBondContact CA-O 3.3Å; C99-V112 WeakPolarHBondContact CB-O 3.43Å; C99-I113 HydrophobicContact CB-CB 4.33Å; C99-I113 HydrophobicContact CB-CG1 4.33Å
100	L	94.5	Very high	89.7	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	129.2	177.5	-172.8	150.8	0	0	0	109	L12 F35 W39 S45 L46 L102 E111 V112	L12-L100 HydrophobicContact CD1-CD1 4.08Å; F35-L100 HydrophobicContact CD1-CD1 3.65Å; F35-L100 HydrophobicContact CE1-CD1 3.82Å; W39-L100 HydrophobicContact CD2-CD1 4.46Å; W39-L100 HydrophobicContact CD2-CD2 4.44Å; W39-L100 HydrophobicContact CE3-CD1 3.88Å; W39-L100 HydrophobicContact CH2-CD1 4Å; W39-L100 HydrophobicContact CZ2-CD2 4.46Å; W39-L100 HydrophobicContact CZ3-CD1 3.63Å; S45-L100 WeakPolarHBondContact O-CA 3.43Å; L46-L100 HydrophobicContact CD1-CB 4.34Å; L100-L102 HydrophobicContact CD2-CD2 3.72Å; L100-L102 HydrophobicContact CD2-CG 4.03Å; L100-E111 HydrophobicContact CD2-CB 4.08Å; L100-E111 HydrophobicContact CD2-CG 4.29Å; L100-E111 PolarHBondContact O-N 3.43Å; L100-V112 HydrophobicContact CB-CB 4.05Å; L100-V112 HydrophobicContact CB-CG2 4.49Å; L100-V112 PolarHBondContact N-O 3.07Å; L100-V112 PolarHBondContact O-N 3.26Å
101	L	92.9	Very high	89.7	Confident	11 Å²	11	44.7 Å²	44.7	6%	0.058	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	137.3	176.8	-47.5	-178.1	0	0	0	109.4	S45 Y47 N105 I107 P110	S45-L101 PolarHBondContact N-O 3.41Å; S45-L101 PolarHBondContact O-N 2.72Å; Y47-L101 HydrophobicContact CD2-CD1 3.79Å; Y47-L101 HydrophobicContact CD2-CG 4.11Å; Y47-L101 HydrophobicContact CE2-CD1 3.52Å; Y47-L101 HydrophobicContact CE2-CG 4.2Å; L101-N105 HydrophobicContact CB-CB 4.41Å; L101-N105 WeakPolarHBondContact CD1-O 3.42Å; L101-I107 HydrophobicContact CD1-CG1 3.89Å; L101-P110 HydrophobicContact CD2-CB 3.76Å
102	L	90	Very high	90	Very high	18 Å²	18	42 Å²	42	9%	0.094	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	133.5	171.9	-63.5	179	0	0	0	109.9	W39 Q42 I44 L100 T104 N105 E111	W39-L102 HydrophobicContact CB-CD2 4.29Å; W39-L102 HydrophobicContact CG-CD2 4Å; Q42-L102 HydrophobicContact CB-CD2 4.47Å; I44-L102 HydrophobicContact CG2-CD2 3.86Å; L100-L102 HydrophobicContact CD2-CD2 3.72Å; L100-L102 HydrophobicContact CD2-CG 4.03Å; L102-T104 PolarHBondContact O-N 2.58Å; L102-N105 WeakPolarHBondContact O-CB 3.17Å; L102-N105 VanDerWaalsContact O-CG 3.32Å; L102-N105 PolarHBondContact O-N 2.72Å; L102-N105 PolarHBondContact O-OD1 3.44Å; L102-E111 HydrophobicContact CD1-CB 4.05Å; L102-E111 HydrophobicContact CD1-CG 3.62Å; L102-E111 HydrophobicContact CG-CB 3.96Å; L102-E111 HydrophobicContact CG-CG 3.99Å
103	G	85.4	Confident	90.2	Very high	44 Å²	44	39.5 Å²	39.5	45%	0.454	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.2	-104.9	171.1	0	0	0	0	0	113.7	K43	K43-G103 PolarHBondContact O-N 3.39Å
104	T	80.1	Confident	90.5	Very high	143 Å²	143	39.2 Å²	39.2	88%	0.877	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-111.1	7.7	-178.8	53.7	0	0	0	0	113.5	L102	L102-T104 PolarHBondContact O-N 2.58Å
105	N	85.6	Confident	90.7	Very high	64 Å²	64	40 Å²	40	34%	0.342	25%	0.245	S	C	.	.			trans	-59.3	140.3	178	-71.8	10.9	0	0	0	111.3	L101 L102	L101-N105 HydrophobicContact CB-CB 4.41Å; L101-N105 WeakPolarHBondContact CD1-O 3.42Å; L102-N105 WeakPolarHBondContact O-CB 3.17Å; L102-N105 VanDerWaalsContact O-CG 3.32Å; L102-N105 PolarHBondContact O-N 2.72Å; L102-N105 PolarHBondContact O-OD1 3.44Å
106	S	85.5	Confident	90.8	Very high	60 Å²	60	38.1 Å²	38.1	42%	0.42	23%	0.233	S	C	.	.			trans	-90.6	162.9	175	53.7	0	0	0	0	111.7	S108 C109	S106-S108 PolarHBondContact O-N 2.68Å; S106-S108 VanDerWaalsContact O-N 3.09Å; S106-S108 PolarHBondContact OG-OG 3.1Å; S106-C109 CarbonylContact O-C 3.51Å; S106-C109 VanDerWaalsContact O-C 3.24Å; S106-C109 PolarHBondContact O-N 3.36Å
107	I	86.1	Confident	90.8	Very high	25 Å²	25	37.5 Å²	37.5	13%	0.128	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-21.1	175	-62.3	-176	0	0	0	112.6	Y47 V59 T61 W66 L101 C109 P110	Y47-I107 HydrophobicContact CD1-CD1 4.02Å; Y47-I107 HydrophobicContact CE1-CD1 4.32Å; Y47-I107 HydrophobicContact CG-CD1 4.22Å; V59-I107 HydrophobicContact CB-CD1 3.7Å; V59-I107 HydrophobicContact CG1-CD1 3.73Å; V59-I107 HydrophobicContact CG2-CD1 4.17Å; T61-I107 HydrophobicContact CG2-CG2 4.18Å; W66-I107 HydrophobicContact CB-CD1 3.6Å; W66-I107 HydrophobicContact CD2-CD1 4.38Å; W66-I107 HydrophobicContact CD2-CG2 3.99Å; W66-I107 HydrophobicContact CG-CD1 3.76Å; W66-I107 HydrophobicContact CG-CG2 4.08Å; W66-I107 HydrophobicContact CZ2-CG2 4.22Å; L101-I107 HydrophobicContact CD1-CG1 3.89Å; I107-C109 VanDerWaalsContact C-N 3.34Å; I107-P110 WeakPolarHBondContact O-CD 3.45Å
108	S	84.1	Confident	90.7	Very high	108 Å²	108	36 Å²	36	76%	0.755	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-15.4	172.3	51.7	0	0	0	0	114.9	S106	S106-S108 PolarHBondContact O-N 2.68Å; S106-S108 VanDerWaalsContact O-N 3.09Å; S106-S108 PolarHBondContact OG-OG 3.1Å
109	C	87	Confident	90.6	Very high	84 Å²	84	37.5 Å²	37.5	57%	0.568	23%	0.232	S	C	*	.	S	Bend	trans	-140.1	67.3	175.7	-164.4	0	0	0	0	110.1	S106 I107	S106-C109 CarbonylContact O-C 3.51Å; S106-C109 VanDerWaalsContact O-C 3.24Å; S106-C109 PolarHBondContact O-N 3.36Å; I107-C109 VanDerWaalsContact C-N 3.34Å
110	P	90.1	Very high	90.4	Very high	34 Å²	34	37.7 Å²	37.7	22%	0.221	23%	0.233	C	C	.	.			trans	-75.9	151.7	-179.3	33.7	-34.1	0	0	0	111.3	C99 L101 I107 I113	C99-P110 HydrophobicContact CB-CB 3.86Å; C99-P110 HydrophobicContact CB-CG 4.4Å; L101-P110 HydrophobicContact CD2-CB 3.76Å; I107-P110 WeakPolarHBondContact O-CD 3.45Å; P110-I113 HydrophobicContact CG-CB 3.94Å; P110-I113 HydrophobicContact CG-CD1 4.47Å; P110-I113 HydrophobicContact CG-CG2 4.32Å
111	E	90.6	Very high	89.8	Confident	80 Å²	80	39.9 Å²	39.9	37%	0.374	25%	0.245	S	C	.	.	S	Bend	trans	-70.9	-37.5	173.3	176.2	68.6	-171.6	0	0	111	W39 L100 L102	W39-E111 HydrophobicContact CZ2-CG 4.15Å; L100-E111 HydrophobicContact CD2-CB 4.08Å; L100-E111 HydrophobicContact CD2-CG 4.29Å; L100-E111 PolarHBondContact O-N 3.43Å; L102-E111 HydrophobicContact CD1-CB 4.05Å; L102-E111 HydrophobicContact CD1-CG 3.62Å; L102-E111 HydrophobicContact CG-CB 3.96Å; L102-E111 HydrophobicContact CG-CG 3.99Å
112	V	93.7	Very high	89	Confident	8 Å²	8	39.8 Å²	39.8	5%	0.048	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	136.3	174.7	-179.1	0	0	0	0	108.7	Y18 W39 F98 C99 L100	Y18-V112 HydrophobicContact CD2-CG1 3.42Å; Y18-V112 VanDerWaalsContact CD2-CG1 3.42Å; Y18-V112 HydrophobicContact CE2-CG1 3.73Å; Y18-V112 HydrophobicContact CG-CG1 4.3Å; W39-V112 HydrophobicContact CH2-CG2 3.73Å; W39-V112 HydrophobicContact CZ2-CG2 3.65Å; F98-V112 HydrophobicContact CE2-CG1 4.07Å; C99-V112 CarbonylContact C-O 3.43Å; C99-V112 WeakPolarHBondContact CA-O 3.3Å; C99-V112 WeakPolarHBondContact CB-O 3.43Å; L100-V112 HydrophobicContact CB-CB 4.05Å; L100-V112 HydrophobicContact CB-CG2 4.49Å; L100-V112 PolarHBondContact N-O 3.07Å; L100-V112 PolarHBondContact O-N 3.26Å
113	I	94.5	Very high	87.7	Confident	52 Å²	52	41.8 Å²	41.8	27%	0.267	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	143.3	167.4	-173.2	165.7	0	0	0	109.3	E19 W66 F98 C99 P110	E19-I113 HydrophobicContact CG-CG2 4.06Å; W66-I113 HydrophobicContact CH2-CD1 4.26Å; F98-I113 WeakPolarHBondContact O-CA 3.25Å; C99-I113 HydrophobicContact CB-CB 4.33Å; C99-I113 HydrophobicContact CB-CG1 4.33Å; P110-I113 HydrophobicContact CG-CB 3.94Å; P110-I113 HydrophobicContact CG-CD1 4.47Å; P110-I113 HydrophobicContact CG-CG2 4.32Å
114	G	95.2	Very high	86.3	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-171.6	-177.5	-178.3	0	0	0	0	0	113.9	Y18 K97 F98	Y18-G114 VanDerWaalsContact O-CA 3.3Å; Y18-G114 WeakPolarHBondContact O-CA 3.23Å; K97-G114 CarbonylContact C-O 3.29Å; K97-G114 VanDerWaalsContact CA-O 3.26Å; K97-G114 WeakPolarHBondContact CA-O 3.5Å; F98-G114 VanDerWaalsContact CD1-C 3.49Å; F98-G114 VanDerWaalsContact CD1-O 3.32Å; F98-G114 WeakPolarHBondContact CD1-O 3.21Å; F98-G114 PolarHBondContact N-O 3.36Å; F98-G114 PolarHBondContact O-N 2.94Å
115	Y	95.8	Very high	84.8	Confident	21 Å²	21	42.5 Å²	42.5	8%	0.082	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	150.7	-174.1	-68	-108.2	0	0	0	112.9	Y18 Y23 F96 K97 N582	Y18-Y115 PolarHBondContact O-N 2.9Å; Y23-Y115 WeakPolarHBondContact CD2-O 3.08Å; F96-Y115 CarbonylContact O-C 3.58Å; F96-Y115 WeakPolarHBondContact O-CA 3.36Å; K97-Y115 HydrophobicContact CD-CE1 4.19Å; K97-Y115 VanDerWaalsContact CE-OH 3.32Å; K97-Y115 WeakPolarHBondContact CE-OH 3.44Å; K97-Y115 HydrophobicContact CG-CD1 3.95Å; K97-Y115 HydrophobicContact CG-CE1 3.66Å; Y115-N582 HydrophobicContact CD1-CB 3.84Å; Y115-N582 WeakPolarHBondContact CD1-O 3.3Å; Y115-N582 HydrophobicContact CD2-CB 3.83Å; Y115-N582 HydrophobicContact CE1-CB 4.23Å; Y115-N582 VanDerWaalsContact CE1-O 3.27Å; Y115-N582 WeakPolarHBondContact CE1-O 3.36Å; Y115-N582 HydrophobicContact CE2-CB 4.26Å; Y115-N582 HydrophobicContact CG-CB 3.61Å
116	F	95.8	Very high	82.7	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	148	160.7	64	-86.9	0	0	0	110.2	I31 F33 L88 F96 F98 I118	I31-F116 HydrophobicContact CD1-CB 4.3Å; I31-F116 HydrophobicContact CD1-CD2 3.62Å; I31-F116 HydrophobicContact CD1-CE2 4.06Å; I31-F116 HydrophobicContact CD1-CG 3.92Å; F33-F116 HydrophobicContact CZ-CD1 4.37Å; F33-F116 HydrophobicContact CZ-CE1 4.21Å; L88-F116 HydrophobicContact CD2-CE1 4.31Å; L88-F116 HydrophobicContact CD2-CE2 3.87Å; L88-F116 HydrophobicContact CD2-CZ 3.42Å; L88-F116 VanDerWaalsContact CD2-CZ 3.42Å; F96-F116 HydrophobicContact CB-CD1 4.44Å; F96-F116 HydrophobicContact CB-CD2 4.3Å; F96-F116 HydrophobicContact CB-CE1 3.88Å; F96-F116 HydrophobicContact CB-CE2 3.73Å; F96-F116 HydrophobicContact CB-CZ 3.49Å; F96-F116 VanDerWaalsContact CB-CZ 3.49Å; F96-F116 HydrophobicContact CD2-CE2 4Å; F96-F116 HydrophobicContact CG-CE2 4.2Å; F96-F116 HydrophobicContact CG-CZ 4.25Å; F96-F116 PolarHBondContact N-O 2.9Å; F96-F116 PolarHBondContact O-N 3.11Å; F98-F116 HydrophobicContact CB-CE1 4.4Å; F98-F116 AromaticContact CD1-CD1 3.92Å; F98-F116 HydrophobicContact CD1-CD1 3.92Å; F98-F116 HydrophobicContact CD1-CE1 4.48Å; F116-I118 HydrophobicContact CD2-CG1 4.2Å; F116-I118 HydrophobicContact CE2-CD1 4.07Å; F116-I118 HydrophobicContact CE2-CG1 4.14Å
117	H	95.3	Very high	80.7	Confident	3 Å²	3	49.7 Å²	49.7	1%	0.014	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	125.7	-179.6	-64.3	-90.6	0	0	0	110.2	Y23 F24 V25 G94 I581 N582	Y23-H117 PolarHBondContact O-N 3.28Å; F24-H117 WeakPolarHBondContact CA-O 3.48Å; F24-H117 HydrophobicContact CD1-CB 3.47Å; F24-H117 VanDerWaalsContact CD1-CB 3.47Å; F24-H117 AromaticContact CD1-CG 3.93Å; F24-H117 HydrophobicContact CE1-CB 3.86Å; F24-H117 AromaticContact CE1-CD2 3.86Å; F24-H117 AromaticContact CE1-CG 3.79Å; F24-H117 HydrophobicContact CG-CB 4.36Å; V25-H117 PolarHBondContact N-O 3.14Å; G94-H117 WeakPolarHBondContact O-CA 3.27Å; H117-I581 PolarHBondContact CE1-O 3.25Å; H117-I581 VanDerWaalsContact CE1-O 3.27Å; H117-N582 PolarHBondContact NE2-OD1 3Å
118	I	94.1	Very high	79	Confident	2 Å²	2	51.9 Å²	51.9	1%	0.01	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	110.8	167.3	-57.6	171.9	0	0	0	106.6	V25 K27 Y50 C90 R92 P93 G94 F96 F116	V25-I118 HydrophobicContact CG2-CB 4.43Å; V25-I118 HydrophobicContact CG2-CG1 3.85Å; K27-I118 HydrophobicContact CB-CG2 4.29Å; Y50-I118 HydrophobicContact CD2-CD1 3.6Å; Y50-I118 HydrophobicContact CE2-CD1 3.35Å; C90-I118 HydrophobicContact CB-CD1 3.5Å; C90-I118 VanDerWaalsContact CB-CD1 3.5Å; C90-I118 HydrophobicContact CB-CG1 3.78Å; C90-I118 HydrophobicContact CB-CG2 4.18Å; R92-I118 WeakPolarHBondContact O-CB 3.27Å; R92-I118 WeakPolarHBondContact O-CD1 3.24Å; P93-I118 CarbonylContact C-O 3.17Å; P93-I118 VanDerWaalsContact CA-O 3.26Å; P93-I118 WeakPolarHBondContact CA-O 3.46Å; P93-I118 WeakPolarHBondContact CB-O 3.3Å; G94-I118 PolarHBondContact N-O 3.43Å; G94-I118 PolarHBondContact O-N 2.7Å; F96-I118 HydrophobicContact CD2-CD1 3.88Å; F96-I118 HydrophobicContact CD2-CG1 4.15Å; F96-I118 HydrophobicContact CE2-CB 4.35Å; F96-I118 HydrophobicContact CE2-CD1 3.79Å; F96-I118 HydrophobicContact CE2-CG1 4.2Å; F116-I118 HydrophobicContact CD2-CG1 4.2Å; F116-I118 HydrophobicContact CE2-CD1 4.07Å; F116-I118 HydrophobicContact CE2-CG1 4.14Å
119	L	92.5	Very high	77.6	Confident	30 Å²	30	49.7 Å²	49.7	16%	0.157	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.3	139.1	-175.4	-70.3	174	0	0	0	111.2	F24 V25 L133 V587	F24-L119 HydrophobicContact CB-CD1 4.2Å; F24-L119 HydrophobicContact CB-CD2 4.35Å; F24-L119 HydrophobicContact CB-CG 4.19Å; F24-L119 HydrophobicContact CD1-CD2 3.65Å; F24-L119 HydrophobicContact CD1-CG 4.34Å; F24-L119 HydrophobicContact CE1-CD2 4.4Å; F24-L119 HydrophobicContact CG-CD2 4.34Å; V25-L119 PolarHBondContact O-N 2.84Å; L119-L133 HydrophobicContact CB-CD1 4.16Å; L119-L133 HydrophobicContact CD2-CD1 4.25Å; L119-V587 HydrophobicContact CD2-CG1 4.21Å
120	P	90	Very high	76.7	Confident	5 Å²	5	49.6 Å²	49.6	3%	0.032	28%	0.278	C	S	.	.			trans	-63.4	146.7	173.5	27.5	-33.4	0	0	0	110.2	P93 L133 N563 V587	P93-P120 HydrophobicContact CB-CB 4.38Å; P120-L133 HydrophobicContact CG-CD1 4.02Å; P120-L133 HydrophobicContact CG-CD2 4.33Å; P120-N563 HydrophobicContact CB-CB 4.28Å; P120-N563 WeakPolarHBondContact CB-O 3.16Å; P120-V587 HydrophobicContact CG-CG1 4.2Å; P120-V587 HydrophobicContact CG-CG2 4.22Å
121	N	82.6	Confident	76.1	Confident	45 Å²	45	48.5 Å²	48.5	24%	0.241	27%	0.271	C	S	.	.			trans	-111.7	111.2	171.8	-175.9	-9.5	0	0	0	108.1	K27 N130 N563	K27-N121 HydrophobicContact CB-CB 4.48Å; K27-N121 HydrophobicContact CD-CB 4.02Å; N121-N130 VanDerWaalsContact ND2-CG 3.26Å; N121-N130 PolarHBondContact ND2-ND2 3.27Å; N121-N130 PolarHBondContact ND2-OD1 3.37Å; N121-N130 WeakPolarHBondContact OD1-CB 3.46Å; N121-N130 PolarHBondContact OD1-OD1 3.3Å; N121-N563 PolarHBondContact N-OD1 2.81Å; N121-N563 WeakPolarHBondContact O-CB 3.43Å; N121-N563 PolarHBondContact O-ND2 3.49Å; N121-N563 PolarHBondContact O-OD1 3.16Å
122	I	76.2	Confident	75.7	Confident	10 Å²	10	46.4 Å²	46.4	5%	0.051	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	95.6	-175.6	-50.9	175.9	0	0	0	107.9	L131 L133 I136 L220 Y565	I122-L131 PolarHBondContact O-N 3.01Å; I122-L133 HydrophobicContact CD1-CD2 3.65Å; I122-L133 HydrophobicContact CG1-CD2 3.87Å; I122-I136 HydrophobicContact CD1-CD1 4.5Å; I122-L220 HydrophobicContact CB-CD1 4.48Å; I122-L220 HydrophobicContact CG2-CD1 3.59Å; I122-L220 HydrophobicContact CG2-CD2 3.45Å; I122-L220 VanDerWaalsContact CG2-CD2 3.45Å; I122-L220 HydrophobicContact CG2-CG 4.17Å; I122-Y565 HydrophobicContact CD1-CD2 3.98Å; I122-Y565 HydrophobicContact CD1-CG 4.34Å
123	A	61.4	Low	75.5	Confident	59 Å²	59	47.2 Å²	47.2	49%	0.488	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	140	175.7	0	0	0	0	0	110.6
124	T	55.9	Low	75.2	Confident	13 Å²	13	46.9 Å²	46.9	8%	0.08	27%	0.265	C	S	.	.			trans	-125.9	136.6	166.6	67.7	0	0	0	0	107.3	L126 L131 N218 L220	T124-L126 PolarHBondContact O-N 3.36Å; T124-L131 HydrophobicContact CG2-CB 3.97Å; T124-L131 HydrophobicContact CG2-CD2 4.21Å; T124-N218 WeakPolarHBondContact CB-ND2 3.24Å; T124-N218 VanDerWaalsContact CB-OD1 3.23Å; T124-N218 WeakPolarHBondContact CB-OD1 3.31Å; T124-N218 PolarHBondContact OG1-ND2 3.24Å; T124-N218 PolarHBondContact OG1-OD1 2.8Å; T124-L220 HydrophobicContact CG2-CD1 4.49Å; T124-L220 HydrophobicContact CG2-CD2 4Å; T124-L220 HydrophobicContact CG2-CG 4.19Å
125	R	48.8	Very low	75	Confident	190 Å²	190	46.9 Å²	46.9	72%	0.717	27%	0.265	S	S	*	.	G	3₁₀ helix	trans	-65.9	-27.4	-160.8	-82.8	-171.4	172	-145.4	-2.2	116.6	N127 G128 N218	R125-N127 PolarHBondContact O-N 3.28Å; R125-G128 PolarHBondContact O-N 2.9Å; R125-G128 VanDerWaalsContact O-N 3.14Å; R125-N218 PolarHBondContact N-OD1 3.13Å
126	L	42.2	Very low	74.9	Confident	126 Å²	126	45.9 Å²	45.9	66%	0.66	26%	0.261	S	S	*	.	G	3₁₀ helix	trans	-62.2	-12.1	-153.8	-110.2	173.7	0	0	0	118	T124 N218	T124-L126 PolarHBondContact O-N 3.36Å; L126-N218 HydrophobicContact CB-CB 4.33Å; L126-N218 WeakPolarHBondContact CB-OD1 3.43Å; L126-N218 HydrophobicContact CD1-CB 3.75Å; L126-N218 HydrophobicContact CG-CB 4.17Å; L126-N218 PolarHBondContact N-OD1 3.4Å
127	N	44.1	Very low	74.9	Confident	148 Å²	148	46 Å²	46	79%	0.791	26%	0.262	S	S	*	.	G	3₁₀ helix	trans	-140.2	9.6	171.6	-82.9	-46.1	0	0	0	114	R125 S129	R125-N127 PolarHBondContact O-N 3.28Å; N127-S129 WeakPolarHBondContact CB-OG 3.2Å; N127-S129 PolarHBondContact O-N 3.35Å
128	G	48.9	Very low	74.9	Confident	72 Å²	72	45.8 Å²	45.8	74%	0.742	26%	0.261	S	S	*	.	S	Bend	trans	66	-4.4	-164.9	0	0	0	0	0	114.5	R125	R125-G128 PolarHBondContact O-N 2.9Å; R125-G128 VanDerWaalsContact O-N 3.14Å
129	S	55	Low	75.1	Confident	61 Å²	61	45.7 Å²	45.7	43%	0.427	26%	0.26	S	S	.	.	P	Polyproline II helix	trans	-77.6	134.6	172.8	57.8	0	0	0	0	111.2	N127	N127-S129 WeakPolarHBondContact CB-OG 3.2Å; N127-S129 PolarHBondContact O-N 3.35Å
130	N	68	Low	75.2	Confident	82 Å²	82	44.4 Å²	44.4	44%	0.439	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	145.5	170.6	-60.3	-50.5	0	0	0	110.8	N121 P132	N121-N130 VanDerWaalsContact ND2-CG 3.26Å; N121-N130 PolarHBondContact ND2-ND2 3.27Å; N121-N130 PolarHBondContact ND2-OD1 3.37Å; N121-N130 WeakPolarHBondContact OD1-CB 3.46Å; N121-N130 PolarHBondContact OD1-OD1 3.3Å; N130-P132 WeakPolarHBondContact O-CD 3.36Å
131	L	76.9	Confident	75.4	Confident	12 Å²	12	44.1 Å²	44.1	6%	0.063	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	120.8	167.1	-174.9	69.9	0	0	0	107.8	I122 T124 A135 I136 L220	I122-L131 PolarHBondContact O-N 3.01Å; T124-L131 HydrophobicContact CG2-CB 3.97Å; T124-L131 HydrophobicContact CG2-CD2 4.21Å; L131-A135 HydrophobicContact CD1-CB 3.72Å; L131-A135 HydrophobicContact CG-CB 4.23Å; L131-I136 HydrophobicContact CD2-CG1 4.26Å; L131-L220 HydrophobicContact CD2-CD1 3.89Å
132	P	83.6	Confident	75.9	Confident	36 Å²	36	42.5 Å²	42.5	23%	0.234	24%	0.243	C	C	.	.	P	Polyproline II helix	trans	-57.5	142.4	170.8	-22.5	33.9	0	0	0	110	N130 E134 A135	N130-P132 WeakPolarHBondContact O-CD 3.36Å; P132-E134 PolarHBondContact O-N 2.98Å; P132-A135 HydrophobicContact CB-CB 4.18Å; P132-A135 HydrophobicContact CG-CB 4.34Å; P132-A135 WeakPolarHBondContact O-CB 3.37Å; P132-A135 PolarHBondContact O-N 3.45Å
133	L	89.2	Confident	76.6	Confident	24 Å²	24	42 Å²	42	13%	0.126	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-60.3	-30.5	177.6	-62.5	-177.9	0	0	0	111	L119 P120 I122 A135 I136 Y565 P666	L119-L133 HydrophobicContact CB-CD1 4.16Å; L119-L133 HydrophobicContact CD2-CD1 4.25Å; P120-L133 HydrophobicContact CG-CD1 4.02Å; P120-L133 HydrophobicContact CG-CD2 4.33Å; I122-L133 HydrophobicContact CD1-CD2 3.65Å; I122-L133 HydrophobicContact CG1-CD2 3.87Å; L133-A135 PolarHBondContact O-N 3.27Å; L133-I136 HydrophobicContact CD2-CD1 4.43Å; L133-I136 WeakPolarHBondContact O-CD1 3.35Å; L133-I136 WeakPolarHBondContact O-CG1 3.43Å; L133-I136 PolarHBondContact O-N 2.76Å; L133-Y565 HydrophobicContact CD2-CD2 4.19Å; L133-Y565 HydrophobicContact CD2-CE2 4.46Å; L133-P666 WeakPolarHBondContact O-CB 3.47Å
134	E	88.1	Confident	77.9	Confident	45 Å²	45	39.8 Å²	39.8	21%	0.21	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-78.5	3	176.4	-47.1	98.6	117.8	0	0	114.3	P132 R664 H735 S739	P132-E134 PolarHBondContact O-N 2.98Å; E134-R664 HydrophobicContact CB-CG 4.11Å; E134-R664 HydrophobicContact CG-CG 4.21Å; E134-R664 IonicContact OE1-CZ 2.74Å; E134-R664 IonicContact OE1-NE 3.99Å; E134-R664 PolarHBondContact OE1-NE 3.19Å; E134-R664 IonicContact OE1-NH2 2.68Å; E134-R664 PolarHBondContact OE1-NH2 2.72Å; E134-H735 PolarHBondContact O-CE1 2.79Å; E134-H735 PolarHBondContact O-NE2 3.1Å; E134-H735 VanDerWaalsContact O-NE2 3.12Å; E134-S739 WeakPolarHBondContact O-CB 3.01Å; E134-S739 PolarHBondContact O-OG 3.28Å
135	A	89.8	Confident	79.4	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-103.1	2.8	173.3	0	0	0	0	0	112.8	L131 P132 L133 A137 N165	L131-A135 HydrophobicContact CD1-CB 3.72Å; L131-A135 HydrophobicContact CG-CB 4.23Å; P132-A135 HydrophobicContact CB-CB 4.18Å; P132-A135 HydrophobicContact CG-CB 4.34Å; P132-A135 WeakPolarHBondContact O-CB 3.37Å; P132-A135 PolarHBondContact O-N 3.45Å; L133-A135 PolarHBondContact O-N 3.27Å; A135-A137 PolarHBondContact O-N 3.39Å; A135-N165 PolarHBondContact O-ND2 2.86Å
136	I	93.9	Very high	81.4	Confident	1 Å²	1	30.2 Å²	30.2	1%	0.005	18%	0.183	C	C	.	.			trans	-70.6	117.9	179.8	-64.1	167.8	0	0	0	109.6	I122 L131 L133 C138 N165 M166 Y565 F633 P666 Y667	I122-I136 HydrophobicContact CD1-CD1 4.5Å; L131-I136 HydrophobicContact CD2-CG1 4.26Å; L133-I136 HydrophobicContact CD2-CD1 4.43Å; L133-I136 WeakPolarHBondContact O-CD1 3.35Å; L133-I136 WeakPolarHBondContact O-CG1 3.43Å; L133-I136 PolarHBondContact O-N 2.76Å; I136-C138 HydrophobicContact CG2-CB 4.28Å; I136-N165 WeakPolarHBondContact CA-OD1 3.15Å; I136-M166 HydrophobicContact CD1-CE 3.96Å; I136-M166 HydrophobicContact CG1-CE 4.39Å; I136-M166 HydrophobicContact CG2-CB 3.94Å; I136-M166 HydrophobicContact CG2-CE 3.93Å; I136-M166 HydrophobicContact CG2-SD 3.93Å; I136-Y565 HydrophobicContact CD1-CD2 3.74Å; I136-Y565 HydrophobicContact CD1-CE2 3.75Å; I136-Y565 HydrophobicContact CD1-CG 4.44Å; I136-F633 HydrophobicContact CG2-CE2 4.4Å; I136-F633 HydrophobicContact CG2-CZ 4.05Å; I136-P666 HydrophobicContact CB-CB 3.89Å; I136-P666 HydrophobicContact CG2-CB 4.45Å; I136-P666 WeakPolarHBondContact O-CA 3.09Å; I136-Y667 PolarHBondContact O-N 3.25Å
137	A	95.3	Very high	83.6	Confident	1 Å²	1	24.6 Å²	24.6	1%	0.008	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	110.1	168.2	0	0	0	0	0	108.1	A135 Y164 N165 M166 Y667 N732	A135-A137 PolarHBondContact O-N 3.39Å; A137-Y164 HydrophobicContact CB-CD1 4.16Å; A137-Y164 WeakPolarHBondContact O-CB 3.36Å; A137-N165 PolarHBondContact N-OD1 2.89Å; A137-N165 PolarHBondContact O-N 3.17Å; A137-N165 PolarHBondContact O-OD1 2.95Å; A137-M166 PolarHBondContact O-N 2.88Å; A137-M166 VanDerWaalsContact O-N 3.09Å; A137-Y667 CarbonylContact C-O 2.99Å; A137-Y667 WeakPolarHBondContact CA-O 3.38Å; A137-Y667 HydrophobicContact CB-CD1 4.29Å; A137-Y667 HydrophobicContact CB-CE1 3.72Å; A137-N732 VanDerWaalsContact CB-OD1 3.26Å; A137-N732 WeakPolarHBondContact CB-OD1 3.16Å
138	C	96.7	Very high	85.8	Confident	0 Å²	0	21.1 Å²	21.1	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	137.3	-170.6	-173	0	0	0	0	113.4	I136 Y164 M166 H168 F633 F635 Y667 G668 S669	I136-C138 HydrophobicContact CG2-CB 4.28Å; C138-Y164 WeakPolarHBondContact O-CE1 3.24Å; C138-M166 CarbonylContact C-O 3.21Å; C138-M166 VanDerWaalsContact CA-O 3.26Å; C138-M166 WeakPolarHBondContact CA-O 3.36Å; C138-M166 HydrophobicContact CB-CB 4.06Å; C138-M166 HydrophobicContact CB-CG 4.37Å; C138-M166 HydrophobicContact CB-SD 4.45Å; C138-H168 VanDerWaalsContact SG-CB 3.54Å; C138-F633 HydrophobicContact CB-CE2 4.06Å; C138-F633 HydrophobicContact CB-CZ 3.66Å; C138-F635 HydrophobicContact CB-CZ 4.31Å; C138-Y667 PolarHBondContact N-O 2.72Å; C138-G668 CarbonylContact O-C 3.24Å; C138-G668 WeakPolarHBondContact O-CA 3.28Å; C138-S669 PolarHBondContact O-N 3.15Å
139	Q	97.4	Very high	87.7	Confident	0 Å²	0	19.2 Å²	19.2	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	122.1	165	-159.2	-178.7	55.1	0	0	109.7	T159 Y164 M166 H168 S669 R671 D674	Q139-T159 HydrophobicContact CB-CG2 3.6Å; Q139-T159 HydrophobicContact CG-CG2 4.44Å; Q139-T159 PolarHBondContact OE1-OG1 3.3Å; Q139-Y164 HydrophobicContact CB-CD1 4.11Å; Q139-Y164 HydrophobicContact CB-CD2 3.75Å; Q139-Y164 HydrophobicContact CB-CE1 4.19Å; Q139-Y164 HydrophobicContact CB-CE2 3.86Å; Q139-Y164 HydrophobicContact CB-CG 3.87Å; Q139-Y164 HydrophobicContact CG-CD2 4.26Å; Q139-Y164 HydrophobicContact CG-CE2 3.91Å; Q139-Y164 VanDerWaalsContact NE2-CE2 3.34Å; Q139-M166 PolarHBondContact N-O 3.31Å; Q139-H168 PolarHBondContact O-N 3.09Å; Q139-S669 WeakPolarHBondContact CA-O 3.48Å; Q139-R671 VanDerWaalsContact OE1-CD 3.27Å; Q139-D674 PolarHBondContact NE2-OD2 3.23Å
140	S	96	Very high	89.2	Confident	2 Å²	2	21.8 Å²	21.8	1%	0.014	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	138	172.7	-55.5	0	0	0	0	111	H168 F635 S669 C670 R671	S140-H168 CarbonylContact C-O 3.52Å; S140-H168 WeakPolarHBondContact CA-O 3.29Å; S140-H168 PolarHBondContact OG-ND1 3.22Å; S140-F635 WeakPolarHBondContact OG-CE1 3.36Å; S140-S669 PolarHBondContact N-O 3.44Å; S140-C670 CarbonylContact O-C 3.55Å; S140-C670 VanDerWaalsContact O-CA 3.32Å; S140-C670 WeakPolarHBondContact O-CA 3.35Å; S140-R671 PolarHBondContact O-N 3.5Å
141	V	93.9	Very high	90.1	Very high	0 Å²	0	19 Å²	19	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	127.7	-171	-163	0	0	0	0	110.3	A143 L146 I167 H168 L169 T170 R671 Y694	V141-A143 PolarHBondContact O-N 2.88Å; V141-L146 HydrophobicContact CG1-CD2 3.8Å; V141-L146 HydrophobicContact CG1-CG 4.22Å; V141-I167 HydrophobicContact CG2-CG2 4.3Å; V141-H168 PolarHBondContact N-O 2.94Å; V141-L169 HydrophobicContact CB-CD2 4.16Å; V141-T170 PolarHBondContact O-N 3.35Å; V141-R671 HydrophobicContact CG1-CB 4.16Å; V141-R671 HydrophobicContact CG1-CG 4.41Å; V141-R671 HydrophobicContact CG2-CB 4.26Å; V141-Y694 HydrophobicContact CG1-CD2 3.96Å; V141-Y694 HydrophobicContact CG1-CE2 3.44Å; V141-Y694 VanDerWaalsContact CG1-CE2 3.44Å
142	Y	91.9	Very high	90.8	Very high	10 Å²	10	18.5 Å²	18.5	4%	0.039	12%	0.118	C	C	.	.			trans	-66.9	114.2	169.1	-75.5	-81.4	0	0	0	110.6	N144 L145 T170 A181 W182 L639 D640 V681 I685	Y142-N144 VanDerWaalsContact C-N 3.34Å; Y142-N144 PolarHBondContact O-N 3.43Å; Y142-L145 HydrophobicContact CD2-CD1 4.39Å; Y142-L145 HydrophobicContact CG-CD1 4.28Å; Y142-L145 PolarHBondContact O-N 3.05Å; Y142-T170 HydrophobicContact CD1-CG2 3.68Å; Y142-T170 HydrophobicContact CE1-CG2 4.04Å; Y142-T170 HydrophobicContact CG-CG2 4.27Å; Y142-A181 HydrophobicContact CD1-CB 3.87Å; Y142-A181 HydrophobicContact CE1-CB 4.14Å; Y142-W182 AromaticContact CE1-CH2 3.79Å; Y142-W182 HydrophobicContact CE1-CH2 3.79Å; Y142-W182 HydrophobicContact CE1-CZ2 4.43Å; Y142-W182 HydrophobicContact CE1-CZ3 4.08Å; Y142-W182 WeakPolarHBondContact OH-CH2 3.48Å; Y142-L639 HydrophobicContact CD2-CD2 3.99Å; Y142-L639 HydrophobicContact CE2-CD2 3.63Å; Y142-D640 PolarHBondContact OH-N 2.85Å; Y142-V681 HydrophobicContact CD2-CG1 3.91Å; Y142-V681 HydrophobicContact CE2-CB 4.4Å; Y142-V681 HydrophobicContact CE2-CG1 4.25Å; Y142-I685 HydrophobicContact CD1-CD1 4.44Å
143	A	92.3	Very high	91.2	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	12%	0.122	C	C	.	.	G	3₁₀ helix	trans	-64.4	-35.4	-173.5	0	0	0	0	0	113.2	V141 L145 L146 T170 V172 I194	V141-A143 PolarHBondContact O-N 2.88Å; A143-L145 VanDerWaalsContact C-N 3.29Å; A143-L145 PolarHBondContact O-N 3.48Å; A143-L146 WeakPolarHBondContact O-CB 3.39Å; A143-L146 PolarHBondContact O-N 2.97Å; A143-T170 PolarHBondContact N-OG1 3.43Å; A143-V172 HydrophobicContact CB-CG1 4.13Å; A143-I194 HydrophobicContact CB-CD1 4.31Å; A143-I194 WeakPolarHBondContact O-CD1 3.32Å
144	N	87.2	Confident	91.1	Very high	12 Å²	12	21.8 Å²	21.8	6%	0.064	14%	0.135	C	C	.	.	G	3₁₀ helix	trans	-67.3	-25	176.3	60.7	-36.8	0	0	0	113.5	Y142 L175 H691	Y142-N144 VanDerWaalsContact C-N 3.34Å; Y142-N144 PolarHBondContact O-N 3.43Å; N144-L175 HydrophobicContact CB-CD1 4.33Å; N144-H691 PolarHBondContact ND2-NE2 3.5Å
145	L	88.7	Confident	91.2	Very high	0 Å²	0	20 Å²	20	0%	0	13%	0.126	C	C	.	.	G	3₁₀ helix	trans	-86.2	-6.4	178.6	-52.1	-172.3	0	0	0	113.1	Y142 A143 G147 V681 I685 H691 L693 Y694	Y142-L145 HydrophobicContact CD2-CD1 4.39Å; Y142-L145 HydrophobicContact CG-CD1 4.28Å; Y142-L145 PolarHBondContact O-N 3.05Å; A143-L145 VanDerWaalsContact C-N 3.29Å; A143-L145 PolarHBondContact O-N 3.48Å; L145-G147 VanDerWaalsContact C-N 3.26Å; L145-G147 PolarHBondContact O-N 2.87Å; L145-V681 HydrophobicContact CD1-CG1 3.46Å; L145-V681 VanDerWaalsContact CD1-CG1 3.46Å; L145-I685 HydrophobicContact CD2-CG1 4.31Å; L145-H691 HydrophobicContact CD2-CB 3.69Å; L145-L693 CarbonylContact O-C 3.59Å; L145-L693 WeakPolarHBondContact O-CA 3.49Å; L145-Y694 HydrophobicContact CB-CD2 3.69Å; L145-Y694 HydrophobicContact CB-CE2 3.48Å; L145-Y694 VanDerWaalsContact CB-CE2 3.48Å; L145-Y694 HydrophobicContact CB-CG 4.41Å; L145-Y694 HydrophobicContact CD1-CE2 4.29Å; L145-Y694 HydrophobicContact CG-CE2 4.41Å; L145-Y694 PolarHBondContact O-N 3.13Å
146	L	90.5	Very high	91.3	Very high	3 Å²	3	20.2 Å²	20.2	2%	0.016	13%	0.127	C	C	.	.	G	3₁₀ helix	trans	-70.9	-22.6	173.8	-66.7	168	0	0	0	112.9	V141 A143 W152 Q155 F156 L169 Y694	V141-L146 HydrophobicContact CG1-CD2 3.8Å; V141-L146 HydrophobicContact CG1-CG 4.22Å; A143-L146 WeakPolarHBondContact O-CB 3.39Å; A143-L146 PolarHBondContact O-N 2.97Å; L146-W152 HydrophobicContact CD1-CD2 4.03Å; L146-W152 HydrophobicContact CD1-CG 4.42Å; L146-W152 HydrophobicContact CD1-CH2 4.28Å; L146-W152 HydrophobicContact CD1-CZ2 3.68Å; L146-Q155 HydrophobicContact CB-CG 4.47Å; L146-Q155 HydrophobicContact CD2-CB 3.55Å; L146-Q155 HydrophobicContact CD2-CG 4.11Å; L146-Q155 WeakPolarHBondContact O-CG 3.38Å; L146-Q155 PolarHBondContact O-NE2 2.66Å; L146-F156 HydrophobicContact CD1-CE1 3.63Å; L146-F156 HydrophobicContact CD1-CE2 4.33Å; L146-F156 HydrophobicContact CD1-CZ 3.37Å; L146-F156 HydrophobicContact CD2-CD1 4.27Å; L146-F156 HydrophobicContact CD2-CE1 3.78Å; L146-F156 HydrophobicContact CD2-CZ 4.26Å; L146-F156 HydrophobicContact CG-CE1 4.39Å; L146-F156 HydrophobicContact CG-CZ 4.49Å; L146-L169 HydrophobicContact CD1-CD2 4.38Å; L146-Y694 HydrophobicContact CD2-CD2 4.29Å
147	G	87.7	Confident	91.2	Very high	8 Å²	8	20.9 Å²	20.9	8%	0.082	13%	0.133	C	C	.	.			trans	75.5	-161	-168.9	0	0	0	0	0	112.8	L145 W152	L145-G147 VanDerWaalsContact C-N 3.26Å; L145-G147 PolarHBondContact O-N 2.87Å; G147-W152 PolarHBondContact O-NE1 3.27Å
148	P	89.7	Confident	91.1	Very high	75 Å²	75	20.9 Å²	20.9	49%	0.487	13%	0.133	S	C	.	.	S	Bend	trans	-59.3	145	-173.5	-25.7	35	0	0	0	113.7	S150 G151 W152 I194	P148-S150 PolarHBondContact O-N 3.07Å; P148-S150 VanDerWaalsContact O-N 3.1Å; P148-G151 WeakPolarHBondContact O-CA 3.4Å; P148-G151 PolarHBondContact O-N 3.04Å; P148-W152 VanDerWaalsContact O-CD1 3.29Å; P148-I194 CarbonylContact C-O 3.6Å; P148-I194 WeakPolarHBondContact CA-O 3.34Å
149	F	90.7	Very high	91	Very high	31 Å²	31	20.9 Å²	20.9	14%	0.136	13%	0.133	C	C	.	.	G	3₁₀ helix	trans	-54	-32.9	-178.1	-177	-113.6	0	0	0	113.6	G151 W152 I194 F195 L205 L206 F209	F149-G151 PolarHBondContact O-N 2.98Å; F149-W152 AromaticContact CD2-CD2 3.68Å; F149-W152 HydrophobicContact CD2-CD2 3.68Å; F149-W152 AromaticContact CD2-CE3 3.52Å; F149-W152 HydrophobicContact CD2-CE3 3.52Å; F149-W152 HydrophobicContact CD2-CG 4.14Å; F149-W152 HydrophobicContact CD2-CZ3 4.04Å; F149-W152 HydrophobicContact CE2-CD2 4.3Å; F149-W152 AromaticContact CE2-CE3 3.7Å; F149-W152 HydrophobicContact CE2-CE3 3.7Å; F149-W152 HydrophobicContact CE2-CZ3 4.14Å; F149-W152 WeakPolarHBondContact O-CB 3.29Å; F149-W152 PolarHBondContact O-N 3.41Å; F149-W152 VanDerWaalsContact O-N 3.15Å; F149-I194 HydrophobicContact CB-CG2 4.35Å; F149-I194 WeakPolarHBondContact CB-O 3.37Å; F149-I194 PolarHBondContact N-O 3.06Å; F149-F195 HydrophobicContact CB-CD1 3.96Å; F149-F195 HydrophobicContact CB-CE1 4.21Å; F149-F195 HydrophobicContact CD1-CD1 4.17Å; F149-F195 HydrophobicContact CD1-CE1 4.27Å; F149-F195 AromaticContact CD2-CD1 3.93Å; F149-F195 HydrophobicContact CD2-CD1 3.93Å; F149-F195 AromaticContact CD2-CE1 3.34Å; F149-F195 HydrophobicContact CD2-CE1 3.34Å; F149-F195 AromaticContact CD2-CZ 3.99Å; F149-F195 HydrophobicContact CD2-CZ 3.99Å; F149-F195 HydrophobicContact CE2-CD1 4.48Å; F149-F195 AromaticContact CE2-CE1 3.65Å; F149-F195 HydrophobicContact CE2-CE1 3.65Å; F149-F195 HydrophobicContact CE2-CZ 4.36Å; F149-F195 AromaticContact CG-CD1 3.76Å; F149-F195 HydrophobicContact CG-CD1 3.76Å; F149-F195 AromaticContact CG-CE1 3.69Å; F149-F195 HydrophobicContact CG-CE1 3.69Å; F149-F195 HydrophobicContact CZ-CE1 4.23Å; F149-L205 HydrophobicContact CE1-CB 4.11Å; F149-L205 HydrophobicContact CZ-CB 4.47Å; F149-L206 HydrophobicContact CE2-CD1 4.04Å; F149-F209 HydrophobicContact CE2-CB 4.24Å; F149-F209 HydrophobicContact CE2-CD1 4.2Å; F149-F209 HydrophobicContact CE2-CG 4.11Å; F149-F209 HydrophobicContact CZ-CB 3.74Å; F149-F209 HydrophobicContact CZ-CD1 4.49Å; F149-F209 HydrophobicContact CZ-CD2 4.36Å; F149-F209 AromaticContact CZ-CG 3.96Å; F149-F209 HydrophobicContact CZ-CG 3.96Å
150	S	85.9	Confident	90.8	Very high	115 Å²	115	23.8 Å²	23.8	80%	0.804	15%	0.148	S	C	*	.	G	3₁₀ helix	trans	-61.8	-25.8	174.6	53.4	0	0	0	0	114	P148	P148-S150 PolarHBondContact O-N 3.07Å; P148-S150 VanDerWaalsContact O-N 3.1Å
151	G	87.4	Confident	90.6	Very high	25 Å²	25	26.4 Å²	26.4	26%	0.258	16%	0.161	S	C	.	.	G	3₁₀ helix	trans	-89	-11.6	176.3	0	0	0	0	0	114.6	P148 F149 A153 K154 Q155	P148-G151 WeakPolarHBondContact O-CA 3.4Å; P148-G151 PolarHBondContact O-N 3.04Å; F149-G151 PolarHBondContact O-N 2.98Å; G151-A153 VanDerWaalsContact C-N 3.25Å; G151-A153 PolarHBondContact O-N 2.94Å; G151-A153 VanDerWaalsContact O-N 3.13Å; G151-K154 PolarHBondContact O-N 3.45Å; G151-Q155 PolarHBondContact O-N 3Å
152	W	91.8	Very high	90.5	Very high	1 Å²	1	26.4 Å²	26.4	0%	0.004	16%	0.161	C	C	.	.	H	α-helix	trans	-58.3	-33.2	-171	-81	21.3	0	0	0	114	L146 G147 P148 F149 K154 Q155 F156 L169 V172 I194 F195 L206 F209	L146-W152 HydrophobicContact CD1-CD2 4.03Å; L146-W152 HydrophobicContact CD1-CG 4.42Å; L146-W152 HydrophobicContact CD1-CH2 4.28Å; L146-W152 HydrophobicContact CD1-CZ2 3.68Å; G147-W152 PolarHBondContact O-NE1 3.27Å; P148-W152 VanDerWaalsContact O-CD1 3.29Å; F149-W152 AromaticContact CD2-CD2 3.68Å; F149-W152 HydrophobicContact CD2-CD2 3.68Å; F149-W152 AromaticContact CD2-CE3 3.52Å; F149-W152 HydrophobicContact CD2-CE3 3.52Å; F149-W152 HydrophobicContact CD2-CG 4.14Å; F149-W152 HydrophobicContact CD2-CZ3 4.04Å; F149-W152 HydrophobicContact CE2-CD2 4.3Å; F149-W152 AromaticContact CE2-CE3 3.7Å; F149-W152 HydrophobicContact CE2-CE3 3.7Å; F149-W152 HydrophobicContact CE2-CZ3 4.14Å; F149-W152 WeakPolarHBondContact O-CB 3.29Å; F149-W152 PolarHBondContact O-N 3.41Å; F149-W152 VanDerWaalsContact O-N 3.15Å; W152-K154 VanDerWaalsContact C-N 3.31Å; W152-K154 PolarHBondContact O-N 2.81Å; W152-Q155 PolarHBondContact O-N 3.16Å; W152-F156 HydrophobicContact CB-CD2 4.18Å; W152-F156 HydrophobicContact CB-CE2 3.97Å; W152-F156 AromaticContact CD2-CE2 3.97Å; W152-F156 HydrophobicContact CD2-CE2 3.97Å; W152-F156 HydrophobicContact CD2-CZ 4.29Å; W152-F156 AromaticContact CE3-CE2 3.58Å; W152-F156 HydrophobicContact CE3-CE2 3.58Å; W152-F156 HydrophobicContact CE3-CZ 4.01Å; W152-F156 HydrophobicContact CG-CE2 4.21Å; W152-F156 HydrophobicContact CZ3-CE2 4.25Å; W152-F156 HydrophobicContact CZ3-CZ 4.34Å; W152-F156 VanDerWaalsContact O-CD2 3.28Å; W152-F156 WeakPolarHBondContact O-CD2 3.49Å; W152-F156 PolarHBondContact O-N 2.96Å; W152-L169 HydrophobicContact CH2-CD1 4.41Å; W152-L169 HydrophobicContact CZ3-CD1 4.28Å; W152-V172 HydrophobicContact CH2-CG1 3.92Å; W152-I194 HydrophobicContact CH2-CG2 4.22Å; W152-I194 HydrophobicContact CZ2-CD1 4.25Å; W152-I194 HydrophobicContact CZ2-CG2 3.34Å; W152-F195 HydrophobicContact CH2-CE2 4.47Å; W152-F195 HydrophobicContact CH2-CZ 4.04Å; W152-F195 HydrophobicContact CZ3-CZ 4.32Å; W152-L206 HydrophobicContact CZ3-CD1 3.79Å; W152-F209 HydrophobicContact CB-CE1 4.29Å; W152-F209 HydrophobicContact CB-CZ 3.9Å; W152-F209 HydrophobicContact CE3-CE1 4.22Å
153	A	90.1	Very high	90.4	Very high	37 Å²	37	27.5 Å²	27.5	31%	0.306	18%	0.176	S	C	.	.	H	α-helix	trans	-58.1	-42.1	174.3	0	0	0	0	0	112.2	G151 A157 F209 W217	G151-A153 VanDerWaalsContact C-N 3.25Å; G151-A153 PolarHBondContact O-N 2.94Å; G151-A153 VanDerWaalsContact O-N 3.13Å; A153-A157 VanDerWaalsContact O-CB 3.26Å; A153-A157 WeakPolarHBondContact O-CB 3.38Å; A153-A157 PolarHBondContact O-N 3.39Å; A153-F209 HydrophobicContact CB-CE2 4.27Å; A153-W217 WeakPolarHBondContact O-CH2 3.24Å
154	K	87.6	Confident	90.6	Very high	92 Å²	92	27.8 Å²	27.8	40%	0.4	18%	0.177	S	C	.	.	H	α-helix	trans	-74.7	-27.5	179.2	-63.2	-168.4	172.2	-165.8	0	113	G151 W152 W697 E699	G151-K154 PolarHBondContact O-N 3.45Å; W152-K154 VanDerWaalsContact C-N 3.31Å; W152-K154 PolarHBondContact O-N 2.81Å; K154-W697 PolarHBondContact O-N 3.4Å; K154-E699 WeakPolarHBondContact CE-OE1 3.17Å; K154-E699 IonicContact NZ-OE1 3.78Å
155	Q	89.9	Confident	90.9	Very high	7 Å²	7	28.4 Å²	28.4	3%	0.033	18%	0.18	C	C	.	.	H	α-helix	trans	-74.7	-48.3	175.7	-65.2	-69.8	4.7	0	0	112.2	L146 G151 W152 A157 V158 R671 Y694 C695 S696	L146-Q155 HydrophobicContact CB-CG 4.47Å; L146-Q155 HydrophobicContact CD2-CB 3.55Å; L146-Q155 HydrophobicContact CD2-CG 4.11Å; L146-Q155 WeakPolarHBondContact O-CG 3.38Å; L146-Q155 PolarHBondContact O-NE2 2.66Å; G151-Q155 PolarHBondContact O-N 3Å; W152-Q155 PolarHBondContact O-N 3.16Å; Q155-A157 VanDerWaalsContact C-N 3.28Å; Q155-A157 PolarHBondContact O-N 3.14Å; Q155-V158 WeakPolarHBondContact O-CB 3.39Å; Q155-V158 WeakPolarHBondContact O-CG2 3.41Å; Q155-V158 PolarHBondContact O-N 2.84Å; Q155-V158 VanDerWaalsContact O-N 3.15Å; Q155-R671 PolarHBondContact O-NH1 3.34Å; Q155-R671 VanDerWaalsContact O-NH1 3.12Å; Q155-Y694 PolarHBondContact NE2-O 3.02Å; Q155-Y694 PolarHBondContact OE1-O 2.75Å; Q155-C695 PolarHBondContact OE1-O 3.48Å; Q155-C695 VanDerWaalsContact OE1-O 3.08Å; Q155-S696 PolarHBondContact NE2-OG 2.84Å
156	F	93.5	Very high	91.2	Very high	4 Å²	4	28.4 Å²	28.4	2%	0.018	18%	0.18	C	C	.	.	H	α-helix	trans	-73.4	-20.2	177.2	-63.3	-43.3	0	0	0	113.1	L146 W152 V158 T159 M160 I167 L169 F209 I213 W217	L146-F156 HydrophobicContact CD1-CE1 3.63Å; L146-F156 HydrophobicContact CD1-CE2 4.33Å; L146-F156 HydrophobicContact CD1-CZ 3.37Å; L146-F156 HydrophobicContact CD2-CD1 4.27Å; L146-F156 HydrophobicContact CD2-CE1 3.78Å; L146-F156 HydrophobicContact CD2-CZ 4.26Å; L146-F156 HydrophobicContact CG-CE1 4.39Å; L146-F156 HydrophobicContact CG-CZ 4.49Å; W152-F156 HydrophobicContact CB-CD2 4.18Å; W152-F156 HydrophobicContact CB-CE2 3.97Å; W152-F156 AromaticContact CD2-CE2 3.97Å; W152-F156 HydrophobicContact CD2-CE2 3.97Å; W152-F156 HydrophobicContact CD2-CZ 4.29Å; W152-F156 AromaticContact CE3-CE2 3.58Å; W152-F156 HydrophobicContact CE3-CE2 3.58Å; W152-F156 HydrophobicContact CE3-CZ 4.01Å; W152-F156 HydrophobicContact CG-CE2 4.21Å; W152-F156 HydrophobicContact CZ3-CE2 4.25Å; W152-F156 HydrophobicContact CZ3-CZ 4.34Å; W152-F156 VanDerWaalsContact O-CD2 3.28Å; W152-F156 WeakPolarHBondContact O-CD2 3.49Å; W152-F156 PolarHBondContact O-N 2.96Å; F156-V158 PolarHBondContact O-N 3.46Å; F156-T159 WeakPolarHBondContact O-CB 3.26Å; F156-T159 PolarHBondContact O-N 2.77Å; F156-M160 PolarHBondContact O-N 3.32Å; F156-I167 HydrophobicContact CB-CD1 3.98Å; F156-I167 HydrophobicContact CD1-CD1 3.93Å; F156-I167 HydrophobicContact CD1-CG1 4.34Å; F156-I167 HydrophobicContact CD1-CG2 4.08Å; F156-I167 HydrophobicContact CE1-CG2 3.78Å; F156-I167 HydrophobicContact CG-CD1 3.91Å; F156-I167 HydrophobicContact CZ-CG2 4.41Å; F156-L169 HydrophobicContact CE1-CD2 3.68Å; F156-L169 HydrophobicContact CZ-CD1 4.17Å; F156-L169 HydrophobicContact CZ-CD2 3.67Å; F156-F209 AromaticContact CD2-CE1 3.72Å; F156-F209 HydrophobicContact CD2-CE1 3.72Å; F156-F209 AromaticContact CD2-CZ 3.91Å; F156-F209 HydrophobicContact CD2-CZ 3.91Å; F156-F209 AromaticContact CE2-CE1 3.73Å; F156-F209 HydrophobicContact CE2-CE1 3.73Å; F156-F209 HydrophobicContact CE2-CZ 4.27Å; F156-I213 HydrophobicContact CB-CD1 4.42Å; F156-I213 HydrophobicContact CD2-CD1 3.86Å; F156-I213 HydrophobicContact CG-CD1 4.47Å; F156-W217 HydrophobicContact CB-CH2 4.22Å; F156-W217 HydrophobicContact CB-CZ3 3.69Å
157	A	91.8	Very high	91.4	Very high	16 Å²	16	28.3 Å²	28.3	13%	0.132	18%	0.18	C	C	.	.	H	α-helix	trans	-56.1	-28.6	166.5	0	0	0	0	0	112	A153 Q155 N161 W697	A153-A157 VanDerWaalsContact O-CB 3.26Å; A153-A157 WeakPolarHBondContact O-CB 3.38Å; A153-A157 PolarHBondContact O-N 3.39Å; Q155-A157 VanDerWaalsContact C-N 3.28Å; Q155-A157 PolarHBondContact O-N 3.14Å; A157-N161 WeakPolarHBondContact O-CB 3.27Å; A157-N161 PolarHBondContact O-N 3.15Å; A157-N161 PolarHBondContact O-ND2 3.03Å; A157-W697 HydrophobicContact CB-CB 3.77Å; A157-W697 HydrophobicContact CB-CG 4.28Å
158	V	92.6	Very high	91.9	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-68.2	-44.3	173	-172.3	0	0	0	0	111	Q155 F156 N161 S162 W697 V718 I725	Q155-V158 WeakPolarHBondContact O-CB 3.39Å; Q155-V158 WeakPolarHBondContact O-CG2 3.41Å; Q155-V158 PolarHBondContact O-N 2.84Å; Q155-V158 VanDerWaalsContact O-N 3.15Å; F156-V158 PolarHBondContact O-N 3.46Å; V158-N161 PolarHBondContact O-N 3.07Å; V158-S162 VanDerWaalsContact O-CB 3.29Å; V158-S162 WeakPolarHBondContact O-CB 3.45Å; V158-S162 PolarHBondContact O-N 3.38Å; V158-S162 PolarHBondContact O-OG 3.07Å; V158-W697 HydrophobicContact CB-CE3 4.17Å; V158-W697 HydrophobicContact CG1-CE3 4.06Å; V158-W697 HydrophobicContact CG1-CZ3 4.41Å; V158-W697 HydrophobicContact CG2-CB 3.74Å; V158-W697 HydrophobicContact CG2-CE3 4.07Å; V158-W697 VanDerWaalsContact CG2-N 3.31Å; V158-V718 HydrophobicContact CB-CG2 4.37Å; V158-V718 HydrophobicContact CG1-CG2 3.75Å; V158-V718 HydrophobicContact CG2-CG2 3.64Å; V158-I725 HydrophobicContact CG1-CD1 4.02Å
159	T	94.4	Very high	92.2	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-62	-45.7	176.9	-51.1	0	0	0	0	111.4	Q139 F156 S162 Y164 I167 M219	Q139-T159 HydrophobicContact CB-CG2 3.6Å; Q139-T159 HydrophobicContact CG-CG2 4.44Å; Q139-T159 PolarHBondContact OE1-OG1 3.3Å; F156-T159 WeakPolarHBondContact O-CB 3.26Å; F156-T159 PolarHBondContact O-N 2.77Å; T159-S162 PolarHBondContact O-N 3.39Å; T159-Y164 HydrophobicContact CG2-CD2 3.99Å; T159-Y164 HydrophobicContact CG2-CG 4.22Å; T159-Y164 PolarHBondContact O-N 2.9Å; T159-I167 HydrophobicContact CG2-CG1 3.71Å; T159-M219 HydrophobicContact CG2-CE 3.86Å
160	M	92.4	Very high	92.4	Very high	62 Å²	62	23.4 Å²	23.4	31%	0.305	15%	0.149	S	C	.	.	H	α-helix	trans	-61.4	-51.9	175.9	-174.6	-114.3	-102.3	0	0	111.7	F156 S162 G163 W217 M219	F156-M160 PolarHBondContact O-N 3.32Å; M160-S162 PolarHBondContact O-N 2.85Å; M160-G163 WeakPolarHBondContact O-CA 3.37Å; M160-G163 PolarHBondContact O-N 3.17Å; M160-W217 HydrophobicContact CB-CE3 4.16Å; M160-W217 HydrophobicContact CE-CB 3.97Å; M160-W217 HydrophobicContact CE-CD2 3.52Å; M160-W217 HydrophobicContact CE-CE3 4.21Å; M160-W217 HydrophobicContact CE-CG 3.35Å; M160-W217 HydrophobicContact CE-CZ2 4.44Å; M160-W217 HydrophobicContact CG-CB 4.27Å; M160-W217 HydrophobicContact CG-CD2 4.42Å; M160-W217 HydrophobicContact CG-CE3 4.32Å; M160-W217 HydrophobicContact CG-CG 4.41Å; M160-M219 HydrophobicContact CB-CE 4.32Å; M160-M219 HydrophobicContact CB-SD 3.47Å; M160-M219 WeakPolarHBondContact CB-SD 3.41Å; M160-M219 HydrophobicContact CG-SD 3.68Å
161	N	91.8	Very high	92.8	Very high	56 Å²	56	18.1 Å²	18.1	30%	0.299	11%	0.112	S	C	.	.	H	α-helix	trans	-68.9	-18.1	178.9	-74.3	-69.5	0	0	0	112.8	A157 V158 G163 W697 Q729	A157-N161 WeakPolarHBondContact O-CB 3.27Å; A157-N161 PolarHBondContact O-N 3.15Å; A157-N161 PolarHBondContact O-ND2 3.03Å; V158-N161 PolarHBondContact O-N 3.07Å; N161-G163 PolarHBondContact O-N 2.86Å; N161-W697 HydrophobicContact CB-CD2 3.94Å; N161-W697 HydrophobicContact CB-CE3 4Å; N161-W697 HydrophobicContact CB-CH2 3.5Å; N161-W697 HydrophobicContact CB-CZ2 3.46Å; N161-W697 VanDerWaalsContact CB-CZ2 3.46Å; N161-W697 HydrophobicContact CB-CZ3 3.79Å; N161-W697 PolarHBondContact ND2-NE1 2.92Å; N161-Q729 VanDerWaalsContact O-CD 3.3Å; N161-Q729 WeakPolarHBondContact O-CG 3.39Å; N161-Q729 PolarHBondContact O-NE2 3.41Å
162	S	93.1	Very high	93.1	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-3.7	168.8	-57.5	0	0	0	0	112.9	V158 T159 M160 R728 Q729 N732	V158-S162 VanDerWaalsContact O-CB 3.29Å; V158-S162 WeakPolarHBondContact O-CB 3.45Å; V158-S162 PolarHBondContact O-N 3.38Å; V158-S162 PolarHBondContact O-OG 3.07Å; T159-S162 PolarHBondContact O-N 3.39Å; M160-S162 PolarHBondContact O-N 2.85Å; S162-R728 CarbonylContact O-C 3.54Å; S162-Q729 WeakPolarHBondContact O-CA 3.27Å; S162-Q729 PolarHBondContact O-N 3.44Å; S162-N732 PolarHBondContact O-ND2 2.78Å
163	G	90.5	Very high	93.3	Very high	34 Å²	34	16.9 Å²	16.9	35%	0.351	10%	0.099	S	C	.	.	T	Hydrogen-bonded Turn	trans	84.9	6.1	176.5	0	0	0	0	0	115.3	M160 N161 N732	M160-G163 WeakPolarHBondContact O-CA 3.37Å; M160-G163 PolarHBondContact O-N 3.17Å; N161-G163 PolarHBondContact O-N 2.86Å; G163-N732 VanDerWaalsContact C-ND2 3.31Å; G163-N732 WeakPolarHBondContact O-CB 3.35Å
164	Y	95.4	Very high	93.4	Very high	6 Å²	6	18.2 Å²	18.2	2%	0.024	10%	0.098	C	C	.	.			trans	-68.1	149.5	174.1	-65.4	-78.2	0	0	0	110.5	A137 C138 Q139 T159 M219 S669 D674 R728 N732	A137-Y164 HydrophobicContact CB-CD1 4.16Å; A137-Y164 WeakPolarHBondContact O-CB 3.36Å; C138-Y164 WeakPolarHBondContact O-CE1 3.24Å; Q139-Y164 HydrophobicContact CB-CD1 4.11Å; Q139-Y164 HydrophobicContact CB-CD2 3.75Å; Q139-Y164 HydrophobicContact CB-CE1 4.19Å; Q139-Y164 HydrophobicContact CB-CE2 3.86Å; Q139-Y164 HydrophobicContact CB-CG 3.87Å; Q139-Y164 HydrophobicContact CG-CD2 4.26Å; Q139-Y164 HydrophobicContact CG-CE2 3.91Å; Q139-Y164 VanDerWaalsContact NE2-CE2 3.34Å; T159-Y164 HydrophobicContact CG2-CD2 3.99Å; T159-Y164 HydrophobicContact CG2-CG 4.22Å; T159-Y164 PolarHBondContact O-N 2.9Å; Y164-M219 WeakPolarHBondContact O-CE 3.39Å; Y164-S669 VanDerWaalsContact OH-CB 3.29Å; Y164-S669 WeakPolarHBondContact OH-CB 3.41Å; Y164-D674 VanDerWaalsContact CE2-OD2 3.28Å; Y164-D674 WeakPolarHBondContact CE2-OD2 3.5Å; Y164-D674 PolarHBondContact OH-OD1 2.66Å; Y164-D674 PolarHBondContact OH-OD2 3.5Å; Y164-R728 HydrophobicContact CE1-CG 4.38Å; Y164-R728 HydrophobicContact CE2-CG 3.78Å; Y164-R728 VanDerWaalsContact OH-CD 3.23Å; Y164-R728 WeakPolarHBondContact OH-CD 3.47Å; Y164-R728 WeakPolarHBondContact OH-CG 3.45Å; Y164-R728 VanDerWaalsContact OH-CZ 3.28Å; Y164-R728 PolarHBondContact OH-NE 3.37Å; Y164-R728 VanDerWaalsContact OH-NE 3.1Å; Y164-N732 PolarHBondContact N-ND2 2.82Å
165	N	92.6	Very high	93.6	Very high	25 Å²	25	14.8 Å²	14.8	13%	0.134	8%	0.084	C	C	.	.	S	Bend	trans	-115.4	0.8	177.8	62.8	24.9	0	0	0	113.4	A135 I136 A137 M219 L220	A135-N165 PolarHBondContact O-ND2 2.86Å; I136-N165 WeakPolarHBondContact CA-OD1 3.15Å; A137-N165 PolarHBondContact N-OD1 2.89Å; A137-N165 PolarHBondContact O-N 3.17Å; A137-N165 PolarHBondContact O-OD1 2.95Å; N165-M219 WeakPolarHBondContact O-CA 3.36Å; N165-L220 PolarHBondContact O-N 2.64Å
166	M	95	Very high	93.6	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	132.6	169.4	-176.2	178.1	-74.8	0	0	111.4	I136 A137 C138 Q139 L220 M222	I136-M166 HydrophobicContact CD1-CE 3.96Å; I136-M166 HydrophobicContact CG1-CE 4.39Å; I136-M166 HydrophobicContact CG2-CB 3.94Å; I136-M166 HydrophobicContact CG2-CE 3.93Å; I136-M166 HydrophobicContact CG2-SD 3.93Å; A137-M166 PolarHBondContact O-N 2.88Å; A137-M166 VanDerWaalsContact O-N 3.09Å; C138-M166 CarbonylContact C-O 3.21Å; C138-M166 VanDerWaalsContact CA-O 3.26Å; C138-M166 WeakPolarHBondContact CA-O 3.36Å; C138-M166 HydrophobicContact CB-CB 4.06Å; C138-M166 HydrophobicContact CB-CG 4.37Å; C138-M166 HydrophobicContact CB-SD 4.45Å; Q139-M166 PolarHBondContact N-O 3.31Å; M166-L220 CarbonylContact C-O 3.59Å; M166-L220 WeakPolarHBondContact CA-O 3.17Å; M166-L220 HydrophobicContact CB-CB 4.13Å; M166-L220 HydrophobicContact CE-CB 3.83Å; M166-L220 HydrophobicContact CE-CD1 3.74Å; M166-L220 HydrophobicContact CE-CG 4.46Å; M166-L220 HydrophobicContact CG-CB 4.05Å; M166-M222 HydrophobicContact SD-CB 4.09Å
167	I	96.2	Very high	93.2	Very high	1 Å²	1	22 Å²	22	1%	0.005	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	128.5	166.8	-65.7	150.4	0	0	0	108	V141 F156 T159 L169 I213 M219 L220 T221 M222	V141-I167 HydrophobicContact CG2-CG2 4.3Å; F156-I167 HydrophobicContact CB-CD1 3.98Å; F156-I167 HydrophobicContact CD1-CD1 3.93Å; F156-I167 HydrophobicContact CD1-CG1 4.34Å; F156-I167 HydrophobicContact CD1-CG2 4.08Å; F156-I167 HydrophobicContact CE1-CG2 3.78Å; F156-I167 HydrophobicContact CG-CD1 3.91Å; F156-I167 HydrophobicContact CZ-CG2 4.41Å; T159-I167 HydrophobicContact CG2-CG1 3.71Å; I167-L169 HydrophobicContact CG2-CD2 3.54Å; I167-L169 HydrophobicContact CG2-CG 4.01Å; I167-I213 HydrophobicContact CD1-CD1 4.45Å; I167-M219 HydrophobicContact CD1-CE 3.6Å; I167-M219 HydrophobicContact CD1-SD 4.37Å; I167-M219 HydrophobicContact CG1-CE 3.59Å; I167-L220 PolarHBondContact N-O 3.1Å; I167-T221 CarbonylContact O-C 3.6Å; I167-T221 VanDerWaalsContact O-CA 3.31Å; I167-T221 WeakPolarHBondContact O-CA 3.39Å; I167-M222 PolarHBondContact O-N 3.13Å
168	H	97	Very high	92.8	Very high	4 Å²	4	22.5 Å²	22.5	2%	0.019	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	127.2	168.7	170.8	-142.3	0	0	0	109.5	C138 Q139 S140 V141 M222 D224	C138-H168 VanDerWaalsContact SG-CB 3.54Å; Q139-H168 PolarHBondContact O-N 3.09Å; S140-H168 CarbonylContact C-O 3.52Å; S140-H168 WeakPolarHBondContact CA-O 3.29Å; S140-H168 PolarHBondContact OG-ND1 3.22Å; V141-H168 PolarHBondContact N-O 2.94Å; H168-M222 CarbonylContact C-O 3.56Å; H168-M222 WeakPolarHBondContact CA-O 3.44Å; H168-M222 HydrophobicContact CB-CB 4.24Å; H168-M222 HydrophobicContact CB-CE 3.88Å; H168-D224 IonicContact CE1-OD1 2.78Å; H168-D224 IonicContact NE2-OD1 3.61Å; H168-D224 PolarHBondContact NE2-OD1 3.09Å; H168-D224 VanDerWaalsContact NE2-OD1 3.16Å
169	L	96.2	Very high	92.3	Very high	5 Å²	5	26.1 Å²	26.1	3%	0.026	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	138.1	179.2	-59	-176.6	0	0	0	111.1	V141 L146 W152 F156 I167 V172 M222 S223 D224 F534	V141-L169 HydrophobicContact CB-CD2 4.16Å; L146-L169 HydrophobicContact CD1-CD2 4.38Å; W152-L169 HydrophobicContact CH2-CD1 4.41Å; W152-L169 HydrophobicContact CZ3-CD1 4.28Å; F156-L169 HydrophobicContact CE1-CD2 3.68Å; F156-L169 HydrophobicContact CZ-CD1 4.17Å; F156-L169 HydrophobicContact CZ-CD2 3.67Å; I167-L169 HydrophobicContact CG2-CD2 3.54Å; I167-L169 HydrophobicContact CG2-CG 4.01Å; L169-V172 HydrophobicContact CD1-CG1 4.2Å; L169-M222 PolarHBondContact N-O 3Å; L169-S223 WeakPolarHBondContact O-CA 3.45Å; L169-D224 PolarHBondContact O-N 2.91Å; L169-F534 HydrophobicContact CD1-CE1 4.04Å; L169-F534 HydrophobicContact CD1-CZ 4.45Å
170	T	94.9	Very high	91.9	Very high	1 Å²	1	27.3 Å²	27.3	1%	0.006	14%	0.142	C	C	.	.			trans	-59.8	165.7	156.7	63.1	0	0	0	0	110.5	V141 Y142 A143 V172 A181 W182 D224 L639	V141-T170 PolarHBondContact O-N 3.35Å; Y142-T170 HydrophobicContact CD1-CG2 3.68Å; Y142-T170 HydrophobicContact CE1-CG2 4.04Å; Y142-T170 HydrophobicContact CG-CG2 4.27Å; A143-T170 PolarHBondContact N-OG1 3.43Å; T170-V172 PolarHBondContact O-N 2.9Å; T170-A181 HydrophobicContact CG2-CB 4.08Å; T170-W182 HydrophobicContact CG2-CZ2 4.04Å; T170-D224 WeakPolarHBondContact CA-OD2 3.33Å; T170-L639 HydrophobicContact CG2-CD1 3.7Å
171	P	94.8	Very high	91.7	Very high	4 Å²	4	24.4 Å²	24.4	3%	0.026	13%	0.128	C	C	.	.			trans	-50.2	135.5	179.8	-29.4	37.9	0	0	0	113.6	A181 I184 D224 V226	P171-A181 VanDerWaalsContact CD-O 3.28Å; P171-A181 WeakPolarHBondContact CD-O 3.28Å; P171-A181 WeakPolarHBondContact CG-O 3.5Å; P171-I184 HydrophobicContact CB-CD1 3.64Å; P171-I184 HydrophobicContact CB-CG1 3.88Å; P171-I184 HydrophobicContact CG-CD1 3.94Å; P171-I184 HydrophobicContact CG-CG1 4.33Å; P171-D224 HydrophobicContact CG-CB 3.92Å; P171-V226 HydrophobicContact CG-CG2 3.78Å
172	V	94.2	Very high	91.7	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.118	C	C	.	.			trans	-96.8	-1.1	178.2	-62.8	0	0	0	0	112.3	A143 W152 L169 T170 L190 N191 F195 L206	A143-V172 HydrophobicContact CB-CG1 4.13Å; W152-V172 HydrophobicContact CH2-CG1 3.92Å; L169-V172 HydrophobicContact CD1-CG1 4.2Å; T170-V172 PolarHBondContact O-N 2.9Å; V172-L190 HydrophobicContact CB-CD2 4.2Å; V172-L190 HydrophobicContact CG2-CD2 3.7Å; V172-L190 WeakPolarHBondContact O-CD2 3.36Å; V172-N191 PolarHBondContact O-N 2.79Å; V172-F195 HydrophobicContact CB-CE2 4.38Å; V172-L206 HydrophobicContact CG2-CD2 3.87Å
173	Q	94.7	Very high	91.7	Very high	1 Å²	1	23 Å²	23	1%	0.005	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	165.6	-178.5	-71.3	67.8	33.1	0	0	111.7	L175 I184 Q187 K189 Y526	Q173-L175 PolarHBondContact O-N 2.89Å; Q173-I184 HydrophobicContact CB-CD1 4.3Å; Q173-I184 HydrophobicContact CB-CG1 4.31Å; Q173-I184 HydrophobicContact CB-CG2 3.61Å; Q173-I184 HydrophobicContact CG-CG2 4.48Å; Q173-Q187 WeakPolarHBondContact CG-O 3.44Å; Q173-K189 CarbonylContact C-O 3.5Å; Q173-K189 WeakPolarHBondContact CA-O 3.2Å; Q173-Y526 HydrophobicContact CG-CD2 4.33Å; Q173-Y526 HydrophobicContact CG-CE2 3.91Å
174	K	93.5	Very high	91.9	Very high	65 Å²	65	21.4 Å²	21.4	28%	0.283	10%	0.102	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.1	119.5	177.6	-168.7	-166.2	176.5	81.5	0	110.4	I184 S185 D186 K189 D192	K174-I184 CarbonylContact O-C 3.1Å; K174-I184 WeakPolarHBondContact O-CA 3.43Å; K174-I184 WeakPolarHBondContact O-CG2 3.49Å; K174-S185 WeakPolarHBondContact CG-OG 3.45Å; K174-S185 PolarHBondContact O-N 2.99Å; K174-S185 PolarHBondContact O-OG 3.48Å; K174-D186 HydrophobicContact CB-CB 4.11Å; K174-D186 HydrophobicContact CD-CB 3.97Å; K174-D186 PolarHBondContact O-N 3.27Å; K174-K189 HydrophobicContact CB-CB 4.23Å; K174-K189 PolarHBondContact N-O 3.21Å; K174-D192 IonicContact NZ-OD2 2.89Å; K174-D192 PolarHBondContact NZ-OD2 3.33Å
175	L	91.5	Very high	91.9	Very high	19 Å²	19	21.6 Å²	21.6	10%	0.099	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	162.1	177.9	-55.6	-176.8	0	0	0	111.4	N144 Q173 S183 S185	N144-L175 HydrophobicContact CB-CD1 4.33Å; Q173-L175 PolarHBondContact O-N 2.89Å; L175-S183 CarbonylContact C-O 3.52Å; L175-S185 VanDerWaalsContact C-OG 3.3Å; L175-S185 WeakPolarHBondContact O-CB 3.48Å; L175-S185 PolarHBondContact O-OG 3.41Å
176	G	89.2	Confident	92	Very high	6 Å²	6	21.5 Å²	21.5	6%	0.062	10%	0.103	C	C	.	.			trans	-85.1	178.9	169.5	0	0	0	0	0	113.3	S178 R179 S183 D233	G176-S178 PolarHBondContact O-N 3.45Å; G176-S178 VanDerWaalsContact O-N 3.09Å; G176-R179 PolarHBondContact O-N 3.48Å; G176-S183 PolarHBondContact N-O 3.44Å; G176-D233 VanDerWaalsContact CA-OD1 3.25Å; G176-D233 WeakPolarHBondContact CA-OD1 2.97Å
177	Q	85.6	Confident	92	Very high	156 Å²	156	21.5 Å²	21.5	73%	0.729	10%	0.104	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.3	-25.3	-179.7	-86.8	162.1	64.7	0	0	115.3	R179 D233	Q177-R179 PolarHBondContact O-N 3.07Å; Q177-D233 VanDerWaalsContact CG-OD2 3.26Å; Q177-D233 WeakPolarHBondContact CG-OD2 3.45Å; Q177-D233 PolarHBondContact N-OD1 3.01Å; Q177-D233 PolarHBondContact N-OD2 2.99Å; Q177-D233 VanDerWaalsContact NE2-CB 3.32Å; Q177-D233 PolarHBondContact NE2-OD2 3.26Å
178	S	82.4	Confident	91.8	Very high	27 Å²	27	24.3 Å²	24.3	19%	0.189	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-20.7	175.3	58.2	0	0	0	0	113.7	G176 D180 S183	G176-S178 PolarHBondContact O-N 3.45Å; G176-S178 VanDerWaalsContact O-N 3.09Å; S178-D180 PolarHBondContact O-N 3.06Å; S178-D180 PolarHBondContact OG-N 3.5Å; S178-S183 WeakPolarHBondContact OG-CB 3.39Å; S178-S183 PolarHBondContact OG-OG 3.09Å
179	R	82.9	Confident	91.6	Very high	76 Å²	76	28.6 Å²	28.6	29%	0.287	14%	0.137	S	C	.	.			trans	54.3	14.5	-169.4	-66.1	177	161.2	153	-1.8	115.1	G176 Q177 E193	G176-R179 PolarHBondContact O-N 3.48Å; Q177-R179 PolarHBondContact O-N 3.07Å; R179-E193 IonicContact CZ-OE1 3.07Å; R179-E193 VanDerWaalsContact CZ-OE1 3.3Å; R179-E193 IonicContact NE-OE1 3.48Å; R179-E193 PolarHBondContact NE-OE1 3.01Å; R179-E193 VanDerWaalsContact NE-OE1 3.08Å; R179-E193 IonicContact NE-OE2 3.29Å; R179-E193 IonicContact NH2-OE1 2.71Å; R179-E193 PolarHBondContact NH2-OE1 3.31Å
180	D	85.8	Confident	91.5	Very high	25 Å²	25	28.3 Å²	28.3	13%	0.134	14%	0.135	C	C	.	.			trans	-62.8	137.7	168	177.8	-83.3	0	0	0	109.5	S178 W182 S183	S178-D180 PolarHBondContact O-N 3.06Å; S178-D180 PolarHBondContact OG-N 3.5Å; D180-W182 VanDerWaalsContact C-N 3.26Å; D180-W182 PolarHBondContact O-N 3.2Å; D180-W182 WeakPolarHBondContact OD1-CA 3.27Å; D180-W182 PolarHBondContact OD1-N 3.04Å; D180-S183 PolarHBondContact O-N 2.92Å; D180-S183 PolarHBondContact OD1-N 3.2Å
181	A	88.3	Confident	91.3	Very high	1 Å²	1	28.7 Å²	28.7	1%	0.008	14%	0.137	C	C	.	.	S	Bend	trans	-66.7	-24.3	-170.8	0	0	0	0	0	113.8	Y142 T170 P171	Y142-A181 HydrophobicContact CD1-CB 3.87Å; Y142-A181 HydrophobicContact CE1-CB 4.14Å; T170-A181 HydrophobicContact CG2-CB 4.08Å; P171-A181 VanDerWaalsContact CD-O 3.28Å; P171-A181 WeakPolarHBondContact CD-O 3.28Å; P171-A181 WeakPolarHBondContact CG-O 3.5Å
182	W	92.2	Very high	91	Very high	27 Å²	27	31.9 Å²	31.9	10%	0.102	15%	0.154	C	C	.	.	S	Bend	trans	-98.7	-15.3	178.1	-59.6	-74.2	0	0	0	112.9	Y142 T170 D180 I184 D224 V226 H229 V540 L639 D640 I682	Y142-W182 AromaticContact CE1-CH2 3.79Å; Y142-W182 HydrophobicContact CE1-CH2 3.79Å; Y142-W182 HydrophobicContact CE1-CZ2 4.43Å; Y142-W182 HydrophobicContact CE1-CZ3 4.08Å; Y142-W182 WeakPolarHBondContact OH-CH2 3.48Å; T170-W182 HydrophobicContact CG2-CZ2 4.04Å; D180-W182 VanDerWaalsContact C-N 3.26Å; D180-W182 PolarHBondContact O-N 3.2Å; D180-W182 WeakPolarHBondContact OD1-CA 3.27Å; D180-W182 PolarHBondContact OD1-N 3.04Å; W182-I184 VanDerWaalsContact C-N 3.26Å; W182-I184 PolarHBondContact O-N 3.05Å; W182-D224 PolarHBondContact NE1-OD2 3.31Å; W182-V226 HydrophobicContact CB-CG2 4.26Å; W182-H229 PolarHBondContact O-NE2 3.45Å; W182-V540 HydrophobicContact CG-CG1 4.26Å; W182-L639 HydrophobicContact CH2-CB 3.97Å; W182-L639 HydrophobicContact CZ2-CB 3.87Å; W182-L639 HydrophobicContact CZ2-CD1 4.15Å; W182-D640 HydrophobicContact CH2-CB 4.1Å; W182-D640 HydrophobicContact CZ3-CB 4.33Å; W182-I682 HydrophobicContact CZ3-CD1 4.31Å
183	S	92.1	Very high	90.5	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.176	C	C	.	.			trans	-75.3	70.4	173.8	-169	0	0	0	0	112.7	L175 G176 S178 D180 A231 H503	L175-S183 CarbonylContact C-O 3.52Å; G176-S183 PolarHBondContact N-O 3.44Å; S178-S183 WeakPolarHBondContact OG-CB 3.39Å; S178-S183 PolarHBondContact OG-OG 3.09Å; D180-S183 PolarHBondContact O-N 2.92Å; D180-S183 PolarHBondContact OD1-N 3.2Å; S183-A231 WeakPolarHBondContact OG-CB 3.4Å; S183-H503 PolarHBondContact OG-O 3.04Å
184	I	95.1	Very high	90.2	Very high	1 Å²	1	36.9 Å²	36.9	1%	0.005	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	123	179.6	-56.9	169	0	0	0	110.6	P171 Q173 K174 W182 Q187 V226 T230 A231	P171-I184 HydrophobicContact CB-CD1 3.64Å; P171-I184 HydrophobicContact CB-CG1 3.88Å; P171-I184 HydrophobicContact CG-CD1 3.94Å; P171-I184 HydrophobicContact CG-CG1 4.33Å; Q173-I184 HydrophobicContact CB-CD1 4.3Å; Q173-I184 HydrophobicContact CB-CG1 4.31Å; Q173-I184 HydrophobicContact CB-CG2 3.61Å; Q173-I184 HydrophobicContact CG-CG2 4.48Å; K174-I184 CarbonylContact O-C 3.1Å; K174-I184 WeakPolarHBondContact O-CA 3.43Å; K174-I184 WeakPolarHBondContact O-CG2 3.49Å; W182-I184 VanDerWaalsContact C-N 3.26Å; W182-I184 PolarHBondContact O-N 3.05Å; I184-Q187 HydrophobicContact CG2-CB 4.38Å; I184-Q187 HydrophobicContact CG2-CG 3.9Å; I184-V226 HydrophobicContact CD1-CB 4.04Å; I184-V226 HydrophobicContact CD1-CG2 4.04Å; I184-T230 PolarHBondContact O-OG1 3.48Å; I184-A231 PolarHBondContact O-N 3.32Å
185	S	94.9	Very high	90.1	Very high	9 Å²	9	34.1 Å²	34.1	6%	0.063	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	-36.9	173.7	64.6	0	0	0	0	113.2	K174 L175 S234 W236	K174-S185 WeakPolarHBondContact CG-OG 3.45Å; K174-S185 PolarHBondContact O-N 2.99Å; K174-S185 PolarHBondContact O-OG 3.48Å; L175-S185 VanDerWaalsContact C-OG 3.3Å; L175-S185 WeakPolarHBondContact O-CB 3.48Å; L175-S185 PolarHBondContact O-OG 3.41Å; S185-S234 WeakPolarHBondContact CA-OG 3.41Å; S185-S234 WeakPolarHBondContact O-CB 3.4Å; S185-S234 PolarHBondContact O-OG 2.69Å; S185-W236 PolarHBondContact O-NE1 2.98Å
186	D	94.9	Very high	89.7	Confident	23 Å²	23	34.8 Å²	34.8	12%	0.123	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	100.5	176.6	-167.5	-12.8	0	0	0	111.5	K174 L188 K189 R522	K174-D186 HydrophobicContact CB-CB 4.11Å; K174-D186 HydrophobicContact CD-CB 3.97Å; K174-D186 PolarHBondContact O-N 3.27Å; D186-L188 PolarHBondContact O-N 3.19Å; D186-L188 VanDerWaalsContact O-N 3.12Å; D186-L188 PolarHBondContact OD1-N 3.26Å; D186-L188 VanDerWaalsContact OD1-N 3.1Å; D186-K189 HydrophobicContact CB-CB 4.29Å; D186-K189 PolarHBondContact O-N 2.89Å; D186-K189 VanDerWaalsContact O-O 3.08Å; D186-K189 WeakPolarHBondContact OD2-CD 3.41Å; D186-K189 WeakPolarHBondContact OD2-CE 3.41Å; D186-K189 WeakPolarHBondContact OD2-CG 3.28Å; D186-K189 IonicContact OD2-NZ 2.85Å; D186-K189 PolarHBondContact OD2-NZ 3.08Å; D186-R522 IonicContact OD1-CZ 3.24Å; D186-R522 IonicContact OD1-NH1 3.87Å; D186-R522 IonicContact OD1-NH2 2.73Å; D186-R522 PolarHBondContact OD1-NH2 3.35Å
187	Q	94.7	Very high	89.1	Confident	1 Å²	1	40.4 Å²	40.4	1%	0.005	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.8	-19.1	179.2	-63	75.9	12.7	0	0	114.2	Q173 I184 T230 R522 M523 Y526	Q173-Q187 WeakPolarHBondContact CG-O 3.44Å; I184-Q187 HydrophobicContact CG2-CB 4.38Å; I184-Q187 HydrophobicContact CG2-CG 3.9Å; Q187-T230 PolarHBondContact NE2-OG1 3.32Å; Q187-R522 VanDerWaalsContact OE1-NE 3.16Å; Q187-M523 HydrophobicContact CG-CE 3.9Å; Q187-M523 HydrophobicContact CG-SD 4.29Å; Q187-Y526 HydrophobicContact CB-CD1 4.13Å; Q187-Y526 HydrophobicContact CB-CD2 3.98Å; Q187-Y526 HydrophobicContact CB-CG 3.75Å; Q187-Y526 HydrophobicContact CG-CD1 4.08Å; Q187-Y526 HydrophobicContact CG-CE1 4.37Å; Q187-Y526 HydrophobicContact CG-CG 4.23Å; Q187-Y526 WeakPolarHBondContact O-CD2 3.46Å
188	L	93.7	Very high	88.5	Confident	59 Å²	59	36.6 Å²	36.6	31%	0.309	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	5.6	-176.6	-56.5	-175.1	0	0	0	113	D186 F203 R522 K525	D186-L188 PolarHBondContact O-N 3.19Å; D186-L188 VanDerWaalsContact O-N 3.12Å; D186-L188 PolarHBondContact OD1-N 3.26Å; D186-L188 VanDerWaalsContact OD1-N 3.1Å; L188-F203 WeakPolarHBondContact O-CE2 3.42Å; L188-R522 HydrophobicContact CD1-CG 4.29Å; L188-K525 HydrophobicContact CD1-CB 4.4Å; L188-K525 HydrophobicContact CD1-CD 4.34Å; L188-K525 HydrophobicContact CD2-CB 3.7Å
189	K	92.6	Very high	88	Confident	94 Å²	94	35.4 Å²	35.4	41%	0.409	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	151.9	172.9	-66	-178.7	-170.5	159.8	0	110.3	Q173 K174 D186	Q173-K189 CarbonylContact C-O 3.5Å; Q173-K189 WeakPolarHBondContact CA-O 3.2Å; K174-K189 HydrophobicContact CB-CB 4.23Å; K174-K189 PolarHBondContact N-O 3.21Å; D186-K189 HydrophobicContact CB-CB 4.29Å; D186-K189 PolarHBondContact O-N 2.89Å; D186-K189 VanDerWaalsContact O-O 3.08Å; D186-K189 WeakPolarHBondContact OD2-CD 3.41Å; D186-K189 WeakPolarHBondContact OD2-CE 3.41Å; D186-K189 WeakPolarHBondContact OD2-CG 3.28Å; D186-K189 IonicContact OD2-NZ 2.85Å; D186-K189 PolarHBondContact OD2-NZ 3.08Å
190	L	92.9	Very high	87.4	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	163.6	172.1	-69.4	175.8	0	0	0	111.4	V172 D192 F195 F203 L206	V172-L190 HydrophobicContact CB-CD2 4.2Å; V172-L190 HydrophobicContact CG2-CD2 3.7Å; V172-L190 WeakPolarHBondContact O-CD2 3.36Å; L190-D192 PolarHBondContact O-N 3.31Å; L190-F195 HydrophobicContact CB-CB 4.5Å; L190-F195 HydrophobicContact CB-CD2 3.6Å; L190-F195 HydrophobicContact CB-CE2 3.97Å; L190-F195 HydrophobicContact CB-CG 4.06Å; L190-F195 HydrophobicContact CD1-CD1 3.92Å; L190-F195 HydrophobicContact CD1-CD2 4.06Å; L190-F195 HydrophobicContact CD1-CE1 3.9Å; L190-F195 HydrophobicContact CD1-CE2 4.04Å; L190-F195 HydrophobicContact CD1-CG 4.01Å; L190-F195 HydrophobicContact CD1-CZ 3.97Å; L190-F195 HydrophobicContact CD2-CE2 4.03Å; L190-F195 HydrophobicContact CD2-CZ 4.29Å; L190-F195 HydrophobicContact CG-CD2 4.29Å; L190-F195 HydrophobicContact CG-CE2 4.25Å; L190-F203 HydrophobicContact CD1-CD1 4.41Å; L190-F203 HydrophobicContact CD1-CD2 4.33Å; L190-F203 HydrophobicContact CD1-CG 4.23Å; L190-F203 HydrophobicContact CD2-CD1 3.93Å; L190-F203 HydrophobicContact CD2-CE1 3.54Å; L190-F203 HydrophobicContact CD2-CE2 4.26Å; L190-F203 HydrophobicContact CD2-CG 4.45Å; L190-F203 HydrophobicContact CD2-CZ 3.73Å; L190-F203 HydrophobicContact CG-CD1 4.21Å; L190-F203 HydrophobicContact CG-CD2 4.06Å; L190-F203 HydrophobicContact CG-CE1 4.04Å; L190-F203 HydrophobicContact CG-CE2 3.87Å; L190-F203 HydrophobicContact CG-CG 4.23Å; L190-F203 HydrophobicContact CG-CZ 3.87Å; L190-L206 HydrophobicContact CD2-CD2 4.37Å
191	N	91.1	Very high	86.6	Confident	9 Å²	9	43.2 Å²	43.2	5%	0.048	24%	0.237	C	C	.	.			trans	-68.3	117	177.9	-172.5	-15.3	0	0	0	111.7	V172 E193 I194 F195	V172-N191 PolarHBondContact O-N 2.79Å; N191-E193 PolarHBondContact O-N 3.18Å; N191-E193 WeakPolarHBondContact OD1-CB 3.38Å; N191-E193 PolarHBondContact OD1-N 2.82Å; N191-I194 HydrophobicContact CB-CB 4.2Å; N191-I194 HydrophobicContact CB-CD1 3.87Å; N191-I194 HydrophobicContact CB-CG1 4.02Å; N191-I194 PolarHBondContact O-N 2.85Å; N191-F195 WeakPolarHBondContact O-CD2 3.48Å; N191-F195 PolarHBondContact O-N 3.06Å
192	D	88	Confident	86	Confident	70 Å²	70	43.2 Å²	43.2	37%	0.374	24%	0.236	S	C	.	.	H	α-helix	trans	-59.5	-31.8	179.3	-51.4	-60.5	0	0	0	112.7	K174 L190 I194 G196 A199	K174-D192 IonicContact NZ-OD2 2.89Å; K174-D192 PolarHBondContact NZ-OD2 3.33Å; L190-D192 PolarHBondContact O-N 3.31Å; D192-I194 VanDerWaalsContact C-N 3.27Å; D192-I194 PolarHBondContact O-N 3.41Å; D192-G196 WeakPolarHBondContact O-CA 3.45Å; D192-G196 PolarHBondContact O-N 3.26Å; D192-A199 WeakPolarHBondContact OD1-CB 3.31Å
193	E	84.8	Confident	85.8	Confident	99 Å²	99	43.8 Å²	43.8	46%	0.463	24%	0.24	S	C	.	.	H	α-helix	trans	-70.2	-25.3	178.5	-59.7	-173.5	165.1	0	0	112.4	R179 N191	R179-E193 IonicContact CZ-OE1 3.07Å; R179-E193 VanDerWaalsContact CZ-OE1 3.3Å; R179-E193 IonicContact NE-OE1 3.48Å; R179-E193 PolarHBondContact NE-OE1 3.01Å; R179-E193 VanDerWaalsContact NE-OE1 3.08Å; R179-E193 IonicContact NE-OE2 3.29Å; R179-E193 IonicContact NH2-OE1 2.71Å; R179-E193 PolarHBondContact NH2-OE1 3.31Å; N191-E193 PolarHBondContact O-N 3.18Å; N191-E193 WeakPolarHBondContact OD1-CB 3.38Å; N191-E193 PolarHBondContact OD1-N 2.82Å
194	I	88.9	Confident	85.7	Confident	7 Å²	7	45.4 Å²	45.4	4%	0.036	26%	0.256	C	S	.	.	H	α-helix	trans	-92.6	-50.4	-179.9	-61.5	177.3	0	0	0	110.3	A143 P148 F149 W152 N191 D192	A143-I194 HydrophobicContact CB-CD1 4.31Å; A143-I194 WeakPolarHBondContact O-CD1 3.32Å; P148-I194 CarbonylContact C-O 3.6Å; P148-I194 WeakPolarHBondContact CA-O 3.34Å; F149-I194 HydrophobicContact CB-CG2 4.35Å; F149-I194 WeakPolarHBondContact CB-O 3.37Å; F149-I194 PolarHBondContact N-O 3.06Å; W152-I194 HydrophobicContact CH2-CG2 4.22Å; W152-I194 HydrophobicContact CZ2-CD1 4.25Å; W152-I194 HydrophobicContact CZ2-CG2 3.34Å; N191-I194 HydrophobicContact CB-CB 4.2Å; N191-I194 HydrophobicContact CB-CD1 3.87Å; N191-I194 HydrophobicContact CB-CG1 4.02Å; N191-I194 PolarHBondContact O-N 2.85Å; D192-I194 VanDerWaalsContact C-N 3.27Å; D192-I194 PolarHBondContact O-N 3.41Å
195	F	89.7	Confident	85.4	Confident	7 Å²	7	48.5 Å²	48.5	3%	0.031	27%	0.272	C	S	.	.	H	α-helix	trans	-96.8	-14.4	-170.4	-65.8	-90.3	0	0	0	113.6	F149 W152 V172 L190 N191 N198 A199 L206	F149-F195 HydrophobicContact CB-CD1 3.96Å; F149-F195 HydrophobicContact CB-CE1 4.21Å; F149-F195 HydrophobicContact CD1-CD1 4.17Å; F149-F195 HydrophobicContact CD1-CE1 4.27Å; F149-F195 AromaticContact CD2-CD1 3.93Å; F149-F195 HydrophobicContact CD2-CD1 3.93Å; F149-F195 AromaticContact CD2-CE1 3.34Å; F149-F195 HydrophobicContact CD2-CE1 3.34Å; F149-F195 AromaticContact CD2-CZ 3.99Å; F149-F195 HydrophobicContact CD2-CZ 3.99Å; F149-F195 HydrophobicContact CE2-CD1 4.48Å; F149-F195 AromaticContact CE2-CE1 3.65Å; F149-F195 HydrophobicContact CE2-CE1 3.65Å; F149-F195 HydrophobicContact CE2-CZ 4.36Å; F149-F195 AromaticContact CG-CD1 3.76Å; F149-F195 HydrophobicContact CG-CD1 3.76Å; F149-F195 AromaticContact CG-CE1 3.69Å; F149-F195 HydrophobicContact CG-CE1 3.69Å; F149-F195 HydrophobicContact CZ-CE1 4.23Å; W152-F195 HydrophobicContact CH2-CE2 4.47Å; W152-F195 HydrophobicContact CH2-CZ 4.04Å; W152-F195 HydrophobicContact CZ3-CZ 4.32Å; V172-F195 HydrophobicContact CB-CE2 4.38Å; L190-F195 HydrophobicContact CB-CB 4.5Å; L190-F195 HydrophobicContact CB-CD2 3.6Å; L190-F195 HydrophobicContact CB-CE2 3.97Å; L190-F195 HydrophobicContact CB-CG 4.06Å; L190-F195 HydrophobicContact CD1-CD1 3.92Å; L190-F195 HydrophobicContact CD1-CD2 4.06Å; L190-F195 HydrophobicContact CD1-CE1 3.9Å; L190-F195 HydrophobicContact CD1-CE2 4.04Å; L190-F195 HydrophobicContact CD1-CG 4.01Å; L190-F195 HydrophobicContact CD1-CZ 3.97Å; L190-F195 HydrophobicContact CD2-CE2 4.03Å; L190-F195 HydrophobicContact CD2-CZ 4.29Å; L190-F195 HydrophobicContact CG-CD2 4.29Å; L190-F195 HydrophobicContact CG-CE2 4.25Å; N191-F195 WeakPolarHBondContact O-CD2 3.48Å; N191-F195 PolarHBondContact O-N 3.06Å; F195-N198 WeakPolarHBondContact O-CB 3.2Å; F195-N198 PolarHBondContact O-N 3.1Å; F195-N198 VanDerWaalsContact O-N 3.09Å; F195-A199 HydrophobicContact CB-CB 4.23Å; F195-L206 HydrophobicContact CE1-CB 4.38Å; F195-L206 HydrophobicContact CZ-CD1 4.38Å; F195-L206 HydrophobicContact CZ-CD2 4.27Å
196	G	83.4	Confident	85.3	Confident	33 Å²	33	48.1 Å²	48.1	34%	0.34	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	55.4	-132.4	178.1	0	0	0	0	0	112.3	D192 N198 A199	D192-G196 WeakPolarHBondContact O-CA 3.45Å; D192-G196 PolarHBondContact O-N 3.26Å; G196-N198 PolarHBondContact O-N 2.78Å; G196-N198 VanDerWaalsContact O-N 3.08Å; G196-A199 WeakPolarHBondContact O-CB 2.83Å; G196-A199 PolarHBondContact O-N 3.38Å
197	P	76.8	Confident	85.2	Confident	125 Å²	125	48.2 Å²	48.2	81%	0.812	27%	0.27	S	S	*	.	G	3₁₀ helix	trans	-62.3	-18.9	179.8	28.1	-35.2	0	0	0	113.4	A199	P197-A199 VanDerWaalsContact C-N 3.26Å; P197-A199 PolarHBondContact O-N 3.1Å
198	N	73.1	Confident	85.1	Confident	75 Å²	75	54.3 Å²	54.3	40%	0.401	30%	0.298	S	S	.	.	G	3₁₀ helix	trans	-80.3	-0.6	177.5	-59.4	-23.1	0	0	0	112.9	F195 G196 N200 D201 G202 L205	F195-N198 WeakPolarHBondContact O-CB 3.2Å; F195-N198 PolarHBondContact O-N 3.1Å; F195-N198 VanDerWaalsContact O-N 3.09Å; G196-N198 PolarHBondContact O-N 2.78Å; G196-N198 VanDerWaalsContact O-N 3.08Å; N198-N200 PolarHBondContact O-N 2.69Å; N198-N200 VanDerWaalsContact O-N 3.13Å; N198-D201 PolarHBondContact O-N 3.09Å; N198-G202 WeakPolarHBondContact O-CA 3.1Å; N198-G202 PolarHBondContact O-N 3.37Å; N198-L205 HydrophobicContact CB-CD1 3.96Å
199	A	72.4	Confident	85	Confident	3 Å²	3	53 Å²	53	3%	0.025	29%	0.29	C	S	.	.	G	3₁₀ helix	trans	-60.1	-26.1	-174.1	0	0	0	0	0	114.6	D192 F195 G196 P197	D192-A199 WeakPolarHBondContact OD1-CB 3.31Å; F195-A199 HydrophobicContact CB-CB 4.23Å; G196-A199 WeakPolarHBondContact O-CB 2.83Å; G196-A199 PolarHBondContact O-N 3.38Å; P197-A199 VanDerWaalsContact C-N 3.26Å; P197-A199 PolarHBondContact O-N 3.1Å
200	N	70.4	Confident	85.1	Confident	128 Å²	128	48.8 Å²	48.8	68%	0.684	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-40.7	178	-69.2	-33.9	0	0	0	113.3	N198	N198-N200 PolarHBondContact O-N 2.69Å; N198-N200 VanDerWaalsContact O-N 3.13Å
201	D	69.6	Low	85	Confident	137 Å²	137	53.7 Å²	53.7	73%	0.733	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.8	-4.1	-178.5	-66.2	-44.8	0	0	0	113.5	N198 F203 G204	N198-D201 PolarHBondContact O-N 3.09Å; D201-F203 PolarHBondContact O-N 2.68Å; D201-G204 PolarHBondContact O-N 3.06Å; D201-G204 VanDerWaalsContact O-N 3.13Å
202	G	75.6	Confident	85	Confident	0 Å²	0	58 Å²	58	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-68.3	-13.4	-162.5	0	0	0	0	0	115.6	N198 G204 L205 L206	N198-G202 WeakPolarHBondContact O-CA 3.1Å; N198-G202 PolarHBondContact O-N 3.37Å; G202-G204 PolarHBondContact O-N 2.8Å; G202-L205 PolarHBondContact O-N 3.49Å; G202-L206 VanDerWaalsContact O-CB 3.28Å; G202-L206 WeakPolarHBondContact O-CB 3.44Å; G202-L206 PolarHBondContact O-N 3.13Å
203	F	88	Confident	85.1	Confident	39 Å²	39	54.8 Å²	54.8	17%	0.171	30%	0.295	C	S	.	.	H	α-helix	trans	-62.1	-34.1	173	-76.6	-74.5	0	0	0	111.4	L188 L190 D201 E207 I533	L188-F203 WeakPolarHBondContact O-CE2 3.42Å; L190-F203 HydrophobicContact CD1-CD1 4.41Å; L190-F203 HydrophobicContact CD1-CD2 4.33Å; L190-F203 HydrophobicContact CD1-CG 4.23Å; L190-F203 HydrophobicContact CD2-CD1 3.93Å; L190-F203 HydrophobicContact CD2-CE1 3.54Å; L190-F203 HydrophobicContact CD2-CE2 4.26Å; L190-F203 HydrophobicContact CD2-CG 4.45Å; L190-F203 HydrophobicContact CD2-CZ 3.73Å; L190-F203 HydrophobicContact CG-CD1 4.21Å; L190-F203 HydrophobicContact CG-CD2 4.06Å; L190-F203 HydrophobicContact CG-CE1 4.04Å; L190-F203 HydrophobicContact CG-CE2 3.87Å; L190-F203 HydrophobicContact CG-CG 4.23Å; L190-F203 HydrophobicContact CG-CZ 3.87Å; D201-F203 PolarHBondContact O-N 2.68Å; F203-E207 WeakPolarHBondContact O-CB 3.44Å; F203-E207 PolarHBondContact O-N 3.27Å; F203-I533 HydrophobicContact CB-CD1 4.36Å; F203-I533 HydrophobicContact CD1-CD1 3.79Å
204	G	88.9	Confident	85.3	Confident	34 Å²	34	52.9 Å²	52.9	35%	0.351	29%	0.286	S	S	.	.	H	α-helix	trans	-66.8	-49.3	173.4	0	0	0	0	0	112	D201 G202 L206 E207 E208	D201-G204 PolarHBondContact O-N 3.06Å; D201-G204 VanDerWaalsContact O-N 3.13Å; G202-G204 PolarHBondContact O-N 2.8Å; G204-L206 VanDerWaalsContact C-N 3.29Å; G204-L206 PolarHBondContact O-N 2.94Å; G204-E207 WeakPolarHBondContact O-CB 3.47Å; G204-E207 PolarHBondContact O-N 3.35Å; G204-E207 VanDerWaalsContact O-N 3.14Å; G204-E208 WeakPolarHBondContact O-CG 3.43Å; G204-E208 PolarHBondContact O-N 3.42Å
205	L	88.7	Confident	85.1	Confident	66 Å²	66	59.9 Å²	59.9	35%	0.346	32%	0.316	S	S	.	.	H	α-helix	trans	-61.3	-36.8	177.1	-64.8	173.8	0	0	0	112.4	F149 N198 G202 E208 F209	F149-L205 HydrophobicContact CE1-CB 4.11Å; F149-L205 HydrophobicContact CZ-CB 4.47Å; N198-L205 HydrophobicContact CB-CD1 3.96Å; G202-L205 PolarHBondContact O-N 3.49Å; L205-E208 PolarHBondContact O-N 3.09Å; L205-F209 VanDerWaalsContact O-CB 3.24Å; L205-F209 WeakPolarHBondContact O-CB 3.48Å; L205-F209 PolarHBondContact O-N 3.15Å
206	L	92.3	Very high	85	Confident	1 Å²	1	64.7 Å²	64.7	1%	0.005	34%	0.338	C	S	.	.	H	α-helix	trans	-68.8	-40.2	174.8	-178.7	61.9	0	0	0	111.6	F149 W152 V172 L190 F195 G202 G204 F209 V210 I533 F534	F149-L206 HydrophobicContact CE2-CD1 4.04Å; W152-L206 HydrophobicContact CZ3-CD1 3.79Å; V172-L206 HydrophobicContact CG2-CD2 3.87Å; L190-L206 HydrophobicContact CD2-CD2 4.37Å; F195-L206 HydrophobicContact CE1-CB 4.38Å; F195-L206 HydrophobicContact CZ-CD1 4.38Å; F195-L206 HydrophobicContact CZ-CD2 4.27Å; G202-L206 VanDerWaalsContact O-CB 3.28Å; G202-L206 WeakPolarHBondContact O-CB 3.44Å; G202-L206 PolarHBondContact O-N 3.13Å; G204-L206 VanDerWaalsContact C-N 3.29Å; G204-L206 PolarHBondContact O-N 2.94Å; L206-F209 PolarHBondContact O-N 3.34Å; L206-V210 HydrophobicContact CD1-CG2 4.37Å; L206-V210 WeakPolarHBondContact O-CB 3.48Å; L206-V210 WeakPolarHBondContact O-CG2 3.39Å; L206-V210 PolarHBondContact O-N 3.21Å; L206-I533 HydrophobicContact CD2-CD1 4.19Å; L206-I533 HydrophobicContact CD2-CG2 4.38Å; L206-I533 HydrophobicContact CG-CD1 4.43Å; L206-I533 HydrophobicContact CG-CG2 4.1Å; L206-F534 HydrophobicContact CD2-CZ 4.14Å
207	E	93.9	Very high	85.2	Confident	26 Å²	26	65.8 Å²	65.8	12%	0.121	33%	0.332	C	S	.	.	H	α-helix	trans	-62.1	-43.3	173.5	-165.4	-176.2	148.4	0	0	111.6	F203 G204 K211 K532 I533	F203-E207 WeakPolarHBondContact O-CB 3.44Å; F203-E207 PolarHBondContact O-N 3.27Å; G204-E207 WeakPolarHBondContact O-CB 3.47Å; G204-E207 PolarHBondContact O-N 3.35Å; G204-E207 VanDerWaalsContact O-N 3.14Å; E207-K211 HydrophobicContact CG-CD 4.42Å; E207-K211 WeakPolarHBondContact O-CB 3.4Å; E207-K211 VanDerWaalsContact O-CG 3.26Å; E207-K211 WeakPolarHBondContact O-CG 3.16Å; E207-K211 PolarHBondContact O-N 3.44Å; E207-K211 WeakPolarHBondContact OE1-CE 3.37Å; E207-K211 IonicContact OE1-NZ 3.98Å; E207-K211 PolarHBondContact OE1-NZ 2.94Å; E207-K532 WeakPolarHBondContact OE1-CE 3.42Å; E207-K532 IonicContact OE1-NZ 2.65Å; E207-K532 WeakPolarHBondContact OE2-CD 3.15Å; E207-K532 WeakPolarHBondContact OE2-CE 3.32Å; E207-K532 IonicContact OE2-NZ 3.53Å; E207-K532 PolarHBondContact OE2-NZ 2.91Å; E207-I533 HydrophobicContact CB-CG1 4.01Å; E207-I533 HydrophobicContact CG-CG1 4.22Å
208	E	92.1	Very high	85.5	Confident	128 Å²	128	61.3 Å²	61.3	60%	0.598	30%	0.302	S	S	*	.	H	α-helix	trans	-63.6	-42.2	174.2	-72.3	-178.7	173.5	0	0	112.1	G204 L205 K211 K212	G204-E208 WeakPolarHBondContact O-CG 3.43Å; G204-E208 PolarHBondContact O-N 3.42Å; L205-E208 PolarHBondContact O-N 3.09Å; E208-K211 PolarHBondContact O-N 2.83Å; E208-K212 WeakPolarHBondContact O-CB 3.33Å; E208-K212 PolarHBondContact O-N 3.34Å
209	F	92.5	Very high	86.3	Confident	31 Å²	31	58 Å²	58	14%	0.136	28%	0.284	C	S	.	.	H	α-helix	trans	-66.9	-40.5	177.8	-177.9	-96.1	0	0	0	112.6	F149 W152 A153 F156 L205 L206 K212 I213	F149-F209 HydrophobicContact CE2-CB 4.24Å; F149-F209 HydrophobicContact CE2-CD1 4.2Å; F149-F209 HydrophobicContact CE2-CG 4.11Å; F149-F209 HydrophobicContact CZ-CB 3.74Å; F149-F209 HydrophobicContact CZ-CD1 4.49Å; F149-F209 HydrophobicContact CZ-CD2 4.36Å; F149-F209 AromaticContact CZ-CG 3.96Å; F149-F209 HydrophobicContact CZ-CG 3.96Å; W152-F209 HydrophobicContact CB-CE1 4.29Å; W152-F209 HydrophobicContact CB-CZ 3.9Å; W152-F209 HydrophobicContact CE3-CE1 4.22Å; A153-F209 HydrophobicContact CB-CE2 4.27Å; F156-F209 AromaticContact CD2-CE1 3.72Å; F156-F209 HydrophobicContact CD2-CE1 3.72Å; F156-F209 AromaticContact CD2-CZ 3.91Å; F156-F209 HydrophobicContact CD2-CZ 3.91Å; F156-F209 AromaticContact CE2-CE1 3.73Å; F156-F209 HydrophobicContact CE2-CE1 3.73Å; F156-F209 HydrophobicContact CE2-CZ 4.27Å; L205-F209 VanDerWaalsContact O-CB 3.24Å; L205-F209 WeakPolarHBondContact O-CB 3.48Å; L205-F209 PolarHBondContact O-N 3.15Å; L206-F209 PolarHBondContact O-N 3.34Å; F209-K212 WeakPolarHBondContact O-CB 3.27Å; F209-K212 PolarHBondContact O-N 2.87Å; F209-I213 HydrophobicContact CD1-CD1 4.07Å; F209-I213 HydrophobicContact CE1-CD1 3.33Å; F209-I213 HydrophobicContact CE1-CG1 4.16Å; F209-I213 HydrophobicContact CZ-CD1 3.64Å; F209-I213 HydrophobicContact CZ-CG1 4.28Å; F209-I213 PolarHBondContact O-N 3.36Å
210	V	93.3	Very high	87.3	Confident	6 Å²	6	57.9 Å²	57.9	4%	0.036	28%	0.283	C	S	.	.	H	α-helix	trans	-64.1	-44.2	173.1	168.1	0	0	0	0	111	L206 K212 I213 E214 T221 I533 F534	L206-V210 HydrophobicContact CD1-CG2 4.37Å; L206-V210 WeakPolarHBondContact O-CB 3.48Å; L206-V210 WeakPolarHBondContact O-CG2 3.39Å; L206-V210 PolarHBondContact O-N 3.21Å; V210-K212 VanDerWaalsContact C-N 3.27Å; V210-K212 PolarHBondContact O-N 2.78Å; V210-I213 PolarHBondContact O-N 3.4Å; V210-E214 WeakPolarHBondContact O-CB 3.47Å; V210-E214 PolarHBondContact O-N 2.88Å; V210-T221 HydrophobicContact CG1-CG2 4.06Å; V210-T221 WeakPolarHBondContact CG1-OG1 3.42Å; V210-T221 HydrophobicContact CG2-CG2 4.24Å; V210-I533 HydrophobicContact CB-CG2 4.31Å; V210-I533 WeakPolarHBondContact CG1-O 3.38Å; V210-I533 HydrophobicContact CG2-CG2 3.84Å; V210-F534 HydrophobicContact CG2-CE1 4.38Å
211	K	92	Very high	88.4	Confident	103 Å²	103	52 Å²	52	45%	0.448	25%	0.251	S	S	.	.	H	α-helix	trans	-61.9	-33.7	172.9	-74.3	168.3	-177.3	167.5	0	112.5	E207 E208 K215	E207-K211 HydrophobicContact CG-CD 4.42Å; E207-K211 WeakPolarHBondContact O-CB 3.4Å; E207-K211 VanDerWaalsContact O-CG 3.26Å; E207-K211 WeakPolarHBondContact O-CG 3.16Å; E207-K211 PolarHBondContact O-N 3.44Å; E207-K211 WeakPolarHBondContact OE1-CE 3.37Å; E207-K211 IonicContact OE1-NZ 3.98Å; E207-K211 PolarHBondContact OE1-NZ 2.94Å; E208-K211 PolarHBondContact O-N 2.83Å; K211-K215 WeakPolarHBondContact O-CB 3.21Å; K211-K215 PolarHBondContact O-N 2.96Å
212	K	91	Very high	89.7	Confident	99 Å²	99	45.4 Å²	45.4	43%	0.43	22%	0.216	S	C	.	.	H	α-helix	trans	-65.5	-49.5	174.9	-174	-176.1	176	-178.8	0	110.8	E208 F209 V210 E214 K215 E216	E208-K212 WeakPolarHBondContact O-CB 3.33Å; E208-K212 PolarHBondContact O-N 3.34Å; F209-K212 WeakPolarHBondContact O-CB 3.27Å; F209-K212 PolarHBondContact O-N 2.87Å; V210-K212 VanDerWaalsContact C-N 3.27Å; V210-K212 PolarHBondContact O-N 2.78Å; K212-E214 PolarHBondContact O-N 3.45Å; K212-K215 PolarHBondContact O-N 3.42Å; K212-E216 WeakPolarHBondContact CE-OE1 3.43Å; K212-E216 WeakPolarHBondContact CE-OE2 2.94Å; K212-E216 VanDerWaalsContact CG-CD 3.49Å; K212-E216 HydrophobicContact CG-CG 4.19Å; K212-E216 WeakPolarHBondContact CG-OE1 3.26Å; K212-E216 IonicContact NZ-OE2 3.35Å; K212-E216 WeakPolarHBondContact O-CB 3.28Å; K212-E216 PolarHBondContact O-N 2.63Å
213	I	89.7	Confident	90.7	Very high	4 Å²	4	45.4 Å²	45.4	2%	0.021	22%	0.216	C	C	.	.	H	α-helix	trans	-60.8	-43.9	175.8	-73.8	-175.1	0	0	0	111.4	F156 I167 F209 V210 K215 W217 N218 M219	F156-I213 HydrophobicContact CB-CD1 4.42Å; F156-I213 HydrophobicContact CD2-CD1 3.86Å; F156-I213 HydrophobicContact CG-CD1 4.47Å; I167-I213 HydrophobicContact CD1-CD1 4.45Å; F209-I213 HydrophobicContact CD1-CD1 4.07Å; F209-I213 HydrophobicContact CE1-CD1 3.33Å; F209-I213 HydrophobicContact CE1-CG1 4.16Å; F209-I213 HydrophobicContact CZ-CD1 3.64Å; F209-I213 HydrophobicContact CZ-CG1 4.28Å; F209-I213 PolarHBondContact O-N 3.36Å; V210-I213 PolarHBondContact O-N 3.4Å; I213-K215 VanDerWaalsContact C-N 3.33Å; I213-K215 PolarHBondContact O-N 2.8Å; I213-W217 HydrophobicContact CB-CE3 4.32Å; I213-W217 HydrophobicContact CD1-CE3 4.05Å; I213-W217 HydrophobicContact CD1-CH2 4.37Å; I213-W217 HydrophobicContact CD1-CZ3 3.73Å; I213-W217 HydrophobicContact CG1-CD2 4.21Å; I213-W217 HydrophobicContact CG1-CE3 3.76Å; I213-W217 HydrophobicContact CG1-CH2 4.36Å; I213-W217 HydrophobicContact CG1-CZ3 3.85Å; I213-W217 HydrophobicContact CG2-CE3 3.96Å; I213-W217 CarbonylContact O-C 3.5Å; I213-W217 WeakPolarHBondContact O-CA 3.31Å; I213-W217 WeakPolarHBondContact O-CB 3.35Å; I213-W217 PolarHBondContact O-N 3.45Å; I213-N218 PolarHBondContact O-N 3.09Å; I213-M219 HydrophobicContact CG2-CB 3.71Å
214	E	88.3	Confident	91.1	Very high	59 Å²	59	43.6 Å²	43.6	28%	0.276	21%	0.208	S	C	.	.	H	α-helix	trans	-57.7	-45.6	174.8	-173.3	-160.9	163.3	0	0	111.4	V210 K212 N218 M219 H535	V210-E214 WeakPolarHBondContact O-CB 3.47Å; V210-E214 PolarHBondContact O-N 2.88Å; K212-E214 PolarHBondContact O-N 3.45Å; E214-N218 VanDerWaalsContact O-CA 3.32Å; E214-N218 WeakPolarHBondContact O-CA 3.21Å; E214-N218 PolarHBondContact O-N 3.5Å; E214-M219 WeakPolarHBondContact CA-O 3.34Å; E214-H535 IonicContact OE1-NE2 2.75Å; E214-H535 IonicContact OE2-CE1 3.46Å; E214-H535 IonicContact OE2-NE2 2.65Å; E214-H535 PolarHBondContact OE2-NE2 3.49Å
215	K	85.7	Confident	91.5	Very high	153 Å²	153	42 Å²	42	67%	0.665	19%	0.192	S	C	*	.	H	α-helix	trans	-76.9	-43.3	-175.1	-177.7	-172.8	174	-166.7	0	113.9	K211 K212 I213	K211-K215 WeakPolarHBondContact O-CB 3.21Å; K211-K215 PolarHBondContact O-N 2.96Å; K212-K215 PolarHBondContact O-N 3.42Å; I213-K215 VanDerWaalsContact C-N 3.33Å; I213-K215 PolarHBondContact O-N 2.8Å
216	E	87.6	Confident	91.9	Very high	109 Å²	109	38.9 Å²	38.9	51%	0.509	18%	0.176	S	C	.	.	H	α-helix	trans	-89.9	-36.6	-173.2	-67.2	179.7	-173	0	0	112.3	K212	K212-E216 WeakPolarHBondContact CE-OE1 3.43Å; K212-E216 WeakPolarHBondContact CE-OE2 2.94Å; K212-E216 VanDerWaalsContact CG-CD 3.49Å; K212-E216 HydrophobicContact CG-CG 4.19Å; K212-E216 WeakPolarHBondContact CG-OE1 3.26Å; K212-E216 IonicContact NZ-OE2 3.35Å; K212-E216 WeakPolarHBondContact O-CB 3.28Å; K212-E216 PolarHBondContact O-N 2.63Å
217	W	87.1	Confident	92	Very high	55 Å²	55	38.9 Å²	38.9	21%	0.208	18%	0.175	C	C	.	.	H	α-helix	trans	-111.4	-6.7	-171.8	-53.5	-9.9	0	0	0	113	A153 F156 M160 I213 M219	A153-W217 WeakPolarHBondContact O-CH2 3.24Å; F156-W217 HydrophobicContact CB-CH2 4.22Å; F156-W217 HydrophobicContact CB-CZ3 3.69Å; M160-W217 HydrophobicContact CB-CE3 4.16Å; M160-W217 HydrophobicContact CE-CB 3.97Å; M160-W217 HydrophobicContact CE-CD2 3.52Å; M160-W217 HydrophobicContact CE-CE3 4.21Å; M160-W217 HydrophobicContact CE-CG 3.35Å; M160-W217 HydrophobicContact CE-CZ2 4.44Å; M160-W217 HydrophobicContact CG-CB 4.27Å; M160-W217 HydrophobicContact CG-CD2 4.42Å; M160-W217 HydrophobicContact CG-CE3 4.32Å; M160-W217 HydrophobicContact CG-CG 4.41Å; I213-W217 HydrophobicContact CB-CE3 4.32Å; I213-W217 HydrophobicContact CD1-CE3 4.05Å; I213-W217 HydrophobicContact CD1-CH2 4.37Å; I213-W217 HydrophobicContact CD1-CZ3 3.73Å; I213-W217 HydrophobicContact CG1-CD2 4.21Å; I213-W217 HydrophobicContact CG1-CE3 3.76Å; I213-W217 HydrophobicContact CG1-CH2 4.36Å; I213-W217 HydrophobicContact CG1-CZ3 3.85Å; I213-W217 HydrophobicContact CG2-CE3 3.96Å; I213-W217 CarbonylContact O-C 3.5Å; I213-W217 WeakPolarHBondContact O-CA 3.31Å; I213-W217 WeakPolarHBondContact O-CB 3.35Å; I213-W217 PolarHBondContact O-N 3.45Å; W217-M219 HydrophobicContact CB-CG 4.08Å; W217-M219 HydrophobicContact CB-SD 4.17Å; W217-M219 HydrophobicContact CE3-SD 3.91Å; W217-M219 PolarHBondContact O-N 3.25Å
218	N	83.9	Confident	92	Very high	32 Å²	32	37.7 Å²	37.7	17%	0.171	17%	0.17	C	C	.	.			trans	58	32.8	-179.4	-164	84.6	0	0	0	112.5	T124 R125 L126 I213 E214	T124-N218 WeakPolarHBondContact CB-ND2 3.24Å; T124-N218 VanDerWaalsContact CB-OD1 3.23Å; T124-N218 WeakPolarHBondContact CB-OD1 3.31Å; T124-N218 PolarHBondContact OG1-ND2 3.24Å; T124-N218 PolarHBondContact OG1-OD1 2.8Å; R125-N218 PolarHBondContact N-OD1 3.13Å; L126-N218 HydrophobicContact CB-CB 4.33Å; L126-N218 WeakPolarHBondContact CB-OD1 3.43Å; L126-N218 HydrophobicContact CD1-CB 3.75Å; L126-N218 HydrophobicContact CG-CB 4.17Å; L126-N218 PolarHBondContact N-OD1 3.4Å; I213-N218 PolarHBondContact O-N 3.09Å; E214-N218 VanDerWaalsContact O-CA 3.32Å; E214-N218 WeakPolarHBondContact O-CA 3.21Å; E214-N218 PolarHBondContact O-N 3.5Å
219	M	88.9	Confident	92.1	Very high	4 Å²	4	31.8 Å²	31.8	2%	0.02	14%	0.142	C	C	.	.			trans	-106.7	142.3	-179.1	-67.7	177.9	76.3	0	0	111.9	T159 M160 Y164 N165 I167 I213 E214 W217	T159-M219 HydrophobicContact CG2-CE 3.86Å; M160-M219 HydrophobicContact CB-CE 4.32Å; M160-M219 HydrophobicContact CB-SD 3.47Å; M160-M219 WeakPolarHBondContact CB-SD 3.41Å; M160-M219 HydrophobicContact CG-SD 3.68Å; Y164-M219 WeakPolarHBondContact O-CE 3.39Å; N165-M219 WeakPolarHBondContact O-CA 3.36Å; I167-M219 HydrophobicContact CD1-CE 3.6Å; I167-M219 HydrophobicContact CD1-SD 4.37Å; I167-M219 HydrophobicContact CG1-CE 3.59Å; I213-M219 HydrophobicContact CG2-CB 3.71Å; E214-M219 WeakPolarHBondContact CA-O 3.34Å; W217-M219 HydrophobicContact CB-CG 4.08Å; W217-M219 HydrophobicContact CB-SD 4.17Å; W217-M219 HydrophobicContact CE3-SD 3.91Å; W217-M219 PolarHBondContact O-N 3.25Å
220	L	92.9	Very high	92.3	Very high	1 Å²	1	30.3 Å²	30.3	1%	0.005	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	160.5	174	-59.3	173.1	0	0	0	111	I122 T124 L131 N165 M166 I167 H535	I122-L220 HydrophobicContact CB-CD1 4.48Å; I122-L220 HydrophobicContact CG2-CD1 3.59Å; I122-L220 HydrophobicContact CG2-CD2 3.45Å; I122-L220 VanDerWaalsContact CG2-CD2 3.45Å; I122-L220 HydrophobicContact CG2-CG 4.17Å; T124-L220 HydrophobicContact CG2-CD1 4.49Å; T124-L220 HydrophobicContact CG2-CD2 4Å; T124-L220 HydrophobicContact CG2-CG 4.19Å; L131-L220 HydrophobicContact CD2-CD1 3.89Å; N165-L220 PolarHBondContact O-N 2.64Å; M166-L220 CarbonylContact C-O 3.59Å; M166-L220 WeakPolarHBondContact CA-O 3.17Å; M166-L220 HydrophobicContact CB-CB 4.13Å; M166-L220 HydrophobicContact CE-CB 3.83Å; M166-L220 HydrophobicContact CE-CD1 3.74Å; M166-L220 HydrophobicContact CE-CG 4.46Å; M166-L220 HydrophobicContact CG-CB 4.05Å; I167-L220 PolarHBondContact N-O 3.1Å; L220-H535 HydrophobicContact CB-CB 4.35Å; L220-H535 HydrophobicContact CD2-CB 4.18Å
221	T	95.3	Very high	92.3	Very high	4 Å²	4	30 Å²	30	3%	0.025	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	135.9	177.6	58.3	0	0	0	0	110.9	I167 V210 H535 G536	I167-T221 CarbonylContact O-C 3.6Å; I167-T221 VanDerWaalsContact O-CA 3.31Å; I167-T221 WeakPolarHBondContact O-CA 3.39Å; V210-T221 HydrophobicContact CG1-CG2 4.06Å; V210-T221 WeakPolarHBondContact CG1-OG1 3.42Å; V210-T221 HydrophobicContact CG2-CG2 4.24Å; T221-H535 PolarHBondContact N-ND1 2.99Å; T221-H535 CarbonylContact O-C 3.55Å; T221-H535 VanDerWaalsContact O-CA 3.3Å; T221-H535 WeakPolarHBondContact O-CA 3.07Å; T221-H535 VanDerWaalsContact O-CB 3.26Å; T221-H535 WeakPolarHBondContact O-CB 3.41Å; T221-H535 PolarHBondContact O-N 3.3Å; T221-H535 PolarHBondContact OG1-ND1 3.16Å; T221-G536 PolarHBondContact O-N 3.42Å
222	M	96.2	Very high	92.3	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	144.7	174.8	177.9	158.2	80.8	0	0	109.1	M166 I167 H168 L169 G536 N538 Y565 C567 F633	M166-M222 HydrophobicContact SD-CB 4.09Å; I167-M222 PolarHBondContact O-N 3.13Å; H168-M222 CarbonylContact C-O 3.56Å; H168-M222 WeakPolarHBondContact CA-O 3.44Å; H168-M222 HydrophobicContact CB-CB 4.24Å; H168-M222 HydrophobicContact CB-CE 3.88Å; L169-M222 PolarHBondContact N-O 3Å; M222-G536 WeakPolarHBondContact CA-O 3.44Å; M222-G536 VanDerWaalsContact CG-C 3.49Å; M222-N538 HydrophobicContact CE-CB 4.24Å; M222-N538 HydrophobicContact SD-CB 4.29Å; M222-Y565 HydrophobicContact SD-CD1 4.35Å; M222-C567 PolarHBondContact SD-SG 3.27Å; M222-F633 HydrophobicContact CE-CE1 4.12Å
223	S	96.6	Very high	92.3	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	145.4	171.6	179.3	0	0	0	0	110	L169 G536 I537 N538	L169-S223 WeakPolarHBondContact O-CA 3.45Å; S223-G536 PolarHBondContact N-O 3.06Å; S223-I537 WeakPolarHBondContact O-CA 3.4Å; S223-N538 PolarHBondContact O-N 3.25Å
224	D	97	Very high	92.5	Very high	1 Å²	1	24.8 Å²	24.8	1%	0.005	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.6	143.7	160.1	-81.9	-31.7	0	0	0	111.4	H168 L169 T170 P171 W182 N538 V540	H168-D224 IonicContact CE1-OD1 2.78Å; H168-D224 IonicContact NE2-OD1 3.61Å; H168-D224 PolarHBondContact NE2-OD1 3.09Å; H168-D224 VanDerWaalsContact NE2-OD1 3.16Å; L169-D224 PolarHBondContact O-N 2.91Å; T170-D224 WeakPolarHBondContact CA-OD2 3.33Å; P171-D224 HydrophobicContact CG-CB 3.92Å; W182-D224 PolarHBondContact NE1-OD2 3.31Å; D224-N538 CarbonylContact C-O 3.59Å; D224-N538 WeakPolarHBondContact CA-O 3.34Å; D224-N538 WeakPolarHBondContact OD1-CB 3.48Å; D224-N538 PolarHBondContact OD1-ND2 3.26Å; D224-V540 HydrophobicContact CB-CG2 3.48Å; D224-V540 VanDerWaalsContact CB-CG2 3.48Å; D224-V540 WeakPolarHBondContact OD1-CG2 3.36Å
225	L	97.1	Very high	92.8	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	108.8	170.3	-177.7	75.2	0	0	0	108.5	L227 Y526 T527 V530 I537 N538 V540	L225-L227 HydrophobicContact CD1-CD2 4.45Å; L225-L227 HydrophobicContact CD2-CD1 3.99Å; L225-L227 HydrophobicContact CD2-CD2 4.28Å; L225-L227 HydrophobicContact CD2-CG 4.15Å; L225-L227 HydrophobicContact CG-CD1 4.44Å; L225-L227 HydrophobicContact CG-CD2 4.11Å; L225-L227 HydrophobicContact CG-CG 4.06Å; L225-Y526 HydrophobicContact CD1-CD1 3.99Å; L225-Y526 HydrophobicContact CD1-CE1 3.56Å; L225-Y526 HydrophobicContact CD1-CE2 4.47Å; L225-Y526 HydrophobicContact CG-CE1 4.41Å; L225-T527 HydrophobicContact CD2-CG2 4.29Å; L225-V530 HydrophobicContact CD1-CB 4.43Å; L225-V530 HydrophobicContact CD1-CG2 4.31Å; L225-I537 HydrophobicContact CB-CG2 3.55Å; L225-I537 HydrophobicContact CD2-CG2 4.11Å; L225-I537 HydrophobicContact CG-CG2 4.45Å; L225-N538 PolarHBondContact N-O 3.11Å; L225-V540 PolarHBondContact O-N 2.7Å; L225-V540 VanDerWaalsContact O-N 3.15Å
226	V	96.2	Very high	93.2	Very high	1 Å²	1	21.7 Å²	21.7	1%	0.006	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	111.5	-178.2	-177.2	0	0	0	0	109.8	P171 W182 I184 Y526 V540	P171-V226 HydrophobicContact CG-CG2 3.78Å; W182-V226 HydrophobicContact CB-CG2 4.26Å; I184-V226 HydrophobicContact CD1-CB 4.04Å; I184-V226 HydrophobicContact CD1-CG2 4.04Å; V226-Y526 PolarHBondContact N-OH 3.15Å; V226-Y526 WeakPolarHBondContact O-CE1 3.49Å; V226-V540 HydrophobicContact CG2-CB 4.08Å; V226-V540 HydrophobicContact CG2-CG1 4.31Å; V226-V540 HydrophobicContact CG2-CG2 4.18Å
227	L	95.4	Very high	93.4	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	8%	0.082	C	C	.	.			trans	-115.6	-8.6	-179.4	-61.5	178.8	0	0	0	113.8	L225 Y509 S545 M553	L225-L227 HydrophobicContact CD1-CD2 4.45Å; L225-L227 HydrophobicContact CD2-CD1 3.99Å; L225-L227 HydrophobicContact CD2-CD2 4.28Å; L225-L227 HydrophobicContact CD2-CG 4.15Å; L225-L227 HydrophobicContact CG-CD1 4.44Å; L225-L227 HydrophobicContact CG-CD2 4.11Å; L225-L227 HydrophobicContact CG-CG 4.06Å; L227-Y509 WeakPolarHBondContact O-CE2 3.34Å; L227-Y509 PolarHBondContact O-OH 3.33Å; L227-Y509 VanDerWaalsContact O-OH 3.12Å; L227-S545 VanDerWaalsContact C-OG 3.25Å; L227-S545 PolarHBondContact O-OG 3.33Å; L227-M553 HydrophobicContact CD1-CB 3.98Å; L227-M553 HydrophobicContact CD1-CG 3.99Å; L227-M553 HydrophobicContact CD2-CG 4.23Å
228	S	92.7	Very high	93.6	Very high	2 Å²	2	18.7 Å²	18.7	1%	0.014	10%	0.096	C	C	.	.	S	Bend	trans	-91.1	-26	-175.8	57.6	0	0	0	0	113.8	N473 L507 D541 S544 S545	S228-N473 PolarHBondContact OG-ND2 3.48Å; S228-L507 PolarHBondContact O-N 3.14Å; S228-L507 VanDerWaalsContact O-N 3.08Å; S228-D541 VanDerWaalsContact CB-OD2 3.28Å; S228-D541 WeakPolarHBondContact CB-OD2 3.36Å; S228-D541 PolarHBondContact OG-OD2 3.12Å; S228-S544 VanDerWaalsContact CB-CB 3.48Å; S228-S545 WeakPolarHBondContact CA-OG 3.46Å; S228-S545 WeakPolarHBondContact CB-OG 3.32Å; S228-S545 PolarHBondContact N-OG 3.49Å
229	H	94.6	Very high	94.1	Very high	3 Å²	3	24 Å²	24	1%	0.014	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	170.9	-170	63	-87.3	0	0	0	114.6	W182 N473 W501 S504 V505 D541	W182-H229 PolarHBondContact O-NE2 3.45Å; H229-N473 HydrophobicContact CB-CB 3.73Å; H229-N473 PolarHBondContact ND1-ND2 3.18Å; H229-N473 VanDerWaalsContact ND1-ND2 3.14Å; H229-W501 AromaticContact CE1-CZ3 3.76Å; H229-S504 PolarHBondContact CD2-OG 2.94Å; H229-S504 VanDerWaalsContact CD2-OG 3.29Å; H229-V505 WeakPolarHBondContact CA-O 3.44Å; H229-V505 VanDerWaalsContact CB-O 3.23Å; H229-V505 WeakPolarHBondContact CB-O 3.22Å; H229-D541 IonicContact ND1-OD2 2.76Å
230	T	96.1	Very high	94.3	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	164.2	173.6	-166.7	0	0	0	0	109	I184 Q187 S234 W236 L237 S504 V505 L507	I184-T230 PolarHBondContact O-OG1 3.48Å; Q187-T230 PolarHBondContact NE2-OG1 3.32Å; T230-S234 PolarHBondContact OG1-OG 3.25Å; T230-W236 HydrophobicContact CG2-CH2 4.21Å; T230-W236 HydrophobicContact CG2-CZ2 3.85Å; T230-W236 WeakPolarHBondContact OG1-CZ2 3.34Å; T230-L237 HydrophobicContact CG2-CD1 3.5Å; T230-L237 VanDerWaalsContact CG2-CD1 3.5Å; T230-L237 HydrophobicContact CG2-CD2 4.32Å; T230-L237 HydrophobicContact CG2-CG 4.04Å; T230-S504 CarbonylContact O-C 3.58Å; T230-S504 VanDerWaalsContact O-CA 3.31Å; T230-S504 WeakPolarHBondContact O-CA 3.33Å; T230-V505 HydrophobicContact CG2-CB 4.3Å; T230-V505 PolarHBondContact N-O 3.43Å; T230-V505 VanDerWaalsContact N-O 3.14Å; T230-V505 PolarHBondContact O-N 3.49Å; T230-L507 HydrophobicContact CG2-CD2 3.79Å
231	A	94.6	Very high	94.4	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	150.3	178.9	0	0	0	0	0	112.8	S183 I184 D233 S234	S183-A231 WeakPolarHBondContact OG-CB 3.4Å; I184-A231 PolarHBondContact O-N 3.32Å; A231-D233 WeakPolarHBondContact CB-OD1 3.38Å; A231-D233 PolarHBondContact O-N 3Å; A231-S234 WeakPolarHBondContact O-CB 3.47Å; A231-S234 PolarHBondContact O-N 3.02Å; A231-S234 PolarHBondContact O-OG 3.05Å
232	T	91.7	Very high	94.3	Very high	58 Å²	58	30 Å²	30	36%	0.356	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-20.1	178.3	49.3	0	0	0	0	114.6	T445 H503 V505	T232-T445 HydrophobicContact CG2-CG2 3.46Å; T232-T445 VanDerWaalsContact CG2-CG2 3.46Å; T232-H503 VanDerWaalsContact CG2-C 3.41Å; T232-H503 PolarHBondContact N-O 3.14Å; T232-H503 VanDerWaalsContact N-O 3.14Å; T232-V505 HydrophobicContact CG2-CG2 3.85Å
233	D	90.8	Very high	94.3	Very high	36 Å²	36	30 Å²	30	19%	0.193	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.1	14.3	-179.8	62.1	-42.1	0	0	0	114	G176 Q177 A231 Q235	G176-D233 VanDerWaalsContact CA-OD1 3.25Å; G176-D233 WeakPolarHBondContact CA-OD1 2.97Å; Q177-D233 VanDerWaalsContact CG-OD2 3.26Å; Q177-D233 WeakPolarHBondContact CG-OD2 3.45Å; Q177-D233 PolarHBondContact N-OD1 3.01Å; Q177-D233 PolarHBondContact N-OD2 2.99Å; Q177-D233 VanDerWaalsContact NE2-CB 3.32Å; Q177-D233 PolarHBondContact NE2-OD2 3.26Å; A231-D233 WeakPolarHBondContact CB-OD1 3.38Å; A231-D233 PolarHBondContact O-N 3Å; D233-Q235 PolarHBondContact O-N 3.35Å
234	S	94.5	Very high	94.3	Very high	3 Å²	3	30 Å²	30	2%	0.021	15%	0.151	C	C	.	.			trans	-57	102.3	169	-78.8	0	0	0	0	112	S185 T230 A231 W236 L237	S185-S234 WeakPolarHBondContact CA-OG 3.41Å; S185-S234 WeakPolarHBondContact O-CB 3.4Å; S185-S234 PolarHBondContact O-OG 2.69Å; T230-S234 PolarHBondContact OG1-OG 3.25Å; A231-S234 WeakPolarHBondContact O-CB 3.47Å; A231-S234 PolarHBondContact O-N 3.02Å; A231-S234 PolarHBondContact O-OG 3.05Å; S234-W236 PolarHBondContact O-N 3.01Å; S234-W236 VanDerWaalsContact O-N 3.15Å; S234-W236 PolarHBondContact OG-NE1 3.14Å; S234-L237 WeakPolarHBondContact O-CB 3.36Å; S234-L237 PolarHBondContact O-N 3.28Å
235	Q	93	Very high	94.1	Very high	132 Å²	132	32.1 Å²	32.1	62%	0.617	16%	0.159	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.2	-37.2	-178.9	-65.9	-61.4	-52.8	0	0	113.6	D233 L237 I238	D233-Q235 PolarHBondContact O-N 3.35Å; Q235-L237 PolarHBondContact O-N 3.34Å; Q235-I238 WeakPolarHBondContact O-CB 3.33Å; Q235-I238 PolarHBondContact O-N 2.75Å
236	W	94.7	Very high	94	Very high	15 Å²	15	32.2 Å²	32.2	6%	0.057	16%	0.16	C	C	.	.	H	α-helix	trans	-64.8	-18.9	178.8	64.8	-94.9	0	0	0	113.9	S185 T230 S234 I238 E239 H240 C243 L507 F518 L519 R522 M523	S185-W236 PolarHBondContact O-NE1 2.98Å; T230-W236 HydrophobicContact CG2-CH2 4.21Å; T230-W236 HydrophobicContact CG2-CZ2 3.85Å; T230-W236 WeakPolarHBondContact OG1-CZ2 3.34Å; S234-W236 PolarHBondContact O-N 3.01Å; S234-W236 VanDerWaalsContact O-N 3.15Å; S234-W236 PolarHBondContact OG-NE1 3.14Å; W236-I238 VanDerWaalsContact C-N 3.29Å; W236-E239 PolarHBondContact O-N 3.05Å; W236-H240 PolarHBondContact O-N 3.01Å; W236-C243 HydrophobicContact CH2-CB 4.49Å; W236-C243 HydrophobicContact CZ3-CB 3.74Å; W236-L507 HydrophobicContact CH2-CD2 3.86Å; W236-F518 HydrophobicContact CD2-CE1 4.47Å; W236-F518 HydrophobicContact CE3-CD1 4.44Å; W236-F518 AromaticContact CE3-CE1 3.71Å; W236-F518 HydrophobicContact CE3-CE1 3.71Å; W236-F518 HydrophobicContact CZ3-CE1 4.23Å; W236-L519 HydrophobicContact CH2-CD1 4.16Å; W236-L519 HydrophobicContact CZ3-CD1 4.49Å; W236-R522 VanDerWaalsContact CE2-NE 3.26Å; W236-M523 HydrophobicContact CH2-CE 4.42Å; W236-M523 HydrophobicContact CZ2-CE 4.47Å
237	L	93.2	Very high	93.9	Very high	4 Å²	4	32.2 Å²	32.2	2%	0.021	16%	0.16	C	C	.	.	H	α-helix	trans	-72.1	-23	170.6	-75.7	-178.8	0	0	0	112.7	T230 S234 Q235 H240 P241 C243 A244 M470 V505	T230-L237 HydrophobicContact CG2-CD1 3.5Å; T230-L237 VanDerWaalsContact CG2-CD1 3.5Å; T230-L237 HydrophobicContact CG2-CD2 4.32Å; T230-L237 HydrophobicContact CG2-CG 4.04Å; S234-L237 WeakPolarHBondContact O-CB 3.36Å; S234-L237 PolarHBondContact O-N 3.28Å; Q235-L237 PolarHBondContact O-N 3.34Å; L237-H240 CarbonylContact O-C 3.56Å; L237-H240 VanDerWaalsContact O-C 3.3Å; L237-P241 WeakPolarHBondContact O-CA 3.13Å; L237-C243 HydrophobicContact CD2-CB 3.88Å; L237-A244 HydrophobicContact CD2-CB 4.31Å; L237-M470 HydrophobicContact CB-CE 4.14Å; L237-M470 HydrophobicContact CB-SD 4.16Å; L237-M470 HydrophobicContact CD1-SD 3.96Å; L237-M470 WeakPolarHBondContact O-CE 3.37Å; L237-V505 HydrophobicContact CD1-CB 4Å; L237-V505 HydrophobicContact CD1-CG1 3.91Å; L237-V505 HydrophobicContact CD1-CG2 4.14Å
238	I	91.2	Very high	93.8	Very high	96 Å²	96	35.9 Å²	35.9	49%	0.492	18%	0.177	S	C	.	.	H	α-helix	trans	-74	-37.4	175.7	-53.8	175.5	0	0	0	109.6	Q235 W236 Y468	Q235-I238 WeakPolarHBondContact O-CB 3.33Å; Q235-I238 PolarHBondContact O-N 2.75Å; W236-I238 VanDerWaalsContact C-N 3.29Å; I238-Y468 HydrophobicContact CG2-CE1 4.35Å
239	E	92.7	Very high	93.9	Very high	143 Å²	143	37.8 Å²	37.8	67%	0.668	19%	0.187	S	C	*	.	H	α-helix	trans	-71.2	-39.6	173.8	-61.3	172.5	167.3	0	0	111.7	W236 P241	W236-E239 PolarHBondContact O-N 3.05Å; E239-P241 VanDerWaalsContact C-CD 3.48Å; E239-P241 WeakPolarHBondContact O-CD 3.46Å
240	H	95	Very high	93.8	Very high	58 Å²	58	37.8 Å²	37.8	27%	0.269	19%	0.187	S	C	.	.			trans	-125.6	68.2	-177	-65.5	-77	0	0	0	112.6	W236 L237 D242 C243 F518	W236-H240 PolarHBondContact O-N 3.01Å; L237-H240 CarbonylContact O-C 3.56Å; L237-H240 VanDerWaalsContact O-C 3.3Å; H240-D242 VanDerWaalsContact C-OD1 3.25Å; H240-D242 WeakPolarHBondContact CA-OD1 3.28Å; H240-D242 PolarHBondContact O-N 3.43Å; H240-C243 VanDerWaalsContact O-CB 3.26Å; H240-C243 WeakPolarHBondContact O-CB 3.32Å; H240-C243 PolarHBondContact O-N 3.49Å; H240-C243 VanDerWaalsContact O-N 3.15Å; H240-C243 PolarHBondContact O-SG 2.81Å; H240-C243 VanDerWaalsContact O-SG 3.41Å; H240-F518 HydrophobicContact CB-CD1 3.9Å; H240-F518 HydrophobicContact CB-CE1 4.18Å; H240-F518 HydrophobicContact CB-CG 4.34Å; H240-F518 AromaticContact CD2-CD1 3.76Å; H240-F518 AromaticContact CD2-CD2 3.63Å; H240-F518 AromaticContact CD2-CE1 3.6Å; H240-F518 AromaticContact CD2-CE2 3.46Å; H240-F518 VanDerWaalsContact CD2-CE2 3.46Å; H240-F518 WeakPolarHBondContact CD2-CE2 3.42Å; H240-F518 AromaticContact CD2-CG 3.77Å; H240-F518 AromaticContact CD2-CZ 3.44Å; H240-F518 VanDerWaalsContact CD2-CZ 3.44Å; H240-F518 WeakPolarHBondContact CD2-CZ 3.39Å; H240-F518 AromaticContact CE1-CD2 3.68Å; H240-F518 AromaticContact CE1-CG 3.95Å; H240-F518 AromaticContact CG-CD1 3.69Å; H240-F518 AromaticContact CG-CE1 3.94Å; H240-F518 AromaticContact CG-CG 3.72Å; H240-F518 AromaticContact ND1-CG 3.83Å; H240-F518 AromaticContact NE2-CD2 3.39Å; H240-F518 WeakPolarHBondContact NE2-CD2 3.08Å; H240-F518 AromaticContact NE2-CE2 3.36Å; H240-F518 WeakPolarHBondContact NE2-CE2 3.32Å; H240-F518 AromaticContact NE2-CG 3.91Å; H240-F518 AromaticContact NE2-CZ 3.86Å
241	P	93.9	Very high	93.7	Very high	18 Å²	18	38.9 Å²	38.9	12%	0.117	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-67.4	-16.6	-178.3	26.7	-34.7	0	0	0	113.3	L237 E239 C243 A244 N246 K467 Y468 M470	L237-P241 WeakPolarHBondContact O-CA 3.13Å; E239-P241 VanDerWaalsContact C-CD 3.48Å; E239-P241 WeakPolarHBondContact O-CD 3.46Å; P241-C243 PolarHBondContact O-N 2.72Å; P241-A244 PolarHBondContact O-N 3.14Å; P241-N246 PolarHBondContact O-ND2 3.44Å; P241-K467 WeakPolarHBondContact CB-O 3.5Å; P241-K467 HydrophobicContact CG-CD 4.39Å; P241-K467 HydrophobicContact CG-CG 4.48Å; P241-Y468 HydrophobicContact CB-CD1 4.39Å; P241-Y468 HydrophobicContact CG-CE1 4.38Å; P241-M470 HydrophobicContact CB-CE 3.84Å
242	D	94.1	Very high	93.6	Very high	60 Å²	60	40.1 Å²	40.1	32%	0.321	20%	0.2	S	C	.	.	G	3₁₀ helix	trans	-64	-21.7	173.4	65.4	-58.8	0	0	0	113.5	H240 A244 C516	H240-D242 VanDerWaalsContact C-OD1 3.25Å; H240-D242 WeakPolarHBondContact CA-OD1 3.28Å; H240-D242 PolarHBondContact O-N 3.43Å; D242-A244 PolarHBondContact O-N 3.16Å; D242-C516 PolarHBondContact OD2-SG 2.98Å
243	C	96	Very high	93.8	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.185	C	C	.	.	G	3₁₀ helix	trans	-70.2	-15.1	175.5	-62.7	0	0	0	0	113.9	W236 L237 H240 P241 L507 R508 C516 L519	W236-C243 HydrophobicContact CH2-CB 4.49Å; W236-C243 HydrophobicContact CZ3-CB 3.74Å; L237-C243 HydrophobicContact CD2-CB 3.88Å; H240-C243 VanDerWaalsContact O-CB 3.26Å; H240-C243 WeakPolarHBondContact O-CB 3.32Å; H240-C243 PolarHBondContact O-N 3.49Å; H240-C243 VanDerWaalsContact O-N 3.15Å; H240-C243 PolarHBondContact O-SG 2.81Å; H240-C243 VanDerWaalsContact O-SG 3.41Å; P241-C243 PolarHBondContact O-N 2.72Å; C243-L507 WeakPolarHBondContact O-CA 3.37Å; C243-R508 PolarHBondContact O-N 2.68Å; C243-C516 VanDerWaalsContact CA-SG 3.54Å; C243-C516 PolarHBondContact SG-SG 2.93Å; C243-L519 HydrophobicContact CB-CB 4.25Å; C243-L519 HydrophobicContact CB-CD1 4.49Å; C243-L519 HydrophobicContact CB-CD2 4.46Å
244	A	95	Very high	94	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.176	C	C	.	.	B	Isolated β-bridge	trans	-108.7	155.5	175.9	0	0	0	0	0	111	L237 P241 D242 N246 N249 M470 V505 K506	L237-A244 HydrophobicContact CD2-CB 4.31Å; P241-A244 PolarHBondContact O-N 3.14Å; D242-A244 PolarHBondContact O-N 3.16Å; A244-N246 PolarHBondContact O-N 2.66Å; A244-N249 PolarHBondContact O-ND2 2.96Å; A244-M470 HydrophobicContact CB-CB 3.96Å; A244-M470 HydrophobicContact CB-CG 3.85Å; A244-M470 HydrophobicContact CB-SD 3.7Å; A244-V505 HydrophobicContact CB-CG1 3.53Å; A244-K506 WeakPolarHBondContact CA-O 3.25Å
245	Y	94.4	Very high	94	Very high	45 Å²	45	36 Å²	36	18%	0.176	18%	0.175	C	C	.	.			trans	-68.6	116.5	163	-74.1	-90.2	0	0	0	108.3	S250 M470 L471 V486 K506 L507 R508	Y245-S250 WeakPolarHBondContact CD1-OG 3.17Å; Y245-M470 CarbonylContact O-C 3.55Å; Y245-M470 WeakPolarHBondContact O-CA 3.37Å; Y245-L471 HydrophobicContact CG-CD2 4.48Å; Y245-L471 PolarHBondContact O-N 2.72Å; Y245-V486 HydrophobicContact CD1-CG1 3.43Å; Y245-V486 VanDerWaalsContact CD1-CG1 3.43Å; Y245-V486 HydrophobicContact CD2-CG1 4.21Å; Y245-V486 HydrophobicContact CE1-CB 4.29Å; Y245-V486 HydrophobicContact CE1-CG1 3.55Å; Y245-V486 HydrophobicContact CE2-CG1 4.29Å; Y245-V486 HydrophobicContact CG-CG1 3.79Å; Y245-K506 HydrophobicContact CD2-CB 4.08Å; Y245-K506 HydrophobicContact CD2-CG 3.59Å; Y245-K506 HydrophobicContact CE2-CG 3.91Å; Y245-K506 PolarHBondContact N-O 2.74Å; Y245-L507 WeakPolarHBondContact CE2-O 3.25Å; Y245-R508 HydrophobicContact CD1-CB 4.45Å; Y245-R508 HydrophobicContact CD1-CG 4.13Å; Y245-R508 HydrophobicContact CD2-CB 3.7Å; Y245-R508 HydrophobicContact CD2-CG 4.23Å; Y245-R508 HydrophobicContact CE1-CB 4.48Å; Y245-R508 HydrophobicContact CE1-CG 3.96Å; Y245-R508 HydrophobicContact CE2-CB 3.74Å; Y245-R508 HydrophobicContact CE2-CG 4.06Å; Y245-R508 HydrophobicContact CG-CB 4.07Å; Y245-R508 HydrophobicContact CG-CG 4.26Å
246	N	94.7	Very high	94.1	Very high	3 Å²	3	30 Å²	30	2%	0.016	15%	0.148	C	C	.	.	B	Isolated β-bridge	trans	-135.3	170.2	-176.4	73.2	40.1	0	0	0	111.3	P241 A244 E248 N249 S250 K467 I469	P241-N246 PolarHBondContact O-ND2 3.44Å; A244-N246 PolarHBondContact O-N 2.66Å; N246-E248 PolarHBondContact O-N 2.98Å; N246-E248 WeakPolarHBondContact OD1-CA 3.05Å; N246-E248 VanDerWaalsContact OD1-CB 3.32Å; N246-E248 WeakPolarHBondContact OD1-CB 3.38Å; N246-E248 PolarHBondContact OD1-N 2.93Å; N246-N249 PolarHBondContact N-OD1 2.94Å; N246-N249 PolarHBondContact ND2-ND2 2.83Å; N246-N249 PolarHBondContact O-N 3.41Å; N246-N249 PolarHBondContact O-OD1 3.01Å; N246-N249 VanDerWaalsContact OD1-CG 3.31Å; N246-N249 PolarHBondContact OD1-N 3.05Å; N246-S250 WeakPolarHBondContact O-CA 3.48Å; N246-S250 VanDerWaalsContact O-CB 3.27Å; N246-S250 WeakPolarHBondContact O-CB 3.29Å; N246-S250 PolarHBondContact O-N 2.95Å; N246-K467 WeakPolarHBondContact CB-O 3.27Å; N246-K467 PolarHBondContact ND2-O 3.36Å; N246-I469 VanDerWaalsContact CA-O 3.23Å; N246-I469 WeakPolarHBondContact CA-O 3.35Å; N246-I469 VanDerWaalsContact CB-O 3.25Å; N246-I469 WeakPolarHBondContact CB-O 3.38Å
247	L	94.4	Very high	94.1	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-5.8	-172.9	-57.7	-179	0	0	0	114.8	L253 R254 Y257 F444 M460 R466 I469	L247-L253 HydrophobicContact CD2-CB 4.2Å; L247-R254 HydrophobicContact CB-CG 4.43Å; L247-R254 HydrophobicContact CD2-CG 4.11Å; L247-R254 PolarHBondContact O-NE 2.99Å; L247-R254 VanDerWaalsContact O-NE 3.11Å; L247-R254 PolarHBondContact O-NH2 2.94Å; L247-Y257 HydrophobicContact CD1-CD1 3.63Å; L247-Y257 HydrophobicContact CD1-CD2 4.03Å; L247-Y257 HydrophobicContact CD1-CE1 4.04Å; L247-Y257 HydrophobicContact CD1-CE2 4.4Å; L247-Y257 HydrophobicContact CD1-CG 3.61Å; L247-Y257 HydrophobicContact CD2-CG 4.47Å; L247-F444 HydrophobicContact CD2-CE1 4.04Å; L247-M460 HydrophobicContact CD1-CB 4.45Å; L247-M460 HydrophobicContact CD1-CG 4.12Å; L247-R466 HydrophobicContact CB-CB 4.07Å; L247-R466 PolarHBondContact N-O 3.11Å; L247-I469 HydrophobicContact CD1-CB 3.88Å; L247-I469 HydrophobicContact CD1-CD1 3.86Å; L247-I469 HydrophobicContact CD1-CG1 4.49Å; L247-I469 HydrophobicContact CD1-CG2 3.56Å; L247-I469 HydrophobicContact CG-CB 4.12Å; L247-I469 HydrophobicContact CG-CG2 3.9Å
248	E	93.3	Very high	94.2	Very high	78 Å²	78	29.1 Å²	29.1	36%	0.364	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85	-53.2	168	177.6	148.1	-100.5	0	0	111.4	N246 R466 K467	N246-E248 PolarHBondContact O-N 2.98Å; N246-E248 WeakPolarHBondContact OD1-CA 3.05Å; N246-E248 VanDerWaalsContact OD1-CB 3.32Å; N246-E248 WeakPolarHBondContact OD1-CB 3.38Å; N246-E248 PolarHBondContact OD1-N 2.93Å; E248-R466 HydrophobicContact CB-CG 4.01Å; E248-R466 IonicContact OE1-CZ 2.65Å; E248-R466 IonicContact OE1-NE 3.87Å; E248-R466 PolarHBondContact OE1-NE 3.25Å; E248-R466 VanDerWaalsContact OE1-NE 3.17Å; E248-R466 IonicContact OE1-NH2 3.93Å; E248-R466 PolarHBondContact OE1-NH2 3.04Å; E248-K467 HydrophobicContact CB-CB 4.17Å
249	N	93.1	Very high	94.5	Very high	42 Å²	42	24.6 Å²	24.6	23%	0.225	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-9.3	-174.1	70.3	27.7	0	0	0	114.3	A244 N246 R508	A244-N249 PolarHBondContact O-ND2 2.96Å; N246-N249 PolarHBondContact N-OD1 2.94Å; N246-N249 PolarHBondContact ND2-ND2 2.83Å; N246-N249 PolarHBondContact O-N 3.41Å; N246-N249 PolarHBondContact O-OD1 3.01Å; N246-N249 VanDerWaalsContact OD1-CG 3.31Å; N246-N249 PolarHBondContact OD1-N 3.05Å; N249-R508 VanDerWaalsContact CG-CD 3.45Å; N249-R508 VanDerWaalsContact ND2-CD 3.28Å; N249-R508 WeakPolarHBondContact ND2-CD 3.36Å; N249-R508 WeakPolarHBondContact OD1-CD 3.42Å
250	S	93.7	Very high	94.6	Very high	3 Å²	3	17.9 Å²	17.9	2%	0.021	9%	0.09	C	C	.	.			trans	-141.9	61.5	-175.9	-54.5	0	0	0	0	111.3	Y245 N246 H252 L253	Y245-S250 WeakPolarHBondContact CD1-OG 3.17Å; N246-S250 WeakPolarHBondContact O-CA 3.48Å; N246-S250 VanDerWaalsContact O-CB 3.27Å; N246-S250 WeakPolarHBondContact O-CB 3.29Å; N246-S250 PolarHBondContact O-N 2.95Å; S250-H252 PolarHBondContact O-N 3.31Å; S250-H252 VanDerWaalsContact O-N 3.12Å; S250-L253 WeakPolarHBondContact O-CB 3.18Å; S250-L253 PolarHBondContact O-N 2.91Å
251	P	93.5	Very high	94.6	Very high	22 Å²	22	15.1 Å²	15.1	14%	0.143	8%	0.077	C	C	.	.	G	3₁₀ helix	trans	-64.4	-19.8	-172.4	28.5	-37.1	0	0	0	113.7	L253 R254 M349 Y351	P251-L253 PolarHBondContact O-N 3.26Å; P251-L253 VanDerWaalsContact O-N 3.11Å; P251-R254 WeakPolarHBondContact O-CB 3.45Å; P251-R254 WeakPolarHBondContact O-CG 3.4Å; P251-R254 PolarHBondContact O-N 3.47Å; P251-M349 VanDerWaalsContact CB-O 3.23Å; P251-M349 WeakPolarHBondContact CB-O 3.35Å; P251-M349 WeakPolarHBondContact CG-O 3.11Å; P251-Y351 WeakPolarHBondContact O-CD2 3.32Å
252	H	93.2	Very high	94.7	Very high	27 Å²	27	14.4 Å²	14.4	13%	0.125	7%	0.073	C	C	.	.	G	3₁₀ helix	trans	-63.2	-12.5	172.2	63.8	-79.5	0	0	0	114.7	S250 Y351 V486 P488	S250-H252 PolarHBondContact O-N 3.31Å; S250-H252 VanDerWaalsContact O-N 3.12Å; H252-Y351 VanDerWaalsContact CA-CE2 3.42Å; H252-Y351 HydrophobicContact CB-CE2 3.98Å; H252-V486 PolarHBondContact NE2-O 2.91Å; H252-P488 HydrophobicContact CB-CB 4.46Å
253	L	94.7	Very high	94.7	Very high	9 Å²	9	11.6 Å²	11.6	5%	0.047	6%	0.057	C	C	.	.	G	3₁₀ helix	trans	-86.1	-10	173.3	-59.9	175	0	0	0	113.1	L247 S250 P251 A256 Y257 F444 L471 V486	L247-L253 HydrophobicContact CD2-CB 4.2Å; S250-L253 WeakPolarHBondContact O-CB 3.18Å; S250-L253 PolarHBondContact O-N 2.91Å; P251-L253 PolarHBondContact O-N 3.26Å; P251-L253 VanDerWaalsContact O-N 3.11Å; L253-A256 WeakPolarHBondContact O-CA 3.22Å; L253-A256 WeakPolarHBondContact O-CB 3.25Å; L253-A256 PolarHBondContact O-N 2.74Å; L253-Y257 PolarHBondContact O-N 3.08Å; L253-F444 HydrophobicContact CB-CE1 4.19Å; L253-F444 HydrophobicContact CB-CZ 4.14Å; L253-L471 HydrophobicContact CD1-CB 4.46Å; L253-L471 HydrophobicContact CD1-CD1 4.19Å; L253-L471 HydrophobicContact CD1-CD2 3.94Å; L253-L471 HydrophobicContact CD1-CG 4.44Å; L253-V486 HydrophobicContact CD1-CG1 4.27Å; L253-V486 HydrophobicContact CD2-CG1 4.45Å
254	R	94.9	Very high	94.5	Very high	0 Å²	0	12.4 Å²	12.4	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-54.6	-45	-179.3	-72.4	176.8	-169.7	179.2	9	113.7	L247 P251 A256 Y257 L258 E350 M460 R466	L247-R254 HydrophobicContact CB-CG 4.43Å; L247-R254 HydrophobicContact CD2-CG 4.11Å; L247-R254 PolarHBondContact O-NE 2.99Å; L247-R254 VanDerWaalsContact O-NE 3.11Å; L247-R254 PolarHBondContact O-NH2 2.94Å; P251-R254 WeakPolarHBondContact O-CB 3.45Å; P251-R254 WeakPolarHBondContact O-CG 3.4Å; P251-R254 PolarHBondContact O-N 3.47Å; R254-A256 VanDerWaalsContact C-N 3.29Å; R254-A256 PolarHBondContact O-N 3.41Å; R254-Y257 PolarHBondContact O-N 3.25Å; R254-L258 PolarHBondContact O-N 2.86Å; R254-E350 WeakPolarHBondContact CD-O 3.28Å; R254-E350 IonicContact CZ-OE2 2.86Å; R254-E350 VanDerWaalsContact CZ-OE2 3.24Å; R254-E350 VanDerWaalsContact NH1-CD 3.3Å; R254-E350 PolarHBondContact NH1-O 3.08Å; R254-E350 IonicContact NH1-OE1 2.69Å; R254-E350 IonicContact NH1-OE2 3.17Å; R254-E350 PolarHBondContact NH1-OE2 3.25Å; R254-E350 IonicContact NH2-OE1 3.74Å; R254-E350 PolarHBondContact NH2-OE1 3.06Å; R254-E350 IonicContact NH2-OE2 3.39Å; R254-E350 PolarHBondContact NH2-OE2 3.32Å; R254-M460 HydrophobicContact CB-CE 4.25Å; R254-M460 HydrophobicContact CB-CG 3.99Å; R254-M460 HydrophobicContact CB-SD 3.56Å; R254-M460 VanDerWaalsContact CB-SD 3.56Å; R254-M460 HydrophobicContact CG-CG 3.69Å; R254-M460 HydrophobicContact CG-SD 3.99Å; R254-M460 VanDerWaalsContact O-SD 3.32Å; R254-R466 VanDerWaalsContact NH2-NH1 3.12Å
255	P	95.2	Very high	94.4	Very high	1 Å²	1	13.5 Å²	13.5	1%	0.006	7%	0.066	C	C	.	.	H	α-helix	trans	-62.5	-33.2	174.6	-23.3	34.6	0	0	0	113.8	L259 L310 F311 Y351 F494	P255-L259 WeakPolarHBondContact O-CB 3.45Å; P255-L259 PolarHBondContact O-N 2.75Å; P255-L259 VanDerWaalsContact O-N 3.15Å; P255-L310 HydrophobicContact CB-CD1 4.02Å; P255-L310 HydrophobicContact CG-CD1 4.03Å; P255-F311 HydrophobicContact CB-CE2 4Å; P255-F311 HydrophobicContact CB-CZ 3.6Å; P255-F311 HydrophobicContact CG-CE1 4.16Å; P255-F311 HydrophobicContact CG-CE2 4.15Å; P255-F311 HydrophobicContact CG-CZ 3.57Å; P255-Y351 HydrophobicContact CG-CD1 3.51Å; P255-Y351 HydrophobicContact CG-CE1 3.95Å; P255-Y351 HydrophobicContact CG-CG 4.27Å; P255-F494 HydrophobicContact CB-CD2 3.97Å; P255-F494 HydrophobicContact CB-CE2 3.86Å
256	A	95.1	Very high	94.3	Very high	5 Å²	5	11.6 Å²	11.6	4%	0.041	6%	0.059	C	C	.	.	H	α-helix	trans	-73.1	-37.5	176.3	0	0	0	0	0	111.8	L253 R254 D260 F444 F494	L253-A256 WeakPolarHBondContact O-CA 3.22Å; L253-A256 WeakPolarHBondContact O-CB 3.25Å; L253-A256 PolarHBondContact O-N 2.74Å; R254-A256 VanDerWaalsContact C-N 3.29Å; R254-A256 PolarHBondContact O-N 3.41Å; A256-D260 WeakPolarHBondContact O-CB 3.41Å; A256-D260 PolarHBondContact O-N 2.97Å; A256-F444 HydrophobicContact CB-CE2 4.25Å; A256-F444 HydrophobicContact CB-CZ 4.22Å; A256-F494 HydrophobicContact CB-CB 4.16Å; A256-F494 HydrophobicContact CB-CD2 4.48Å
257	Y	95.7	Very high	94.1	Very high	2 Å²	2	11.5 Å²	11.5	1%	0.008	6%	0.058	C	C	.	.	H	α-helix	trans	-62.1	-54.4	171.3	171.7	-102.4	0	0	0	111.1	L247 L253 R254 L259 D260 R261 F444 D456 M460 I469	L247-Y257 HydrophobicContact CD1-CD1 3.63Å; L247-Y257 HydrophobicContact CD1-CD2 4.03Å; L247-Y257 HydrophobicContact CD1-CE1 4.04Å; L247-Y257 HydrophobicContact CD1-CE2 4.4Å; L247-Y257 HydrophobicContact CD1-CG 3.61Å; L247-Y257 HydrophobicContact CD2-CG 4.47Å; L253-Y257 PolarHBondContact O-N 3.08Å; R254-Y257 PolarHBondContact O-N 3.25Å; Y257-L259 PolarHBondContact O-N 3.02Å; Y257-D260 WeakPolarHBondContact O-CA 3.31Å; Y257-D260 WeakPolarHBondContact O-CB 3.27Å; Y257-D260 PolarHBondContact O-N 3.44Å; Y257-R261 HydrophobicContact CD1-CG 4.14Å; Y257-R261 HydrophobicContact CD2-CG 3.9Å; Y257-R261 HydrophobicContact CE1-CG 3.78Å; Y257-R261 HydrophobicContact CE2-CG 3.52Å; Y257-R261 HydrophobicContact CG-CG 4.21Å; Y257-R261 VanDerWaalsContact CZ-CG 3.46Å; Y257-R261 VanDerWaalsContact O-CG 3.28Å; Y257-R261 WeakPolarHBondContact O-CG 3.29Å; Y257-R261 PolarHBondContact O-N 3.48Å; Y257-F444 VanDerWaalsContact CA-CE2 3.41Å; Y257-F444 HydrophobicContact CD2-CB 3.83Å; Y257-F444 HydrophobicContact CD2-CD1 4.13Å; Y257-F444 AromaticContact CD2-CD2 3.99Å; Y257-F444 HydrophobicContact CD2-CD2 3.99Å; Y257-F444 AromaticContact CD2-CG 3.72Å; Y257-F444 HydrophobicContact CD2-CG 3.72Å; Y257-F444 HydrophobicContact CE2-CB 4.31Å; Y257-D456 HydrophobicContact CE1-CB 4.19Å; Y257-D456 WeakPolarHBondContact CE1-O 3.34Å; Y257-M460 HydrophobicContact CD1-CB 4.02Å; Y257-M460 HydrophobicContact CD1-CG 4.06Å; Y257-M460 HydrophobicContact CD1-SD 3.84Å; Y257-M460 HydrophobicContact CE1-CB 3.92Å; Y257-M460 HydrophobicContact CE1-CG 4.46Å; Y257-I469 HydrophobicContact CD2-CG2 3.57Å; Y257-I469 HydrophobicContact CE1-CD1 4.25Å; Y257-I469 HydrophobicContact CE2-CD1 4.03Å; Y257-I469 HydrophobicContact CE2-CG1 4.41Å; Y257-I469 HydrophobicContact CE2-CG2 3.41Å; Y257-I469 VanDerWaalsContact CE2-CG2 3.41Å; Y257-I469 HydrophobicContact CG-CG2 4.41Å; Y257-I469 WeakPolarHBondContact OH-CD1 3.48Å
258	L	95.6	Very high	93.9	Very high	0 Å²	0	15 Å²	15	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-54	-42.7	179.7	-176	60.7	0	0	0	111.6	R254 R261 V262 I307 L310 W453 E457 M460	R254-L258 PolarHBondContact O-N 2.86Å; L258-R261 PolarHBondContact O-N 2.89Å; L258-V262 WeakPolarHBondContact O-CB 3.44Å; L258-V262 WeakPolarHBondContact O-CG2 3.43Å; L258-V262 PolarHBondContact O-N 2.82Å; L258-I307 HydrophobicContact CD2-CG1 4.06Å; L258-I307 HydrophobicContact CG-CG1 4.45Å; L258-L310 HydrophobicContact CD2-CD1 3.96Å; L258-W453 HydrophobicContact CD1-CE3 3.86Å; L258-W453 HydrophobicContact CD1-CZ3 4.22Å; L258-E457 HydrophobicContact CD1-CB 3.87Å; L258-E457 HydrophobicContact CD1-CG 4.04Å; L258-M460 HydrophobicContact CB-SD 4.23Å
259	L	96	Very high	93.8	Very high	1 Å²	1	12.5 Å²	12.5	1%	0.005	7%	0.065	C	C	.	.	H	α-helix	trans	-62.8	-45.1	174	-178.9	61.8	0	0	0	113	P255 Y257 R261 V262 L263 Y302 I307 L407 F494	P255-L259 WeakPolarHBondContact O-CB 3.45Å; P255-L259 PolarHBondContact O-N 2.75Å; P255-L259 VanDerWaalsContact O-N 3.15Å; Y257-L259 PolarHBondContact O-N 3.02Å; L259-R261 VanDerWaalsContact C-N 3.27Å; L259-R261 PolarHBondContact O-N 3.07Å; L259-V262 PolarHBondContact O-N 3.1Å; L259-L263 HydrophobicContact CD1-CD1 3.99Å; L259-L263 HydrophobicContact CD1-CG 4.3Å; L259-L263 HydrophobicContact CG-CD1 3.89Å; L259-L263 WeakPolarHBondContact O-CB 3.44Å; L259-L263 WeakPolarHBondContact O-CD1 3.49Å; L259-L263 VanDerWaalsContact O-CG 3.24Å; L259-L263 WeakPolarHBondContact O-CG 3.42Å; L259-L263 PolarHBondContact O-N 2.98Å; L259-Y302 HydrophobicContact CD1-CD1 4.25Å; L259-Y302 HydrophobicContact CD1-CE1 3.56Å; L259-Y302 HydrophobicContact CD1-CE2 4.43Å; L259-I307 HydrophobicContact CB-CD1 4.37Å; L259-I307 HydrophobicContact CD1-CD1 4.09Å; L259-L407 HydrophobicContact CD1-CD2 3.8Å; L259-L407 HydrophobicContact CD2-CD2 3.79Å; L259-L407 HydrophobicContact CG-CD2 4.39Å; L259-F494 HydrophobicContact CB-CE2 4.45Å; L259-F494 HydrophobicContact CD2-CD2 4.03Å; L259-F494 HydrophobicContact CD2-CE2 4.13Å; L259-F494 WeakPolarHBondContact CD2-O 3.19Å
260	D	95.4	Very high	93.6	Very high	1 Å²	1	10.5 Å²	10.5	1%	0.005	5%	0.054	C	C	.	.	H	α-helix	trans	-58.9	-39.9	176.6	-172.4	58	0	0	0	111.9	A256 Y257 L263 H264 Q442 Y443 F444 R496	A256-D260 WeakPolarHBondContact O-CB 3.41Å; A256-D260 PolarHBondContact O-N 2.97Å; Y257-D260 WeakPolarHBondContact O-CA 3.31Å; Y257-D260 WeakPolarHBondContact O-CB 3.27Å; Y257-D260 PolarHBondContact O-N 3.44Å; D260-L263 PolarHBondContact O-N 3Å; D260-H264 WeakPolarHBondContact O-CB 3.45Å; D260-H264 PolarHBondContact O-N 3.17Å; D260-Q442 WeakPolarHBondContact OD1-CA 3.42Å; D260-Y443 VanDerWaalsContact CG-N 3.28Å; D260-Y443 PolarHBondContact OD1-N 3.44Å; D260-Y443 PolarHBondContact OD2-N 2.95Å; D260-F444 HydrophobicContact CB-CD2 3.98Å; D260-F444 HydrophobicContact CB-CE2 4.37Å; D260-F444 PolarHBondContact OD2-N 3.01Å; D260-R496 IonicContact OD1-CZ 3.18Å; D260-R496 IonicContact OD1-NH1 3.55Å; D260-R496 PolarHBondContact OD1-NH1 3.38Å; D260-R496 IonicContact OD1-NH2 2.84Å; D260-R496 PolarHBondContact OD1-NH2 2.92Å
261	R	94.4	Very high	93.2	Very high	1 Å²	1	11.7 Å²	11.7	0%	0.004	6%	0.064	C	C	.	.	H	α-helix	trans	-69	-47	177.9	-62	-45.6	-53.1	175.1	-13	112.9	Y257 L258 L259 L263 H264 H265 Q446 S450 D456	Y257-R261 HydrophobicContact CD1-CG 4.14Å; Y257-R261 HydrophobicContact CD2-CG 3.9Å; Y257-R261 HydrophobicContact CE1-CG 3.78Å; Y257-R261 HydrophobicContact CE2-CG 3.52Å; Y257-R261 HydrophobicContact CG-CG 4.21Å; Y257-R261 VanDerWaalsContact CZ-CG 3.46Å; Y257-R261 VanDerWaalsContact O-CG 3.28Å; Y257-R261 WeakPolarHBondContact O-CG 3.29Å; Y257-R261 PolarHBondContact O-N 3.48Å; L258-R261 PolarHBondContact O-N 2.89Å; L259-R261 VanDerWaalsContact C-N 3.27Å; L259-R261 PolarHBondContact O-N 3.07Å; R261-L263 PolarHBondContact O-N 3.27Å; R261-H264 PolarHBondContact O-N 3.26Å; R261-H264 VanDerWaalsContact O-N 3.16Å; R261-H265 PolarHBondContact O-CD2 3.32Å; R261-H265 PolarHBondContact O-N 3.27Å; R261-Q446 VanDerWaalsContact NH1-CD 3.32Å; R261-S450 PolarHBondContact NH2-OG 3.38Å; R261-S450 VanDerWaalsContact NH2-OG 3.09Å; R261-D456 HydrophobicContact CB-CB 3.93Å; R261-D456 HydrophobicContact CG-CB 3.76Å; R261-D456 IonicContact CZ-OD1 2.93Å; R261-D456 IonicContact CZ-OD2 3.24Å; R261-D456 VanDerWaalsContact NE-CG 3.26Å; R261-D456 IonicContact NE-OD1 2.79Å; R261-D456 IonicContact NE-OD2 2.68Å; R261-D456 PolarHBondContact NE-OD2 3.49Å; R261-D456 IonicContact NH2-OD1 2.85Å; R261-D456 PolarHBondContact NH2-OD1 3.21Å; R261-D456 IonicContact NH2-OD2 2.69Å; R261-D456 PolarHBondContact NH2-OD2 3.44Å
262	V	95.5	Very high	92.9	Very high	3 Å²	3	15.2 Å²	15.2	2%	0.018	9%	0.089	C	C	.	.	H	α-helix	trans	-54.3	-43.5	172.1	166.9	0	0	0	0	110.9	L258 L259 F266 V301 Y302 T305 W453	L258-V262 WeakPolarHBondContact O-CB 3.44Å; L258-V262 WeakPolarHBondContact O-CG2 3.43Å; L258-V262 PolarHBondContact O-N 2.82Å; L259-V262 PolarHBondContact O-N 3.1Å; V262-F266 WeakPolarHBondContact O-CB 3.21Å; V262-F266 PolarHBondContact O-N 2.7Å; V262-V301 HydrophobicContact CG1-CG1 3.51Å; V262-Y302 HydrophobicContact CG1-CD1 4.47Å; V262-T305 HydrophobicContact CB-CG2 4.32Å; V262-T305 HydrophobicContact CG1-CG2 3.86Å; V262-T305 HydrophobicContact CG2-CG2 3.44Å; V262-T305 VanDerWaalsContact CG2-CG2 3.44Å; V262-W453 HydrophobicContact CG2-CB 4.11Å; V262-W453 HydrophobicContact CG2-CD2 3.9Å; V262-W453 HydrophobicContact CG2-CE3 3.99Å; V262-W453 HydrophobicContact CG2-CG 3.95Å
263	L	94.6	Very high	92.6	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-70.6	-35.5	178.5	-72.1	168.3	0	0	0	113.2	L259 D260 R261 F266 S267 L297 Y302 L414 F440 R496	L259-L263 HydrophobicContact CD1-CD1 3.99Å; L259-L263 HydrophobicContact CD1-CG 4.3Å; L259-L263 HydrophobicContact CG-CD1 3.89Å; L259-L263 WeakPolarHBondContact O-CB 3.44Å; L259-L263 WeakPolarHBondContact O-CD1 3.49Å; L259-L263 VanDerWaalsContact O-CG 3.24Å; L259-L263 WeakPolarHBondContact O-CG 3.42Å; L259-L263 PolarHBondContact O-N 2.98Å; D260-L263 PolarHBondContact O-N 3Å; R261-L263 PolarHBondContact O-N 3.27Å; L263-F266 PolarHBondContact O-N 3.33Å; L263-S267 WeakPolarHBondContact O-CB 3.35Å; L263-S267 PolarHBondContact O-N 2.92Å; L263-L297 HydrophobicContact CD2-CD1 4.27Å; L263-L297 HydrophobicContact CD2-CD2 3.71Å; L263-Y302 HydrophobicContact CD2-CE1 4.18Å; L263-L414 HydrophobicContact CD1-CD1 3.7Å; L263-L414 HydrophobicContact CD1-CD2 4.24Å; L263-L414 HydrophobicContact CD2-CD1 3.72Å; L263-L414 HydrophobicContact CG-CD1 4.39Å; L263-F440 HydrophobicContact CB-CD2 3.97Å; L263-F440 HydrophobicContact CB-CE2 4.49Å; L263-F440 HydrophobicContact CD2-CD2 4.02Å; L263-F440 HydrophobicContact CD2-CE2 3.73Å; L263-R496 VanDerWaalsContact CD1-NE 3.31Å; L263-R496 VanDerWaalsContact CD1-NH2 3.3Å
264	H	92.2	Very high	92.2	Very high	18 Å²	18	18.4 Å²	18.4	8%	0.083	12%	0.124	C	C	.	.	H	α-helix	trans	-63.1	-47.3	172.6	177.8	73.1	0	0	0	111.8	D260 R261 S267 R268 Q442	D260-H264 WeakPolarHBondContact O-CB 3.45Å; D260-H264 PolarHBondContact O-N 3.17Å; R261-H264 PolarHBondContact O-N 3.26Å; R261-H264 VanDerWaalsContact O-N 3.16Å; H264-S267 WeakPolarHBondContact O-CB 3.39Å; H264-S267 PolarHBondContact O-N 3.46Å; H264-R268 WeakPolarHBondContact O-CG 3.4Å; H264-R268 PolarHBondContact O-N 3.12Å; H264-Q442 PolarHBondContact ND1-OE1 3.12Å
265	H	93	Very high	91.9	Very high	22 Å²	22	20.1 Å²	20.1	10%	0.102	13%	0.131	C	C	.	.	H	α-helix	trans	-69.4	-34.2	177.4	-69.9	-71.8	0	0	0	112.4	R261 R268 A269 S450 K452 W453 D456	R261-H265 PolarHBondContact O-CD2 3.32Å; R261-H265 PolarHBondContact O-N 3.27Å; H265-R268 PolarHBondContact O-N 2.81Å; H265-A269 PolarHBondContact O-N 3.32Å; H265-S450 PolarHBondContact CE1-OG 3Å; H265-S450 PolarHBondContact NE2-OG 2.87Å; H265-K452 PolarHBondContact CE1-N 3.23Å; H265-K452 VanDerWaalsContact NE2-C 3.27Å; H265-K452 PolarHBondContact NE2-O 3.4Å; H265-W453 PolarHBondContact CD2-N 2.96Å; H265-W453 PolarHBondContact NE2-N 3.39Å; H265-D456 IonicContact CD2-OD2 2.69Å; H265-D456 PolarHBondContact CD2-OD2 3.01Å; H265-D456 IonicContact NE2-OD2 2.72Å; H265-D456 PolarHBondContact NE2-OD2 2.66Å
266	F	93	Very high	91.4	Very high	5 Å²	5	23.2 Å²	23.2	2%	0.022	15%	0.152	C	C	.	.	H	α-helix	trans	-59.1	-47.8	168.2	174.4	-97.8	0	0	0	111.6	V262 L263 R268 A269 V270 Y275 L280 M293 I296 L297 V301 L439 F440	V262-F266 WeakPolarHBondContact O-CB 3.21Å; V262-F266 PolarHBondContact O-N 2.7Å; L263-F266 PolarHBondContact O-N 3.33Å; F266-R268 VanDerWaalsContact C-N 3.28Å; F266-R268 PolarHBondContact O-N 3.22Å; F266-A269 PolarHBondContact O-N 3.43Å; F266-V270 HydrophobicContact CD1-CG2 4.19Å; F266-V270 HydrophobicContact CD2-CG2 4.48Å; F266-V270 HydrophobicContact CE1-CG2 3.73Å; F266-V270 HydrophobicContact CE2-CG2 4.02Å; F266-V270 HydrophobicContact CZ-CG2 3.64Å; F266-V270 WeakPolarHBondContact O-CG2 3.28Å; F266-V270 PolarHBondContact O-N 3.13Å; F266-Y275 HydrophobicContact CD2-CD2 4.5Å; F266-Y275 AromaticContact CD2-CE2 3.7Å; F266-Y275 HydrophobicContact CD2-CE2 3.7Å; F266-Y275 AromaticContact CD2-CZ 3.89Å; F266-Y275 HydrophobicContact CE2-CD2 4.11Å; F266-Y275 HydrophobicContact CE2-CE1 4.3Å; F266-Y275 AromaticContact CE2-CE2 3.65Å; F266-Y275 HydrophobicContact CE2-CE2 3.65Å; F266-Y275 AromaticContact CE2-CZ 3.77Å; F266-L280 HydrophobicContact CZ-CD1 3.85Å; F266-M293 HydrophobicContact CE1-CG 4.11Å; F266-M293 HydrophobicContact CZ-CG 4.16Å; F266-I296 HydrophobicContact CE2-CG2 3.73Å; F266-I296 HydrophobicContact CZ-CG2 4.38Å; F266-L297 HydrophobicContact CD1-CD2 3.98Å; F266-L297 HydrophobicContact CD2-CD2 4.2Å; F266-L297 HydrophobicContact CE1-CD2 4.06Å; F266-L297 HydrophobicContact CE1-CG 4.45Å; F266-L297 HydrophobicContact CE2-CD2 4.29Å; F266-L297 HydrophobicContact CG-CD2 4.03Å; F266-L297 HydrophobicContact CZ-CD2 4.21Å; F266-L297 HydrophobicContact CZ-CG 4.44Å; F266-V301 HydrophobicContact CD2-CG2 3.78Å; F266-V301 HydrophobicContact CE2-CG2 4.14Å; F266-L439 HydrophobicContact CE1-CD2 4.42Å; F266-F440 AromaticContact CD1-CE2 3.81Å; F266-F440 HydrophobicContact CD1-CE2 3.81Å; F266-F440 HydrophobicContact CE1-CE2 4.12Å; F266-F440 HydrophobicContact CE1-CZ 4.4Å
267	S	90.5	Very high	90.9	Very high	1 Å²	1	27.1 Å²	27.1	1%	0.007	19%	0.193	C	C	.	.	H	α-helix	trans	-56	-42.6	175.7	171.7	0	0	0	0	112	L263 H264 V270 A271 L439	L263-S267 WeakPolarHBondContact O-CB 3.35Å; L263-S267 PolarHBondContact O-N 2.92Å; H264-S267 WeakPolarHBondContact O-CB 3.39Å; H264-S267 PolarHBondContact O-N 3.46Å; S267-V270 PolarHBondContact O-N 3.29Å; S267-A271 WeakPolarHBondContact O-CB 3.18Å; S267-A271 PolarHBondContact O-N 2.96Å; S267-L439 VanDerWaalsContact OG-CB 3.29Å; S267-L439 WeakPolarHBondContact OG-CB 3.21Å; S267-L439 PolarHBondContact OG-N 3.5Å
268	R	90	Very high	90.5	Very high	74 Å²	74	31.8 Å²	31.8	28%	0.279	21%	0.213	S	C	.	.	H	α-helix	trans	-64.2	-38.1	176.2	-69.2	175.4	61.5	-167.1	-1.9	112.5	H264 H265 F266 A271 S272 S450	H264-R268 WeakPolarHBondContact O-CG 3.4Å; H264-R268 PolarHBondContact O-N 3.12Å; H265-R268 PolarHBondContact O-N 2.81Å; F266-R268 VanDerWaalsContact C-N 3.28Å; F266-R268 PolarHBondContact O-N 3.22Å; R268-A271 WeakPolarHBondContact O-CB 2.98Å; R268-A271 PolarHBondContact O-N 2.77Å; R268-S272 PolarHBondContact O-N 2.73Å; R268-S272 PolarHBondContact O-OG 2.9Å; R268-S450 PolarHBondContact NH1-O 3.39Å
269	A	89.8	Confident	89.8	Confident	26 Å²	26	34 Å²	34	22%	0.215	24%	0.235	C	C	.	.	H	α-helix	trans	-70.6	-32.9	176.5	0	0	0	0	0	113.1	H265 F266 S272 G273 A274 Y275	H265-A269 PolarHBondContact O-N 3.32Å; F266-A269 PolarHBondContact O-N 3.43Å; A269-S272 PolarHBondContact O-OG 3.23Å; A269-G273 PolarHBondContact O-N 2.86Å; A269-A274 HydrophobicContact CB-CB 4.31Å; A269-A274 VanDerWaalsContact O-CB 3.25Å; A269-A274 WeakPolarHBondContact O-CB 3.43Å; A269-A274 PolarHBondContact O-N 3.4Å; A269-Y275 HydrophobicContact CB-CD2 4.18Å; A269-Y275 HydrophobicContact CB-CE2 3.7Å
270	V	89.2	Confident	89.3	Confident	0 Å²	0	34 Å²	34	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-70	-37.5	168	-173	0	0	0	0	110.3	F266 S267 S272 G273 Y275 L280 W285	F266-V270 HydrophobicContact CD1-CG2 4.19Å; F266-V270 HydrophobicContact CD2-CG2 4.48Å; F266-V270 HydrophobicContact CE1-CG2 3.73Å; F266-V270 HydrophobicContact CE2-CG2 4.02Å; F266-V270 HydrophobicContact CZ-CG2 3.64Å; F266-V270 WeakPolarHBondContact O-CG2 3.28Å; F266-V270 PolarHBondContact O-N 3.13Å; S267-V270 PolarHBondContact O-N 3.29Å; V270-S272 PolarHBondContact O-N 3.47Å; V270-G273 PolarHBondContact O-N 2.91Å; V270-G273 VanDerWaalsContact O-N 3.15Å; V270-Y275 HydrophobicContact CG2-CD2 3.72Å; V270-Y275 HydrophobicContact CG2-CE2 4.37Å; V270-Y275 HydrophobicContact CG2-CG 4.43Å; V270-L280 HydrophobicContact CG1-CB 4.1Å; V270-L280 HydrophobicContact CG2-CD1 4.21Å; V270-W285 HydrophobicContact CG1-CH2 4.45Å; V270-W285 HydrophobicContact CG1-CZ2 4.2Å
271	A	86.1	Confident	88.4	Confident	28 Å²	28	35.9 Å²	35.9	23%	0.231	25%	0.249	C	C	.	.	H	α-helix	trans	-61.4	-40.5	177.2	0	0	0	0	0	113.4	S267 R268 G273 H433	S267-A271 WeakPolarHBondContact O-CB 3.18Å; S267-A271 PolarHBondContact O-N 2.96Å; R268-A271 WeakPolarHBondContact O-CB 2.98Å; R268-A271 PolarHBondContact O-N 2.77Å; A271-G273 PolarHBondContact O-N 3.24Å; A271-H433 VanDerWaalsContact CA-CD2 3.42Å; A271-H433 WeakPolarHBondContact CA-CD2 3.38Å; A271-H433 WeakPolarHBondContact CA-NE2 3.46Å; A271-H433 PolarHBondContact N-NE2 3.28Å
272	S	87.7	Confident	87.5	Confident	96 Å²	96	38 Å²	38	67%	0.671	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-0.2	177	64.3	0	0	0	0	114	R268 A269 V270	R268-S272 PolarHBondContact O-N 2.73Å; R268-S272 PolarHBondContact O-OG 2.9Å; A269-S272 PolarHBondContact O-OG 3.23Å; V270-S272 PolarHBondContact O-N 3.47Å
273	G	85.8	Confident	86.3	Confident	28 Å²	28	43.6 Å²	43.6	29%	0.289	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.6	12.1	179.3	0	0	0	0	0	115.1	A269 V270 A271 Y275 S276	A269-G273 PolarHBondContact O-N 2.86Å; V270-G273 PolarHBondContact O-N 2.91Å; V270-G273 VanDerWaalsContact O-N 3.15Å; A271-G273 PolarHBondContact O-N 3.24Å; G273-Y275 PolarHBondContact O-N 3.24Å; G273-Y275 VanDerWaalsContact O-N 3.14Å; G273-S276 VanDerWaalsContact CA-OG 3.29Å; G273-S276 WeakPolarHBondContact CA-OG 3.34Å; G273-S276 WeakPolarHBondContact O-CB 3.48Å; G273-S276 PolarHBondContact O-N 2.97Å; G273-S276 PolarHBondContact O-OG 3.29Å
274	A	87.1	Confident	85.3	Confident	74 Å²	74	47.6 Å²	47.6	61%	0.612	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-24	-178.9	0	0	0	0	0	113.6	A269	A269-A274 HydrophobicContact CB-CB 4.31Å; A269-A274 VanDerWaalsContact O-CB 3.25Å; A269-A274 WeakPolarHBondContact O-CB 3.43Å; A269-A274 PolarHBondContact O-N 3.4Å
275	Y	88.7	Confident	84.7	Confident	37 Å²	37	47.6 Å²	47.6	15%	0.145	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100	7.1	176.6	-67.3	-80.3	0	0	0	114.4	F266 A269 V270 G273 G277 K278 G279 L280 I296	F266-Y275 HydrophobicContact CD2-CD2 4.5Å; F266-Y275 AromaticContact CD2-CE2 3.7Å; F266-Y275 HydrophobicContact CD2-CE2 3.7Å; F266-Y275 AromaticContact CD2-CZ 3.89Å; F266-Y275 HydrophobicContact CE2-CD2 4.11Å; F266-Y275 HydrophobicContact CE2-CE1 4.3Å; F266-Y275 AromaticContact CE2-CE2 3.65Å; F266-Y275 HydrophobicContact CE2-CE2 3.65Å; F266-Y275 AromaticContact CE2-CZ 3.77Å; A269-Y275 HydrophobicContact CB-CD2 4.18Å; A269-Y275 HydrophobicContact CB-CE2 3.7Å; V270-Y275 HydrophobicContact CG2-CD2 3.72Å; V270-Y275 HydrophobicContact CG2-CE2 4.37Å; V270-Y275 HydrophobicContact CG2-CG 4.43Å; G273-Y275 PolarHBondContact O-N 3.24Å; G273-Y275 VanDerWaalsContact O-N 3.14Å; Y275-G277 VanDerWaalsContact C-N 3.27Å; Y275-G277 PolarHBondContact O-N 3.01Å; Y275-K278 HydrophobicContact CD1-CD 4.39Å; Y275-K278 PolarHBondContact O-N 2.88Å; Y275-G279 PolarHBondContact O-N 3.22Å; Y275-L280 CarbonylContact C-O 3.53Å; Y275-L280 VanDerWaalsContact C-O 3.32Å; Y275-L280 HydrophobicContact CG-CD1 4.49Å; Y275-L280 PolarHBondContact O-N 3.21Å; Y275-I296 HydrophobicContact CD1-CD1 4.07Å; Y275-I296 HydrophobicContact CD1-CG2 4.05Å; Y275-I296 HydrophobicContact CE1-CG2 3.58Å
276	S	84.8	Confident	84.3	Confident	65 Å²	65	50.3 Å²	50.3	46%	0.455	33%	0.33	S	S	.	.	G	3₁₀ helix	trans	-57.1	-40.7	-178.9	-51.7	0	0	0	0	112	G273 K278 G279 L280	G273-S276 VanDerWaalsContact CA-OG 3.29Å; G273-S276 WeakPolarHBondContact CA-OG 3.34Å; G273-S276 WeakPolarHBondContact O-CB 3.48Å; G273-S276 PolarHBondContact O-N 2.97Å; G273-S276 PolarHBondContact O-OG 3.29Å; S276-K278 PolarHBondContact O-N 2.82Å; S276-K278 VanDerWaalsContact O-N 3.13Å; S276-G279 PolarHBondContact O-N 3.3Å; S276-L280 WeakPolarHBondContact CA-O 3.37Å; S276-L280 PolarHBondContact N-O 3.42Å
277	G	84.5	Confident	83.9	Confident	87 Å²	87	57.5 Å²	57.5	90%	0.897	36%	0.363	S	S	*	.	G	3₁₀ helix	trans	-65.4	-11.2	176.7	0	0	0	0	0	115.1	Y275	Y275-G277 VanDerWaalsContact C-N 3.27Å; Y275-G277 PolarHBondContact O-N 3.01Å
278	K	85.6	Confident	83.7	Confident	101 Å²	101	67.1 Å²	67.1	44%	0.439	40%	0.399	S	S	.	.	G	3₁₀ helix	trans	-103.3	-0.8	173.2	-58.1	-165.2	179.1	-171.6	0	113.2	Y275 S276 T292 I296 E300	Y275-K278 HydrophobicContact CD1-CD 4.39Å; Y275-K278 PolarHBondContact O-N 2.88Å; S276-K278 PolarHBondContact O-N 2.82Å; S276-K278 VanDerWaalsContact O-N 3.13Å; K278-T292 VanDerWaalsContact O-CG2 3.28Å; K278-T292 WeakPolarHBondContact O-CG2 3.37Å; K278-I296 HydrophobicContact CB-CD1 3.92Å; K278-I296 HydrophobicContact CD-CD1 4.05Å; K278-I296 HydrophobicContact CD-CG1 4.35Å; K278-E300 IonicContact NZ-OE1 3.45Å; K278-E300 PolarHBondContact NZ-OE1 3.16Å; K278-E300 IonicContact NZ-OE2 3.44Å; K278-E300 PolarHBondContact NZ-OE2 3.07Å
279	G	82	Confident	83.6	Confident	45 Å²	45	64.2 Å²	64.2	46%	0.464	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	90	19.4	-178.4	0	0	0	0	0	115.1	Y275 S276	Y275-G279 PolarHBondContact O-N 3.22Å; S276-G279 PolarHBondContact O-N 3.3Å
280	L	84.7	Confident	83.6	Confident	1 Å²	1	63.9 Å²	63.9	1%	0.005	39%	0.385	C	S	.	.			trans	-105.7	106.5	165.5	-57.7	-174.3	0	0	0	109.9	F266 V270 Y275 S276 W285 S289 T292 M293 I296	F266-L280 HydrophobicContact CZ-CD1 3.85Å; V270-L280 HydrophobicContact CG1-CB 4.1Å; V270-L280 HydrophobicContact CG2-CD1 4.21Å; Y275-L280 CarbonylContact C-O 3.53Å; Y275-L280 VanDerWaalsContact C-O 3.32Å; Y275-L280 HydrophobicContact CG-CD1 4.49Å; Y275-L280 PolarHBondContact O-N 3.21Å; S276-L280 WeakPolarHBondContact CA-O 3.37Å; S276-L280 PolarHBondContact N-O 3.42Å; L280-W285 HydrophobicContact CD2-CH2 4.27Å; L280-W285 HydrophobicContact CD2-CZ3 3.95Å; L280-S289 VanDerWaalsContact CD2-O 3.24Å; L280-S289 WeakPolarHBondContact CD2-O 3.43Å; L280-T292 HydrophobicContact CD2-CG2 3.79Å; L280-T292 HydrophobicContact CG-CG2 4Å; L280-M293 HydrophobicContact CD1-CB 4.17Å; L280-M293 HydrophobicContact CD2-CB 4.06Å; L280-I296 HydrophobicContact CD1-CD1 3.68Å; L280-I296 HydrophobicContact CG-CD1 4.02Å
281	S	77.2	Confident	83.7	Confident	42 Å²	42	66.4 Å²	66.4	29%	0.294	40%	0.403	S	S	.	.			trans	-108.6	171.5	174	52.7	0	0	0	0	111.7	E283	S281-E283 WeakPolarHBondContact CB-OE2 3.42Å; S281-E283 PolarHBondContact O-N 3.05Å; S281-E283 WeakPolarHBondContact OG-CB 3.08Å; S281-E283 PolarHBondContact OG-OE2 3.41Å
282	N	75.5	Confident	84	Confident	44 Å²	44	66.9 Å²	66.9	24%	0.235	40%	0.402	C	S	.	.	S	Bend	trans	-89.7	51.7	175.6	-160.3	-5.2	0	0	0	110.8	K432 H433	N282-K432 VanDerWaalsContact OD1-CA 3.26Å; N282-K432 WeakPolarHBondContact OD1-CA 3.47Å; N282-H433 PolarHBondContact ND2-O 2.9Å; N282-H433 PolarHBondContact OD1-CD2 3.38Å; N282-H433 PolarHBondContact OD1-CE1 3.17Å; N282-H433 VanDerWaalsContact OD1-CE1 3.29Å; N282-H433 PolarHBondContact OD1-N 2.82Å; N282-H433 PolarHBondContact OD1-ND1 3.15Å; N282-H433 PolarHBondContact OD1-NE2 3.18Å
283	E	71	Confident	84.3	Confident	121 Å²	121	62.3 Å²	62.3	57%	0.565	37%	0.37	S	S	*	.	S	Bend	trans	-134.3	166.4	-169.1	-68.3	178.9	142.9	0	0	109.2	S281 W285	S281-E283 WeakPolarHBondContact CB-OE2 3.42Å; S281-E283 PolarHBondContact O-N 3.05Å; S281-E283 WeakPolarHBondContact OG-CB 3.08Å; S281-E283 PolarHBondContact OG-OE2 3.41Å; E283-W285 PolarHBondContact O-N 2.88Å
284	P	72.2	Confident	84.8	Confident	85 Å²	85	63.2 Å²	63.2	55%	0.552	37%	0.366	S	S	*	.			trans	-49.5	118.4	176.3	15.8	-31.1	0	0	0	112.5	L431	P284-L431 HydrophobicContact CB-CD1 4.07Å; P284-L431 HydrophobicContact CG-CD1 4.47Å
285	W	80.4	Confident	85.1	Confident	18 Å²	18	61.6 Å²	61.6	7%	0.068	35%	0.353	C	S	.	.			trans	-66.3	146.8	179.2	-64.4	66.7	0	0	0	110.6	V270 L280 E283 S289 L290 M293 V418 Q422 H433 L439	V270-W285 HydrophobicContact CG1-CH2 4.45Å; V270-W285 HydrophobicContact CG1-CZ2 4.2Å; L280-W285 HydrophobicContact CD2-CH2 4.27Å; L280-W285 HydrophobicContact CD2-CZ3 3.95Å; E283-W285 PolarHBondContact O-N 2.88Å; W285-S289 WeakPolarHBondContact CA-OG 3.09Å; W285-L290 HydrophobicContact CE3-CD2 4.01Å; W285-M293 HydrophobicContact CE3-SD 4.38Å; W285-M293 HydrophobicContact CH2-CB 4.38Å; W285-M293 HydrophobicContact CH2-CG 4.34Å; W285-M293 HydrophobicContact CH2-SD 3.79Å; W285-M293 HydrophobicContact CZ3-CB 3.73Å; W285-M293 HydrophobicContact CZ3-CG 4.02Å; W285-M293 HydrophobicContact CZ3-SD 3.46Å; W285-M293 WeakPolarHBondContact CZ3-SD 3.31Å; W285-V418 HydrophobicContact CB-CG1 4.14Å; W285-V418 HydrophobicContact CD2-CG1 3.91Å; W285-V418 HydrophobicContact CE3-CG1 4.27Å; W285-V418 HydrophobicContact CG-CG1 3.82Å; W285-Q422 PolarHBondContact O-NE2 2.89Å; W285-Q422 PolarHBondContact O-OE1 2.94Å; W285-H433 AromaticContact NE1-ND1 4Å; W285-L439 HydrophobicContact CH2-CD1 4.22Å; W285-L439 HydrophobicContact CH2-CD2 3.56Å; W285-L439 HydrophobicContact CZ2-CD1 3.43Å; W285-L439 VanDerWaalsContact CZ2-CD1 3.43Å; W285-L439 HydrophobicContact CZ2-CD2 3.45Å; W285-L439 VanDerWaalsContact CZ2-CD2 3.45Å; W285-L439 HydrophobicContact CZ2-CG 4.08Å
286	T	83.9	Confident	85.4	Confident	78 Å²	78	60.1 Å²	60.1	48%	0.479	35%	0.348	S	S	.	.			trans	-122.1	164.5	179	59.6	0	0	0	0	109.1	R288 S289 L290	T286-R288 PolarHBondContact O-N 3.05Å; T286-R288 PolarHBondContact OG1-N 2.9Å; T286-S289 PolarHBondContact N-OG 3.14Å; T286-S289 PolarHBondContact O-N 2.97Å; T286-S289 PolarHBondContact O-OG 3.05Å; T286-S289 PolarHBondContact OG1-N 2.86Å; T286-S289 VanDerWaalsContact OG1-N 3.16Å; T286-L290 WeakPolarHBondContact O-CG 3.43Å; T286-L290 PolarHBondContact O-N 2.79Å
287	H	84.8	Confident	85.9	Confident	156 Å²	156	57 Å²	57	72%	0.722	33%	0.326	S	S	*	.	H	α-helix	trans	-51.5	-32	171.2	-171.2	-77.5	0	0	0	112.3	S291	H287-S291 WeakPolarHBondContact O-CB 3.08Å; H287-S291 PolarHBondContact O-N 3.33Å; H287-S291 PolarHBondContact O-OG 3.29Å
288	R	87	Confident	86.5	Confident	204 Å²	204	54.8 Å²	54.8	77%	0.77	29%	0.293	S	S	*	.	H	α-helix	trans	-69.3	-49.9	174.4	-170.6	175.6	-177.3	166.8	1.3	112.4	T286 L290 S291 T292	T286-R288 PolarHBondContact O-N 3.05Å; T286-R288 PolarHBondContact OG1-N 2.9Å; R288-L290 VanDerWaalsContact C-N 3.35Å; R288-L290 PolarHBondContact O-N 3.13Å; R288-S291 WeakPolarHBondContact O-CB 3.37Å; R288-S291 PolarHBondContact O-N 2.87Å; R288-T292 WeakPolarHBondContact O-CB 3.35Å; R288-T292 PolarHBondContact O-N 2.8Å; R288-T292 PolarHBondContact O-OG1 3.27Å; R288-T292 VanDerWaalsContact O-OG1 3.14Å
289	S	87.5	Confident	86.9	Confident	13 Å²	13	55.7 Å²	55.7	9%	0.091	30%	0.303	C	S	.	.	H	α-helix	trans	-68.5	-33.3	179.5	69.5	0	0	0	0	112.5	L280 W285 T286 T292 M293	L280-S289 VanDerWaalsContact CD2-O 3.24Å; L280-S289 WeakPolarHBondContact CD2-O 3.43Å; W285-S289 WeakPolarHBondContact CA-OG 3.09Å; T286-S289 PolarHBondContact N-OG 3.14Å; T286-S289 PolarHBondContact O-N 2.97Å; T286-S289 PolarHBondContact O-OG 3.05Å; T286-S289 PolarHBondContact OG1-N 2.86Å; T286-S289 VanDerWaalsContact OG1-N 3.16Å; S289-T292 PolarHBondContact O-N 3.42Å; S289-M293 WeakPolarHBondContact O-CB 3.29Å; S289-M293 PolarHBondContact O-N 3.5Å
290	L	89.9	Confident	87.5	Confident	18 Å²	18	55.9 Å²	55.9	9%	0.094	29%	0.292	C	S	.	.	H	α-helix	trans	-59.1	-48.9	168.5	-70.2	173.1	0	0	0	111	W285 T286 R288 T292 M293 K294 A415 V418	W285-L290 HydrophobicContact CE3-CD2 4.01Å; T286-L290 WeakPolarHBondContact O-CG 3.43Å; T286-L290 PolarHBondContact O-N 2.79Å; R288-L290 VanDerWaalsContact C-N 3.35Å; R288-L290 PolarHBondContact O-N 3.13Å; L290-T292 PolarHBondContact O-N 3.05Å; L290-M293 HydrophobicContact CD2-CE 4.17Å; L290-M293 PolarHBondContact O-N 3.2Å; L290-K294 WeakPolarHBondContact O-CG 3.39Å; L290-K294 PolarHBondContact O-N 3.45Å; L290-A415 HydrophobicContact CD2-CB 4.39Å; L290-V418 HydrophobicContact CD2-CB 3.89Å; L290-V418 HydrophobicContact CD2-CG1 3.76Å
291	S	92.1	Very high	87.9	Confident	54 Å²	54	56.6 Å²	56.6	38%	0.378	30%	0.296	S	S	.	.	H	α-helix	trans	-60.6	-42.7	176.6	-57.2	0	0	0	0	112.2	H287 R288 M293 K294 A295	H287-S291 WeakPolarHBondContact O-CB 3.08Å; H287-S291 PolarHBondContact O-N 3.33Å; H287-S291 PolarHBondContact O-OG 3.29Å; R288-S291 WeakPolarHBondContact O-CB 3.37Å; R288-S291 PolarHBondContact O-N 2.87Å; S291-M293 PolarHBondContact O-N 3.02Å; S291-K294 PolarHBondContact O-N 3.05Å; S291-A295 PolarHBondContact O-N 2.88Å; S291-A295 VanDerWaalsContact O-N 3.08Å
292	T	92.4	Very high	88.8	Confident	37 Å²	37	54.7 Å²	54.7	23%	0.227	28%	0.283	C	S	.	.	H	α-helix	trans	-61.3	-40.6	174.3	-67.5	0	0	0	0	112.2	K278 L280 R288 S289 L290 A295 I296	K278-T292 VanDerWaalsContact O-CG2 3.28Å; K278-T292 WeakPolarHBondContact O-CG2 3.37Å; L280-T292 HydrophobicContact CD2-CG2 3.79Å; L280-T292 HydrophobicContact CG-CG2 4Å; R288-T292 WeakPolarHBondContact O-CB 3.35Å; R288-T292 PolarHBondContact O-N 2.8Å; R288-T292 PolarHBondContact O-OG1 3.27Å; R288-T292 VanDerWaalsContact O-OG1 3.14Å; S289-T292 PolarHBondContact O-N 3.42Å; L290-T292 PolarHBondContact O-N 3.05Å; T292-A295 PolarHBondContact O-N 3.21Å; T292-I296 HydrophobicContact CG2-CD1 3.74Å; T292-I296 WeakPolarHBondContact O-CG1 3.26Å; T292-I296 PolarHBondContact O-N 3.27Å
293	M	93.5	Very high	89.7	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-66.4	-42.5	175.8	172.5	-165.1	78.2	0	0	112	F266 L280 W285 S289 L290 S291 A295 I296 L297 A415 L439 F440	F266-M293 HydrophobicContact CE1-CG 4.11Å; F266-M293 HydrophobicContact CZ-CG 4.16Å; L280-M293 HydrophobicContact CD1-CB 4.17Å; L280-M293 HydrophobicContact CD2-CB 4.06Å; W285-M293 HydrophobicContact CE3-SD 4.38Å; W285-M293 HydrophobicContact CH2-CB 4.38Å; W285-M293 HydrophobicContact CH2-CG 4.34Å; W285-M293 HydrophobicContact CH2-SD 3.79Å; W285-M293 HydrophobicContact CZ3-CB 3.73Å; W285-M293 HydrophobicContact CZ3-CG 4.02Å; W285-M293 HydrophobicContact CZ3-SD 3.46Å; W285-M293 WeakPolarHBondContact CZ3-SD 3.31Å; S289-M293 WeakPolarHBondContact O-CB 3.29Å; S289-M293 PolarHBondContact O-N 3.5Å; L290-M293 HydrophobicContact CD2-CE 4.17Å; L290-M293 PolarHBondContact O-N 3.2Å; S291-M293 PolarHBondContact O-N 3.02Å; M293-A295 VanDerWaalsContact C-N 3.31Å; M293-A295 PolarHBondContact O-N 3.22Å; M293-I296 PolarHBondContact O-N 2.88Å; M293-L297 HydrophobicContact CG-CD1 3.93Å; M293-L297 HydrophobicContact CG-CG 4.31Å; M293-L297 WeakPolarHBondContact O-CB 3.46Å; M293-L297 VanDerWaalsContact O-CG 3.31Å; M293-L297 WeakPolarHBondContact O-CG 3.29Å; M293-L297 PolarHBondContact O-N 2.71Å; M293-A415 HydrophobicContact CE-CB 4.07Å; M293-L439 HydrophobicContact SD-CD2 4.47Å; M293-F440 HydrophobicContact CE-CZ 4.42Å; M293-F440 HydrophobicContact SD-CE1 4.03Å; M293-F440 HydrophobicContact SD-CZ 3.61Å
294	K	95.1	Very high	90.8	Very high	47 Å²	47	57.9 Å²	57.9	20%	0.204	29%	0.293	C	S	.	.	H	α-helix	trans	-56.1	-47.5	174.3	-66.3	-178.4	175.9	-172.2	0	111	L290 S291 L297 L298 V411 E412 A415	L290-K294 WeakPolarHBondContact O-CG 3.39Å; L290-K294 PolarHBondContact O-N 3.45Å; S291-K294 PolarHBondContact O-N 3.05Å; K294-L297 PolarHBondContact O-N 2.89Å; K294-L298 WeakPolarHBondContact O-CB 3.19Å; K294-L298 WeakPolarHBondContact O-CG 3.31Å; K294-L298 PolarHBondContact O-N 2.85Å; K294-V411 HydrophobicContact CB-CG1 3.63Å; K294-V411 HydrophobicContact CD-CG1 4.37Å; K294-V411 HydrophobicContact CG-CG1 3.56Å; K294-E412 WeakPolarHBondContact CD-OE1 3.36Å; K294-E412 VanDerWaalsContact CE-OE1 3.31Å; K294-E412 WeakPolarHBondContact CE-OE1 3.31Å; K294-E412 IonicContact NZ-OE1 3.41Å; K294-E412 PolarHBondContact NZ-OE1 2.89Å; K294-E412 IonicContact NZ-OE2 3.56Å; K294-E412 PolarHBondContact NZ-OE2 3.1Å; K294-A415 HydrophobicContact CD-CB 4.42Å; K294-A415 HydrophobicContact CG-CB 4.36Å
295	A	94.3	Very high	91.8	Very high	40 Å²	40	54 Å²	54	33%	0.331	27%	0.267	S	S	.	.	H	α-helix	trans	-60.7	-51.5	176.1	0	0	0	0	0	112	S291 T292 M293 L297 L298 D299	S291-A295 PolarHBondContact O-N 2.88Å; S291-A295 VanDerWaalsContact O-N 3.08Å; T292-A295 PolarHBondContact O-N 3.21Å; M293-A295 VanDerWaalsContact C-N 3.31Å; M293-A295 PolarHBondContact O-N 3.22Å; A295-L297 VanDerWaalsContact C-N 3.31Å; A295-L297 PolarHBondContact O-N 3.39Å; A295-L298 PolarHBondContact O-N 3.39Å; A295-D299 VanDerWaalsContact O-CB 3.24Å; A295-D299 WeakPolarHBondContact O-CB 3.45Å; A295-D299 PolarHBondContact O-N 3.11Å
296	I	95	Very high	92.5	Very high	7 Å²	7	57.8 Å²	57.8	4%	0.036	29%	0.285	C	S	.	.	H	α-helix	trans	-59.8	-40.4	179.7	-69.8	165.2	0	0	0	111.8	F266 Y275 K278 L280 T292 M293 E300 V301	F266-I296 HydrophobicContact CE2-CG2 3.73Å; F266-I296 HydrophobicContact CZ-CG2 4.38Å; Y275-I296 HydrophobicContact CD1-CD1 4.07Å; Y275-I296 HydrophobicContact CD1-CG2 4.05Å; Y275-I296 HydrophobicContact CE1-CG2 3.58Å; K278-I296 HydrophobicContact CB-CD1 3.92Å; K278-I296 HydrophobicContact CD-CD1 4.05Å; K278-I296 HydrophobicContact CD-CG1 4.35Å; L280-I296 HydrophobicContact CD1-CD1 3.68Å; L280-I296 HydrophobicContact CG-CD1 4.02Å; T292-I296 HydrophobicContact CG2-CD1 3.74Å; T292-I296 WeakPolarHBondContact O-CG1 3.26Å; T292-I296 PolarHBondContact O-N 3.27Å; M293-I296 PolarHBondContact O-N 2.88Å; I296-E300 WeakPolarHBondContact O-CB 3.44Å; I296-E300 PolarHBondContact O-N 2.83Å; I296-E300 VanDerWaalsContact O-N 3.09Å; I296-V301 HydrophobicContact CG2-CG2 3.98Å; I296-V301 WeakPolarHBondContact O-CG2 3.3Å; I296-V301 PolarHBondContact O-N 2.97Å
297	L	95.7	Very high	93.1	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	26%	0.262	C	S	.	.	I	π-helix	trans	-63.4	-46.5	177.1	-72.6	174.5	0	0	0	111.9	L263 F266 M293 K294 A295 V301 Y302 V411 L414 F440	L263-L297 HydrophobicContact CD2-CD1 4.27Å; L263-L297 HydrophobicContact CD2-CD2 3.71Å; F266-L297 HydrophobicContact CD1-CD2 3.98Å; F266-L297 HydrophobicContact CD2-CD2 4.2Å; F266-L297 HydrophobicContact CE1-CD2 4.06Å; F266-L297 HydrophobicContact CE1-CG 4.45Å; F266-L297 HydrophobicContact CE2-CD2 4.29Å; F266-L297 HydrophobicContact CG-CD2 4.03Å; F266-L297 HydrophobicContact CZ-CD2 4.21Å; F266-L297 HydrophobicContact CZ-CG 4.44Å; M293-L297 HydrophobicContact CG-CD1 3.93Å; M293-L297 HydrophobicContact CG-CG 4.31Å; M293-L297 WeakPolarHBondContact O-CB 3.46Å; M293-L297 VanDerWaalsContact O-CG 3.31Å; M293-L297 WeakPolarHBondContact O-CG 3.29Å; M293-L297 PolarHBondContact O-N 2.71Å; K294-L297 PolarHBondContact O-N 2.89Å; A295-L297 VanDerWaalsContact C-N 3.31Å; A295-L297 PolarHBondContact O-N 3.39Å; L297-V301 HydrophobicContact CD2-CB 4.33Å; L297-V301 HydrophobicContact CD2-CG1 4.46Å; L297-V301 HydrophobicContact CD2-CG2 4.39Å; L297-Y302 HydrophobicContact CB-CE1 4.43Å; L297-Y302 HydrophobicContact CD2-CE1 4.14Å; L297-Y302 VanDerWaalsContact O-CB 3.32Å; L297-Y302 WeakPolarHBondContact O-CB 3.5Å; L297-Y302 PolarHBondContact O-N 2.92Å; L297-V411 HydrophobicContact CB-CG2 3.99Å; L297-V411 HydrophobicContact CD1-CG2 4.14Å; L297-L414 HydrophobicContact CD1-CD1 4.27Å; L297-F440 HydrophobicContact CD1-CZ 4.43Å
298	L	96.2	Very high	93.6	Very high	40 Å²	40	48.6 Å²	48.6	21%	0.209	24%	0.236	C	C	.	.	I	π-helix	trans	-78	-38.8	-176	-67.4	174	0	0	0	114	K294 A295 Y302 P303 W404 R408 V411	K294-L298 WeakPolarHBondContact O-CB 3.19Å; K294-L298 WeakPolarHBondContact O-CG 3.31Å; K294-L298 PolarHBondContact O-N 2.85Å; A295-L298 PolarHBondContact O-N 3.39Å; L298-Y302 HydrophobicContact CD2-CD2 4.16Å; L298-Y302 HydrophobicContact CD2-CE2 4.35Å; L298-P303 VanDerWaalsContact O-CD 3.25Å; L298-P303 WeakPolarHBondContact O-CD 3.43Å; L298-P303 WeakPolarHBondContact O-CG 3.35Å; L298-W404 HydrophobicContact CD2-CZ3 4.23Å; L298-R408 HydrophobicContact CD1-CG 4.37Å; L298-R408 HydrophobicContact CD2-CG 3.82Å; L298-V411 HydrophobicContact CD1-CG1 4.21Å; L298-V411 HydrophobicContact CD2-CB 4.39Å; L298-V411 HydrophobicContact CD2-CG2 3.91Å; L298-V411 HydrophobicContact CG-CB 4.47Å; L298-V411 HydrophobicContact CG-CG1 4.24Å; L298-V411 HydrophobicContact CG-CG2 4.14Å
299	D	94.3	Very high	94	Very high	119 Å²	119	40.1 Å²	40.1	64%	0.636	21%	0.206	S	C	*	.	I	π-helix	trans	-96.7	-21.6	-169.8	-56.2	-30.5	0	0	0	112.9	A295	A295-D299 VanDerWaalsContact O-CB 3.24Å; A295-D299 WeakPolarHBondContact O-CB 3.45Å; A295-D299 PolarHBondContact O-N 3.11Å
300	E	93.8	Very high	94.4	Very high	50 Å²	50	39.5 Å²	39.5	23%	0.234	20%	0.201	C	C	.	.	I	π-helix	trans	-125.8	-44.3	-175.4	-57.5	-173.4	-166.8	0	0	114.7	K278 I296 R304	K278-E300 IonicContact NZ-OE1 3.45Å; K278-E300 PolarHBondContact NZ-OE1 3.16Å; K278-E300 IonicContact NZ-OE2 3.44Å; K278-E300 PolarHBondContact NZ-OE2 3.07Å; I296-E300 WeakPolarHBondContact O-CB 3.44Å; I296-E300 PolarHBondContact O-N 2.83Å; I296-E300 VanDerWaalsContact O-N 3.09Å; E300-R304 WeakPolarHBondContact O-CD 3.39Å; E300-R304 WeakPolarHBondContact O-CG 3.29Å; E300-R304 PolarHBondContact O-NE 2.94Å; E300-R304 VanDerWaalsContact O-NE 3.11Å
301	V	94.1	Very high	94.7	Very high	16 Å²	16	39.6 Å²	39.6	10%	0.097	20%	0.201	C	C	.	.	I	π-helix	trans	-82.3	-57.9	-172.6	-178.8	0	0	0	0	111.2	V262 F266 I296 L297 R304	V262-V301 HydrophobicContact CG1-CG1 3.51Å; F266-V301 HydrophobicContact CD2-CG2 3.78Å; F266-V301 HydrophobicContact CE2-CG2 4.14Å; I296-V301 HydrophobicContact CG2-CG2 3.98Å; I296-V301 WeakPolarHBondContact O-CG2 3.3Å; I296-V301 PolarHBondContact O-N 2.97Å; L297-V301 HydrophobicContact CD2-CB 4.33Å; L297-V301 HydrophobicContact CD2-CG1 4.46Å; L297-V301 HydrophobicContact CD2-CG2 4.39Å; V301-R304 PolarHBondContact O-N 3.39Å
302	Y	95.8	Very high	94.9	Very high	2 Å²	2	37.9 Å²	37.9	1%	0.008	19%	0.187	C	C	.	.	H	α-helix	trans	-65.2	-32.8	-178.3	-64.6	-5.4	0	0	0	114.6	L259 V262 L263 L297 L298 R304 T305 K306 W404 L407 V411	L259-Y302 HydrophobicContact CD1-CD1 4.25Å; L259-Y302 HydrophobicContact CD1-CE1 3.56Å; L259-Y302 HydrophobicContact CD1-CE2 4.43Å; V262-Y302 HydrophobicContact CG1-CD1 4.47Å; L263-Y302 HydrophobicContact CD2-CE1 4.18Å; L297-Y302 HydrophobicContact CB-CE1 4.43Å; L297-Y302 HydrophobicContact CD2-CE1 4.14Å; L297-Y302 VanDerWaalsContact O-CB 3.32Å; L297-Y302 WeakPolarHBondContact O-CB 3.5Å; L297-Y302 PolarHBondContact O-N 2.92Å; L298-Y302 HydrophobicContact CD2-CD2 4.16Å; L298-Y302 HydrophobicContact CD2-CE2 4.35Å; Y302-R304 VanDerWaalsContact C-N 3.29Å; Y302-R304 PolarHBondContact O-N 2.89Å; Y302-T305 PolarHBondContact O-N 3.39Å; Y302-T305 PolarHBondContact O-OG1 3.41Å; Y302-K306 PolarHBondContact O-N 3.03Å; Y302-W404 HydrophobicContact CD2-CZ3 4.2Å; Y302-L407 HydrophobicContact CD2-CB 3.9Å; Y302-L407 HydrophobicContact CD2-CD1 4.12Å; Y302-L407 HydrophobicContact CD2-CD2 4.2Å; Y302-L407 HydrophobicContact CD2-CG 4.3Å; Y302-L407 HydrophobicContact CE2-CB 3.92Å; Y302-L407 HydrophobicContact CE2-CD2 4.08Å; Y302-L407 HydrophobicContact CE2-CG 4.46Å; Y302-V411 HydrophobicContact CD2-CG2 4.47Å; Y302-V411 HydrophobicContact CE2-CG2 3.46Å; Y302-V411 VanDerWaalsContact CE2-CG2 3.46Å
303	P	95.5	Very high	95.1	Very high	52 Å²	52	36.1 Å²	36.1	34%	0.338	18%	0.176	S	C	.	.	H	α-helix	trans	-63.2	-34.1	174.8	-26.1	37.1	0	0	0	113.1	L298 W404	L298-P303 VanDerWaalsContact O-CD 3.25Å; L298-P303 WeakPolarHBondContact O-CD 3.43Å; L298-P303 WeakPolarHBondContact O-CG 3.35Å; P303-W404 HydrophobicContact CG-CH2 3.84Å; P303-W404 HydrophobicContact CG-CZ2 4.29Å
304	R	93.6	Very high	95.3	Very high	179 Å²	179	38.8 Å²	38.8	68%	0.675	19%	0.19	S	C	*	.	H	α-helix	trans	-69.2	-33	-179.9	-69.8	172.7	-166.2	-165.2	5.6	113	E300 V301 Y302	E300-R304 WeakPolarHBondContact O-CD 3.39Å; E300-R304 WeakPolarHBondContact O-CG 3.29Å; E300-R304 PolarHBondContact O-NE 2.94Å; E300-R304 VanDerWaalsContact O-NE 3.11Å; V301-R304 PolarHBondContact O-N 3.39Å; Y302-R304 VanDerWaalsContact C-N 3.29Å; Y302-R304 PolarHBondContact O-N 2.89Å
305	T	93.6	Very high	95.2	Very high	3 Å²	3	37 Å²	37	2%	0.018	18%	0.183	C	C	.	.	H	α-helix	trans	-82.7	-18.8	-175.9	62.7	0	0	0	0	112.5	V262 Y302 I307 R353 W453	V262-T305 HydrophobicContact CB-CG2 4.32Å; V262-T305 HydrophobicContact CG1-CG2 3.86Å; V262-T305 HydrophobicContact CG2-CG2 3.44Å; V262-T305 VanDerWaalsContact CG2-CG2 3.44Å; Y302-T305 PolarHBondContact O-N 3.39Å; Y302-T305 PolarHBondContact O-OG1 3.41Å; T305-I307 PolarHBondContact O-N 3.34Å; T305-I307 WeakPolarHBondContact OG1-CD1 3.41Å; T305-I307 WeakPolarHBondContact OG1-CG1 3.24Å; T305-R353 PolarHBondContact O-NH1 2.95Å; T305-R353 PolarHBondContact O-NH2 2.86Å; T305-W453 HydrophobicContact CG2-CD2 4.25Å; T305-W453 HydrophobicContact CG2-CE3 4.35Å; T305-W453 HydrophobicContact CG2-CH2 3.98Å; T305-W453 HydrophobicContact CG2-CZ2 3.85Å; T305-W453 HydrophobicContact CG2-CZ3 4.22Å
306	K	94.9	Very high	95.3	Very high	99 Å²	99	42.6 Å²	42.6	43%	0.43	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.7	41.1	179.1	-49	-173.7	-170.2	180	0	114.3	Y302 H308 E309 R353	Y302-K306 PolarHBondContact O-N 3.03Å; K306-H308 PolarHBondContact O-N 3.39Å; K306-E309 HydrophobicContact CB-CG 4.03Å; K306-E309 VanDerWaalsContact CD-CD 3.41Å; K306-E309 HydrophobicContact CD-CG 4.37Å; K306-E309 WeakPolarHBondContact CD-OE1 3.37Å; K306-E309 IonicContact NZ-OE1 3.12Å; K306-E309 PolarHBondContact NZ-OE1 3.44Å; K306-E309 WeakPolarHBondContact O-CB 3.43Å; K306-E309 PolarHBondContact O-N 2.86Å; K306-R353 PolarHBondContact O-NH1 3.07Å
307	I	95.3	Very high	95.2	Very high	1 Å²	1	46 Å²	46	1%	0.005	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-52.5	-24.7	-177.1	-69.6	161.7	0	0	0	113.3	L258 L259 T305 E309 L310 F311 L407 F494	L258-I307 HydrophobicContact CD2-CG1 4.06Å; L258-I307 HydrophobicContact CG-CG1 4.45Å; L259-I307 HydrophobicContact CB-CD1 4.37Å; L259-I307 HydrophobicContact CD1-CD1 4.09Å; T305-I307 PolarHBondContact O-N 3.34Å; T305-I307 WeakPolarHBondContact OG1-CD1 3.41Å; T305-I307 WeakPolarHBondContact OG1-CG1 3.24Å; I307-E309 VanDerWaalsContact C-N 3.25Å; I307-E309 PolarHBondContact O-N 2.88Å; I307-L310 HydrophobicContact CG2-CD1 4.33Å; I307-L310 WeakPolarHBondContact O-CB 3.15Å; I307-L310 WeakPolarHBondContact O-CG 3.45Å; I307-L310 PolarHBondContact O-N 3.13Å; I307-F311 HydrophobicContact CG2-CE2 4.31Å; I307-L407 HydrophobicContact CD1-CD2 4.42Å; I307-F494 HydrophobicContact CG2-CE2 3.81Å; I307-F494 HydrophobicContact CG2-CZ 3.79Å
308	H	95.7	Very high	95.2	Very high	39 Å²	39	46.9 Å²	46.9	18%	0.181	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-60.8	-27.8	173.7	57.9	-91.4	0	0	0	114.3	K306 L310 F311 Q312 A400 C403 W404	K306-H308 PolarHBondContact O-N 3.39Å; H308-L310 PolarHBondContact O-N 3.17Å; H308-F311 PolarHBondContact O-N 3.06Å; H308-Q312 PolarHBondContact CD2-OE1 3.26Å; H308-Q312 WeakPolarHBondContact O-CG 3.37Å; H308-A400 HydrophobicContact CB-CB 3.94Å; H308-C403 HydrophobicContact CB-CB 4.09Å; H308-W404 AromaticContact ND1-NE1 3.84Å
309	E	96.2	Very high	95.1	Very high	27 Å²	27	45.9 Å²	45.9	13%	0.126	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-60.9	-25.4	177.3	-69.5	176.2	160.6	0	0	112.3	K306 I307 F311 Q312 R353 L354	K306-E309 HydrophobicContact CB-CG 4.03Å; K306-E309 VanDerWaalsContact CD-CD 3.41Å; K306-E309 HydrophobicContact CD-CG 4.37Å; K306-E309 WeakPolarHBondContact CD-OE1 3.37Å; K306-E309 IonicContact NZ-OE1 3.12Å; K306-E309 PolarHBondContact NZ-OE1 3.44Å; K306-E309 WeakPolarHBondContact O-CB 3.43Å; K306-E309 PolarHBondContact O-N 2.86Å; I307-E309 VanDerWaalsContact C-N 3.25Å; I307-E309 PolarHBondContact O-N 2.88Å; E309-F311 PolarHBondContact O-N 2.76Å; E309-Q312 PolarHBondContact O-N 2.86Å; E309-R353 HydrophobicContact CB-CB 4.14Å; E309-R353 HydrophobicContact CB-CG 4.12Å; E309-R353 IonicContact OE2-CZ 3.25Å; E309-R353 IonicContact OE2-NH1 3.23Å; E309-R353 PolarHBondContact OE2-NH1 2.73Å; E309-L354 HydrophobicContact CB-CD2 4.18Å; E309-L354 HydrophobicContact CB-CG 4.31Å; E309-L354 HydrophobicContact CG-CD2 4.12Å; E309-L354 HydrophobicContact CG-CG 4.38Å; E309-L354 PolarHBondContact O-N 3.11Å
310	L	95.1	Very high	95	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-67.8	-14.9	176.3	-51.3	177.8	0	0	0	113.5	P255 L258 I307 H308 Q347 Y351 R353	P255-L310 HydrophobicContact CB-CD1 4.02Å; P255-L310 HydrophobicContact CG-CD1 4.03Å; L258-L310 HydrophobicContact CD2-CD1 3.96Å; I307-L310 HydrophobicContact CG2-CD1 4.33Å; I307-L310 WeakPolarHBondContact O-CB 3.15Å; I307-L310 WeakPolarHBondContact O-CG 3.45Å; I307-L310 PolarHBondContact O-N 3.13Å; H308-L310 PolarHBondContact O-N 3.17Å; L310-Q347 PolarHBondContact O-NE2 3.43Å; L310-Y351 VanDerWaalsContact CD2-O 3.28Å; L310-Y351 WeakPolarHBondContact CD2-O 3.42Å; L310-R353 HydrophobicContact CD2-CG 3.68Å
311	F	95.7	Very high	95	Very high	20 Å²	20	46.5 Å²	46.5	9%	0.088	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-114.7	8.5	-178	-55.3	-89.1	0	0	0	112.6	P255 I307 H308 E309 Q347 Y351 A399 C403 F494	P255-F311 HydrophobicContact CB-CE2 4Å; P255-F311 HydrophobicContact CB-CZ 3.6Å; P255-F311 HydrophobicContact CG-CE1 4.16Å; P255-F311 HydrophobicContact CG-CE2 4.15Å; P255-F311 HydrophobicContact CG-CZ 3.57Å; I307-F311 HydrophobicContact CG2-CE2 4.31Å; H308-F311 PolarHBondContact O-N 3.06Å; E309-F311 PolarHBondContact O-N 2.76Å; F311-Q347 VanDerWaalsContact CD1-OE1 3.29Å; F311-Y351 HydrophobicContact CD1-CE1 4.38Å; F311-Y351 HydrophobicContact CE1-CD1 4.45Å; F311-Y351 HydrophobicContact CE1-CE1 4Å; F311-A399 HydrophobicContact CB-CB 4.41Å; F311-A399 WeakPolarHBondContact O-CB 3.2Å; F311-C403 HydrophobicContact CD2-CB 4.16Å; F311-C403 HydrophobicContact CE2-CB 4.4Å; F311-F494 HydrophobicContact CE2-CE1 4.44Å; F311-F494 HydrophobicContact CE2-CZ 4.14Å; F311-F494 HydrophobicContact CZ-CE1 4.24Å; F311-F494 HydrophobicContact CZ-CZ 4.24Å
312	Q	97.6	Very high	95	Very high	18 Å²	18	45.7 Å²	45.7	8%	0.084	22%	0.22	C	C	.	.			trans	-116.1	164.1	-171.6	-79.5	-177.3	-28.2	0	0	112.2	H308 E309 L354 S355 S356 N396 A399	H308-Q312 PolarHBondContact CD2-OE1 3.26Å; H308-Q312 WeakPolarHBondContact O-CG 3.37Å; E309-Q312 PolarHBondContact O-N 2.86Å; Q312-L354 HydrophobicContact CB-CD2 3.81Å; Q312-L354 CarbonylContact O-C 3.46Å; Q312-L354 VanDerWaalsContact O-C 3.31Å; Q312-L354 VanDerWaalsContact O-CA 3.3Å; Q312-L354 WeakPolarHBondContact O-CA 3.32Å; Q312-S355 PolarHBondContact O-N 2.87Å; Q312-S356 VanDerWaalsContact O-CB 3.29Å; Q312-S356 WeakPolarHBondContact O-CB 3.44Å; Q312-S356 PolarHBondContact O-N 3.01Å; Q312-S356 VanDerWaalsContact O-N 3.16Å; Q312-N396 WeakPolarHBondContact CA-OD1 3.49Å; Q312-N396 VanDerWaalsContact CB-OD1 3.29Å; Q312-N396 WeakPolarHBondContact CB-OD1 3.42Å; Q312-N396 HydrophobicContact CG-CB 4.05Å; Q312-N396 WeakPolarHBondContact CG-OD1 3.37Å; Q312-N396 PolarHBondContact NE2-O 2.98Å; Q312-A399 HydrophobicContact CG-CB 4.31Å
313	V	96.1	Very high	94.9	Very high	0 Å²	0	51 Å²	51	0%	0	24%	0.243	C	C	.	.	B	Isolated β-bridge	trans	-101.6	148.3	176.6	-43.8	0	0	0	0	111.1	V315 L318 I345 L354 S356 V358 L392 N396	V313-V315 HydrophobicContact CG2-CG2 4.49Å; V313-V315 PolarHBondContact O-N 3.02Å; V313-V315 VanDerWaalsContact O-N 3.13Å; V313-L318 HydrophobicContact CB-CD1 3.63Å; V313-L318 HydrophobicContact CG1-CD1 4.2Å; V313-L318 HydrophobicContact CG2-CD1 3.73Å; V313-I345 HydrophobicContact CG1-CB 4.44Å; V313-I345 HydrophobicContact CG1-CD1 4.03Å; V313-I345 HydrophobicContact CG1-CG1 3.85Å; V313-I345 HydrophobicContact CG1-CG2 3.92Å; V313-L354 CarbonylContact C-O 3.56Å; V313-S356 WeakPolarHBondContact CA-O 3.4Å; V313-S356 VanDerWaalsContact CB-O 3.26Å; V313-S356 WeakPolarHBondContact CB-O 3.28Å; V313-S356 VanDerWaalsContact CG1-O 3.27Å; V313-S356 WeakPolarHBondContact CG1-O 3.37Å; V313-V358 HydrophobicContact CG1-CG1 4.33Å; V313-L392 HydrophobicContact CG2-CB 4.39Å; V313-L392 HydrophobicContact CG2-CD1 4.33Å; V313-L392 HydrophobicContact CG2-CD2 4.28Å; V313-N396 PolarHBondContact N-OD1 2.65Å; V313-N396 PolarHBondContact O-ND2 3.48Å
314	N	97	Very high	94.7	Very high	55 Å²	55	53.6 Å²	53.6	29%	0.294	25%	0.251	S	S	.	.			trans	-74.6	101.7	167.1	-173.9	-37	0	0	0	109.1	E316 T317 L318 L354	N314-E316 VanDerWaalsContact C-N 3.32Å; N314-E316 PolarHBondContact O-N 3.32Å; N314-E316 PolarHBondContact OD1-N 3.2Å; N314-E316 VanDerWaalsContact OD1-N 3.09Å; N314-T317 VanDerWaalsContact CG-OG1 3.23Å; N314-T317 PolarHBondContact ND2-OG1 3.45Å; N314-T317 PolarHBondContact O-N 2.98Å; N314-T317 PolarHBondContact OD1-N 3.38Å; N314-T317 PolarHBondContact OD1-OG1 2.91Å; N314-L318 PolarHBondContact O-N 2.9Å; N314-L318 VanDerWaalsContact O-N 3.08Å; N314-L354 HydrophobicContact CB-CB 4.05Å; N314-L354 VanDerWaalsContact CB-O 3.25Å; N314-L354 WeakPolarHBondContact CB-O 3.27Å; N314-L354 PolarHBondContact N-O 3.5Å
315	V	94.8	Very high	94.6	Very high	9 Å²	9	48.4 Å²	48.4	6%	0.055	23%	0.233	C	C	.	.	H	α-helix	trans	-57.9	-44.7	-178.4	-176.9	0	0	0	0	111.1	V313 V319 Q389 L392 W393 N396	V313-V315 HydrophobicContact CG2-CG2 4.49Å; V313-V315 PolarHBondContact O-N 3.02Å; V313-V315 VanDerWaalsContact O-N 3.13Å; V315-V319 HydrophobicContact CG1-CG2 3.98Å; V315-V319 WeakPolarHBondContact O-CB 3.22Å; V315-V319 WeakPolarHBondContact O-CG2 3.43Å; V315-V319 PolarHBondContact O-N 3.28Å; V315-Q389 HydrophobicContact CG1-CG 3.97Å; V315-L392 HydrophobicContact CG1-CB 4.15Å; V315-L392 HydrophobicContact CG1-CD1 4.37Å; V315-L392 HydrophobicContact CG2-CB 4.24Å; V315-W393 HydrophobicContact CG2-CD2 4.36Å; V315-W393 HydrophobicContact CG2-CE3 4.46Å; V315-N396 VanDerWaalsContact CG2-ND2 3.34Å; V315-N396 WeakPolarHBondContact CG2-ND2 3.27Å
316	E	94.7	Very high	94.5	Very high	159 Å²	159	48.3 Å²	48.3	74%	0.743	23%	0.232	S	C	*	.	H	α-helix	trans	-65	-44.6	-176.4	-60.9	-179.1	175.1	0	0	111.8	N314 K320	N314-E316 VanDerWaalsContact C-N 3.32Å; N314-E316 PolarHBondContact O-N 3.32Å; N314-E316 PolarHBondContact OD1-N 3.2Å; N314-E316 VanDerWaalsContact OD1-N 3.09Å; E316-K320 WeakPolarHBondContact O-CB 3.49Å; E316-K320 PolarHBondContact O-N 2.94Å
317	T	93.4	Very high	94.1	Very high	77 Å²	77	46.6 Å²	46.6	47%	0.472	24%	0.236	S	C	.	.	H	α-helix	trans	-64.4	-48.6	178.3	-59.4	0	0	0	0	111.5	N314 K320 T321	N314-T317 VanDerWaalsContact CG-OG1 3.23Å; N314-T317 PolarHBondContact ND2-OG1 3.45Å; N314-T317 PolarHBondContact O-N 2.98Å; N314-T317 PolarHBondContact OD1-N 3.38Å; N314-T317 PolarHBondContact OD1-OG1 2.91Å; T317-K320 WeakPolarHBondContact O-CB 3.31Å; T317-K320 PolarHBondContact O-N 3.37Å; T317-T321 PolarHBondContact O-N 3.14Å; T317-T321 PolarHBondContact O-OG1 2.82Å
318	L	95	Very high	93.7	Very high	20 Å²	20	50.8 Å²	50.8	11%	0.105	27%	0.271	C	S	.	.	H	α-helix	trans	-67.5	-38.9	179.3	-69.6	-179.4	0	0	0	112.3	V313 N314 K320 T321 F322 V358 M360 F388 L392	V313-L318 HydrophobicContact CB-CD1 3.63Å; V313-L318 HydrophobicContact CG1-CD1 4.2Å; V313-L318 HydrophobicContact CG2-CD1 3.73Å; N314-L318 PolarHBondContact O-N 2.9Å; N314-L318 VanDerWaalsContact O-N 3.08Å; L318-K320 VanDerWaalsContact C-N 3.3Å; L318-K320 PolarHBondContact O-N 3.14Å; L318-T321 PolarHBondContact O-N 2.84Å; L318-F322 VanDerWaalsContact O-CB 3.24Å; L318-F322 WeakPolarHBondContact O-CB 3.28Å; L318-F322 PolarHBondContact O-N 2.95Å; L318-V358 HydrophobicContact CD1-CG1 4.49Å; L318-V358 HydrophobicContact CD1-CG2 4.19Å; L318-M360 HydrophobicContact CD2-CE 4.49Å; L318-M360 HydrophobicContact CD2-SD 4.1Å; L318-F388 HydrophobicContact CB-CE1 4.33Å; L318-F388 HydrophobicContact CB-CZ 4.47Å; L318-L392 HydrophobicContact CB-CD1 3.63Å; L318-L392 HydrophobicContact CD1-CD1 4.02Å; L318-L392 HydrophobicContact CD1-CD2 4.45Å; L318-L392 HydrophobicContact CG-CD1 4.5Å
319	V	94.3	Very high	93.2	Very high	19 Å²	19	52.3 Å²	52.3	12%	0.115	28%	0.278	C	S	.	.	H	α-helix	trans	-61.7	-39.5	174.4	165.6	0	0	0	0	111	V315 K323 V385 F388 Q389 L392	V315-V319 HydrophobicContact CG1-CG2 3.98Å; V315-V319 WeakPolarHBondContact O-CB 3.22Å; V315-V319 WeakPolarHBondContact O-CG2 3.43Å; V315-V319 PolarHBondContact O-N 3.28Å; V319-K323 WeakPolarHBondContact O-CB 3.39Å; V319-K323 PolarHBondContact O-N 2.74Å; V319-V385 HydrophobicContact CG1-CG1 3.77Å; V319-F388 HydrophobicContact CG2-CD1 4.22Å; V319-F388 HydrophobicContact CG2-CE1 4.48Å; V319-Q389 HydrophobicContact CG2-CB 3.7Å; V319-Q389 HydrophobicContact CG2-CG 3.92Å; V319-L392 HydrophobicContact CG2-CD1 4.24Å
320	K	93.8	Very high	92.4	Very high	129 Å²	129	53 Å²	53	56%	0.561	29%	0.292	S	S	*	.	H	α-helix	trans	-62.3	-52.1	173.6	-178.8	-177.5	169.1	-174.5	0	111.4	E316 T317 L318 F322 K323 E324	E316-K320 WeakPolarHBondContact O-CB 3.49Å; E316-K320 PolarHBondContact O-N 2.94Å; T317-K320 WeakPolarHBondContact O-CB 3.31Å; T317-K320 PolarHBondContact O-N 3.37Å; L318-K320 VanDerWaalsContact C-N 3.3Å; L318-K320 PolarHBondContact O-N 3.14Å; K320-F322 VanDerWaalsContact C-N 3.29Å; K320-F322 PolarHBondContact O-N 3.48Å; K320-K323 WeakPolarHBondContact O-CB 3.49Å; K320-K323 PolarHBondContact O-N 2.89Å; K320-E324 WeakPolarHBondContact CE-OE1 3.32Å; K320-E324 IonicContact NZ-OE1 3.93Å; K320-E324 WeakPolarHBondContact O-CG 3.45Å; K320-E324 PolarHBondContact O-N 3.46Å
321	T	93	Very high	91.8	Very high	52 Å²	52	58.4 Å²	58.4	32%	0.319	32%	0.318	S	S	.	.	H	α-helix	trans	-61.8	-36.2	178.8	-55.8	0	0	0	0	112.3	T317 L318 E324 K325 M360	T317-T321 PolarHBondContact O-N 3.14Å; T317-T321 PolarHBondContact O-OG1 2.82Å; L318-T321 PolarHBondContact O-N 2.84Å; T321-E324 PolarHBondContact O-N 3.16Å; T321-K325 PolarHBondContact O-N 3.07Å; T321-M360 HydrophobicContact CG2-CE 3.71Å
322	F	94.4	Very high	91.2	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-67.1	-42.4	175.4	-176.7	-105.3	0	0	0	112	L318 K320 E324 K325 I326 M360 A363 L364 F367 V385 F388	L318-F322 VanDerWaalsContact O-CB 3.24Å; L318-F322 WeakPolarHBondContact O-CB 3.28Å; L318-F322 PolarHBondContact O-N 2.95Å; K320-F322 VanDerWaalsContact C-N 3.29Å; K320-F322 PolarHBondContact O-N 3.48Å; F322-E324 VanDerWaalsContact C-N 3.34Å; F322-E324 PolarHBondContact O-N 2.96Å; F322-K325 PolarHBondContact O-N 3.39Å; F322-I326 HydrophobicContact CD1-CD1 4.02Å; F322-I326 HydrophobicContact CE1-CD1 3.29Å; F322-I326 HydrophobicContact CE1-CG1 4.13Å; F322-I326 HydrophobicContact CE2-CD1 4.23Å; F322-I326 HydrophobicContact CE2-CG1 4.41Å; F322-I326 HydrophobicContact CZ-CD1 3.41Å; F322-I326 VanDerWaalsContact CZ-CD1 3.41Å; F322-I326 HydrophobicContact CZ-CG1 4.06Å; F322-I326 WeakPolarHBondContact O-CB 3.33Å; F322-I326 PolarHBondContact O-N 3.42Å; F322-M360 HydrophobicContact CB-CE 3.99Å; F322-A363 HydrophobicContact CD2-CB 4.38Å; F322-A363 HydrophobicContact CE2-CB 4.24Å; F322-L364 HydrophobicContact CD2-CD2 4.33Å; F322-L364 HydrophobicContact CE2-CD2 3.95Å; F322-L364 HydrophobicContact CE2-CG 4.34Å; F322-F367 HydrophobicContact CE1-CB 4.39Å; F322-F367 HydrophobicContact CE2-CB 4.35Å; F322-F367 HydrophobicContact CZ-CB 3.63Å; F322-V385 HydrophobicContact CD1-CG2 4.11Å; F322-V385 HydrophobicContact CE1-CG2 4.36Å; F322-F388 HydrophobicContact CB-CD1 3.56Å; F322-F388 HydrophobicContact CB-CE1 3.42Å; F322-F388 VanDerWaalsContact CB-CE1 3.42Å; F322-F388 HydrophobicContact CB-CG 4.49Å; F322-F388 HydrophobicContact CB-CZ 4.28Å; F322-F388 HydrophobicContact CD1-CB 3.75Å; F322-F388 AromaticContact CD1-CD1 3.42Å; F322-F388 HydrophobicContact CD1-CD1 3.42Å; F322-F388 VanDerWaalsContact CD1-CD1 3.42Å; F322-F388 HydrophobicContact CD1-CE1 4.17Å; F322-F388 AromaticContact CD1-CG 3.71Å; F322-F388 HydrophobicContact CD1-CG 3.71Å; F322-F388 AromaticContact CD2-CD1 4Å; F322-F388 HydrophobicContact CD2-CD1 4Å; F322-F388 HydrophobicContact CD2-CD2 4.41Å; F322-F388 HydrophobicContact CD2-CE1 4.09Å; F322-F388 HydrophobicContact CD2-CG 4.14Å; F322-F388 HydrophobicContact CD2-CZ 4.34Å; F322-F388 HydrophobicContact CE1-CB 3.5Å; F322-F388 HydrophobicContact CE1-CD1 4.06Å; F322-F388 AromaticContact CE1-CG 3.86Å; F322-F388 HydrophobicContact CE1-CG 3.86Å; F322-F388 HydrophobicContact CE2-CD2 4.43Å; F322-F388 HydrophobicContact CE2-CG 4.29Å; F322-F388 HydrophobicContact CG-CB 4.39Å; F322-F388 AromaticContact CG-CD1 3.38Å; F322-F388 HydrophobicContact CG-CD1 3.38Å; F322-F388 AromaticContact CG-CE1 3.65Å; F322-F388 HydrophobicContact CG-CE1 3.65Å; F322-F388 AromaticContact CG-CG 3.86Å; F322-F388 HydrophobicContact CG-CG 3.86Å; F322-F388 HydrophobicContact CG-CZ 4.34Å; F322-F388 HydrophobicContact CZ-CB 3.98Å; F322-F388 HydrophobicContact CZ-CG 4.16Å
323	K	92.5	Very high	90.6	Very high	114 Å²	114	59.1 Å²	59.1	50%	0.496	33%	0.326	S	S	.	.	H	α-helix	trans	-61.4	-41.4	173.8	-176.4	176.3	-178.4	174.1	0	111.9	V319 K320 A327 V385	V319-K323 WeakPolarHBondContact O-CB 3.39Å; V319-K323 PolarHBondContact O-N 2.74Å; K320-K323 WeakPolarHBondContact O-CB 3.49Å; K320-K323 PolarHBondContact O-N 2.89Å; K323-A327 WeakPolarHBondContact O-CB 3.43Å; K323-A327 PolarHBondContact O-N 2.92Å; K323-V385 HydrophobicContact CB-CG2 3.98Å; K323-V385 HydrophobicContact CG-CG2 4.2Å
324	E	92.9	Very high	89.8	Confident	106 Å²	106	63.8 Å²	63.8	50%	0.495	36%	0.356	S	S	.	.	H	α-helix	trans	-64.9	-44.4	175.5	-71.5	166.1	173.6	0	0	111.8	K320 T321 F322 A327 A328	K320-E324 WeakPolarHBondContact CE-OE1 3.32Å; K320-E324 IonicContact NZ-OE1 3.93Å; K320-E324 WeakPolarHBondContact O-CG 3.45Å; K320-E324 PolarHBondContact O-N 3.46Å; T321-E324 PolarHBondContact O-N 3.16Å; F322-E324 VanDerWaalsContact C-N 3.34Å; F322-E324 PolarHBondContact O-N 2.96Å; E324-A327 PolarHBondContact O-N 2.96Å; E324-A328 WeakPolarHBondContact O-CB 3.37Å; E324-A328 PolarHBondContact O-N 3.18Å
325	K	91.6	Very high	88.7	Confident	70 Å²	70	65.8 Å²	65.8	30%	0.304	37%	0.374	S	S	.	.	H	α-helix	trans	-62.7	-46.6	175	-84	-171.3	159.1	-163.2	0	112.8	T321 F322 A327 A328 E329 D361 L364	T321-K325 PolarHBondContact O-N 3.07Å; F322-K325 PolarHBondContact O-N 3.39Å; K325-A327 VanDerWaalsContact C-N 3.33Å; K325-A327 PolarHBondContact O-N 3.37Å; K325-A328 PolarHBondContact O-N 3.04Å; K325-A328 VanDerWaalsContact O-N 3.14Å; K325-E329 PolarHBondContact O-N 3.17Å; K325-D361 IonicContact NZ-OD1 2.77Å; K325-D361 PolarHBondContact NZ-OD1 3.31Å; K325-L364 HydrophobicContact CB-CD1 4.23Å; K325-L364 HydrophobicContact CB-CD2 4.14Å; K325-L364 HydrophobicContact CD-CD1 3.89Å
326	I	90.2	Very high	87.4	Confident	1 Å²	1	67.6 Å²	67.6	1%	0.005	39%	0.387	C	S	.	.	H	α-helix	trans	-59.3	-43.8	176.3	-81.1	-169.5	0	0	0	111.4	F322 A328 E329 G330 L364 N368 Q381 C384	F322-I326 HydrophobicContact CD1-CD1 4.02Å; F322-I326 HydrophobicContact CE1-CD1 3.29Å; F322-I326 HydrophobicContact CE1-CG1 4.13Å; F322-I326 HydrophobicContact CE2-CD1 4.23Å; F322-I326 HydrophobicContact CE2-CG1 4.41Å; F322-I326 HydrophobicContact CZ-CD1 3.41Å; F322-I326 VanDerWaalsContact CZ-CD1 3.41Å; F322-I326 HydrophobicContact CZ-CG1 4.06Å; F322-I326 WeakPolarHBondContact O-CB 3.33Å; F322-I326 PolarHBondContact O-N 3.42Å; I326-A328 PolarHBondContact O-N 3.11Å; I326-E329 PolarHBondContact O-N 3.21Å; I326-G330 PolarHBondContact O-N 2.92Å; I326-L364 HydrophobicContact CG1-CD2 3.77Å; I326-N368 HydrophobicContact CD1-CB 3.96Å; I326-N368 HydrophobicContact CG1-CB 4.07Å; I326-Q381 HydrophobicContact CG2-CB 3.8Å; I326-Q381 HydrophobicContact CG2-CG 3.41Å; I326-Q381 VanDerWaalsContact CG2-CG 3.41Å; I326-C384 HydrophobicContact CD1-CB 3.69Å
327	A	87	Confident	86.3	Confident	62 Å²	62	66.1 Å²	66.1	51%	0.512	39%	0.394	S	S	.	.	H	α-helix	trans	-65.1	-30	178.4	0	0	0	0	0	112.5	K323 E324 K325	K323-A327 WeakPolarHBondContact O-CB 3.43Å; K323-A327 PolarHBondContact O-N 2.92Å; E324-A327 PolarHBondContact O-N 2.96Å; K325-A327 VanDerWaalsContact C-N 3.33Å; K325-A327 PolarHBondContact O-N 3.37Å
328	A	87.4	Confident	84.9	Confident	89 Å²	89	68.8 Å²	68.8	74%	0.736	40%	0.401	S	S	*	.	H	α-helix	trans	-78	-35.9	176	0	0	0	0	0	113.4	E324 K325 I326	E324-A328 WeakPolarHBondContact O-CB 3.37Å; E324-A328 PolarHBondContact O-N 3.18Å; K325-A328 PolarHBondContact O-N 3.04Å; K325-A328 VanDerWaalsContact O-N 3.14Å; I326-A328 PolarHBondContact O-N 3.11Å
329	E	84.4	Confident	83.3	Confident	71 Å²	71	76.8 Å²	76.8	33%	0.332	44%	0.438	S	S	.	.	H	α-helix	trans	-67.2	-45.9	171.6	-70.7	-168.1	160	0	0	110.8	K325 I326 H331 S333 N368	K325-E329 PolarHBondContact O-N 3.17Å; I326-E329 PolarHBondContact O-N 3.21Å; E329-H331 PolarHBondContact O-N 3.23Å; E329-H331 PolarHBondContact O-ND1 3.31Å; E329-S333 PolarHBondContact OE2-OG 2.92Å; E329-N368 PolarHBondContact OE2-ND2 2.83Å
330	G	79.5	Confident	82.1	Confident	41 Å²	41	84.2 Å²	84.2	42%	0.423	47%	0.471	S	S	.	.			trans	65.5	3.2	178.5	0	0	0	0	0	115.2	I326	I326-G330 PolarHBondContact O-N 2.92Å
331	H	82.3	Confident	81.5	Confident	115 Å²	115	80.6 Å²	80.6	53%	0.532	46%	0.459	S	S	.	.	S	Bend	trans	-140.1	161.3	174.5	62.9	-77.7	0	0	0	110.6	E329 N368	E329-H331 PolarHBondContact O-N 3.23Å; E329-H331 PolarHBondContact O-ND1 3.31Å; H331-N368 PolarHBondContact O-ND2 2.98Å
332	P	83.4	Confident	81.1	Confident	39 Å²	39	82.3 Å²	82.3	25%	0.253	47%	0.47	S	S	.	.	P	Polyproline II helix	trans	-72	142.1	176.8	-17.9	33.3	0	0	0	112.3	N368 T370	P332-N368 CarbonylContact C-O 3.54Å; P332-N368 WeakPolarHBondContact CA-O 3.45Å; P332-T370 WeakPolarHBondContact CB-OG1 3.04Å; P332-T370 HydrophobicContact CG-CG2 4.49Å; P332-T370 WeakPolarHBondContact CG-OG1 3.49Å
333	S	84.7	Confident	81	Confident	13 Å²	13	82.8 Å²	82.8	9%	0.091	47%	0.472	C	S	.	.	P	Polyproline II helix	trans	-70.6	152.5	175	-50.1	0	0	0	0	111.3	E329 L364 N368	E329-S333 PolarHBondContact OE2-OG 2.92Å; S333-L364 PolarHBondContact OG-O 3.08Å; S333-N368 PolarHBondContact N-O 3.38Å; S333-N368 WeakPolarHBondContact OG-CB 3.38Å; S333-N368 PolarHBondContact OG-ND2 2.85Å
334	P	80.4	Confident	81	Confident	98 Å²	98	83 Å²	83	64%	0.636	48%	0.475	S	S	*	.	P	Polyproline II helix	trans	-61.3	155.4	176.1	25.8	-34.6	0	0	0	112	L365 Q369	P334-L365 HydrophobicContact CG-CD1 4.32Å; P334-L365 VanDerWaalsContact O-CD1 3.28Å; P334-L365 WeakPolarHBondContact O-CD1 3.29Å; P334-Q369 PolarHBondContact O-NE2 3.38Å
335	S	72.6	Confident	81.1	Confident	97 Å²	97	80 Å²	80	68%	0.678	46%	0.461	S	S	*	.	P	Polyproline II helix	trans	-68.2	136.8	175.8	50.1	0	0	0	0	111.1
336	P	68.8	Low	81.1	Confident	48 Å²	48	80.9 Å²	80.9	31%	0.312	47%	0.469	S	S	.	.	P	Polyproline II helix	trans	-60.9	141.8	-178.7	24.8	-34.3	0	0	0	112.1	E338 L365	P336-E338 VanDerWaalsContact C-N 3.27Å; P336-E338 PolarHBondContact O-N 3.15Å; P336-L365 HydrophobicContact CB-CD2 4.02Å; P336-L365 HydrophobicContact CB-CG 4.24Å
337	S	70.7	Confident	81.3	Confident	127 Å²	127	83.1 Å²	83.1	89%	0.888	48%	0.479	S	S	*	.	S	Bend	trans	-71.3	-20.2	180	51.7	0	0	0	0	113.9
338	E	64.4	Low	81.6	Confident	133 Å²	133	81.6 Å²	81.6	62%	0.621	46%	0.462	S	S	*	.	S	Bend	trans	-118	131.8	-178.8	-66.9	-177.8	-179.3	0	0	110.6	P336 H340 V341	P336-E338 VanDerWaalsContact C-N 3.27Å; P336-E338 PolarHBondContact O-N 3.15Å; E338-H340 PolarHBondContact O-N 3.08Å; E338-V341 HydrophobicContact CB-CG2 3.78Å
339	Q	61.3	Low	81.8	Confident	189 Å²	189	84.2 Å²	84.2	88%	0.883	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	-2.3	-172.9	-68.5	-176.6	-19.3	0	0	114.9
340	H	69.5	Low	82.1	Confident	175 Å²	175	83.9 Å²	83.9	81%	0.81	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-133.6	24.5	-169.8	-71.8	-47.4	0	0	0	115.2	E338 T342	E338-H340 PolarHBondContact O-N 3.08Å; H340-T342 PolarHBondContact O-N 3.4Å
341	V	80.5	Confident	82.8	Confident	53 Å²	53	82.8 Å²	82.8	32%	0.321	44%	0.443	S	S	.	.			trans	-78.4	117.4	174.7	-161.8	0	0	0	0	110.5	E338 L362	E338-V341 HydrophobicContact CB-CG2 3.78Å; V341-L362 HydrophobicContact CB-CD1 4.33Å; V341-L362 HydrophobicContact CG1-CD1 3.54Å; V341-L362 HydrophobicContact CG1-CD2 3.95Å; V341-L362 HydrophobicContact CG1-CG 4.39Å
342	T	84.7	Confident	83.3	Confident	87 Å²	87	80 Å²	80	53%	0.534	43%	0.432	S	S	.	.			trans	-108.3	137.3	177.5	48.5	0	0	0	0	111.9	H340 H344	H340-T342 PolarHBondContact O-N 3.4Å; T342-H344 PolarHBondContact OG1-CE1 3.36Å; T342-H344 PolarHBondContact OG1-NE2 3.39Å; T342-H344 VanDerWaalsContact OG1-NE2 3.09Å
343	L	91.7	Very high	83.9	Confident	10 Å²	10	81.2 Å²	81.2	5%	0.052	43%	0.431	C	S	.	.			trans	-69.1	138.8	173	-166.4	68.4	0	0	0	110.7	V358 D359 L362 A363 L366 F367 F388 L392 L395	L343-V358 HydrophobicContact CD1-CB 4.04Å; L343-V358 HydrophobicContact CD1-CG2 4.48Å; L343-V358 HydrophobicContact CD2-CB 4.04Å; L343-V358 HydrophobicContact CD2-CG1 4.18Å; L343-V358 HydrophobicContact CD2-CG2 4.11Å; L343-V358 HydrophobicContact CG-CB 4.12Å; L343-V358 HydrophobicContact CG-CG1 4.36Å; L343-D359 WeakPolarHBondContact CD1-O 2.81Å; L343-L362 HydrophobicContact CD1-CB 4.4Å; L343-L362 HydrophobicContact CD1-CD2 4.05Å; L343-L362 HydrophobicContact CD1-CG 4.15Å; L343-A363 HydrophobicContact CD1-CB 4.37Å; L343-A363 HydrophobicContact CD2-CB 4.3Å; L343-L366 HydrophobicContact CB-CD1 4.15Å; L343-F367 HydrophobicContact CD2-CE2 4.03Å; L343-F388 HydrophobicContact CD2-CE2 3.95Å; L343-L392 HydrophobicContact CD2-CD2 4.48Å; L343-L395 HydrophobicContact CB-CD1 4.43Å; L343-L395 HydrophobicContact CD2-CD1 4.18Å; L343-L395 HydrophobicContact CG-CD1 4.23Å
344	H	93.1	Very high	84.4	Confident	119 Å²	119	83.3 Å²	83.3	55%	0.551	44%	0.441	S	S	*	.			trans	-132.4	155.6	177.8	-63.4	-45.6	0	0	0	111.2	T342 I346	T342-H344 PolarHBondContact OG1-CE1 3.36Å; T342-H344 PolarHBondContact OG1-NE2 3.39Å; T342-H344 VanDerWaalsContact OG1-NE2 3.09Å; H344-I346 PolarHBondContact O-N 3.05Å
345	I	94.4	Very high	85.1	Confident	42 Å²	42	81.2 Å²	81.2	22%	0.215	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	124.2	173.1	-65.4	177.3	0	0	0	109.3	V313 T357 L395 A399	V313-I345 HydrophobicContact CG1-CB 4.44Å; V313-I345 HydrophobicContact CG1-CD1 4.03Å; V313-I345 HydrophobicContact CG1-CG1 3.85Å; V313-I345 HydrophobicContact CG1-CG2 3.92Å; I345-T357 WeakPolarHBondContact CA-O 3.48Å; I345-L395 HydrophobicContact CD1-CB 3.9Å; I345-L395 HydrophobicContact CG1-CB 3.96Å; I345-L395 HydrophobicContact CG1-CD1 4.45Å; I345-A399 HydrophobicContact CD1-CB 3.96Å
346	I	93.2	Very high	86.2	Confident	89 Å²	89	76.8 Å²	76.8	46%	0.456	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	106.2	165.8	-56.6	175.2	0	0	0	106.4	H344 D348 S356 T357 D359	H344-I346 PolarHBondContact O-N 3.05Å; I346-D348 PolarHBondContact O-N 3.08Å; I346-S356 WeakPolarHBondContact O-CA 3.21Å; I346-S356 WeakPolarHBondContact O-CB 3.41Å; I346-T357 PolarHBondContact N-O 3.25Å; I346-T357 PolarHBondContact O-N 3.48Å; I346-D359 HydrophobicContact CD1-CB 4.34Å
347	Q	93.2	Very high	87.4	Confident	49 Å²	49	77.6 Å²	77.6	23%	0.229	40%	0.402	C	S	.	.			trans	-57.7	131.4	-179.6	175.7	60.1	63	0	0	111.1	L310 F311 M349 Y351 S356	L310-Q347 PolarHBondContact O-NE2 3.43Å; F311-Q347 VanDerWaalsContact CD1-OE1 3.29Å; Q347-M349 PolarHBondContact O-N 3.48Å; Q347-Y351 VanDerWaalsContact CD-CE1 3.5Å; Q347-Y351 HydrophobicContact CG-CD1 4.45Å; Q347-Y351 HydrophobicContact CG-CE1 3.79Å; Q347-Y351 HydrophobicContact CG-CE2 4.24Å; Q347-Y351 VanDerWaalsContact NE2-CD1 3.34Å; Q347-S356 PolarHBondContact NE2-OG 3.03Å
348	D	93.3	Very high	88.5	Confident	29 Å²	29	71.8 Å²	71.8	16%	0.155	36%	0.362	C	S	.	.			trans	-59.7	127.2	169.8	176.9	20.7	0	0	0	110.3	I346 E350 Y351 N352 S356	I346-D348 PolarHBondContact O-N 3.08Å; D348-E350 PolarHBondContact O-N 3.04Å; D348-E350 PolarHBondContact OD1-N 3.32Å; D348-Y351 WeakPolarHBondContact O-CD2 3.17Å; D348-Y351 PolarHBondContact O-N 3.11Å; D348-Y351 VanDerWaalsContact O-N 3.11Å; D348-Y351 PolarHBondContact OD2-N 3.4Å; D348-N352 WeakPolarHBondContact OD2-CB 3.44Å; D348-N352 PolarHBondContact OD2-N 3.25Å; D348-N352 PolarHBondContact OD2-ND2 3.38Å; D348-S356 PolarHBondContact N-OG 3.3Å; D348-S356 VanDerWaalsContact N-OG 3.12Å
349	M	91.4	Very high	89.9	Confident	144 Å²	144	68.9 Å²	68.9	71%	0.709	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-31.3	177.9	-71.3	-66	-66.3	0	0	112.4	P251 Q347	P251-M349 VanDerWaalsContact CB-O 3.23Å; P251-M349 WeakPolarHBondContact CB-O 3.35Å; P251-M349 WeakPolarHBondContact CG-O 3.11Å; Q347-M349 PolarHBondContact O-N 3.48Å
350	E	91.7	Very high	91.5	Very high	65 Å²	65	61.1 Å²	61.1	30%	0.304	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.9	-0.4	177.9	-71.3	-67.7	111	0	0	112.9	R254 D348 N352 R466	R254-E350 WeakPolarHBondContact CD-O 3.28Å; R254-E350 IonicContact CZ-OE2 2.86Å; R254-E350 VanDerWaalsContact CZ-OE2 3.24Å; R254-E350 VanDerWaalsContact NH1-CD 3.3Å; R254-E350 PolarHBondContact NH1-O 3.08Å; R254-E350 IonicContact NH1-OE1 2.69Å; R254-E350 IonicContact NH1-OE2 3.17Å; R254-E350 PolarHBondContact NH1-OE2 3.25Å; R254-E350 IonicContact NH2-OE1 3.74Å; R254-E350 PolarHBondContact NH2-OE1 3.06Å; R254-E350 IonicContact NH2-OE2 3.39Å; R254-E350 PolarHBondContact NH2-OE2 3.32Å; D348-E350 PolarHBondContact O-N 3.04Å; D348-E350 PolarHBondContact OD1-N 3.32Å; E350-N352 WeakPolarHBondContact CB-ND2 3.21Å; E350-N352 PolarHBondContact O-N 3.08Å; E350-R466 IonicContact OE2-NH1 3.68Å; E350-R466 PolarHBondContact OE2-NH1 3.41Å
351	Y	93.4	Very high	92.5	Very high	18 Å²	18	57.9 Å²	57.9	7%	0.071	30%	0.303	C	S	.	.			trans	52.2	36	178.9	-70.2	-102.9	0	0	0	113.9	P251 H252 P255 L310 F311 Q347 D348	P251-Y351 WeakPolarHBondContact O-CD2 3.32Å; H252-Y351 VanDerWaalsContact CA-CE2 3.42Å; H252-Y351 HydrophobicContact CB-CE2 3.98Å; P255-Y351 HydrophobicContact CG-CD1 3.51Å; P255-Y351 HydrophobicContact CG-CE1 3.95Å; P255-Y351 HydrophobicContact CG-CG 4.27Å; L310-Y351 VanDerWaalsContact CD2-O 3.28Å; L310-Y351 WeakPolarHBondContact CD2-O 3.42Å; F311-Y351 HydrophobicContact CD1-CE1 4.38Å; F311-Y351 HydrophobicContact CE1-CD1 4.45Å; F311-Y351 HydrophobicContact CE1-CE1 4Å; Q347-Y351 VanDerWaalsContact CD-CE1 3.5Å; Q347-Y351 HydrophobicContact CG-CD1 4.45Å; Q347-Y351 HydrophobicContact CG-CE1 3.79Å; Q347-Y351 HydrophobicContact CG-CE2 4.24Å; Q347-Y351 VanDerWaalsContact NE2-CD1 3.34Å; D348-Y351 WeakPolarHBondContact O-CD2 3.17Å; D348-Y351 PolarHBondContact O-N 3.11Å; D348-Y351 VanDerWaalsContact O-N 3.11Å; D348-Y351 PolarHBondContact OD2-N 3.4Å
352	N	93.6	Very high	93	Very high	56 Å²	56	56.9 Å²	56.9	30%	0.299	30%	0.295	S	S	.	.			trans	-71.8	148.7	172.6	-52.5	-78.4	0	0	0	110.1	D348 E350 L354 S355 H461	D348-N352 WeakPolarHBondContact OD2-CB 3.44Å; D348-N352 PolarHBondContact OD2-N 3.25Å; D348-N352 PolarHBondContact OD2-ND2 3.38Å; E350-N352 WeakPolarHBondContact CB-ND2 3.21Å; E350-N352 PolarHBondContact O-N 3.08Å; N352-L354 PolarHBondContact O-N 3.18Å; N352-S355 WeakPolarHBondContact CB-OG 3.36Å; N352-S355 WeakPolarHBondContact O-CB 3.4Å; N352-S355 PolarHBondContact O-N 2.87Å; N352-H461 PolarHBondContact OD1-CE1 3.41Å; N352-H461 PolarHBondContact OD1-ND1 3.22Å
353	R	94.3	Very high	93.3	Very high	64 Å²	64	52.7 Å²	52.7	24%	0.242	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	134.4	177.5	-67.3	179.3	-178.8	-92.4	-3.8	111.5	T305 K306 E309 L310 S355 E457	T305-R353 PolarHBondContact O-NH1 2.95Å; T305-R353 PolarHBondContact O-NH2 2.86Å; K306-R353 PolarHBondContact O-NH1 3.07Å; E309-R353 HydrophobicContact CB-CB 4.14Å; E309-R353 HydrophobicContact CB-CG 4.12Å; E309-R353 IonicContact OE2-CZ 3.25Å; E309-R353 IonicContact OE2-NH1 3.23Å; E309-R353 PolarHBondContact OE2-NH1 2.73Å; L310-R353 HydrophobicContact CD2-CG 3.68Å; R353-S355 PolarHBondContact O-N 3.31Å; R353-S355 PolarHBondContact O-OG 2.6Å; R353-E457 IonicContact CZ-OE1 2.74Å; R353-E457 VanDerWaalsContact CZ-OE1 3.29Å; R353-E457 IonicContact CZ-OE2 2.83Å; R353-E457 IonicContact NE-OE1 3.76Å; R353-E457 PolarHBondContact NE-OE1 3.39Å; R353-E457 IonicContact NE-OE2 2.61Å; R353-E457 VanDerWaalsContact NH2-CD 3.31Å; R353-E457 IonicContact NH2-OE1 2.68Å; R353-E457 PolarHBondContact NH2-OE1 3.17Å; R353-E457 IonicContact NH2-OE2 2.97Å; R353-E457 PolarHBondContact NH2-OE2 3.48Å
354	L	95.2	Very high	93.2	Very high	57 Å²	57	52.7 Å²	52.7	30%	0.298	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	52	21.8	177.5	-55.9	177.5	0	0	0	114.3	E309 Q312 V313 N314 N352	E309-L354 HydrophobicContact CB-CD2 4.18Å; E309-L354 HydrophobicContact CB-CG 4.31Å; E309-L354 HydrophobicContact CG-CD2 4.12Å; E309-L354 HydrophobicContact CG-CG 4.38Å; E309-L354 PolarHBondContact O-N 3.11Å; Q312-L354 HydrophobicContact CB-CD2 3.81Å; Q312-L354 CarbonylContact O-C 3.46Å; Q312-L354 VanDerWaalsContact O-C 3.31Å; Q312-L354 VanDerWaalsContact O-CA 3.3Å; Q312-L354 WeakPolarHBondContact O-CA 3.32Å; V313-L354 CarbonylContact C-O 3.56Å; N314-L354 HydrophobicContact CB-CB 4.05Å; N314-L354 VanDerWaalsContact CB-O 3.25Å; N314-L354 WeakPolarHBondContact CB-O 3.27Å; N314-L354 PolarHBondContact N-O 3.5Å; N352-L354 PolarHBondContact O-N 3.18Å
355	S	95.1	Very high	93	Very high	55 Å²	55	49.5 Å²	49.5	39%	0.385	26%	0.257	S	S	.	.	B	Isolated β-bridge	trans	-104.5	-0.6	-172.9	-58.3	0	0	0	0	113.6	Q312 N352 R353	Q312-S355 PolarHBondContact O-N 2.87Å; N352-S355 WeakPolarHBondContact CB-OG 3.36Å; N352-S355 WeakPolarHBondContact O-CB 3.4Å; N352-S355 PolarHBondContact O-N 2.87Å; R353-S355 PolarHBondContact O-N 3.31Å; R353-S355 PolarHBondContact O-OG 2.6Å
356	S	95.6	Very high	92.7	Very high	3 Å²	3	49.6 Å²	49.6	2%	0.021	26%	0.257	C	S	.	.	B	Isolated β-bridge	trans	-66.1	154.7	170.4	-57.8	0	0	0	0	109.9	Q312 V313 I346 Q347 D348	Q312-S356 VanDerWaalsContact O-CB 3.29Å; Q312-S356 WeakPolarHBondContact O-CB 3.44Å; Q312-S356 PolarHBondContact O-N 3.01Å; Q312-S356 VanDerWaalsContact O-N 3.16Å; V313-S356 WeakPolarHBondContact CA-O 3.4Å; V313-S356 VanDerWaalsContact CB-O 3.26Å; V313-S356 WeakPolarHBondContact CB-O 3.28Å; V313-S356 VanDerWaalsContact CG1-O 3.27Å; V313-S356 WeakPolarHBondContact CG1-O 3.37Å; I346-S356 WeakPolarHBondContact O-CA 3.21Å; I346-S356 WeakPolarHBondContact O-CB 3.41Å; Q347-S356 PolarHBondContact NE2-OG 3.03Å; D348-S356 PolarHBondContact N-OG 3.3Å; D348-S356 VanDerWaalsContact N-OG 3.12Å
357	T	94.8	Very high	92.6	Very high	65 Å²	65	47.2 Å²	47.2	40%	0.399	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	-176.6	-174.2	59.8	0	0	0	0	111.2	I345 I346	I345-T357 WeakPolarHBondContact CA-O 3.48Å; I346-T357 PolarHBondContact N-O 3.25Å; I346-T357 PolarHBondContact O-N 3.48Å
358	V	94.9	Very high	92.4	Very high	6 Å²	6	44.9 Å²	44.9	4%	0.036	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	161.1	168.4	-59.6	0	0	0	0	108	V313 L318 L343 M360 F388 L392 L395	V313-V358 HydrophobicContact CG1-CG1 4.33Å; L318-V358 HydrophobicContact CD1-CG1 4.49Å; L318-V358 HydrophobicContact CD1-CG2 4.19Å; L343-V358 HydrophobicContact CD1-CB 4.04Å; L343-V358 HydrophobicContact CD1-CG2 4.48Å; L343-V358 HydrophobicContact CD2-CB 4.04Å; L343-V358 HydrophobicContact CD2-CG1 4.18Å; L343-V358 HydrophobicContact CD2-CG2 4.11Å; L343-V358 HydrophobicContact CG-CB 4.12Å; L343-V358 HydrophobicContact CG-CG1 4.36Å; V358-M360 HydrophobicContact CG2-SD 3.83Å; V358-M360 PolarHBondContact O-N 2.96Å; V358-M360 VanDerWaalsContact O-N 3.08Å; V358-F388 HydrophobicContact CG2-CE2 4.24Å; V358-F388 HydrophobicContact CG2-CZ 4.09Å; V358-L392 HydrophobicContact CG1-CD2 3.84Å; V358-L392 HydrophobicContact CG2-CD2 4.31Å; V358-L395 HydrophobicContact CG1-CD1 4.47Å
359	D	93.9	Very high	92	Very high	72 Å²	72	46.1 Å²	46.1	39%	0.385	24%	0.238	S	C	.	.			trans	-65.7	109.1	168	-176.5	-25	0	0	0	109	L343 I346 D361 L362 A363	L343-D359 WeakPolarHBondContact CD1-O 2.81Å; I346-D359 HydrophobicContact CD1-CB 4.34Å; D359-D361 VanDerWaalsContact C-N 3.34Å; D359-D361 PolarHBondContact OD1-N 3.16Å; D359-L362 HydrophobicContact CB-CB 3.82Å; D359-L362 HydrophobicContact CB-CD2 4.49Å; D359-L362 VanDerWaalsContact CG-CB 3.45Å; D359-L362 PolarHBondContact OD1-N 2.82Å; D359-A363 WeakPolarHBondContact O-CB 3.38Å; D359-A363 PolarHBondContact O-N 3.13Å
360	M	93.2	Very high	91.1	Very high	26 Å²	26	42.3 Å²	42.3	13%	0.128	22%	0.222	C	C	.	.	H	α-helix	trans	-77.5	-20.5	-175.4	-69.7	-66.8	-84.4	0	0	113.1	L318 T321 F322 V358 L364 F388	L318-M360 HydrophobicContact CD2-CE 4.49Å; L318-M360 HydrophobicContact CD2-SD 4.1Å; T321-M360 HydrophobicContact CG2-CE 3.71Å; F322-M360 HydrophobicContact CB-CE 3.99Å; V358-M360 HydrophobicContact CG2-SD 3.83Å; V358-M360 PolarHBondContact O-N 2.96Å; V358-M360 VanDerWaalsContact O-N 3.08Å; M360-L364 WeakPolarHBondContact O-CG 3.39Å; M360-L364 PolarHBondContact O-N 3.13Å; M360-L364 VanDerWaalsContact O-N 3.09Å; M360-F388 HydrophobicContact SD-CZ 4.06Å
361	D	90.9	Very high	89.8	Confident	106 Å²	106	46.3 Å²	46.3	57%	0.567	24%	0.241	S	C	*	.	H	α-helix	trans	-86.4	-37.2	179.7	-59.1	-27.9	0	0	0	109.3	K325 D359 A363 L364 L365	K325-D361 IonicContact NZ-OD1 2.77Å; K325-D361 PolarHBondContact NZ-OD1 3.31Å; D359-D361 VanDerWaalsContact C-N 3.34Å; D359-D361 PolarHBondContact OD1-N 3.16Å; D361-A363 VanDerWaalsContact C-N 3.32Å; D361-L364 PolarHBondContact O-N 2.95Å; D361-L365 PolarHBondContact O-N 3.05Å
362	L	90.7	Very high	88.7	Confident	32 Å²	32	49.1 Å²	49.1	17%	0.168	26%	0.258	C	S	.	.	H	α-helix	trans	-61.8	-38.7	163	179.4	59	0	0	0	112	V341 L343 D359 L365 L366	V341-L362 HydrophobicContact CB-CD1 4.33Å; V341-L362 HydrophobicContact CG1-CD1 3.54Å; V341-L362 HydrophobicContact CG1-CD2 3.95Å; V341-L362 HydrophobicContact CG1-CG 4.39Å; L343-L362 HydrophobicContact CD1-CB 4.4Å; L343-L362 HydrophobicContact CD1-CD2 4.05Å; L343-L362 HydrophobicContact CD1-CG 4.15Å; D359-L362 HydrophobicContact CB-CB 3.82Å; D359-L362 HydrophobicContact CB-CD2 4.49Å; D359-L362 VanDerWaalsContact CG-CB 3.45Å; D359-L362 PolarHBondContact OD1-N 2.82Å; L362-L365 HydrophobicContact CD1-CD2 4.44Å; L362-L365 PolarHBondContact O-N 3.11Å; L362-L366 HydrophobicContact CD1-CD1 3.85Å; L362-L366 HydrophobicContact CD1-CD2 4.49Å; L362-L366 HydrophobicContact CD1-CG 3.88Å; L362-L366 HydrophobicContact CD2-CD1 4.48Å; L362-L366 HydrophobicContact CG-CD1 3.86Å; L362-L366 HydrophobicContact CG-CG 4.3Å; L362-L366 WeakPolarHBondContact O-CB 3.28Å; L362-L366 WeakPolarHBondContact O-CG 3.35Å; L362-L366 PolarHBondContact O-N 3.48Å
363	A	91.2	Very high	87.5	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-63.3	-40.9	175.6	0	0	0	0	0	112.3	F322 L343 D359 D361 L366 F367 F388	F322-A363 HydrophobicContact CD2-CB 4.38Å; F322-A363 HydrophobicContact CE2-CB 4.24Å; L343-A363 HydrophobicContact CD1-CB 4.37Å; L343-A363 HydrophobicContact CD2-CB 4.3Å; D359-A363 WeakPolarHBondContact O-CB 3.38Å; D359-A363 PolarHBondContact O-N 3.13Å; D361-A363 VanDerWaalsContact C-N 3.32Å; A363-L366 PolarHBondContact O-N 2.96Å; A363-F367 HydrophobicContact CB-CD2 4.41Å; A363-F367 WeakPolarHBondContact O-CB 3.42Å; A363-F367 VanDerWaalsContact O-CD2 3.28Å; A363-F367 WeakPolarHBondContact O-CD2 3.39Å; A363-F367 PolarHBondContact O-N 2.94Å; A363-F388 HydrophobicContact CB-CD2 4.11Å; A363-F388 HydrophobicContact CB-CE2 3.56Å; A363-F388 HydrophobicContact CB-CZ 4.24Å
364	L	90.4	Very high	86.7	Confident	9 Å²	9	58.5 Å²	58.5	5%	0.047	31%	0.307	C	S	.	.	H	α-helix	trans	-59.7	-51.8	171.9	-76.6	168.9	0	0	0	110.8	F322 K325 I326 S333 M360 D361 L366 F367 N368	F322-L364 HydrophobicContact CD2-CD2 4.33Å; F322-L364 HydrophobicContact CE2-CD2 3.95Å; F322-L364 HydrophobicContact CE2-CG 4.34Å; K325-L364 HydrophobicContact CB-CD1 4.23Å; K325-L364 HydrophobicContact CB-CD2 4.14Å; K325-L364 HydrophobicContact CD-CD1 3.89Å; I326-L364 HydrophobicContact CG1-CD2 3.77Å; S333-L364 PolarHBondContact OG-O 3.08Å; M360-L364 WeakPolarHBondContact O-CG 3.39Å; M360-L364 PolarHBondContact O-N 3.13Å; M360-L364 VanDerWaalsContact O-N 3.09Å; D361-L364 PolarHBondContact O-N 2.95Å; L364-L366 VanDerWaalsContact C-N 3.28Å; L364-L366 PolarHBondContact O-N 3.39Å; L364-F367 PolarHBondContact O-N 3.43Å; L364-N368 HydrophobicContact CD2-CB 4.24Å; L364-N368 VanDerWaalsContact O-CB 3.26Å; L364-N368 WeakPolarHBondContact O-CB 3.21Å; L364-N368 PolarHBondContact O-N 2.89Å
365	L	88.9	Confident	85.9	Confident	53 Å²	53	58.3 Å²	58.3	28%	0.277	31%	0.306	S	S	.	.	H	α-helix	trans	-55	-41.2	179.1	-171.1	71.7	0	0	0	112.9	P334 P336 D361 L362 Q369	P334-L365 HydrophobicContact CG-CD1 4.32Å; P334-L365 VanDerWaalsContact O-CD1 3.28Å; P334-L365 WeakPolarHBondContact O-CD1 3.29Å; P336-L365 HydrophobicContact CB-CD2 4.02Å; P336-L365 HydrophobicContact CB-CG 4.24Å; D361-L365 PolarHBondContact O-N 3.05Å; L362-L365 HydrophobicContact CD1-CD2 4.44Å; L362-L365 PolarHBondContact O-N 3.11Å; L365-Q369 PolarHBondContact O-NE2 3.35Å
366	L	88.8	Confident	85.3	Confident	43 Å²	43	59.5 Å²	59.5	23%	0.225	31%	0.313	C	S	.	.	H	α-helix	trans	-79.9	-36.6	-178.3	-68.8	175.8	0	0	0	113.8	L343 L362 A363 L364	L343-L366 HydrophobicContact CB-CD1 4.15Å; L362-L366 HydrophobicContact CD1-CD1 3.85Å; L362-L366 HydrophobicContact CD1-CD2 4.49Å; L362-L366 HydrophobicContact CD1-CG 3.88Å; L362-L366 HydrophobicContact CD2-CD1 4.48Å; L362-L366 HydrophobicContact CG-CD1 3.86Å; L362-L366 HydrophobicContact CG-CG 4.3Å; L362-L366 WeakPolarHBondContact O-CB 3.28Å; L362-L366 WeakPolarHBondContact O-CG 3.35Å; L362-L366 PolarHBondContact O-N 3.48Å; A363-L366 PolarHBondContact O-N 2.96Å; L364-L366 VanDerWaalsContact C-N 3.28Å; L364-L366 PolarHBondContact O-N 3.39Å
367	F	90	Very high	84.6	Confident	40 Å²	40	62.8 Å²	62.8	18%	0.175	33%	0.328	C	S	.	.	H	α-helix	trans	-112.4	-23.5	-167.6	-61.6	-73.9	0	0	0	115.1	F322 L343 A363 L364 Q369 C384 K387 F388 C391	F322-F367 HydrophobicContact CE1-CB 4.39Å; F322-F367 HydrophobicContact CE2-CB 4.35Å; F322-F367 HydrophobicContact CZ-CB 3.63Å; L343-F367 HydrophobicContact CD2-CE2 4.03Å; A363-F367 HydrophobicContact CB-CD2 4.41Å; A363-F367 WeakPolarHBondContact O-CB 3.42Å; A363-F367 VanDerWaalsContact O-CD2 3.28Å; A363-F367 WeakPolarHBondContact O-CD2 3.39Å; A363-F367 PolarHBondContact O-N 2.94Å; L364-F367 PolarHBondContact O-N 3.43Å; F367-Q369 PolarHBondContact O-N 3.31Å; F367-C384 WeakPolarHBondContact O-CB 3.41Å; F367-C384 PolarHBondContact O-SG 3.27Å; F367-K387 HydrophobicContact CD1-CB 4.16Å; F367-F388 HydrophobicContact CB-CB 4.26Å; F367-F388 HydrophobicContact CD2-CB 4.4Å; F367-F388 AromaticContact CD2-CD2 3.69Å; F367-F388 HydrophobicContact CD2-CD2 3.69Å; F367-F388 HydrophobicContact CE2-CD2 4.02Å; F367-F388 HydrophobicContact CG-CB 4.17Å; F367-F388 HydrophobicContact CG-CD2 4.31Å; F367-C391 HydrophobicContact CE1-CB 3.94Å; F367-C391 HydrophobicContact CE2-CB 4.29Å; F367-C391 HydrophobicContact CZ-CB 3.54Å; F367-C391 VanDerWaalsContact CZ-SG 3.55Å
368	N	88.9	Confident	84.1	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	34%	0.34	C	S	.	.	S	Bend	trans	-81.4	52.3	175.8	-174.4	25.8	0	0	0	112	I326 E329 H331 P332 S333 L364 R380	I326-N368 HydrophobicContact CD1-CB 3.96Å; I326-N368 HydrophobicContact CG1-CB 4.07Å; E329-N368 PolarHBondContact OE2-ND2 2.83Å; H331-N368 PolarHBondContact O-ND2 2.98Å; P332-N368 CarbonylContact C-O 3.54Å; P332-N368 WeakPolarHBondContact CA-O 3.45Å; S333-N368 PolarHBondContact N-O 3.38Å; S333-N368 WeakPolarHBondContact OG-CB 3.38Å; S333-N368 PolarHBondContact OG-ND2 2.85Å; L364-N368 HydrophobicContact CD2-CB 4.24Å; L364-N368 VanDerWaalsContact O-CB 3.26Å; L364-N368 WeakPolarHBondContact O-CB 3.21Å; L364-N368 PolarHBondContact O-N 2.89Å; N368-R380 PolarHBondContact OD1-NH1 3.34Å; N368-R380 PolarHBondContact OD1-NH2 3.4Å
369	Q	84.6	Confident	83.7	Confident	54 Å²	54	68.3 Å²	68.3	25%	0.252	36%	0.362	S	S	.	.			trans	-97.3	158.5	-173.6	-72	-66.2	-28.2	0	0	113.3	P334 L365 F367 R380	P334-Q369 PolarHBondContact O-NE2 3.38Å; L365-Q369 PolarHBondContact O-NE2 3.35Å; F367-Q369 PolarHBondContact O-N 3.31Å; Q369-R380 PolarHBondContact O-NH1 3.27Å
370	T	74.1	Confident	83.3	Confident	64 Å²	64	65.5 Å²	65.5	39%	0.393	35%	0.346	S	S	.	.			trans	-91.2	122.8	170.9	-37.2	0	0	0	0	109.3	P332 K373	P332-T370 WeakPolarHBondContact CB-OG1 3.04Å; P332-T370 HydrophobicContact CG-CG2 4.49Å; P332-T370 WeakPolarHBondContact CG-OG1 3.49Å; T370-K373 HydrophobicContact CG2-CG 4.27Å
371	Q	63.5	Low	83	Confident	149 Å²	149	66.1 Å²	66.1	70%	0.696	35%	0.349	S	S	*	.	S	Bend	trans	-104.6	-37.9	170.2	-70.8	-158.5	-46.8	0	0	113.1
372	D	70.9	Confident	82.9	Confident	78 Å²	78	65.4 Å²	65.4	42%	0.417	34%	0.342	S	S	.	.			trans	-143.8	141.5	176.8	-164	-19.5	0	0	0	109	T374 I375	D372-T374 PolarHBondContact OD1-N 3.23Å; D372-T374 PolarHBondContact OD1-OG1 2.95Å; D372-T374 PolarHBondContact OD2-OG1 2.92Å; D372-I375 HydrophobicContact CB-CD1 3.79Å; D372-I375 HydrophobicContact CB-CG1 3.99Å
373	K	68.6	Low	82.8	Confident	197 Å²	197	66.2 Å²	66.2	86%	0.857	35%	0.346	S	S	*	.	S	Bend	trans	-88.5	-8.4	177.9	-69.9	-173.2	177.2	-177.2	0	112.8	T370	T370-K373 HydrophobicContact CG2-CG 4.27Å
374	T	76.4	Confident	82.8	Confident	119 Å²	119	66.4 Å²	66.4	73%	0.73	35%	0.347	S	S	*	.	S	Bend	trans	-86.7	-12.4	176.6	65.1	0	0	0	0	113.7	D372	D372-T374 PolarHBondContact OD1-N 3.23Å; D372-T374 PolarHBondContact OD1-OG1 2.95Å; D372-T374 PolarHBondContact OD2-OG1 2.92Å
375	I	78.1	Confident	82.9	Confident	53 Å²	53	66.5 Å²	66.5	27%	0.272	35%	0.348	S	S	.	.	S	Bend	trans	-79.2	132	-178.9	-62.9	174.9	0	0	0	109.6	D372 E379 R380 I383	D372-I375 HydrophobicContact CB-CD1 3.79Å; D372-I375 HydrophobicContact CB-CG1 3.99Å; I375-E379 HydrophobicContact CG2-CB 3.67Å; I375-E379 HydrophobicContact CG2-CG 3.71Å; I375-R380 HydrophobicContact CG2-CB 4.36Å; I375-I383 HydrophobicContact CD1-CD1 4.33Å
376	P	82.8	Confident	83.1	Confident	80 Å²	80	68.4 Å²	68.4	52%	0.519	36%	0.356	S	S	.	.			trans	-55.5	139.7	172.7	-24.9	34.3	0	0	0	112.2	A378 E379 R380	P376-A378 PolarHBondContact O-N 2.98Å; P376-A378 VanDerWaalsContact O-N 3.11Å; P376-E379 WeakPolarHBondContact O-CA 3.38Å; P376-E379 WeakPolarHBondContact O-CB 3.45Å; P376-E379 PolarHBondContact O-N 3.37Å; P376-R380 PolarHBondContact O-N 3.44Å
377	E	81.7	Confident	83.2	Confident	72 Å²	72	69.6 Å²	69.6	34%	0.336	36%	0.359	S	S	.	.	H	α-helix	trans	-53.7	-39.7	-174.3	178.4	56.6	-159.4	0	0	113	E379 R380 Q381	E377-E379 VanDerWaalsContact C-N 3.31Å; E377-E379 PolarHBondContact O-N 3.23Å; E377-R380 WeakPolarHBondContact O-CB 3.48Å; E377-R380 PolarHBondContact O-N 3.15Å; E377-R380 IonicContact OE1-CZ 3.26Å; E377-R380 IonicContact OE1-NE 2.71Å; E377-R380 PolarHBondContact OE1-NE 3.24Å; E377-R380 IonicContact OE1-NH2 2.86Å; E377-R380 PolarHBondContact OE1-NH2 3.48Å; E377-R380 WeakPolarHBondContact OE2-CD 3.4Å; E377-R380 IonicContact OE2-CZ 3.97Å; E377-R380 IonicContact OE2-NE 3.9Å; E377-R380 PolarHBondContact OE2-NE 2.86Å; E377-R380 IonicContact OE2-NH2 3.15Å; E377-Q381 HydrophobicContact CG-CG 4.45Å; E377-Q381 WeakPolarHBondContact O-CB 3.42Å; E377-Q381 VanDerWaalsContact O-CG 3.24Å; E377-Q381 WeakPolarHBondContact O-CG 3.17Å; E377-Q381 PolarHBondContact O-N 3.48Å; E377-Q381 WeakPolarHBondContact OE1-CG 3.08Å; E377-Q381 PolarHBondContact OE1-NE2 2.94Å
378	A	84	Confident	83.4	Confident	79 Å²	79	67.7 Å²	67.7	65%	0.653	35%	0.351	S	S	*	.	H	α-helix	trans	-61	-35.4	175.9	0	0	0	0	0	113.8	P376 Q382	P376-A378 PolarHBondContact O-N 2.98Å; P376-A378 VanDerWaalsContact O-N 3.11Å; A378-Q382 WeakPolarHBondContact O-CB 3.12Å; A378-Q382 PolarHBondContact O-N 3.36Å; A378-Q382 VanDerWaalsContact O-N 3.17Å
379	E	85.6	Confident	83.7	Confident	108 Å²	108	71 Å²	71	51%	0.505	37%	0.366	S	S	.	.	H	α-helix	trans	-77.8	-39.3	177.5	-177.5	174.3	-167.5	0	0	111.1	I375 P376 E377 Q381 Q382 I383	I375-E379 HydrophobicContact CG2-CB 3.67Å; I375-E379 HydrophobicContact CG2-CG 3.71Å; P376-E379 WeakPolarHBondContact O-CA 3.38Å; P376-E379 WeakPolarHBondContact O-CB 3.45Å; P376-E379 PolarHBondContact O-N 3.37Å; E377-E379 VanDerWaalsContact C-N 3.31Å; E377-E379 PolarHBondContact O-N 3.23Å; E379-Q381 PolarHBondContact O-N 2.87Å; E379-Q382 PolarHBondContact O-N 3.21Å; E379-I383 HydrophobicContact CG-CD1 4.29Å; E379-I383 WeakPolarHBondContact O-CG1 3.17Å; E379-I383 PolarHBondContact O-N 2.88Å
380	R	86.3	Confident	84.2	Confident	13 Å²	13	74.7 Å²	74.7	5%	0.049	38%	0.383	C	S	.	.	H	α-helix	trans	-55.1	-51.3	170.6	-173.2	-160.7	72.1	81.8	-3.7	110.9	N368 Q369 I375 P376 E377 Q382 I383 C384	N368-R380 PolarHBondContact OD1-NH1 3.34Å; N368-R380 PolarHBondContact OD1-NH2 3.4Å; Q369-R380 PolarHBondContact O-NH1 3.27Å; I375-R380 HydrophobicContact CG2-CB 4.36Å; P376-R380 PolarHBondContact O-N 3.44Å; E377-R380 WeakPolarHBondContact O-CB 3.48Å; E377-R380 PolarHBondContact O-N 3.15Å; E377-R380 IonicContact OE1-CZ 3.26Å; E377-R380 IonicContact OE1-NE 2.71Å; E377-R380 PolarHBondContact OE1-NE 3.24Å; E377-R380 IonicContact OE1-NH2 2.86Å; E377-R380 PolarHBondContact OE1-NH2 3.48Å; E377-R380 WeakPolarHBondContact OE2-CD 3.4Å; E377-R380 IonicContact OE2-CZ 3.97Å; E377-R380 IonicContact OE2-NE 3.9Å; E377-R380 PolarHBondContact OE2-NE 2.86Å; E377-R380 IonicContact OE2-NH2 3.15Å; R380-Q382 VanDerWaalsContact C-N 3.32Å; R380-Q382 PolarHBondContact O-N 2.9Å; R380-I383 PolarHBondContact O-N 3.12Å; R380-C384 PolarHBondContact O-N 2.95Å; R380-C384 PolarHBondContact O-SG 2.8Å; R380-C384 VanDerWaalsContact O-SG 3.33Å
381	Q	86.7	Confident	85.2	Confident	39 Å²	39	72.9 Å²	72.9	18%	0.182	37%	0.373	C	S	.	.	H	α-helix	trans	-59.3	-42.9	178.7	-68.6	-177.3	6.7	0	0	111.5	I326 E377 E379 I383 C384 V385	I326-Q381 HydrophobicContact CG2-CB 3.8Å; I326-Q381 HydrophobicContact CG2-CG 3.41Å; I326-Q381 VanDerWaalsContact CG2-CG 3.41Å; E377-Q381 HydrophobicContact CG-CG 4.45Å; E377-Q381 WeakPolarHBondContact O-CB 3.42Å; E377-Q381 VanDerWaalsContact O-CG 3.24Å; E377-Q381 WeakPolarHBondContact O-CG 3.17Å; E377-Q381 PolarHBondContact O-N 3.48Å; E377-Q381 WeakPolarHBondContact OE1-CG 3.08Å; E377-Q381 PolarHBondContact OE1-NE2 2.94Å; E379-Q381 PolarHBondContact O-N 2.87Å; Q381-I383 PolarHBondContact O-N 3.14Å; Q381-C384 WeakPolarHBondContact O-CB 3.34Å; Q381-C384 PolarHBondContact O-N 2.82Å; Q381-V385 VanDerWaalsContact O-CG2 3.26Å; Q381-V385 WeakPolarHBondContact O-CG2 3.07Å; Q381-V385 PolarHBondContact O-N 2.95Å
382	Q	89.1	Confident	86.7	Confident	91 Å²	91	65.8 Å²	65.8	43%	0.425	34%	0.34	S	S	.	.	H	α-helix	trans	-61.9	-40.2	177.2	-172.3	70.1	0.6	0	0	112.4	A378 E379 R380 V385 Q386	A378-Q382 WeakPolarHBondContact O-CB 3.12Å; A378-Q382 PolarHBondContact O-N 3.36Å; A378-Q382 VanDerWaalsContact O-N 3.17Å; E379-Q382 PolarHBondContact O-N 3.21Å; R380-Q382 VanDerWaalsContact C-N 3.32Å; R380-Q382 PolarHBondContact O-N 2.9Å; Q382-V385 PolarHBondContact O-N 3.45Å; Q382-Q386 WeakPolarHBondContact O-CG 3.31Å; Q382-Q386 PolarHBondContact O-N 3.11Å
383	I	89.2	Confident	87.9	Confident	49 Å²	49	68.5 Å²	68.5	25%	0.251	34%	0.344	S	S	.	.	H	α-helix	trans	-64.9	-42.8	175	-67.1	163.9	0	0	0	111.2	I375 E379 R380 Q381 Q386 K387	I375-I383 HydrophobicContact CD1-CD1 4.33Å; E379-I383 HydrophobicContact CG-CD1 4.29Å; E379-I383 WeakPolarHBondContact O-CG1 3.17Å; E379-I383 PolarHBondContact O-N 2.88Å; R380-I383 PolarHBondContact O-N 3.12Å; Q381-I383 PolarHBondContact O-N 3.14Å; I383-Q386 PolarHBondContact O-N 3.37Å; I383-K387 HydrophobicContact CG2-CD 4.34Å; I383-K387 WeakPolarHBondContact O-CG 3.23Å; I383-K387 PolarHBondContact O-N 3Å
384	C	90.3	Very high	89.2	Confident	5 Å²	5	66.2 Å²	66.2	3%	0.034	33%	0.331	C	S	.	.	H	α-helix	trans	-60.1	-45.8	175.7	-68	0	0	0	0	111.6	I326 F367 R380 Q381 Q386 K387 F388	I326-C384 HydrophobicContact CD1-CB 3.69Å; F367-C384 WeakPolarHBondContact O-CB 3.41Å; F367-C384 PolarHBondContact O-SG 3.27Å; R380-C384 PolarHBondContact O-N 2.95Å; R380-C384 PolarHBondContact O-SG 2.8Å; R380-C384 VanDerWaalsContact O-SG 3.33Å; Q381-C384 WeakPolarHBondContact O-CB 3.34Å; Q381-C384 PolarHBondContact O-N 2.82Å; C384-Q386 PolarHBondContact O-N 3.01Å; C384-K387 PolarHBondContact O-N 3.19Å; C384-F388 PolarHBondContact O-N 3.38Å
385	V	92.1	Very high	90.1	Very high	10 Å²	10	61 Å²	61	6%	0.061	30%	0.299	C	S	.	.	H	α-helix	trans	-61.6	-42.2	177	172.4	0	0	0	0	111.5	V319 F322 K323 Q381 Q382 F388 Q389	V319-V385 HydrophobicContact CG1-CG1 3.77Å; F322-V385 HydrophobicContact CD1-CG2 4.11Å; F322-V385 HydrophobicContact CE1-CG2 4.36Å; K323-V385 HydrophobicContact CB-CG2 3.98Å; K323-V385 HydrophobicContact CG-CG2 4.2Å; Q381-V385 VanDerWaalsContact O-CG2 3.26Å; Q381-V385 WeakPolarHBondContact O-CG2 3.07Å; Q381-V385 PolarHBondContact O-N 2.95Å; Q382-V385 PolarHBondContact O-N 3.45Å; V385-F388 PolarHBondContact O-N 3.49Å; V385-Q389 WeakPolarHBondContact O-CB 3.48Å; V385-Q389 PolarHBondContact O-N 3.14Å
386	Q	92.9	Very high	91.1	Very high	94 Å²	94	58.9 Å²	58.9	44%	0.439	29%	0.288	S	S	.	.	H	α-helix	trans	-63.9	-41.4	176.3	-76.1	177.9	-4.6	0	0	112.9	Q382 I383 C384 Q389 Q390	Q382-Q386 WeakPolarHBondContact O-CG 3.31Å; Q382-Q386 PolarHBondContact O-N 3.11Å; I383-Q386 PolarHBondContact O-N 3.37Å; C384-Q386 PolarHBondContact O-N 3.01Å; Q386-Q389 WeakPolarHBondContact O-CB 3.29Å; Q386-Q389 PolarHBondContact O-N 3.35Å; Q386-Q390 WeakPolarHBondContact O-CG 3.2Å; Q386-Q390 PolarHBondContact O-N 3.3Å
387	K	91.8	Very high	91.7	Very high	67 Å²	67	60 Å²	60	29%	0.291	29%	0.29	S	S	.	.	H	α-helix	trans	-65.6	-42.8	176.7	-73.3	173.7	-176.9	167.7	0	112.2	F367 I383 C384 Q389 Q390 C391	F367-K387 HydrophobicContact CD1-CB 4.16Å; I383-K387 HydrophobicContact CG2-CD 4.34Å; I383-K387 WeakPolarHBondContact O-CG 3.23Å; I383-K387 PolarHBondContact O-N 3Å; C384-K387 PolarHBondContact O-N 3.19Å; K387-Q389 VanDerWaalsContact C-N 3.35Å; K387-Q390 PolarHBondContact O-N 3.2Å; K387-C391 PolarHBondContact O-N 3.43Å
388	F	94.2	Very high	92.4	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-60.9	-45.3	174	178.4	-115.7	0	0	0	111.1	L318 V319 F322 L343 V358 M360 A363 F367 C384 V385 Q390 C391 L392	L318-F388 HydrophobicContact CB-CE1 4.33Å; L318-F388 HydrophobicContact CB-CZ 4.47Å; V319-F388 HydrophobicContact CG2-CD1 4.22Å; V319-F388 HydrophobicContact CG2-CE1 4.48Å; F322-F388 HydrophobicContact CB-CD1 3.56Å; F322-F388 HydrophobicContact CB-CE1 3.42Å; F322-F388 VanDerWaalsContact CB-CE1 3.42Å; F322-F388 HydrophobicContact CB-CG 4.49Å; F322-F388 HydrophobicContact CB-CZ 4.28Å; F322-F388 HydrophobicContact CD1-CB 3.75Å; F322-F388 AromaticContact CD1-CD1 3.42Å; F322-F388 HydrophobicContact CD1-CD1 3.42Å; F322-F388 VanDerWaalsContact CD1-CD1 3.42Å; F322-F388 HydrophobicContact CD1-CE1 4.17Å; F322-F388 AromaticContact CD1-CG 3.71Å; F322-F388 HydrophobicContact CD1-CG 3.71Å; F322-F388 AromaticContact CD2-CD1 4Å; F322-F388 HydrophobicContact CD2-CD1 4Å; F322-F388 HydrophobicContact CD2-CD2 4.41Å; F322-F388 HydrophobicContact CD2-CE1 4.09Å; F322-F388 HydrophobicContact CD2-CG 4.14Å; F322-F388 HydrophobicContact CD2-CZ 4.34Å; F322-F388 HydrophobicContact CE1-CB 3.5Å; F322-F388 HydrophobicContact CE1-CD1 4.06Å; F322-F388 AromaticContact CE1-CG 3.86Å; F322-F388 HydrophobicContact CE1-CG 3.86Å; F322-F388 HydrophobicContact CE2-CD2 4.43Å; F322-F388 HydrophobicContact CE2-CG 4.29Å; F322-F388 HydrophobicContact CG-CB 4.39Å; F322-F388 AromaticContact CG-CD1 3.38Å; F322-F388 HydrophobicContact CG-CD1 3.38Å; F322-F388 AromaticContact CG-CE1 3.65Å; F322-F388 HydrophobicContact CG-CE1 3.65Å; F322-F388 AromaticContact CG-CG 3.86Å; F322-F388 HydrophobicContact CG-CG 3.86Å; F322-F388 HydrophobicContact CG-CZ 4.34Å; F322-F388 HydrophobicContact CZ-CB 3.98Å; F322-F388 HydrophobicContact CZ-CG 4.16Å; L343-F388 HydrophobicContact CD2-CE2 3.95Å; V358-F388 HydrophobicContact CG2-CE2 4.24Å; V358-F388 HydrophobicContact CG2-CZ 4.09Å; M360-F388 HydrophobicContact SD-CZ 4.06Å; A363-F388 HydrophobicContact CB-CD2 4.11Å; A363-F388 HydrophobicContact CB-CE2 3.56Å; A363-F388 HydrophobicContact CB-CZ 4.24Å; F367-F388 HydrophobicContact CB-CB 4.26Å; F367-F388 HydrophobicContact CD2-CB 4.4Å; F367-F388 AromaticContact CD2-CD2 3.69Å; F367-F388 HydrophobicContact CD2-CD2 3.69Å; F367-F388 HydrophobicContact CE2-CD2 4.02Å; F367-F388 HydrophobicContact CG-CB 4.17Å; F367-F388 HydrophobicContact CG-CD2 4.31Å; C384-F388 PolarHBondContact O-N 3.38Å; V385-F388 PolarHBondContact O-N 3.49Å; F388-Q390 PolarHBondContact O-N 2.92Å; F388-C391 WeakPolarHBondContact O-CB 3.47Å; F388-C391 PolarHBondContact O-N 3.16Å; F388-C391 VanDerWaalsContact O-N 3.14Å; F388-L392 HydrophobicContact CD1-CD1 4.25Å; F388-L392 HydrophobicContact CD1-CG 4.49Å; F388-L392 HydrophobicContact CD2-CG 4.45Å; F388-L392 HydrophobicContact CE1-CD1 3.62Å; F388-L392 HydrophobicContact CE1-CG 4.12Å; F388-L392 HydrophobicContact CE2-CD1 4.37Å; F388-L392 HydrophobicContact CE2-CD2 3.85Å; F388-L392 HydrophobicContact CE2-CG 4.06Å; F388-L392 HydrophobicContact CZ-CD1 3.7Å; F388-L392 HydrophobicContact CZ-CD2 3.86Å; F388-L392 HydrophobicContact CZ-CG 3.9Å; F388-L392 WeakPolarHBondContact O-CG 3.21Å; F388-L392 PolarHBondContact O-N 2.8Å
389	Q	95.5	Very high	92.9	Very high	71 Å²	71	55.7 Å²	55.7	33%	0.332	26%	0.259	S	S	.	.	H	α-helix	trans	-57	-45.6	174.4	-175.3	176.3	27.6	0	0	112.3	V315 V319 V385 Q386 K387 C391 L392 W393	V315-Q389 HydrophobicContact CG1-CG 3.97Å; V319-Q389 HydrophobicContact CG2-CB 3.7Å; V319-Q389 HydrophobicContact CG2-CG 3.92Å; V385-Q389 WeakPolarHBondContact O-CB 3.48Å; V385-Q389 PolarHBondContact O-N 3.14Å; Q386-Q389 WeakPolarHBondContact O-CB 3.29Å; Q386-Q389 PolarHBondContact O-N 3.35Å; K387-Q389 VanDerWaalsContact C-N 3.35Å; Q389-C391 VanDerWaalsContact C-N 3.35Å; Q389-C391 PolarHBondContact O-N 2.92Å; Q389-L392 PolarHBondContact O-N 2.62Å; Q389-W393 PolarHBondContact O-N 2.73Å
390	Q	94.2	Very high	93.4	Very high	130 Å²	130	51.2 Å²	51.2	61%	0.607	24%	0.24	S	C	*	.	H	α-helix	trans	-61.9	-39.5	175.4	-73.2	174.5	1.5	0	0	112.5	Q386 K387 F388 W393 Y394	Q386-Q390 WeakPolarHBondContact O-CG 3.2Å; Q386-Q390 PolarHBondContact O-N 3.3Å; K387-Q390 PolarHBondContact O-N 3.2Å; F388-Q390 PolarHBondContact O-N 2.92Å; Q390-W393 PolarHBondContact O-N 2.82Å; Q390-Y394 PolarHBondContact O-N 2.98Å
391	C	94.3	Very high	93.9	Very high	26 Å²	26	57 Å²	57	18%	0.176	26%	0.262	C	S	.	.	H	α-helix	trans	-63.1	-45.2	174.2	-177.5	0	0	0	0	111.8	F367 K387 F388 Q389 W393 Y394 L395	F367-C391 HydrophobicContact CE1-CB 3.94Å; F367-C391 HydrophobicContact CE2-CB 4.29Å; F367-C391 HydrophobicContact CZ-CB 3.54Å; F367-C391 VanDerWaalsContact CZ-SG 3.55Å; K387-C391 PolarHBondContact O-N 3.43Å; F388-C391 WeakPolarHBondContact O-CB 3.47Å; F388-C391 PolarHBondContact O-N 3.16Å; F388-C391 VanDerWaalsContact O-N 3.14Å; Q389-C391 VanDerWaalsContact C-N 3.35Å; Q389-C391 PolarHBondContact O-N 2.92Å; C391-W393 VanDerWaalsContact C-N 3.34Å; C391-W393 PolarHBondContact O-N 3.13Å; C391-Y394 WeakPolarHBondContact O-CB 3.13Å; C391-Y394 PolarHBondContact O-N 3.13Å; C391-L395 WeakPolarHBondContact O-CG 3.39Å; C391-L395 PolarHBondContact O-N 2.87Å
392	L	95.8	Very high	94.3	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-62.6	-39.3	176.2	-65	-168.8	0	0	0	112.3	V313 V315 L318 V319 L343 V358 F388 Q389 L395 N396	V313-L392 HydrophobicContact CG2-CB 4.39Å; V313-L392 HydrophobicContact CG2-CD1 4.33Å; V313-L392 HydrophobicContact CG2-CD2 4.28Å; V315-L392 HydrophobicContact CG1-CB 4.15Å; V315-L392 HydrophobicContact CG1-CD1 4.37Å; V315-L392 HydrophobicContact CG2-CB 4.24Å; L318-L392 HydrophobicContact CB-CD1 3.63Å; L318-L392 HydrophobicContact CD1-CD1 4.02Å; L318-L392 HydrophobicContact CD1-CD2 4.45Å; L318-L392 HydrophobicContact CG-CD1 4.5Å; V319-L392 HydrophobicContact CG2-CD1 4.24Å; L343-L392 HydrophobicContact CD2-CD2 4.48Å; V358-L392 HydrophobicContact CG1-CD2 3.84Å; V358-L392 HydrophobicContact CG2-CD2 4.31Å; F388-L392 HydrophobicContact CD1-CD1 4.25Å; F388-L392 HydrophobicContact CD1-CG 4.49Å; F388-L392 HydrophobicContact CD2-CG 4.45Å; F388-L392 HydrophobicContact CE1-CD1 3.62Å; F388-L392 HydrophobicContact CE1-CG 4.12Å; F388-L392 HydrophobicContact CE2-CD1 4.37Å; F388-L392 HydrophobicContact CE2-CD2 3.85Å; F388-L392 HydrophobicContact CE2-CG 4.06Å; F388-L392 HydrophobicContact CZ-CD1 3.7Å; F388-L392 HydrophobicContact CZ-CD2 3.86Å; F388-L392 HydrophobicContact CZ-CG 3.9Å; F388-L392 WeakPolarHBondContact O-CG 3.21Å; F388-L392 PolarHBondContact O-N 2.8Å; Q389-L392 PolarHBondContact O-N 2.62Å; L392-L395 HydrophobicContact CD2-CD1 4.49Å; L392-L395 PolarHBondContact O-N 3.43Å; L392-N396 WeakPolarHBondContact O-CB 3.12Å; L392-N396 PolarHBondContact O-N 3.38Å
393	W	96.5	Very high	94.7	Very high	135 Å²	135	56 Å²	56	51%	0.511	26%	0.256	S	S	.	.	H	α-helix	trans	-61.4	-44	172.1	-77.5	118.4	0	0	0	112.2	V315 Q389 Q390 C391 N396 N397	V315-W393 HydrophobicContact CG2-CD2 4.36Å; V315-W393 HydrophobicContact CG2-CE3 4.46Å; Q389-W393 PolarHBondContact O-N 2.73Å; Q390-W393 PolarHBondContact O-N 2.82Å; C391-W393 VanDerWaalsContact C-N 3.34Å; C391-W393 PolarHBondContact O-N 3.13Å; W393-N396 PolarHBondContact O-N 2.99Å; W393-N397 WeakPolarHBondContact O-CB 3.47Å; W393-N397 VanDerWaalsContact O-CG 3.23Å; W393-N397 PolarHBondContact O-N 3.06Å; W393-N397 PolarHBondContact O-ND2 2.53Å
394	Y	95.9	Very high	95	Very high	149 Å²	149	56 Å²	56	58%	0.584	25%	0.253	S	S	*	.	H	α-helix	trans	-60.2	-48.4	174.9	172.2	-88.3	0	0	0	111.7	Q390 C391 N396 N397 E398	Q390-Y394 PolarHBondContact O-N 2.98Å; C391-Y394 WeakPolarHBondContact O-CB 3.13Å; C391-Y394 PolarHBondContact O-N 3.13Å; Y394-N396 PolarHBondContact O-N 2.9Å; Y394-N397 WeakPolarHBondContact O-CB 3.35Å; Y394-N397 PolarHBondContact O-N 3.03Å; Y394-E398 PolarHBondContact O-N 3.39Å
395	L	96	Very high	95.3	Very high	11 Å²	11	58.8 Å²	58.8	6%	0.058	27%	0.267	C	S	.	.	H	α-helix	trans	-63	-41.7	179.4	-71.4	175.6	0	0	0	112	L343 I345 V358 C391 L392 N397 E398 A399	L343-L395 HydrophobicContact CB-CD1 4.43Å; L343-L395 HydrophobicContact CD2-CD1 4.18Å; L343-L395 HydrophobicContact CG-CD1 4.23Å; I345-L395 HydrophobicContact CD1-CB 3.9Å; I345-L395 HydrophobicContact CG1-CB 3.96Å; I345-L395 HydrophobicContact CG1-CD1 4.45Å; V358-L395 HydrophobicContact CG1-CD1 4.47Å; C391-L395 WeakPolarHBondContact O-CG 3.39Å; C391-L395 PolarHBondContact O-N 2.87Å; L392-L395 HydrophobicContact CD2-CD1 4.49Å; L392-L395 PolarHBondContact O-N 3.43Å; L395-N397 VanDerWaalsContact C-N 3.35Å; L395-N397 PolarHBondContact O-N 3.12Å; L395-E398 PolarHBondContact O-N 3.17Å; L395-A399 WeakPolarHBondContact O-CB 3.33Å; L395-A399 PolarHBondContact O-N 2.67Å
396	N	97.1	Very high	95.5	Very high	7 Å²	7	59.3 Å²	59.3	4%	0.037	27%	0.27	C	S	.	.	H	α-helix	trans	-63.4	-39.4	174.1	-89.5	-3.3	0	0	0	112.1	Q312 V313 V315 L392 W393 Y394 A399 A400	Q312-N396 WeakPolarHBondContact CA-OD1 3.49Å; Q312-N396 VanDerWaalsContact CB-OD1 3.29Å; Q312-N396 WeakPolarHBondContact CB-OD1 3.42Å; Q312-N396 HydrophobicContact CG-CB 4.05Å; Q312-N396 WeakPolarHBondContact CG-OD1 3.37Å; Q312-N396 PolarHBondContact NE2-O 2.98Å; V313-N396 PolarHBondContact N-OD1 2.65Å; V313-N396 PolarHBondContact O-ND2 3.48Å; V315-N396 VanDerWaalsContact CG2-ND2 3.34Å; V315-N396 WeakPolarHBondContact CG2-ND2 3.27Å; L392-N396 WeakPolarHBondContact O-CB 3.12Å; L392-N396 PolarHBondContact O-N 3.38Å; W393-N396 PolarHBondContact O-N 2.99Å; Y394-N396 PolarHBondContact O-N 2.9Å; N396-A399 PolarHBondContact O-N 3.38Å; N396-A400 VanDerWaalsContact O-CB 3.32Å; N396-A400 WeakPolarHBondContact O-CB 3.47Å; N396-A400 PolarHBondContact O-N 3.39Å
397	N	96.9	Very high	95.7	Very high	103 Å²	103	55 Å²	55	55%	0.551	25%	0.25	S	C	*	.	H	α-helix	trans	-66.1	-37.4	174.1	-73.6	-27	0	0	0	111.9	W393 Y394 L395 R401	W393-N397 WeakPolarHBondContact O-CB 3.47Å; W393-N397 VanDerWaalsContact O-CG 3.23Å; W393-N397 PolarHBondContact O-N 3.06Å; W393-N397 PolarHBondContact O-ND2 2.53Å; Y394-N397 WeakPolarHBondContact O-CB 3.35Å; Y394-N397 PolarHBondContact O-N 3.03Å; L395-N397 VanDerWaalsContact C-N 3.35Å; L395-N397 PolarHBondContact O-N 3.12Å; N397-R401 WeakPolarHBondContact O-CB 3.09Å; N397-R401 PolarHBondContact O-N 3.42Å
398	E	96.3	Very high	95.9	Very high	47 Å²	47	57.3 Å²	57.3	22%	0.22	26%	0.257	C	S	.	.	H	α-helix	trans	-67.5	-43	175.8	-160.7	-165.3	144.9	0	0	112	Y394 L395 R401 K402	Y394-E398 PolarHBondContact O-N 3.39Å; L395-E398 PolarHBondContact O-N 3.17Å; E398-R401 PolarHBondContact O-N 3.13Å; E398-K402 WeakPolarHBondContact O-CG 3.4Å; E398-K402 PolarHBondContact O-N 3.48Å; E398-K402 WeakPolarHBondContact OE1-CE 3.07Å; E398-K402 IonicContact OE1-NZ 3.17Å; E398-K402 PolarHBondContact OE1-NZ 3.06Å
399	A	95.1	Very high	95.9	Very high	15 Å²	15	61.5 Å²	61.5	12%	0.124	28%	0.276	C	S	.	.	H	α-helix	trans	-63.5	-43.5	174.2	0	0	0	0	0	111.9	F311 Q312 I345 L395 N396 K402 C403	F311-A399 HydrophobicContact CB-CB 4.41Å; F311-A399 WeakPolarHBondContact O-CB 3.2Å; Q312-A399 HydrophobicContact CG-CB 4.31Å; I345-A399 HydrophobicContact CD1-CB 3.96Å; L395-A399 WeakPolarHBondContact O-CB 3.33Å; L395-A399 PolarHBondContact O-N 2.67Å; N396-A399 PolarHBondContact O-N 3.38Å; A399-K402 PolarHBondContact O-N 2.82Å; A399-C403 WeakPolarHBondContact O-CB 3.21Å; A399-C403 PolarHBondContact O-N 2.77Å
400	A	96.1	Very high	95.9	Very high	13 Å²	13	58.2 Å²	58.2	11%	0.107	26%	0.261	C	S	.	.	H	α-helix	trans	-61.1	-44.3	173.8	0	0	0	0	0	111.8	H308 N396 C403 W404	H308-A400 HydrophobicContact CB-CB 3.94Å; N396-A400 VanDerWaalsContact O-CB 3.32Å; N396-A400 WeakPolarHBondContact O-CB 3.47Å; N396-A400 PolarHBondContact O-N 3.39Å; A400-C403 WeakPolarHBondContact O-CB 3.43Å; A400-C403 PolarHBondContact O-N 3.23Å; A400-W404 WeakPolarHBondContact O-CB 3.36Å; A400-W404 PolarHBondContact O-N 3.34Å
401	R	96.8	Very high	95.9	Very high	136 Å²	136	52 Å²	52	51%	0.513	23%	0.232	S	C	.	.	H	α-helix	trans	-58.2	-50.8	175.4	-172.5	-176.8	66	79.6	-12.6	111.1	N397 E398 C403 W404 D405	N397-R401 WeakPolarHBondContact O-CB 3.09Å; N397-R401 PolarHBondContact O-N 3.42Å; E398-R401 PolarHBondContact O-N 3.13Å; R401-C403 VanDerWaalsContact C-N 3.3Å; R401-C403 PolarHBondContact O-N 3.22Å; R401-W404 PolarHBondContact O-N 3.25Å; R401-D405 IonicContact CZ-OD2 3.41Å; R401-D405 IonicContact NH1-OD2 2.84Å; R401-D405 PolarHBondContact NH1-OD2 2.88Å; R401-D405 WeakPolarHBondContact O-CB 3.45Å; R401-D405 PolarHBondContact O-N 3.43Å
402	K	94.9	Very high	95.9	Very high	106 Å²	106	54.9 Å²	54.9	46%	0.461	24%	0.243	S	C	.	.	H	α-helix	trans	-58.2	-40	176.7	-72.3	172.1	-175.4	167.6	0	112.2	E398 A399 N406	E398-K402 WeakPolarHBondContact O-CG 3.4Å; E398-K402 PolarHBondContact O-N 3.48Å; E398-K402 WeakPolarHBondContact OE1-CE 3.07Å; E398-K402 IonicContact OE1-NZ 3.17Å; E398-K402 PolarHBondContact OE1-NZ 3.06Å; A399-K402 PolarHBondContact O-N 2.82Å; K402-N406 PolarHBondContact O-N 3.4Å; K402-N406 PolarHBondContact O-ND2 3.32Å
403	C	96	Very high	95.8	Very high	3 Å²	3	56.6 Å²	56.6	2%	0.02	25%	0.252	C	S	.	.	H	α-helix	trans	-62.5	-51.7	174.7	-177.5	0	0	0	0	111.2	H308 F311 A399 A400 R401 D405 N406 L407	H308-C403 HydrophobicContact CB-CB 4.09Å; F311-C403 HydrophobicContact CD2-CB 4.16Å; F311-C403 HydrophobicContact CE2-CB 4.4Å; A399-C403 WeakPolarHBondContact O-CB 3.21Å; A399-C403 PolarHBondContact O-N 2.77Å; A400-C403 WeakPolarHBondContact O-CB 3.43Å; A400-C403 PolarHBondContact O-N 3.23Å; R401-C403 VanDerWaalsContact C-N 3.3Å; R401-C403 PolarHBondContact O-N 3.22Å; C403-D405 VanDerWaalsContact C-N 3.34Å; C403-D405 PolarHBondContact O-N 2.85Å; C403-N406 PolarHBondContact O-N 3.34Å; C403-L407 WeakPolarHBondContact O-CG 3.12Å; C403-L407 PolarHBondContact O-N 3.29Å
404	W	97.1	Very high	95.6	Very high	48 Å²	48	50.4 Å²	50.4	18%	0.182	23%	0.229	C	C	.	.	H	α-helix	trans	-61.1	-36.5	178.1	-84.3	111.8	0	0	0	114	L298 Y302 P303 H308 A400 R401 N406 L407 R408	L298-W404 HydrophobicContact CD2-CZ3 4.23Å; Y302-W404 HydrophobicContact CD2-CZ3 4.2Å; P303-W404 HydrophobicContact CG-CH2 3.84Å; P303-W404 HydrophobicContact CG-CZ2 4.29Å; H308-W404 AromaticContact ND1-NE1 3.84Å; A400-W404 WeakPolarHBondContact O-CB 3.36Å; A400-W404 PolarHBondContact O-N 3.34Å; R401-W404 PolarHBondContact O-N 3.25Å; W404-N406 VanDerWaalsContact C-N 3.32Å; W404-N406 PolarHBondContact O-N 3.33Å; W404-L407 HydrophobicContact CD2-CD1 4.37Å; W404-L407 HydrophobicContact CE3-CB 4.35Å; W404-L407 HydrophobicContact CE3-CD1 4.13Å; W404-L407 HydrophobicContact CZ3-CD1 4.4Å; W404-L407 PolarHBondContact O-N 2.87Å; W404-R408 WeakPolarHBondContact O-CG 3.47Å; W404-R408 PolarHBondContact O-N 3.19Å
405	D	96.6	Very high	95.3	Very high	64 Å²	64	43.6 Å²	43.6	34%	0.342	20%	0.203	S	C	.	.	H	α-helix	trans	-63.3	-39.4	176.5	-65.1	-18.3	0	0	0	110.9	R401 C403 R408 H409	R401-D405 IonicContact CZ-OD2 3.41Å; R401-D405 IonicContact NH1-OD2 2.84Å; R401-D405 PolarHBondContact NH1-OD2 2.88Å; R401-D405 WeakPolarHBondContact O-CB 3.45Å; R401-D405 PolarHBondContact O-N 3.43Å; C403-D405 VanDerWaalsContact C-N 3.34Å; C403-D405 PolarHBondContact O-N 2.85Å; D405-R408 IonicContact OD1-NH1 3.4Å; D405-R408 PolarHBondContact OD1-NH1 2.9Å; D405-H409 PolarHBondContact O-N 3.25Å
406	N	95.2	Very high	94.9	Very high	20 Å²	20	47.6 Å²	47.6	11%	0.107	23%	0.225	C	C	.	.	H	α-helix	trans	-69.2	-40.2	172.5	-65	-54.6	0	0	0	112.6	K402 C403 W404 H409 G410 F494 R495	K402-N406 PolarHBondContact O-N 3.4Å; K402-N406 PolarHBondContact O-ND2 3.32Å; C403-N406 PolarHBondContact O-N 3.34Å; W404-N406 VanDerWaalsContact C-N 3.32Å; W404-N406 PolarHBondContact O-N 3.33Å; N406-H409 WeakPolarHBondContact O-CB 3.36Å; N406-H409 PolarHBondContact O-N 3.3Å; N406-G410 PolarHBondContact O-N 3.26Å; N406-F494 HydrophobicContact CB-CD1 3.75Å; N406-F494 HydrophobicContact CB-CE1 3.73Å; N406-R495 HydrophobicContact CB-CG 4.03Å; N406-R495 PolarHBondContact OD1-NE 2.66Å; N406-R495 PolarHBondContact OD1-NH2 3.21Å; N406-R495 VanDerWaalsContact OD1-NH2 3.11Å
407	L	96.6	Very high	94.4	Very high	3 Å²	3	50 Å²	50	2%	0.016	23%	0.233	C	C	.	.	H	α-helix	trans	-64.3	-38.9	178.3	-70.7	175.3	0	0	0	112.4	L259 Y302 I307 C403 W404 G410 V411 F494	L259-L407 HydrophobicContact CD1-CD2 3.8Å; L259-L407 HydrophobicContact CD2-CD2 3.79Å; L259-L407 HydrophobicContact CG-CD2 4.39Å; Y302-L407 HydrophobicContact CD2-CB 3.9Å; Y302-L407 HydrophobicContact CD2-CD1 4.12Å; Y302-L407 HydrophobicContact CD2-CD2 4.2Å; Y302-L407 HydrophobicContact CD2-CG 4.3Å; Y302-L407 HydrophobicContact CE2-CB 3.92Å; Y302-L407 HydrophobicContact CE2-CD2 4.08Å; Y302-L407 HydrophobicContact CE2-CG 4.46Å; I307-L407 HydrophobicContact CD1-CD2 4.42Å; C403-L407 WeakPolarHBondContact O-CG 3.12Å; C403-L407 PolarHBondContact O-N 3.29Å; W404-L407 HydrophobicContact CD2-CD1 4.37Å; W404-L407 HydrophobicContact CE3-CB 4.35Å; W404-L407 HydrophobicContact CE3-CD1 4.13Å; W404-L407 HydrophobicContact CZ3-CD1 4.4Å; W404-L407 PolarHBondContact O-N 2.87Å; L407-G410 PolarHBondContact O-N 3.39Å; L407-V411 WeakPolarHBondContact O-CG2 3.27Å; L407-V411 PolarHBondContact O-N 2.8Å; L407-F494 HydrophobicContact CD2-CE2 4.03Å; L407-F494 HydrophobicContact CD2-CZ 3.82Å; L407-F494 HydrophobicContact CG-CZ 4.12Å
408	R	96.8	Very high	93.9	Very high	117 Å²	117	45.3 Å²	45.3	44%	0.442	21%	0.209	S	C	.	.	H	α-helix	trans	-63.4	-44.1	173.3	-71.4	-179.2	-160.8	106.3	1.4	111.8	L298 W404 D405 G410 V411 E412	L298-R408 HydrophobicContact CD1-CG 4.37Å; L298-R408 HydrophobicContact CD2-CG 3.82Å; W404-R408 WeakPolarHBondContact O-CG 3.47Å; W404-R408 PolarHBondContact O-N 3.19Å; D405-R408 IonicContact OD1-NH1 3.4Å; D405-R408 PolarHBondContact OD1-NH1 2.9Å; R408-G410 VanDerWaalsContact C-N 3.3Å; R408-G410 PolarHBondContact O-N 2.71Å; R408-V411 PolarHBondContact O-N 3.29Å; R408-V411 VanDerWaalsContact O-N 3.15Å; R408-E412 PolarHBondContact O-N 2.67Å
409	H	94.2	Very high	93.3	Very high	88 Å²	88	45.1 Å²	45.1	41%	0.407	21%	0.213	S	C	.	.	H	α-helix	trans	-58.5	-43.5	175	-163.5	84.1	0	0	0	111.4	D405 N406 V411 E412 N413 D497	D405-H409 PolarHBondContact O-N 3.25Å; N406-H409 WeakPolarHBondContact O-CB 3.36Å; N406-H409 PolarHBondContact O-N 3.3Å; H409-V411 VanDerWaalsContact C-N 3.32Å; H409-V411 PolarHBondContact O-N 3.47Å; H409-E412 WeakPolarHBondContact O-CB 3.44Å; H409-E412 PolarHBondContact O-N 3.09Å; H409-N413 PolarHBondContact CD2-ND2 3.29Å; H409-N413 PolarHBondContact O-N 3.47Å; H409-N413 VanDerWaalsContact O-N 3.09Å; H409-D497 IonicContact CD2-OD1 2.67Å; H409-D497 PolarHBondContact CD2-OD1 2.92Å; H409-D497 VanDerWaalsContact CD2-OD1 3.23Å; H409-D497 IonicContact NE2-OD1 3.52Å; H409-D497 PolarHBondContact NE2-OD1 3.03Å
410	G	94.4	Very high	92.4	Very high	1 Å²	1	47 Å²	47	1%	0.01	22%	0.22	C	C	.	.	H	α-helix	trans	-64.8	-30.4	175.4	0	0	0	0	0	115.1	N406 L407 R408 N413 L414 R495	N406-G410 PolarHBondContact O-N 3.26Å; L407-G410 PolarHBondContact O-N 3.39Å; R408-G410 VanDerWaalsContact C-N 3.3Å; R408-G410 PolarHBondContact O-N 2.71Å; G410-N413 PolarHBondContact O-N 2.8Å; G410-L414 WeakPolarHBondContact O-CB 3.34Å; G410-L414 WeakPolarHBondContact O-CD1 3.37Å; G410-L414 WeakPolarHBondContact O-CG 3.49Å; G410-L414 PolarHBondContact O-N 2.58Å; G410-R495 WeakPolarHBondContact CA-O 3.48Å
411	V	96.1	Very high	91.4	Very high	1 Å²	1	49 Å²	49	1%	0.006	23%	0.227	C	C	.	.	H	α-helix	trans	-68.7	-33.9	173.7	165.7	0	0	0	0	112.2	K294 L297 L298 Y302 L407 R408 H409 A415	K294-V411 HydrophobicContact CB-CG1 3.63Å; K294-V411 HydrophobicContact CD-CG1 4.37Å; K294-V411 HydrophobicContact CG-CG1 3.56Å; L297-V411 HydrophobicContact CB-CG2 3.99Å; L297-V411 HydrophobicContact CD1-CG2 4.14Å; L298-V411 HydrophobicContact CD1-CG1 4.21Å; L298-V411 HydrophobicContact CD2-CB 4.39Å; L298-V411 HydrophobicContact CD2-CG2 3.91Å; L298-V411 HydrophobicContact CG-CB 4.47Å; L298-V411 HydrophobicContact CG-CG1 4.24Å; L298-V411 HydrophobicContact CG-CG2 4.14Å; Y302-V411 HydrophobicContact CD2-CG2 4.47Å; Y302-V411 HydrophobicContact CE2-CG2 3.46Å; Y302-V411 VanDerWaalsContact CE2-CG2 3.46Å; L407-V411 WeakPolarHBondContact O-CG2 3.27Å; L407-V411 PolarHBondContact O-N 2.8Å; R408-V411 PolarHBondContact O-N 3.29Å; R408-V411 VanDerWaalsContact O-N 3.15Å; H409-V411 VanDerWaalsContact C-N 3.32Å; H409-V411 PolarHBondContact O-N 3.47Å; V411-A415 PolarHBondContact O-N 3.14Å
412	E	94.4	Very high	90.2	Very high	86 Å²	86	44.5 Å²	44.5	40%	0.402	21%	0.212	S	C	.	.	H	α-helix	trans	-65.7	-47.4	170.3	-67.5	-59.1	132.3	0	0	111.5	K294 R408 H409 L414 A415 N416	K294-E412 WeakPolarHBondContact CD-OE1 3.36Å; K294-E412 VanDerWaalsContact CE-OE1 3.31Å; K294-E412 WeakPolarHBondContact CE-OE1 3.31Å; K294-E412 IonicContact NZ-OE1 3.41Å; K294-E412 PolarHBondContact NZ-OE1 2.89Å; K294-E412 IonicContact NZ-OE2 3.56Å; K294-E412 PolarHBondContact NZ-OE2 3.1Å; R408-E412 PolarHBondContact O-N 2.67Å; H409-E412 WeakPolarHBondContact O-CB 3.44Å; H409-E412 PolarHBondContact O-N 3.09Å; E412-L414 VanDerWaalsContact C-N 3.34Å; E412-L414 PolarHBondContact O-N 3.24Å; E412-A415 PolarHBondContact O-N 2.84Å; E412-A415 VanDerWaalsContact O-N 3.15Å; E412-N416 VanDerWaalsContact O-CG 3.27Å; E412-N416 PolarHBondContact O-N 2.82Å; E412-N416 PolarHBondContact O-ND2 2.88Å
413	N	92.1	Very high	88.9	Confident	36 Å²	36	46 Å²	46	19%	0.193	22%	0.22	C	C	.	.	H	α-helix	trans	-61.7	-38.4	177.5	-70.7	-27.9	0	0	0	113.2	H409 G410 N416 Y417 R495 R496 D497	H409-N413 PolarHBondContact CD2-ND2 3.29Å; H409-N413 PolarHBondContact O-N 3.47Å; H409-N413 VanDerWaalsContact O-N 3.09Å; G410-N413 PolarHBondContact O-N 2.8Å; N413-N416 PolarHBondContact O-N 3.15Å; N413-Y417 WeakPolarHBondContact O-CB 3.36Å; N413-Y417 PolarHBondContact O-N 3.46Å; N413-R495 PolarHBondContact ND2-O 3.49Å; N413-R496 HydrophobicContact CB-CB 4.17Å; N413-R496 WeakPolarHBondContact CB-O 3.21Å; N413-D497 PolarHBondContact ND2-OD1 2.99Å
414	L	92.9	Very high	87.3	Confident	5 Å²	5	50.5 Å²	50.5	3%	0.026	24%	0.242	C	C	.	.	H	α-helix	trans	-64.1	-38.9	174.5	-70.8	163.9	0	0	0	112	L263 L297 G410 E412 Y417 V418 F440 R496	L263-L414 HydrophobicContact CD1-CD1 3.7Å; L263-L414 HydrophobicContact CD1-CD2 4.24Å; L263-L414 HydrophobicContact CD2-CD1 3.72Å; L263-L414 HydrophobicContact CG-CD1 4.39Å; L297-L414 HydrophobicContact CD1-CD1 4.27Å; G410-L414 WeakPolarHBondContact O-CB 3.34Å; G410-L414 WeakPolarHBondContact O-CD1 3.37Å; G410-L414 WeakPolarHBondContact O-CG 3.49Å; G410-L414 PolarHBondContact O-N 2.58Å; E412-L414 VanDerWaalsContact C-N 3.34Å; E412-L414 PolarHBondContact O-N 3.24Å; L414-Y417 PolarHBondContact O-N 2.93Å; L414-V418 WeakPolarHBondContact O-CG2 3.45Å; L414-V418 PolarHBondContact O-N 3.26Å; L414-V418 VanDerWaalsContact O-N 3.09Å; L414-F440 HydrophobicContact CB-CD1 4.37Å; L414-F440 HydrophobicContact CB-CE1 3.87Å; L414-F440 HydrophobicContact CB-CZ 4.27Å; L414-F440 HydrophobicContact CD2-CB 4.16Å; L414-F440 HydrophobicContact CD2-CD1 3.51Å; L414-F440 HydrophobicContact CD2-CD2 4.22Å; L414-F440 HydrophobicContact CD2-CE1 3.82Å; L414-F440 HydrophobicContact CD2-CE2 4.45Å; L414-F440 HydrophobicContact CD2-CG 3.72Å; L414-F440 HydrophobicContact CD2-CZ 4.27Å; L414-F440 HydrophobicContact CG-CD1 4.49Å; L414-F440 HydrophobicContact CG-CE1 4.34Å; L414-R496 HydrophobicContact CD1-CG 4.4Å; L414-R496 HydrophobicContact CD2-CG 4.15Å; L414-R496 HydrophobicContact CG-CB 4.44Å; L414-R496 HydrophobicContact CG-CG 4.14Å
415	A	90.6	Very high	85.5	Confident	5 Å²	5	50.6 Å²	50.6	4%	0.041	25%	0.245	C	C	.	.	H	α-helix	trans	-68.8	-41.4	175.5	0	0	0	0	0	112.2	L290 M293 K294 V411 E412 Y417 V418 S419	L290-A415 HydrophobicContact CD2-CB 4.39Å; M293-A415 HydrophobicContact CE-CB 4.07Å; K294-A415 HydrophobicContact CD-CB 4.42Å; K294-A415 HydrophobicContact CG-CB 4.36Å; V411-A415 PolarHBondContact O-N 3.14Å; E412-A415 PolarHBondContact O-N 2.84Å; E412-A415 VanDerWaalsContact O-N 3.15Å; A415-Y417 VanDerWaalsContact C-N 3.33Å; A415-Y417 PolarHBondContact O-N 2.99Å; A415-V418 PolarHBondContact O-N 3.16Å; A415-S419 PolarHBondContact O-N 3.43Å
416	N	87.3	Confident	83.5	Confident	96 Å²	96	53.4 Å²	53.4	51%	0.513	26%	0.26	S	S	.	.	H	α-helix	trans	-61	-42.4	174.1	-66.8	-21.7	0	0	0	111.2	E412 N413 S419 M420	E412-N416 VanDerWaalsContact O-CG 3.27Å; E412-N416 PolarHBondContact O-N 2.82Å; E412-N416 PolarHBondContact O-ND2 2.88Å; N413-N416 PolarHBondContact O-N 3.15Å; N416-S419 PolarHBondContact O-N 3.07Å; N416-M420 WeakPolarHBondContact O-CB 3.27Å; N416-M420 PolarHBondContact O-N 3.47Å
417	Y	86.6	Confident	81.2	Confident	56 Å²	56	54.7 Å²	54.7	22%	0.22	28%	0.277	C	S	.	.	H	α-helix	trans	-60	-48.6	175.4	175.7	-89.8	0	0	0	112.1	N413 L414 A415 S419 M420 Q421 P441	N413-Y417 WeakPolarHBondContact O-CB 3.36Å; N413-Y417 PolarHBondContact O-N 3.46Å; L414-Y417 PolarHBondContact O-N 2.93Å; A415-Y417 VanDerWaalsContact C-N 3.33Å; A415-Y417 PolarHBondContact O-N 2.99Å; Y417-S419 PolarHBondContact O-N 2.72Å; Y417-M420 HydrophobicContact CD2-CE 4.28Å; Y417-M420 PolarHBondContact O-N 3.11Å; Y417-Q421 HydrophobicContact CD1-CG 4.11Å; Y417-Q421 HydrophobicContact CE1-CG 3.58Å; Y417-Q421 HydrophobicContact CE2-CG 4.12Å; Y417-Q421 VanDerWaalsContact CE2-NE2 3.32Å; Y417-Q421 WeakPolarHBondContact O-CG 3.34Å; Y417-Q421 PolarHBondContact O-N 2.97Å; Y417-Q421 PolarHBondContact OH-NE2 2.86Å; Y417-P441 HydrophobicContact CD2-CG 4.38Å; Y417-P441 HydrophobicContact CE1-CG 4.46Å; Y417-P441 HydrophobicContact CE2-CG 3.94Å
418	V	85.5	Confident	78.9	Confident	5 Å²	5	58.2 Å²	58.2	3%	0.03	31%	0.307	C	S	.	.	H	α-helix	trans	-61.7	-44.3	178.9	173.8	0	0	0	0	110.7	W285 L290 L414 A415 M420 Q421 Q422 L439 F440	W285-V418 HydrophobicContact CB-CG1 4.14Å; W285-V418 HydrophobicContact CD2-CG1 3.91Å; W285-V418 HydrophobicContact CE3-CG1 4.27Å; W285-V418 HydrophobicContact CG-CG1 3.82Å; L290-V418 HydrophobicContact CD2-CB 3.89Å; L290-V418 HydrophobicContact CD2-CG1 3.76Å; L414-V418 WeakPolarHBondContact O-CG2 3.45Å; L414-V418 PolarHBondContact O-N 3.26Å; L414-V418 VanDerWaalsContact O-N 3.09Å; A415-V418 PolarHBondContact O-N 3.16Å; V418-M420 PolarHBondContact O-N 3.35Å; V418-Q421 PolarHBondContact O-N 3.17Å; V418-Q422 WeakPolarHBondContact O-CG 3.15Å; V418-Q422 PolarHBondContact O-N 3.34Å; V418-Q422 VanDerWaalsContact O-N 3.12Å; V418-L439 HydrophobicContact CG1-CD1 4.45Å; V418-L439 HydrophobicContact CG2-CD1 3.91Å; V418-L439 HydrophobicContact CG2-CG 4.27Å; V418-F440 HydrophobicContact CG2-CD1 4.21Å; V418-F440 HydrophobicContact CG2-CE1 3.77Å
419	S	83.2	Confident	76.7	Confident	43 Å²	43	59.7 Å²	59.7	30%	0.301	32%	0.316	S	S	.	.	H	α-helix	trans	-58.5	-45.9	175.5	-161.8	0	0	0	0	111.9	A415 N416 Y417 Q421 Q422 E423	A415-S419 PolarHBondContact O-N 3.43Å; N416-S419 PolarHBondContact O-N 3.07Å; Y417-S419 PolarHBondContact O-N 2.72Å; S419-Q421 PolarHBondContact O-N 3.47Å; S419-Q422 PolarHBondContact O-N 3.01Å; S419-E423 PolarHBondContact O-N 3.05Å; S419-E423 VanDerWaalsContact O-N 3.13Å
420	M	77	Confident	74.7	Confident	56 Å²	56	59.3 Å²	59.3	28%	0.276	32%	0.315	S	S	.	.	H	α-helix	trans	-63.1	-40.7	178.6	-173.9	-167.3	73.3	0	0	112.4	N416 Y417 V418 E423 M424	N416-M420 WeakPolarHBondContact O-CB 3.27Å; N416-M420 PolarHBondContact O-N 3.47Å; Y417-M420 HydrophobicContact CD2-CE 4.28Å; Y417-M420 PolarHBondContact O-N 3.11Å; V418-M420 PolarHBondContact O-N 3.35Å; M420-E423 PolarHBondContact O-N 3.38Å; M420-M424 HydrophobicContact CE-SD 4.13Å; M420-M424 HydrophobicContact CG-CG 4.46Å; M420-M424 HydrophobicContact CG-SD 4.11Å; M420-M424 WeakPolarHBondContact O-CB 3.44Å; M420-M424 VanDerWaalsContact O-CG 3.3Å; M420-M424 WeakPolarHBondContact O-CG 3.3Å; M420-M424 PolarHBondContact O-N 3.43Å; M420-M424 HydrophobicContact SD-SD 4.41Å
421	Q	74.5	Confident	72.8	Confident	54 Å²	54	61.3 Å²	61.3	25%	0.252	33%	0.325	S	S	.	.	H	α-helix	trans	-63.4	-41.1	176.2	-69.2	-59.5	-29.2	0	0	111.8	Y417 V418 S419 E423 M424 E425	Y417-Q421 HydrophobicContact CD1-CG 4.11Å; Y417-Q421 HydrophobicContact CE1-CG 3.58Å; Y417-Q421 HydrophobicContact CE2-CG 4.12Å; Y417-Q421 VanDerWaalsContact CE2-NE2 3.32Å; Y417-Q421 WeakPolarHBondContact O-CG 3.34Å; Y417-Q421 PolarHBondContact O-N 2.97Å; Y417-Q421 PolarHBondContact OH-NE2 2.86Å; V418-Q421 PolarHBondContact O-N 3.17Å; S419-Q421 PolarHBondContact O-N 3.47Å; Q421-E423 VanDerWaalsContact C-N 3.33Å; Q421-E423 PolarHBondContact O-N 3.27Å; Q421-M424 PolarHBondContact O-N 2.88Å; Q421-E425 PolarHBondContact O-N 3.12Å; Q421-E425 VanDerWaalsContact O-N 3.09Å
422	Q	72.7	Confident	71.4	Confident	42 Å²	42	69 Å²	69	20%	0.196	36%	0.358	C	S	.	.	H	α-helix	trans	-61.9	-40	176.2	-67.9	-174.4	-83.7	0	0	112.9	W285 V418 S419 L431	W285-Q422 PolarHBondContact O-NE2 2.89Å; W285-Q422 PolarHBondContact O-OE1 2.94Å; V418-Q422 WeakPolarHBondContact O-CG 3.15Å; V418-Q422 PolarHBondContact O-N 3.34Å; V418-Q422 VanDerWaalsContact O-N 3.12Å; S419-Q422 PolarHBondContact O-N 3.01Å; Q422-L431 HydrophobicContact CG-CD2 4.11Å
423	E	67	Low	70.3	Confident	138 Å²	138	65.5 Å²	65.5	65%	0.645	34%	0.342	S	S	*	.	H	α-helix	trans	-66.1	-44.6	174.9	-71.5	176.3	-170.9	0	0	111.7	S419 M420 Q421 E425 N426	S419-E423 PolarHBondContact O-N 3.05Å; S419-E423 VanDerWaalsContact O-N 3.13Å; M420-E423 PolarHBondContact O-N 3.38Å; Q421-E423 VanDerWaalsContact C-N 3.33Å; Q421-E423 PolarHBondContact O-N 3.27Å; E423-E425 VanDerWaalsContact C-N 3.33Å; E423-E425 PolarHBondContact O-N 2.92Å; E423-N426 PolarHBondContact O-N 3.44Å; E423-N426 PolarHBondContact O-OD1 2.71Å
424	M	62.3	Low	69.4	Low	96 Å²	96	65.9 Å²	65.9	47%	0.473	35%	0.347	S	S	.	.	H	α-helix	trans	-65.9	-31.6	-178.1	-73.9	-177.6	67.8	0	0	113.8	M420 Q421	M420-M424 HydrophobicContact CE-SD 4.13Å; M420-M424 HydrophobicContact CG-CG 4.46Å; M420-M424 HydrophobicContact CG-SD 4.11Å; M420-M424 WeakPolarHBondContact O-CB 3.44Å; M420-M424 VanDerWaalsContact O-CG 3.3Å; M420-M424 WeakPolarHBondContact O-CG 3.3Å; M420-M424 PolarHBondContact O-N 3.43Å; M420-M424 HydrophobicContact SD-SD 4.41Å; Q421-M424 PolarHBondContact O-N 2.88Å
425	E	60.5	Low	68.3	Low	51 Å²	51	71.2 Å²	71.2	24%	0.238	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-1.7	-177.3	-73.6	-170.9	-160.2	0	0	114.9	Q421 E423 G427 A428 H430 L431	Q421-E425 PolarHBondContact O-N 3.12Å; Q421-E425 VanDerWaalsContact O-N 3.09Å; E423-E425 VanDerWaalsContact C-N 3.33Å; E423-E425 PolarHBondContact O-N 2.92Å; E425-G427 PolarHBondContact O-N 3.46Å; E425-A428 PolarHBondContact O-N 3.27Å; E425-A428 VanDerWaalsContact O-N 3.15Å; E425-H430 WeakPolarHBondContact OE1-CB 3.48Å; E425-H430 WeakPolarHBondContact OE2-CA 3.34Å; E425-H430 WeakPolarHBondContact OE2-CB 3.41Å; E425-H430 PolarHBondContact OE2-N 3.38Å; E425-L431 PolarHBondContact OE2-N 2.89Å
426	N	53.4	Low	67.2	Low	123 Å²	123	79.8 Å²	79.8	66%	0.658	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.7	32.5	-173.9	-79.7	1.2	0	0	0	112.9	E423 A428	E423-N426 PolarHBondContact O-N 3.44Å; E423-N426 PolarHBondContact O-OD1 2.71Å; N426-A428 VanDerWaalsContact C-N 3.29Å; N426-A428 PolarHBondContact O-N 2.92Å
427	G	47.8	Very low	66.7	Low	46 Å²	46	79.8 Å²	79.8	47%	0.474	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.7	4.3	179	0	0	0	0	0	117.8	E425 L431	E425-G427 PolarHBondContact O-N 3.46Å; G427-L431 WeakPolarHBondContact O-CD1 3.38Å
428	A	48.5	Very low	66.6	Low	77 Å²	77	78.9 Å²	78.9	64%	0.636	41%	0.41	S	S	*	.	S	Bend	trans	-112.9	-21.3	-157	0	0	0	0	0	118.8	E425 N426	E425-A428 PolarHBondContact O-N 3.27Å; E425-A428 VanDerWaalsContact O-N 3.15Å; N426-A428 VanDerWaalsContact C-N 3.29Å; N426-A428 PolarHBondContact O-N 2.92Å
429	K	50.4	Low	66.6	Low	148 Å²	148	79.4 Å²	79.4	64%	0.643	41%	0.412	S	S	*	.	S	Bend	trans	-122.7	-42.9	-171.1	-82.3	-163.3	170.5	-165.6	0	118.5
430	H	51.9	Low	66.9	Low	80 Å²	80	77.6 Å²	77.6	37%	0.37	40%	0.399	S	S	.	.			trans	-128	17.4	-172.3	-49.1	-80.1	0	0	0	116.3	E425 K432	E425-H430 WeakPolarHBondContact OE1-CB 3.48Å; E425-H430 WeakPolarHBondContact OE2-CA 3.34Å; E425-H430 WeakPolarHBondContact OE2-CB 3.41Å; E425-H430 PolarHBondContact OE2-N 3.38Å; H430-K432 CarbonylContact O-C 3.5Å; H430-K432 PolarHBondContact O-N 3.28Å
431	L	54.5	Low	67.4	Low	43 Å²	43	75.4 Å²	75.4	23%	0.225	39%	0.389	C	S	.	.			trans	-51.1	-12.8	173.1	-72.6	178.3	0	0	0	116	P284 Q422 E425 G427	P284-L431 HydrophobicContact CB-CD1 4.07Å; P284-L431 HydrophobicContact CG-CD1 4.47Å; Q422-L431 HydrophobicContact CG-CD2 4.11Å; E425-L431 PolarHBondContact OE2-N 2.89Å; G427-L431 WeakPolarHBondContact O-CD1 3.38Å
432	K	66.9	Low	68.2	Low	164 Å²	164	75 Å²	75	71%	0.713	39%	0.387	S	S	*	.	S	Bend	trans	-92.3	94.8	173.1	-72.4	-174.8	177.6	-179.5	0	111.4	N282 H430	N282-K432 VanDerWaalsContact OD1-CA 3.26Å; N282-K432 WeakPolarHBondContact OD1-CA 3.47Å; H430-K432 CarbonylContact O-C 3.5Å; H430-K432 PolarHBondContact O-N 3.28Å
433	H	70.1	Confident	69.2	Low	11 Å²	11	73.2 Å²	73.2	5%	0.051	38%	0.379	C	S	.	.			trans	-63.7	142.7	172.5	55.9	-109	0	0	0	111.2	A271 N282 W285 H437 L439	A271-H433 VanDerWaalsContact CA-CD2 3.42Å; A271-H433 WeakPolarHBondContact CA-CD2 3.38Å; A271-H433 WeakPolarHBondContact CA-NE2 3.46Å; A271-H433 PolarHBondContact N-NE2 3.28Å; N282-H433 PolarHBondContact ND2-O 2.9Å; N282-H433 PolarHBondContact OD1-CD2 3.38Å; N282-H433 PolarHBondContact OD1-CE1 3.17Å; N282-H433 VanDerWaalsContact OD1-CE1 3.29Å; N282-H433 PolarHBondContact OD1-N 2.82Å; N282-H433 PolarHBondContact OD1-ND1 3.15Å; N282-H433 PolarHBondContact OD1-NE2 3.18Å; W285-H433 AromaticContact NE1-ND1 4Å; H433-H437 CarbonylContact C-O 3.52Å; H433-H437 VanDerWaalsContact CA-O 3.24Å; H433-H437 WeakPolarHBondContact CA-O 3.4Å; H433-L439 HydrophobicContact CB-CB 4.26Å
434	S	73.2	Confident	70.5	Confident	44 Å²	44	66.8 Å²	66.8	31%	0.308	35%	0.349	S	S	.	.			trans	-152.7	175.8	-172.2	67.9	0	0	0	0	111.2	K436 H437	S434-K436 PolarHBondContact O-N 3.19Å; S434-K436 VanDerWaalsContact O-N 3.14Å; S434-K436 PolarHBondContact OG-N 3.31Å; S434-H437 PolarHBondContact N-O 2.9Å; S434-H437 CarbonylContact O-C 3.32Å; S434-H437 PolarHBondContact O-N 3.22Å; S434-H437 VanDerWaalsContact O-N 3.13Å; S434-H437 VanDerWaalsContact O-O 3.06Å; S434-H437 PolarHBondContact OG-N 3.45Å
435	N	69.7	Low	71.9	Confident	118 Å²	118	63.5 Å²	63.5	63%	0.631	33%	0.334	S	S	*	.	S	Bend	trans	-60	-22.4	172.9	-69	-15.5	0	0	0	113.3
436	K	68.8	Low	73	Confident	184 Å²	184	63.4 Å²	63.4	80%	0.8	33%	0.333	S	S	*	.	S	Bend	trans	-87.3	-31.8	174.9	-70	-171.4	176.1	-173.2	0	112.9	S434	S434-K436 PolarHBondContact O-N 3.19Å; S434-K436 VanDerWaalsContact O-N 3.14Å; S434-K436 PolarHBondContact OG-N 3.31Å
437	H	76.5	Confident	74.3	Confident	97 Å²	97	62.2 Å²	62.2	45%	0.449	33%	0.332	S	S	.	.	S	Bend	trans	-127.8	82.2	-178.3	-58.6	-82.9	0	0	0	108.7	H433 S434	H433-H437 CarbonylContact C-O 3.52Å; H433-H437 VanDerWaalsContact CA-O 3.24Å; H433-H437 WeakPolarHBondContact CA-O 3.4Å; S434-H437 PolarHBondContact N-O 2.9Å; S434-H437 CarbonylContact O-C 3.32Å; S434-H437 PolarHBondContact O-N 3.22Å; S434-H437 VanDerWaalsContact O-N 3.13Å; S434-H437 VanDerWaalsContact O-O 3.06Å; S434-H437 PolarHBondContact OG-N 3.45Å
438	P	84	Confident	75.8	Confident	36 Å²	36	68.1 Å²	68.1	23%	0.234	35%	0.345	C	S	.	.			trans	-66.3	152.6	-179.5	28.7	-35.2	0	0	0	111.2	F440	P438-F440 WeakPolarHBondContact CG-O 3.48Å; P438-F440 PolarHBondContact O-N 2.95Å
439	L	85.6	Confident	77.2	Confident	16 Å²	16	68 Å²	68	8%	0.084	34%	0.344	C	S	.	.	S	Bend	trans	-59.1	-29.8	177.9	178	65.9	0	0	0	112.7	F266 S267 W285 M293 V418 H433	F266-L439 HydrophobicContact CE1-CD2 4.42Å; S267-L439 VanDerWaalsContact OG-CB 3.29Å; S267-L439 WeakPolarHBondContact OG-CB 3.21Å; S267-L439 PolarHBondContact OG-N 3.5Å; W285-L439 HydrophobicContact CH2-CD1 4.22Å; W285-L439 HydrophobicContact CH2-CD2 3.56Å; W285-L439 HydrophobicContact CZ2-CD1 3.43Å; W285-L439 VanDerWaalsContact CZ2-CD1 3.43Å; W285-L439 HydrophobicContact CZ2-CD2 3.45Å; W285-L439 VanDerWaalsContact CZ2-CD2 3.45Å; W285-L439 HydrophobicContact CZ2-CG 4.08Å; M293-L439 HydrophobicContact SD-CD2 4.47Å; V418-L439 HydrophobicContact CG1-CD1 4.45Å; V418-L439 HydrophobicContact CG2-CD1 3.91Å; V418-L439 HydrophobicContact CG2-CG 4.27Å; H433-L439 HydrophobicContact CB-CB 4.26Å
440	F	89.7	Confident	78.8	Confident	5 Å²	5	61.6 Å²	61.6	2%	0.022	32%	0.318	C	S	.	.	S	Bend	trans	-125.1	146.8	-179.3	-55.2	-49.7	0	0	0	110.2	L263 F266 M293 L297 L414 V418 P438 Q442	L263-F440 HydrophobicContact CB-CD2 3.97Å; L263-F440 HydrophobicContact CB-CE2 4.49Å; L263-F440 HydrophobicContact CD2-CD2 4.02Å; L263-F440 HydrophobicContact CD2-CE2 3.73Å; F266-F440 AromaticContact CD1-CE2 3.81Å; F266-F440 HydrophobicContact CD1-CE2 3.81Å; F266-F440 HydrophobicContact CE1-CE2 4.12Å; F266-F440 HydrophobicContact CE1-CZ 4.4Å; M293-F440 HydrophobicContact CE-CZ 4.42Å; M293-F440 HydrophobicContact SD-CE1 4.03Å; M293-F440 HydrophobicContact SD-CZ 3.61Å; L297-F440 HydrophobicContact CD1-CZ 4.43Å; L414-F440 HydrophobicContact CB-CD1 4.37Å; L414-F440 HydrophobicContact CB-CE1 3.87Å; L414-F440 HydrophobicContact CB-CZ 4.27Å; L414-F440 HydrophobicContact CD2-CB 4.16Å; L414-F440 HydrophobicContact CD2-CD1 3.51Å; L414-F440 HydrophobicContact CD2-CD2 4.22Å; L414-F440 HydrophobicContact CD2-CE1 3.82Å; L414-F440 HydrophobicContact CD2-CE2 4.45Å; L414-F440 HydrophobicContact CD2-CG 3.72Å; L414-F440 HydrophobicContact CD2-CZ 4.27Å; L414-F440 HydrophobicContact CG-CD1 4.49Å; L414-F440 HydrophobicContact CG-CE1 4.34Å; V418-F440 HydrophobicContact CG2-CD1 4.21Å; V418-F440 HydrophobicContact CG2-CE1 3.77Å; P438-F440 WeakPolarHBondContact CG-O 3.48Å; P438-F440 PolarHBondContact O-N 2.95Å; F440-Q442 PolarHBondContact O-N 3.45Å
441	P	87.8	Confident	80.4	Confident	10 Å²	10	62.6 Å²	62.6	7%	0.065	33%	0.33	C	S	.	.			trans	-69.7	132.2	178.2	30.2	-32.9	0	0	0	109.7	Y417 Y443 R496 C500 T502	Y417-P441 HydrophobicContact CD2-CG 4.38Å; Y417-P441 HydrophobicContact CE1-CG 4.46Å; Y417-P441 HydrophobicContact CE2-CG 3.94Å; P441-Y443 HydrophobicContact CG-CD1 4.49Å; P441-Y443 HydrophobicContact CG-CE1 4.03Å; P441-Y443 PolarHBondContact O-N 3.27Å; P441-R496 PolarHBondContact O-NH1 3.47Å; P441-C500 HydrophobicContact CB-CB 4.19Å; P441-C500 HydrophobicContact CG-CB 4.47Å; P441-T502 HydrophobicContact CB-CG2 3.66Å
442	Q	91.1	Very high	82.1	Confident	45 Å²	45	65 Å²	65	21%	0.21	34%	0.339	C	S	.	.			trans	-74.4	119.8	172.6	-72.7	178.2	98.4	0	0	109.1	D260 H264 F440 F444 C500	D260-Q442 WeakPolarHBondContact OD1-CA 3.42Å; H264-Q442 PolarHBondContact ND1-OE1 3.12Å; F440-Q442 PolarHBondContact O-N 3.45Å; Q442-F444 VanDerWaalsContact C-N 3.27Å; Q442-C500 PolarHBondContact O-SG 2.97Å; Q442-C500 VanDerWaalsContact O-SG 3.4Å
443	Y	94.2	Very high	83.2	Confident	5 Å²	5	59.6 Å²	59.6	2%	0.02	31%	0.314	C	S	.	.	S	Bend	trans	-81.8	-7.3	178.6	-80	11.1	0	0	0	113.1	D260 P441 T472 Y493 R496 V498 C500	D260-Y443 VanDerWaalsContact CG-N 3.28Å; D260-Y443 PolarHBondContact OD1-N 3.44Å; D260-Y443 PolarHBondContact OD2-N 2.95Å; P441-Y443 HydrophobicContact CG-CD1 4.49Å; P441-Y443 HydrophobicContact CG-CE1 4.03Å; P441-Y443 PolarHBondContact O-N 3.27Å; Y443-T472 VanDerWaalsContact C-OG1 3.22Å; Y443-T472 VanDerWaalsContact CA-OG1 3.31Å; Y443-T472 WeakPolarHBondContact CA-OG1 3.42Å; Y443-T472 PolarHBondContact O-N 3.38Å; Y443-T472 PolarHBondContact O-OG1 2.84Å; Y443-Y493 AromaticContact CD2-CD1 3.66Å; Y443-Y493 HydrophobicContact CD2-CD1 3.66Å; Y443-Y493 HydrophobicContact CD2-CG 4.37Å; Y443-Y493 HydrophobicContact CE2-CD1 4.12Å; Y443-Y493 WeakPolarHBondContact CE2-O 3.21Å; Y443-Y493 HydrophobicContact CG-CD1 4.21Å; Y443-R496 VanDerWaalsContact CD2-NH1 3.25Å; Y443-R496 VanDerWaalsContact CE2-CD 3.41Å; Y443-R496 VanDerWaalsContact OH-C 3.22Å; Y443-R496 VanDerWaalsContact OH-CA 3.24Å; Y443-R496 WeakPolarHBondContact OH-CA 3.3Å; Y443-R496 PolarHBondContact OH-O 3.18Å; Y443-V498 HydrophobicContact CE2-CB 4.26Å; Y443-V498 PolarHBondContact OH-N 3.49Å; Y443-V498 PolarHBondContact OH-O 3.03Å; Y443-C500 HydrophobicContact CD1-CB 3.46Å; Y443-C500 VanDerWaalsContact CD1-CB 3.46Å; Y443-C500 HydrophobicContact CE1-CB 3.35Å
444	F	94.8	Very high	84.3	Confident	4 Å²	4	62.6 Å²	62.6	2%	0.018	33%	0.327	C	S	.	.	B	Isolated β-bridge	trans	-134.5	140.5	179.2	-62.8	-97.2	0	0	0	111.1	L247 L253 A256 Y257 D260 Q442 I469 M470 L471	L247-F444 HydrophobicContact CD2-CE1 4.04Å; L253-F444 HydrophobicContact CB-CE1 4.19Å; L253-F444 HydrophobicContact CB-CZ 4.14Å; A256-F444 HydrophobicContact CB-CE2 4.25Å; A256-F444 HydrophobicContact CB-CZ 4.22Å; Y257-F444 VanDerWaalsContact CA-CE2 3.41Å; Y257-F444 HydrophobicContact CD2-CB 3.83Å; Y257-F444 HydrophobicContact CD2-CD1 4.13Å; Y257-F444 AromaticContact CD2-CD2 3.99Å; Y257-F444 HydrophobicContact CD2-CD2 3.99Å; Y257-F444 AromaticContact CD2-CG 3.72Å; Y257-F444 HydrophobicContact CD2-CG 3.72Å; Y257-F444 HydrophobicContact CE2-CB 4.31Å; D260-F444 HydrophobicContact CB-CD2 3.98Å; D260-F444 HydrophobicContact CB-CE2 4.37Å; D260-F444 PolarHBondContact OD2-N 3.01Å; Q442-F444 VanDerWaalsContact C-N 3.27Å; F444-I469 HydrophobicContact CB-CG2 4.04Å; F444-I469 HydrophobicContact CD1-CG2 4.06Å; F444-I469 HydrophobicContact CG-CG2 4.39Å; F444-M470 CarbonylContact C-O 3.31Å; F444-M470 VanDerWaalsContact CA-O 3.26Å; F444-M470 WeakPolarHBondContact CA-O 3.38Å; F444-L471 HydrophobicContact CD1-CD1 4.06Å; F444-L471 HydrophobicContact CE1-CB 4.38Å; F444-L471 HydrophobicContact CE1-CD1 3.44Å; F444-L471 VanDerWaalsContact CE1-CD1 3.44Å; F444-L471 HydrophobicContact CE2-CD1 4.09Å; F444-L471 HydrophobicContact CZ-CD1 3.45Å; F444-L471 VanDerWaalsContact CZ-CD1 3.45Å
445	T	90.7	Very high	85.1	Confident	27 Å²	27	63.2 Å²	63.2	17%	0.166	33%	0.325	C	S	.	.			trans	-77.2	150.9	164.7	64.5	0	0	0	0	110.1	T232 I469 M470 T472 V505	T232-T445 HydrophobicContact CG2-CG2 3.46Å; T232-T445 VanDerWaalsContact CG2-CG2 3.46Å; T445-I469 WeakPolarHBondContact O-CA 3.37Å; T445-M470 PolarHBondContact N-O 3.32Å; T445-M470 WeakPolarHBondContact OG1-CB 3.33Å; T445-M470 PolarHBondContact OG1-N 2.83Å; T445-M470 PolarHBondContact OG1-O 3.42Å; T445-T472 HydrophobicContact CG2-CG2 4.2Å; T445-V505 HydrophobicContact CG2-CG2 3.95Å
446	Q	84.7	Confident	86.2	Confident	48 Å²	48	57.7 Å²	57.7	22%	0.224	30%	0.296	C	S	.	.			trans	-136.6	139.5	174.4	59.8	177.7	-8.1	0	0	109.7	R261 K448	R261-Q446 VanDerWaalsContact NH1-CD 3.32Å; Q446-K448 VanDerWaalsContact C-N 3.31Å; Q446-K448 PolarHBondContact O-N 3.14Å; Q446-K448 PolarHBondContact OE1-O 3.45Å
447	P	78.9	Confident	87.3	Confident	98 Å²	98	50.2 Å²	50.2	64%	0.636	26%	0.264	S	S	*	.	S	Bend	trans	-70.9	-26.2	177.5	-20.6	33.1	0	0	0	113.9	Y468	P447-Y468 VanDerWaalsContact CG-CB 3.5Å; P447-Y468 HydrophobicContact CG-CG 4.48Å
448	K	80.2	Confident	88	Confident	171 Å²	171	52.1 Å²	52.1	74%	0.743	27%	0.273	S	S	*	.	S	Bend	trans	-137.5	137.8	-173.9	-173	-178.8	177.7	-175.1	0	109.7	Q446	Q446-K448 VanDerWaalsContact C-N 3.31Å; Q446-K448 PolarHBondContact O-N 3.14Å; Q446-K448 PolarHBondContact OE1-O 3.45Å
449	A	76.9	Confident	88.3	Confident	74 Å²	74	52 Å²	52	61%	0.612	27%	0.271	S	S	*	.			trans	-74.7	133.1	170.1	0	0	0	0	0	111.2
450	S	85.1	Confident	88.5	Confident	13 Å²	13	51.2 Å²	51.2	9%	0.091	27%	0.267	C	S	.	.			trans	-93.3	163.8	173.6	48	0	0	0	0	112.5	R261 H265 R268 D456	R261-S450 PolarHBondContact NH2-OG 3.38Å; R261-S450 VanDerWaalsContact NH2-OG 3.09Å; H265-S450 PolarHBondContact CE1-OG 3Å; H265-S450 PolarHBondContact NE2-OG 2.87Å; R268-S450 PolarHBondContact NH1-O 3.39Å; S450-D456 WeakPolarHBondContact CB-OD1 3.43Å; S450-D456 PolarHBondContact OG-OD1 3.26Å; S450-D456 PolarHBondContact OG-OD2 2.74Å
451	T	85.1	Confident	88.5	Confident	101 Å²	101	53.7 Å²	53.7	62%	0.62	28%	0.279	S	S	*	.	S	Bend	trans	-91.1	-29.1	176.2	74	0	0	0	0	112.7	E455	T451-E455 PolarHBondContact N-OE2 3.07Å; T451-E455 VanDerWaalsContact OG1-CD 3.29Å; T451-E455 PolarHBondContact OG1-OE1 3.29Å; T451-E455 PolarHBondContact OG1-OE2 3.18Å; T451-E455 VanDerWaalsContact OG1-OE2 3.1Å
452	K	90	Very high	88.6	Confident	95 Å²	95	54.6 Å²	54.6	41%	0.413	29%	0.285	S	S	.	.	S	Bend	trans	-147.8	161.5	-176.6	66.1	-179.1	177.4	171.2	0	110.8	H265 E454 E455	H265-K452 PolarHBondContact CE1-N 3.23Å; H265-K452 VanDerWaalsContact NE2-C 3.27Å; H265-K452 PolarHBondContact NE2-O 3.4Å; K452-E454 VanDerWaalsContact C-N 3.31Å; K452-E454 VanDerWaalsContact CB-OE2 3.23Å; K452-E454 WeakPolarHBondContact CB-OE2 3.13Å; K452-E454 HydrophobicContact CD-CB 4.31Å; K452-E454 WeakPolarHBondContact CD-OE2 3.25Å; K452-E454 HydrophobicContact CG-CB 4.4Å; K452-E454 WeakPolarHBondContact CG-OE2 3.12Å; K452-E454 PolarHBondContact O-N 3.22Å; K452-E455 HydrophobicContact CD-CG 4.39Å; K452-E455 WeakPolarHBondContact CE-OE1 3.43Å; K452-E455 HydrophobicContact CG-CB 4.35Å; K452-E455 HydrophobicContact CG-CG 3.82Å; K452-E455 PolarHBondContact O-N 3.45Å
453	W	91.1	Very high	88.3	Confident	50 Å²	50	56.1 Å²	56.1	19%	0.189	30%	0.301	C	S	.	.	H	α-helix	trans	-75.3	-21.2	-174.4	63.5	-85.7	0	0	0	112.8	L258 V262 H265 T305 E455 D456 E457	L258-W453 HydrophobicContact CD1-CE3 3.86Å; L258-W453 HydrophobicContact CD1-CZ3 4.22Å; V262-W453 HydrophobicContact CG2-CB 4.11Å; V262-W453 HydrophobicContact CG2-CD2 3.9Å; V262-W453 HydrophobicContact CG2-CE3 3.99Å; V262-W453 HydrophobicContact CG2-CG 3.95Å; H265-W453 PolarHBondContact CD2-N 2.96Å; H265-W453 PolarHBondContact NE2-N 3.39Å; T305-W453 HydrophobicContact CG2-CD2 4.25Å; T305-W453 HydrophobicContact CG2-CE3 4.35Å; T305-W453 HydrophobicContact CG2-CH2 3.98Å; T305-W453 HydrophobicContact CG2-CZ2 3.85Å; T305-W453 HydrophobicContact CG2-CZ3 4.22Å; W453-E455 VanDerWaalsContact C-N 3.33Å; W453-E455 PolarHBondContact O-N 3.02Å; W453-D456 WeakPolarHBondContact O-CA 3.28Å; W453-D456 VanDerWaalsContact O-CB 3.32Å; W453-D456 WeakPolarHBondContact O-CB 3.32Å; W453-D456 PolarHBondContact O-N 3.2Å; W453-D456 VanDerWaalsContact O-N 3.1Å; W453-E457 WeakPolarHBondContact CZ3-OE2 3.48Å; W453-E457 PolarHBondContact O-N 2.74Å
454	E	92.1	Very high	87.9	Confident	73 Å²	73	62.8 Å²	62.8	34%	0.341	33%	0.333	S	S	.	.	H	α-helix	trans	-66.2	-35.5	176	-58.8	86.1	163.3	0	0	111.4	K452 D456 E457 E458	K452-E454 VanDerWaalsContact C-N 3.31Å; K452-E454 VanDerWaalsContact CB-OE2 3.23Å; K452-E454 WeakPolarHBondContact CB-OE2 3.13Å; K452-E454 HydrophobicContact CD-CB 4.31Å; K452-E454 WeakPolarHBondContact CD-OE2 3.25Å; K452-E454 HydrophobicContact CG-CB 4.4Å; K452-E454 WeakPolarHBondContact CG-OE2 3.12Å; K452-E454 PolarHBondContact O-N 3.22Å; E454-D456 VanDerWaalsContact C-N 3.25Å; E454-D456 PolarHBondContact O-N 2.57Å; E454-E457 PolarHBondContact O-N 3.48Å; E454-E458 PolarHBondContact O-N 2.95Å
455	E	91.1	Very high	87.6	Confident	57 Å²	57	67.8 Å²	67.8	27%	0.266	35%	0.354	S	S	.	.	H	α-helix	trans	-65.4	-30.9	171.4	-73.2	163.9	-171.3	0	0	112	T451 K452 W453 T459	T451-E455 PolarHBondContact N-OE2 3.07Å; T451-E455 VanDerWaalsContact OG1-CD 3.29Å; T451-E455 PolarHBondContact OG1-OE1 3.29Å; T451-E455 PolarHBondContact OG1-OE2 3.18Å; T451-E455 VanDerWaalsContact OG1-OE2 3.1Å; K452-E455 HydrophobicContact CD-CG 4.39Å; K452-E455 WeakPolarHBondContact CE-OE1 3.43Å; K452-E455 HydrophobicContact CG-CB 4.35Å; K452-E455 HydrophobicContact CG-CG 3.82Å; K452-E455 PolarHBondContact O-N 3.45Å; W453-E455 VanDerWaalsContact C-N 3.33Å; W453-E455 PolarHBondContact O-N 3.02Å; E455-T459 WeakPolarHBondContact O-CB 3.32Å; E455-T459 PolarHBondContact O-N 2.88Å; E455-T459 VanDerWaalsContact O-N 3.08Å; E455-T459 PolarHBondContact O-OG1 2.94Å
456	D	92.1	Very high	87.6	Confident	3 Å²	3	68.4 Å²	68.4	2%	0.016	35%	0.354	C	S	.	.	H	α-helix	trans	-72.2	-37.4	175.8	-64.2	-41.1	0	0	0	110.8	Y257 R261 H265 S450 W453 E454 T459 M460	Y257-D456 HydrophobicContact CE1-CB 4.19Å; Y257-D456 WeakPolarHBondContact CE1-O 3.34Å; R261-D456 HydrophobicContact CB-CB 3.93Å; R261-D456 HydrophobicContact CG-CB 3.76Å; R261-D456 IonicContact CZ-OD1 2.93Å; R261-D456 IonicContact CZ-OD2 3.24Å; R261-D456 VanDerWaalsContact NE-CG 3.26Å; R261-D456 IonicContact NE-OD1 2.79Å; R261-D456 IonicContact NE-OD2 2.68Å; R261-D456 PolarHBondContact NE-OD2 3.49Å; R261-D456 IonicContact NH2-OD1 2.85Å; R261-D456 PolarHBondContact NH2-OD1 3.21Å; R261-D456 IonicContact NH2-OD2 2.69Å; R261-D456 PolarHBondContact NH2-OD2 3.44Å; H265-D456 IonicContact CD2-OD2 2.69Å; H265-D456 PolarHBondContact CD2-OD2 3.01Å; H265-D456 IonicContact NE2-OD2 2.72Å; H265-D456 PolarHBondContact NE2-OD2 2.66Å; S450-D456 WeakPolarHBondContact CB-OD1 3.43Å; S450-D456 PolarHBondContact OG-OD1 3.26Å; S450-D456 PolarHBondContact OG-OD2 2.74Å; W453-D456 WeakPolarHBondContact O-CA 3.28Å; W453-D456 VanDerWaalsContact O-CB 3.32Å; W453-D456 WeakPolarHBondContact O-CB 3.32Å; W453-D456 PolarHBondContact O-N 3.2Å; W453-D456 VanDerWaalsContact O-N 3.1Å; E454-D456 VanDerWaalsContact C-N 3.25Å; E454-D456 PolarHBondContact O-N 2.57Å; D456-T459 CarbonylContact O-C 3.56Å; D456-T459 WeakPolarHBondContact O-CB 3.44Å; D456-T459 PolarHBondContact O-N 2.7Å; D456-M460 PolarHBondContact O-N 2.74Å
457	E	92.3	Very high	88	Confident	27 Å²	27	69 Å²	69	13%	0.126	36%	0.356	C	S	.	.	H	α-helix	trans	-66.3	-41.6	174.2	-164	175	165.5	0	0	112.1	L258 R353 W453 E454 T459 M460 H461	L258-E457 HydrophobicContact CD1-CB 3.87Å; L258-E457 HydrophobicContact CD1-CG 4.04Å; R353-E457 IonicContact CZ-OE1 2.74Å; R353-E457 VanDerWaalsContact CZ-OE1 3.29Å; R353-E457 IonicContact CZ-OE2 2.83Å; R353-E457 IonicContact NE-OE1 3.76Å; R353-E457 PolarHBondContact NE-OE1 3.39Å; R353-E457 IonicContact NE-OE2 2.61Å; R353-E457 VanDerWaalsContact NH2-CD 3.31Å; R353-E457 IonicContact NH2-OE1 2.68Å; R353-E457 PolarHBondContact NH2-OE1 3.17Å; R353-E457 IonicContact NH2-OE2 2.97Å; R353-E457 PolarHBondContact NH2-OE2 3.48Å; W453-E457 WeakPolarHBondContact CZ3-OE2 3.48Å; W453-E457 PolarHBondContact O-N 2.74Å; E454-E457 PolarHBondContact O-N 3.48Å; E457-T459 PolarHBondContact O-N 3.5Å; E457-M460 HydrophobicContact CG-CE 3.87Å; E457-M460 VanDerWaalsContact O-CB 3.29Å; E457-M460 WeakPolarHBondContact O-CB 3.24Å; E457-M460 PolarHBondContact O-N 2.85Å; E457-H461 PolarHBondContact O-CD2 3.38Å; E457-H461 PolarHBondContact O-N 3.38Å
458	E	90.1	Very high	88.7	Confident	137 Å²	137	68.2 Å²	68.2	64%	0.64	34%	0.34	S	S	*	.	H	α-helix	trans	-58.3	-38	169.8	-70.6	173	-163.7	0	0	111.6	E454 S462	E454-E458 PolarHBondContact O-N 2.95Å; E458-S462 PolarHBondContact O-N 3.42Å
459	T	89.7	Confident	89.3	Confident	32 Å²	32	60.1 Å²	60.1	20%	0.196	31%	0.305	C	S	.	.	H	α-helix	trans	-72.7	-32.1	178.3	-56.6	0	0	0	0	112.3	E455 D456 E457 H461 S462 K465 I469	E455-T459 WeakPolarHBondContact O-CB 3.32Å; E455-T459 PolarHBondContact O-N 2.88Å; E455-T459 VanDerWaalsContact O-N 3.08Å; E455-T459 PolarHBondContact O-OG1 2.94Å; D456-T459 CarbonylContact O-C 3.56Å; D456-T459 WeakPolarHBondContact O-CB 3.44Å; D456-T459 PolarHBondContact O-N 2.7Å; E457-T459 PolarHBondContact O-N 3.5Å; T459-H461 VanDerWaalsContact C-N 3.31Å; T459-H461 PolarHBondContact O-N 2.92Å; T459-S462 WeakPolarHBondContact O-CB 3.45Å; T459-S462 PolarHBondContact O-N 3.07Å; T459-K465 HydrophobicContact CG2-CB 3.74Å; T459-K465 HydrophobicContact CG2-CD 3.88Å; T459-K465 HydrophobicContact CG2-CG 4.47Å; T459-I469 HydrophobicContact CG2-CD1 3.78Å
460	M	91.5	Very high	90.2	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-58.7	-39.5	175.5	-179.1	170.2	83.8	0	0	112.5	L247 R254 Y257 L258 D456 E457 R466	L247-M460 HydrophobicContact CD1-CB 4.45Å; L247-M460 HydrophobicContact CD1-CG 4.12Å; R254-M460 HydrophobicContact CB-CE 4.25Å; R254-M460 HydrophobicContact CB-CG 3.99Å; R254-M460 HydrophobicContact CB-SD 3.56Å; R254-M460 VanDerWaalsContact CB-SD 3.56Å; R254-M460 HydrophobicContact CG-CG 3.69Å; R254-M460 HydrophobicContact CG-SD 3.99Å; R254-M460 VanDerWaalsContact O-SD 3.32Å; Y257-M460 HydrophobicContact CD1-CB 4.02Å; Y257-M460 HydrophobicContact CD1-CG 4.06Å; Y257-M460 HydrophobicContact CD1-SD 3.84Å; Y257-M460 HydrophobicContact CE1-CB 3.92Å; Y257-M460 HydrophobicContact CE1-CG 4.46Å; L258-M460 HydrophobicContact CB-SD 4.23Å; D456-M460 PolarHBondContact O-N 2.74Å; E457-M460 HydrophobicContact CG-CE 3.87Å; E457-M460 VanDerWaalsContact O-CB 3.29Å; E457-M460 WeakPolarHBondContact O-CB 3.24Å; E457-M460 PolarHBondContact O-N 2.85Å; M460-R466 WeakPolarHBondContact O-CB 3.5Å
461	H	89.3	Confident	90.7	Very high	57 Å²	57	56.5 Å²	56.5	26%	0.264	28%	0.275	S	S	.	.	H	α-helix	trans	-92.1	-8.6	178.6	-66.8	-82.2	0	0	0	113.7	N352 E457 T459 S463	N352-H461 PolarHBondContact OD1-CE1 3.41Å; N352-H461 PolarHBondContact OD1-ND1 3.22Å; E457-H461 PolarHBondContact O-CD2 3.38Å; E457-H461 PolarHBondContact O-N 3.38Å; T459-H461 VanDerWaalsContact C-N 3.31Å; T459-H461 PolarHBondContact O-N 2.92Å; H461-S463 PolarHBondContact O-N 2.92Å
462	S	89.2	Confident	91.1	Very high	29 Å²	29	51.8 Å²	51.8	20%	0.203	25%	0.245	C	C	.	.			trans	-70.4	113.1	178.7	179	0	0	0	0	111.9	E458 T459 E464 K465 R466	E458-S462 PolarHBondContact O-N 3.42Å; T459-S462 WeakPolarHBondContact O-CB 3.45Å; T459-S462 PolarHBondContact O-N 3.07Å; S462-E464 VanDerWaalsContact C-N 3.27Å; S462-E464 PolarHBondContact O-N 3.29Å; S462-K465 PolarHBondContact O-N 2.82Å; S462-K465 VanDerWaalsContact O-N 3.17Å; S462-R466 VanDerWaalsContact O-CB 3.24Å; S462-R466 WeakPolarHBondContact O-CB 3.27Å; S462-R466 WeakPolarHBondContact O-CD 3.48Å; S462-R466 WeakPolarHBondContact O-CG 3.31Å; S462-R466 PolarHBondContact O-N 2.89Å
463	S	84.2	Confident	91.1	Very high	78 Å²	78	47.2 Å²	47.2	55%	0.545	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.3	-39.7	178.9	51.4	0	0	0	0	113.8	H461	H461-S463 PolarHBondContact O-N 2.92Å
464	E	86.1	Confident	90.9	Very high	144 Å²	144	45 Å²	45	67%	0.673	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74	-34	-178.7	-62.5	-177.2	165.4	0	0	113.7	S462 K467 Y468	S462-E464 VanDerWaalsContact C-N 3.27Å; S462-E464 PolarHBondContact O-N 3.29Å; E464-K467 WeakPolarHBondContact O-CE 3.49Å; E464-Y468 WeakPolarHBondContact O-CE2 3.46Å
465	K	89.3	Confident	90.3	Very high	110 Å²	110	47.2 Å²	47.2	48%	0.478	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.6	-35.5	-167.6	-61	175.3	-172.8	165.6	0	113.5	T459 S462 K467 Y468	T459-K465 HydrophobicContact CG2-CB 3.74Å; T459-K465 HydrophobicContact CG2-CD 3.88Å; T459-K465 HydrophobicContact CG2-CG 4.47Å; S462-K465 PolarHBondContact O-N 2.82Å; S462-K465 VanDerWaalsContact O-N 3.17Å; K465-K467 PolarHBondContact O-N 2.92Å; K465-K467 VanDerWaalsContact O-N 3.09Å; K465-Y468 PolarHBondContact O-N 3.37Å
466	R	91.2	Very high	89.6	Confident	39 Å²	39	45.4 Å²	45.4	15%	0.147	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-57.2	-28.4	-171.4	71.5	-172	-178.3	168.3	4.1	114.3	L247 E248 R254 E350 M460 S462 Y468 I469	L247-R466 HydrophobicContact CB-CB 4.07Å; L247-R466 PolarHBondContact N-O 3.11Å; E248-R466 HydrophobicContact CB-CG 4.01Å; E248-R466 IonicContact OE1-CZ 2.65Å; E248-R466 IonicContact OE1-NE 3.87Å; E248-R466 PolarHBondContact OE1-NE 3.25Å; E248-R466 VanDerWaalsContact OE1-NE 3.17Å; E248-R466 IonicContact OE1-NH2 3.93Å; E248-R466 PolarHBondContact OE1-NH2 3.04Å; R254-R466 VanDerWaalsContact NH2-NH1 3.12Å; E350-R466 IonicContact OE2-NH1 3.68Å; E350-R466 PolarHBondContact OE2-NH1 3.41Å; M460-R466 WeakPolarHBondContact O-CB 3.5Å; S462-R466 VanDerWaalsContact O-CB 3.24Å; S462-R466 WeakPolarHBondContact O-CB 3.27Å; S462-R466 WeakPolarHBondContact O-CD 3.48Å; S462-R466 WeakPolarHBondContact O-CG 3.31Å; S462-R466 PolarHBondContact O-N 2.89Å; R466-Y468 VanDerWaalsContact C-N 3.29Å; R466-Y468 PolarHBondContact O-N 3.25Å; R466-I469 PolarHBondContact O-N 3.04Å
467	K	92.1	Very high	88.3	Confident	61 Å²	61	47.5 Å²	47.5	27%	0.265	23%	0.23	S	C	.	.	G	3₁₀ helix	trans	-67.7	-23.3	176.2	66.2	-174.3	179.6	178.8	0	114.4	P241 N246 E248 E464 K465	P241-K467 WeakPolarHBondContact CB-O 3.5Å; P241-K467 HydrophobicContact CG-CD 4.39Å; P241-K467 HydrophobicContact CG-CG 4.48Å; N246-K467 WeakPolarHBondContact CB-O 3.27Å; N246-K467 PolarHBondContact ND2-O 3.36Å; E248-K467 HydrophobicContact CB-CB 4.17Å; E464-K467 WeakPolarHBondContact O-CE 3.49Å; K465-K467 PolarHBondContact O-N 2.92Å; K465-K467 VanDerWaalsContact O-N 3.09Å
468	Y	92.9	Very high	86.7	Confident	81 Å²	81	54.6 Å²	54.6	32%	0.318	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-93.8	2.6	177.8	-54	-66.8	0	0	0	113.4	I238 P241 P447 E464 K465 R466	I238-Y468 HydrophobicContact CG2-CE1 4.35Å; P241-Y468 HydrophobicContact CB-CD1 4.39Å; P241-Y468 HydrophobicContact CG-CE1 4.38Å; P447-Y468 VanDerWaalsContact CG-CB 3.5Å; P447-Y468 HydrophobicContact CG-CG 4.48Å; E464-Y468 WeakPolarHBondContact O-CE2 3.46Å; K465-Y468 PolarHBondContact O-N 3.37Å; R466-Y468 VanDerWaalsContact C-N 3.29Å; R466-Y468 PolarHBondContact O-N 3.25Å
469	I	94.7	Very high	85.1	Confident	1 Å²	1	53.4 Å²	53.4	1%	0.005	26%	0.263	C	S	.	.			trans	-93.5	108.1	169.8	-64.7	166.5	0	0	0	107.3	N246 L247 Y257 F444 T445 T459 R466	N246-I469 VanDerWaalsContact CA-O 3.23Å; N246-I469 WeakPolarHBondContact CA-O 3.35Å; N246-I469 VanDerWaalsContact CB-O 3.25Å; N246-I469 WeakPolarHBondContact CB-O 3.38Å; L247-I469 HydrophobicContact CD1-CB 3.88Å; L247-I469 HydrophobicContact CD1-CD1 3.86Å; L247-I469 HydrophobicContact CD1-CG1 4.49Å; L247-I469 HydrophobicContact CD1-CG2 3.56Å; L247-I469 HydrophobicContact CG-CB 4.12Å; L247-I469 HydrophobicContact CG-CG2 3.9Å; Y257-I469 HydrophobicContact CD2-CG2 3.57Å; Y257-I469 HydrophobicContact CE1-CD1 4.25Å; Y257-I469 HydrophobicContact CE2-CD1 4.03Å; Y257-I469 HydrophobicContact CE2-CG1 4.41Å; Y257-I469 HydrophobicContact CE2-CG2 3.41Å; Y257-I469 VanDerWaalsContact CE2-CG2 3.41Å; Y257-I469 HydrophobicContact CG-CG2 4.41Å; Y257-I469 WeakPolarHBondContact OH-CD1 3.48Å; F444-I469 HydrophobicContact CB-CG2 4.04Å; F444-I469 HydrophobicContact CD1-CG2 4.06Å; F444-I469 HydrophobicContact CG-CG2 4.39Å; T445-I469 WeakPolarHBondContact O-CA 3.37Å; T459-I469 HydrophobicContact CG2-CD1 3.78Å; R466-I469 PolarHBondContact O-N 3.04Å
470	M	94.9	Very high	83.6	Confident	12 Å²	12	53.9 Å²	53.9	6%	0.059	27%	0.274	C	S	.	.	B	Isolated β-bridge	trans	-115.5	140.5	-169.7	-52.4	177.2	-176.6	0	0	111.5	L237 P241 A244 Y245 F444 T445 V505	L237-M470 HydrophobicContact CB-CE 4.14Å; L237-M470 HydrophobicContact CB-SD 4.16Å; L237-M470 HydrophobicContact CD1-SD 3.96Å; L237-M470 WeakPolarHBondContact O-CE 3.37Å; P241-M470 HydrophobicContact CB-CE 3.84Å; A244-M470 HydrophobicContact CB-CB 3.96Å; A244-M470 HydrophobicContact CB-CG 3.85Å; A244-M470 HydrophobicContact CB-SD 3.7Å; Y245-M470 CarbonylContact O-C 3.55Å; Y245-M470 WeakPolarHBondContact O-CA 3.37Å; F444-M470 CarbonylContact C-O 3.31Å; F444-M470 VanDerWaalsContact CA-O 3.26Å; F444-M470 WeakPolarHBondContact CA-O 3.38Å; T445-M470 PolarHBondContact N-O 3.32Å; T445-M470 WeakPolarHBondContact OG1-CB 3.33Å; T445-M470 PolarHBondContact OG1-N 2.83Å; T445-M470 PolarHBondContact OG1-O 3.42Å; M470-V505 HydrophobicContact CB-CG1 3.89Å; M470-V505 HydrophobicContact CB-CG2 4.4Å; M470-V505 HydrophobicContact SD-CG1 4.24Å
471	L	95	Very high	81.7	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	29%	0.287	C	S	.	.	B	Isolated β-bridge	trans	-68.8	134	177.3	-166.8	72.6	0	0	0	110.8	Y245 L253 F444 V486 Y493 V505 K506	Y245-L471 HydrophobicContact CG-CD2 4.48Å; Y245-L471 PolarHBondContact O-N 2.72Å; L253-L471 HydrophobicContact CD1-CB 4.46Å; L253-L471 HydrophobicContact CD1-CD1 4.19Å; L253-L471 HydrophobicContact CD1-CD2 3.94Å; L253-L471 HydrophobicContact CD1-CG 4.44Å; F444-L471 HydrophobicContact CD1-CD1 4.06Å; F444-L471 HydrophobicContact CE1-CB 4.38Å; F444-L471 HydrophobicContact CE1-CD1 3.44Å; F444-L471 VanDerWaalsContact CE1-CD1 3.44Å; F444-L471 HydrophobicContact CE2-CD1 4.09Å; F444-L471 HydrophobicContact CZ-CD1 3.45Å; F444-L471 VanDerWaalsContact CZ-CD1 3.45Å; L471-V486 HydrophobicContact CD2-CG1 3.6Å; L471-V486 HydrophobicContact CD2-CG2 4.02Å; L471-Y493 HydrophobicContact CD1-CD1 3.53Å; L471-Y493 HydrophobicContact CD1-CE1 3.65Å; L471-Y493 HydrophobicContact CD1-CG 4.11Å; L471-Y493 HydrophobicContact CD2-CD1 4.38Å; L471-Y493 HydrophobicContact CD2-CE1 3.92Å; L471-Y493 HydrophobicContact CD2-CE2 4.13Å; L471-Y493 HydrophobicContact CG-CD1 4.19Å; L471-Y493 HydrophobicContact CG-CE1 3.78Å; L471-V505 WeakPolarHBondContact O-CA 3.22Å; L471-K506 HydrophobicContact CB-CB 4.44Å; L471-K506 HydrophobicContact CD2-CB 4.34Å; L471-K506 PolarHBondContact O-N 2.88Å
472	T	93.4	Very high	79.8	Confident	1 Å²	1	54.6 Å²	54.6	1%	0.006	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	154.3	170.3	55.5	0	0	0	0	111.6	Y443 T445 Y493 C500 S504	Y443-T472 VanDerWaalsContact C-OG1 3.22Å; Y443-T472 VanDerWaalsContact CA-OG1 3.31Å; Y443-T472 WeakPolarHBondContact CA-OG1 3.42Å; Y443-T472 PolarHBondContact O-N 3.38Å; Y443-T472 PolarHBondContact O-OG1 2.84Å; T445-T472 HydrophobicContact CG2-CG2 4.2Å; T472-Y493 PolarHBondContact O-OH 3.18Å; T472-C500 PolarHBondContact OG1-SG 3.44Å; T472-S504 CarbonylContact C-O 3.53Å; T472-S504 WeakPolarHBondContact CA-O 3.27Å; T472-S504 VanDerWaalsContact CB-O 3.31Å; T472-S504 WeakPolarHBondContact CB-O 3.15Å
473	N	91.2	Very high	77.9	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	161.9	176.5	-170.5	38.1	0	0	0	111.5	S228 H229 W501 S504 K506 D541	S228-N473 PolarHBondContact OG-ND2 3.48Å; H229-N473 HydrophobicContact CB-CB 3.73Å; H229-N473 PolarHBondContact ND1-ND2 3.18Å; H229-N473 VanDerWaalsContact ND1-ND2 3.14Å; N473-W501 HydrophobicContact CB-CE3 4.48Å; N473-W501 VanDerWaalsContact ND2-CZ3 3.31Å; N473-W501 WeakPolarHBondContact ND2-CZ3 3.5Å; N473-W501 PolarHBondContact O-N 2.9Å; N473-S504 PolarHBondContact N-O 2.77Å; N473-K506 HydrophobicContact CB-CB 4.42Å; N473-K506 HydrophobicContact CB-CD 4.04Å; N473-K506 WeakPolarHBondContact OD1-CD 3.21Å; N473-K506 WeakPolarHBondContact OD1-CE 3.39Å; N473-K506 PolarHBondContact OD1-NZ 2.93Å; N473-D541 PolarHBondContact ND2-OD2 3.01Å
474	G	86.1	Confident	76.6	Confident	3 Å²	3	57.4 Å²	57.4	3%	0.031	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	172.1	177.8	175.4	0	0	0	0	0	111.2	H499	G474-H499 WeakPolarHBondContact CA-O 3.49Å
475	W	78.9	Confident	75.9	Confident	120 Å²	120	51.2 Å²	51.2	46%	0.455	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	158.2	-177.4	63.2	-82.7	0	0	0	111.4	P477 V498 H499 W501	W475-P477 HydrophobicContact CE3-CG 4.47Å; W475-P477 HydrophobicContact CH2-CG 4.28Å; W475-P477 HydrophobicContact CZ3-CB 4.15Å; W475-P477 HydrophobicContact CZ3-CG 3.88Å; W475-V498 CarbonylContact O-C 3.55Å; W475-V498 WeakPolarHBondContact O-CA 3.48Å; W475-H499 HydrophobicContact CD2-CB 4.07Å; W475-H499 AromaticContact CE2-CD2 3.61Å; W475-H499 AromaticContact CE2-CG 3.77Å; W475-H499 HydrophobicContact CG-CB 4.24Å; W475-H499 AromaticContact CH2-CD2 3.37Å; W475-H499 WeakPolarHBondContact CH2-CD2 3.35Å; W475-H499 AromaticContact CH2-NE2 3.74Å; W475-H499 HydrophobicContact CZ2-CB 3.96Å; W475-H499 AromaticContact CZ2-CD2 3.28Å; W475-H499 WeakPolarHBondContact CZ2-CD2 3.46Å; W475-H499 AromaticContact CZ2-CG 3.65Å; W475-H499 AromaticContact CZ2-NE2 3.9Å; W475-H499 AromaticContact CZ3-CD2 3.78Å; W475-H499 PolarHBondContact N-O 2.65Å; W475-H499 PolarHBondContact O-N 3.24Å; W475-W501 AromaticContact CD1-CZ2 3.74Å
476	V	76.5	Confident	75.5	Confident	18 Å²	18	46.3 Å²	46.3	11%	0.109	24%	0.236	C	C	.	.			trans	-109.7	129.7	179.2	175.6	0	0	0	0	109.5	E479 T485 A492 D497 V498	V476-E479 HydrophobicContact CB-CB 4.37Å; V476-E479 HydrophobicContact CG1-CB 3.95Å; V476-E479 HydrophobicContact CG1-CG 3.98Å; V476-T485 HydrophobicContact CG2-CG2 4.09Å; V476-A492 HydrophobicContact CG2-CB 4.11Å; V476-D497 HydrophobicContact CG1-CB 4.08Å; V476-D497 HydrophobicContact CG2-CB 4.4Å; V476-V498 HydrophobicContact CG2-CG2 3.94Å
477	P	65.1	Low	75	Confident	47 Å²	47	49.4 Å²	49.4	31%	0.305	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	138.2	173.3	-24.9	36.2	0	0	0	112.8	W475 E479 D497 H499	W475-P477 HydrophobicContact CE3-CG 4.47Å; W475-P477 HydrophobicContact CH2-CG 4.28Å; W475-P477 HydrophobicContact CZ3-CB 4.15Å; W475-P477 HydrophobicContact CZ3-CG 3.88Å; P477-E479 PolarHBondContact O-N 3.17Å; P477-D497 VanDerWaalsContact CD-O 3.23Å; P477-D497 WeakPolarHBondContact CD-O 3.42Å; P477-H499 WeakPolarHBondContact CG-CD2 3.43Å; P477-H499 WeakPolarHBondContact CG-NE2 3.45Å
478	N	59	Low	74.5	Confident	176 Å²	176	50.3 Å²	50.3	94%	0.941	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.3	-1	171.6	-49.9	-44.3	0	0	0	116.5
479	E	56.5	Low	74	Confident	113 Å²	113	55.6 Å²	55.6	53%	0.528	29%	0.289	S	S	.	.			trans	-95.8	131.5	165.9	-70.4	-148.7	153.9	0	0	111.2	V476 P477	V476-E479 HydrophobicContact CB-CB 4.37Å; V476-E479 HydrophobicContact CG1-CB 3.95Å; V476-E479 HydrophobicContact CG1-CG 3.98Å; P477-E479 PolarHBondContact O-N 3.17Å
480	G	58.2	Low	73.6	Confident	41 Å²	41	56.6 Å²	56.6	42%	0.423	30%	0.296	S	S	.	.			trans	-77.1	-48.3	-166.4	0	0	0	0	0	117.1
481	F	52	Low	73.3	Confident	61 Å²	61	59.4 Å²	59.4	27%	0.268	31%	0.306	S	S	.	.			trans	-116.5	146.1	-165.9	-96.6	-94.3	0	0	0	114.4	Q483 T484 K575 N576 I580	F481-Q483 VanDerWaalsContact C-N 3.3Å; F481-Q483 PolarHBondContact O-N 3.27Å; F481-T484 PolarHBondContact O-OG1 3.02Å; F481-K575 WeakPolarHBondContact CE2-O 3.45Å; F481-N576 HydrophobicContact CE2-CB 4.19Å; F481-N576 HydrophobicContact CZ-CB 4.43Å; F481-I580 HydrophobicContact CE1-CD1 3.78Å; F481-I580 HydrophobicContact CE1-CG1 3.84Å; F481-I580 HydrophobicContact CE2-CD1 4.17Å; F481-I580 HydrophobicContact CZ-CD1 3.42Å; F481-I580 VanDerWaalsContact CZ-CD1 3.42Å; F481-I580 HydrophobicContact CZ-CG1 3.46Å; F481-I580 VanDerWaalsContact CZ-CG1 3.46Å
482	P	50.3	Low	73	Confident	12 Å²	12	59.6 Å²	59.6	8%	0.078	31%	0.308	C	S	.	.	G	3₁₀ helix	trans	-57.1	-36.9	-177.3	4.8	-18.1	0	0	0	115.5	T484 T485 L543 S545	P482-T484 PolarHBondContact O-N 2.68Å; P482-T485 PolarHBondContact O-N 3.33Å; P482-T485 PolarHBondContact O-OG1 2.97Å; P482-L543 WeakPolarHBondContact CA-O 3.41Å; P482-L543 WeakPolarHBondContact CB-O 3.24Å; P482-L543 WeakPolarHBondContact CD-O 3.34Å; P482-L543 VanDerWaalsContact CG-C 3.44Å; P482-L543 VanDerWaalsContact CG-O 3.29Å; P482-L543 WeakPolarHBondContact CG-O 3.44Å; P482-S545 WeakPolarHBondContact CG-O 3.2Å
483	Q	48.9	Very low	72.9	Confident	89 Å²	89	59.8 Å²	59.8	42%	0.416	31%	0.308	S	S	.	.	G	3₁₀ helix	trans	-64.6	-23.1	-159	-65.6	171.8	10.9	0	0	112	F481 E487 I547	F481-Q483 VanDerWaalsContact C-N 3.3Å; F481-Q483 PolarHBondContact O-N 3.27Å; Q483-E487 VanDerWaalsContact O-CD 3.22Å; Q483-E487 WeakPolarHBondContact O-CG 3.41Å; Q483-I547 VanDerWaalsContact NE2-CG2 3.28Å
484	T	56.6	Low	73	Confident	77 Å²	77	60.1 Å²	60.1	47%	0.472	31%	0.31	S	S	.	.	G	3₁₀ helix	trans	-89.3	-5	178.2	53.2	0	0	0	0	114.6	F481 P482 S490	F481-T484 PolarHBondContact O-OG1 3.02Å; P482-T484 PolarHBondContact O-N 2.68Å; T484-S490 WeakPolarHBondContact O-CB 3.2Å; T484-S490 PolarHBondContact O-OG 2.73Å; T484-S490 VanDerWaalsContact O-OG 3.09Å
485	T	71.5	Confident	73.4	Confident	14 Å²	14	64.3 Å²	64.3	9%	0.086	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-37.2	-170	60	0	0	0	0	114.7	V476 P482 S490 Y493	V476-T485 HydrophobicContact CG2-CG2 4.09Å; P482-T485 PolarHBondContact O-N 3.33Å; P482-T485 PolarHBondContact O-OG1 2.97Å; T485-S490 VanDerWaalsContact C-OG 3.29Å; T485-S490 VanDerWaalsContact O-CB 3.29Å; T485-S490 WeakPolarHBondContact O-CB 3.4Å; T485-S490 PolarHBondContact O-OG 2.99Å; T485-Y493 WeakPolarHBondContact O-CD2 3.34Å
486	V	80.1	Confident	74	Confident	7 Å²	7	59.3 Å²	59.3	4%	0.042	31%	0.306	C	S	.	.	S	Bend	trans	-116	-8.6	-176.6	-167.7	0	0	0	0	112.9	Y245 H252 L253 L471 Y493 K506	Y245-V486 HydrophobicContact CD1-CG1 3.43Å; Y245-V486 VanDerWaalsContact CD1-CG1 3.43Å; Y245-V486 HydrophobicContact CD2-CG1 4.21Å; Y245-V486 HydrophobicContact CE1-CB 4.29Å; Y245-V486 HydrophobicContact CE1-CG1 3.55Å; Y245-V486 HydrophobicContact CE2-CG1 4.29Å; Y245-V486 HydrophobicContact CG-CG1 3.79Å; H252-V486 PolarHBondContact NE2-O 2.91Å; L253-V486 HydrophobicContact CD1-CG1 4.27Å; L253-V486 HydrophobicContact CD2-CG1 4.45Å; L471-V486 HydrophobicContact CD2-CG1 3.6Å; L471-V486 HydrophobicContact CD2-CG2 4.02Å; V486-Y493 HydrophobicContact CG2-CE2 3.7Å; V486-K506 HydrophobicContact CG2-CG 4.42Å
487	E	81.5	Confident	74.5	Confident	103 Å²	103	59.6 Å²	59.6	48%	0.481	31%	0.306	S	S	.	.	S	Bend	trans	-60.2	156.5	179.3	-88.6	-171.4	-177.6	0	0	113.2	Q483 K489 S490	Q483-E487 VanDerWaalsContact O-CD 3.22Å; Q483-E487 WeakPolarHBondContact O-CG 3.41Å; E487-K489 PolarHBondContact O-N 2.94Å; E487-S490 WeakPolarHBondContact O-CA 3.34Å; E487-S490 WeakPolarHBondContact O-CB 3.26Å; E487-S490 PolarHBondContact O-N 3.14Å
488	P	81.8	Confident	75.6	Confident	81 Å²	81	57.7 Å²	57.7	53%	0.526	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-20.8	179.5	-27.8	36	0	0	0	116.1	H252	H252-P488 HydrophobicContact CB-CB 4.46Å
489	K	82.6	Confident	76.8	Confident	192 Å²	192	51.8 Å²	51.8	84%	0.835	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-19.8	173.8	-67	-178.3	178.3	178.5	0	113.3	E487	E487-K489 PolarHBondContact O-N 2.94Å
490	S	85.4	Confident	78.2	Confident	22 Å²	22	47.3 Å²	47.3	15%	0.154	24%	0.242	C	C	.	.			trans	-63	146	177.6	-173.9	0	0	0	0	111.6	T484 T485 E487 A492	T484-S490 WeakPolarHBondContact O-CB 3.2Å; T484-S490 PolarHBondContact O-OG 2.73Å; T484-S490 VanDerWaalsContact O-OG 3.09Å; T485-S490 VanDerWaalsContact C-OG 3.29Å; T485-S490 VanDerWaalsContact O-CB 3.29Å; T485-S490 WeakPolarHBondContact O-CB 3.4Å; T485-S490 PolarHBondContact O-OG 2.99Å; E487-S490 WeakPolarHBondContact O-CA 3.34Å; E487-S490 WeakPolarHBondContact O-CB 3.26Å; E487-S490 PolarHBondContact O-N 3.14Å; S490-A492 PolarHBondContact OG-N 2.98Å
491	R	87.8	Confident	79.6	Confident	70 Å²	70	49.1 Å²	49.1	26%	0.264	24%	0.236	S	C	.	.			trans	-120.5	7.2	162.7	-59.8	-62.7	178.9	-161.2	3.6	112.8	Y493 F494 R495	R491-Y493 PolarHBondContact O-N 3.03Å; R491-F494 CarbonylContact O-C 3.48Å; R491-F494 WeakPolarHBondContact O-CA 3.47Å; R491-F494 WeakPolarHBondContact O-CB 3.27Å; R491-F494 PolarHBondContact O-N 2.74Å; R491-R495 HydrophobicContact CB-CG 4.18Å; R491-R495 WeakPolarHBondContact O-CB 3.37Å; R491-R495 WeakPolarHBondContact O-CG 3.29Å; R491-R495 PolarHBondContact O-N 2.84Å
492	A	89.1	Confident	81.1	Confident	5 Å²	5	49.7 Å²	49.7	4%	0.041	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-49.5	-172.4	0	0	0	0	0	113.6	V476 S490 F494 R495 R496 D497 V498	V476-A492 HydrophobicContact CG2-CB 4.11Å; S490-A492 PolarHBondContact OG-N 2.98Å; A492-F494 PolarHBondContact O-N 3.1Å; A492-R495 CarbonylContact O-C 3.41Å; A492-R495 PolarHBondContact O-N 3.05Å; A492-R496 PolarHBondContact O-N 3.21Å; A492-R496 VanDerWaalsContact O-N 3.08Å; A492-D497 WeakPolarHBondContact CA-OD2 3.29Å; A492-D497 HydrophobicContact CB-CB 4.2Å; A492-D497 PolarHBondContact O-N 2.7Å; A492-V498 HydrophobicContact CB-CG2 4.11Å
493	Y	92.3	Very high	82.9	Confident	4 Å²	4	51.5 Å²	51.5	2%	0.016	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-34.2	177.6	-72.8	-96.4	0	0	0	112.9	Y443 L471 T472 T485 V486 R491 R496 V498	Y443-Y493 AromaticContact CD2-CD1 3.66Å; Y443-Y493 HydrophobicContact CD2-CD1 3.66Å; Y443-Y493 HydrophobicContact CD2-CG 4.37Å; Y443-Y493 HydrophobicContact CE2-CD1 4.12Å; Y443-Y493 WeakPolarHBondContact CE2-O 3.21Å; Y443-Y493 HydrophobicContact CG-CD1 4.21Å; L471-Y493 HydrophobicContact CD1-CD1 3.53Å; L471-Y493 HydrophobicContact CD1-CE1 3.65Å; L471-Y493 HydrophobicContact CD1-CG 4.11Å; L471-Y493 HydrophobicContact CD2-CD1 4.38Å; L471-Y493 HydrophobicContact CD2-CE1 3.92Å; L471-Y493 HydrophobicContact CD2-CE2 4.13Å; L471-Y493 HydrophobicContact CG-CD1 4.19Å; L471-Y493 HydrophobicContact CG-CE1 3.78Å; T472-Y493 PolarHBondContact O-OH 3.18Å; T485-Y493 WeakPolarHBondContact O-CD2 3.34Å; V486-Y493 HydrophobicContact CG2-CE2 3.7Å; R491-Y493 PolarHBondContact O-N 3.03Å; Y493-R496 PolarHBondContact O-N 3.06Å; Y493-V498 HydrophobicContact CD1-CG2 4.14Å; Y493-V498 HydrophobicContact CD2-CG2 3.97Å; Y493-V498 HydrophobicContact CE1-CB 4.46Å; Y493-V498 HydrophobicContact CE1-CG1 4.21Å; Y493-V498 HydrophobicContact CE1-CG2 4.11Å; Y493-V498 HydrophobicContact CE2-CG2 3.88Å; Y493-V498 HydrophobicContact CG-CG2 4.09Å
494	F	93.5	Very high	84.9	Confident	8 Å²	8	47.2 Å²	47.2	4%	0.035	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-29.5	176.3	-174.2	-122.9	0	0	0	112.5	P255 A256 L259 I307 F311 N406 L407 R491 A492	P255-F494 HydrophobicContact CB-CD2 3.97Å; P255-F494 HydrophobicContact CB-CE2 3.86Å; A256-F494 HydrophobicContact CB-CB 4.16Å; A256-F494 HydrophobicContact CB-CD2 4.48Å; L259-F494 HydrophobicContact CB-CE2 4.45Å; L259-F494 HydrophobicContact CD2-CD2 4.03Å; L259-F494 HydrophobicContact CD2-CE2 4.13Å; L259-F494 WeakPolarHBondContact CD2-O 3.19Å; I307-F494 HydrophobicContact CG2-CE2 3.81Å; I307-F494 HydrophobicContact CG2-CZ 3.79Å; F311-F494 HydrophobicContact CE2-CE1 4.44Å; F311-F494 HydrophobicContact CE2-CZ 4.14Å; F311-F494 HydrophobicContact CZ-CE1 4.24Å; F311-F494 HydrophobicContact CZ-CZ 4.24Å; N406-F494 HydrophobicContact CB-CD1 3.75Å; N406-F494 HydrophobicContact CB-CE1 3.73Å; L407-F494 HydrophobicContact CD2-CE2 4.03Å; L407-F494 HydrophobicContact CD2-CZ 3.82Å; L407-F494 HydrophobicContact CG-CZ 4.12Å; R491-F494 CarbonylContact O-C 3.48Å; R491-F494 WeakPolarHBondContact O-CA 3.47Å; R491-F494 WeakPolarHBondContact O-CB 3.27Å; R491-F494 PolarHBondContact O-N 2.74Å; A492-F494 PolarHBondContact O-N 3.1Å
495	R	92.9	Very high	86.7	Confident	91 Å²	91	43.6 Å²	43.6	34%	0.343	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-0.3	175.5	-75.9	-179.7	178.6	177.4	-0.6	114.3	N406 G410 N413 R491 A492 D497	N406-R495 HydrophobicContact CB-CG 4.03Å; N406-R495 PolarHBondContact OD1-NE 2.66Å; N406-R495 PolarHBondContact OD1-NH2 3.21Å; N406-R495 VanDerWaalsContact OD1-NH2 3.11Å; G410-R495 WeakPolarHBondContact CA-O 3.48Å; N413-R495 PolarHBondContact ND2-O 3.49Å; R491-R495 HydrophobicContact CB-CG 4.18Å; R491-R495 WeakPolarHBondContact O-CB 3.37Å; R491-R495 WeakPolarHBondContact O-CG 3.29Å; R491-R495 PolarHBondContact O-N 2.84Å; A492-R495 CarbonylContact O-C 3.41Å; A492-R495 PolarHBondContact O-N 3.05Å; R495-D497 VanDerWaalsContact CB-CG 3.46Å; R495-D497 WeakPolarHBondContact CB-OD1 3.35Å; R495-D497 WeakPolarHBondContact CB-OD2 3.44Å; R495-D497 WeakPolarHBondContact CD-OD2 3.31Å; R495-D497 PolarHBondContact O-N 2.83Å
496	R	92.3	Very high	87.7	Confident	14 Å²	14	43.3 Å²	43.3	5%	0.053	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.6	30.2	-173.5	-59.1	-63.6	-144.8	168.1	6.1	113.9	D260 L263 N413 L414 P441 Y443 A492 Y493 V498	D260-R496 IonicContact OD1-CZ 3.18Å; D260-R496 IonicContact OD1-NH1 3.55Å; D260-R496 PolarHBondContact OD1-NH1 3.38Å; D260-R496 IonicContact OD1-NH2 2.84Å; D260-R496 PolarHBondContact OD1-NH2 2.92Å; L263-R496 VanDerWaalsContact CD1-NE 3.31Å; L263-R496 VanDerWaalsContact CD1-NH2 3.3Å; N413-R496 HydrophobicContact CB-CB 4.17Å; N413-R496 WeakPolarHBondContact CB-O 3.21Å; L414-R496 HydrophobicContact CD1-CG 4.4Å; L414-R496 HydrophobicContact CD2-CG 4.15Å; L414-R496 HydrophobicContact CG-CB 4.44Å; L414-R496 HydrophobicContact CG-CG 4.14Å; P441-R496 PolarHBondContact O-NH1 3.47Å; Y443-R496 VanDerWaalsContact CD2-NH1 3.25Å; Y443-R496 VanDerWaalsContact CE2-CD 3.41Å; Y443-R496 VanDerWaalsContact OH-C 3.22Å; Y443-R496 VanDerWaalsContact OH-CA 3.24Å; Y443-R496 WeakPolarHBondContact OH-CA 3.3Å; Y443-R496 PolarHBondContact OH-O 3.18Å; A492-R496 PolarHBondContact O-N 3.21Å; A492-R496 VanDerWaalsContact O-N 3.08Å; Y493-R496 PolarHBondContact O-N 3.06Å; R496-V498 PolarHBondContact O-N 3.21Å
497	D	88.1	Confident	88.5	Confident	24 Å²	24	43.1 Å²	43.1	13%	0.128	21%	0.206	C	C	.	.			trans	-72.3	-8	179.4	-61.1	-29.9	0	0	0	112.7	H409 N413 V476 P477 A492 R495	H409-D497 IonicContact CD2-OD1 2.67Å; H409-D497 PolarHBondContact CD2-OD1 2.92Å; H409-D497 VanDerWaalsContact CD2-OD1 3.23Å; H409-D497 IonicContact NE2-OD1 3.52Å; H409-D497 PolarHBondContact NE2-OD1 3.03Å; N413-D497 PolarHBondContact ND2-OD1 2.99Å; V476-D497 HydrophobicContact CG1-CB 4.08Å; V476-D497 HydrophobicContact CG2-CB 4.4Å; P477-D497 VanDerWaalsContact CD-O 3.23Å; P477-D497 WeakPolarHBondContact CD-O 3.42Å; A492-D497 WeakPolarHBondContact CA-OD2 3.29Å; A492-D497 HydrophobicContact CB-CB 4.2Å; A492-D497 PolarHBondContact O-N 2.7Å; R495-D497 VanDerWaalsContact CB-CG 3.46Å; R495-D497 WeakPolarHBondContact CB-OD1 3.35Å; R495-D497 WeakPolarHBondContact CB-OD2 3.44Å; R495-D497 WeakPolarHBondContact CD-OD2 3.31Å; R495-D497 PolarHBondContact O-N 2.83Å
498	V	88	Confident	89.1	Confident	8 Å²	8	40.6 Å²	40.6	5%	0.048	19%	0.192	C	C	.	.			trans	-98.8	122.7	-167.5	-172.9	0	0	0	0	111.6	Y443 W475 V476 A492 Y493 R496 C500	Y443-V498 HydrophobicContact CE2-CB 4.26Å; Y443-V498 PolarHBondContact OH-N 3.49Å; Y443-V498 PolarHBondContact OH-O 3.03Å; W475-V498 CarbonylContact O-C 3.55Å; W475-V498 WeakPolarHBondContact O-CA 3.48Å; V476-V498 HydrophobicContact CG2-CG2 3.94Å; A492-V498 HydrophobicContact CB-CG2 4.11Å; Y493-V498 HydrophobicContact CD1-CG2 4.14Å; Y493-V498 HydrophobicContact CD2-CG2 3.97Å; Y493-V498 HydrophobicContact CE1-CB 4.46Å; Y493-V498 HydrophobicContact CE1-CG1 4.21Å; Y493-V498 HydrophobicContact CE1-CG2 4.11Å; Y493-V498 HydrophobicContact CE2-CG2 3.88Å; Y493-V498 HydrophobicContact CG-CG2 4.09Å; R496-V498 PolarHBondContact O-N 3.21Å; V498-C500 VanDerWaalsContact C-N 3.31Å; V498-C500 PolarHBondContact O-N 3.21Å
499	H	83.6	Confident	89.7	Confident	52 Å²	52	36.8 Å²	36.8	24%	0.241	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	90.7	160.2	-72.9	-73.6	0	0	0	109.3	G474 W475 P477	G474-H499 WeakPolarHBondContact CA-O 3.49Å; W475-H499 HydrophobicContact CD2-CB 4.07Å; W475-H499 AromaticContact CE2-CD2 3.61Å; W475-H499 AromaticContact CE2-CG 3.77Å; W475-H499 HydrophobicContact CG-CB 4.24Å; W475-H499 AromaticContact CH2-CD2 3.37Å; W475-H499 WeakPolarHBondContact CH2-CD2 3.35Å; W475-H499 AromaticContact CH2-NE2 3.74Å; W475-H499 HydrophobicContact CZ2-CB 3.96Å; W475-H499 AromaticContact CZ2-CD2 3.28Å; W475-H499 WeakPolarHBondContact CZ2-CD2 3.46Å; W475-H499 AromaticContact CZ2-CG 3.65Å; W475-H499 AromaticContact CZ2-NE2 3.9Å; W475-H499 AromaticContact CZ3-CD2 3.78Å; W475-H499 PolarHBondContact N-O 2.65Å; W475-H499 PolarHBondContact O-N 3.24Å; P477-H499 WeakPolarHBondContact CG-CD2 3.43Å; P477-H499 WeakPolarHBondContact CG-NE2 3.45Å
500	C	85.7	Confident	90	Very high	18 Å²	18	28.5 Å²	28.5	12%	0.122	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	130.8	-173.9	165.8	0	0	0	0	113	P441 Q442 Y443 T472 V498 T502	P441-C500 HydrophobicContact CB-CB 4.19Å; P441-C500 HydrophobicContact CG-CB 4.47Å; Q442-C500 PolarHBondContact O-SG 2.97Å; Q442-C500 VanDerWaalsContact O-SG 3.4Å; Y443-C500 HydrophobicContact CD1-CB 3.46Å; Y443-C500 VanDerWaalsContact CD1-CB 3.46Å; Y443-C500 HydrophobicContact CE1-CB 3.35Å; T472-C500 PolarHBondContact OG1-SG 3.44Å; V498-C500 VanDerWaalsContact C-N 3.31Å; V498-C500 PolarHBondContact O-N 3.21Å; C500-T502 PolarHBondContact O-N 2.63Å
501	W	86.7	Confident	90.2	Very high	80 Å²	80	36.4 Å²	36.4	30%	0.303	17%	0.168	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	92	166.1	-55.9	-30.8	0	0	0	108.9	H229 N473 W475 H503 S504 D541	H229-W501 AromaticContact CE1-CZ3 3.76Å; N473-W501 HydrophobicContact CB-CE3 4.48Å; N473-W501 VanDerWaalsContact ND2-CZ3 3.31Å; N473-W501 WeakPolarHBondContact ND2-CZ3 3.5Å; N473-W501 PolarHBondContact O-N 2.9Å; W475-W501 AromaticContact CD1-CZ2 3.74Å; W501-H503 PolarHBondContact O-N 3.01Å; W501-S504 PolarHBondContact O-N 3.11Å; W501-D541 HydrophobicContact CH2-CB 4.22Å; W501-D541 HydrophobicContact CZ3-CB 4.33Å; W501-D541 WeakPolarHBondContact CZ3-OD2 3.29Å
502	T	85.1	Confident	90.2	Very high	72 Å²	72	35.6 Å²	35.6	44%	0.442	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.1	-11.3	-171.3	59.3	0	0	0	0	114.8	P441 C500	P441-T502 HydrophobicContact CB-CG2 3.66Å; C500-T502 PolarHBondContact O-N 2.63Å
503	H	86.5	Confident	90.3	Very high	50 Å²	50	38.2 Å²	38.2	23%	0.231	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	4	178.3	58.3	-106	0	0	0	113.6	S183 T232 W501	S183-H503 PolarHBondContact OG-O 3.04Å; T232-H503 VanDerWaalsContact CG2-C 3.41Å; T232-H503 PolarHBondContact N-O 3.14Å; T232-H503 VanDerWaalsContact N-O 3.14Å; W501-H503 PolarHBondContact O-N 3.01Å
504	S	91.7	Very high	90.3	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	129.3	-178.8	-65.5	0	0	0	0	112.3	H229 T230 T472 N473 W501	H229-S504 PolarHBondContact CD2-OG 2.94Å; H229-S504 VanDerWaalsContact CD2-OG 3.29Å; T230-S504 CarbonylContact O-C 3.58Å; T230-S504 VanDerWaalsContact O-CA 3.31Å; T230-S504 WeakPolarHBondContact O-CA 3.33Å; T472-S504 CarbonylContact C-O 3.53Å; T472-S504 WeakPolarHBondContact CA-O 3.27Å; T472-S504 VanDerWaalsContact CB-O 3.31Å; T472-S504 WeakPolarHBondContact CB-O 3.15Å; N473-S504 PolarHBondContact N-O 2.77Å; W501-S504 PolarHBondContact O-N 3.11Å
505	V	94.3	Very high	90.2	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	135.9	176.7	173	0	0	0	0	110.8	H229 T230 T232 L237 A244 T445 M470 L471	H229-V505 WeakPolarHBondContact CA-O 3.44Å; H229-V505 VanDerWaalsContact CB-O 3.23Å; H229-V505 WeakPolarHBondContact CB-O 3.22Å; T230-V505 HydrophobicContact CG2-CB 4.3Å; T230-V505 PolarHBondContact N-O 3.43Å; T230-V505 VanDerWaalsContact N-O 3.14Å; T230-V505 PolarHBondContact O-N 3.49Å; T232-V505 HydrophobicContact CG2-CG2 3.85Å; L237-V505 HydrophobicContact CD1-CB 4Å; L237-V505 HydrophobicContact CD1-CG1 3.91Å; L237-V505 HydrophobicContact CD1-CG2 4.14Å; A244-V505 HydrophobicContact CB-CG1 3.53Å; T445-V505 HydrophobicContact CG2-CG2 3.95Å; M470-V505 HydrophobicContact CB-CG1 3.89Å; M470-V505 HydrophobicContact CB-CG2 4.4Å; M470-V505 HydrophobicContact SD-CG1 4.24Å; L471-V505 WeakPolarHBondContact O-CA 3.22Å
506	K	93.6	Very high	90.3	Very high	8 Å²	8	43.3 Å²	43.3	4%	0.035	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	122.8	177.2	-169.2	80.4	-177.6	-168.8	0	111.3	A244 Y245 L471 N473 V486 S544	A244-K506 WeakPolarHBondContact CA-O 3.25Å; Y245-K506 HydrophobicContact CD2-CB 4.08Å; Y245-K506 HydrophobicContact CD2-CG 3.59Å; Y245-K506 HydrophobicContact CE2-CG 3.91Å; Y245-K506 PolarHBondContact N-O 2.74Å; L471-K506 HydrophobicContact CB-CB 4.44Å; L471-K506 HydrophobicContact CD2-CB 4.34Å; L471-K506 PolarHBondContact O-N 2.88Å; N473-K506 HydrophobicContact CB-CB 4.42Å; N473-K506 HydrophobicContact CB-CD 4.04Å; N473-K506 WeakPolarHBondContact OD1-CD 3.21Å; N473-K506 WeakPolarHBondContact OD1-CE 3.39Å; N473-K506 PolarHBondContact OD1-NZ 2.93Å; V486-K506 HydrophobicContact CG2-CG 4.42Å; K506-S544 WeakPolarHBondContact CE-O 3.38Å; K506-S544 VanDerWaalsContact NZ-CB 3.26Å; K506-S544 PolarHBondContact NZ-O 3.13Å
507	L	95.5	Very high	90.4	Very high	4 Å²	4	48.8 Å²	48.8	2%	0.021	25%	0.248	C	C	.	.	B	Isolated β-bridge	trans	-80.9	136.2	179.9	-66.9	173.9	0	0	0	112.7	S228 T230 W236 C243 Y245 Y509 L519 M523	S228-L507 PolarHBondContact O-N 3.14Å; S228-L507 VanDerWaalsContact O-N 3.08Å; T230-L507 HydrophobicContact CG2-CD2 3.79Å; W236-L507 HydrophobicContact CH2-CD2 3.86Å; C243-L507 WeakPolarHBondContact O-CA 3.37Å; Y245-L507 WeakPolarHBondContact CE2-O 3.25Å; L507-Y509 HydrophobicContact CB-CD2 4.41Å; L507-Y509 HydrophobicContact CB-CE2 3.89Å; L507-Y509 HydrophobicContact CD1-CE2 4.44Å; L507-L519 HydrophobicContact CB-CD2 4.14Å; L507-L519 HydrophobicContact CD1-CD1 4.26Å; L507-L519 HydrophobicContact CD2-CD1 3.89Å; L507-L519 HydrophobicContact CG-CD1 4.47Å; L507-M523 HydrophobicContact CD1-CE 3.61Å
508	R	94.4	Very high	90.8	Very high	49 Å²	49	50.6 Å²	50.6	19%	0.185	26%	0.255	C	S	.	.			trans	-112.6	87	-175.2	-175.7	-170.8	165	-78.1	-2.1	111.5	C243 Y245 N249 D515 C516	C243-R508 PolarHBondContact O-N 2.68Å; Y245-R508 HydrophobicContact CD1-CB 4.45Å; Y245-R508 HydrophobicContact CD1-CG 4.13Å; Y245-R508 HydrophobicContact CD2-CB 3.7Å; Y245-R508 HydrophobicContact CD2-CG 4.23Å; Y245-R508 HydrophobicContact CE1-CB 4.48Å; Y245-R508 HydrophobicContact CE1-CG 3.96Å; Y245-R508 HydrophobicContact CE2-CB 3.74Å; Y245-R508 HydrophobicContact CE2-CG 4.06Å; Y245-R508 HydrophobicContact CG-CB 4.07Å; Y245-R508 HydrophobicContact CG-CG 4.26Å; N249-R508 VanDerWaalsContact CG-CD 3.45Å; N249-R508 VanDerWaalsContact ND2-CD 3.28Å; N249-R508 WeakPolarHBondContact ND2-CD 3.36Å; N249-R508 WeakPolarHBondContact OD1-CD 3.42Å; R508-D515 PolarHBondContact NH1-O 3.18Å; R508-C516 WeakPolarHBondContact O-CB 3.42Å
509	Y	93.7	Very high	91.3	Very high	1 Å²	1	50.2 Å²	50.2	0%	0.004	25%	0.252	C	S	.	.			trans	-74.1	-21.5	176.8	-67.9	-93	0	0	0	114.8	L227 L507 L519 W520 M523 P546 V549	L227-Y509 WeakPolarHBondContact O-CE2 3.34Å; L227-Y509 PolarHBondContact O-OH 3.33Å; L227-Y509 VanDerWaalsContact O-OH 3.12Å; L507-Y509 HydrophobicContact CB-CD2 4.41Å; L507-Y509 HydrophobicContact CB-CE2 3.89Å; L507-Y509 HydrophobicContact CD1-CE2 4.44Å; Y509-L519 HydrophobicContact CD1-CD2 3.84Å; Y509-L519 HydrophobicContact CD1-CG 3.92Å; Y509-L519 HydrophobicContact CD2-CD2 3.99Å; Y509-L519 HydrophobicContact CE1-CD1 4.39Å; Y509-L519 HydrophobicContact CE1-CD2 4.01Å; Y509-L519 HydrophobicContact CE1-CG 3.77Å; Y509-L519 HydrophobicContact CE2-CD2 4.12Å; Y509-L519 HydrophobicContact CG-CD2 3.84Å; Y509-L519 HydrophobicContact CG-CG 4.43Å; Y509-W520 HydrophobicContact CD1-CD2 4.22Å; Y509-W520 AromaticContact CD1-CE2 3.98Å; Y509-W520 HydrophobicContact CD1-CG 4.3Å; Y509-W520 AromaticContact CD1-NE1 3.84Å; Y509-W520 PolarHBondContact O-NE1 3.21Å; Y509-M523 HydrophobicContact CE1-CB 4.11Å; Y509-M523 HydrophobicContact CE1-CG 4.02Å; Y509-M523 VanDerWaalsContact OH-CG 3.32Å; Y509-M523 WeakPolarHBondContact OH-CG 3.31Å; Y509-P546 HydrophobicContact CD2-CG 4.41Å; Y509-V549 HydrophobicContact CD1-CB 4.43Å; Y509-V549 HydrophobicContact CD1-CG1 3.67Å; Y509-V549 HydrophobicContact CD1-CG2 3.81Å; Y509-V549 HydrophobicContact CD2-CG1 4.21Å; Y509-V549 HydrophobicContact CD2-CG2 4.01Å; Y509-V549 HydrophobicContact CE1-CG1 3.54Å; Y509-V549 HydrophobicContact CE2-CG1 4.1Å; Y509-V549 HydrophobicContact CG-CB 4.39Å; Y509-V549 HydrophobicContact CG-CG1 4Å; Y509-V549 HydrophobicContact CG-CG2 3.51Å
510	G	90.6	Very high	91.9	Very high	19 Å²	19	48.4 Å²	48.4	20%	0.196	24%	0.243	C	C	.	.			trans	69.4	-165.6	-169.2	0	0	0	0	0	113.8	H548	G510-H548 PolarHBondContact O-CE1 3.04Å; G510-H548 PolarHBondContact O-NE2 3.48Å
511	K	88.2	Confident	92.5	Very high	188 Å²	188	51.7 Å²	51.7	82%	0.817	26%	0.257	S	S	*	.	S	Bend	trans	-82.1	-31.6	178.8	-64.4	-178.5	179.4	179.9	0	112.1	D515 H548	K511-D515 WeakPolarHBondContact CA-OD2 3.38Å; K511-D515 PolarHBondContact N-OD2 2.74Å; K511-H548 PolarHBondContact O-CD2 3.39Å; K511-H548 PolarHBondContact O-NE2 2.92Å
512	C	88.9	Confident	93	Very high	52 Å²	52	48.8 Å²	48.8	35%	0.351	25%	0.246	S	C	.	.	S	Bend	trans	-140.8	166	178.9	73.2	0	0	0	0	112.2	N514 D515	C512-N514 PolarHBondContact O-N 3.03Å; C512-D515 PolarHBondContact N-OD2 2.85Å; C512-D515 VanDerWaalsContact N-OD2 3.16Å; C512-D515 WeakPolarHBondContact O-CB 3.3Å; C512-D515 PolarHBondContact O-N 2.99Å
513	P	91.4	Very high	93.6	Very high	61 Å²	61	45.4 Å²	45.4	40%	0.396	23%	0.225	S	C	.	.	G	3₁₀ helix	trans	-54.9	-26	179.8	-29.1	36.8	0	0	0	115.7	D515 C516 K517 W520	P513-D515 VanDerWaalsContact C-N 3.31Å; P513-D515 PolarHBondContact O-N 3.14Å; P513-C516 CarbonylContact O-C 3.3Å; P513-K517 WeakPolarHBondContact O-CA 3.4Å; P513-K517 PolarHBondContact O-N 2.71Å; P513-K517 VanDerWaalsContact O-N 3.15Å; P513-W520 HydrophobicContact CB-CB 4.42Å; P513-W520 HydrophobicContact CB-CD2 4.07Å; P513-W520 HydrophobicContact CB-CE3 4.47Å; P513-W520 HydrophobicContact CB-CG 4.05Å; P513-W520 HydrophobicContact CG-CD2 3.94Å; P513-W520 HydrophobicContact CG-CE3 3.96Å; P513-W520 HydrophobicContact CG-CG 4.45Å; P513-W520 HydrophobicContact CG-CH2 4.36Å; P513-W520 HydrophobicContact CG-CZ2 4.33Å; P513-W520 HydrophobicContact CG-CZ3 4.18Å
514	N	91.3	Very high	94.1	Very high	142 Å²	142	45.1 Å²	45.1	76%	0.759	22%	0.224	S	C	*	.	G	3₁₀ helix	trans	-72.8	-20.9	179.1	-68.1	-15.1	0	0	0	113.4	C512 C516	C512-N514 PolarHBondContact O-N 3.03Å; N514-C516 VanDerWaalsContact C-N 3.27Å; N514-C516 PolarHBondContact O-N 2.87Å
515	D	91.5	Very high	94.4	Very high	67 Å²	67	50.6 Å²	50.6	36%	0.358	25%	0.248	S	C	.	.	G	3₁₀ helix	trans	-72	-20	-178.6	-69.3	-30.8	0	0	0	113.6	R508 K511 C512 P513	R508-D515 PolarHBondContact NH1-O 3.18Å; K511-D515 WeakPolarHBondContact CA-OD2 3.38Å; K511-D515 PolarHBondContact N-OD2 2.74Å; C512-D515 PolarHBondContact N-OD2 2.85Å; C512-D515 VanDerWaalsContact N-OD2 3.16Å; C512-D515 WeakPolarHBondContact O-CB 3.3Å; C512-D515 PolarHBondContact O-N 2.99Å; P513-D515 VanDerWaalsContact C-N 3.31Å; P513-D515 PolarHBondContact O-N 3.14Å
516	C	94.4	Very high	94.5	Very high	1 Å²	1	50.7 Å²	50.7	1%	0.007	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-162.8	71.5	171.6	-171.4	0	0	0	0	110.9	D242 C243 R508 P513 N514 F518 L519 W520	D242-C516 PolarHBondContact OD2-SG 2.98Å; C243-C516 VanDerWaalsContact CA-SG 3.54Å; C243-C516 PolarHBondContact SG-SG 2.93Å; R508-C516 WeakPolarHBondContact O-CB 3.42Å; P513-C516 CarbonylContact O-C 3.3Å; N514-C516 VanDerWaalsContact C-N 3.27Å; N514-C516 PolarHBondContact O-N 2.87Å; C516-F518 VanDerWaalsContact C-N 3.3Å; C516-F518 PolarHBondContact O-N 2.95Å; C516-L519 HydrophobicContact CB-CB 4.27Å; C516-L519 PolarHBondContact O-N 3.4Å; C516-L519 WeakPolarHBondContact SG-CB 3.4Å; C516-W520 PolarHBondContact O-N 3.25Å
517	K	95.5	Very high	94.7	Very high	128 Å²	128	50.3 Å²	50.3	56%	0.557	25%	0.246	S	C	*	.	H	α-helix	trans	-54.4	-41.2	-171.8	-179.6	175.3	171.2	178.7	0	114	P513 L519 W520 E521	P513-K517 WeakPolarHBondContact O-CA 3.4Å; P513-K517 PolarHBondContact O-N 2.71Å; P513-K517 VanDerWaalsContact O-N 3.15Å; K517-L519 PolarHBondContact O-N 3.26Å; K517-W520 PolarHBondContact O-N 3.18Å; K517-E521 WeakPolarHBondContact CE-OE1 3.26Å; K517-E521 HydrophobicContact CG-CG 4.47Å; K517-E521 IonicContact NZ-OE1 2.74Å; K517-E521 PolarHBondContact O-N 2.76Å
518	F	97.1	Very high	94.8	Very high	63 Å²	63	54.7 Å²	54.7	28%	0.276	26%	0.263	S	S	.	.	H	α-helix	trans	-60.6	-45.5	-179.8	179.6	-90.2	0	0	0	112.2	W236 H240 C516 W520 E521 R522	W236-F518 HydrophobicContact CD2-CE1 4.47Å; W236-F518 HydrophobicContact CE3-CD1 4.44Å; W236-F518 AromaticContact CE3-CE1 3.71Å; W236-F518 HydrophobicContact CE3-CE1 3.71Å; W236-F518 HydrophobicContact CZ3-CE1 4.23Å; H240-F518 HydrophobicContact CB-CD1 3.9Å; H240-F518 HydrophobicContact CB-CE1 4.18Å; H240-F518 HydrophobicContact CB-CG 4.34Å; H240-F518 AromaticContact CD2-CD1 3.76Å; H240-F518 AromaticContact CD2-CD2 3.63Å; H240-F518 AromaticContact CD2-CE1 3.6Å; H240-F518 AromaticContact CD2-CE2 3.46Å; H240-F518 VanDerWaalsContact CD2-CE2 3.46Å; H240-F518 WeakPolarHBondContact CD2-CE2 3.42Å; H240-F518 AromaticContact CD2-CG 3.77Å; H240-F518 AromaticContact CD2-CZ 3.44Å; H240-F518 VanDerWaalsContact CD2-CZ 3.44Å; H240-F518 WeakPolarHBondContact CD2-CZ 3.39Å; H240-F518 AromaticContact CE1-CD2 3.68Å; H240-F518 AromaticContact CE1-CG 3.95Å; H240-F518 AromaticContact CG-CD1 3.69Å; H240-F518 AromaticContact CG-CE1 3.94Å; H240-F518 AromaticContact CG-CG 3.72Å; H240-F518 AromaticContact ND1-CG 3.83Å; H240-F518 AromaticContact NE2-CD2 3.39Å; H240-F518 WeakPolarHBondContact NE2-CD2 3.08Å; H240-F518 AromaticContact NE2-CE2 3.36Å; H240-F518 WeakPolarHBondContact NE2-CE2 3.32Å; H240-F518 AromaticContact NE2-CG 3.91Å; H240-F518 AromaticContact NE2-CZ 3.86Å; C516-F518 VanDerWaalsContact C-N 3.3Å; C516-F518 PolarHBondContact O-N 2.95Å; F518-W520 PolarHBondContact O-N 2.91Å; F518-E521 PolarHBondContact O-N 3.18Å; F518-R522 HydrophobicContact CE1-CB 4.49Å; F518-R522 VanDerWaalsContact O-CB 3.22Å; F518-R522 WeakPolarHBondContact O-CB 3.11Å; F518-R522 PolarHBondContact O-N 2.73Å
519	L	97.4	Very high	94.8	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-61.7	-44.3	179.5	179.2	59.6	0	0	0	111.7	W236 C243 L507 Y509 C516 K517 R522 M523	W236-L519 HydrophobicContact CH2-CD1 4.16Å; W236-L519 HydrophobicContact CZ3-CD1 4.49Å; C243-L519 HydrophobicContact CB-CB 4.25Å; C243-L519 HydrophobicContact CB-CD1 4.49Å; C243-L519 HydrophobicContact CB-CD2 4.46Å; L507-L519 HydrophobicContact CB-CD2 4.14Å; L507-L519 HydrophobicContact CD1-CD1 4.26Å; L507-L519 HydrophobicContact CD2-CD1 3.89Å; L507-L519 HydrophobicContact CG-CD1 4.47Å; Y509-L519 HydrophobicContact CD1-CD2 3.84Å; Y509-L519 HydrophobicContact CD1-CG 3.92Å; Y509-L519 HydrophobicContact CD2-CD2 3.99Å; Y509-L519 HydrophobicContact CE1-CD1 4.39Å; Y509-L519 HydrophobicContact CE1-CD2 4.01Å; Y509-L519 HydrophobicContact CE1-CG 3.77Å; Y509-L519 HydrophobicContact CE2-CD2 4.12Å; Y509-L519 HydrophobicContact CG-CD2 3.84Å; Y509-L519 HydrophobicContact CG-CG 4.43Å; C516-L519 HydrophobicContact CB-CB 4.27Å; C516-L519 PolarHBondContact O-N 3.4Å; C516-L519 WeakPolarHBondContact SG-CB 3.4Å; K517-L519 PolarHBondContact O-N 3.26Å; L519-R522 PolarHBondContact O-N 2.76Å; L519-M523 HydrophobicContact CD1-CE 3.85Å; L519-M523 HydrophobicContact CD1-CG 3.74Å; L519-M523 HydrophobicContact CG-CG 4.38Å; L519-M523 VanDerWaalsContact O-CB 3.28Å; L519-M523 WeakPolarHBondContact O-CB 3.48Å; L519-M523 WeakPolarHBondContact O-CG 3.13Å; L519-M523 PolarHBondContact O-N 2.99Å
520	W	97.3	Very high	94.9	Very high	13 Å²	13	54.3 Å²	54.3	5%	0.049	27%	0.268	C	S	.	.	H	α-helix	trans	-61.2	-51.1	176.9	-79.5	83.8	0	0	0	111.6	Y509 P513 C516 K517 F518 R522 M523 E524 V549 H552 M553	Y509-W520 HydrophobicContact CD1-CD2 4.22Å; Y509-W520 AromaticContact CD1-CE2 3.98Å; Y509-W520 HydrophobicContact CD1-CG 4.3Å; Y509-W520 AromaticContact CD1-NE1 3.84Å; Y509-W520 PolarHBondContact O-NE1 3.21Å; P513-W520 HydrophobicContact CB-CB 4.42Å; P513-W520 HydrophobicContact CB-CD2 4.07Å; P513-W520 HydrophobicContact CB-CE3 4.47Å; P513-W520 HydrophobicContact CB-CG 4.05Å; P513-W520 HydrophobicContact CG-CD2 3.94Å; P513-W520 HydrophobicContact CG-CE3 3.96Å; P513-W520 HydrophobicContact CG-CG 4.45Å; P513-W520 HydrophobicContact CG-CH2 4.36Å; P513-W520 HydrophobicContact CG-CZ2 4.33Å; P513-W520 HydrophobicContact CG-CZ3 4.18Å; C516-W520 PolarHBondContact O-N 3.25Å; K517-W520 PolarHBondContact O-N 3.18Å; F518-W520 PolarHBondContact O-N 2.91Å; W520-R522 VanDerWaalsContact C-N 3.32Å; W520-R522 PolarHBondContact O-N 3.04Å; W520-M523 PolarHBondContact O-N 3.32Å; W520-E524 WeakPolarHBondContact O-CB 2.9Å; W520-E524 WeakPolarHBondContact O-CG 3.36Å; W520-E524 PolarHBondContact O-N 3.2Å; W520-V549 HydrophobicContact CH2-CB 4.37Å; W520-V549 HydrophobicContact CH2-CG2 3.81Å; W520-V549 HydrophobicContact CZ2-CG2 3.67Å; W520-H552 AromaticContact CE3-CD2 3.93Å; W520-H552 HydrophobicContact CZ3-CB 3.91Å; W520-H552 AromaticContact CZ3-CD2 3.62Å; W520-H552 AromaticContact CZ3-CG 3.79Å; W520-M553 HydrophobicContact CE3-CE 4.24Å
521	E	97.3	Very high	95.2	Very high	87 Å²	87	53.4 Å²	53.4	41%	0.407	26%	0.259	S	S	.	.	H	α-helix	trans	-61.4	-38.4	178.7	-71.4	-176.3	-175.5	0	0	113	K517 F518 K525	K517-E521 WeakPolarHBondContact CE-OE1 3.26Å; K517-E521 HydrophobicContact CG-CG 4.47Å; K517-E521 IonicContact NZ-OE1 2.74Å; K517-E521 PolarHBondContact O-N 2.76Å; F518-E521 PolarHBondContact O-N 3.18Å; E521-K525 VanDerWaalsContact O-CG 3.31Å; E521-K525 WeakPolarHBondContact O-CG 3.47Å; E521-K525 PolarHBondContact O-N 2.72Å; E521-K525 VanDerWaalsContact O-N 3.14Å
522	R	97.2	Very high	95.5	Very high	20 Å²	20	50 Å²	50	8%	0.075	24%	0.244	C	C	.	.	H	α-helix	trans	-65.4	-45.5	176.6	-178.7	172.6	178	77.3	12.8	111.6	D186 Q187 L188 W236 F518 L519 W520 K525 Y526	D186-R522 IonicContact OD1-CZ 3.24Å; D186-R522 IonicContact OD1-NH1 3.87Å; D186-R522 IonicContact OD1-NH2 2.73Å; D186-R522 PolarHBondContact OD1-NH2 3.35Å; Q187-R522 VanDerWaalsContact OE1-NE 3.16Å; L188-R522 HydrophobicContact CD1-CG 4.29Å; W236-R522 VanDerWaalsContact CE2-NE 3.26Å; F518-R522 HydrophobicContact CE1-CB 4.49Å; F518-R522 VanDerWaalsContact O-CB 3.22Å; F518-R522 WeakPolarHBondContact O-CB 3.11Å; F518-R522 PolarHBondContact O-N 2.73Å; L519-R522 PolarHBondContact O-N 2.76Å; W520-R522 VanDerWaalsContact C-N 3.32Å; W520-R522 PolarHBondContact O-N 3.04Å; R522-K525 PolarHBondContact O-N 3.26Å; R522-Y526 PolarHBondContact O-N 3.31Å
523	M	97.6	Very high	95.8	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-76.5	-27.8	-177.4	-66.4	-71.2	167.6	0	0	112.4	Q187 W236 L507 Y509 L519 W520 Y526 T527 M553	Q187-M523 HydrophobicContact CG-CE 3.9Å; Q187-M523 HydrophobicContact CG-SD 4.29Å; W236-M523 HydrophobicContact CH2-CE 4.42Å; W236-M523 HydrophobicContact CZ2-CE 4.47Å; L507-M523 HydrophobicContact CD1-CE 3.61Å; Y509-M523 HydrophobicContact CE1-CB 4.11Å; Y509-M523 HydrophobicContact CE1-CG 4.02Å; Y509-M523 VanDerWaalsContact OH-CG 3.32Å; Y509-M523 WeakPolarHBondContact OH-CG 3.31Å; L519-M523 HydrophobicContact CD1-CE 3.85Å; L519-M523 HydrophobicContact CD1-CG 3.74Å; L519-M523 HydrophobicContact CG-CG 4.38Å; L519-M523 VanDerWaalsContact O-CB 3.28Å; L519-M523 WeakPolarHBondContact O-CB 3.48Å; L519-M523 WeakPolarHBondContact O-CG 3.13Å; L519-M523 PolarHBondContact O-N 2.99Å; W520-M523 PolarHBondContact O-N 3.32Å; M523-Y526 HydrophobicContact SD-CD1 4.01Å; M523-T527 VanDerWaalsContact O-CB 3.28Å; M523-T527 WeakPolarHBondContact O-CB 3.28Å; M523-T527 PolarHBondContact O-N 2.81Å; M523-T527 PolarHBondContact O-OG1 2.72Å; M523-M553 HydrophobicContact CB-CE 3.72Å
524	E	97.8	Very high	96	Very high	44 Å²	44	45 Å²	45	21%	0.206	21%	0.21	C	C	.	.	H	α-helix	trans	-60.7	-50.7	164.5	-80.4	-148.9	-163.9	0	0	111.6	W520 Y526 T527 R528 H552 M553 L556	W520-E524 WeakPolarHBondContact O-CB 2.9Å; W520-E524 WeakPolarHBondContact O-CG 3.36Å; W520-E524 PolarHBondContact O-N 3.2Å; E524-Y526 VanDerWaalsContact C-N 3.31Å; E524-Y526 PolarHBondContact O-N 3.22Å; E524-T527 PolarHBondContact O-N 3.35Å; E524-R528 WeakPolarHBondContact O-CB 3.44Å; E524-R528 WeakPolarHBondContact O-CD 3.19Å; E524-R528 WeakPolarHBondContact O-CG 3.45Å; E524-R528 PolarHBondContact O-N 3.15Å; E524-R528 IonicContact OE2-CZ 3.5Å; E524-R528 IonicContact OE2-NE 3.3Å; E524-R528 PolarHBondContact OE2-NE 3.31Å; E524-R528 VanDerWaalsContact OE2-NE 3.15Å; E524-R528 IonicContact OE2-NH2 3.78Å; E524-R528 PolarHBondContact OE2-NH2 3.37Å; E524-H552 IonicContact OE1-CD2 3.5Å; E524-H552 IonicContact OE1-CE1 3.74Å; E524-H552 IonicContact OE1-NE2 3.68Å; E524-H552 PolarHBondContact OE1-NE2 2.81Å; E524-M553 HydrophobicContact CG-CE 4.19Å; E524-M553 HydrophobicContact CG-SD 4.24Å; E524-L556 HydrophobicContact CB-CD1 4.23Å; E524-L556 VanDerWaalsContact CD-CD1 3.44Å; E524-L556 HydrophobicContact CG-CD1 3.53Å
525	K	97.3	Very high	96.1	Very high	116 Å²	116	38.9 Å²	38.9	50%	0.504	18%	0.177	S	C	.	.	H	α-helix	trans	-57.9	-44.8	179.2	-73.4	165.6	-176.2	167.5	0	111.2	L188 E521 R522 R528 S529	L188-K525 HydrophobicContact CD1-CB 4.4Å; L188-K525 HydrophobicContact CD1-CD 4.34Å; L188-K525 HydrophobicContact CD2-CB 3.7Å; E521-K525 VanDerWaalsContact O-CG 3.31Å; E521-K525 WeakPolarHBondContact O-CG 3.47Å; E521-K525 PolarHBondContact O-N 2.72Å; E521-K525 VanDerWaalsContact O-N 3.14Å; R522-K525 PolarHBondContact O-N 3.26Å; K525-R528 PolarHBondContact O-N 3.19Å; K525-S529 PolarHBondContact O-N 3.22Å; K525-S529 VanDerWaalsContact O-N 3.07Å; K525-S529 PolarHBondContact O-OG 3.11Å; K525-S529 VanDerWaalsContact O-OG 3.05Å
526	Y	97.5	Very high	96.3	Very high	1 Å²	1	35.7 Å²	35.7	0%	0.004	16%	0.16	C	C	.	.	H	α-helix	trans	-58.6	-54.2	174.1	170.1	-134.9	0	0	0	112.2	Q173 Q187 L225 V226 R522 M523 E524 R528 S529 V530	Q173-Y526 HydrophobicContact CG-CD2 4.33Å; Q173-Y526 HydrophobicContact CG-CE2 3.91Å; Q187-Y526 HydrophobicContact CB-CD1 4.13Å; Q187-Y526 HydrophobicContact CB-CD2 3.98Å; Q187-Y526 HydrophobicContact CB-CG 3.75Å; Q187-Y526 HydrophobicContact CG-CD1 4.08Å; Q187-Y526 HydrophobicContact CG-CE1 4.37Å; Q187-Y526 HydrophobicContact CG-CG 4.23Å; Q187-Y526 WeakPolarHBondContact O-CD2 3.46Å; L225-Y526 HydrophobicContact CD1-CD1 3.99Å; L225-Y526 HydrophobicContact CD1-CE1 3.56Å; L225-Y526 HydrophobicContact CD1-CE2 4.47Å; L225-Y526 HydrophobicContact CG-CE1 4.41Å; V226-Y526 PolarHBondContact N-OH 3.15Å; V226-Y526 WeakPolarHBondContact O-CE1 3.49Å; R522-Y526 PolarHBondContact O-N 3.31Å; M523-Y526 HydrophobicContact SD-CD1 4.01Å; E524-Y526 VanDerWaalsContact C-N 3.31Å; E524-Y526 PolarHBondContact O-N 3.22Å; Y526-R528 VanDerWaalsContact C-N 3.3Å; Y526-R528 PolarHBondContact O-N 3.44Å; Y526-S529 WeakPolarHBondContact O-CB 3.31Å; Y526-S529 PolarHBondContact O-N 2.96Å; Y526-S529 VanDerWaalsContact O-N 3.13Å; Y526-V530 HydrophobicContact CD2-CG2 3.87Å; Y526-V530 HydrophobicContact CE2-CG2 3.48Å; Y526-V530 VanDerWaalsContact CE2-CG2 3.48Å; Y526-V530 PolarHBondContact O-N 3.41Å
527	T	97.9	Very high	96.4	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-57.1	-42.4	179.6	-60.4	0	0	0	0	111.9	L225 M523 E524 V530 A531 M553 V557	L225-T527 HydrophobicContact CD2-CG2 4.29Å; M523-T527 VanDerWaalsContact O-CB 3.28Å; M523-T527 WeakPolarHBondContact O-CB 3.28Å; M523-T527 PolarHBondContact O-N 2.81Å; M523-T527 PolarHBondContact O-OG1 2.72Å; E524-T527 PolarHBondContact O-N 3.35Å; T527-V530 PolarHBondContact O-N 2.95Å; T527-A531 VanDerWaalsContact O-CB 3.29Å; T527-A531 WeakPolarHBondContact O-CB 3.5Å; T527-A531 PolarHBondContact O-N 2.85Å; T527-M553 HydrophobicContact CG2-CB 4.04Å; T527-M553 WeakPolarHBondContact CG2-O 3.45Å; T527-M553 HydrophobicContact CG2-SD 4.43Å; T527-M553 PolarHBondContact OG1-SD 2.93Å; T527-V557 HydrophobicContact CG2-CG2 3.65Å
528	R	97	Very high	96.5	Very high	96 Å²	96	30.2 Å²	30.2	36%	0.362	14%	0.136	S	C	.	.	H	α-helix	trans	-64	-42.2	178	-68.2	166.4	-176.9	-82	4.4	111.7	E524 K525 Y526 K532 I560	E524-R528 WeakPolarHBondContact O-CB 3.44Å; E524-R528 WeakPolarHBondContact O-CD 3.19Å; E524-R528 WeakPolarHBondContact O-CG 3.45Å; E524-R528 PolarHBondContact O-N 3.15Å; E524-R528 IonicContact OE2-CZ 3.5Å; E524-R528 IonicContact OE2-NE 3.3Å; E524-R528 PolarHBondContact OE2-NE 3.31Å; E524-R528 VanDerWaalsContact OE2-NE 3.15Å; E524-R528 IonicContact OE2-NH2 3.78Å; E524-R528 PolarHBondContact OE2-NH2 3.37Å; K525-R528 PolarHBondContact O-N 3.19Å; Y526-R528 VanDerWaalsContact C-N 3.3Å; Y526-R528 PolarHBondContact O-N 3.44Å; R528-K532 WeakPolarHBondContact O-CB 3.3Å; R528-K532 PolarHBondContact O-N 3Å; R528-I560 HydrophobicContact CB-CD1 3.71Å; R528-I560 HydrophobicContact CG-CD1 3.73Å
529	S	94.1	Very high	96.4	Very high	41 Å²	41	27.2 Å²	27.2	29%	0.287	12%	0.123	S	C	.	.	H	α-helix	trans	-63.2	-45.4	176.6	-62.7	0	0	0	0	112	K525 Y526 K532 I533	K525-S529 PolarHBondContact O-N 3.22Å; K525-S529 VanDerWaalsContact O-N 3.07Å; K525-S529 PolarHBondContact O-OG 3.11Å; K525-S529 VanDerWaalsContact O-OG 3.05Å; Y526-S529 WeakPolarHBondContact O-CB 3.31Å; Y526-S529 PolarHBondContact O-N 2.96Å; Y526-S529 VanDerWaalsContact O-N 3.13Å; S529-K532 PolarHBondContact O-N 3.36Å; S529-I533 WeakPolarHBondContact O-CG1 3.36Å; S529-I533 PolarHBondContact O-N 3.15Å
530	V	96.5	Very high	96.1	Very high	1 Å²	1	28 Å²	28	1%	0.006	13%	0.128	C	C	.	.	H	α-helix	trans	-62.6	-49.5	176.2	176.6	0	0	0	0	111	L225 Y526 T527 K532 I533 F534 I537	L225-V530 HydrophobicContact CD1-CB 4.43Å; L225-V530 HydrophobicContact CD1-CG2 4.31Å; Y526-V530 HydrophobicContact CD2-CG2 3.87Å; Y526-V530 HydrophobicContact CE2-CG2 3.48Å; Y526-V530 VanDerWaalsContact CE2-CG2 3.48Å; Y526-V530 PolarHBondContact O-N 3.41Å; T527-V530 PolarHBondContact O-N 2.95Å; V530-K532 VanDerWaalsContact C-N 3.29Å; V530-K532 PolarHBondContact O-N 3.25Å; V530-I533 PolarHBondContact O-N 3.38Å; V530-I533 VanDerWaalsContact O-N 3.16Å; V530-F534 HydrophobicContact CG1-CD2 3.94Å; V530-F534 WeakPolarHBondContact O-CD2 3.43Å; V530-F534 PolarHBondContact O-N 2.92Å; V530-I537 HydrophobicContact CG1-CD1 4.06Å; V530-I537 HydrophobicContact CG1-CG1 4.21Å
531	A	95.4	Very high	95.6	Very high	1 Å²	1	28.9 Å²	28.9	1%	0.008	13%	0.134	C	C	.	.	H	α-helix	trans	-64.3	-29.9	-178.4	0	0	0	0	0	114.2	T527 I537 V557 I560 R561	T527-A531 VanDerWaalsContact O-CB 3.29Å; T527-A531 WeakPolarHBondContact O-CB 3.5Å; T527-A531 PolarHBondContact O-N 2.85Å; A531-I537 HydrophobicContact CB-CD1 4.37Å; A531-V557 HydrophobicContact CB-CB 4.3Å; A531-V557 HydrophobicContact CB-CG1 4.2Å; A531-V557 HydrophobicContact CB-CG2 4.12Å; A531-I560 HydrophobicContact CB-CB 4.23Å; A531-I560 HydrophobicContact CB-CD1 4.34Å; A531-I560 HydrophobicContact CB-CG2 4.17Å; A531-R561 PolarHBondContact O-NE 3.14Å
532	K	95.2	Very high	95.2	Very high	116 Å²	116	25.3 Å²	25.3	50%	0.504	12%	0.117	S	C	.	.	H	α-helix	trans	-66	-43.7	174.6	-168.4	-169.9	-177.5	-148.1	0	110.8	E207 R528 S529 V530 I560 R561	E207-K532 WeakPolarHBondContact OE1-CE 3.42Å; E207-K532 IonicContact OE1-NZ 2.65Å; E207-K532 WeakPolarHBondContact OE2-CD 3.15Å; E207-K532 WeakPolarHBondContact OE2-CE 3.32Å; E207-K532 IonicContact OE2-NZ 3.53Å; E207-K532 PolarHBondContact OE2-NZ 2.91Å; R528-K532 WeakPolarHBondContact O-CB 3.3Å; R528-K532 PolarHBondContact O-N 3Å; S529-K532 PolarHBondContact O-N 3.36Å; V530-K532 VanDerWaalsContact C-N 3.29Å; V530-K532 PolarHBondContact O-N 3.25Å; K532-I560 HydrophobicContact CB-CG2 4.44Å; K532-R561 PolarHBondContact O-NH2 3.28Å
533	I	95	Very high	94.4	Very high	6 Å²	6	27 Å²	27	3%	0.031	13%	0.128	C	C	.	.	H	α-helix	trans	-81.4	-53.9	-173.3	-64.9	174.3	0	0	0	111.7	F203 L206 E207 V210 S529 V530 R561	F203-I533 HydrophobicContact CB-CD1 4.36Å; F203-I533 HydrophobicContact CD1-CD1 3.79Å; L206-I533 HydrophobicContact CD2-CD1 4.19Å; L206-I533 HydrophobicContact CD2-CG2 4.38Å; L206-I533 HydrophobicContact CG-CD1 4.43Å; L206-I533 HydrophobicContact CG-CG2 4.1Å; E207-I533 HydrophobicContact CB-CG1 4.01Å; E207-I533 HydrophobicContact CG-CG1 4.22Å; V210-I533 HydrophobicContact CB-CG2 4.31Å; V210-I533 WeakPolarHBondContact CG1-O 3.38Å; V210-I533 HydrophobicContact CG2-CG2 3.84Å; S529-I533 WeakPolarHBondContact O-CG1 3.36Å; S529-I533 PolarHBondContact O-N 3.15Å; V530-I533 PolarHBondContact O-N 3.38Å; V530-I533 VanDerWaalsContact O-N 3.16Å; I533-R561 PolarHBondContact O-NH2 3.33Å
534	F	95.6	Very high	93.7	Very high	3 Å²	3	27.5 Å²	27.5	1%	0.013	13%	0.131	C	C	.	.			trans	-93.4	149.1	-165.7	-63.4	-80.9	0	0	0	113.8	L169 L206 V210 V530 R561	L169-F534 HydrophobicContact CD1-CE1 4.04Å; L169-F534 HydrophobicContact CD1-CZ 4.45Å; L206-F534 HydrophobicContact CD2-CZ 4.14Å; V210-F534 HydrophobicContact CG2-CE1 4.38Å; V530-F534 HydrophobicContact CG1-CD2 3.94Å; V530-F534 WeakPolarHBondContact O-CD2 3.43Å; V530-F534 PolarHBondContact O-N 2.92Å; F534-R561 WeakPolarHBondContact O-CD 3.32Å; F534-R561 PolarHBondContact O-NE 2.96Å
535	H	94.1	Very high	93.2	Very high	13 Å²	13	25.5 Å²	25.5	6%	0.06	12%	0.122	C	C	.	.	S	Bend	trans	-79.7	-34.7	178.4	-59.4	78.4	0	0	0	112.8	E214 L220 T221 R561 A564 Y565	E214-H535 IonicContact OE1-NE2 2.75Å; E214-H535 IonicContact OE2-CE1 3.46Å; E214-H535 IonicContact OE2-NE2 2.65Å; E214-H535 PolarHBondContact OE2-NE2 3.49Å; L220-H535 HydrophobicContact CB-CB 4.35Å; L220-H535 HydrophobicContact CD2-CB 4.18Å; T221-H535 PolarHBondContact N-ND1 2.99Å; T221-H535 CarbonylContact O-C 3.55Å; T221-H535 VanDerWaalsContact O-CA 3.3Å; T221-H535 WeakPolarHBondContact O-CA 3.07Å; T221-H535 VanDerWaalsContact O-CB 3.26Å; T221-H535 WeakPolarHBondContact O-CB 3.41Å; T221-H535 PolarHBondContact O-N 3.3Å; T221-H535 PolarHBondContact OG1-ND1 3.16Å; H535-R561 PolarHBondContact CD2-NH1 3.21Å; H535-R561 PolarHBondContact NE2-NH1 3.44Å; H535-A564 WeakPolarHBondContact O-CA 3.46Å; H535-Y565 PolarHBondContact O-N 2.87Å
536	G	94.7	Very high	92.7	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	162.7	174	0	0	0	0	0	112.6	T221 M222 S223 Y565	T221-G536 PolarHBondContact O-N 3.42Å; M222-G536 WeakPolarHBondContact CA-O 3.44Å; M222-G536 VanDerWaalsContact CG-C 3.49Å; S223-G536 PolarHBondContact N-O 3.06Å; G536-Y565 CarbonylContact C-O 3.56Å; G536-Y565 WeakPolarHBondContact CA-O 3.44Å
537	I	96.9	Very high	92.3	Very high	1 Å²	1	22.6 Å²	22.6	1%	0.005	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	129.2	171.2	-64.1	-173.8	0	0	0	109	S223 L225 V530 A531 V539 V557 Y565 I566 C567	S223-I537 WeakPolarHBondContact O-CA 3.4Å; L225-I537 HydrophobicContact CB-CG2 3.55Å; L225-I537 HydrophobicContact CD2-CG2 4.11Å; L225-I537 HydrophobicContact CG-CG2 4.45Å; V530-I537 HydrophobicContact CG1-CD1 4.06Å; V530-I537 HydrophobicContact CG1-CG1 4.21Å; A531-I537 HydrophobicContact CB-CD1 4.37Å; I537-V539 HydrophobicContact CG2-CG2 4.42Å; I537-V557 HydrophobicContact CD1-CB 4.23Å; I537-V557 HydrophobicContact CD1-CG1 3.65Å; I537-V557 HydrophobicContact CD1-CG2 3.46Å; I537-V557 VanDerWaalsContact CD1-CG2 3.46Å; I537-Y565 PolarHBondContact N-O 3.1Å; I537-I566 WeakPolarHBondContact O-CA 3.14Å; I537-C567 PolarHBondContact O-N 3.1Å
538	N	97	Very high	91.8	Very high	12 Å²	12	25.7 Å²	25.7	6%	0.064	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	122	163.9	179.2	42.8	0	0	0	108.5	M222 S223 D224 L225 V540 C567 A568 I590	M222-N538 HydrophobicContact CE-CB 4.24Å; M222-N538 HydrophobicContact SD-CB 4.29Å; S223-N538 PolarHBondContact O-N 3.25Å; D224-N538 CarbonylContact C-O 3.59Å; D224-N538 WeakPolarHBondContact CA-O 3.34Å; D224-N538 WeakPolarHBondContact OD1-CB 3.48Å; D224-N538 PolarHBondContact OD1-ND2 3.26Å; L225-N538 PolarHBondContact N-O 3.11Å; N538-V540 PolarHBondContact O-N 2.92Å; N538-C567 CarbonylContact C-O 3.47Å; N538-C567 WeakPolarHBondContact CA-O 3.34Å; N538-A568 WeakPolarHBondContact OD1-CA 3.5Å; N538-I590 WeakPolarHBondContact OD1-CD1 3.46Å
539	V	95.6	Very high	91.7	Very high	1 Å²	1	21.1 Å²	21.1	1%	0.006	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	105.8	175.1	-171.1	0	0	0	0	108.5	I537 L542 L554 C567 A568	I537-V539 HydrophobicContact CG2-CG2 4.42Å; V539-L542 HydrophobicContact CB-CD1 4.15Å; V539-L542 HydrophobicContact CG1-CB 4.25Å; V539-L542 HydrophobicContact CG1-CD1 3.59Å; V539-L554 HydrophobicContact CG2-CD1 4.27Å; V539-L554 HydrophobicContact CG2-CD2 3.93Å; V539-C567 PolarHBondContact N-O 2.67Å; V539-A568 HydrophobicContact CB-CB 4.44Å
540	V	92.2	Very high	91.7	Very high	17 Å²	17	19.2 Å²	19.2	10%	0.103	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	137.6	-179.5	177.7	0	0	0	0	109.4	W182 D224 L225 V226 N538 L542	W182-V540 HydrophobicContact CG-CG1 4.26Å; D224-V540 HydrophobicContact CB-CG2 3.48Å; D224-V540 VanDerWaalsContact CB-CG2 3.48Å; D224-V540 WeakPolarHBondContact OD1-CG2 3.36Å; L225-V540 PolarHBondContact O-N 2.7Å; L225-V540 VanDerWaalsContact O-N 3.15Å; V226-V540 HydrophobicContact CG2-CB 4.08Å; V226-V540 HydrophobicContact CG2-CG1 4.31Å; V226-V540 HydrophobicContact CG2-CG2 4.18Å; N538-V540 PolarHBondContact O-N 2.92Å; V540-L542 PolarHBondContact O-N 3.03Å; V540-L542 VanDerWaalsContact O-N 3.16Å
541	D	86.3	Confident	91.5	Very high	31 Å²	31	20.5 Å²	20.5	17%	0.166	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.2	41.9	170.8	-173.7	31.4	0	0	0	111.7	S228 H229 N473 W501 L543 S544 S545	S228-D541 VanDerWaalsContact CB-OD2 3.28Å; S228-D541 WeakPolarHBondContact CB-OD2 3.36Å; S228-D541 PolarHBondContact OG-OD2 3.12Å; H229-D541 IonicContact ND1-OD2 2.76Å; N473-D541 PolarHBondContact ND2-OD2 3.01Å; W501-D541 HydrophobicContact CH2-CB 4.22Å; W501-D541 HydrophobicContact CZ3-CB 4.33Å; W501-D541 WeakPolarHBondContact CZ3-OD2 3.29Å; D541-L543 PolarHBondContact O-N 3.34Å; D541-L543 VanDerWaalsContact O-N 3.16Å; D541-S544 WeakPolarHBondContact O-CA 3.38Å; D541-S544 WeakPolarHBondContact O-CB 3.5Å; D541-S544 PolarHBondContact O-N 2.9Å; D541-S544 WeakPolarHBondContact OD1-CB 3.4Å; D541-S544 PolarHBondContact OD1-OG 3.13Å; D541-S544 WeakPolarHBondContact OD2-CB 3.49Å; D541-S544 PolarHBondContact OD2-OG 2.7Å; D541-S544 VanDerWaalsContact OD2-OG 3.07Å; D541-S545 PolarHBondContact O-N 2.62Å
542	L	87.6	Confident	91.4	Very high	11 Å²	11	23.3 Å²	23.3	6%	0.058	12%	0.116	C	C	.	.	G	3₁₀ helix	trans	-55.4	-34.3	-178.8	-177	73.6	0	0	0	111.6	V539 V540 S544 S545 C550 A568 L570 I580 L584 L586	V539-L542 HydrophobicContact CB-CD1 4.15Å; V539-L542 HydrophobicContact CG1-CB 4.25Å; V539-L542 HydrophobicContact CG1-CD1 3.59Å; V540-L542 PolarHBondContact O-N 3.03Å; V540-L542 VanDerWaalsContact O-N 3.16Å; L542-S544 PolarHBondContact O-N 3.39Å; L542-S544 VanDerWaalsContact O-N 3.15Å; L542-S545 PolarHBondContact O-N 3.16Å; L542-C550 HydrophobicContact CD1-CB 4.02Å; L542-C550 VanDerWaalsContact CD1-SG 3.55Å; L542-A568 HydrophobicContact CB-CB 4.28Å; L542-A568 HydrophobicContact CD2-CB 3.87Å; L542-L570 HydrophobicContact CB-CD2 4.45Å; L542-L570 HydrophobicContact CD2-CD1 3.95Å; L542-L570 HydrophobicContact CD2-CD2 4.21Å; L542-L570 HydrophobicContact CD2-CG 4.35Å; L542-I580 HydrophobicContact CD2-CG2 3.88Å; L542-L584 HydrophobicContact CD1-CD1 3.69Å; L542-L584 HydrophobicContact CD2-CD1 3.88Å; L542-L584 HydrophobicContact CG-CD1 4.32Å; L542-L586 HydrophobicContact CD2-CD1 4.3Å
543	L	80.7	Confident	91.5	Very high	57 Å²	57	17.8 Å²	17.8	30%	0.298	9%	0.092	S	C	.	.	G	3₁₀ helix	trans	-75	11.1	175	-61.4	178.6	0	0	0	114.4	P482 D541 L570	P482-L543 WeakPolarHBondContact CA-O 3.41Å; P482-L543 WeakPolarHBondContact CB-O 3.24Å; P482-L543 WeakPolarHBondContact CD-O 3.34Å; P482-L543 VanDerWaalsContact CG-C 3.44Å; P482-L543 VanDerWaalsContact CG-O 3.29Å; P482-L543 WeakPolarHBondContact CG-O 3.44Å; D541-L543 PolarHBondContact O-N 3.34Å; D541-L543 VanDerWaalsContact O-N 3.16Å; L543-L570 HydrophobicContact CD1-CD2 3.79Å; L543-L570 HydrophobicContact CD2-CD2 3.78Å; L543-L570 HydrophobicContact CG-CD2 3.48Å; L543-L570 VanDerWaalsContact CG-CD2 3.48Å
544	S	82.6	Confident	91.5	Very high	9 Å²	9	17.8 Å²	17.8	6%	0.063	9%	0.092	C	C	.	.	G	3₁₀ helix	trans	-119.4	-12.5	168.2	-75.2	0	0	0	0	113.6	S228 K506 D541 L542	S228-S544 VanDerWaalsContact CB-CB 3.48Å; K506-S544 WeakPolarHBondContact CE-O 3.38Å; K506-S544 VanDerWaalsContact NZ-CB 3.26Å; K506-S544 PolarHBondContact NZ-O 3.13Å; D541-S544 WeakPolarHBondContact O-CA 3.38Å; D541-S544 WeakPolarHBondContact O-CB 3.5Å; D541-S544 PolarHBondContact O-N 2.9Å; D541-S544 WeakPolarHBondContact OD1-CB 3.4Å; D541-S544 PolarHBondContact OD1-OG 3.13Å; D541-S544 WeakPolarHBondContact OD2-CB 3.49Å; D541-S544 PolarHBondContact OD2-OG 2.7Å; D541-S544 VanDerWaalsContact OD2-OG 3.07Å; L542-S544 PolarHBondContact O-N 3.39Å; L542-S544 VanDerWaalsContact O-N 3.15Å
545	S	87.3	Confident	91.4	Very high	2 Å²	2	21.8 Å²	21.8	1%	0.014	11%	0.109	C	C	.	.	S	Bend	trans	-94.1	144.5	-179.2	-72	0	0	0	0	112	L227 S228 P482 D541 L542 I547 C550	L227-S545 VanDerWaalsContact C-OG 3.25Å; L227-S545 PolarHBondContact O-OG 3.33Å; S228-S545 WeakPolarHBondContact CA-OG 3.46Å; S228-S545 WeakPolarHBondContact CB-OG 3.32Å; S228-S545 PolarHBondContact N-OG 3.49Å; P482-S545 WeakPolarHBondContact CG-O 3.2Å; D541-S545 PolarHBondContact O-N 2.62Å; L542-S545 PolarHBondContact O-N 3.16Å; S545-I547 PolarHBondContact O-N 2.83Å; S545-C550 WeakPolarHBondContact CB-SG 3.47Å
546	P	87.7	Confident	91.5	Very high	28 Å²	28	22 Å²	22	18%	0.182	11%	0.111	C	C	.	.			trans	-65.9	133.6	173.1	-18.1	31.2	0	0	0	111.6	Y509 H548 V549 C550	Y509-P546 HydrophobicContact CD2-CG 4.41Å; P546-H548 VanDerWaalsContact C-N 3.31Å; P546-H548 WeakPolarHBondContact CB-CE1 3.1Å; P546-H548 WeakPolarHBondContact CB-ND1 3.28Å; P546-H548 PolarHBondContact O-N 3.24Å; P546-V549 HydrophobicContact CB-CB 4.4Å; P546-V549 HydrophobicContact CB-CG2 3.88Å; P546-V549 HydrophobicContact CG-CG2 4.09Å; P546-V549 WeakPolarHBondContact O-CB 3.44Å; P546-V549 PolarHBondContact O-N 2.99Å; P546-V549 VanDerWaalsContact O-N 3.08Å; P546-C550 PolarHBondContact O-N 3.4Å; P546-C550 VanDerWaalsContact O-N 3.12Å; P546-C550 PolarHBondContact O-SG 3.41Å
547	I	87.9	Confident	91.6	Very high	28 Å²	28	22 Å²	22	14%	0.144	11%	0.111	C	C	.	.	H	α-helix	trans	-65.8	-32.4	-169.7	-160.8	162.4	0	0	0	113.2	Q483 S545 V549 C550 E551 Q583 L584	Q483-I547 VanDerWaalsContact NE2-CG2 3.28Å; S545-I547 PolarHBondContact O-N 2.83Å; I547-V549 VanDerWaalsContact C-N 3.33Å; I547-C550 PolarHBondContact O-N 3.4Å; I547-E551 WeakPolarHBondContact O-CB 3.46Å; I547-E551 PolarHBondContact O-N 2.98Å; I547-Q583 VanDerWaalsContact CD1-OE1 3.27Å; I547-L584 HydrophobicContact CG1-CD1 4.44Å; I547-L584 HydrophobicContact CG1-CD2 4.02Å; I547-L584 HydrophobicContact CG1-CG 4.36Å
548	H	89.3	Confident	91.4	Very high	66 Å²	66	23.3 Å²	23.3	31%	0.306	12%	0.116	S	C	.	.	H	α-helix	trans	-68.1	-32.3	176.1	63.4	-69.1	0	0	0	112.5	G510 K511 P546 H552	G510-H548 PolarHBondContact O-CE1 3.04Å; G510-H548 PolarHBondContact O-NE2 3.48Å; K511-H548 PolarHBondContact O-CD2 3.39Å; K511-H548 PolarHBondContact O-NE2 2.92Å; P546-H548 VanDerWaalsContact C-N 3.31Å; P546-H548 WeakPolarHBondContact CB-CE1 3.1Å; P546-H548 WeakPolarHBondContact CB-ND1 3.28Å; P546-H548 PolarHBondContact O-N 3.24Å; H548-H552 WeakPolarHBondContact O-CB 3.19Å; H548-H552 PolarHBondContact O-N 3.32Å
549	V	93.1	Very high	91.2	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-67.7	-48.2	172.4	179.4	0	0	0	0	109.3	Y509 W520 P546 I547 E551 H552 M553	Y509-V549 HydrophobicContact CD1-CB 4.43Å; Y509-V549 HydrophobicContact CD1-CG1 3.67Å; Y509-V549 HydrophobicContact CD1-CG2 3.81Å; Y509-V549 HydrophobicContact CD2-CG1 4.21Å; Y509-V549 HydrophobicContact CD2-CG2 4.01Å; Y509-V549 HydrophobicContact CE1-CG1 3.54Å; Y509-V549 HydrophobicContact CE2-CG1 4.1Å; Y509-V549 HydrophobicContact CG-CB 4.39Å; Y509-V549 HydrophobicContact CG-CG1 4Å; Y509-V549 HydrophobicContact CG-CG2 3.51Å; W520-V549 HydrophobicContact CH2-CB 4.37Å; W520-V549 HydrophobicContact CH2-CG2 3.81Å; W520-V549 HydrophobicContact CZ2-CG2 3.67Å; P546-V549 HydrophobicContact CB-CB 4.4Å; P546-V549 HydrophobicContact CB-CG2 3.88Å; P546-V549 HydrophobicContact CG-CG2 4.09Å; P546-V549 WeakPolarHBondContact O-CB 3.44Å; P546-V549 PolarHBondContact O-N 2.99Å; P546-V549 VanDerWaalsContact O-N 3.08Å; I547-V549 VanDerWaalsContact C-N 3.33Å; V549-E551 VanDerWaalsContact C-N 3.34Å; V549-E551 PolarHBondContact O-N 3.05Å; V549-H552 PolarHBondContact O-N 3.47Å; V549-M553 HydrophobicContact CG1-CE 4.36Å; V549-M553 HydrophobicContact CG1-CG 4.29Å; V549-M553 WeakPolarHBondContact O-CB 3.46Å; V549-M553 VanDerWaalsContact O-CG 3.27Å; V549-M553 WeakPolarHBondContact O-CG 3.36Å; V549-M553 PolarHBondContact O-N 2.85Å
550	C	94.4	Very high	91.1	Very high	1 Å²	1	34 Å²	34	1%	0.007	16%	0.164	C	C	.	.	H	α-helix	trans	-58.5	-45.5	176.5	-60.5	0	0	0	0	111.5	L542 S545 P546 I547 H552 M553 L554 L584	L542-C550 HydrophobicContact CD1-CB 4.02Å; L542-C550 VanDerWaalsContact CD1-SG 3.55Å; S545-C550 WeakPolarHBondContact CB-SG 3.47Å; P546-C550 PolarHBondContact O-N 3.4Å; P546-C550 VanDerWaalsContact O-N 3.12Å; P546-C550 PolarHBondContact O-SG 3.41Å; I547-C550 PolarHBondContact O-N 3.4Å; C550-H552 PolarHBondContact O-N 2.65Å; C550-M553 PolarHBondContact O-N 3.36Å; C550-L554 WeakPolarHBondContact O-CB 3.4Å; C550-L554 WeakPolarHBondContact O-CG 3.39Å; C550-L554 PolarHBondContact O-N 2.77Å; C550-L584 HydrophobicContact CB-CD1 4.09Å; C550-L584 HydrophobicContact CB-CD2 3.79Å
551	E	93.4	Very high	91	Very high	27 Å²	27	36 Å²	36	13%	0.126	17%	0.169	C	C	.	.	H	α-helix	trans	-59.8	-46.6	177.8	-170.2	-175	151.6	0	0	111.5	I547 V549 L554 K555 Q583 L584	I547-E551 WeakPolarHBondContact O-CB 3.46Å; I547-E551 PolarHBondContact O-N 2.98Å; V549-E551 VanDerWaalsContact C-N 3.34Å; V549-E551 PolarHBondContact O-N 3.05Å; E551-L554 PolarHBondContact O-N 2.93Å; E551-K555 HydrophobicContact CG-CD 4.16Å; E551-K555 VanDerWaalsContact O-CB 3.3Å; E551-K555 WeakPolarHBondContact O-CB 3.43Å; E551-K555 WeakPolarHBondContact O-CG 3.24Å; E551-K555 PolarHBondContact O-N 3.17Å; E551-K555 VanDerWaalsContact OE1-CE 3.3Å; E551-K555 WeakPolarHBondContact OE1-CE 3.46Å; E551-K555 IonicContact OE1-NZ 2.77Å; E551-K555 PolarHBondContact OE1-NZ 3.33Å; E551-Q583 HydrophobicContact CG-CG 4.4Å; E551-Q583 VanDerWaalsContact OE2-CG 3.29Å; E551-Q583 WeakPolarHBondContact OE2-CG 3.11Å; E551-Q583 PolarHBondContact OE2-NE2 2.8Å; E551-L584 HydrophobicContact CB-CD2 3.88Å
552	H	93.6	Very high	91.2	Very high	61 Å²	61	37.1 Å²	37.1	28%	0.282	18%	0.179	S	C	.	.	H	α-helix	trans	-61.3	-49.4	176.9	-176.4	79	0	0	0	112.2	W520 E524 H548 V549 C550 L554 K555 L556	W520-H552 AromaticContact CE3-CD2 3.93Å; W520-H552 HydrophobicContact CZ3-CB 3.91Å; W520-H552 AromaticContact CZ3-CD2 3.62Å; W520-H552 AromaticContact CZ3-CG 3.79Å; E524-H552 IonicContact OE1-CD2 3.5Å; E524-H552 IonicContact OE1-CE1 3.74Å; E524-H552 IonicContact OE1-NE2 3.68Å; E524-H552 PolarHBondContact OE1-NE2 2.81Å; H548-H552 WeakPolarHBondContact O-CB 3.19Å; H548-H552 PolarHBondContact O-N 3.32Å; V549-H552 PolarHBondContact O-N 3.47Å; C550-H552 PolarHBondContact O-N 2.65Å; H552-L554 PolarHBondContact O-N 3.36Å; H552-K555 WeakPolarHBondContact O-CB 3.3Å; H552-K555 PolarHBondContact O-N 3.26Å; H552-L556 WeakPolarHBondContact O-CG 3.17Å; H552-L556 PolarHBondContact O-N 3.38Å
553	M	96.3	Very high	91.4	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-63	-41.3	180	-64.4	-56.4	169.5	0	0	111.3	L227 W520 M523 E524 T527 V549 C550 L556 V557	L227-M553 HydrophobicContact CD1-CB 3.98Å; L227-M553 HydrophobicContact CD1-CG 3.99Å; L227-M553 HydrophobicContact CD2-CG 4.23Å; W520-M553 HydrophobicContact CE3-CE 4.24Å; M523-M553 HydrophobicContact CB-CE 3.72Å; E524-M553 HydrophobicContact CG-CE 4.19Å; E524-M553 HydrophobicContact CG-SD 4.24Å; T527-M553 HydrophobicContact CG2-CB 4.04Å; T527-M553 WeakPolarHBondContact CG2-O 3.45Å; T527-M553 HydrophobicContact CG2-SD 4.43Å; T527-M553 PolarHBondContact OG1-SD 2.93Å; V549-M553 HydrophobicContact CG1-CE 4.36Å; V549-M553 HydrophobicContact CG1-CG 4.29Å; V549-M553 WeakPolarHBondContact O-CB 3.46Å; V549-M553 VanDerWaalsContact O-CG 3.27Å; V549-M553 WeakPolarHBondContact O-CG 3.36Å; V549-M553 PolarHBondContact O-N 2.85Å; C550-M553 PolarHBondContact O-N 3.36Å; M553-L556 WeakPolarHBondContact O-CB 3.47Å; M553-L556 PolarHBondContact O-N 3.18Å; M553-L556 HydrophobicContact SD-CD1 4.27Å; M553-V557 WeakPolarHBondContact O-CG2 3.49Å; M553-V557 PolarHBondContact O-N 2.97Å
554	L	96.1	Very high	92	Very high	5 Å²	5	36.6 Å²	36.6	3%	0.026	18%	0.177	C	C	.	.	H	α-helix	trans	-73.4	-30.7	177.6	-62.6	177.5	0	0	0	113	V539 C550 E551 H552 L556 V557 R558 I566 L584 L586	V539-L554 HydrophobicContact CG2-CD1 4.27Å; V539-L554 HydrophobicContact CG2-CD2 3.93Å; C550-L554 WeakPolarHBondContact O-CB 3.4Å; C550-L554 WeakPolarHBondContact O-CG 3.39Å; C550-L554 PolarHBondContact O-N 2.77Å; E551-L554 PolarHBondContact O-N 2.93Å; H552-L554 PolarHBondContact O-N 3.36Å; L554-L556 VanDerWaalsContact C-N 3.3Å; L554-L556 PolarHBondContact O-N 2.96Å; L554-V557 HydrophobicContact CD2-CG2 4.23Å; L554-V557 WeakPolarHBondContact O-CB 3.39Å; L554-V557 PolarHBondContact O-N 2.97Å; L554-R558 WeakPolarHBondContact O-CG 3.11Å; L554-R558 PolarHBondContact O-N 3.2Å; L554-I566 HydrophobicContact CD1-CG2 3.99Å; L554-I566 HydrophobicContact CD2-CD1 4.25Å; L554-I566 HydrophobicContact CD2-CG2 3.7Å; L554-I566 HydrophobicContact CG-CG2 4.42Å; L554-L584 HydrophobicContact CD1-CB 3.86Å; L554-L584 HydrophobicContact CD1-CD1 4.49Å; L554-L584 HydrophobicContact CD1-CD2 4.4Å; L554-L584 HydrophobicContact CD1-CG 4.49Å; L554-L586 HydrophobicContact CD1-CD2 4.35Å
555	K	93.1	Very high	92.5	Very high	88 Å²	88	36.2 Å²	36.2	38%	0.383	17%	0.174	S	C	.	.	H	α-helix	trans	-59.5	-39.9	166	-81.7	173.6	166.6	173.5	0	110.7	D64 E551 H552 K559	D64-K555 IonicContact OD1-NZ 3.66Å; D64-K555 PolarHBondContact OD1-NZ 3.26Å; E551-K555 HydrophobicContact CG-CD 4.16Å; E551-K555 VanDerWaalsContact O-CB 3.3Å; E551-K555 WeakPolarHBondContact O-CB 3.43Å; E551-K555 WeakPolarHBondContact O-CG 3.24Å; E551-K555 PolarHBondContact O-N 3.17Å; E551-K555 VanDerWaalsContact OE1-CE 3.3Å; E551-K555 WeakPolarHBondContact OE1-CE 3.46Å; E551-K555 IonicContact OE1-NZ 2.77Å; E551-K555 PolarHBondContact OE1-NZ 3.33Å; H552-K555 WeakPolarHBondContact O-CB 3.3Å; H552-K555 PolarHBondContact O-N 3.26Å; K555-K559 WeakPolarHBondContact O-CB 3.21Å; K555-K559 PolarHBondContact O-N 3.34Å; K555-K559 VanDerWaalsContact O-N 3.07Å
556	L	95.2	Very high	92.9	Very high	18 Å²	18	36.1 Å²	36.1	9%	0.094	17%	0.173	C	C	.	.	H	α-helix	trans	-67.4	-40.8	173	-65.8	175.7	0	0	0	113.2	E524 H552 M553 L554 K559 I560	E524-L556 HydrophobicContact CB-CD1 4.23Å; E524-L556 VanDerWaalsContact CD-CD1 3.44Å; E524-L556 HydrophobicContact CG-CD1 3.53Å; H552-L556 WeakPolarHBondContact O-CG 3.17Å; H552-L556 PolarHBondContact O-N 3.38Å; M553-L556 WeakPolarHBondContact O-CB 3.47Å; M553-L556 PolarHBondContact O-N 3.18Å; M553-L556 HydrophobicContact SD-CD1 4.27Å; L554-L556 VanDerWaalsContact C-N 3.3Å; L554-L556 PolarHBondContact O-N 2.96Å; L556-K559 WeakPolarHBondContact O-CB 3.24Å; L556-K559 PolarHBondContact O-N 3.14Å; L556-I560 PolarHBondContact O-N 3.48Å; L556-I560 VanDerWaalsContact O-N 3.16Å
557	V	96.5	Very high	93.3	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-56.4	-52.5	173.5	172.2	0	0	0	0	110.3	T527 A531 I537 M553 L554 K559 I560 R561 A564 I566	T527-V557 HydrophobicContact CG2-CG2 3.65Å; A531-V557 HydrophobicContact CB-CB 4.3Å; A531-V557 HydrophobicContact CB-CG1 4.2Å; A531-V557 HydrophobicContact CB-CG2 4.12Å; I537-V557 HydrophobicContact CD1-CB 4.23Å; I537-V557 HydrophobicContact CD1-CG1 3.65Å; I537-V557 HydrophobicContact CD1-CG2 3.46Å; I537-V557 VanDerWaalsContact CD1-CG2 3.46Å; M553-V557 WeakPolarHBondContact O-CG2 3.49Å; M553-V557 PolarHBondContact O-N 2.97Å; L554-V557 HydrophobicContact CD2-CG2 4.23Å; L554-V557 WeakPolarHBondContact O-CB 3.39Å; L554-V557 PolarHBondContact O-N 2.97Å; V557-K559 VanDerWaalsContact C-N 3.26Å; V557-K559 PolarHBondContact O-N 3.48Å; V557-I560 PolarHBondContact O-N 2.98Å; V557-I560 VanDerWaalsContact O-N 3.12Å; V557-R561 PolarHBondContact O-N 3.27Å; V557-A564 HydrophobicContact CG1-CB 3.85Å; V557-I566 HydrophobicContact CG1-CD1 4.03Å; V557-I566 HydrophobicContact CG1-CG1 4.39Å
558	R	92.9	Very high	93.6	Very high	28 Å²	28	33.5 Å²	33.5	11%	0.106	16%	0.158	C	C	.	.	H	α-helix	trans	-62.6	-30.6	179.4	-70.3	-71.8	-174.8	-158.6	-9.5	112.6	L554 R561 P562 A564 I566 G585	L554-R558 WeakPolarHBondContact O-CG 3.11Å; L554-R558 PolarHBondContact O-N 3.2Å; R558-R561 CarbonylContact O-C 3.49Å; R558-P562 WeakPolarHBondContact CD-O 3.5Å; R558-P562 PolarHBondContact NH1-O 3.26Å; R558-P562 VanDerWaalsContact O-CA 3.28Å; R558-P562 WeakPolarHBondContact O-CA 3.46Å; R558-P562 WeakPolarHBondContact O-CG 3.41Å; R558-A564 PolarHBondContact NH1-O 2.79Å; R558-A564 PolarHBondContact NH2-O 3.48Å; R558-I566 HydrophobicContact CG-CD1 4.03Å; R558-G585 PolarHBondContact NH2-O 2.81Å
559	K	92.3	Very high	93.7	Very high	171 Å²	171	34 Å²	34	74%	0.743	16%	0.159	S	C	*	.	H	α-helix	trans	-67.8	-34.3	174.6	-173.1	171.4	-178	171.3	0	113	K555 L556 V557	K555-K559 WeakPolarHBondContact O-CB 3.21Å; K555-K559 PolarHBondContact O-N 3.34Å; K555-K559 VanDerWaalsContact O-N 3.07Å; L556-K559 WeakPolarHBondContact O-CB 3.24Å; L556-K559 PolarHBondContact O-N 3.14Å; V557-K559 VanDerWaalsContact C-N 3.26Å; V557-K559 PolarHBondContact O-N 3.48Å
560	I	93.9	Very high	93.3	Very high	66 Å²	66	34.4 Å²	34.4	34%	0.338	16%	0.161	S	C	.	.	H	α-helix	trans	-83.6	-46.6	177.2	-71.3	170.3	0	0	0	111.3	R528 A531 K532 L556 V557	R528-I560 HydrophobicContact CB-CD1 3.71Å; R528-I560 HydrophobicContact CG-CD1 3.73Å; A531-I560 HydrophobicContact CB-CB 4.23Å; A531-I560 HydrophobicContact CB-CD1 4.34Å; A531-I560 HydrophobicContact CB-CG2 4.17Å; K532-I560 HydrophobicContact CB-CG2 4.44Å; L556-I560 PolarHBondContact O-N 3.48Å; L556-I560 VanDerWaalsContact O-N 3.16Å; V557-I560 PolarHBondContact O-N 2.98Å; V557-I560 VanDerWaalsContact O-N 3.12Å
561	R	91.5	Very high	92.4	Very high	58 Å²	58	38.5 Å²	38.5	22%	0.219	18%	0.183	C	C	.	.			trans	-132.7	86.2	-175.7	-169.6	177.7	-73.1	-122.3	11.3	109.6	A531 K532 I533 F534 H535 V557 R558 N563 A564	A531-R561 PolarHBondContact O-NE 3.14Å; K532-R561 PolarHBondContact O-NH2 3.28Å; I533-R561 PolarHBondContact O-NH2 3.33Å; F534-R561 WeakPolarHBondContact O-CD 3.32Å; F534-R561 PolarHBondContact O-NE 2.96Å; H535-R561 PolarHBondContact CD2-NH1 3.21Å; H535-R561 PolarHBondContact NE2-NH1 3.44Å; V557-R561 PolarHBondContact O-N 3.27Å; R558-R561 CarbonylContact O-C 3.49Å; R561-N563 VanDerWaalsContact C-N 3.27Å; R561-N563 PolarHBondContact O-N 3.16Å; R561-A564 HydrophobicContact CB-CB 4.36Å; R561-A564 HydrophobicContact CG-CB 4.28Å; R561-A564 VanDerWaalsContact O-CB 3.29Å; R561-A564 WeakPolarHBondContact O-CB 3.36Å; R561-A564 PolarHBondContact O-N 2.78Å
562	P	90	Very high	91.3	Very high	56 Å²	56	37.4 Å²	37.4	36%	0.364	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-40.8	-177.1	-28.9	35.1	0	0	0	113.5	P93 R558 A564	P93-P562 VanDerWaalsContact CG-C 3.49Å; P93-P562 HydrophobicContact CG-CB 3.79Å; P93-P562 VanDerWaalsContact CG-O 3.24Å; P93-P562 WeakPolarHBondContact CG-O 3.38Å; R558-P562 WeakPolarHBondContact CD-O 3.5Å; R558-P562 PolarHBondContact NH1-O 3.26Å; R558-P562 VanDerWaalsContact O-CA 3.28Å; R558-P562 WeakPolarHBondContact O-CA 3.46Å; R558-P562 WeakPolarHBondContact O-CG 3.41Å; P562-A564 PolarHBondContact O-N 2.81Å
563	N	91.2	Very high	90.4	Very high	55 Å²	55	39.4 Å²	39.4	29%	0.294	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	14.9	179.4	-58.9	-48	0	0	0	114.5	P120 N121 R561	P120-N563 HydrophobicContact CB-CB 4.28Å; P120-N563 WeakPolarHBondContact CB-O 3.16Å; N121-N563 PolarHBondContact N-OD1 2.81Å; N121-N563 WeakPolarHBondContact O-CB 3.43Å; N121-N563 PolarHBondContact O-ND2 3.49Å; N121-N563 PolarHBondContact O-OD1 3.16Å; R561-N563 VanDerWaalsContact C-N 3.27Å; R561-N563 PolarHBondContact O-N 3.16Å
564	A	92.8	Very high	89.2	Confident	2 Å²	2	40.5 Å²	40.5	2%	0.017	20%	0.198	C	C	.	.			trans	-57.5	140.4	-177.9	0	0	0	0	0	113.1	H535 V557 R558 R561 P562 I566	H535-A564 WeakPolarHBondContact O-CA 3.46Å; V557-A564 HydrophobicContact CG1-CB 3.85Å; R558-A564 PolarHBondContact NH1-O 2.79Å; R558-A564 PolarHBondContact NH2-O 3.48Å; R561-A564 HydrophobicContact CB-CB 4.36Å; R561-A564 HydrophobicContact CG-CB 4.28Å; R561-A564 VanDerWaalsContact O-CB 3.29Å; R561-A564 WeakPolarHBondContact O-CB 3.36Å; R561-A564 PolarHBondContact O-N 2.78Å; P562-A564 PolarHBondContact O-N 2.81Å; A564-I566 HydrophobicContact CB-CG1 4.11Å; A564-I566 PolarHBondContact O-N 2.82Å
565	Y	94.4	Very high	88	Confident	1 Å²	1	48.2 Å²	48.2	0%	0.004	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	101.2	169.3	-166	-88.5	0	0	0	109.4	I122 L133 I136 M222 H535 G536 I537 C567 V587 G588 F633 P666	I122-Y565 HydrophobicContact CD1-CD2 3.98Å; I122-Y565 HydrophobicContact CD1-CG 4.34Å; L133-Y565 HydrophobicContact CD2-CD2 4.19Å; L133-Y565 HydrophobicContact CD2-CE2 4.46Å; I136-Y565 HydrophobicContact CD1-CD2 3.74Å; I136-Y565 HydrophobicContact CD1-CE2 3.75Å; I136-Y565 HydrophobicContact CD1-CG 4.44Å; M222-Y565 HydrophobicContact SD-CD1 4.35Å; H535-Y565 PolarHBondContact O-N 2.87Å; G536-Y565 CarbonylContact C-O 3.56Å; G536-Y565 WeakPolarHBondContact CA-O 3.44Å; I537-Y565 PolarHBondContact N-O 3.1Å; Y565-C567 HydrophobicContact CD1-CB 4.33Å; Y565-C567 HydrophobicContact CE1-CB 3.9Å; Y565-V587 HydrophobicContact CD1-CG2 4.47Å; Y565-V587 HydrophobicContact CD2-CG2 3.83Å; Y565-V587 HydrophobicContact CE2-CG2 3.9Å; Y565-V587 HydrophobicContact CG-CG2 4.12Å; Y565-V587 PolarHBondContact OH-O 3.13Å; Y565-G588 WeakPolarHBondContact OH-CA 3.49Å; Y565-F633 HydrophobicContact CD1-CE1 4.39Å; Y565-F633 AromaticContact CE1-CD1 3.62Å; Y565-F633 HydrophobicContact CE1-CD1 3.62Å; Y565-F633 AromaticContact CE1-CE1 3.62Å; Y565-F633 HydrophobicContact CE1-CE1 3.62Å; Y565-P666 WeakPolarHBondContact OH-CG 3.23Å
566	I	96.2	Very high	87.3	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	123.3	-176.7	-54.4	177.5	0	0	0	109.1	I537 L554 V557 R558 A564 L586 V587 G588	I537-I566 WeakPolarHBondContact O-CA 3.14Å; L554-I566 HydrophobicContact CD1-CG2 3.99Å; L554-I566 HydrophobicContact CD2-CD1 4.25Å; L554-I566 HydrophobicContact CD2-CG2 3.7Å; L554-I566 HydrophobicContact CG-CG2 4.42Å; V557-I566 HydrophobicContact CG1-CD1 4.03Å; V557-I566 HydrophobicContact CG1-CG1 4.39Å; R558-I566 HydrophobicContact CG-CD1 4.03Å; A564-I566 HydrophobicContact CB-CG1 4.11Å; A564-I566 PolarHBondContact O-N 2.82Å; I566-L586 HydrophobicContact CG2-CD2 3.8Å; I566-V587 WeakPolarHBondContact O-CG2 3.39Å; I566-V587 PolarHBondContact O-N 3.22Å; I566-G588 PolarHBondContact O-N 2.99Å
567	C	96.2	Very high	86.9	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	171.6	179.9	65.7	0	0	0	0	112.6	M222 I537 N538 V539 Y565 G588	M222-C567 PolarHBondContact SD-SG 3.27Å; I537-C567 PolarHBondContact O-N 3.1Å; N538-C567 CarbonylContact C-O 3.47Å; N538-C567 WeakPolarHBondContact CA-O 3.34Å; V539-C567 PolarHBondContact N-O 2.67Å; Y565-C567 HydrophobicContact CD1-CB 4.33Å; Y565-C567 HydrophobicContact CE1-CB 3.9Å; C567-G588 WeakPolarHBondContact CA-O 3.43Å; C567-G588 WeakPolarHBondContact CB-O 3.42Å
568	A	94.3	Very high	86.7	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	151.1	172.3	0	0	0	0	0	110.3	N538 V539 L542 L570 L586 G588 I589 I590	N538-A568 WeakPolarHBondContact OD1-CA 3.5Å; V539-A568 HydrophobicContact CB-CB 4.44Å; L542-A568 HydrophobicContact CB-CB 4.28Å; L542-A568 HydrophobicContact CD2-CB 3.87Å; A568-L570 HydrophobicContact CB-CG 4.26Å; A568-L570 PolarHBondContact O-N 2.9Å; A568-L586 HydrophobicContact CB-CD1 4.31Å; A568-G588 PolarHBondContact N-O 3.07Å; A568-I589 WeakPolarHBondContact O-CA 3.34Å; A568-I590 PolarHBondContact O-N 2.94Å
569	K	89.4	Confident	86.6	Confident	76 Å²	76	51.9 Å²	51.9	33%	0.33	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	109.2	166.6	-174.3	176.9	178.9	177.8	0	108.7	I590 A638 L639 D640 E641	K569-I590 HydrophobicContact CB-CB 4.27Å; K569-I590 HydrophobicContact CB-CG2 4.46Å; K569-I590 HydrophobicContact CG-CG2 4.48Å; K569-A638 HydrophobicContact CD-CB 4.46Å; K569-L639 PolarHBondContact NZ-O 3.21Å; K569-D640 IonicContact NZ-OD1 3.04Å; K569-D640 PolarHBondContact NZ-OD1 3.35Å; K569-D640 IonicContact NZ-OD2 2.66Å; K569-D640 PolarHBondContact NZ-OD2 3.26Å; K569-E641 IonicContact NZ-OE1 3.93Å; K569-E641 PolarHBondContact NZ-OE1 2.87Å
570	L	84.7	Confident	86.5	Confident	9 Å²	9	44 Å²	44	5%	0.047	22%	0.218	C	C	.	.			trans	-144.7	150.6	177.6	-64	178.6	0	0	0	108.8	L542 L543 A568 V577 I580 L586 I589	L542-L570 HydrophobicContact CB-CD2 4.45Å; L542-L570 HydrophobicContact CD2-CD1 3.95Å; L542-L570 HydrophobicContact CD2-CD2 4.21Å; L542-L570 HydrophobicContact CD2-CG 4.35Å; L543-L570 HydrophobicContact CD1-CD2 3.79Å; L543-L570 HydrophobicContact CD2-CD2 3.78Å; L543-L570 HydrophobicContact CG-CD2 3.48Å; L543-L570 VanDerWaalsContact CG-CD2 3.48Å; A568-L570 HydrophobicContact CB-CG 4.26Å; A568-L570 PolarHBondContact O-N 2.9Å; L570-V577 HydrophobicContact CD1-CG2 4.29Å; L570-I580 HydrophobicContact CD1-CD1 4.21Å; L570-I580 HydrophobicContact CD1-CG2 4.34Å; L570-L586 HydrophobicContact CD1-CD1 4.39Å; L570-I589 HydrophobicContact CB-CG2 3.99Å; L570-I589 HydrophobicContact CD1-CD1 3.97Å; L570-I589 WeakPolarHBondContact O-CG2 3.09Å
571	D	76.7	Confident	86.5	Confident	87 Å²	87	40.8 Å²	40.8	47%	0.465	20%	0.202	S	C	.	.			trans	-71.4	138.5	165.4	-164.7	-5.8	0	0	0	110.2	D573 T574 Q591	D571-D573 VanDerWaalsContact C-N 3.27Å; D571-D573 PolarHBondContact OD1-N 2.87Å; D571-T574 WeakPolarHBondContact CB-OG1 3.45Å; D571-T574 WeakPolarHBondContact O-CB 3.42Å; D571-T574 PolarHBondContact O-N 3.23Å; D571-T574 PolarHBondContact O-OG1 3.35Å; D571-Q591 PolarHBondContact OD1-NE2 3.11Å
572	A	70.3	Confident	86.7	Confident	4 Å²	4	38 Å²	38	3%	0.033	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-18.2	179.2	0	0	0	0	0	111.6	T574 Q591 Y609 I630	A572-T574 VanDerWaalsContact C-N 3.34Å; A572-Q591 HydrophobicContact CB-CG 4.44Å; A572-Y609 WeakPolarHBondContact CB-OH 3.45Å; A572-I630 HydrophobicContact CB-CD1 3.93Å; A572-I630 HydrophobicContact CB-CG2 4.4Å; A572-I630 WeakPolarHBondContact O-CD1 3.38Å
573	D	73.5	Confident	86.7	Confident	104 Å²	104	38 Å²	38	56%	0.556	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.8	9.3	170	-64.7	-40.3	0	0	0	112.2	D571 K575 R608	D571-D573 VanDerWaalsContact C-N 3.27Å; D571-D573 PolarHBondContact OD1-N 2.87Å; D573-K575 PolarHBondContact O-N 3.29Å; D573-R608 IonicContact OD1-CZ 3.94Å; D573-R608 IonicContact OD1-NH1 3.13Å; D573-R608 PolarHBondContact OD1-NH1 3.09Å; D573-R608 IonicContact OD1-NH2 2.7Å; D573-R608 PolarHBondContact OD1-NH2 3.22Å; D573-R608 IonicContact OD2-NH1 3.35Å; D573-R608 PolarHBondContact OD2-NH1 3.17Å
574	T	71.5	Confident	86.8	Confident	23 Å²	23	35.7 Å²	35.7	14%	0.141	17%	0.174	C	C	.	.	S	Bend	trans	-58.6	129.4	170.6	-56.1	0	0	0	0	110.6	D571 A572 N576 V577	D571-T574 WeakPolarHBondContact CB-OG1 3.45Å; D571-T574 WeakPolarHBondContact O-CB 3.42Å; D571-T574 PolarHBondContact O-N 3.23Å; D571-T574 PolarHBondContact O-OG1 3.35Å; A572-T574 VanDerWaalsContact C-N 3.34Å; T574-N576 PolarHBondContact O-N 2.85Å; T574-V577 VanDerWaalsContact O-CB 3.3Å; T574-V577 WeakPolarHBondContact O-CB 3.25Å; T574-V577 WeakPolarHBondContact O-CG1 3.49Å; T574-V577 PolarHBondContact O-N 3.46Å; T574-V577 VanDerWaalsContact O-N 3.07Å
575	K	70.8	Confident	86.9	Confident	166 Å²	166	35.6 Å²	35.6	72%	0.722	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	-51.7	133.8	174.8	-173.6	175.1	-177.5	177.6	0	110.4	F481 D573 V577	F481-K575 WeakPolarHBondContact CE2-O 3.45Å; D573-K575 PolarHBondContact O-N 3.29Å; K575-V577 PolarHBondContact O-N 2.76Å
576	N	78.8	Confident	86.9	Confident	78 Å²	78	35.6 Å²	35.6	42%	0.417	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.8	17.7	-179	-56.8	-16.9	0	0	0	116	F481 T574 S578 R579 I580	F481-N576 HydrophobicContact CE2-CB 4.19Å; F481-N576 HydrophobicContact CZ-CB 4.43Å; T574-N576 PolarHBondContact O-N 2.85Å; N576-S578 PolarHBondContact O-N 2.96Å; N576-S578 VanDerWaalsContact O-N 3.13Å; N576-R579 HydrophobicContact CB-CB 4.39Å; N576-R579 HydrophobicContact CB-CG 4.49Å; N576-R579 WeakPolarHBondContact O-CA 3.42Å; N576-R579 WeakPolarHBondContact O-CB 3.44Å; N576-R579 PolarHBondContact O-N 2.61Å; N576-I580 PolarHBondContact O-N 2.69Å
577	V	87.5	Confident	86.8	Confident	7 Å²	7	36.1 Å²	36.1	4%	0.042	18%	0.177	C	C	.	.	H	α-helix	trans	-51.8	-38.1	178.6	66.2	0	0	0	0	113.2	L570 T574 K575 R579 I580 I581 I630	L570-V577 HydrophobicContact CD1-CG2 4.29Å; T574-V577 VanDerWaalsContact O-CB 3.3Å; T574-V577 WeakPolarHBondContact O-CB 3.25Å; T574-V577 WeakPolarHBondContact O-CG1 3.49Å; T574-V577 PolarHBondContact O-N 3.46Å; T574-V577 VanDerWaalsContact O-N 3.07Å; K575-V577 PolarHBondContact O-N 2.76Å; V577-R579 VanDerWaalsContact C-N 3.29Å; V577-R579 PolarHBondContact O-N 3.38Å; V577-I580 WeakPolarHBondContact O-CB 3.38Å; V577-I580 PolarHBondContact O-N 3.22Å; V577-I580 VanDerWaalsContact O-N 3.13Å; V577-I581 HydrophobicContact CG2-CD1 3.98Å; V577-I581 HydrophobicContact CG2-CG1 4.5Å; V577-I581 WeakPolarHBondContact O-CG1 3.41Å; V577-I581 PolarHBondContact O-N 3.14Å; V577-I630 HydrophobicContact CG1-CD1 3.51Å; V577-I630 HydrophobicContact CG1-CG1 4.31Å
578	S	90.9	Very high	86.7	Confident	30 Å²	30	36.1 Å²	36.1	21%	0.21	18%	0.177	C	C	.	.	H	α-helix	trans	-60.8	-35.2	175.7	-52.5	0	0	0	0	113.3	S20 L22 N576 I581 N582	S20-S578 WeakPolarHBondContact O-CB 3.49Å; S20-S578 PolarHBondContact O-OG 3.19Å; L22-S578 WeakPolarHBondContact CD2-O 3.32Å; N576-S578 PolarHBondContact O-N 2.96Å; N576-S578 VanDerWaalsContact O-N 3.13Å; S578-I581 PolarHBondContact O-N 2.8Å; S578-N582 VanDerWaalsContact O-CB 3.3Å; S578-N582 WeakPolarHBondContact O-CB 3.49Å; S578-N582 PolarHBondContact O-N 3.37Å
579	R	90.9	Very high	86.7	Confident	97 Å²	97	36.1 Å²	36.1	37%	0.366	18%	0.177	S	C	.	.	H	α-helix	trans	-70	-37.7	175.5	-63.1	-173.7	177.2	-155	-5.4	111.2	D17 S20 N576 V577 N582 Q583	D17-R579 IonicContact OD1-NH2 2.71Å; D17-R579 IonicContact OD2-CZ 2.8Å; D17-R579 IonicContact OD2-NH2 2.61Å; D17-R579 PolarHBondContact OD2-NH2 3.28Å; S20-R579 PolarHBondContact OG-NE 2.79Å; S20-R579 PolarHBondContact OG-NH2 3.35Å; N576-R579 HydrophobicContact CB-CB 4.39Å; N576-R579 HydrophobicContact CB-CG 4.49Å; N576-R579 WeakPolarHBondContact O-CA 3.42Å; N576-R579 WeakPolarHBondContact O-CB 3.44Å; N576-R579 PolarHBondContact O-N 2.61Å; V577-R579 VanDerWaalsContact C-N 3.29Å; V577-R579 PolarHBondContact O-N 3.38Å; R579-N582 PolarHBondContact O-N 3.19Å; R579-Q583 WeakPolarHBondContact O-CB 3.5Å; R579-Q583 PolarHBondContact O-N 3.12Å
580	I	90.7	Very high	86.9	Confident	4 Å²	4	33 Å²	33	2%	0.021	16%	0.164	C	C	.	.	H	α-helix	trans	-60.2	-50.4	171.9	-52.3	175.4	0	0	0	110	F481 L542 L570 N576 V577 N582 Q583 L584 L586	F481-I580 HydrophobicContact CE1-CD1 3.78Å; F481-I580 HydrophobicContact CE1-CG1 3.84Å; F481-I580 HydrophobicContact CE2-CD1 4.17Å; F481-I580 HydrophobicContact CZ-CD1 3.42Å; F481-I580 VanDerWaalsContact CZ-CD1 3.42Å; F481-I580 HydrophobicContact CZ-CG1 3.46Å; F481-I580 VanDerWaalsContact CZ-CG1 3.46Å; L542-I580 HydrophobicContact CD2-CG2 3.88Å; L570-I580 HydrophobicContact CD1-CD1 4.21Å; L570-I580 HydrophobicContact CD1-CG2 4.34Å; N576-I580 PolarHBondContact O-N 2.69Å; V577-I580 WeakPolarHBondContact O-CB 3.38Å; V577-I580 PolarHBondContact O-N 3.22Å; V577-I580 VanDerWaalsContact O-N 3.13Å; I580-N582 VanDerWaalsContact C-N 3.31Å; I580-N582 PolarHBondContact O-N 2.92Å; I580-Q583 PolarHBondContact O-N 3.12Å; I580-L584 HydrophobicContact CG2-CD1 3.68Å; I580-L584 HydrophobicContact CG2-CG 4.25Å; I580-L584 VanDerWaalsContact O-CB 3.32Å; I580-L584 WeakPolarHBondContact O-CB 3.29Å; I580-L584 WeakPolarHBondContact O-CG 3.24Å; I580-L584 PolarHBondContact O-N 3.37Å; I580-L586 HydrophobicContact CG2-CD1 4.22Å
581	I	94.4	Very high	87.2	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-57.4	-46.4	178.8	-68.7	159.5	0	0	0	110.4	L22 F24 H117 V577 S578 G585 L586 I589 I630	L22-I581 HydrophobicContact CD1-CD1 4.01Å; L22-I581 HydrophobicContact CD1-CG2 4.33Å; L22-I581 HydrophobicContact CD2-CB 3.97Å; L22-I581 HydrophobicContact CD2-CG2 3.68Å; F24-I581 HydrophobicContact CZ-CG2 4.22Å; H117-I581 PolarHBondContact CE1-O 3.25Å; H117-I581 VanDerWaalsContact CE1-O 3.27Å; V577-I581 HydrophobicContact CG2-CD1 3.98Å; V577-I581 HydrophobicContact CG2-CG1 4.5Å; V577-I581 WeakPolarHBondContact O-CG1 3.41Å; V577-I581 PolarHBondContact O-N 3.14Å; S578-I581 PolarHBondContact O-N 2.8Å; I581-G585 WeakPolarHBondContact O-CA 3.04Å; I581-G585 PolarHBondContact O-N 3.36Å; I581-L586 HydrophobicContact CG1-CB 4.29Å; I581-L586 HydrophobicContact CG1-CD1 4.33Å; I581-L586 HydrophobicContact CG2-CB 4.46Å; I581-L586 PolarHBondContact O-N 2.69Å; I581-I589 HydrophobicContact CD1-CD1 4.26Å; I581-I589 HydrophobicContact CD1-CG1 4Å; I581-I589 HydrophobicContact CG1-CD1 4Å; I581-I589 HydrophobicContact CG1-CG1 4.26Å; I581-I630 HydrophobicContact CD1-CG1 4.26Å; I581-I630 HydrophobicContact CD1-CG2 4.02Å
582	N	94.7	Very high	87.8	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-60.9	-50.7	177	-84.4	-16.2	0	0	0	113	E19 M21 L22 Y115 H117 S578 R579 I580	E19-N582 PolarHBondContact O-ND2 3.22Å; M21-N582 PolarHBondContact O-ND2 3.33Å; L22-N582 VanDerWaalsContact CD2-OD1 3.31Å; L22-N582 WeakPolarHBondContact CD2-OD1 3.15Å; Y115-N582 HydrophobicContact CD1-CB 3.84Å; Y115-N582 WeakPolarHBondContact CD1-O 3.3Å; Y115-N582 HydrophobicContact CD2-CB 3.83Å; Y115-N582 HydrophobicContact CE1-CB 4.23Å; Y115-N582 VanDerWaalsContact CE1-O 3.27Å; Y115-N582 WeakPolarHBondContact CE1-O 3.36Å; Y115-N582 HydrophobicContact CE2-CB 4.26Å; Y115-N582 HydrophobicContact CG-CB 3.61Å; H117-N582 PolarHBondContact NE2-OD1 3Å; S578-N582 VanDerWaalsContact O-CB 3.3Å; S578-N582 WeakPolarHBondContact O-CB 3.49Å; S578-N582 PolarHBondContact O-N 3.37Å; R579-N582 PolarHBondContact O-N 3.19Å; I580-N582 VanDerWaalsContact C-N 3.31Å; I580-N582 PolarHBondContact O-N 2.92Å
583	Q	91.4	Very high	88.8	Confident	55 Å²	55	30.3 Å²	30.3	26%	0.257	15%	0.149	S	C	.	.	H	α-helix	trans	-67	-39.3	-178.6	-173.7	170.9	2.4	0	0	113.1	I547 E551 R579 I580	I547-Q583 VanDerWaalsContact CD1-OE1 3.27Å; E551-Q583 HydrophobicContact CG-CG 4.4Å; E551-Q583 VanDerWaalsContact OE2-CG 3.29Å; E551-Q583 WeakPolarHBondContact OE2-CG 3.11Å; E551-Q583 PolarHBondContact OE2-NE2 2.8Å; R579-Q583 WeakPolarHBondContact O-CB 3.5Å; R579-Q583 PolarHBondContact O-N 3.12Å; I580-Q583 PolarHBondContact O-N 3.12Å
584	L	93.6	Very high	89.3	Confident	6 Å²	6	25.5 Å²	25.5	3%	0.031	12%	0.124	C	C	.	.	H	α-helix	trans	-96.6	-13.4	-172.8	-60.8	-172.9	0	0	0	114.7	L542 I547 C550 E551 L554 I580 L586	L542-L584 HydrophobicContact CD1-CD1 3.69Å; L542-L584 HydrophobicContact CD2-CD1 3.88Å; L542-L584 HydrophobicContact CG-CD1 4.32Å; I547-L584 HydrophobicContact CG1-CD1 4.44Å; I547-L584 HydrophobicContact CG1-CD2 4.02Å; I547-L584 HydrophobicContact CG1-CG 4.36Å; C550-L584 HydrophobicContact CB-CD1 4.09Å; C550-L584 HydrophobicContact CB-CD2 3.79Å; E551-L584 HydrophobicContact CB-CD2 3.88Å; L554-L584 HydrophobicContact CD1-CB 3.86Å; L554-L584 HydrophobicContact CD1-CD1 4.49Å; L554-L584 HydrophobicContact CD1-CD2 4.4Å; L554-L584 HydrophobicContact CD1-CG 4.49Å; I580-L584 HydrophobicContact CG2-CD1 3.68Å; I580-L584 HydrophobicContact CG2-CG 4.25Å; I580-L584 VanDerWaalsContact O-CB 3.32Å; I580-L584 WeakPolarHBondContact O-CB 3.29Å; I580-L584 WeakPolarHBondContact O-CG 3.24Å; I580-L584 PolarHBondContact O-N 3.37Å; L584-L586 HydrophobicContact CB-CD2 4.06Å; L584-L586 HydrophobicContact CB-CG 4.03Å
585	G	93.8	Very high	89.6	Confident	1 Å²	1	31 Å²	31	1%	0.01	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.4	37.8	-179	0	0	0	0	0	114	R558 I581	R558-G585 PolarHBondContact NH2-O 2.81Å; I581-G585 WeakPolarHBondContact O-CA 3.04Å; I581-G585 PolarHBondContact O-N 3.36Å
586	L	95	Very high	90.5	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	12%	0.115	C	C	.	.			trans	-71.5	132.8	178	-54.2	-177.5	0	0	0	110.3	L542 L554 I566 A568 L570 I580 I581 L584 I589	L542-L586 HydrophobicContact CD2-CD1 4.3Å; L554-L586 HydrophobicContact CD1-CD2 4.35Å; I566-L586 HydrophobicContact CG2-CD2 3.8Å; A568-L586 HydrophobicContact CB-CD1 4.31Å; L570-L586 HydrophobicContact CD1-CD1 4.39Å; I580-L586 HydrophobicContact CG2-CD1 4.22Å; I581-L586 HydrophobicContact CG1-CB 4.29Å; I581-L586 HydrophobicContact CG1-CD1 4.33Å; I581-L586 HydrophobicContact CG2-CB 4.46Å; I581-L586 PolarHBondContact O-N 2.69Å; L584-L586 HydrophobicContact CB-CD2 4.06Å; L584-L586 HydrophobicContact CB-CG 4.03Å; L586-I589 HydrophobicContact CB-CD1 4.38Å; L586-I589 HydrophobicContact CD1-CD1 3.7Å
587	V	93.7	Very high	90.8	Very high	12 Å²	12	29 Å²	29	7%	0.073	13%	0.126	C	C	.	.	S	Bend	trans	-114.8	2.9	178.4	-62.2	0	0	0	0	112.9	L119 P120 Y565 I566	L119-V587 HydrophobicContact CD2-CG1 4.21Å; P120-V587 HydrophobicContact CG-CG1 4.2Å; P120-V587 HydrophobicContact CG-CG2 4.22Å; Y565-V587 HydrophobicContact CD1-CG2 4.47Å; Y565-V587 HydrophobicContact CD2-CG2 3.83Å; Y565-V587 HydrophobicContact CE2-CG2 3.9Å; Y565-V587 HydrophobicContact CG-CG2 4.12Å; Y565-V587 PolarHBondContact OH-O 3.13Å; I566-V587 WeakPolarHBondContact O-CG2 3.39Å; I566-V587 PolarHBondContact O-N 3.22Å
588	G	93.7	Very high	90.9	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	132.9	172.9	0	0	0	0	0	110.6	Y565 I566 C567 A568 P631	Y565-G588 WeakPolarHBondContact OH-CA 3.49Å; I566-G588 PolarHBondContact O-N 2.99Å; C567-G588 WeakPolarHBondContact CA-O 3.43Å; C567-G588 WeakPolarHBondContact CB-O 3.42Å; A568-G588 PolarHBondContact N-O 3.07Å; G588-P631 CarbonylContact C-O 2.97Å; G588-P631 VanDerWaalsContact CA-O 3.23Å; G588-P631 WeakPolarHBondContact CA-O 3.29Å
589	I	94.1	Very high	90.9	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	112.5	164.8	-62.7	-53.6	0	0	0	107.2	A568 L570 I581 L586 Q591 I630 P631 F633	A568-I589 WeakPolarHBondContact O-CA 3.34Å; L570-I589 HydrophobicContact CB-CG2 3.99Å; L570-I589 HydrophobicContact CD1-CD1 3.97Å; L570-I589 WeakPolarHBondContact O-CG2 3.09Å; I581-I589 HydrophobicContact CD1-CD1 4.26Å; I581-I589 HydrophobicContact CD1-CG1 4Å; I581-I589 HydrophobicContact CG1-CD1 4Å; I581-I589 HydrophobicContact CG1-CG1 4.26Å; L586-I589 HydrophobicContact CB-CD1 4.38Å; L586-I589 HydrophobicContact CD1-CD1 3.7Å; I589-Q591 HydrophobicContact CG2-CG 4.45Å; I589-Q591 PolarHBondContact O-N 2.85Å; I589-I630 HydrophobicContact CB-CG2 4.1Å; I589-I630 HydrophobicContact CG1-CG2 3.75Å; I589-P631 PolarHBondContact N-O 3.17Å; I589-F633 PolarHBondContact O-N 3.07Å
590	I	93.7	Very high	90.9	Very high	9 Å²	9	35 Å²	35	5%	0.046	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	114.4	-179.6	-66.5	177.6	0	0	0	108.3	N538 A568 K569 F633 F635 A638	N538-I590 WeakPolarHBondContact OD1-CD1 3.46Å; A568-I590 PolarHBondContact O-N 2.94Å; K569-I590 HydrophobicContact CB-CB 4.27Å; K569-I590 HydrophobicContact CB-CG2 4.46Å; K569-I590 HydrophobicContact CG-CG2 4.48Å; I590-F633 WeakPolarHBondContact CA-O 3.44Å; I590-F633 HydrophobicContact CG1-CB 4.42Å; I590-F633 HydrophobicContact CG1-CD1 4.08Å; I590-F633 HydrophobicContact CG1-CG 4.46Å; I590-F635 HydrophobicContact CD1-CE2 4.31Å; I590-F635 HydrophobicContact CG1-CD2 4.45Å; I590-F635 HydrophobicContact CG1-CE2 4.03Å; I590-F635 HydrophobicContact CG2-CD2 3.72Å; I590-F635 HydrophobicContact CG2-CE2 4.07Å; I590-F635 HydrophobicContact CG2-CG 4.33Å; I590-A638 HydrophobicContact CG2-CB 4.26Å
591	Q	90.8	Very high	90.9	Very high	33 Å²	33	38.7 Å²	38.7	15%	0.154	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	117.5	176.9	-87.6	-72.3	8.5	0	0	109.8	D571 A572 I589 V632 F633 F635	D571-Q591 PolarHBondContact OD1-NE2 3.11Å; A572-Q591 HydrophobicContact CB-CG 4.44Å; I589-Q591 HydrophobicContact CG2-CG 4.45Å; I589-Q591 PolarHBondContact O-N 2.85Å; Q591-V632 HydrophobicContact CB-CG1 3.63Å; Q591-V632 HydrophobicContact CG-CG1 3.86Å; Q591-F633 PolarHBondContact N-O 3.04Å; Q591-F635 PolarHBondContact O-N 3.43Å
592	S	90.7	Very high	90.9	Very high	10 Å²	10	38.7 Å²	38.7	7%	0.07	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	130.5	-178.8	-169.8	0	0	0	0	111.4	S594 A638 E641	S592-S594 VanDerWaalsContact C-N 3.35Å; S592-S594 PolarHBondContact OG-OG 2.91Å; S592-A638 PolarHBondContact OG-N 3.38Å; S592-A638 VanDerWaalsContact OG-N 3.1Å; S592-E641 WeakPolarHBondContact CB-OE1 3.5Å; S592-E641 WeakPolarHBondContact CB-OE2 3.18Å; S592-E641 VanDerWaalsContact OG-CD 3.31Å; S592-E641 PolarHBondContact OG-OE1 2.91Å; S592-E641 PolarHBondContact OG-OE2 3.38Å
593	T	90.9	Very high	90.8	Very high	2 Å²	2	39.1 Å²	39.1	1%	0.012	17%	0.17	C	C	.	.	G	3₁₀ helix	trans	-86.1	-2.2	177.5	61.5	0	0	0	0	113.6	W595 V596 L602 L605 F635 D636 R648 L660	T593-W595 PolarHBondContact O-N 3.44Å; T593-W595 VanDerWaalsContact O-N 3.08Å; T593-V596 WeakPolarHBondContact O-CB 3.49Å; T593-V596 WeakPolarHBondContact O-CG2 3.44Å; T593-V596 PolarHBondContact O-N 2.91Å; T593-V596 VanDerWaalsContact O-N 3.08Å; T593-L602 HydrophobicContact CG2-CD1 4.09Å; T593-L605 HydrophobicContact CG2-CD2 3.57Å; T593-F635 PolarHBondContact N-O 3.47Å; T593-F635 PolarHBondContact OG1-O 3.13Å; T593-D636 WeakPolarHBondContact OG1-CA 3.48Å; T593-R648 PolarHBondContact O-NH2 3.03Å; T593-L660 HydrophobicContact CG2-CD1 4.49Å; T593-L660 HydrophobicContact CG2-CD2 3.89Å
594	S	83.7	Confident	90.8	Very high	3 Å²	3	39.4 Å²	39.4	2%	0.021	18%	0.178	C	C	.	.	G	3₁₀ helix	trans	-50.1	-34.1	173.4	-46.7	0	0	0	0	113.5	S592 D636 M637 E641 R647	S592-S594 VanDerWaalsContact C-N 3.35Å; S592-S594 PolarHBondContact OG-OG 2.91Å; S594-D636 PolarHBondContact N-O 2.79Å; S594-D636 PolarHBondContact OG-O 3.19Å; S594-M637 WeakPolarHBondContact OG-CA 3.39Å; S594-E641 WeakPolarHBondContact CB-OE2 3.45Å; S594-E641 PolarHBondContact OG-OE2 3.48Å; S594-R647 VanDerWaalsContact O-CD 3.25Å; S594-R647 WeakPolarHBondContact O-CD 3.46Å; S594-R647 PolarHBondContact O-NE 2.9Å
595	W	78.9	Confident	90.6	Very high	139 Å²	139	40.7 Å²	40.7	53%	0.527	19%	0.185	S	C	.	.	G	3₁₀ helix	trans	-76.7	-22.7	-175	-55.4	104	0	0	0	113.7	T593 R597 E641	T593-W595 PolarHBondContact O-N 3.44Å; T593-W595 VanDerWaalsContact O-N 3.08Å; W595-R597 WeakPolarHBondContact O-CG 3.45Å; W595-R597 PolarHBondContact O-N 2.82Å; W595-E641 HydrophobicContact CZ2-CG 3.98Å; W595-E641 PolarHBondContact NE1-OE1 3.21Å; W595-E641 PolarHBondContact NE1-OE2 2.8Å
596	V	88.6	Confident	90.5	Very high	25 Å²	25	40.7 Å²	40.7	15%	0.152	19%	0.185	C	C	.	.			trans	-63.1	125.4	-177.8	179.4	0	0	0	0	109.9	T593 Q598 E601 L602 R648 F777	T593-V596 WeakPolarHBondContact O-CB 3.49Å; T593-V596 WeakPolarHBondContact O-CG2 3.44Å; T593-V596 PolarHBondContact O-N 2.91Å; T593-V596 VanDerWaalsContact O-N 3.08Å; V596-Q598 WeakPolarHBondContact CG1-O 3.35Å; V596-E601 HydrophobicContact CG1-CB 3.57Å; V596-L602 HydrophobicContact CG1-CB 4.05Å; V596-R648 PolarHBondContact O-NH2 3.28Å; V596-F777 HydrophobicContact CG1-CE2 4.15Å; V596-F777 HydrophobicContact CG1-CZ 4.35Å; V596-F777 WeakPolarHBondContact O-CE2 3.2Å
597	R	86	Confident	90.2	Very high	176 Å²	176	48.4 Å²	48.4	66%	0.664	22%	0.219	S	C	*	.			trans	-99.6	-19.2	-170.1	-64.4	-168.9	179.5	-162.1	0.2	114.1	W595 E601 F777	W595-R597 WeakPolarHBondContact O-CG 3.45Å; W595-R597 PolarHBondContact O-N 2.82Å; R597-E601 PolarHBondContact N-OE2 2.97Å; R597-F777 WeakPolarHBondContact O-CD2 3.21Å
598	Q	89.7	Confident	89.8	Confident	103 Å²	103	53.4 Å²	53.4	48%	0.481	24%	0.236	S	C	.	.	S	Bend	trans	-141.4	150.9	177.7	-65.5	-174.7	-13.2	0	0	111.8	V596 Y600 E601 L602 F777	V596-Q598 WeakPolarHBondContact CG1-O 3.35Å; Q598-Y600 PolarHBondContact O-N 3.29Å; Q598-E601 PolarHBondContact N-OE2 2.89Å; Q598-E601 WeakPolarHBondContact O-CB 3.17Å; Q598-E601 PolarHBondContact O-N 2.99Å; Q598-E601 VanDerWaalsContact O-N 3.15Å; Q598-L602 PolarHBondContact O-N 3.06Å; Q598-F777 VanDerWaalsContact C-CE2 3.48Å
599	P	90.9	Very high	89.5	Confident	6 Å²	6	53.6 Å²	53.6	4%	0.039	24%	0.237	C	C	.	.	H	α-helix	trans	-60.3	-27.5	177.9	-23.7	33.5	0	0	0	114.1	E601 L602 A603 E753 I756 N775 F777	P599-E601 PolarHBondContact O-N 2.99Å; P599-L602 WeakPolarHBondContact O-CB 3.46Å; P599-L602 PolarHBondContact O-N 2.89Å; P599-A603 PolarHBondContact O-N 3.21Å; P599-E753 WeakPolarHBondContact CB-O 3.44Å; P599-I756 HydrophobicContact CB-CD1 4.1Å; P599-I756 WeakPolarHBondContact O-CD1 3.43Å; P599-N775 HydrophobicContact CB-CB 4.24Å; P599-N775 HydrophobicContact CG-CB 3.91Å; P599-F777 HydrophobicContact CG-CD1 4.08Å; P599-F777 HydrophobicContact CG-CE1 4.21Å; P599-F777 HydrophobicContact CG-CG 4.27Å; P599-F777 HydrophobicContact CG-CZ 4.48Å
600	Y	90.5	Very high	89	Confident	151 Å²	151	53.6 Å²	53.6	59%	0.592	24%	0.237	S	C	*	.	H	α-helix	trans	-59.1	-43.5	174.2	173.5	-91.3	0	0	0	112.7	Q598 L602 A603 S604 Q750	Q598-Y600 PolarHBondContact O-N 3.29Å; Y600-L602 VanDerWaalsContact C-N 3.31Å; Y600-L602 PolarHBondContact O-N 3.14Å; Y600-A603 PolarHBondContact O-N 3.48Å; Y600-S604 WeakPolarHBondContact O-CB 3.27Å; Y600-S604 PolarHBondContact O-N 2.93Å; Y600-Q750 VanDerWaalsContact CD2-OE1 3.28Å
601	E	91.3	Very high	88.6	Confident	82 Å²	82	54.7 Å²	54.7	38%	0.383	25%	0.251	S	S	.	.	H	α-helix	trans	-63.3	-39.5	176.6	-68.7	171.4	170.3	0	0	110.8	V596 R597 Q598 P599 S604 L605	V596-E601 HydrophobicContact CG1-CB 3.57Å; R597-E601 PolarHBondContact N-OE2 2.97Å; Q598-E601 PolarHBondContact N-OE2 2.89Å; Q598-E601 WeakPolarHBondContact O-CB 3.17Å; Q598-E601 PolarHBondContact O-N 2.99Å; Q598-E601 VanDerWaalsContact O-N 3.15Å; P599-E601 PolarHBondContact O-N 2.99Å; E601-S604 WeakPolarHBondContact O-CB 3.1Å; E601-S604 PolarHBondContact O-N 3.26Å; E601-L605 PolarHBondContact O-N 2.91Å
602	L	92.9	Very high	88.4	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-63.9	-47	174	-175.8	58.8	0	0	0	111.1	T593 V596 Q598 P599 Y600 S604 L605 L606 L659 L660 F777	T593-L602 HydrophobicContact CG2-CD1 4.09Å; V596-L602 HydrophobicContact CG1-CB 4.05Å; Q598-L602 PolarHBondContact O-N 3.06Å; P599-L602 WeakPolarHBondContact O-CB 3.46Å; P599-L602 PolarHBondContact O-N 2.89Å; Y600-L602 VanDerWaalsContact C-N 3.31Å; Y600-L602 PolarHBondContact O-N 3.14Å; L602-S604 VanDerWaalsContact C-N 3.28Å; L602-S604 PolarHBondContact O-N 3.47Å; L602-L605 HydrophobicContact CD1-CD2 4.41Å; L602-L605 WeakPolarHBondContact O-CB 2.95Å; L602-L605 PolarHBondContact O-N 3.33Å; L602-L606 HydrophobicContact CD1-CD1 4.46Å; L602-L606 HydrophobicContact CD1-CG 4.44Å; L602-L606 HydrophobicContact CG-CD1 4.1Å; L602-L606 WeakPolarHBondContact O-CG 3.38Å; L602-L606 PolarHBondContact O-N 3.17Å; L602-L659 HydrophobicContact CD2-CD1 3.67Å; L602-L659 HydrophobicContact CG-CD1 4.38Å; L602-L660 HydrophobicContact CD1-CD2 4.18Å; L602-F777 HydrophobicContact CD2-CZ 4.46Å
603	A	92.8	Very high	88.3	Confident	8 Å²	8	61 Å²	61	7%	0.066	28%	0.283	C	S	.	.	H	α-helix	trans	-58.5	-40.1	175.5	0	0	0	0	0	112.2	P599 Y600 L606 K607 V748 I756	P599-A603 PolarHBondContact O-N 3.21Å; Y600-A603 PolarHBondContact O-N 3.48Å; A603-L606 PolarHBondContact O-N 2.93Å; A603-K607 WeakPolarHBondContact O-CB 3.27Å; A603-K607 PolarHBondContact O-N 3.35Å; A603-V748 HydrophobicContact CB-CG1 4.3Å; A603-I756 HydrophobicContact CB-CD1 3.9Å; A603-I756 HydrophobicContact CB-CG1 4.15Å; A603-I756 HydrophobicContact CB-CG2 4.44Å
604	S	90.7	Very high	87.9	Confident	61 Å²	61	62.1 Å²	62.1	43%	0.427	29%	0.29	S	S	.	.	H	α-helix	trans	-63.7	-45.9	175.5	-171.1	0	0	0	0	112.1	Y600 E601 L602 L606 K607 R608	Y600-S604 WeakPolarHBondContact O-CB 3.27Å; Y600-S604 PolarHBondContact O-N 2.93Å; E601-S604 WeakPolarHBondContact O-CB 3.1Å; E601-S604 PolarHBondContact O-N 3.26Å; L602-S604 VanDerWaalsContact C-N 3.28Å; L602-S604 PolarHBondContact O-N 3.47Å; S604-L606 PolarHBondContact O-N 3.21Å; S604-K607 PolarHBondContact O-N 3.49Å; S604-R608 WeakPolarHBondContact O-CB 3.24Å; S604-R608 PolarHBondContact O-N 3.47Å
605	L	89.7	Confident	87.8	Confident	33 Å²	33	62 Å²	62	17%	0.173	29%	0.29	C	S	.	.	H	α-helix	trans	-57.8	-46.2	174.4	-171.3	87.2	0	0	0	111.6	T593 E601 L602 R608 Y609 L634	T593-L605 HydrophobicContact CG2-CD2 3.57Å; E601-L605 PolarHBondContact O-N 2.91Å; L602-L605 HydrophobicContact CD1-CD2 4.41Å; L602-L605 WeakPolarHBondContact O-CB 2.95Å; L602-L605 PolarHBondContact O-N 3.33Å; L605-R608 PolarHBondContact O-N 3.02Å; L605-Y609 HydrophobicContact CD1-CD2 3.89Å; L605-Y609 HydrophobicContact CD1-CE2 3.9Å; L605-Y609 HydrophobicContact CG-CD2 4.16Å; L605-Y609 PolarHBondContact O-N 3.49Å; L605-L634 HydrophobicContact CD2-CD2 3.72Å; L605-L634 HydrophobicContact CG-CD2 4.37Å
606	L	92	Very high	88.1	Confident	1 Å²	1	55.7 Å²	55.7	1%	0.005	27%	0.266	C	S	.	.	H	α-helix	trans	-65.3	-37.7	177.9	-63.4	167.1	0	0	0	111.8	L602 A603 S604 G610 L659 L660 T663 V748	L602-L606 HydrophobicContact CD1-CD1 4.46Å; L602-L606 HydrophobicContact CD1-CG 4.44Å; L602-L606 HydrophobicContact CG-CD1 4.1Å; L602-L606 WeakPolarHBondContact O-CG 3.38Å; L602-L606 PolarHBondContact O-N 3.17Å; A603-L606 PolarHBondContact O-N 2.93Å; S604-L606 PolarHBondContact O-N 3.21Å; L606-G610 WeakPolarHBondContact O-CA 3.4Å; L606-G610 PolarHBondContact O-N 3.33Å; L606-L659 HydrophobicContact CD1-CB 3.87Å; L606-L659 HydrophobicContact CD1-CD1 4.3Å; L606-L659 HydrophobicContact CD1-CD2 4.07Å; L606-L659 HydrophobicContact CD1-CG 4.31Å; L606-L659 WeakPolarHBondContact CD2-O 3.33Å; L606-L660 HydrophobicContact CD2-CD2 4.35Å; L606-T663 HydrophobicContact CD2-CG2 3.32Å; L606-V748 HydrophobicContact CB-CG1 4.24Å; L606-V748 HydrophobicContact CB-CG2 4.04Å
607	K	89	Confident	87.9	Confident	162 Å²	162	55.4 Å²	55.4	70%	0.704	26%	0.263	S	S	*	.	H	α-helix	trans	-68.9	-38.8	175.1	-172.5	174.9	179.2	177.1	0	112.1	A603 S604 V748	A603-K607 WeakPolarHBondContact O-CB 3.27Å; A603-K607 PolarHBondContact O-N 3.35Å; S604-K607 PolarHBondContact O-N 3.49Å; K607-V748 HydrophobicContact CB-CB 4.35Å
608	R	86.3	Confident	87.5	Confident	117 Å²	117	48.9 Å²	48.9	44%	0.442	24%	0.241	S	C	.	.	H	α-helix	trans	-70.1	-41.8	179.3	-172.8	176.1	-179.3	-165.6	-2.7	112.4	D573 S604 L605	D573-R608 IonicContact OD1-CZ 3.94Å; D573-R608 IonicContact OD1-NH1 3.13Å; D573-R608 PolarHBondContact OD1-NH1 3.09Å; D573-R608 IonicContact OD1-NH2 2.7Å; D573-R608 PolarHBondContact OD1-NH2 3.22Å; D573-R608 IonicContact OD2-NH1 3.35Å; D573-R608 PolarHBondContact OD2-NH1 3.17Å; S604-R608 WeakPolarHBondContact O-CB 3.24Å; S604-R608 PolarHBondContact O-N 3.47Å; L605-R608 PolarHBondContact O-N 3.02Å
609	Y	85.8	Confident	86.7	Confident	5 Å²	5	49.2 Å²	49.2	2%	0.02	24%	0.238	C	C	.	.	H	α-helix	trans	-114.1	-9.4	-171.5	-60.7	-64.3	0	0	0	115.3	A572 L605 G611 I630 V632 R665	A572-Y609 WeakPolarHBondContact CB-OH 3.45Å; L605-Y609 HydrophobicContact CD1-CD2 3.89Å; L605-Y609 HydrophobicContact CD1-CE2 3.9Å; L605-Y609 HydrophobicContact CG-CD2 4.16Å; L605-Y609 PolarHBondContact O-N 3.49Å; Y609-G611 PolarHBondContact O-N 3.23Å; Y609-I630 HydrophobicContact CE1-CB 4.48Å; Y609-V632 HydrophobicContact CD1-CB 4.43Å; Y609-V632 HydrophobicContact CD1-CG2 3.53Å; Y609-V632 HydrophobicContact CD2-CG2 4.09Å; Y609-V632 HydrophobicContact CE1-CG2 3.64Å; Y609-V632 HydrophobicContact CE2-CG2 4.18Å; Y609-V632 HydrophobicContact CG-CB 4.34Å; Y609-V632 HydrophobicContact CG-CG2 3.76Å; Y609-R665 VanDerWaalsContact O-CG 3.31Å; Y609-R665 WeakPolarHBondContact O-CG 3.44Å; Y609-R665 PolarHBondContact O-NE 3.04Å; Y609-R665 PolarHBondContact O-NH2 2.94Å
610	G	84.8	Confident	85.5	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	25%	0.247	C	C	.	.	S	Bend	trans	-72.3	-19.5	-163.6	0	0	0	0	0	117.4	L606 R664	L606-G610 WeakPolarHBondContact O-CA 3.4Å; L606-G610 PolarHBondContact O-N 3.33Å; G610-R664 WeakPolarHBondContact O-CB 3.48Å; G610-R664 PolarHBondContact O-N 3.1Å
611	G	85.4	Confident	84.4	Confident	32 Å²	32	46.4 Å²	46.4	33%	0.33	24%	0.24	S	C	.	.			trans	152.4	-165.3	-177	0	0	0	0	0	113.9	Y609	Y609-G611 PolarHBondContact O-N 3.23Å
612	K	86.4	Confident	83.5	Confident	108 Å²	108	45 Å²	45	47%	0.47	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	145.2	172.7	-63.2	-176.4	177.3	-175.1	0	110.2	T744 E745 I746	K612-T744 PolarHBondContact N-O 3.23Å; K612-E745 CarbonylContact O-C 3.56Å; K612-E745 VanDerWaalsContact O-CA 3.27Å; K612-E745 WeakPolarHBondContact O-CA 3.32Å; K612-I746 PolarHBondContact O-N 2.93Å
613	P	87.2	Confident	82.9	Confident	67 Å²	67	45.7 Å²	45.7	44%	0.435	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-61	150.7	173.4	-20.7	32	0	0	0	113	S616 I746 I907	P613-S616 WeakPolarHBondContact O-CB 3.24Å; P613-S616 PolarHBondContact O-N 3.01Å; P613-I746 CarbonylContact C-O 3.48Å; P613-I746 WeakPolarHBondContact CA-O 3.04Å; P613-I907 HydrophobicContact CB-CD1 3.72Å; P613-I907 HydrophobicContact CG-CD1 4.24Å
614	V	83.8	Confident	82.4	Confident	25 Å²	25	48.9 Å²	48.9	15%	0.152	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61	136	171.6	171.3	0	0	0	0	111.1	E745 I746 Q747 R761 F955	V614-E745 WeakPolarHBondContact CA-OE2 3.14Å; V614-E745 HydrophobicContact CG2-CB 4.21Å; V614-I746 PolarHBondContact N-O 2.83Å; V614-Q747 HydrophobicContact CB-CB 4.22Å; V614-Q747 HydrophobicContact CG2-CB 3.7Å; V614-R761 HydrophobicContact CG2-CB 4.45Å; V614-F955 HydrophobicContact CG1-CD2 3.77Å; V614-F955 HydrophobicContact CG1-CE2 4.28Å; V614-F955 HydrophobicContact CG1-CG 4.24Å
615	G	80.5	Confident	82.4	Confident	2 Å²	2	46.5 Å²	46.5	2%	0.021	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	82.7	15.8	-176.8	0	0	0	0	0	114.2	E745	G615-E745 PolarHBondContact N-OE2 2.83Å
616	S	86.1	Confident	82.3	Confident	6 Å²	6	48.7 Å²	48.7	4%	0.042	25%	0.249	C	C	.	.	P	Polyproline II helix	trans	-51.8	145.4	173.9	-121.1	0	0	0	0	112.7	P613 E745 N905 C959	P613-S616 WeakPolarHBondContact O-CB 3.24Å; P613-S616 PolarHBondContact O-N 3.01Å; S616-E745 PolarHBondContact N-OE1 2.77Å; S616-N905 VanDerWaalsContact OG-CG 3.23Å; S616-N905 PolarHBondContact OG-ND2 3.3Å; S616-N905 PolarHBondContact OG-OD1 2.84Å; S616-C959 VanDerWaalsContact O-CB 3.29Å; S616-C959 WeakPolarHBondContact O-CB 3.43Å
617	F	84.4	Confident	82.1	Confident	19 Å²	19	52 Å²	52	8%	0.083	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-62.7	141.9	178.5	-71.1	-85.9	0	0	0	111.6	M901 K902 N905 I907 D962	F617-M901 HydrophobicContact CE2-CB 4.01Å; F617-M901 HydrophobicContact CZ-CB 3.73Å; F617-K902 HydrophobicContact CB-CB 4.45Å; F617-K902 HydrophobicContact CB-CG 3.96Å; F617-K902 HydrophobicContact CD1-CB 4.29Å; F617-K902 HydrophobicContact CG-CB 4.18Å; F617-K902 HydrophobicContact CG-CG 4.23Å; F617-N905 PolarHBondContact N-OD1 3.36Å; F617-I907 HydrophobicContact CE2-CG1 4.46Å; F617-D962 HydrophobicContact CD1-CB 3.66Å; F617-D962 HydrophobicContact CE1-CB 3.79Å
618	L	78.3	Confident	82	Confident	38 Å²	38	48.9 Å²	48.9	20%	0.199	26%	0.255	C	S	.	.	P	Polyproline II helix	trans	-65.4	140.3	179.1	-64.9	179.9	0	0	0	110.8	A620 K902 Y960 A963	L618-A620 PolarHBondContact O-N 3.45Å; L618-A620 VanDerWaalsContact O-N 3.14Å; L618-K902 VanDerWaalsContact O-CE 3.25Å; L618-K902 WeakPolarHBondContact O-CE 3.15Å; L618-K902 PolarHBondContact O-NZ 2.91Å; L618-Y960 HydrophobicContact CD1-CD1 4.35Å; L618-Y960 HydrophobicContact CD1-CE1 4.28Å; L618-A963 HydrophobicContact CD1-CB 3.87Å
619	R	71.4	Confident	81.9	Confident	111 Å²	111	48 Å²	48	42%	0.419	26%	0.258	S	S	.	.	P	Polyproline II helix	trans	-56.1	118.4	178.7	-174.3	178.6	-177.3	150.2	2.5	108.9	Y5 P623	Y5-R619 HydrophobicContact CD1-CG 4.35Å; Y5-R619 WeakPolarHBondContact CE1-O 3.1Å; Y5-R619 VanDerWaalsContact O-CZ 3.26Å; Y5-R619 PolarHBondContact O-NE 3.39Å; Y5-R619 PolarHBondContact O-NH2 2.93Å; R619-P623 HydrophobicContact CG-CB 4.23Å; R619-P623 HydrophobicContact CG-CG 4.34Å
620	A	67.4	Low	82.2	Confident	28 Å²	28	48.5 Å²	48.5	23%	0.231	26%	0.262	C	S	.	.	P	Polyproline II helix	trans	-66.3	157.8	173.6	0	0	0	0	0	111.1	L618 P623	L618-A620 PolarHBondContact O-N 3.45Å; L618-A620 VanDerWaalsContact O-N 3.14Å; A620-P623 WeakPolarHBondContact O-CD 3.22Å
621	P	66.2	Low	82.5	Confident	69 Å²	69	49.1 Å²	49.1	45%	0.448	27%	0.266	S	S	.	.	S	Bend	trans	-55.5	135.5	151.5	-15	29.4	0	0	0	108.4	Y5	Y5-P621 HydrophobicContact CE1-CG 4.36Å
622	L	71.6	Confident	82.8	Confident	53 Å²	53	47.7 Å²	47.7	28%	0.277	25%	0.25	S	S	.	.	S	Bend	trans	55.5	61.1	-175.2	-62.5	166.7	0	0	0	113.8	L4 T7 V9	L4-L622 HydrophobicContact CD2-CD1 4.21Å; L4-L622 HydrophobicContact CD2-CD2 4.18Å; L4-L622 HydrophobicContact CD2-CG 4.1Å; L4-L622 WeakPolarHBondContact O-CA 3.16Å; L4-L622 PolarHBondContact O-N 3.32Å; T7-L622 HydrophobicContact CG2-CD2 3.66Å; T7-L622 WeakPolarHBondContact O-CA 3.33Å; V9-L622 HydrophobicContact CG2-CB 4.04Å
623	P	80.4	Confident	83.2	Confident	15 Å²	15	42.5 Å²	42.5	10%	0.097	23%	0.228	C	C	.	.			trans	-60	147.6	179.8	28.1	-38	0	0	0	113	T7 F8 V9 R619 A620	T7-P623 WeakPolarHBondContact O-CD 3.29Å; F8-P623 CarbonylContact C-O 3.51Å; F8-P623 WeakPolarHBondContact CA-O 3.21Å; F8-P623 HydrophobicContact CD1-CB 4.18Å; F8-P623 HydrophobicContact CD1-CG 3.69Å; F8-P623 HydrophobicContact CE1-CB 4.39Å; F8-P623 HydrophobicContact CE1-CG 3.91Å; F8-P623 HydrophobicContact CG-CG 4.29Å; V9-P623 PolarHBondContact N-O 3.03Å; R619-P623 HydrophobicContact CG-CB 4.23Å; R619-P623 HydrophobicContact CG-CG 4.34Å; A620-P623 WeakPolarHBondContact O-CD 3.22Å
624	L	84.2	Confident	83.6	Confident	75 Å²	75	39.3 Å²	39.3	39%	0.393	21%	0.207	S	C	.	.	B	Isolated β-bridge	trans	-68.6	141	171.8	-65.3	172.5	0	0	0	111.4	V9 L626 R903	V9-L624 HydrophobicContact CB-CD2 4.23Å; V9-L624 HydrophobicContact CG1-CD2 4.26Å; V9-L624 CarbonylContact O-C 3.48Å; V9-L624 WeakPolarHBondContact O-CA 3.45Å; L624-L626 HydrophobicContact CB-CD2 4.05Å; L624-L626 HydrophobicContact CB-CG 4.17Å; L624-L626 PolarHBondContact O-N 3.17Å; L624-R903 HydrophobicContact CD1-CB 4.38Å; L624-R903 HydrophobicContact CD1-CG 3.85Å
625	L	89.8	Confident	84.1	Confident	10 Å²	10	38.2 Å²	38.2	5%	0.052	20%	0.2	C	C	.	.			trans	-82.8	90.6	168.8	-171	52.1	0	0	0	109.3	F8 V9 F10 Y23 V25 I31	F8-L625 HydrophobicContact CB-CB 4.02Å; F8-L625 HydrophobicContact CB-CD1 4.45Å; F8-L625 HydrophobicContact CD1-CD1 4.42Å; F8-L625 HydrophobicContact CG-CD1 4.48Å; V9-L625 PolarHBondContact O-N 2.86Å; F10-L625 HydrophobicContact CB-CB 3.91Å; F10-L625 HydrophobicContact CB-CD2 4.02Å; F10-L625 HydrophobicContact CB-CG 4.5Å; F10-L625 HydrophobicContact CD1-CD2 3.9Å; F10-L625 HydrophobicContact CD2-CB 4.28Å; F10-L625 HydrophobicContact CD2-CD2 4.47Å; F10-L625 HydrophobicContact CE1-CD2 4.45Å; F10-L625 HydrophobicContact CG-CB 4.19Å; F10-L625 HydrophobicContact CG-CD2 3.91Å; F10-L625 HydrophobicContact CG-CG 4.39Å; Y23-L625 HydrophobicContact CD1-CG 4Å; V25-L625 HydrophobicContact CG1-CD1 3.61Å; V25-L625 HydrophobicContact CG1-CD2 4.01Å; V25-L625 HydrophobicContact CG1-CG 4.49Å; I31-L625 HydrophobicContact CD1-CD2 4.09Å; I31-L625 HydrophobicContact CG1-CD2 4.18Å; I31-L625 HydrophobicContact CG2-CD2 4.27Å
626	L	86.8	Confident	84.7	Confident	80 Å²	80	38.2 Å²	38.2	42%	0.419	20%	0.2	S	C	.	.			trans	-87.5	151.4	177.9	-59.3	176.5	0	0	0	110.9	L624 R903	L624-L626 HydrophobicContact CB-CD2 4.05Å; L624-L626 HydrophobicContact CB-CG 4.17Å; L624-L626 PolarHBondContact O-N 3.17Å; L626-R903 VanDerWaalsContact CD1-O 3.29Å; L626-R903 WeakPolarHBondContact CD1-O 3.19Å
627	P	88.7	Confident	85	Confident	70 Å²	70	38.6 Å²	38.6	46%	0.455	20%	0.201	S	C	.	.			trans	-61.4	145.5	170	28.3	-34.8	0	0	0	110	M21 L22 Y23	M21-P627 HydrophobicContact CB-CB 4.4Å; L22-P627 CarbonylContact O-C 3.56Å; L22-P627 WeakPolarHBondContact O-CA 3.4Å; Y23-P627 HydrophobicContact CE1-CB 4.06Å; Y23-P627 HydrophobicContact CE1-CG 4.49Å
628	R	85.9	Confident	85.2	Confident	96 Å²	96	37.9 Å²	37.9	36%	0.362	20%	0.199	S	C	.	.			trans	-113.4	158.7	175.3	-51.6	-167.7	-170.1	-170	2.6	110.9	L22 F24	L22-R628 PolarHBondContact O-N 3.39Å; F24-R628 HydrophobicContact CD2-CB 4.01Å; F24-R628 HydrophobicContact CD2-CG 4.23Å; F24-R628 HydrophobicContact CE2-CB 4.47Å; F24-R628 PolarHBondContact O-NE 3.15Å; F24-R628 PolarHBondContact O-NH2 2.91Å
629	D	86.1	Confident	85.6	Confident	98 Å²	98	36.7 Å²	36.7	52%	0.524	19%	0.193	S	C	.	.			trans	-63.3	163	168.5	-53.8	-71.8	0	0	0	112.7
630	I	90.3	Very high	85.9	Confident	17 Å²	17	35 Å²	35	9%	0.087	19%	0.192	C	C	.	.			trans	-47.7	134.1	175.5	-66.2	166	0	0	0	110.6	L22 A572 V577 I581 I589 Y609 V632	L22-I630 HydrophobicContact CD1-CG1 4.21Å; A572-I630 HydrophobicContact CB-CD1 3.93Å; A572-I630 HydrophobicContact CB-CG2 4.4Å; A572-I630 WeakPolarHBondContact O-CD1 3.38Å; V577-I630 HydrophobicContact CG1-CD1 3.51Å; V577-I630 HydrophobicContact CG1-CG1 4.31Å; I581-I630 HydrophobicContact CD1-CG1 4.26Å; I581-I630 HydrophobicContact CD1-CG2 4.02Å; I589-I630 HydrophobicContact CB-CG2 4.1Å; I589-I630 HydrophobicContact CG1-CG2 3.75Å; Y609-I630 HydrophobicContact CE1-CB 4.48Å; I630-V632 VanDerWaalsContact C-N 3.3Å; I630-V632 HydrophobicContact CB-CG2 4.43Å; I630-V632 HydrophobicContact CG2-CG2 4.02Å; I630-V632 PolarHBondContact O-N 3.34Å
631	P	91.7	Very high	86.6	Confident	13 Å²	13	34.2 Å²	34.2	8%	0.084	18%	0.183	C	C	.	.			trans	-75.8	81.7	177.8	32.3	-35.1	0	0	0	110.1	F24 G588 I589	F24-P631 HydrophobicContact CE1-CG 4.4Å; F24-P631 HydrophobicContact CZ-CB 4.35Å; F24-P631 HydrophobicContact CZ-CG 3.83Å; G588-P631 CarbonylContact C-O 2.97Å; G588-P631 VanDerWaalsContact CA-O 3.23Å; G588-P631 WeakPolarHBondContact CA-O 3.29Å; I589-P631 PolarHBondContact N-O 3.17Å
632	V	92.8	Very high	87.3	Confident	1 Å²	1	32.8 Å²	32.8	1%	0.006	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	138.6	-179.2	-176	0	0	0	0	111.7	Q591 Y609 I630 L634	Q591-V632 HydrophobicContact CB-CG1 3.63Å; Q591-V632 HydrophobicContact CG-CG1 3.86Å; Y609-V632 HydrophobicContact CD1-CB 4.43Å; Y609-V632 HydrophobicContact CD1-CG2 3.53Å; Y609-V632 HydrophobicContact CD2-CG2 4.09Å; Y609-V632 HydrophobicContact CE1-CG2 3.64Å; Y609-V632 HydrophobicContact CE2-CG2 4.18Å; Y609-V632 HydrophobicContact CG-CB 4.34Å; Y609-V632 HydrophobicContact CG-CG2 3.76Å; I630-V632 VanDerWaalsContact C-N 3.3Å; I630-V632 HydrophobicContact CB-CG2 4.43Å; I630-V632 HydrophobicContact CG2-CG2 4.02Å; I630-V632 PolarHBondContact O-N 3.34Å; V632-L634 HydrophobicContact CG1-CD2 3.57Å; V632-L634 HydrophobicContact CG1-CG 3.94Å
633	F	94.4	Very high	87.9	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	105	169.9	-169	175.3	0	0	0	107.3	I136 C138 M222 Y565 I589 I590 Q591 F635 P666	I136-F633 HydrophobicContact CG2-CE2 4.4Å; I136-F633 HydrophobicContact CG2-CZ 4.05Å; C138-F633 HydrophobicContact CB-CE2 4.06Å; C138-F633 HydrophobicContact CB-CZ 3.66Å; M222-F633 HydrophobicContact CE-CE1 4.12Å; Y565-F633 HydrophobicContact CD1-CE1 4.39Å; Y565-F633 AromaticContact CE1-CD1 3.62Å; Y565-F633 HydrophobicContact CE1-CD1 3.62Å; Y565-F633 AromaticContact CE1-CE1 3.62Å; Y565-F633 HydrophobicContact CE1-CE1 3.62Å; I589-F633 PolarHBondContact O-N 3.07Å; I590-F633 WeakPolarHBondContact CA-O 3.44Å; I590-F633 HydrophobicContact CG1-CB 4.42Å; I590-F633 HydrophobicContact CG1-CD1 4.08Å; I590-F633 HydrophobicContact CG1-CG 4.46Å; Q591-F633 PolarHBondContact N-O 3.04Å; F633-F635 HydrophobicContact CD1-CE2 4.01Å; F633-F635 HydrophobicContact CD2-CD2 4.18Å; F633-F635 AromaticContact CD2-CE2 3.54Å; F633-F635 HydrophobicContact CD2-CE2 3.54Å; F633-F635 HydrophobicContact CD2-CZ 4.34Å; F633-F635 HydrophobicContact CE1-CE2 4.06Å; F633-F635 HydrophobicContact CE1-CZ 4.32Å; F633-F635 AromaticContact CE2-CE2 3.6Å; F633-F635 HydrophobicContact CE2-CE2 3.6Å; F633-F635 AromaticContact CE2-CZ 3.94Å; F633-F635 HydrophobicContact CE2-CZ 3.94Å; F633-F635 HydrophobicContact CG-CD2 4.48Å; F633-F635 AromaticContact CG-CE2 3.79Å; F633-F635 HydrophobicContact CG-CE2 3.79Å; F633-F635 AromaticContact CZ-CE2 3.88Å; F633-F635 HydrophobicContact CZ-CE2 3.88Å; F633-F635 AromaticContact CZ-CZ 3.94Å; F633-F635 HydrophobicContact CZ-CZ 3.94Å; F633-P666 WeakPolarHBondContact CA-O 3.26Å; F633-P666 HydrophobicContact CB-CG 4.26Å; F633-P666 VanDerWaalsContact CD2-C 3.49Å; F633-P666 HydrophobicContact CD2-CB 3.7Å; F633-P666 HydrophobicContact CD2-CG 4.05Å; F633-P666 WeakPolarHBondContact CD2-O 3.38Å; F633-P666 HydrophobicContact CE2-CB 3.84Å; F633-P666 HydrophobicContact CG-CB 4.24Å; F633-P666 HydrophobicContact CG-CG 4.17Å; F633-P666 HydrophobicContact CZ-CB 4.48Å
634	L	94.4	Very high	88.2	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	124.2	-166.9	-69.8	170.6	0	0	0	111.9	L605 V632 L660 T663 R665 P666 Y667 G668	L605-L634 HydrophobicContact CD2-CD2 3.72Å; L605-L634 HydrophobicContact CG-CD2 4.37Å; V632-L634 HydrophobicContact CG1-CD2 3.57Å; V632-L634 HydrophobicContact CG1-CG 3.94Å; L634-L660 HydrophobicContact CB-CD1 4.44Å; L634-L660 HydrophobicContact CB-CD2 4.27Å; L634-L660 HydrophobicContact CD1-CD2 4.33Å; L634-T663 HydrophobicContact CD1-CG2 3.77Å; L634-R665 HydrophobicContact CD1-CB 4.33Å; L634-P666 PolarHBondContact N-O 3.08Å; L634-Y667 CarbonylContact O-C 3.11Å; L634-Y667 WeakPolarHBondContact O-CA 3.48Å; L634-Y667 WeakPolarHBondContact O-CB 3.09Å; L634-G668 PolarHBondContact O-N 3.34Å
635	F	95.1	Very high	88.4	Confident	1 Å²	1	26.8 Å²	26.8	0%	0.004	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	140.5	174.3	-81.9	-102.3	0	0	0	111.6	C138 S140 I590 Q591 T593 F633 M637 L660 G668	C138-F635 HydrophobicContact CB-CZ 4.31Å; S140-F635 WeakPolarHBondContact OG-CE1 3.36Å; I590-F635 HydrophobicContact CD1-CE2 4.31Å; I590-F635 HydrophobicContact CG1-CD2 4.45Å; I590-F635 HydrophobicContact CG1-CE2 4.03Å; I590-F635 HydrophobicContact CG2-CD2 3.72Å; I590-F635 HydrophobicContact CG2-CE2 4.07Å; I590-F635 HydrophobicContact CG2-CG 4.33Å; Q591-F635 PolarHBondContact O-N 3.43Å; T593-F635 PolarHBondContact N-O 3.47Å; T593-F635 PolarHBondContact OG1-O 3.13Å; F633-F635 HydrophobicContact CD1-CE2 4.01Å; F633-F635 HydrophobicContact CD2-CD2 4.18Å; F633-F635 AromaticContact CD2-CE2 3.54Å; F633-F635 HydrophobicContact CD2-CE2 3.54Å; F633-F635 HydrophobicContact CD2-CZ 4.34Å; F633-F635 HydrophobicContact CE1-CE2 4.06Å; F633-F635 HydrophobicContact CE1-CZ 4.32Å; F633-F635 AromaticContact CE2-CE2 3.6Å; F633-F635 HydrophobicContact CE2-CE2 3.6Å; F633-F635 AromaticContact CE2-CZ 3.94Å; F633-F635 HydrophobicContact CE2-CZ 3.94Å; F633-F635 HydrophobicContact CG-CD2 4.48Å; F633-F635 AromaticContact CG-CE2 3.79Å; F633-F635 HydrophobicContact CG-CE2 3.79Å; F633-F635 AromaticContact CZ-CE2 3.88Å; F633-F635 HydrophobicContact CZ-CE2 3.88Å; F633-F635 AromaticContact CZ-CZ 3.94Å; F633-F635 HydrophobicContact CZ-CZ 3.94Å; F635-M637 VanDerWaalsContact C-N 3.32Å; F635-M637 WeakPolarHBondContact CD1-O 3.44Å; F635-L660 VanDerWaalsContact C-CD1 3.45Å; F635-G668 VanDerWaalsContact CA-O 3.31Å; F635-G668 WeakPolarHBondContact CA-O 3.34Å
636	D	93.7	Very high	88.1	Confident	3 Å²	3	31.2 Å²	31.2	2%	0.016	16%	0.158	C	C	.	.	S	Bend	trans	-70.4	-35.4	166.6	55.3	35.7	0	0	0	110.9	T593 S594 T656 L660 G668 S669 R728	T593-D636 WeakPolarHBondContact OG1-CA 3.48Å; S594-D636 PolarHBondContact N-O 2.79Å; S594-D636 PolarHBondContact OG-O 3.19Å; D636-T656 HydrophobicContact CB-CG2 4.05Å; D636-L660 HydrophobicContact CB-CD1 3.88Å; D636-L660 VanDerWaalsContact N-CD1 3.29Å; D636-G668 PolarHBondContact N-O 3.18Å; D636-S669 VanDerWaalsContact CG-OG 3.23Å; D636-S669 WeakPolarHBondContact OD1-CA 3.5Å; D636-S669 WeakPolarHBondContact OD1-CB 3.34Å; D636-S669 PolarHBondContact OD1-OG 3.49Å; D636-S669 WeakPolarHBondContact OD2-CB 3.37Å; D636-S669 PolarHBondContact OD2-OG 3.38Å; D636-S669 VanDerWaalsContact OD2-OG 3.13Å; D636-R728 IonicContact OD2-CZ 2.76Å; D636-R728 VanDerWaalsContact OD2-CZ 3.26Å; D636-R728 IonicContact OD2-NH1 3.52Å; D636-R728 PolarHBondContact OD2-NH1 3.13Å; D636-R728 IonicContact OD2-NH2 2.62Å; D636-R728 PolarHBondContact OD2-NH2 3.31Å
637	M	91.7	Very high	87.9	Confident	13 Å²	13	31 Å²	31	6%	0.064	15%	0.152	C	C	.	.	S	Bend	trans	-147.1	133.6	165.3	-171.6	-173.4	70	0	0	110.1	S594 F635 E641 S643 P644 C670 V673	S594-M637 WeakPolarHBondContact OG-CA 3.39Å; F635-M637 VanDerWaalsContact C-N 3.32Å; F635-M637 WeakPolarHBondContact CD1-O 3.44Å; M637-E641 HydrophobicContact CG-CB 3.99Å; M637-S643 VanDerWaalsContact SD-CA 3.52Å; M637-P644 HydrophobicContact CB-CG 4.43Å; M637-C670 HydrophobicContact CE-CB 3.5Å; M637-C670 PolarHBondContact O-SG 3.12Å; M637-V673 HydrophobicContact CB-CG2 4.16Å; M637-V673 HydrophobicContact CE-CG2 3.58Å; M637-V673 HydrophobicContact SD-CG2 4.19Å
638	A	89.4	Confident	87.9	Confident	4 Å²	4	28.8 Å²	28.8	3%	0.033	13%	0.134	C	C	.	.			trans	-85.7	160.4	167.3	0	0	0	0	0	111.5	K569 I590 S592 E641	K569-A638 HydrophobicContact CD-CB 4.46Å; I590-A638 HydrophobicContact CG2-CB 4.26Å; S592-A638 PolarHBondContact OG-N 3.38Å; S592-A638 VanDerWaalsContact OG-N 3.1Å; A638-E641 HydrophobicContact CB-CG 4.33Å; A638-E641 WeakPolarHBondContact O-CB 3.29Å; A638-E641 PolarHBondContact O-N 3.33Å
639	L	85.7	Confident	88.1	Confident	14 Å²	14	24.3 Å²	24.3	7%	0.073	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.8	153.8	168	-62.6	172.5	0	0	0	110.1	Y142 T170 W182 K569 E641 C670	Y142-L639 HydrophobicContact CD2-CD2 3.99Å; Y142-L639 HydrophobicContact CE2-CD2 3.63Å; T170-L639 HydrophobicContact CG2-CD1 3.7Å; W182-L639 HydrophobicContact CH2-CB 3.97Å; W182-L639 HydrophobicContact CZ2-CB 3.87Å; W182-L639 HydrophobicContact CZ2-CD1 4.15Å; K569-L639 PolarHBondContact NZ-O 3.21Å; L639-E641 VanDerWaalsContact C-N 3.29Å; L639-E641 PolarHBondContact O-N 3.23Å; L639-C670 HydrophobicContact CD2-CB 4.31Å; L639-C670 PolarHBondContact N-SG 2.93Å; L639-C670 VanDerWaalsContact N-SG 3.39Å
640	D	78	Confident	88.3	Confident	75 Å²	75	19.8 Å²	19.8	40%	0.401	9%	0.094	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.7	-15.5	-169.9	81.2	41	0	0	0	117.6	Y142 W182 K569	Y142-D640 PolarHBondContact OH-N 2.85Å; W182-D640 HydrophobicContact CH2-CB 4.1Å; W182-D640 HydrophobicContact CZ3-CB 4.33Å; K569-D640 IonicContact NZ-OD1 3.04Å; K569-D640 PolarHBondContact NZ-OD1 3.35Å; K569-D640 IonicContact NZ-OD2 2.66Å; K569-D640 PolarHBondContact NZ-OD2 3.26Å
641	E	81.9	Confident	88.3	Confident	12 Å²	12	20.2 Å²	20.2	6%	0.056	10%	0.097	C	C	.	.	S	Bend	trans	-87.1	176.4	-170.2	-58.6	-172.4	174	0	0	114.8	K569 S592 S594 W595 M637 A638 L639	K569-E641 IonicContact NZ-OE1 3.93Å; K569-E641 PolarHBondContact NZ-OE1 2.87Å; S592-E641 WeakPolarHBondContact CB-OE1 3.5Å; S592-E641 WeakPolarHBondContact CB-OE2 3.18Å; S592-E641 VanDerWaalsContact OG-CD 3.31Å; S592-E641 PolarHBondContact OG-OE1 2.91Å; S592-E641 PolarHBondContact OG-OE2 3.38Å; S594-E641 WeakPolarHBondContact CB-OE2 3.45Å; S594-E641 PolarHBondContact OG-OE2 3.48Å; W595-E641 HydrophobicContact CZ2-CG 3.98Å; W595-E641 PolarHBondContact NE1-OE1 3.21Å; W595-E641 PolarHBondContact NE1-OE2 2.8Å; M637-E641 HydrophobicContact CG-CB 3.99Å; A638-E641 HydrophobicContact CB-CG 4.33Å; A638-E641 WeakPolarHBondContact O-CB 3.29Å; A638-E641 PolarHBondContact O-N 3.33Å; L639-E641 VanDerWaalsContact C-N 3.29Å; L639-E641 PolarHBondContact O-N 3.23Å
642	E	80.2	Confident	88.4	Confident	39 Å²	39	19.7 Å²	19.7	18%	0.182	9%	0.093	C	C	.	.			trans	-87	135.7	174.1	-176.4	170.3	-125.9	0	0	111.8	K646 R647	E642-K646 HydrophobicContact CG-CD 4.35Å; E642-K646 WeakPolarHBondContact OE1-CD 3.22Å; E642-K646 WeakPolarHBondContact OE1-CE 3.33Å; E642-K646 IonicContact OE1-NZ 3.67Å; E642-K646 PolarHBondContact OE1-NZ 2.87Å; E642-R647 HydrophobicContact CG-CB 4.45Å; E642-R647 IonicContact OE2-NH1 3.85Å; E642-R647 PolarHBondContact OE2-NH1 2.72Å
643	S	85.1	Confident	88.4	Confident	4 Å²	4	19.8 Å²	19.8	3%	0.028	9%	0.094	C	C	.	.			trans	-55.3	127.7	-179.1	-175	0	0	0	0	112.4	M637 V645 K646 R647 V677	M637-S643 VanDerWaalsContact SD-CA 3.52Å; S643-V645 PolarHBondContact O-N 3.26Å; S643-V645 VanDerWaalsContact O-N 3.14Å; S643-V645 WeakPolarHBondContact OG-CB 3.32Å; S643-V645 VanDerWaalsContact OG-CG2 3.3Å; S643-V645 WeakPolarHBondContact OG-CG2 3.48Å; S643-V645 PolarHBondContact OG-N 2.77Å; S643-K646 PolarHBondContact O-N 2.92Å; S643-R647 PolarHBondContact O-N 2.78Å; S643-V677 WeakPolarHBondContact CB-O 3.45Å; S643-V677 PolarHBondContact OG-O 2.95Å
644	P	86.7	Confident	88.4	Confident	7 Å²	7	20 Å²	20	5%	0.045	10%	0.095	C	C	.	.	H	α-helix	trans	-60.3	-24.5	175	24.3	-33.2	0	0	0	111.9	M637 K646 R647 R648 V673	M637-P644 HydrophobicContact CB-CG 4.43Å; P644-K646 PolarHBondContact O-N 3.09Å; P644-R647 PolarHBondContact O-N 3.04Å; P644-R648 WeakPolarHBondContact O-CB 3.48Å; P644-R648 PolarHBondContact O-N 3.22Å; P644-V673 HydrophobicContact CG-CG1 4.18Å
645	V	87.8	Confident	88.4	Confident	5 Å²	5	21 Å²	21	3%	0.03	10%	0.102	C	C	.	.	H	α-helix	trans	-55.4	-36.1	171.8	-175.6	0	0	0	0	111.9	S643 P650 V653 L676	S643-V645 PolarHBondContact O-N 3.26Å; S643-V645 VanDerWaalsContact O-N 3.14Å; S643-V645 WeakPolarHBondContact OG-CB 3.32Å; S643-V645 VanDerWaalsContact OG-CG2 3.3Å; S643-V645 WeakPolarHBondContact OG-CG2 3.48Å; S643-V645 PolarHBondContact OG-N 2.77Å; V645-P650 HydrophobicContact CG1-CB 4.01Å; V645-P650 HydrophobicContact CG1-CG 3.76Å; V645-V653 HydrophobicContact CG2-CG2 3.87Å; V645-L676 HydrophobicContact CG1-CB 4.45Å; V645-L676 HydrophobicContact CG2-CD2 4.4Å
646	K	83.5	Confident	88.4	Confident	104 Å²	104	21.1 Å²	21.1	45%	0.452	10%	0.103	S	C	.	.	H	α-helix	trans	-94	-38.2	178.2	178.8	-173.5	173.2	-146.6	0	112.7	E642 S643 P644 S678	E642-K646 HydrophobicContact CG-CD 4.35Å; E642-K646 WeakPolarHBondContact OE1-CD 3.22Å; E642-K646 WeakPolarHBondContact OE1-CE 3.33Å; E642-K646 IonicContact OE1-NZ 3.67Å; E642-K646 PolarHBondContact OE1-NZ 2.87Å; S643-K646 PolarHBondContact O-N 2.92Å; P644-K646 PolarHBondContact O-N 3.09Å; K646-S678 VanDerWaalsContact CB-O 3.31Å; K646-S678 WeakPolarHBondContact CB-O 3.34Å
647	R	82.8	Confident	88.5	Confident	76 Å²	76	21 Å²	21	29%	0.287	10%	0.102	S	C	.	.	H	α-helix	trans	-77.9	-25.2	-173.7	-168.9	176.3	178.7	89.1	-1.2	113.5	S594 E642 S643 P644	S594-R647 VanDerWaalsContact O-CD 3.25Å; S594-R647 WeakPolarHBondContact O-CD 3.46Å; S594-R647 PolarHBondContact O-NE 2.9Å; E642-R647 HydrophobicContact CG-CB 4.45Å; E642-R647 IonicContact OE2-NH1 3.85Å; E642-R647 PolarHBondContact OE2-NH1 2.72Å; S643-R647 PolarHBondContact O-N 2.78Å; P644-R647 PolarHBondContact O-N 3.04Å
648	R	89	Confident	88.7	Confident	23 Å²	23	20.9 Å²	20.9	9%	0.087	10%	0.102	C	C	.	.	S	Bend	trans	-121.9	-122.4	173.2	-64	-176.8	-175	144.6	11	109.1	T593 V596 P644 D652 T656 F777	T593-R648 PolarHBondContact O-NH2 3.03Å; V596-R648 PolarHBondContact O-NH2 3.28Å; P644-R648 WeakPolarHBondContact O-CB 3.48Å; P644-R648 PolarHBondContact O-N 3.22Å; R648-D652 HydrophobicContact CB-CB 4.49Å; R648-D652 VanDerWaalsContact CD-OD2 3.29Å; R648-D652 WeakPolarHBondContact CD-OD2 3.5Å; R648-D652 IonicContact CZ-OD2 2.7Å; R648-D652 IonicContact NE-OD2 2.59Å; R648-D652 IonicContact NH1-OD2 3.66Å; R648-D652 PolarHBondContact NH1-OD2 2.85Å; R648-D652 VanDerWaalsContact NH1-OD2 3.12Å; R648-T656 PolarHBondContact NH1-OG1 3.43Å; R648-F777 CarbonylContact C-O 3.44Å; R648-F777 WeakPolarHBondContact CA-O 3.26Å; R648-F777 WeakPolarHBondContact CB-O 3.49Å; R648-F777 HydrophobicContact CG-CG 4.36Å
649	T	89.5	Confident	89	Confident	1 Å²	1	20.7 Å²	20.7	1%	0.006	10%	0.101	C	C	.	.			trans	-124.8	154.4	167.5	74.1	0	0	0	0	110.2	V651 D652 C776 M779	T649-V651 PolarHBondContact O-N 3.04Å; T649-V651 VanDerWaalsContact O-N 3.16Å; T649-V651 PolarHBondContact OG1-N 3.18Å; T649-D652 PolarHBondContact O-N 3.13Å; T649-D652 VanDerWaalsContact O-N 3.12Å; T649-D652 PolarHBondContact OG1-N 3.41Å; T649-C776 VanDerWaalsContact CG2-O 3.3Å; T649-C776 WeakPolarHBondContact CG2-O 3.38Å; T649-C776 PolarHBondContact OG1-O 2.88Å; T649-M779 HydrophobicContact CG2-CE 3.93Å; T649-M779 HydrophobicContact CG2-CG 3.85Å; T649-M779 HydrophobicContact CG2-SD 3.72Å
650	P	89.9	Confident	89.4	Confident	4 Å²	4	20 Å²	20	3%	0.026	10%	0.097	C	C	.	.	G	3₁₀ helix	trans	-57.1	-28.4	170.9	-23.6	34.9	0	0	0	112.4	V645 D652 V653 L676 L806 Y843	V645-P650 HydrophobicContact CG1-CB 4.01Å; V645-P650 HydrophobicContact CG1-CG 3.76Å; P650-D652 VanDerWaalsContact C-N 3.3Å; P650-D652 PolarHBondContact O-N 3Å; P650-V653 WeakPolarHBondContact O-CG2 3.24Å; P650-V653 PolarHBondContact O-N 3.19Å; P650-L676 HydrophobicContact CB-CD2 4.37Å; P650-L806 HydrophobicContact CB-CD2 4.25Å; P650-L806 WeakPolarHBondContact O-CD2 3.45Å; P650-Y843 HydrophobicContact CB-CD2 4.01Å; P650-Y843 HydrophobicContact CB-CE1 4.24Å; P650-Y843 HydrophobicContact CB-CE2 3.65Å; P650-Y843 HydrophobicContact CB-CG 4.48Å; P650-Y843 HydrophobicContact CG-CD2 4.39Å; P650-Y843 HydrophobicContact CG-CE2 3.58Å
651	V	91.4	Very high	90.2	Very high	25 Å²	25	16.5 Å²	16.5	15%	0.152	8%	0.078	C	C	.	.	G	3₁₀ helix	trans	-69.1	-25.4	-179.4	-176.6	0	0	0	0	112.4	T649 P655 C776 Y843	T649-V651 PolarHBondContact O-N 3.04Å; T649-V651 VanDerWaalsContact O-N 3.16Å; T649-V651 PolarHBondContact OG1-N 3.18Å; V651-P655 WeakPolarHBondContact O-CD 3.36Å; V651-P655 WeakPolarHBondContact O-CG 3.33Å; V651-C776 HydrophobicContact CB-CB 4.42Å; V651-C776 HydrophobicContact CG1-CB 4.3Å; V651-Y843 HydrophobicContact CG2-CD1 4.26Å; V651-Y843 HydrophobicContact CG2-CE1 3.8Å
652	D	92.9	Very high	90.7	Very high	2 Å²	2	15.9 Å²	15.9	1%	0.011	8%	0.075	C	C	.	.	G	3₁₀ helix	trans	-79	-14.4	179.4	-167.4	68.9	0	0	0	114.4	R648 T649 P650 L654 P655 T656 N775 C776 F777	R648-D652 HydrophobicContact CB-CB 4.49Å; R648-D652 VanDerWaalsContact CD-OD2 3.29Å; R648-D652 WeakPolarHBondContact CD-OD2 3.5Å; R648-D652 IonicContact CZ-OD2 2.7Å; R648-D652 IonicContact NE-OD2 2.59Å; R648-D652 IonicContact NH1-OD2 3.66Å; R648-D652 PolarHBondContact NH1-OD2 2.85Å; R648-D652 VanDerWaalsContact NH1-OD2 3.12Å; T649-D652 PolarHBondContact O-N 3.13Å; T649-D652 VanDerWaalsContact O-N 3.12Å; T649-D652 PolarHBondContact OG1-N 3.41Å; P650-D652 VanDerWaalsContact C-N 3.3Å; P650-D652 PolarHBondContact O-N 3Å; D652-L654 PolarHBondContact O-N 2.83Å; D652-P655 WeakPolarHBondContact O-CD 3.37Å; D652-T656 WeakPolarHBondContact O-CB 3.48Å; D652-T656 PolarHBondContact O-N 2.57Å; D652-T656 PolarHBondContact OD2-OG1 2.84Å; D652-N775 WeakPolarHBondContact OD1-CA 3.29Å; D652-N775 WeakPolarHBondContact OD1-CB 3.41Å; D652-N775 PolarHBondContact OD1-ND2 3.14Å; D652-C776 PolarHBondContact OD1-N 3.35Å; D652-F777 WeakPolarHBondContact OD1-CD1 3.31Å; D652-F777 WeakPolarHBondContact OD2-CE1 3.5Å
653	V	93.7	Very high	91.4	Very high	4 Å²	4	14 Å²	14	2%	0.024	7%	0.067	C	C	.	.	H	α-helix	trans	-58.5	-49.9	-175.3	178.4	0	0	0	0	111.7	V645 P650 A657 V673 L676 V724	V645-V653 HydrophobicContact CG2-CG2 3.87Å; P650-V653 WeakPolarHBondContact O-CG2 3.24Å; P650-V653 PolarHBondContact O-N 3.19Å; V653-A657 VanDerWaalsContact O-CB 3.22Å; V653-A657 WeakPolarHBondContact O-CB 3.26Å; V653-A657 PolarHBondContact O-N 2.85Å; V653-V673 HydrophobicContact CG1-CG1 3.63Å; V653-L676 HydrophobicContact CB-CD2 4.31Å; V653-L676 HydrophobicContact CG2-CD2 4.04Å; V653-V724 HydrophobicContact CG1-CG2 3.9Å
654	L	94.3	Very high	91.6	Very high	5 Å²	5	16.3 Å²	16.3	3%	0.026	7%	0.074	C	C	.	.	H	α-helix	trans	-69.7	-45.1	179	-178.7	69	0	0	0	113	D652 A657 T658 V724 V731 L845	D652-L654 PolarHBondContact O-N 2.83Å; L654-A657 PolarHBondContact O-N 2.84Å; L654-T658 VanDerWaalsContact O-CB 3.31Å; L654-T658 WeakPolarHBondContact O-CB 3.28Å; L654-T658 PolarHBondContact O-N 2.89Å; L654-T658 PolarHBondContact O-OG1 2.72Å; L654-V724 HydrophobicContact CB-CG1 4.2Å; L654-V731 HydrophobicContact CD1-CG2 3.76Å; L654-L845 HydrophobicContact CD2-CD1 3.64Å
655	P	94.5	Very high	91.9	Very high	20 Å²	20	18.2 Å²	18.2	13%	0.13	8%	0.081	C	C	.	.	H	α-helix	trans	-47.4	-55.1	167.2	-34.8	38.4	0	0	0	114.5	V651 D652 T658 L659 V773 R774	V651-P655 WeakPolarHBondContact O-CD 3.36Å; V651-P655 WeakPolarHBondContact O-CG 3.33Å; D652-P655 WeakPolarHBondContact O-CD 3.37Å; P655-T658 WeakPolarHBondContact O-CB 3.22Å; P655-T658 PolarHBondContact O-N 2.84Å; P655-L659 PolarHBondContact O-N 2.96Å; P655-L659 VanDerWaalsContact O-N 3.1Å; P655-V773 HydrophobicContact CB-CG1 3.5Å; P655-V773 HydrophobicContact CG-CG1 4.46Å; P655-R774 WeakPolarHBondContact CG-O 3.4Å
656	T	95.2	Very high	92.2	Very high	4 Å²	4	18.6 Å²	18.6	3%	0.025	8%	0.083	C	C	.	.	H	α-helix	trans	-63.9	-47	-179.6	-74.2	0	0	0	0	110.9	D636 R648 D652 T658 L659 L660	D636-T656 HydrophobicContact CB-CG2 4.05Å; R648-T656 PolarHBondContact NH1-OG1 3.43Å; D652-T656 WeakPolarHBondContact O-CB 3.48Å; D652-T656 PolarHBondContact O-N 2.57Å; D652-T656 PolarHBondContact OD2-OG1 2.84Å; T656-T658 VanDerWaalsContact C-N 3.3Å; T656-T658 PolarHBondContact O-N 3.17Å; T656-L659 PolarHBondContact O-N 2.71Å; T656-L659 VanDerWaalsContact O-N 3.13Å; T656-L660 HydrophobicContact CG2-CD1 4.49Å; T656-L660 HydrophobicContact CG2-CG 4.49Å; T656-L660 WeakPolarHBondContact O-CG 3.34Å; T656-L660 PolarHBondContact O-N 3.44Å
657	A	95.3	Very high	92.8	Very high	1 Å²	1	13.6 Å²	13.6	1%	0.008	6%	0.062	C	C	.	.	H	α-helix	trans	-54.3	-44.8	175.4	0	0	0	0	0	112.9	V653 L654 L659 L660 A661 R728	V653-A657 VanDerWaalsContact O-CB 3.22Å; V653-A657 WeakPolarHBondContact O-CB 3.26Å; V653-A657 PolarHBondContact O-N 2.85Å; L654-A657 PolarHBondContact O-N 2.84Å; A657-L659 PolarHBondContact O-N 2.92Å; A657-L660 PolarHBondContact O-N 2.88Å; A657-A661 VanDerWaalsContact O-CB 3.29Å; A657-A661 WeakPolarHBondContact O-CB 3.44Å; A657-A661 PolarHBondContact O-N 2.78Å; A657-R728 VanDerWaalsContact CB-NH1 3.29Å
658	T	95.4	Very high	93.4	Very high	10 Å²	10	10 Å²	10	6%	0.061	5%	0.048	C	C	.	.	H	α-helix	trans	-60.6	-43	178	-62.9	0	0	0	0	111.8	L654 P655 T656 A662 V731 M734 I771 V773 Y802	L654-T658 VanDerWaalsContact O-CB 3.31Å; L654-T658 WeakPolarHBondContact O-CB 3.28Å; L654-T658 PolarHBondContact O-N 2.89Å; L654-T658 PolarHBondContact O-OG1 2.72Å; P655-T658 WeakPolarHBondContact O-CB 3.22Å; P655-T658 PolarHBondContact O-N 2.84Å; T656-T658 VanDerWaalsContact C-N 3.3Å; T656-T658 PolarHBondContact O-N 3.17Å; T658-A662 WeakPolarHBondContact O-CB 3.08Å; T658-A662 PolarHBondContact O-N 3.38Å; T658-V731 WeakPolarHBondContact OG1-CG2 3.1Å; T658-M734 HydrophobicContact CG2-CE 4.46Å; T658-I771 HydrophobicContact CG2-CG2 3.41Å; T658-I771 VanDerWaalsContact CG2-CG2 3.41Å; T658-V773 HydrophobicContact CG2-CG2 3.59Å; T658-Y802 VanDerWaalsContact CG2-OH 3.26Å; T658-Y802 WeakPolarHBondContact CG2-OH 3.43Å; T658-Y802 PolarHBondContact OG1-OH 2.68Å
659	L	95.5	Very high	93.7	Very high	0 Å²	0	8.9 Å²	8.9	0%	0	4%	0.044	C	C	.	.	H	α-helix	trans	-68.4	-39.2	178.9	-74.2	174.2	0	0	0	113.3	L602 L606 P655 T656 A657 A662 I756 V758 V773 N775	L602-L659 HydrophobicContact CD2-CD1 3.67Å; L602-L659 HydrophobicContact CG-CD1 4.38Å; L606-L659 HydrophobicContact CD1-CB 3.87Å; L606-L659 HydrophobicContact CD1-CD1 4.3Å; L606-L659 HydrophobicContact CD1-CD2 4.07Å; L606-L659 HydrophobicContact CD1-CG 4.31Å; L606-L659 WeakPolarHBondContact CD2-O 3.33Å; P655-L659 PolarHBondContact O-N 2.96Å; P655-L659 VanDerWaalsContact O-N 3.1Å; T656-L659 PolarHBondContact O-N 2.71Å; T656-L659 VanDerWaalsContact O-N 3.13Å; A657-L659 PolarHBondContact O-N 2.92Å; L659-A662 WeakPolarHBondContact O-CB 3.4Å; L659-A662 PolarHBondContact O-N 3.49Å; L659-I756 HydrophobicContact CD1-CB 4.31Å; L659-I756 HydrophobicContact CD1-CD1 3.79Å; L659-I756 HydrophobicContact CD2-CB 4.13Å; L659-I756 HydrophobicContact CD2-CG2 3.81Å; L659-V758 HydrophobicContact CD2-CG2 3.66Å; L659-V773 HydrophobicContact CD1-CB 4.28Å; L659-V773 HydrophobicContact CD1-CG1 3.95Å; L659-V773 HydrophobicContact CD2-CB 3.95Å; L659-V773 HydrophobicContact CD2-CG1 4.47Å; L659-V773 HydrophobicContact CD2-CG2 3.92Å; L659-V773 HydrophobicContact CG-CB 3.99Å; L659-V773 HydrophobicContact CG-CG1 3.97Å; L659-V773 HydrophobicContact CG-CG2 3.98Å; L659-N775 VanDerWaalsContact CD1-OD1 3.31Å; L659-N775 WeakPolarHBondContact CD1-OD1 3.38Å
660	L	95.4	Very high	93.9	Very high	0 Å²	0	9 Å²	9	0%	0	4%	0.044	C	C	.	.	H	α-helix	trans	-66.4	-46	175.8	-58.2	-171.5	0	0	0	111	T593 L602 L606 L634 F635 D636 T656 A657 A662 T663 Y667	T593-L660 HydrophobicContact CG2-CD1 4.49Å; T593-L660 HydrophobicContact CG2-CD2 3.89Å; L602-L660 HydrophobicContact CD1-CD2 4.18Å; L606-L660 HydrophobicContact CD2-CD2 4.35Å; L634-L660 HydrophobicContact CB-CD1 4.44Å; L634-L660 HydrophobicContact CB-CD2 4.27Å; L634-L660 HydrophobicContact CD1-CD2 4.33Å; F635-L660 VanDerWaalsContact C-CD1 3.45Å; D636-L660 HydrophobicContact CB-CD1 3.88Å; D636-L660 VanDerWaalsContact N-CD1 3.29Å; T656-L660 HydrophobicContact CG2-CD1 4.49Å; T656-L660 HydrophobicContact CG2-CG 4.49Å; T656-L660 WeakPolarHBondContact O-CG 3.34Å; T656-L660 PolarHBondContact O-N 3.44Å; A657-L660 PolarHBondContact O-N 2.88Å; L660-A662 PolarHBondContact O-N 2.89Å; L660-T663 WeakPolarHBondContact O-CB 3.23Å; L660-T663 WeakPolarHBondContact O-CG2 3.46Å; L660-T663 PolarHBondContact O-N 3.32Å; L660-T663 PolarHBondContact O-OG1 2.94Å; L660-Y667 HydrophobicContact CB-CD2 3.67Å; L660-Y667 HydrophobicContact CB-CE2 4.42Å; L660-Y667 HydrophobicContact CB-CG 4.28Å
661	A	93.9	Very high	94.1	Very high	0 Å²	0	8.8 Å²	8.8	0%	0	4%	0.043	C	C	.	.	H	α-helix	trans	-60.9	-27.9	174.2	0	0	0	0	0	113.6	A657 T663 Y667 V731 M734 H735	A657-A661 VanDerWaalsContact O-CB 3.29Å; A657-A661 WeakPolarHBondContact O-CB 3.44Å; A657-A661 PolarHBondContact O-N 2.78Å; A661-T663 PolarHBondContact O-N 3.45Å; A661-Y667 HydrophobicContact CB-CD1 4.44Å; A661-Y667 HydrophobicContact CB-CE1 3.97Å; A661-Y667 HydrophobicContact CB-CE2 4.19Å; A661-V731 HydrophobicContact CB-CG1 3.28Å; A661-M734 HydrophobicContact CB-CE 3.77Å; A661-H735 HydrophobicContact CB-CB 4.06Å; A661-H735 PolarHBondContact O-ND1 3.44Å
662	A	93.3	Very high	94	Very high	0 Å²	0	7.7 Å²	7.7	0%	0	4%	0.037	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-11.1	174.5	0	0	0	0	0	113.5	T658 L659 L660 V758 R760 I771	T658-A662 WeakPolarHBondContact O-CB 3.08Å; T658-A662 PolarHBondContact O-N 3.38Å; L659-A662 WeakPolarHBondContact O-CB 3.4Å; L659-A662 PolarHBondContact O-N 3.49Å; L660-A662 PolarHBondContact O-N 2.89Å; A662-V758 HydrophobicContact CB-CB 4.07Å; A662-V758 HydrophobicContact CB-CG1 3.88Å; A662-V758 HydrophobicContact CB-CG2 4.29Å; A662-R760 VanDerWaalsContact C-NH1 3.3Å; A662-R760 WeakPolarHBondContact O-CD 3.35Å; A662-R760 WeakPolarHBondContact O-CG 3.34Å; A662-R760 PolarHBondContact O-NH1 3.36Å; A662-I771 HydrophobicContact CB-CD1 3.48Å; A662-I771 VanDerWaalsContact CB-CD1 3.48Å; A662-I771 HydrophobicContact CB-CG2 4.26Å
663	T	93.6	Very high	94	Very high	0 Å²	0	7.7 Å²	7.7	0%	0	4%	0.037	C	C	.	.	S	Bend	trans	-80.5	160.8	173.9	69.6	0	0	0	0	113.2	L606 L634 L660 A661 R665 R760	L606-T663 HydrophobicContact CD2-CG2 3.32Å; L634-T663 HydrophobicContact CD1-CG2 3.77Å; L660-T663 WeakPolarHBondContact O-CB 3.23Å; L660-T663 WeakPolarHBondContact O-CG2 3.46Å; L660-T663 PolarHBondContact O-N 3.32Å; L660-T663 PolarHBondContact O-OG1 2.94Å; A661-T663 PolarHBondContact O-N 3.45Å; T663-R665 PolarHBondContact O-N 2.96Å; T663-R665 PolarHBondContact OG1-N 3.49Å; T663-R760 PolarHBondContact O-NH1 3.35Å
664	R	91	Very high	94	Very high	51 Å²	51	7.5 Å²	7.5	19%	0.192	4%	0.036	C	C	.	.	S	Bend	trans	-90.1	51.8	164.5	-168.9	-145.6	164.8	131.4	7	109.7	E134 G610 T744	E134-R664 HydrophobicContact CB-CG 4.11Å; E134-R664 HydrophobicContact CG-CG 4.21Å; E134-R664 IonicContact OE1-CZ 2.74Å; E134-R664 IonicContact OE1-NE 3.99Å; E134-R664 PolarHBondContact OE1-NE 3.19Å; E134-R664 IonicContact OE1-NH2 2.68Å; E134-R664 PolarHBondContact OE1-NH2 2.72Å; G610-R664 WeakPolarHBondContact O-CB 3.48Å; G610-R664 PolarHBondContact O-N 3.1Å; R664-T744 VanDerWaalsContact NH1-CB 3.32Å
665	R	92.1	Very high	93.9	Very high	48 Å²	48	7.9 Å²	7.9	18%	0.181	4%	0.037	C	C	.	.	S	Bend	trans	-136.2	150	176.6	-65.3	-64.1	178.7	161.9	6.3	110	Y609 L634 T663 H735	Y609-R665 VanDerWaalsContact O-CG 3.31Å; Y609-R665 WeakPolarHBondContact O-CG 3.44Å; Y609-R665 PolarHBondContact O-NE 3.04Å; Y609-R665 PolarHBondContact O-NH2 2.94Å; L634-R665 HydrophobicContact CD1-CB 4.33Å; T663-R665 PolarHBondContact O-N 2.96Å; T663-R665 PolarHBondContact OG1-N 3.49Å; R665-H735 PolarHBondContact O-CE1 2.91Å
666	P	94.5	Very high	93.8	Very high	12 Å²	12	7 Å²	7	8%	0.078	3%	0.031	C	C	.	.			trans	-57.1	141.2	166.1	27.7	-34.1	0	0	0	109	L133 I136 Y565 F633 L634	L133-P666 WeakPolarHBondContact O-CB 3.47Å; I136-P666 HydrophobicContact CB-CB 3.89Å; I136-P666 HydrophobicContact CG2-CB 4.45Å; I136-P666 WeakPolarHBondContact O-CA 3.09Å; Y565-P666 WeakPolarHBondContact OH-CG 3.23Å; F633-P666 WeakPolarHBondContact CA-O 3.26Å; F633-P666 HydrophobicContact CB-CG 4.26Å; F633-P666 VanDerWaalsContact CD2-C 3.49Å; F633-P666 HydrophobicContact CD2-CB 3.7Å; F633-P666 HydrophobicContact CD2-CG 4.05Å; F633-P666 WeakPolarHBondContact CD2-O 3.38Å; F633-P666 HydrophobicContact CE2-CB 3.84Å; F633-P666 HydrophobicContact CG-CB 4.24Å; F633-P666 HydrophobicContact CG-CG 4.17Å; F633-P666 HydrophobicContact CZ-CB 4.48Å; L634-P666 PolarHBondContact N-O 3.08Å
667	Y	95.8	Very high	93.4	Very high	0 Å²	0	7 Å²	7	0%	0	3%	0.032	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	162.4	-178.5	99.1	-73.3	0	0	0	112.2	I136 A137 C138 L634 L660 A661 N732 H735	I136-Y667 PolarHBondContact O-N 3.25Å; A137-Y667 CarbonylContact C-O 2.99Å; A137-Y667 WeakPolarHBondContact CA-O 3.38Å; A137-Y667 HydrophobicContact CB-CD1 4.29Å; A137-Y667 HydrophobicContact CB-CE1 3.72Å; C138-Y667 PolarHBondContact N-O 2.72Å; L634-Y667 CarbonylContact O-C 3.11Å; L634-Y667 WeakPolarHBondContact O-CA 3.48Å; L634-Y667 WeakPolarHBondContact O-CB 3.09Å; L660-Y667 HydrophobicContact CB-CD2 3.67Å; L660-Y667 HydrophobicContact CB-CE2 4.42Å; L660-Y667 HydrophobicContact CB-CG 4.28Å; A661-Y667 HydrophobicContact CB-CD1 4.44Å; A661-Y667 HydrophobicContact CB-CE1 3.97Å; A661-Y667 HydrophobicContact CB-CE2 4.19Å; Y667-N732 PolarHBondContact OH-OD1 3.38Å; Y667-H735 AromaticContact CD1-CD2 3.84Å; Y667-H735 AromaticContact CD1-CE1 3.98Å; Y667-H735 AromaticContact CD1-CG 3.93Å; Y667-H735 AromaticContact CD1-NE2 3.89Å; Y667-H735 HydrophobicContact CE1-CB 4.12Å; Y667-H735 AromaticContact CE1-CD2 3.89Å; Y667-H735 AromaticContact CE1-CG 3.82Å
668	G	95.7	Very high	92.4	Very high	0 Å²	0	8.7 Å²	8.7	0%	0	4%	0.043	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.8	-179	-179.7	0	0	0	0	0	116.4	C138 L634 F635 D636	C138-G668 CarbonylContact O-C 3.24Å; C138-G668 WeakPolarHBondContact O-CA 3.28Å; L634-G668 PolarHBondContact O-N 3.34Å; F635-G668 VanDerWaalsContact CA-O 3.31Å; F635-G668 WeakPolarHBondContact CA-O 3.34Å; D636-G668 PolarHBondContact N-O 3.18Å
669	S	95.9	Very high	91	Very high	0 Å²	0	12.3 Å²	12.3	0%	0	6%	0.059	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	-178.4	178.8	-165.3	0	0	0	0	110.2	C138 Q139 S140 Y164 D636 R728	C138-S669 PolarHBondContact O-N 3.15Å; Q139-S669 WeakPolarHBondContact CA-O 3.48Å; S140-S669 PolarHBondContact N-O 3.44Å; Y164-S669 VanDerWaalsContact OH-CB 3.29Å; Y164-S669 WeakPolarHBondContact OH-CB 3.41Å; D636-S669 VanDerWaalsContact CG-OG 3.23Å; D636-S669 WeakPolarHBondContact OD1-CA 3.5Å; D636-S669 WeakPolarHBondContact OD1-CB 3.34Å; D636-S669 PolarHBondContact OD1-OG 3.49Å; D636-S669 WeakPolarHBondContact OD2-CB 3.37Å; D636-S669 PolarHBondContact OD2-OG 3.38Å; D636-S669 VanDerWaalsContact OD2-OG 3.13Å; S669-R728 PolarHBondContact OG-NH2 3.12Å
670	C	93.8	Very high	89.1	Confident	3 Å²	3	14.3 Å²	14.3	2%	0.02	7%	0.068	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	151.2	166.3	-57.5	0	0	0	0	111	S140 M637 L639 G672 V673	S140-C670 CarbonylContact O-C 3.55Å; S140-C670 VanDerWaalsContact O-CA 3.32Å; S140-C670 WeakPolarHBondContact O-CA 3.35Å; M637-C670 HydrophobicContact CE-CB 3.5Å; M637-C670 PolarHBondContact O-SG 3.12Å; L639-C670 HydrophobicContact CD2-CB 4.31Å; L639-C670 PolarHBondContact N-SG 2.93Å; L639-C670 VanDerWaalsContact N-SG 3.39Å; C670-G672 PolarHBondContact O-N 2.89Å; C670-V673 WeakPolarHBondContact O-CB 3.48Å; C670-V673 WeakPolarHBondContact O-CG2 3.02Å; C670-V673 PolarHBondContact O-N 3.48Å; C670-V673 VanDerWaalsContact O-N 3.16Å
671	R	92.6	Very high	87.1	Confident	0 Å²	0	14.9 Å²	14.9	0%	0	7%	0.072	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	137.1	174	-165.8	69.9	-166.6	-82.6	-19.5	110.9	Q139 S140 V141 Q155 E675 Y694 C695	Q139-R671 VanDerWaalsContact OE1-CD 3.27Å; S140-R671 PolarHBondContact O-N 3.5Å; V141-R671 HydrophobicContact CG1-CB 4.16Å; V141-R671 HydrophobicContact CG1-CG 4.41Å; V141-R671 HydrophobicContact CG2-CB 4.26Å; Q155-R671 PolarHBondContact O-NH1 3.34Å; Q155-R671 VanDerWaalsContact O-NH1 3.12Å; R671-E675 IonicContact CZ-OE1 2.74Å; R671-E675 VanDerWaalsContact CZ-OE1 3.24Å; R671-E675 IonicContact NE-OE1 3.37Å; R671-E675 PolarHBondContact NE-OE1 2.95Å; R671-E675 IonicContact NE-OE2 3.16Å; R671-E675 IonicContact NH2-OE1 2.61Å; R671-E675 PolarHBondContact NH2-OE1 2.78Å; R671-Y694 HydrophobicContact CB-CD1 4.4Å; R671-Y694 HydrophobicContact CB-CE1 3.76Å; R671-Y694 HydrophobicContact CB-CE2 4.34Å; R671-Y694 HydrophobicContact CG-CD1 3.56Å; R671-Y694 HydrophobicContact CG-CD2 4.29Å; R671-Y694 HydrophobicContact CG-CE1 3.41Å; R671-Y694 VanDerWaalsContact CG-CE1 3.41Å; R671-Y694 HydrophobicContact CG-CE2 4.16Å; R671-Y694 HydrophobicContact CG-CG 4.01Å; R671-C695 PolarHBondContact NH2-O 3.27Å
672	G	90.1	Very high	85	Confident	2 Å²	2	16.9 Å²	16.9	2%	0.021	8%	0.082	C	C	.	.	T	Hydrogen-bonded Turn	trans	99.3	-29.1	-171.3	0	0	0	0	0	113.9	C670 E675 L676 V677	C670-G672 PolarHBondContact O-N 2.89Å; G672-E675 WeakPolarHBondContact CA-OE2 3.47Å; G672-E675 PolarHBondContact N-OE2 3.31Å; G672-E675 PolarHBondContact O-N 2.84Å; G672-L676 PolarHBondContact O-N 2.9Å; G672-V677 VanDerWaalsContact O-CB 3.32Å; G672-V677 WeakPolarHBondContact O-CB 3.46Å; G672-V677 WeakPolarHBondContact O-CG2 3.29Å; G672-V677 PolarHBondContact O-N 2.79Å
673	V	92.3	Very high	82.7	Confident	1 Å²	1	23 Å²	23	1%	0.006	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-45.5	176	176.6	0	0	0	0	110.6	M637 P644 V653 C670 E675 L676	M637-V673 HydrophobicContact CB-CG2 4.16Å; M637-V673 HydrophobicContact CE-CG2 3.58Å; M637-V673 HydrophobicContact SD-CG2 4.19Å; P644-V673 HydrophobicContact CG-CG1 4.18Å; V653-V673 HydrophobicContact CG1-CG1 3.63Å; C670-V673 WeakPolarHBondContact O-CB 3.48Å; C670-V673 WeakPolarHBondContact O-CG2 3.02Å; C670-V673 PolarHBondContact O-N 3.48Å; C670-V673 VanDerWaalsContact O-N 3.16Å; V673-E675 VanDerWaalsContact C-N 3.27Å; V673-E675 PolarHBondContact O-N 2.9Å; V673-L676 PolarHBondContact O-N 3.35Å; V673-L676 VanDerWaalsContact O-N 3.08Å
674	D	94	Very high	80.4	Confident	0 Å²	0	23.5 Å²	23.5	0%	0	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-29.8	178.8	-64.5	-43.9	0	0	0	112.5	Q139 Y164 L676 G723 V724 I725 R728	Q139-D674 PolarHBondContact NE2-OD2 3.23Å; Y164-D674 VanDerWaalsContact CE2-OD2 3.28Å; Y164-D674 WeakPolarHBondContact CE2-OD2 3.5Å; Y164-D674 PolarHBondContact OH-OD1 2.66Å; Y164-D674 PolarHBondContact OH-OD2 3.5Å; D674-L676 VanDerWaalsContact C-N 3.31Å; D674-G723 WeakPolarHBondContact O-CA 3.23Å; D674-V724 HydrophobicContact CB-CG2 4.4Å; D674-V724 WeakPolarHBondContact O-CG2 3.42Å; D674-V724 PolarHBondContact O-N 3.3Å; D674-I725 HydrophobicContact CB-CG1 3.99Å; D674-R728 IonicContact OD1-CZ 3.59Å; D674-R728 IonicContact OD1-NE 3.56Å; D674-R728 PolarHBondContact OD1-NE 3.03Å; D674-R728 IonicContact OD1-NH2 3.47Å; D674-R728 PolarHBondContact OD1-NH2 3.22Å; D674-R728 IonicContact OD2-NE 2.72Å
675	E	91.9	Very high	78.2	Confident	13 Å²	13	22.2 Å²	22.2	6%	0.061	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-2.5	173.4	-65.7	98.6	150.3	0	0	114.6	R671 G672 V673 V677 V718 T722 I725 G839	R671-E675 IonicContact CZ-OE1 2.74Å; R671-E675 VanDerWaalsContact CZ-OE1 3.24Å; R671-E675 IonicContact NE-OE1 3.37Å; R671-E675 PolarHBondContact NE-OE1 2.95Å; R671-E675 IonicContact NE-OE2 3.16Å; R671-E675 IonicContact NH2-OE1 2.61Å; R671-E675 PolarHBondContact NH2-OE1 2.78Å; G672-E675 WeakPolarHBondContact CA-OE2 3.47Å; G672-E675 PolarHBondContact N-OE2 3.31Å; G672-E675 PolarHBondContact O-N 2.84Å; V673-E675 VanDerWaalsContact C-N 3.27Å; V673-E675 PolarHBondContact O-N 2.9Å; E675-V677 HydrophobicContact CB-CG2 4.18Å; E675-V718 HydrophobicContact CG-CG1 4.31Å; E675-T722 HydrophobicContact CB-CG2 4.39Å; E675-T722 HydrophobicContact CG-CG2 4.11Å; E675-I725 HydrophobicContact CG-CD1 4.21Å; E675-G839 WeakPolarHBondContact O-CA 3.47Å
676	L	91.7	Very high	75.9	Confident	1 Å²	1	22 Å²	22	1%	0.005	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.7	41.5	-174.8	-51.6	174.9	0	0	0	114.2	V645 P650 V653 G672 V673 D674 S678 V724 L806 Q840 Y843	V645-L676 HydrophobicContact CG1-CB 4.45Å; V645-L676 HydrophobicContact CG2-CD2 4.4Å; P650-L676 HydrophobicContact CB-CD2 4.37Å; V653-L676 HydrophobicContact CB-CD2 4.31Å; V653-L676 HydrophobicContact CG2-CD2 4.04Å; G672-L676 PolarHBondContact O-N 2.9Å; V673-L676 PolarHBondContact O-N 3.35Å; V673-L676 VanDerWaalsContact O-N 3.08Å; D674-L676 VanDerWaalsContact C-N 3.31Å; L676-S678 PolarHBondContact O-N 3.16Å; L676-V724 HydrophobicContact CD2-CG1 4.22Å; L676-L806 HydrophobicContact CD1-CD1 4.19Å; L676-L806 HydrophobicContact CD1-CD2 3.67Å; L676-L806 HydrophobicContact CD2-CD2 4.12Å; L676-Q840 HydrophobicContact CB-CB 4.08Å; L676-Q840 PolarHBondContact O-N 3.13Å; L676-Y843 HydrophobicContact CD1-CD2 4.26Å; L676-Y843 HydrophobicContact CD1-CG 4.33Å
677	V	87.5	Confident	73.6	Confident	5 Å²	5	24.3 Å²	24.3	3%	0.03	13%	0.132	C	C	.	.			trans	-74.7	114.9	172.4	-177.8	0	0	0	0	109.6	S643 G672 E675 V681 V837	S643-V677 WeakPolarHBondContact CB-O 3.45Å; S643-V677 PolarHBondContact OG-O 2.95Å; G672-V677 VanDerWaalsContact O-CB 3.32Å; G672-V677 WeakPolarHBondContact O-CB 3.46Å; G672-V677 WeakPolarHBondContact O-CG2 3.29Å; G672-V677 PolarHBondContact O-N 2.79Å; E675-V677 HydrophobicContact CB-CG2 4.18Å; V677-V681 HydrophobicContact CG1-CG2 4.39Å; V677-V837 HydrophobicContact CB-CG1 4.44Å; V677-V837 HydrophobicContact CG1-CG1 3.85Å; V677-V837 HydrophobicContact CG2-CG1 3.7Å
678	S	75.6	Confident	71.3	Confident	36 Å²	36	29.9 Å²	29.9	25%	0.252	17%	0.166	S	C	.	.			trans	-88.8	-24.9	-179.2	58.3	0	0	0	0	114.4	K646 L676 Q840	K646-S678 VanDerWaalsContact CB-O 3.31Å; K646-S678 WeakPolarHBondContact CB-O 3.34Å; L676-S678 PolarHBondContact O-N 3.16Å; S678-Q840 PolarHBondContact OG-NE2 3Å
679	E	66	Low	69.3	Low	86 Å²	86	34.3 Å²	34.3	40%	0.402	19%	0.186	S	C	.	.	S	Bend	trans	-66.5	149.2	170.7	-59.3	-170.9	150	0	0	108.9	V681 K692	E679-V681 PolarHBondContact O-N 3.25Å; E679-K692 IonicContact OE2-NZ 3.43Å; E679-K692 PolarHBondContact OE2-NZ 2.8Å
680	K	55	Low	67.5	Low	43 Å²	43	45.6 Å²	45.6	19%	0.187	23%	0.229	C	C	.	.			trans	-60.9	129	165.4	-61	-166.8	178	-171.7	0	106.5	I682 F683	K680-I682 HydrophobicContact CB-CG2 3.91Å; K680-I682 HydrophobicContact CD-CG2 3.95Å; K680-I682 PolarHBondContact O-N 3.3Å; K680-I682 VanDerWaalsContact O-N 3.11Å; K680-F683 HydrophobicContact CB-CD2 3.53Å; K680-F683 HydrophobicContact CB-CE2 4.07Å; K680-F683 HydrophobicContact CB-CG 4.24Å; K680-F683 HydrophobicContact CD-CD2 4.03Å; K680-F683 HydrophobicContact CD-CE2 3.7Å; K680-F683 HydrophobicContact CD-CZ 4.36Å; K680-F683 HydrophobicContact CG-CD2 3.72Å; K680-F683 HydrophobicContact CG-CE2 3.73Å; K680-F683 WeakPolarHBondContact O-CB 3.27Å; K680-F683 PolarHBondContact O-N 3.08Å
681	V	53.1	Low	66.2	Low	12 Å²	12	46.5 Å²	46.5	7%	0.073	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-57.7	-29.1	175.4	-178.9	0	0	0	0	110.7	Y142 L145 V677 E679 F683 C684 Y694	Y142-V681 HydrophobicContact CD2-CG1 3.91Å; Y142-V681 HydrophobicContact CE2-CB 4.4Å; Y142-V681 HydrophobicContact CE2-CG1 4.25Å; L145-V681 HydrophobicContact CD1-CG1 3.46Å; L145-V681 VanDerWaalsContact CD1-CG1 3.46Å; V677-V681 HydrophobicContact CG1-CG2 4.39Å; E679-V681 PolarHBondContact O-N 3.25Å; V681-F683 VanDerWaalsContact C-N 3.31Å; V681-F683 PolarHBondContact O-N 2.82Å; V681-C684 VanDerWaalsContact O-CB 3.25Å; V681-C684 WeakPolarHBondContact O-CB 3.4Å; V681-C684 PolarHBondContact O-N 2.93Å; V681-Y694 HydrophobicContact CG1-CE1 4.16Å; V681-Y694 WeakPolarHBondContact CG1-OH 3.35Å
682	I	49.2	Very low	65.4	Low	42 Å²	42	49.6 Å²	49.6	22%	0.215	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-65	-25.3	172.9	-139.8	171.6	0	0	0	114	W182 K680 C684 I685	W182-I682 HydrophobicContact CZ3-CD1 4.31Å; K680-I682 HydrophobicContact CB-CG2 3.91Å; K680-I682 HydrophobicContact CD-CG2 3.95Å; K680-I682 PolarHBondContact O-N 3.3Å; K680-I682 VanDerWaalsContact O-N 3.11Å; I682-C684 PolarHBondContact O-N 2.99Å; I682-I685 HydrophobicContact CG1-CD1 4.13Å; I682-I685 WeakPolarHBondContact O-CA 3.38Å; I682-I685 VanDerWaalsContact O-CB 3.27Å; I682-I685 WeakPolarHBondContact O-CB 3.25Å; I682-I685 PolarHBondContact O-N 2.93Å
683	F	46.1	Very low	65.1	Low	128 Å²	128	51.5 Å²	51.5	56%	0.561	26%	0.256	S	S	*	.	G	3₁₀ helix	trans	-74.8	-3.1	172.8	-73.4	-54.1	0	0	0	113	K680 V681 I685	K680-F683 HydrophobicContact CB-CD2 3.53Å; K680-F683 HydrophobicContact CB-CE2 4.07Å; K680-F683 HydrophobicContact CB-CG 4.24Å; K680-F683 HydrophobicContact CD-CD2 4.03Å; K680-F683 HydrophobicContact CD-CE2 3.7Å; K680-F683 HydrophobicContact CD-CZ 4.36Å; K680-F683 HydrophobicContact CG-CD2 3.72Å; K680-F683 HydrophobicContact CG-CE2 3.73Å; K680-F683 WeakPolarHBondContact O-CB 3.27Å; K680-F683 PolarHBondContact O-N 3.08Å; V681-F683 VanDerWaalsContact C-N 3.31Å; V681-F683 PolarHBondContact O-N 2.82Å; F683-I685 PolarHBondContact O-N 3.16Å
684	C	44.1	Very low	65	Low	10 Å²	10	51.6 Å²	51.6	7%	0.068	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-81.4	7.2	162.6	-57.2	0	0	0	0	112.4	V681 I682 H691 K692	V681-C684 VanDerWaalsContact O-CB 3.25Å; V681-C684 WeakPolarHBondContact O-CB 3.4Å; V681-C684 PolarHBondContact O-N 2.93Å; I682-C684 PolarHBondContact O-N 2.99Å; C684-H691 WeakPolarHBondContact O-CA 3.27Å; C684-H691 PolarHBondContact O-ND1 3.22Å; C684-K692 HydrophobicContact CB-CB 4.07Å
685	I	46.2	Very low	64.7	Low	25 Å²	25	52 Å²	52	13%	0.128	26%	0.258	C	S	.	.			trans	-119.2	59.3	175.9	-50.6	172.1	0	0	0	108.1	Y142 L145 I682 F683	Y142-I685 HydrophobicContact CD1-CD1 4.44Å; L145-I685 HydrophobicContact CD2-CG1 4.31Å; I682-I685 HydrophobicContact CG1-CD1 4.13Å; I682-I685 WeakPolarHBondContact O-CA 3.38Å; I682-I685 VanDerWaalsContact O-CB 3.27Å; I682-I685 WeakPolarHBondContact O-CB 3.25Å; I682-I685 PolarHBondContact O-N 2.93Å; F683-I685 PolarHBondContact O-N 3.16Å
686	D	43.4	Very low	64.6	Low	43 Å²	43	52.1 Å²	52.1	23%	0.23	26%	0.261	C	S	.	.			trans	-74.3	125.9	160.1	-167.6	-40.6	0	0	0	107.5	T688 E689	D686-T688 PolarHBondContact O-N 2.8Å; D686-T688 PolarHBondContact OD1-N 2.96Å; D686-T688 PolarHBondContact OD1-OG1 2.92Å; D686-E689 HydrophobicContact CB-CB 4.4Å; D686-E689 PolarHBondContact O-N 2.95Å; D686-E689 VanDerWaalsContact O-N 3.16Å
687	A	46.5	Very low	64.3	Low	61 Å²	61	53.1 Å²	53.1	50%	0.504	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-12.9	-176.6	0	0	0	0	0	113.4
688	T	47.3	Very low	64	Low	117 Å²	117	54.8 Å²	54.8	72%	0.718	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.7	-16	179	58	0	0	0	0	115.2	D686	D686-T688 PolarHBondContact O-N 2.8Å; D686-T688 PolarHBondContact OD1-N 2.96Å; D686-T688 PolarHBondContact OD1-OG1 2.92Å
689	E	53.2	Low	63.5	Low	93 Å²	93	59.2 Å²	59.2	44%	0.435	29%	0.29	S	S	.	.	S	Bend	trans	-110.8	168.3	-176.3	-69	176.9	-176.9	0	0	111.9	D686	D686-E689 HydrophobicContact CB-CB 4.4Å; D686-E689 PolarHBondContact O-N 2.95Å; D686-E689 VanDerWaalsContact O-N 3.16Å
690	R	57.7	Low	62.9	Low	237 Å²	237	56.8 Å²	56.8	89%	0.894	29%	0.288	S	S	*	.	P	Polyproline II helix	trans	-78.5	136.4	171.2	-78	-175.7	175.4	176.8	-0.8	109.1	K692	R690-K692 PolarHBondContact O-N 3.16Å
691	H	65.8	Low	62.4	Low	22 Å²	22	57.7 Å²	57.7	10%	0.102	30%	0.304	C	S	.	.	P	Polyproline II helix	trans	-53	133.1	173.9	-64.7	-47.4	0	0	0	112.4	N144 L145 C684 L693	N144-H691 PolarHBondContact ND2-NE2 3.5Å; L145-H691 HydrophobicContact CD2-CB 3.69Å; C684-H691 WeakPolarHBondContact O-CA 3.27Å; C684-H691 PolarHBondContact O-ND1 3.22Å; H691-L693 PolarHBondContact O-N 3.28Å
692	K	76.6	Confident	61.6	Low	65 Å²	65	65.1 Å²	65.1	28%	0.283	34%	0.343	S	S	.	.	P	Polyproline II helix	trans	-67.3	127.9	161.5	-66.5	-178.5	-172.4	168.4	0	108.6	E679 C684 R690 V835 V837	E679-K692 IonicContact OE2-NZ 3.43Å; E679-K692 PolarHBondContact OE2-NZ 2.8Å; C684-K692 HydrophobicContact CB-CB 4.07Å; R690-K692 PolarHBondContact O-N 3.16Å; K692-V835 CarbonylContact C-O 3.44Å; K692-V835 VanDerWaalsContact CA-O 3.31Å; K692-V835 WeakPolarHBondContact CA-O 3.4Å; K692-V837 HydrophobicContact CB-CG2 3.62Å
693	L	84.4	Confident	61.1	Low	41 Å²	41	66.5 Å²	66.5	22%	0.215	37%	0.368	C	S	.	.	B	Isolated β-bridge	trans	-83.8	151.2	180	-59.8	-179.9	0	0	0	111.4	L145 H691 V835 Y836 V837	L145-L693 CarbonylContact O-C 3.59Å; L145-L693 WeakPolarHBondContact O-CA 3.49Å; H691-L693 PolarHBondContact O-N 3.28Å; L693-V835 PolarHBondContact N-O 2.69Å; L693-Y836 HydrophobicContact CB-CD1 3.9Å; L693-Y836 HydrophobicContact CB-CE1 4.09Å; L693-Y836 CarbonylContact O-C 3.54Å; L693-Y836 WeakPolarHBondContact O-CA 3.44Å; L693-V837 PolarHBondContact O-N 3.01Å
694	Y	89.2	Confident	60.4	Low	4 Å²	4	65.8 Å²	65.8	2%	0.016	37%	0.374	C	S	.	.	P	Polyproline II helix	trans	-63.3	147.5	166.7	-69.1	-59.6	0	0	0	111	V141 L145 L146 Q155 R671 V681	V141-Y694 HydrophobicContact CG1-CD2 3.96Å; V141-Y694 HydrophobicContact CG1-CE2 3.44Å; V141-Y694 VanDerWaalsContact CG1-CE2 3.44Å; L145-Y694 HydrophobicContact CB-CD2 3.69Å; L145-Y694 HydrophobicContact CB-CE2 3.48Å; L145-Y694 VanDerWaalsContact CB-CE2 3.48Å; L145-Y694 HydrophobicContact CB-CG 4.41Å; L145-Y694 HydrophobicContact CD1-CE2 4.29Å; L145-Y694 HydrophobicContact CG-CE2 4.41Å; L145-Y694 PolarHBondContact O-N 3.13Å; L146-Y694 HydrophobicContact CD2-CD2 4.29Å; Q155-Y694 PolarHBondContact NE2-O 3.02Å; Q155-Y694 PolarHBondContact OE1-O 2.75Å; R671-Y694 HydrophobicContact CB-CD1 4.4Å; R671-Y694 HydrophobicContact CB-CE1 3.76Å; R671-Y694 HydrophobicContact CB-CE2 4.34Å; R671-Y694 HydrophobicContact CG-CD1 3.56Å; R671-Y694 HydrophobicContact CG-CD2 4.29Å; R671-Y694 HydrophobicContact CG-CE1 3.41Å; R671-Y694 VanDerWaalsContact CG-CE1 3.41Å; R671-Y694 HydrophobicContact CG-CE2 4.16Å; R671-Y694 HydrophobicContact CG-CG 4.01Å; V681-Y694 HydrophobicContact CG1-CE1 4.16Å; V681-Y694 WeakPolarHBondContact CG1-OH 3.35Å
695	C	88.5	Confident	59.6	Low	7 Å²	7	73.8 Å²	73.8	5%	0.047	41%	0.41	C	S	.	.	P	Polyproline II helix	trans	-71.5	137	169.2	-67.8	0	0	0	0	111.3	Q155 R671 G716 V718	Q155-C695 PolarHBondContact OE1-O 3.48Å; Q155-C695 VanDerWaalsContact OE1-O 3.08Å; R671-C695 PolarHBondContact NH2-O 3.27Å; C695-G716 CarbonylContact C-O 3.57Å; C695-G716 VanDerWaalsContact CA-O 3.24Å; C695-G716 WeakPolarHBondContact CA-O 3.14Å; C695-V718 HydrophobicContact CB-CB 4.31Å; C695-V718 HydrophobicContact CB-CG1 3.53Å; C695-V718 HydrophobicContact CB-CG2 4.09Å
696	S	88.5	Confident	59	Low	16 Å²	16	76 Å²	76	11%	0.112	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	161.6	175.5	-76	0	0	0	0	112.5	Q155 G716 Y717 V718	Q155-S696 PolarHBondContact NE2-OG 2.84Å; S696-G716 PolarHBondContact N-O 3.05Å; S696-Y717 CarbonylContact O-C 3.58Å; S696-Y717 VanDerWaalsContact O-CA 3.27Å; S696-Y717 WeakPolarHBondContact O-CA 3.33Å; S696-V718 PolarHBondContact O-N 2.97Å
697	W	87.4	Confident	58.3	Low	23 Å²	23	80.2 Å²	80.2	9%	0.087	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	138.1	174.7	-170.6	-102.9	0	0	0	111.9	K154 A157 V158 N161 A720 I725	K154-W697 PolarHBondContact O-N 3.4Å; A157-W697 HydrophobicContact CB-CB 3.77Å; A157-W697 HydrophobicContact CB-CG 4.28Å; V158-W697 HydrophobicContact CB-CE3 4.17Å; V158-W697 HydrophobicContact CG1-CE3 4.06Å; V158-W697 HydrophobicContact CG1-CZ3 4.41Å; V158-W697 HydrophobicContact CG2-CB 3.74Å; V158-W697 HydrophobicContact CG2-CE3 4.07Å; V158-W697 VanDerWaalsContact CG2-N 3.31Å; N161-W697 HydrophobicContact CB-CD2 3.94Å; N161-W697 HydrophobicContact CB-CE3 4Å; N161-W697 HydrophobicContact CB-CH2 3.5Å; N161-W697 HydrophobicContact CB-CZ2 3.46Å; N161-W697 VanDerWaalsContact CB-CZ2 3.46Å; N161-W697 HydrophobicContact CB-CZ3 3.79Å; N161-W697 PolarHBondContact ND2-NE1 2.92Å; W697-A720 HydrophobicContact CH2-CB 4.12Å; W697-A720 VanDerWaalsContact CH2-N 3.35Å; W697-I725 HydrophobicContact CH2-CG2 4.46Å; W697-I725 HydrophobicContact CZ3-CG2 4.17Å
698	N	80.8	Confident	57.9	Low	39 Å²	39	81.9 Å²	81.9	21%	0.209	44%	0.44	C	S	.	.			trans	-86.6	110.4	171.9	-170.9	-4.9	0	0	0	111.4	G700 Y717 V718	N698-G700 PolarHBondContact O-N 3.41Å; N698-G700 PolarHBondContact OD1-N 3.46Å; N698-Y717 HydrophobicContact CB-CD1 4.39Å; N698-V718 PolarHBondContact N-O 3.13Å
699	E	64.1	Low	57.4	Low	130 Å²	130	80 Å²	80	61%	0.607	43%	0.428	S	S	*	.	G	3₁₀ helix	trans	-66.2	-18.3	178.6	-68.8	168.5	-158.6	0	0	113.5	K154 A701	K154-E699 WeakPolarHBondContact CE-OE1 3.17Å; K154-E699 IonicContact NZ-OE1 3.78Å; E699-A701 PolarHBondContact O-N 3.35Å
700	G	53.2	Low	56.9	Low	35 Å²	35	80.1 Å²	80.1	36%	0.361	45%	0.446	S	S	.	.	G	3₁₀ helix	trans	-65.2	-5.4	-176.3	0	0	0	0	0	116.3	N698 N702	N698-G700 PolarHBondContact O-N 3.41Å; N698-G700 PolarHBondContact OD1-N 3.46Å; G700-N702 VanDerWaalsContact C-N 3.26Å; G700-N702 PolarHBondContact O-N 3.44Å
701	A	44.6	Very low	55.9	Low	62 Å²	62	77.1 Å²	77.1	51%	0.512	44%	0.442	S	S	.	.	G	3₁₀ helix	trans	-71.5	-11.9	-178.8	0	0	0	0	0	114.9	E699 G703	E699-A701 PolarHBondContact O-N 3.35Å; A701-G703 PolarHBondContact O-N 2.59Å
702	N	37.9	Very low	54.6	Low	167 Å²	167	79.9 Å²	79.9	89%	0.893	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.3	34.4	-173.9	-79.8	-5.1	0	0	0	115.3	G700	G700-N702 VanDerWaalsContact C-N 3.26Å; G700-N702 PolarHBondContact O-N 3.44Å
703	G	38.7	Very low	53.2	Low	72 Å²	72	82.6 Å²	82.6	74%	0.742	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	131	-0.1	161.5	0	0	0	0	0	117.9	A701	A701-G703 PolarHBondContact O-N 2.59Å
704	V	29.5	Very low	51.6	Low	113 Å²	113	84.7 Å²	84.7	69%	0.685	49%	0.488	S	S	*	.			trans	-97.9	120.6	170.2	-178.2	0	0	0	0	109.1	V706	V704-V706 VanDerWaalsContact C-N 3.31Å; V704-V706 PolarHBondContact O-N 3.32Å
705	Q	28.4	Very low	50.5	Low	178 Å²	178	88.1 Å²	88.1	83%	0.832	52%	0.517	S	S	*	.			trans	-67.7	89.3	170.2	-81.6	-174.1	-26.6	0	0	110.1	N707	Q705-N707 PolarHBondContact O-N 3.32Å
706	V	32.7	Very low	50	Low	71 Å²	71	88 Å²	88	43%	0.43	52%	0.517	S	S	.	.			trans	-70.3	115	156	-178.1	0	0	0	0	106.6	V704 W708	V704-V706 VanDerWaalsContact C-N 3.31Å; V704-V706 PolarHBondContact O-N 3.32Å; V706-W708 PolarHBondContact O-N 2.91Å; V706-W708 VanDerWaalsContact O-N 3.11Å
707	N	30.5	Very low	49.9	Very low	132 Å²	132	92.2 Å²	92.2	71%	0.706	53%	0.531	S	S	*	.			trans	-73.7	101.3	172.1	-85.3	-24	0	0	0	109	Q705 T709	Q705-N707 PolarHBondContact O-N 3.32Å; N707-T709 PolarHBondContact O-N 2.98Å
708	W	37.9	Very low	49.9	Very low	96 Å²	96	91.7 Å²	91.7	36%	0.364	53%	0.53	S	S	.	.			trans	-78.8	97.4	177.4	-69.8	83.6	0	0	0	110.6	V706 N712	V706-W708 PolarHBondContact O-N 2.91Å; V706-W708 VanDerWaalsContact O-N 3.11Å; W708-N712 WeakPolarHBondContact CZ3-O 3.4Å
709	T	35.6	Very low	50.2	Low	76 Å²	76	91 Å²	91	47%	0.466	53%	0.527	S	S	.	.			trans	-77.2	163.3	153.3	55.8	0	0	0	0	109.4	N707 E711 N712	N707-T709 PolarHBondContact O-N 2.98Å; T709-E711 PolarHBondContact O-N 3.29Å; T709-N712 PolarHBondContact O-N 3.25Å; T709-N712 VanDerWaalsContact O-N 3.11Å
710	A	42.8	Very low	51.3	Low	96 Å²	96	86 Å²	86	79%	0.793	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-12.1	177.9	0	0	0	0	0	114.1
711	E	37.9	Very low	52.8	Low	174 Å²	174	92.1 Å²	92.1	81%	0.813	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.8	-15.6	180	-64.4	167.5	161.7	0	0	112.8	T709 H713	T709-E711 PolarHBondContact O-N 3.29Å; E711-H713 PolarHBondContact O-N 3.01Å
712	N	38.7	Very low	55	Low	80 Å²	80	90.8 Å²	90.8	43%	0.428	51%	0.51	S	S	.	.			trans	-96.5	24.5	-172.5	-82.2	-15.9	0	0	0	114.9	W708 T709 C714	W708-N712 WeakPolarHBondContact CZ3-O 3.4Å; T709-N712 PolarHBondContact O-N 3.25Å; T709-N712 VanDerWaalsContact O-N 3.11Å; N712-C714 VanDerWaalsContact C-N 3.32Å; N712-C714 PolarHBondContact O-N 3.38Å
713	H	46.2	Very low	57.5	Low	123 Å²	123	83.4 Å²	83.4	57%	0.569	47%	0.473	S	S	*	.			trans	-67.1	88.6	166.9	-86.5	-65.3	0	0	0	110.9	E711 A715	E711-H713 PolarHBondContact O-N 3.01Å; H713-A715 PolarHBondContact O-N 3.22Å
714	C	51.3	Low	60.1	Low	84 Å²	84	80 Å²	80	57%	0.568	44%	0.438	S	S	*	.			trans	-56.6	110.3	168.1	-80.5	0	0	0	0	109.9	N712 G716 Y717	N712-C714 VanDerWaalsContact C-N 3.32Å; N712-C714 PolarHBondContact O-N 3.38Å; C714-G716 PolarHBondContact O-N 3.47Å; C714-Y717 HydrophobicContact CB-CD2 4.28Å; C714-Y717 PolarHBondContact O-N 2.95Å
715	A	65.5	Low	63.1	Low	77 Å²	77	74.7 Å²	74.7	64%	0.636	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	134.2	179.5	0	0	0	0	0	111.2	H713	H713-A715 PolarHBondContact O-N 3.22Å
716	G	78.5	Confident	66.1	Low	4 Å²	4	71.8 Å²	71.8	4%	0.041	39%	0.387	C	S	.	.	T	Hydrogen-bonded Turn	trans	87.3	8.9	177.8	0	0	0	0	0	116.6	C695 S696 C714	C695-G716 CarbonylContact C-O 3.57Å; C695-G716 VanDerWaalsContact CA-O 3.24Å; C695-G716 WeakPolarHBondContact CA-O 3.14Å; S696-G716 PolarHBondContact N-O 3.05Å; C714-G716 PolarHBondContact O-N 3.47Å
717	Y	85.2	Confident	68.9	Low	104 Å²	104	68.4 Å²	68.4	41%	0.408	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	148	176.5	-69.2	-86.5	0	0	0	113.7	S696 N698 C714	S696-Y717 CarbonylContact O-C 3.58Å; S696-Y717 VanDerWaalsContact O-CA 3.27Å; S696-Y717 WeakPolarHBondContact O-CA 3.33Å; N698-Y717 HydrophobicContact CB-CD1 4.39Å; C714-Y717 HydrophobicContact CB-CD2 4.28Å; C714-Y717 PolarHBondContact O-N 2.95Å
718	V	88.5	Confident	71.9	Confident	12 Å²	12	62.2 Å²	62.2	7%	0.073	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	156.9	172.3	-68.9	0	0	0	0	111.2	V158 E675 C695 S696 N698 T722	V158-V718 HydrophobicContact CB-CG2 4.37Å; V158-V718 HydrophobicContact CG1-CG2 3.75Å; V158-V718 HydrophobicContact CG2-CG2 3.64Å; E675-V718 HydrophobicContact CG-CG1 4.31Å; C695-V718 HydrophobicContact CB-CB 4.31Å; C695-V718 HydrophobicContact CB-CG1 3.53Å; C695-V718 HydrophobicContact CB-CG2 4.09Å; S696-V718 PolarHBondContact O-N 2.97Å; N698-V718 PolarHBondContact N-O 3.13Å; V718-T722 HydrophobicContact CB-CG2 4.13Å; V718-T722 HydrophobicContact CG1-CG2 3.67Å
719	D	86.5	Confident	74.5	Confident	25 Å²	25	59 Å²	59	13%	0.134	32%	0.322	C	S	.	.			trans	-139.9	-175.9	-179.5	75.2	-4.6	0	0	0	110.9	K721 T722	D719-K721 PolarHBondContact O-N 2.67Å; D719-K721 WeakPolarHBondContact OD1-CA 3.45Å; D719-K721 WeakPolarHBondContact OD1-CB 3.49Å; D719-K721 PolarHBondContact OD1-N 2.74Å; D719-T722 PolarHBondContact N-OG1 3.05Å; D719-T722 VanDerWaalsContact N-OG1 3.16Å; D719-T722 WeakPolarHBondContact O-CB 3.46Å; D719-T722 PolarHBondContact O-N 3.4Å; D719-T722 VanDerWaalsContact O-N 3.13Å; D719-T722 PolarHBondContact O-OG1 3.3Å; D719-T722 PolarHBondContact OD1-N 2.88Å; D719-T722 VanDerWaalsContact OD1-N 3.15Å; D719-T722 PolarHBondContact OD1-OG1 2.79Å; D719-T722 VanDerWaalsContact OD1-OG1 3.12Å
720	A	86.6	Confident	77.1	Confident	24 Å²	24	55.6 Å²	55.6	20%	0.198	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-23.4	179	0	0	0	0	0	114.1	W697 T722 R726	W697-A720 HydrophobicContact CH2-CB 4.12Å; W697-A720 VanDerWaalsContact CH2-N 3.35Å; A720-T722 VanDerWaalsContact C-N 3.32Å; A720-R726 HydrophobicContact CB-CB 4.37Å; A720-R726 WeakPolarHBondContact O-CB 3.31Å; A720-R726 PolarHBondContact O-N 3.23Å; A720-R726 VanDerWaalsContact O-N 3.11Å
721	K	85.5	Confident	79.5	Confident	165 Å²	165	51 Å²	51	72%	0.717	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-8.7	179.6	-61.4	179	179.5	177.3	0	112.9	D719 G723	D719-K721 PolarHBondContact O-N 2.67Å; D719-K721 WeakPolarHBondContact OD1-CA 3.45Å; D719-K721 WeakPolarHBondContact OD1-CB 3.49Å; D719-K721 PolarHBondContact OD1-N 2.74Å; K721-G723 PolarHBondContact O-N 3.31Å
722	T	90.1	Very high	82.1	Confident	34 Å²	34	42.9 Å²	42.9	21%	0.209	23%	0.226	C	C	.	.	S	Bend	trans	-73.9	125.6	179.6	-54.2	0	0	0	0	110.2	E675 V718 D719 A720 V724 I725	E675-T722 HydrophobicContact CB-CG2 4.39Å; E675-T722 HydrophobicContact CG-CG2 4.11Å; V718-T722 HydrophobicContact CB-CG2 4.13Å; V718-T722 HydrophobicContact CG1-CG2 3.67Å; D719-T722 PolarHBondContact N-OG1 3.05Å; D719-T722 VanDerWaalsContact N-OG1 3.16Å; D719-T722 WeakPolarHBondContact O-CB 3.46Å; D719-T722 PolarHBondContact O-N 3.4Å; D719-T722 VanDerWaalsContact O-N 3.13Å; D719-T722 PolarHBondContact O-OG1 3.3Å; D719-T722 PolarHBondContact OD1-N 2.88Å; D719-T722 VanDerWaalsContact OD1-N 3.15Å; D719-T722 PolarHBondContact OD1-OG1 2.79Å; D719-T722 VanDerWaalsContact OD1-OG1 3.12Å; A720-T722 VanDerWaalsContact C-N 3.32Å; T722-V724 PolarHBondContact O-N 3.33Å; T722-I725 WeakPolarHBondContact O-CB 3.36Å; T722-I725 WeakPolarHBondContact O-CG1 3.33Å; T722-I725 PolarHBondContact O-N 3.37Å
723	G	91	Very high	84.5	Confident	12 Å²	12	44.9 Å²	44.9	12%	0.124	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.9	-122.5	176.5	0	0	0	0	0	113	D674 K721	D674-G723 WeakPolarHBondContact O-CA 3.23Å; K721-G723 PolarHBondContact O-N 3.31Å
724	V	93.3	Very high	86.6	Confident	1 Å²	1	39.5 Å²	39.5	1%	0.006	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.2	13.6	175.5	-63.9	0	0	0	0	113.3	V653 L654 D674 L676 T722 R726 G727 R728 L806	V653-V724 HydrophobicContact CG1-CG2 3.9Å; L654-V724 HydrophobicContact CB-CG1 4.2Å; D674-V724 HydrophobicContact CB-CG2 4.4Å; D674-V724 WeakPolarHBondContact O-CG2 3.42Å; D674-V724 PolarHBondContact O-N 3.3Å; L676-V724 HydrophobicContact CD2-CG1 4.22Å; T722-V724 PolarHBondContact O-N 3.33Å; V724-R726 PolarHBondContact O-N 3.27Å; V724-G727 CarbonylContact O-C 3.47Å; V724-G727 VanDerWaalsContact O-CA 3.26Å; V724-G727 WeakPolarHBondContact O-CA 3.49Å; V724-G727 PolarHBondContact O-N 2.82Å; V724-R728 PolarHBondContact O-N 3.34Å; V724-L806 HydrophobicContact CG1-CD1 3.93Å; V724-L806 HydrophobicContact CG1-CD2 4.31Å
725	I	93.4	Very high	88.6	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-52.3	-49.3	-173.7	-72	-178.9	0	0	0	112.7	V158 D674 E675 W697 T722 G727 R728 Q729	V158-I725 HydrophobicContact CG1-CD1 4.02Å; D674-I725 HydrophobicContact CB-CG1 3.99Å; E675-I725 HydrophobicContact CG-CD1 4.21Å; W697-I725 HydrophobicContact CH2-CG2 4.46Å; W697-I725 HydrophobicContact CZ3-CG2 4.17Å; T722-I725 WeakPolarHBondContact O-CB 3.36Å; T722-I725 WeakPolarHBondContact O-CG1 3.33Å; T722-I725 PolarHBondContact O-N 3.37Å; I725-G727 VanDerWaalsContact C-N 3.26Å; I725-G727 PolarHBondContact O-N 2.87Å; I725-R728 WeakPolarHBondContact O-CB 3.47Å; I725-R728 PolarHBondContact O-N 3.25Å; I725-R728 VanDerWaalsContact O-N 3.15Å; I725-Q729 WeakPolarHBondContact O-CG 3.36Å; I725-Q729 PolarHBondContact O-N 3.49Å
726	R	90.3	Very high	89.6	Confident	118 Å²	118	32.9 Å²	32.9	45%	0.445	16%	0.155	S	C	.	.	H	α-helix	trans	-63	-32.1	175.3	-172.1	-170.6	179.5	118	9.3	113	A720 V724 Q729 A730 L845 L847 E849	A720-R726 HydrophobicContact CB-CB 4.37Å; A720-R726 WeakPolarHBondContact O-CB 3.31Å; A720-R726 PolarHBondContact O-N 3.23Å; A720-R726 VanDerWaalsContact O-N 3.11Å; V724-R726 PolarHBondContact O-N 3.27Å; R726-Q729 WeakPolarHBondContact O-CB 3.09Å; R726-Q729 PolarHBondContact O-N 3.34Å; R726-A730 PolarHBondContact O-N 2.72Å; R726-L845 HydrophobicContact CB-CD2 4.03Å; R726-L847 HydrophobicContact CG-CD2 3.72Å; R726-E849 IonicContact CZ-OE1 3.44Å; R726-E849 IonicContact NE-OE1 2.69Å; R726-E849 IonicContact NH2-OE1 3.34Å; R726-E849 PolarHBondContact NH2-OE1 3.2Å
727	G	91.6	Very high	90	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-65.6	-46	172.5	0	0	0	0	0	110.7	V724 I725 Q729 A730 V731	V724-G727 CarbonylContact O-C 3.47Å; V724-G727 VanDerWaalsContact O-CA 3.26Å; V724-G727 WeakPolarHBondContact O-CA 3.49Å; V724-G727 PolarHBondContact O-N 2.82Å; I725-G727 VanDerWaalsContact C-N 3.26Å; I725-G727 PolarHBondContact O-N 2.87Å; G727-Q729 VanDerWaalsContact C-N 3.29Å; G727-Q729 PolarHBondContact O-N 3.42Å; G727-A730 PolarHBondContact O-N 2.89Å; G727-A730 VanDerWaalsContact O-N 3.07Å; G727-V731 WeakPolarHBondContact O-CG2 3.3Å; G727-V731 PolarHBondContact O-N 3.23Å
728	R	94.1	Very high	90.2	Very high	1 Å²	1	31.6 Å²	31.6	0%	0.004	15%	0.15	C	C	.	.	H	α-helix	trans	-59.2	-38	174.5	-173.3	65.2	66.8	156.6	12.6	112.2	S162 Y164 D636 A657 S669 D674 V724 I725 A730 V731 N732	S162-R728 CarbonylContact O-C 3.54Å; Y164-R728 HydrophobicContact CE1-CG 4.38Å; Y164-R728 HydrophobicContact CE2-CG 3.78Å; Y164-R728 VanDerWaalsContact OH-CD 3.23Å; Y164-R728 WeakPolarHBondContact OH-CD 3.47Å; Y164-R728 WeakPolarHBondContact OH-CG 3.45Å; Y164-R728 VanDerWaalsContact OH-CZ 3.28Å; Y164-R728 PolarHBondContact OH-NE 3.37Å; Y164-R728 VanDerWaalsContact OH-NE 3.1Å; D636-R728 IonicContact OD2-CZ 2.76Å; D636-R728 VanDerWaalsContact OD2-CZ 3.26Å; D636-R728 IonicContact OD2-NH1 3.52Å; D636-R728 PolarHBondContact OD2-NH1 3.13Å; D636-R728 IonicContact OD2-NH2 2.62Å; D636-R728 PolarHBondContact OD2-NH2 3.31Å; A657-R728 VanDerWaalsContact CB-NH1 3.29Å; S669-R728 PolarHBondContact OG-NH2 3.12Å; D674-R728 IonicContact OD1-CZ 3.59Å; D674-R728 IonicContact OD1-NE 3.56Å; D674-R728 PolarHBondContact OD1-NE 3.03Å; D674-R728 IonicContact OD1-NH2 3.47Å; D674-R728 PolarHBondContact OD1-NH2 3.22Å; D674-R728 IonicContact OD2-NE 2.72Å; V724-R728 PolarHBondContact O-N 3.34Å; I725-R728 WeakPolarHBondContact O-CB 3.47Å; I725-R728 PolarHBondContact O-N 3.25Å; I725-R728 VanDerWaalsContact O-N 3.15Å; R728-A730 PolarHBondContact O-N 2.82Å; R728-V731 PolarHBondContact O-N 3.31Å; R728-N732 VanDerWaalsContact O-CB 3.26Å; R728-N732 WeakPolarHBondContact O-CB 3.28Å; R728-N732 PolarHBondContact O-N 3.24Å; R728-N732 PolarHBondContact O-ND2 3.15Å
729	Q	91.5	Very high	90.1	Very high	28 Å²	28	31.6 Å²	31.6	13%	0.131	15%	0.151	C	C	.	.	H	α-helix	trans	-56.5	-48.6	171.4	-69.2	172.6	-6.4	0	0	112	N161 S162 I725 R726 G727 N732 R733	N161-Q729 VanDerWaalsContact O-CD 3.3Å; N161-Q729 WeakPolarHBondContact O-CG 3.39Å; N161-Q729 PolarHBondContact O-NE2 3.41Å; S162-Q729 WeakPolarHBondContact O-CA 3.27Å; S162-Q729 PolarHBondContact O-N 3.44Å; I725-Q729 WeakPolarHBondContact O-CG 3.36Å; I725-Q729 PolarHBondContact O-N 3.49Å; R726-Q729 WeakPolarHBondContact O-CB 3.09Å; R726-Q729 PolarHBondContact O-N 3.34Å; G727-Q729 VanDerWaalsContact C-N 3.29Å; G727-Q729 PolarHBondContact O-N 3.42Å; Q729-N732 PolarHBondContact O-N 2.78Å; Q729-R733 WeakPolarHBondContact O-CB 3.38Å; Q729-R733 WeakPolarHBondContact O-CG 3.24Å; Q729-R733 PolarHBondContact O-N 3.14Å
730	A	90.4	Very high	89.9	Confident	5 Å²	5	35.9 Å²	35.9	4%	0.041	17%	0.17	C	C	.	.	H	α-helix	trans	-65.6	-42.2	179	0	0	0	0	0	111.9	R726 G727 R728 R733 M734 Y802 L847	R726-A730 PolarHBondContact O-N 2.72Å; G727-A730 PolarHBondContact O-N 2.89Å; G727-A730 VanDerWaalsContact O-N 3.07Å; R728-A730 PolarHBondContact O-N 2.82Å; A730-R733 PolarHBondContact O-N 3.43Å; A730-M734 WeakPolarHBondContact O-CB 3.22Å; A730-M734 PolarHBondContact O-N 3.27Å; A730-Y802 HydrophobicContact CB-CD1 3.94Å; A730-Y802 HydrophobicContact CB-CE1 4.38Å; A730-Y802 HydrophobicContact CB-CG 4.04Å; A730-L847 HydrophobicContact CB-CD1 4.45Å; A730-L847 HydrophobicContact CB-CD2 4.17Å
731	V	93.4	Very high	89.6	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-60.8	-44.5	174.8	174.4	0	0	0	0	111.6	L654 T658 A661 G727 R728 M734 H735 Y802	L654-V731 HydrophobicContact CD1-CG2 3.76Å; T658-V731 WeakPolarHBondContact OG1-CG2 3.1Å; A661-V731 HydrophobicContact CB-CG1 3.28Å; G727-V731 WeakPolarHBondContact O-CG2 3.3Å; G727-V731 PolarHBondContact O-N 3.23Å; R728-V731 PolarHBondContact O-N 3.31Å; V731-M734 WeakPolarHBondContact O-CB 3.37Å; V731-M734 PolarHBondContact O-N 3.44Å; V731-H735 WeakPolarHBondContact O-CB 3.36Å; V731-H735 PolarHBondContact O-N 3.21Å; V731-Y802 HydrophobicContact CG2-CE2 4.37Å
732	N	93.2	Very high	89.2	Confident	4 Å²	4	32 Å²	32	2%	0.021	15%	0.154	C	C	.	.	H	α-helix	trans	-67.8	-41.7	177.5	-81.6	-26.2	0	0	0	112.6	A137 S162 G163 Y164 Y667 R728 Q729 M734 H735 A736	A137-N732 VanDerWaalsContact CB-OD1 3.26Å; A137-N732 WeakPolarHBondContact CB-OD1 3.16Å; S162-N732 PolarHBondContact O-ND2 2.78Å; G163-N732 VanDerWaalsContact C-ND2 3.31Å; G163-N732 WeakPolarHBondContact O-CB 3.35Å; Y164-N732 PolarHBondContact N-ND2 2.82Å; Y667-N732 PolarHBondContact OH-OD1 3.38Å; R728-N732 VanDerWaalsContact O-CB 3.26Å; R728-N732 WeakPolarHBondContact O-CB 3.28Å; R728-N732 PolarHBondContact O-N 3.24Å; R728-N732 PolarHBondContact O-ND2 3.15Å; Q729-N732 PolarHBondContact O-N 2.78Å; N732-M734 VanDerWaalsContact C-N 3.34Å; N732-M734 PolarHBondContact O-N 3.17Å; N732-H735 PolarHBondContact O-N 3.44Å; N732-A736 WeakPolarHBondContact O-CB 3.04Å; N732-A736 PolarHBondContact O-N 2.82Å
733	R	88.5	Confident	89.2	Confident	122 Å²	122	30.5 Å²	30.5	46%	0.46	15%	0.145	S	C	.	.	H	α-helix	trans	-59.6	-44.3	172.1	-76.2	-167.7	-67.9	-96.1	5.2	111.3	Q729 A730 F737 E849	Q729-R733 WeakPolarHBondContact O-CB 3.38Å; Q729-R733 WeakPolarHBondContact O-CG 3.24Å; Q729-R733 PolarHBondContact O-N 3.14Å; A730-R733 PolarHBondContact O-N 3.43Å; R733-F737 VanDerWaalsContact O-CB 3.28Å; R733-F737 WeakPolarHBondContact O-CB 3.21Å; R733-F737 PolarHBondContact O-N 2.9Å; R733-E849 IonicContact CZ-OE2 2.77Å; R733-E849 IonicContact NE-OE2 3.65Å; R733-E849 IonicContact NH2-OE1 3.15Å; R733-E849 PolarHBondContact NH2-OE1 2.91Å; R733-E849 IonicContact NH2-OE2 3.62Å; R733-E849 PolarHBondContact NH2-OE2 3.47Å
734	M	90.6	Very high	89	Confident	9 Å²	9	30.8 Å²	30.8	4%	0.044	14%	0.144	C	C	.	.	H	α-helix	trans	-60.4	-47.5	174.6	177.4	-166.8	76.5	0	0	111.6	T658 A661 A730 V731 N732 A736 F737 L738 I771 L801 Y802	T658-M734 HydrophobicContact CG2-CE 4.46Å; A661-M734 HydrophobicContact CB-CE 3.77Å; A730-M734 WeakPolarHBondContact O-CB 3.22Å; A730-M734 PolarHBondContact O-N 3.27Å; V731-M734 WeakPolarHBondContact O-CB 3.37Å; V731-M734 PolarHBondContact O-N 3.44Å; N732-M734 VanDerWaalsContact C-N 3.34Å; N732-M734 PolarHBondContact O-N 3.17Å; M734-A736 PolarHBondContact O-N 3.44Å; M734-F737 PolarHBondContact O-N 3.13Å; M734-L738 HydrophobicContact CG-CD1 3.75Å; M734-L738 HydrophobicContact CG-CG 4.27Å; M734-L738 WeakPolarHBondContact O-CB 3.25Å; M734-L738 VanDerWaalsContact O-CG 3.23Å; M734-L738 WeakPolarHBondContact O-CG 3.2Å; M734-L738 PolarHBondContact O-N 2.9Å; M734-L738 HydrophobicContact SD-CD1 4.4Å; M734-I771 HydrophobicContact CE-CD1 3.96Å; M734-I771 HydrophobicContact SD-CD1 3.61Å; M734-I771 HydrophobicContact SD-CG1 4.03Å; M734-L801 HydrophobicContact CG-CD1 4.07Å; M734-Y802 HydrophobicContact CB-CE1 4.07Å; M734-Y802 HydrophobicContact CG-CE1 4.4Å; M734-Y802 HydrophobicContact SD-CE1 3.75Å; M734-Y802 PolarHBondContact SD-OH 2.71Å; M734-Y802 VanDerWaalsContact SD-OH 3.38Å
735	H	92.4	Very high	88.8	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-58.3	-49.8	178.8	-175.9	64	0	0	0	111.9	E134 A661 R665 Y667 V731 N732 F737 L738 S739	E134-H735 PolarHBondContact O-CE1 2.79Å; E134-H735 PolarHBondContact O-NE2 3.1Å; E134-H735 VanDerWaalsContact O-NE2 3.12Å; A661-H735 HydrophobicContact CB-CB 4.06Å; A661-H735 PolarHBondContact O-ND1 3.44Å; R665-H735 PolarHBondContact O-CE1 2.91Å; Y667-H735 AromaticContact CD1-CD2 3.84Å; Y667-H735 AromaticContact CD1-CE1 3.98Å; Y667-H735 AromaticContact CD1-CG 3.93Å; Y667-H735 AromaticContact CD1-NE2 3.89Å; Y667-H735 HydrophobicContact CE1-CB 4.12Å; Y667-H735 AromaticContact CE1-CD2 3.89Å; Y667-H735 AromaticContact CE1-CG 3.82Å; V731-H735 WeakPolarHBondContact O-CB 3.36Å; V731-H735 PolarHBondContact O-N 3.21Å; N732-H735 PolarHBondContact O-N 3.44Å; H735-F737 PolarHBondContact O-N 3.47Å; H735-L738 PolarHBondContact O-N 3.33Å; H735-S739 WeakPolarHBondContact O-CB 3.49Å; H735-S739 PolarHBondContact O-N 3.31Å; H735-S739 PolarHBondContact O-OG 2.83Å
736	A	86.7	Confident	88.7	Confident	23 Å²	23	31.6 Å²	31.6	19%	0.19	15%	0.148	C	C	.	.	H	α-helix	trans	-60.4	-45.5	176.9	0	0	0	0	0	112	N732 M734 L738 S739 Q740	N732-A736 WeakPolarHBondContact O-CB 3.04Å; N732-A736 PolarHBondContact O-N 2.82Å; M734-A736 PolarHBondContact O-N 3.44Å; A736-L738 PolarHBondContact O-N 3.3Å; A736-S739 PolarHBondContact O-N 2.94Å; A736-Q740 VanDerWaalsContact O-CB 3.27Å; A736-Q740 WeakPolarHBondContact O-CB 3.04Å; A736-Q740 VanDerWaalsContact O-CG 3.26Å; A736-Q740 WeakPolarHBondContact O-CG 3.48Å; A736-Q740 PolarHBondContact O-N 2.77Å
737	F	86.9	Confident	88.7	Confident	81 Å²	81	29.7 Å²	29.7	36%	0.355	14%	0.144	S	C	.	.	H	α-helix	trans	-58.3	-47.3	175.9	169.2	-102.6	0	0	0	112.4	R733 M734 H735 G741 F743 V769	R733-F737 VanDerWaalsContact O-CB 3.28Å; R733-F737 WeakPolarHBondContact O-CB 3.21Å; R733-F737 PolarHBondContact O-N 2.9Å; M734-F737 PolarHBondContact O-N 3.13Å; H735-F737 PolarHBondContact O-N 3.47Å; F737-G741 WeakPolarHBondContact O-CA 3.39Å; F737-G741 PolarHBondContact O-N 3.13Å; F737-F743 HydrophobicContact CD1-CE2 4.48Å; F737-F743 AromaticContact CE1-CE2 3.81Å; F737-F743 HydrophobicContact CE1-CE2 3.81Å; F737-F743 AromaticContact CE1-CZ 3.88Å; F737-F743 HydrophobicContact CE1-CZ 3.88Å; F737-F743 AromaticContact CZ-CE2 3.91Å; F737-F743 HydrophobicContact CZ-CE2 3.91Å; F737-F743 AromaticContact CZ-CZ 3.99Å; F737-F743 HydrophobicContact CZ-CZ 3.99Å; F737-V769 HydrophobicContact CE1-CG2 4.02Å
738	L	89.7	Confident	88.7	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-66	-43	-179.5	-70.3	172.8	0	0	0	112.1	M734 H735 A736 F743 R760 V769 I771	M734-L738 HydrophobicContact CG-CD1 3.75Å; M734-L738 HydrophobicContact CG-CG 4.27Å; M734-L738 WeakPolarHBondContact O-CB 3.25Å; M734-L738 VanDerWaalsContact O-CG 3.23Å; M734-L738 WeakPolarHBondContact O-CG 3.2Å; M734-L738 PolarHBondContact O-N 2.9Å; M734-L738 HydrophobicContact SD-CD1 4.4Å; H735-L738 PolarHBondContact O-N 3.33Å; A736-L738 PolarHBondContact O-N 3.3Å; L738-F743 HydrophobicContact CB-CB 4.28Å; L738-F743 HydrophobicContact CD2-CB 3.91Å; L738-F743 HydrophobicContact CD2-CD1 3.78Å; L738-F743 HydrophobicContact CD2-CD2 3.95Å; L738-F743 HydrophobicContact CD2-CE1 4.29Å; L738-F743 HydrophobicContact CD2-CE2 4.43Å; L738-F743 HydrophobicContact CD2-CG 3.61Å; L738-F743 VanDerWaalsContact O-CB 3.31Å; L738-F743 WeakPolarHBondContact O-CB 3.4Å; L738-F743 WeakPolarHBondContact O-CD2 3.47Å; L738-F743 PolarHBondContact O-N 3.04Å; L738-F743 VanDerWaalsContact O-N 3.1Å; L738-R760 HydrophobicContact CD1-CB 4.46Å; L738-R760 HydrophobicContact CD1-CG 4.29Å; L738-R760 HydrophobicContact CD2-CB 3.99Å; L738-V769 HydrophobicContact CD2-CB 3.77Å; L738-V769 HydrophobicContact CD2-CG1 4.1Å; L738-V769 HydrophobicContact CD2-CG2 3.76Å; L738-I771 HydrophobicContact CD1-CD1 4.08Å
739	S	87.3	Confident	88.5	Confident	12 Å²	12	32.4 Å²	32.4	8%	0.084	16%	0.16	C	C	.	.	H	α-helix	trans	-76.6	-28.3	-178.1	-67.1	0	0	0	0	113.1	E134 H735 A736	E134-S739 WeakPolarHBondContact O-CB 3.01Å; E134-S739 PolarHBondContact O-OG 3.28Å; H735-S739 WeakPolarHBondContact O-CB 3.49Å; H735-S739 PolarHBondContact O-N 3.31Å; H735-S739 PolarHBondContact O-OG 2.83Å; A736-S739 PolarHBondContact O-N 2.94Å
740	Q	81.9	Confident	88.5	Confident	115 Å²	115	34 Å²	34	54%	0.537	17%	0.167	S	C	.	.	H	α-helix	trans	-84	-31.3	173.1	-66.8	175.1	5.1	0	0	113.2	A736 E742	A736-Q740 VanDerWaalsContact O-CB 3.27Å; A736-Q740 WeakPolarHBondContact O-CB 3.04Å; A736-Q740 VanDerWaalsContact O-CG 3.26Å; A736-Q740 WeakPolarHBondContact O-CG 3.48Å; A736-Q740 PolarHBondContact O-N 2.77Å; Q740-E742 PolarHBondContact O-N 3.37Å
741	G	79	Confident	88.4	Confident	16 Å²	16	36 Å²	36	17%	0.165	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.9	14.8	179.3	0	0	0	0	0	115.4	F737 F743 S762 L765	F737-G741 WeakPolarHBondContact O-CA 3.39Å; F737-G741 PolarHBondContact O-N 3.13Å; G741-F743 WeakPolarHBondContact O-CD2 3.26Å; G741-F743 PolarHBondContact O-N 2.79Å; G741-S762 WeakPolarHBondContact O-CB 3.36Å; G741-S762 PolarHBondContact O-OG 2.81Å; G741-L765 WeakPolarHBondContact O-CD1 3.33Å
742	E	79	Confident	88.2	Confident	91 Å²	91	37.1 Å²	37.1	43%	0.425	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.1	37.3	-176.6	-71.6	-67.5	150.7	0	0	113.3	Q740 T744 S762 L764	Q740-E742 PolarHBondContact O-N 3.37Å; E742-T744 HydrophobicContact CB-CG2 4.38Å; E742-T744 WeakPolarHBondContact O-CG2 3.32Å; E742-T744 PolarHBondContact O-N 2.84Å; E742-T744 WeakPolarHBondContact OE2-CG2 3.26Å; E742-S762 WeakPolarHBondContact O-CA 3.49Å; E742-S762 PolarHBondContact O-OG 3.37Å; E742-L764 HydrophobicContact CB-CB 4.47Å; E742-L764 HydrophobicContact CB-CD2 4.42Å; E742-L764 HydrophobicContact CG-CD2 4.38Å
743	F	88.5	Confident	87.9	Confident	3 Å²	3	41.3 Å²	41.3	1%	0.013	20%	0.202	C	C	.	.			trans	-73.9	69.1	171.2	-68	-103.6	0	0	0	110.2	F737 L738 G741 R760 R761 S762 Q767 V769	F737-F743 HydrophobicContact CD1-CE2 4.48Å; F737-F743 AromaticContact CE1-CE2 3.81Å; F737-F743 HydrophobicContact CE1-CE2 3.81Å; F737-F743 AromaticContact CE1-CZ 3.88Å; F737-F743 HydrophobicContact CE1-CZ 3.88Å; F737-F743 AromaticContact CZ-CE2 3.91Å; F737-F743 HydrophobicContact CZ-CE2 3.91Å; F737-F743 AromaticContact CZ-CZ 3.99Å; F737-F743 HydrophobicContact CZ-CZ 3.99Å; L738-F743 HydrophobicContact CB-CB 4.28Å; L738-F743 HydrophobicContact CD2-CB 3.91Å; L738-F743 HydrophobicContact CD2-CD1 3.78Å; L738-F743 HydrophobicContact CD2-CD2 3.95Å; L738-F743 HydrophobicContact CD2-CE1 4.29Å; L738-F743 HydrophobicContact CD2-CE2 4.43Å; L738-F743 HydrophobicContact CD2-CG 3.61Å; L738-F743 VanDerWaalsContact O-CB 3.31Å; L738-F743 WeakPolarHBondContact O-CB 3.4Å; L738-F743 WeakPolarHBondContact O-CD2 3.47Å; L738-F743 PolarHBondContact O-N 3.04Å; L738-F743 VanDerWaalsContact O-N 3.1Å; G741-F743 WeakPolarHBondContact O-CD2 3.26Å; G741-F743 PolarHBondContact O-N 2.79Å; F743-R760 HydrophobicContact CB-CB 4.42Å; F743-R760 VanDerWaalsContact O-CZ 3.28Å; F743-R760 PolarHBondContact O-NE 3.07Å; F743-R760 PolarHBondContact O-NH2 3.3Å; F743-R761 CarbonylContact C-O 3.58Å; F743-R761 VanDerWaalsContact CA-O 3.24Å; F743-R761 WeakPolarHBondContact CA-O 3.29Å; F743-S762 VanDerWaalsContact CD1-N 3.29Å; F743-Q767 HydrophobicContact CE1-CB 4.02Å; F743-Q767 HydrophobicContact CZ-CB 3.91Å; F743-V769 HydrophobicContact CD1-CG2 4.44Å; F743-V769 HydrophobicContact CE1-CG2 3.86Å; F743-V769 HydrophobicContact CZ-CG2 4.23Å
744	T	86.9	Confident	88	Confident	18 Å²	18	35.5 Å²	35.5	11%	0.11	18%	0.18	C	C	.	.			trans	-82.8	-17.5	-168.4	55.4	0	0	0	0	114.6	K612 R664 E742 R761 P763	K612-T744 PolarHBondContact N-O 3.23Å; R664-T744 VanDerWaalsContact NH1-CB 3.32Å; E742-T744 HydrophobicContact CB-CG2 4.38Å; E742-T744 WeakPolarHBondContact O-CG2 3.32Å; E742-T744 PolarHBondContact O-N 2.84Å; E742-T744 WeakPolarHBondContact OE2-CG2 3.26Å; T744-R761 PolarHBondContact N-O 3.26Å; T744-R761 VanDerWaalsContact N-O 3.13Å; T744-P763 VanDerWaalsContact OG1-CD 3.29Å; T744-P763 WeakPolarHBondContact OG1-CD 3.49Å
745	E	89.5	Confident	88.1	Confident	10 Å²	10	36.9 Å²	36.9	5%	0.047	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	144.3	177.6	-71.7	180	-169.9	0	0	111.3	K612 V614 G615 S616 R760 R761 P763	K612-E745 CarbonylContact O-C 3.56Å; K612-E745 VanDerWaalsContact O-CA 3.27Å; K612-E745 WeakPolarHBondContact O-CA 3.32Å; V614-E745 WeakPolarHBondContact CA-OE2 3.14Å; V614-E745 HydrophobicContact CG2-CB 4.21Å; G615-E745 PolarHBondContact N-OE2 2.83Å; S616-E745 PolarHBondContact N-OE1 2.77Å; E745-R760 CarbonylContact O-C 3.56Å; E745-R760 WeakPolarHBondContact O-CA 3.29Å; E745-R761 HydrophobicContact CB-CB 4.01Å; E745-R761 PolarHBondContact N-O 3.44Å; E745-R761 VanDerWaalsContact N-O 3.1Å; E745-R761 PolarHBondContact O-N 2.83Å; E745-R761 WeakPolarHBondContact OE2-CD 3.49Å; E745-P763 HydrophobicContact CG-CG 3.89Å; E745-P763 WeakPolarHBondContact OE1-CG 3.34Å
746	I	91.6	Very high	88.2	Confident	8 Å²	8	36.9 Å²	36.9	4%	0.041	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	144	177.9	-160.9	173.8	0	0	0	110.4	K612 P613 V614 V748 V758 H759 R760	K612-I746 PolarHBondContact O-N 2.93Å; P613-I746 CarbonylContact C-O 3.48Å; P613-I746 WeakPolarHBondContact CA-O 3.04Å; V614-I746 PolarHBondContact N-O 2.83Å; I746-V748 HydrophobicContact CD1-CG2 4.09Å; I746-V748 HydrophobicContact CG1-CG2 4.18Å; I746-V758 HydrophobicContact CD1-CG1 3.68Å; I746-V758 HydrophobicContact CG1-CG1 3.61Å; I746-H759 CarbonylContact C-O 3.55Å; I746-H759 VanDerWaalsContact CA-O 3.25Å; I746-H759 WeakPolarHBondContact CA-O 3.46Å; I746-R760 HydrophobicContact CG1-CG 4.41Å
747	Q	90	Very high	88.5	Confident	77 Å²	77	35.8 Å²	35.8	36%	0.36	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	138.3	162.7	168	-178.4	-5.5	0	0	107.6	V614 D749 V758 H759	V614-Q747 HydrophobicContact CB-CB 4.22Å; V614-Q747 HydrophobicContact CG2-CB 3.7Å; Q747-D749 WeakPolarHBondContact CG-OD1 3.24Å; Q747-D749 PolarHBondContact NE2-OD1 3.23Å; Q747-D749 PolarHBondContact NE2-OD2 2.88Å; Q747-V758 CarbonylContact O-C 3.56Å; Q747-V758 WeakPolarHBondContact O-CA 3.16Å; Q747-H759 HydrophobicContact CB-CB 4.24Å; Q747-H759 PolarHBondContact N-O 2.92Å; Q747-H759 PolarHBondContact O-N 2.85Å
748	V	91.7	Very high	88.8	Confident	19 Å²	19	32 Å²	32	12%	0.115	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	110.2	-178.6	-176.6	0	0	0	0	108.1	A603 L606 K607 I746 I756 V758	A603-V748 HydrophobicContact CB-CG1 4.3Å; L606-V748 HydrophobicContact CB-CG1 4.24Å; L606-V748 HydrophobicContact CB-CG2 4.04Å; K607-V748 HydrophobicContact CB-CB 4.35Å; I746-V748 HydrophobicContact CD1-CG2 4.09Å; I746-V748 HydrophobicContact CG1-CG2 4.18Å; V748-I756 HydrophobicContact CG1-CG2 3.89Å; V748-V758 HydrophobicContact CG1-CG2 4.43Å; V748-V758 HydrophobicContact CG2-CG1 4.42Å; V748-V758 HydrophobicContact CG2-CG2 4.32Å
749	D	90.1	Very high	88.8	Confident	40 Å²	40	33.3 Å²	33.3	21%	0.214	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	120.8	179.9	-78.4	12.8	0	0	0	109.5	Q747 K751 V757	Q747-D749 WeakPolarHBondContact CG-OD1 3.24Å; Q747-D749 PolarHBondContact NE2-OD1 3.23Å; Q747-D749 PolarHBondContact NE2-OD2 2.88Å; D749-K751 HydrophobicContact CB-CD 4.37Å; D749-K751 IonicContact OD2-NZ 3.43Å; D749-K751 PolarHBondContact OD2-NZ 2.79Å; D749-V757 PolarHBondContact N-O 3.16Å; D749-V757 PolarHBondContact O-N 2.93Å
750	Q	90.8	Very high	89	Confident	61 Å²	61	32.8 Å²	32.8	29%	0.285	16%	0.164	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	120.4	166.2	-170.9	171	12.3	0	0	108.9	Y600 C752 E753 M755 I756	Y600-Q750 VanDerWaalsContact CD2-OE1 3.28Å; Q750-C752 WeakPolarHBondContact CG-O 3.26Å; Q750-C752 PolarHBondContact NE2-O 2.88Å; Q750-E753 PolarHBondContact NE2-O 2.71Å; Q750-M755 WeakPolarHBondContact CA-O 3.37Å; Q750-I756 HydrophobicContact CG-CG1 4.5Å
751	K	89.5	Confident	89.1	Confident	47 Å²	47	27.9 Å²	27.9	20%	0.204	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	-23.9	-175.8	-60.5	-61.5	-179.6	-168.1	0	113.3	D749 M755 V757 V788 I791	D749-K751 HydrophobicContact CB-CD 4.37Å; D749-K751 IonicContact OD2-NZ 3.43Å; D749-K751 PolarHBondContact OD2-NZ 2.79Å; K751-M755 PolarHBondContact N-O 2.69Å; K751-V757 HydrophobicContact CG-CB 4.49Å; K751-V757 HydrophobicContact CG-CG2 3.61Å; K751-V788 HydrophobicContact CB-CG1 4.13Å; K751-I791 HydrophobicContact CG-CG1 4.25Å
752	C	88.9	Confident	89.5	Confident	24 Å²	24	27.1 Å²	27.1	16%	0.162	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.7	177.9	167.8	63	0	0	0	0	108.6	Q750 N754 M755 E786	Q750-C752 WeakPolarHBondContact CG-O 3.26Å; Q750-C752 PolarHBondContact NE2-O 2.88Å; C752-N754 VanDerWaalsContact C-N 3.26Å; C752-N754 PolarHBondContact O-N 2.97Å; C752-M755 PolarHBondContact O-N 3.41Å; C752-M755 VanDerWaalsContact O-N 3.12Å; C752-M755 WeakPolarHBondContact SG-CB 3.25Å; C752-E786 HydrophobicContact CB-CB 4.19Å; C752-E786 WeakPolarHBondContact CB-OE2 3.4Å; C752-E786 PolarHBondContact SG-OE2 2.86Å
753	E	87.2	Confident	89.4	Confident	91 Å²	91	23.8 Å²	23.8	43%	0.425	12%	0.118	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.8	-45.6	-174	-169.6	176.4	139.7	0	0	112.4	P599 Q750 R784 E786	P599-E753 WeakPolarHBondContact CB-O 3.44Å; Q750-E753 PolarHBondContact NE2-O 2.71Å; E753-R784 IonicContact OE1-CZ 3.77Å; E753-R784 IonicContact OE1-NH1 2.66Å; E753-R784 PolarHBondContact OE1-NH1 3.41Å; E753-R784 IonicContact OE1-NH2 2.74Å; E753-R784 IonicContact OE2-CZ 2.7Å; E753-R784 IonicContact OE2-NH1 3.73Å; E753-R784 PolarHBondContact OE2-NH1 3.37Å; E753-R784 IonicContact OE2-NH2 3.73Å; E753-R784 PolarHBondContact OE2-NH2 3.48Å; E753-E786 PolarHBondContact N-OE2 3.5Å
754	N	91	Very high	88.7	Confident	1 Å²	1	29.1 Å²	29.1	1%	0.005	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.7	4.8	-178.3	-78.2	-63.3	0	0	0	115.5	C752 R774 N775 D781 E786	C752-N754 VanDerWaalsContact C-N 3.26Å; C752-N754 PolarHBondContact O-N 2.97Å; N754-R774 CarbonylContact O-C 3.15Å; N754-R774 VanDerWaalsContact O-CA 3.29Å; N754-R774 WeakPolarHBondContact O-CA 3.47Å; N754-N775 PolarHBondContact O-N 3.21Å; N754-D781 VanDerWaalsContact ND2-CG 3.35Å; N754-D781 PolarHBondContact ND2-OD1 3.18Å; N754-E786 PolarHBondContact N-OE2 3.4Å; N754-E786 VanDerWaalsContact N-OE2 3.07Å; N754-E786 PolarHBondContact ND2-OE1 2.84Å
755	M	92.2	Very high	88.3	Confident	37 Å²	37	32.2 Å²	32.2	18%	0.182	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	119.5	-176.2	-160.3	175.5	-157	0	0	114	Q750 K751 C752 A772 V773 V788	Q750-M755 WeakPolarHBondContact CA-O 3.37Å; K751-M755 PolarHBondContact N-O 2.69Å; C752-M755 PolarHBondContact O-N 3.41Å; C752-M755 VanDerWaalsContact O-N 3.12Å; C752-M755 WeakPolarHBondContact SG-CB 3.25Å; M755-A772 HydrophobicContact CE-CB 4.24Å; M755-V773 WeakPolarHBondContact CA-O 3.38Å; M755-V773 WeakPolarHBondContact CG-O 3.4Å; M755-V788 HydrophobicContact SD-CB 4.3Å; M755-V788 HydrophobicContact SD-CG1 3.46Å; M755-V788 WeakPolarHBondContact SD-CG1 3.46Å; M755-V788 HydrophobicContact SD-CG2 3.78Å
756	I	94.4	Very high	87.7	Confident	0 Å²	0	32 Å²	32	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	132.6	179.9	-57.7	169.7	0	0	0	108.6	P599 A603 L659 V748 Q750 V758 V773	P599-I756 HydrophobicContact CB-CD1 4.1Å; P599-I756 WeakPolarHBondContact O-CD1 3.43Å; A603-I756 HydrophobicContact CB-CD1 3.9Å; A603-I756 HydrophobicContact CB-CG1 4.15Å; A603-I756 HydrophobicContact CB-CG2 4.44Å; L659-I756 HydrophobicContact CD1-CB 4.31Å; L659-I756 HydrophobicContact CD1-CD1 3.79Å; L659-I756 HydrophobicContact CD2-CB 4.13Å; L659-I756 HydrophobicContact CD2-CG2 3.81Å; V748-I756 HydrophobicContact CG1-CG2 3.89Å; Q750-I756 HydrophobicContact CG-CG1 4.5Å; I756-V758 HydrophobicContact CG2-CG2 4.22Å; I756-V773 PolarHBondContact N-O 2.68Å; I756-V773 PolarHBondContact O-N 3.03Å
757	V	92.8	Very high	87.2	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	116.8	177.6	-172	0	0	0	0	108.7	D749 K751 H759 I770 I771 A772 I791	D749-V757 PolarHBondContact N-O 3.16Å; D749-V757 PolarHBondContact O-N 2.93Å; K751-V757 HydrophobicContact CG-CB 4.49Å; K751-V757 HydrophobicContact CG-CG2 3.61Å; V757-H759 WeakPolarHBondContact CG1-NE2 3.36Å; V757-I770 HydrophobicContact CG1-CG2 3.75Å; V757-I771 WeakPolarHBondContact CA-O 3.45Å; V757-A772 HydrophobicContact CG1-CB 4.43Å; V757-A772 HydrophobicContact CG2-CB 4.21Å; V757-I791 HydrophobicContact CG1-CD1 4.43Å; V757-I791 HydrophobicContact CG1-CG2 4.26Å; V757-I791 HydrophobicContact CG2-CD1 3.6Å; V757-I791 HydrophobicContact CG2-CG1 4.13Å
758	V	93	Very high	87	Confident	1 Å²	1	31 Å²	31	1%	0.006	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	119.2	176.9	-175.6	0	0	0	0	109.3	L659 A662 I746 Q747 V748 I756 R760 I771	L659-V758 HydrophobicContact CD2-CG2 3.66Å; A662-V758 HydrophobicContact CB-CB 4.07Å; A662-V758 HydrophobicContact CB-CG1 3.88Å; A662-V758 HydrophobicContact CB-CG2 4.29Å; I746-V758 HydrophobicContact CD1-CG1 3.68Å; I746-V758 HydrophobicContact CG1-CG1 3.61Å; Q747-V758 CarbonylContact O-C 3.56Å; Q747-V758 WeakPolarHBondContact O-CA 3.16Å; V748-V758 HydrophobicContact CG1-CG2 4.43Å; V748-V758 HydrophobicContact CG2-CG1 4.42Å; V748-V758 HydrophobicContact CG2-CG2 4.32Å; I756-V758 HydrophobicContact CG2-CG2 4.22Å; V758-R760 HydrophobicContact CG1-CG 4.29Å; V758-I771 HydrophobicContact CB-CB 4.29Å; V758-I771 PolarHBondContact N-O 2.89Å; V758-I771 PolarHBondContact O-N 2.86Å
759	H	89.9	Confident	86.9	Confident	29 Å²	29	30.4 Å²	30.4	13%	0.134	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	111	173	-65.5	-121.5	0	0	0	108.2	I746 Q747 V757	I746-H759 CarbonylContact C-O 3.55Å; I746-H759 VanDerWaalsContact CA-O 3.25Å; I746-H759 WeakPolarHBondContact CA-O 3.46Å; Q747-H759 HydrophobicContact CB-CB 4.24Å; Q747-H759 PolarHBondContact N-O 2.92Å; Q747-H759 PolarHBondContact O-N 2.85Å; V757-H759 WeakPolarHBondContact CG1-NE2 3.36Å
760	R	90.5	Very high	86.8	Confident	1 Å²	1	30.4 Å²	30.4	0%	0.004	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	129.3	171.2	-78.8	-72.7	-67.8	-76	6.6	109.6	A662 T663 L738 F743 E745 I746 V758 S768 V769	A662-R760 VanDerWaalsContact C-NH1 3.3Å; A662-R760 WeakPolarHBondContact O-CD 3.35Å; A662-R760 WeakPolarHBondContact O-CG 3.34Å; A662-R760 PolarHBondContact O-NH1 3.36Å; T663-R760 PolarHBondContact O-NH1 3.35Å; L738-R760 HydrophobicContact CD1-CB 4.46Å; L738-R760 HydrophobicContact CD1-CG 4.29Å; L738-R760 HydrophobicContact CD2-CB 3.99Å; F743-R760 HydrophobicContact CB-CB 4.42Å; F743-R760 VanDerWaalsContact O-CZ 3.28Å; F743-R760 PolarHBondContact O-NE 3.07Å; F743-R760 PolarHBondContact O-NH2 3.3Å; E745-R760 CarbonylContact O-C 3.56Å; E745-R760 WeakPolarHBondContact O-CA 3.29Å; I746-R760 HydrophobicContact CG1-CG 4.41Å; V758-R760 HydrophobicContact CG1-CG 4.29Å; R760-S768 CarbonylContact O-C 3.58Å; R760-S768 VanDerWaalsContact O-CA 3.29Å; R760-S768 WeakPolarHBondContact O-CA 3.43Å; R760-V769 PolarHBondContact N-O 3.06Å; R760-V769 PolarHBondContact O-N 2.97Å
761	R	85.7	Confident	86.9	Confident	11 Å²	11	28.1 Å²	28.1	4%	0.042	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	135	-175.9	173.2	171.8	-172.5	86.4	1.8	111.2	V614 F743 T744 E745 P763 S768 M855 M863	V614-R761 HydrophobicContact CG2-CB 4.45Å; F743-R761 CarbonylContact C-O 3.58Å; F743-R761 VanDerWaalsContact CA-O 3.24Å; F743-R761 WeakPolarHBondContact CA-O 3.29Å; T744-R761 PolarHBondContact N-O 3.26Å; T744-R761 VanDerWaalsContact N-O 3.13Å; E745-R761 HydrophobicContact CB-CB 4.01Å; E745-R761 PolarHBondContact N-O 3.44Å; E745-R761 VanDerWaalsContact N-O 3.1Å; E745-R761 PolarHBondContact O-N 2.83Å; E745-R761 WeakPolarHBondContact OE2-CD 3.49Å; R761-P763 WeakPolarHBondContact O-CD 3.34Å; R761-S768 WeakPolarHBondContact CG-OG 3.3Å; R761-S768 PolarHBondContact NH1-OG 2.87Å; R761-M855 PolarHBondContact NH1-SD 3.13Å; R761-M855 VanDerWaalsContact NH1-SD 3.35Å; R761-M863 PolarHBondContact NH2-SD 2.69Å
762	S	85.8	Confident	87	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	108.9	166.2	179.5	0	0	0	0	108	G741 E742 F743 L764 L765 A766 Q767	G741-S762 WeakPolarHBondContact O-CB 3.36Å; G741-S762 PolarHBondContact O-OG 2.81Å; E742-S762 WeakPolarHBondContact O-CA 3.49Å; E742-S762 PolarHBondContact O-OG 3.37Å; F743-S762 VanDerWaalsContact CD1-N 3.29Å; S762-L764 VanDerWaalsContact C-N 3.27Å; S762-L764 PolarHBondContact O-N 3.44Å; S762-L765 PolarHBondContact OG-N 3.41Å; S762-A766 WeakPolarHBondContact O-CA 3.35Å; S762-A766 PolarHBondContact O-N 2.91Å; S762-Q767 PolarHBondContact N-O 3.3Å
763	P	77.5	Confident	87.3	Confident	21 Å²	21	27.8 Å²	27.8	14%	0.136	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-49.1	171.2	-23.6	35.2	0	0	0	108.9	T744 E745 R761 L765 A766 R867	T744-P763 VanDerWaalsContact OG1-CD 3.29Å; T744-P763 WeakPolarHBondContact OG1-CD 3.49Å; E745-P763 HydrophobicContact CG-CG 3.89Å; E745-P763 WeakPolarHBondContact OE1-CG 3.34Å; R761-P763 WeakPolarHBondContact O-CD 3.34Å; P763-L765 PolarHBondContact O-N 3.48Å; P763-A766 PolarHBondContact O-N 3.4Å; P763-R867 PolarHBondContact O-NH1 2.76Å; P763-R867 PolarHBondContact O-NH2 2.9Å
764	L	74.3	Confident	87.5	Confident	115 Å²	115	28.4 Å²	28.4	60%	0.602	15%	0.15	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-50.7	-174	-177.5	61.7	0	0	0	112.7	E742 S762 R867	E742-L764 HydrophobicContact CB-CB 4.47Å; E742-L764 HydrophobicContact CB-CD2 4.42Å; E742-L764 HydrophobicContact CG-CD2 4.38Å; S762-L764 VanDerWaalsContact C-N 3.27Å; S762-L764 PolarHBondContact O-N 3.44Å; L764-R867 PolarHBondContact O-NH1 2.86Å
765	L	77.3	Confident	87.6	Confident	84 Å²	84	28.3 Å²	28.3	44%	0.44	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-9.1	-177	-57.3	176.8	0	0	0	113.8	G741 S762 P763 Q767	G741-L765 WeakPolarHBondContact O-CD1 3.33Å; S762-L765 PolarHBondContact OG-N 3.41Å; P763-L765 PolarHBondContact O-N 3.48Å; L765-Q767 HydrophobicContact CB-CB 4.28Å; L765-Q767 HydrophobicContact CB-CG 4.19Å; L765-Q767 PolarHBondContact O-N 2.91Å
766	A	76.6	Confident	87.6	Confident	6 Å²	6	26.8 Å²	26.8	5%	0.05	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.4	31.8	-169.6	0	0	0	0	0	113.3	S762 P763 M855 R860 M863	S762-A766 WeakPolarHBondContact O-CA 3.35Å; S762-A766 PolarHBondContact O-N 2.91Å; P763-A766 PolarHBondContact O-N 3.4Å; A766-M855 WeakPolarHBondContact O-CB 3.26Å; A766-M855 WeakPolarHBondContact O-CG 3.39Å; A766-R860 HydrophobicContact CB-CG 4.21Å; A766-M863 HydrophobicContact CB-CB 4.38Å; A766-M863 HydrophobicContact CB-SD 3.87Å
767	Q	82.6	Confident	87.4	Confident	45 Å²	45	26.9 Å²	26.9	21%	0.21	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	159.5	175.4	-74.3	177	-40.5	0	0	110.7	F743 S762 L765	F743-Q767 HydrophobicContact CE1-CB 4.02Å; F743-Q767 HydrophobicContact CZ-CB 3.91Å; S762-Q767 PolarHBondContact N-O 3.3Å; L765-Q767 HydrophobicContact CB-CB 4.28Å; L765-Q767 HydrophobicContact CB-CG 4.19Å; L765-Q767 PolarHBondContact O-N 2.91Å
768	S	86.2	Confident	87.2	Confident	18 Å²	18	33 Å²	33	13%	0.126	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	137.5	177.7	-62.2	0	0	0	0	110.1	R760 R761 V853	R760-S768 CarbonylContact O-C 3.58Å; R760-S768 VanDerWaalsContact O-CA 3.29Å; R760-S768 WeakPolarHBondContact O-CA 3.43Å; R761-S768 WeakPolarHBondContact CG-OG 3.3Å; R761-S768 PolarHBondContact NH1-OG 2.87Å; S768-V853 WeakPolarHBondContact O-CB 3.5Å; S768-V853 VanDerWaalsContact O-O 3.11Å
769	V	87.8	Confident	86.6	Confident	6 Å²	6	37.6 Å²	37.6	4%	0.036	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	131.4	177.7	170.4	0	0	0	0	107.3	F737 L738 F743 R760 I771 L801	F737-V769 HydrophobicContact CE1-CG2 4.02Å; L738-V769 HydrophobicContact CD2-CB 3.77Å; L738-V769 HydrophobicContact CD2-CG1 4.1Å; L738-V769 HydrophobicContact CD2-CG2 3.76Å; F743-V769 HydrophobicContact CD1-CG2 4.44Å; F743-V769 HydrophobicContact CE1-CG2 3.86Å; F743-V769 HydrophobicContact CZ-CG2 4.23Å; R760-V769 PolarHBondContact N-O 3.06Å; R760-V769 PolarHBondContact O-N 2.97Å; V769-I771 HydrophobicContact CG1-CD1 4.1Å; V769-I771 HydrophobicContact CG1-CG1 3.92Å; V769-L801 HydrophobicContact CB-CD1 4.44Å; V769-L801 HydrophobicContact CG1-CD1 3.45Å; V769-L801 VanDerWaalsContact CG1-CD1 3.45Å; V769-L801 HydrophobicContact CG2-CD1 4.07Å
770	I	90	Very high	86.2	Confident	41 Å²	41	44.1 Å²	44.1	21%	0.21	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	123.2	-174.3	-62.3	173.9	0	0	0	107.7	V757 I793	V757-I770 HydrophobicContact CG1-CG2 3.75Å; I770-I793 HydrophobicContact CD1-CB 4.14Å; I770-I793 HydrophobicContact CD1-CD1 3.68Å; I770-I793 HydrophobicContact CD1-CG1 3.69Å; I770-I793 HydrophobicContact CD1-CG2 3.43Å; I770-I793 VanDerWaalsContact CD1-CG2 3.43Å; I770-I793 HydrophobicContact CG2-CD1 4.36Å
771	I	92.3	Very high	85.8	Confident	12 Å²	12	44.2 Å²	44.2	6%	0.062	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	93.9	-167.9	-62.9	164.8	0	0	0	105.9	T658 A662 M734 L738 V757 V758 V769 V773	T658-I771 HydrophobicContact CG2-CG2 3.41Å; T658-I771 VanDerWaalsContact CG2-CG2 3.41Å; A662-I771 HydrophobicContact CB-CD1 3.48Å; A662-I771 VanDerWaalsContact CB-CD1 3.48Å; A662-I771 HydrophobicContact CB-CG2 4.26Å; M734-I771 HydrophobicContact CE-CD1 3.96Å; M734-I771 HydrophobicContact SD-CD1 3.61Å; M734-I771 HydrophobicContact SD-CG1 4.03Å; L738-I771 HydrophobicContact CD1-CD1 4.08Å; V757-I771 WeakPolarHBondContact CA-O 3.45Å; V758-I771 HydrophobicContact CB-CB 4.29Å; V758-I771 PolarHBondContact N-O 2.89Å; V758-I771 PolarHBondContact O-N 2.86Å; V769-I771 HydrophobicContact CG1-CD1 4.1Å; V769-I771 HydrophobicContact CG1-CG1 3.92Å; I771-V773 HydrophobicContact CG2-CG2 3.9Å
772	A	92.2	Very high	85.3	Confident	55 Å²	55	47.6 Å²	47.6	46%	0.455	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	116.3	178.1	0	0	0	0	0	109.1	M755 V757 I791	M755-A772 HydrophobicContact CE-CB 4.24Å; V757-A772 HydrophobicContact CG1-CB 4.43Å; V757-A772 HydrophobicContact CG2-CB 4.21Å; A772-I791 HydrophobicContact CB-CD1 4.25Å
773	V	93.8	Very high	84.8	Confident	9 Å²	9	54.9 Å²	54.9	6%	0.055	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	133	-175	173.7	0	0	0	0	109.6	P655 T658 L659 M755 I756 I771	P655-V773 HydrophobicContact CB-CG1 3.5Å; P655-V773 HydrophobicContact CG-CG1 4.46Å; T658-V773 HydrophobicContact CG2-CG2 3.59Å; L659-V773 HydrophobicContact CD1-CB 4.28Å; L659-V773 HydrophobicContact CD1-CG1 3.95Å; L659-V773 HydrophobicContact CD2-CB 3.95Å; L659-V773 HydrophobicContact CD2-CG1 4.47Å; L659-V773 HydrophobicContact CD2-CG2 3.92Å; L659-V773 HydrophobicContact CG-CB 3.99Å; L659-V773 HydrophobicContact CG-CG1 3.97Å; L659-V773 HydrophobicContact CG-CG2 3.98Å; M755-V773 WeakPolarHBondContact CA-O 3.38Å; M755-V773 WeakPolarHBondContact CG-O 3.4Å; I756-V773 PolarHBondContact N-O 2.68Å; I756-V773 PolarHBondContact O-N 3.03Å; I771-V773 HydrophobicContact CG2-CG2 3.9Å
774	R	92.1	Very high	84.8	Confident	104 Å²	104	58.6 Å²	58.6	39%	0.392	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	113.1	165.7	-172.7	175.1	-176.6	-95	2.7	108.5	P655 N754 D781 R784	P655-R774 WeakPolarHBondContact CG-O 3.4Å; N754-R774 CarbonylContact O-C 3.15Å; N754-R774 VanDerWaalsContact O-CA 3.29Å; N754-R774 WeakPolarHBondContact O-CA 3.47Å; R774-D781 PolarHBondContact NH1-O 2.79Å; R774-D781 PolarHBondContact NH2-O 3.27Å; R774-R784 PolarHBondContact NH2-O 2.94Å
775	N	92.8	Very high	84.9	Confident	0 Å²	0	65 Å²	65	0%	0	30%	0.296	C	S	.	.			trans	-75.7	162	173.5	-75.5	101.5	0	0	0	110.8	P599 D652 L659 N754 F777	P599-N775 HydrophobicContact CB-CB 4.24Å; P599-N775 HydrophobicContact CG-CB 3.91Å; D652-N775 WeakPolarHBondContact OD1-CA 3.29Å; D652-N775 WeakPolarHBondContact OD1-CB 3.41Å; D652-N775 PolarHBondContact OD1-ND2 3.14Å; L659-N775 VanDerWaalsContact CD1-OD1 3.31Å; L659-N775 WeakPolarHBondContact CD1-OD1 3.38Å; N754-N775 PolarHBondContact O-N 3.21Å; N775-F777 HydrophobicContact CB-CD1 4Å; N775-F777 HydrophobicContact CB-CE1 4.05Å
776	C	91.5	Very high	85.1	Confident	5 Å²	5	63.1 Å²	63.1	3%	0.034	29%	0.285	C	S	.	.			trans	-143.9	66	179.1	-165.3	0	0	0	0	109.2	T649 V651 D652 W778	T649-C776 VanDerWaalsContact CG2-O 3.3Å; T649-C776 WeakPolarHBondContact CG2-O 3.38Å; T649-C776 PolarHBondContact OG1-O 2.88Å; V651-C776 HydrophobicContact CB-CB 4.42Å; V651-C776 HydrophobicContact CG1-CB 4.3Å; D652-C776 PolarHBondContact OD1-N 3.35Å; C776-W778 VanDerWaalsContact C-N 3.28Å; C776-W778 PolarHBondContact O-N 3.32Å; C776-W778 PolarHBondContact SG-O 3.28Å
777	F	91.3	Very high	85.6	Confident	1 Å²	1	71.1 Å²	71.1	0%	0.004	32%	0.319	C	S	.	.	S	Bend	trans	-65.1	-36.6	-174	-85.5	35.3	0	0	0	111.2	V596 R597 Q598 P599 L602 R648 D652 N775	V596-F777 HydrophobicContact CG1-CE2 4.15Å; V596-F777 HydrophobicContact CG1-CZ 4.35Å; V596-F777 WeakPolarHBondContact O-CE2 3.2Å; R597-F777 WeakPolarHBondContact O-CD2 3.21Å; Q598-F777 VanDerWaalsContact C-CE2 3.48Å; P599-F777 HydrophobicContact CG-CD1 4.08Å; P599-F777 HydrophobicContact CG-CE1 4.21Å; P599-F777 HydrophobicContact CG-CG 4.27Å; P599-F777 HydrophobicContact CG-CZ 4.48Å; L602-F777 HydrophobicContact CD2-CZ 4.46Å; R648-F777 CarbonylContact C-O 3.44Å; R648-F777 WeakPolarHBondContact CA-O 3.26Å; R648-F777 WeakPolarHBondContact CB-O 3.49Å; R648-F777 HydrophobicContact CG-CG 4.36Å; D652-F777 WeakPolarHBondContact OD1-CD1 3.31Å; D652-F777 WeakPolarHBondContact OD2-CE1 3.5Å; N775-F777 HydrophobicContact CB-CD1 4Å; N775-F777 HydrophobicContact CB-CE1 4.05Å
778	W	88.8	Confident	85.6	Confident	128 Å²	128	72 Å²	72	49%	0.485	33%	0.327	S	S	.	.	S	Bend	trans	-116.8	154	177.8	-46.4	104.6	0	0	0	110.7	C776 E780 D781	C776-W778 VanDerWaalsContact C-N 3.28Å; C776-W778 PolarHBondContact O-N 3.32Å; C776-W778 PolarHBondContact SG-O 3.28Å; W778-E780 PolarHBondContact O-N 3.21Å; W778-D781 WeakPolarHBondContact CB-OD2 3.31Å; W778-D781 PolarHBondContact N-OD2 2.7Å; W778-D781 WeakPolarHBondContact O-CB 3.32Å; W778-D781 PolarHBondContact O-N 2.68Å; W778-D781 VanDerWaalsContact O-N 3.13Å
779	M	80.5	Confident	85.6	Confident	99 Å²	99	72.8 Å²	72.8	49%	0.488	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-63.7	-24.3	175.7	-75.6	-66.4	-178.3	0	0	112.4	T649 D781 K782	T649-M779 HydrophobicContact CG2-CE 3.93Å; T649-M779 HydrophobicContact CG2-CG 3.85Å; T649-M779 HydrophobicContact CG2-SD 3.72Å; M779-D781 VanDerWaalsContact C-N 3.32Å; M779-D781 PolarHBondContact O-N 2.86Å; M779-K782 WeakPolarHBondContact O-CB 3Å; M779-K782 PolarHBondContact O-N 3.09Å
780	E	81.3	Confident	85.4	Confident	165 Å²	165	77.4 Å²	77.4	77%	0.771	37%	0.365	S	S	*	.	G	3₁₀ helix	trans	-64	-34.1	174.7	-67.5	158.7	-150.7	0	0	112.1	W778 K782	W778-E780 PolarHBondContact O-N 3.21Å; E780-K782 PolarHBondContact O-N 2.86Å
781	D	81.4	Confident	85	Confident	4 Å²	4	78 Å²	78	2%	0.021	37%	0.368	C	S	.	.	G	3₁₀ helix	trans	-66.1	-21.8	177.8	-59.9	-50.6	0	0	0	112.3	N754 R774 W778 M779 E783 R784	N754-D781 VanDerWaalsContact ND2-CG 3.35Å; N754-D781 PolarHBondContact ND2-OD1 3.18Å; R774-D781 PolarHBondContact NH1-O 2.79Å; R774-D781 PolarHBondContact NH2-O 3.27Å; W778-D781 WeakPolarHBondContact CB-OD2 3.31Å; W778-D781 PolarHBondContact N-OD2 2.7Å; W778-D781 WeakPolarHBondContact O-CB 3.32Å; W778-D781 PolarHBondContact O-N 2.68Å; W778-D781 VanDerWaalsContact O-N 3.13Å; M779-D781 VanDerWaalsContact C-N 3.32Å; M779-D781 PolarHBondContact O-N 2.86Å; D781-E783 VanDerWaalsContact C-N 3.34Å; D781-E783 PolarHBondContact O-N 3.28Å; D781-R784 PolarHBondContact O-N 2.77Å; D781-R784 IonicContact OD1-NH1 3.96Å
782	K	75.5	Confident	84.3	Confident	81 Å²	81	83.5 Å²	83.5	35%	0.352	40%	0.402	S	S	.	.	G	3₁₀ helix	trans	-58	-42.6	-177.8	-170.6	175.2	176.3	178.6	0	112.5	M779 E780 E808	M779-K782 WeakPolarHBondContact O-CB 3Å; M779-K782 PolarHBondContact O-N 3.09Å; E780-K782 PolarHBondContact O-N 2.86Å; K782-E808 IonicContact NZ-OE2 3.18Å; K782-E808 PolarHBondContact NZ-OE2 3.45Å
783	E	75.4	Confident	83.3	Confident	153 Å²	153	84.3 Å²	84.3	72%	0.715	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.8	-8.2	-179.7	-61.5	-168.5	178.3	0	0	113.4	D781 R785	D781-E783 VanDerWaalsContact C-N 3.34Å; D781-E783 PolarHBondContact O-N 3.28Å; E783-R785 PolarHBondContact O-N 3.4Å
784	R	78.3	Confident	82.1	Confident	99 Å²	99	87 Å²	87	37%	0.374	42%	0.421	S	S	.	.			trans	-66	109.1	-175.1	-166.9	176.5	179.1	-171.6	-6.9	112.9	E753 R774 D781 E786	E753-R784 IonicContact OE1-CZ 3.77Å; E753-R784 IonicContact OE1-NH1 2.66Å; E753-R784 PolarHBondContact OE1-NH1 3.41Å; E753-R784 IonicContact OE1-NH2 2.74Å; E753-R784 IonicContact OE2-CZ 2.7Å; E753-R784 IonicContact OE2-NH1 3.73Å; E753-R784 PolarHBondContact OE2-NH1 3.37Å; E753-R784 IonicContact OE2-NH2 3.73Å; E753-R784 PolarHBondContact OE2-NH2 3.48Å; R774-R784 PolarHBondContact NH2-O 2.94Å; D781-R784 PolarHBondContact O-N 2.77Å; D781-R784 IonicContact OD1-NH1 3.96Å; R784-E786 VanDerWaalsContact CD-OE1 3.3Å; R784-E786 WeakPolarHBondContact CD-OE1 3.36Å; R784-E786 HydrophobicContact CG-CG 4.11Å; R784-E786 IonicContact CZ-OE1 2.74Å; R784-E786 IonicContact NE-OE1 3.23Å; R784-E786 PolarHBondContact NE-OE1 3.31Å; R784-E786 IonicContact NH1-OE1 3.31Å; R784-E786 PolarHBondContact O-N 2.92Å
785	R	75.7	Confident	81.2	Confident	251 Å²	251	83.2 Å²	83.2	95%	0.947	42%	0.415	S	S	*	.			trans	-83.1	108.5	172.9	-65.4	-173	-178.2	-168.8	0.7	110.3	E783	E783-R785 PolarHBondContact O-N 3.4Å
786	E	81.9	Confident	80.2	Confident	44 Å²	44	87.7 Å²	87.7	21%	0.206	44%	0.439	C	S	.	.			trans	-102.9	149.8	176.1	-66.4	174.9	-167.7	0	0	110.6	C752 E753 N754 R784 V788	C752-E786 HydrophobicContact CB-CB 4.19Å; C752-E786 WeakPolarHBondContact CB-OE2 3.4Å; C752-E786 PolarHBondContact SG-OE2 2.86Å; E753-E786 PolarHBondContact N-OE2 3.5Å; N754-E786 PolarHBondContact N-OE2 3.4Å; N754-E786 VanDerWaalsContact N-OE2 3.07Å; N754-E786 PolarHBondContact ND2-OE1 2.84Å; R784-E786 VanDerWaalsContact CD-OE1 3.3Å; R784-E786 WeakPolarHBondContact CD-OE1 3.36Å; R784-E786 HydrophobicContact CG-CG 4.11Å; R784-E786 IonicContact CZ-OE1 2.74Å; R784-E786 IonicContact NE-OE1 3.23Å; R784-E786 PolarHBondContact NE-OE1 3.31Å; R784-E786 IonicContact NH1-OE1 3.31Å; R784-E786 PolarHBondContact O-N 2.92Å; E786-V788 PolarHBondContact O-N 3.35Å
787	F	86.2	Confident	79.5	Confident	174 Å²	174	93 Å²	93	76%	0.763	47%	0.466	S	S	*	.			trans	-73.8	114.5	166.1	175	-96.9	0	0	0	108.8	A789	F787-A789 HydrophobicContact CE1-CB 4.4Å
788	V	83.8	Confident	78.6	Confident	62 Å²	62	97.1 Å²	97.1	38%	0.376	49%	0.486	S	S	.	.	P	Polyproline II helix	trans	-92.8	118.6	174.1	179.2	0	0	0	0	108.4	K751 M755 E786	K751-V788 HydrophobicContact CB-CG1 4.13Å; M755-V788 HydrophobicContact SD-CB 4.3Å; M755-V788 HydrophobicContact SD-CG1 3.46Å; M755-V788 WeakPolarHBondContact SD-CG1 3.46Å; M755-V788 HydrophobicContact SD-CG2 3.78Å; E786-V788 PolarHBondContact O-N 3.35Å
789	A	84.8	Confident	77.9	Confident	36 Å²	36	95 Å²	95	30%	0.298	48%	0.481	S	S	.	.	P	Polyproline II helix	trans	-62	139.5	173.4	0	0	0	0	0	111	F787 I791	F787-A789 HydrophobicContact CE1-CB 4.4Å; A789-I791 PolarHBondContact O-N 2.94Å
790	P	84.3	Confident	77.9	Confident	102 Å²	102	93.7 Å²	93.7	66%	0.662	48%	0.475	S	S	*	.	P	Polyproline II helix	trans	-53.4	132.1	-177.8	-28.5	35.2	0	0	0	113.8	V792	P790-V792 PolarHBondContact O-N 2.98Å
791	I	82.1	Confident	77.9	Confident	54 Å²	54	88 Å²	88	28%	0.277	45%	0.45	S	S	.	.			trans	-88.2	97.7	173.9	-53.1	170.3	0	0	0	107.7	K751 V757 A772 A789 I793	K751-I791 HydrophobicContact CG-CG1 4.25Å; V757-I791 HydrophobicContact CG1-CD1 4.43Å; V757-I791 HydrophobicContact CG1-CG2 4.26Å; V757-I791 HydrophobicContact CG2-CD1 3.6Å; V757-I791 HydrophobicContact CG2-CG1 4.13Å; A772-I791 HydrophobicContact CB-CD1 4.25Å; A789-I791 PolarHBondContact O-N 2.94Å; I791-I793 HydrophobicContact CG2-CD1 4.22Å; I791-I793 HydrophobicContact CG2-CG1 3.98Å
792	V	77.2	Confident	78.1	Confident	128 Å²	128	89.5 Å²	89.5	78%	0.776	46%	0.456	S	S	*	.			trans	-84.1	121.5	176.9	-176.2	0	0	0	0	109.3	P790	P790-V792 PolarHBondContact O-N 2.98Å
793	I	70.9	Confident	78.7	Confident	71 Å²	71	88.9 Å²	88.9	36%	0.364	45%	0.454	S	S	.	.			trans	-117.2	122	-176.3	-57.7	174.8	0	0	0	108.7	I770 I791 G795	I770-I793 HydrophobicContact CD1-CB 4.14Å; I770-I793 HydrophobicContact CD1-CD1 3.68Å; I770-I793 HydrophobicContact CD1-CG1 3.69Å; I770-I793 HydrophobicContact CD1-CG2 3.43Å; I770-I793 VanDerWaalsContact CD1-CG2 3.43Å; I770-I793 HydrophobicContact CG2-CD1 4.36Å; I791-I793 HydrophobicContact CG2-CD1 4.22Å; I791-I793 HydrophobicContact CG2-CG1 3.98Å; I793-G795 PolarHBondContact O-N 3.26Å
794	A	69	Low	79.4	Confident	65 Å²	65	83.3 Å²	83.3	54%	0.537	44%	0.438	S	S	.	.			trans	-82.9	101.5	171.3	0	0	0	0	0	109.7
795	G	72.1	Confident	79.9	Confident	26 Å²	26	80.5 Å²	80.5	27%	0.268	44%	0.436	S	S	.	.	S	Bend	trans	162.1	173.4	-177.7	0	0	0	0	0	113.8	I793	I793-G795 PolarHBondContact O-N 3.26Å
796	N	72.4	Confident	80.7	Confident	93 Å²	93	69 Å²	69	50%	0.497	39%	0.393	S	S	.	.	B	Isolated β-bridge	trans	-91.8	126.4	161.8	-70.2	-14	0	0	0	106.9	E798 S854	N796-E798 PolarHBondContact O-N 3.33Å; N796-S854 PolarHBondContact N-O 3.5Å; N796-S854 PolarHBondContact O-N 2.93Å
797	L	75.7	Confident	80.8	Confident	117 Å²	117	71.6 Å²	71.6	61%	0.613	41%	0.405	S	S	*	.			trans	-65.5	90.6	165.8	-171.8	85.4	0	0	0	107.7	E799 I800 V853	L797-E799 VanDerWaalsContact C-N 3.33Å; L797-I800 HydrophobicContact CD2-CD1 4.41Å; L797-I800 HydrophobicContact CD2-CG1 4.25Å; L797-V853 HydrophobicContact CD1-CG2 3.52Å; L797-V853 HydrophobicContact CG-CG2 4.39Å
798	E	73.7	Confident	80.7	Confident	88 Å²	88	66.6 Å²	66.6	41%	0.411	38%	0.384	S	S	.	.			trans	-66.2	-38.9	173.9	-83.6	180	169.7	0	0	110	N796 S852 S854 R860	N796-E798 PolarHBondContact O-N 3.33Å; E798-S852 WeakPolarHBondContact CB-O 3.12Å; E798-S854 PolarHBondContact OE1-OG 3.25Å; E798-S854 WeakPolarHBondContact OE2-CB 3.38Å; E798-S854 PolarHBondContact OE2-OG 3.18Å; E798-R860 IonicContact OE1-CZ 3.93Å; E798-R860 IonicContact OE1-NH1 2.83Å; E798-R860 PolarHBondContact OE1-NH1 2.98Å; E798-R860 IonicContact OE1-NH2 3.86Å; E798-R860 PolarHBondContact OE1-NH2 3.48Å; E798-R860 IonicContact OE2-NH1 3.79Å
799	E	74.7	Confident	80.5	Confident	83 Å²	83	67.7 Å²	67.7	39%	0.388	38%	0.384	S	S	.	.			trans	-173.5	172.7	-168.7	-124.1	-169.6	151.5	0	0	112.2	L797 M850 A851 S852 V853	L797-E799 VanDerWaalsContact C-N 3.33Å; E799-M850 VanDerWaalsContact CG-O 3.25Å; E799-M850 WeakPolarHBondContact CG-O 3.31Å; E799-A851 CarbonylContact C-O 3.35Å; E799-A851 VanDerWaalsContact CD-C 3.49Å; E799-A851 VanDerWaalsContact CD-CB 3.49Å; E799-A851 VanDerWaalsContact CD-N 3.34Å; E799-A851 WeakPolarHBondContact OE1-CA 3.44Å; E799-A851 WeakPolarHBondContact OE1-CB 3.48Å; E799-A851 PolarHBondContact OE1-N 2.81Å; E799-A851 VanDerWaalsContact OE2-C 3.26Å; E799-A851 WeakPolarHBondContact OE2-CA 3.43Å; E799-A851 WeakPolarHBondContact OE2-CB 3.3Å; E799-S852 VanDerWaalsContact CB-N 3.25Å; E799-S852 WeakPolarHBondContact CB-O 3.48Å; E799-S852 PolarHBondContact N-O 3.43Å; E799-S852 PolarHBondContact OE2-N 3.39Å; E799-V853 WeakPolarHBondContact O-CG2 3.21Å
800	I	79.9	Confident	79.6	Confident	71 Å²	71	74.8 Å²	74.8	36%	0.364	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	102.8	-174.8	-52.7	173.1	0	0	0	114	L797 Y802 E803 M850 A851	L797-I800 HydrophobicContact CD2-CD1 4.41Å; L797-I800 HydrophobicContact CD2-CG1 4.25Å; I800-Y802 PolarHBondContact O-N 2.74Å; I800-Y802 VanDerWaalsContact O-N 3.1Å; I800-E803 HydrophobicContact CG2-CG 3.88Å; I800-M850 CarbonylContact C-O 3.47Å; I800-M850 VanDerWaalsContact CA-O 3.27Å; I800-M850 WeakPolarHBondContact CA-O 3.49Å; I800-M850 PolarHBondContact N-O 2.99Å; I800-M850 CarbonylContact O-C 3.45Å; I800-M850 PolarHBondContact O-N 2.9Å; I800-A851 CarbonylContact C-O 3.59Å; I800-A851 WeakPolarHBondContact CA-O 3.27Å; I800-A851 PolarHBondContact N-O 3.29Å
801	L	81.6	Confident	78.1	Confident	46 Å²	46	71.3 Å²	71.3	24%	0.241	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-52	-51.3	-161.5	-78.6	175.6	0	0	0	113.7	M734 V769 M850 A851	M734-L801 HydrophobicContact CG-CD1 4.07Å; V769-L801 HydrophobicContact CB-CD1 4.44Å; V769-L801 HydrophobicContact CG1-CD1 3.45Å; V769-L801 VanDerWaalsContact CG1-CD1 3.45Å; V769-L801 HydrophobicContact CG2-CD1 4.07Å; L801-M850 PolarHBondContact O-N 3.37Å; L801-A851 WeakPolarHBondContact CA-O 3.35Å; L801-A851 VanDerWaalsContact CD2-C 3.48Å; L801-A851 HydrophobicContact CD2-CB 4.05Å; L801-A851 WeakPolarHBondContact CD2-O 3.23Å; L801-A851 WeakPolarHBondContact CG-O 3.45Å; L801-A851 PolarHBondContact N-O 3.23Å
802	Y	85.3	Confident	76.7	Confident	36 Å²	36	75.6 Å²	75.6	14%	0.141	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.7	150.8	161.6	56.1	-83.7	0	0	0	110.1	T658 A730 V731 M734 I800 L847 K848	T658-Y802 VanDerWaalsContact CG2-OH 3.26Å; T658-Y802 WeakPolarHBondContact CG2-OH 3.43Å; T658-Y802 PolarHBondContact OG1-OH 2.68Å; A730-Y802 HydrophobicContact CB-CD1 3.94Å; A730-Y802 HydrophobicContact CB-CE1 4.38Å; A730-Y802 HydrophobicContact CB-CG 4.04Å; V731-Y802 HydrophobicContact CG2-CE2 4.37Å; M734-Y802 HydrophobicContact CB-CE1 4.07Å; M734-Y802 HydrophobicContact CG-CE1 4.4Å; M734-Y802 HydrophobicContact SD-CE1 3.75Å; M734-Y802 PolarHBondContact SD-OH 2.71Å; M734-Y802 VanDerWaalsContact SD-OH 3.38Å; I800-Y802 PolarHBondContact O-N 2.74Å; I800-Y802 VanDerWaalsContact O-N 3.1Å; Y802-L847 HydrophobicContact CD2-CD1 3.92Å; Y802-L847 HydrophobicContact CG-CD1 4.27Å; Y802-K848 CarbonylContact C-O 3.58Å; Y802-K848 WeakPolarHBondContact CA-O 3.4Å; Y802-K848 WeakPolarHBondContact CB-O 3.15Å
803	E	88.7	Confident	75.2	Confident	67 Å²	67	80.3 Å²	80.3	31%	0.313	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	121.7	161.4	-65.9	163.7	-156.5	0	0	106.7	I800 L847 K848	I800-E803 HydrophobicContact CG2-CG 3.88Å; E803-L847 CarbonylContact O-C 3.58Å; E803-L847 WeakPolarHBondContact O-CA 3.09Å; E803-K848 HydrophobicContact CB-CB 4.43Å; E803-K848 VanDerWaalsContact CD-NZ 3.32Å; E803-K848 PolarHBondContact N-O 2.99Å; E803-K848 PolarHBondContact O-N 3.2Å; E803-K848 IonicContact OE1-NZ 3.29Å; E803-K848 PolarHBondContact OE1-NZ 3.1Å; E803-K848 WeakPolarHBondContact OE2-CD 3.4Å; E803-K848 IonicContact OE2-NZ 2.85Å; E803-K848 PolarHBondContact OE2-NZ 3.29Å; E803-K848 VanDerWaalsContact OE2-NZ 3.1Å
804	G	89.1	Confident	73.8	Confident	37 Å²	37	80.4 Å²	80.4	38%	0.381	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	132.3	-176.8	0	0	0	0	0	112.2	F846	G804-F846 WeakPolarHBondContact CA-O 3.46Å
805	A	90	Very high	72.3	Confident	40 Å²	40	84.4 Å²	84.4	33%	0.331	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	132.1	173.3	0	0	0	0	0	110.6	F846	A805-F846 PolarHBondContact N-O 3.27Å; A805-F846 WeakPolarHBondContact O-CB 3.39Å; A805-F846 PolarHBondContact O-N 2.91Å
806	L	90.6	Very high	70.6	Confident	8 Å²	8	91 Å²	91	4%	0.042	47%	0.469	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	125.6	168.9	-168.1	72.9	0	0	0	109.1	P650 L676 V724 Y843 L845	P650-L806 HydrophobicContact CB-CD2 4.25Å; P650-L806 WeakPolarHBondContact O-CD2 3.45Å; L676-L806 HydrophobicContact CD1-CD1 4.19Å; L676-L806 HydrophobicContact CD1-CD2 3.67Å; L676-L806 HydrophobicContact CD2-CD2 4.12Å; V724-L806 HydrophobicContact CG1-CD1 3.93Å; V724-L806 HydrophobicContact CG1-CD2 4.31Å; L806-Y843 HydrophobicContact CD2-CD1 3.89Å; L806-Y843 HydrophobicContact CD2-CG 3.87Å; L806-Y843 HydrophobicContact CG-CD1 4.03Å; L806-Y843 HydrophobicContact CG-CG 4.17Å; L806-L845 HydrophobicContact CD1-CB 4.3Å
807	Q	85.6	Confident	69	Low	99 Å²	99	90.6 Å²	90.6	46%	0.463	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	154.1	-179.3	-60.1	-172.4	25.6	0	0	110.6	Y843 E844	Q807-Y843 CarbonylContact O-C 3.42Å; Q807-Y843 VanDerWaalsContact O-CA 3.25Å; Q807-Y843 WeakPolarHBondContact O-CA 3.31Å; Q807-E844 PolarHBondContact N-O 2.89Å; Q807-E844 PolarHBondContact O-N 3.34Å
808	E	83.5	Confident	66.9	Low	70 Å²	70	92.6 Å²	92.6	33%	0.327	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	131.6	174.4	-171.8	-179.4	177	0	0	109.6	K782 K810 Y843	K782-E808 IonicContact NZ-OE2 3.18Å; K782-E808 PolarHBondContact NZ-OE2 3.45Å; E808-K810 PolarHBondContact O-N 3.13Å; E808-Y843 HydrophobicContact CB-CE1 4.4Å
809	K	79.1	Confident	65.2	Low	84 Å²	84	92.4 Å²	92.4	37%	0.365	49%	0.485	S	S	.	.	P	Polyproline II helix	trans	-62.5	119.1	-177.6	-74.3	177.4	179.1	164.8	0	110.6	T841 E842 Y843 E844	K809-T841 WeakPolarHBondContact CD-O 3.26Å; K809-T841 WeakPolarHBondContact CE-O 3.48Å; K809-T841 PolarHBondContact NZ-O 3.36Å; K809-E842 WeakPolarHBondContact CB-O 3.41Å; K809-E842 PolarHBondContact N-O 3.41Å; K809-Y843 VanDerWaalsContact CE-O 3.25Å; K809-Y843 WeakPolarHBondContact CE-O 3.37Å; K809-E844 HydrophobicContact CG-CB 3.85Å
810	K	66.6	Low	63.2	Low	186 Å²	186	96.4 Å²	96.4	81%	0.809	50%	0.501	S	S	*	.	P	Polyproline II helix	trans	-74.5	126.6	174.8	-65.2	177.3	-176.6	171.7	0	109.3	E808	E808-K810 PolarHBondContact O-N 3.13Å
811	S	53.4	Low	60.9	Low	29 Å²	29	98.8 Å²	98.8	20%	0.203	52%	0.519	C	S	.	.	P	Polyproline II helix	trans	-64.5	145.8	173.1	83.6	0	0	0	0	110.5	R813 G814 Q815	S811-R813 PolarHBondContact O-N 3.27Å; S811-G814 PolarHBondContact O-N 2.85Å; S811-G814 VanDerWaalsContact O-N 3.16Å; S811-Q815 PolarHBondContact OG-O 3.21Å
812	P	51.6	Low	58.5	Low	143 Å²	143	101.7 Å²	101.7	93%	0.929	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-10.7	-179.9	-26.8	35.2	0	0	0	115.6
813	R	45.5	Very low	55.8	Low	228 Å²	228	105.8 Å²	105.8	86%	0.86	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.7	13.2	-178.7	-73.9	-171.8	172.2	-177	-1.4	114.3	S811 Q815	S811-R813 PolarHBondContact O-N 3.27Å; R813-Q815 PolarHBondContact O-N 3.38Å
814	G	42.5	Very low	53.4	Low	73 Å²	73	110.2 Å²	110.2	75%	0.753	58%	0.579	S	S	*	*	S	Bend	trans	68.8	-5.6	173.3	0	0	0	0	0	115.5	S811 K816	S811-G814 PolarHBondContact O-N 2.85Å; S811-G814 VanDerWaalsContact O-N 3.16Å; G814-K816 PolarHBondContact O-N 2.93Å
815	Q	37.1	Very low	50.6	Low	149 Å²	149	118 Å²	118	70%	0.696	60%	0.602	S	S	*	*			trans	-59.1	122.6	159.1	-72.7	-178.9	-24.8	0	0	107	S811 R813 I817	S811-Q815 PolarHBondContact OG-O 3.21Å; R813-Q815 PolarHBondContact O-N 3.38Å; Q815-I817 PolarHBondContact O-N 3.48Å; Q815-I817 VanDerWaalsContact O-N 3.14Å
816	K	35.7	Very low	47.6	Very low	165 Å²	165	119.4 Å²	119.4	72%	0.717	61%	0.609	S	S	*	*			trans	-46.4	127.3	155.6	-74.9	-171.3	174.2	-170.6	0	104.9	G814 Q818	G814-K816 PolarHBondContact O-N 2.93Å; K816-Q818 PolarHBondContact O-N 2.8Å
817	I	39.3	Very low	44.7	Very low	83 Å²	83	127.4 Å²	127.4	43%	0.426	64%	0.639	S	S	.	*			trans	-59.5	101.1	153.9	-61.1	176	0	0	0	101.4	Q815 A819	Q815-I817 PolarHBondContact O-N 3.48Å; Q815-I817 VanDerWaalsContact O-N 3.14Å; I817-A819 VanDerWaalsContact C-N 3.35Å; I817-A819 PolarHBondContact O-N 2.67Å
818	Q	31.5	Very low	42.2	Very low	160 Å²	160	127.6 Å²	127.6	75%	0.748	66%	0.657	S	S	*	*			trans	-55.3	117.9	164	-76.3	-179.5	-12.4	0	0	102.4	K816 K820	K816-Q818 PolarHBondContact O-N 2.8Å; Q818-K820 PolarHBondContact O-N 3.39Å
819	A	37.5	Very low	39.5	Very low	83 Å²	83	129.3 Å²	129.3	69%	0.686	68%	0.677	S	S	*	*			trans	-49.7	97.8	155.2	0	0	0	0	0	103.1	I817 T821	I817-A819 VanDerWaalsContact C-N 3.35Å; I817-A819 PolarHBondContact O-N 2.67Å; A819-T821 VanDerWaalsContact C-N 3.33Å; A819-T821 PolarHBondContact O-N 3.04Å
820	K	32.6	Very low	37.3	Very low	168 Å²	168	132 Å²	132	73%	0.73	69%	0.694	S	S	*	*			trans	-58.1	113.9	179.6	-82.6	179.7	176.2	175.4	0	101.2	Q818 I822	Q818-K820 PolarHBondContact O-N 3.39Å; K820-I822 WeakPolarHBondContact O-CG1 3.32Å; K820-I822 PolarHBondContact O-N 3.3Å
821	T	31.7	Very low	35.7	Very low	120 Å²	120	128 Å²	128	74%	0.736	69%	0.69	S	S	*	*			trans	-48.6	103.9	150.7	-29.8	0	0	0	0	102	A819 N823	A819-T821 VanDerWaalsContact C-N 3.33Å; A819-T821 PolarHBondContact O-N 3.04Å; T821-N823 PolarHBondContact O-N 3.24Å
822	I	31.7	Very low	34.8	Very low	108 Å²	108	135.6 Å²	135.6	55%	0.554	72%	0.722	S	S	*	*			trans	-72.5	83.3	-174.6	-61.9	-178.3	0	0	0	103	K820 E824	K820-I822 WeakPolarHBondContact O-CG1 3.32Å; K820-I822 PolarHBondContact O-N 3.3Å; I822-E824 WeakPolarHBondContact O-CA 3.49Å; I822-E824 PolarHBondContact O-N 3Å
823	N	28.7	Very low	34.7	Very low	121 Å²	121	136.8 Å²	136.8	65%	0.647	72%	0.715	S	S	*	*			trans	-50.5	114	173	-79	-21.7	0	0	0	104.1	T821 K825 S826	T821-N823 PolarHBondContact O-N 3.24Å; N823-K825 PolarHBondContact O-N 3.46Å; N823-S826 PolarHBondContact O-N 3.15Å
824	E	37.5	Very low	35.5	Very low	160 Å²	160	128.3 Å²	128.3	75%	0.748	69%	0.69	S	S	*	*	G	3₁₀ helix	trans	-59	-16.8	-154.1	-62	167.3	129.6	0	0	113	I822 S826	I822-E824 WeakPolarHBondContact O-CA 3.49Å; I822-E824 PolarHBondContact O-N 3Å; E824-S826 VanDerWaalsContact C-N 3.33Å; E824-S826 PolarHBondContact O-N 3.19Å
825	K	30.1	Very low	37	Very low	202 Å²	202	129.2 Å²	129.2	88%	0.878	68%	0.681	S	S	*	*	G	3₁₀ helix	trans	-64.4	-19.1	172.6	-59.3	-175.5	177.7	-178.9	0	115.5	N823	N823-K825 PolarHBondContact O-N 3.46Å
826	S	27.4	Very low	39.1	Very low	69 Å²	69	125.5 Å²	125.5	48%	0.483	66%	0.661	S	S	.	*	G	3₁₀ helix	trans	-90.2	7.2	178.2	82.8	0	0	0	0	114.8	N823 E824 A828	N823-S826 PolarHBondContact O-N 3.15Å; E824-S826 VanDerWaalsContact C-N 3.33Å; E824-S826 PolarHBondContact O-N 3.19Å; S826-A828 VanDerWaalsContact C-N 3.29Å
827	R	31.3	Very low	41.3	Very low	176 Å²	176	118.3 Å²	118.3	66%	0.664	63%	0.631	S	S	*	*	G	3₁₀ helix	trans	-75.1	-12.5	174.6	-100.1	179.2	166.9	161.8	-6.6	114.3	S829	R827-S829 VanDerWaalsContact C-N 3.25Å; R827-S829 PolarHBondContact O-N 2.89Å
828	A	32	Very low	43.2	Very low	102 Å²	102	118.8 Å²	118.8	84%	0.843	64%	0.638	S	S	*	*	G	3₁₀ helix	trans	-77.2	3.3	-173.8	0	0	0	0	0	115.7	S826	S826-A828 VanDerWaalsContact C-N 3.29Å
829	S	27.4	Very low	45.7	Very low	106 Å²	106	112.2 Å²	112.2	74%	0.741	61%	0.613	S	S	*	*	G	3₁₀ helix	trans	-141.4	31.6	-175.5	74.1	0	0	0	0	114.4	R827	R827-S829 VanDerWaalsContact C-N 3.25Å; R827-S829 PolarHBondContact O-N 2.89Å
830	I	31.7	Very low	47.9	Very low	142 Å²	142	110.3 Å²	110.3	73%	0.728	59%	0.59	S	S	*	*			trans	-86.8	110.7	161.5	-63	179.2	0	0	0	106.8
831	S	32.5	Very low	50.3	Low	102 Å²	102	106.3 Å²	106.3	71%	0.713	58%	0.58	S	S	*	*			trans	-58.8	137.6	175.1	48.6	0	0	0	0	111.9
832	E	36.3	Very low	52.8	Low	187 Å²	187	103.9 Å²	103.9	87%	0.874	56%	0.56	S	S	*	*	S	Bend	trans	43.4	96	164.1	-63.2	-175.3	166.9	0	0	115.4	S834	E832-S834 PolarHBondContact O-N 3.46Å; E832-S834 VanDerWaalsContact O-N 3.08Å
833	E	49.7	Very low	55.5	Low	168 Å²	168	99.9 Å²	99.9	79%	0.785	54%	0.538	S	S	*	.			trans	-49.7	115.6	177.8	-65.3	178.9	143.3	0	0	111.7	V835	E833-V835 PolarHBondContact O-N 3.29Å
834	S	61.4	Low	58.2	Low	50 Å²	50	100 Å²	100	35%	0.35	54%	0.535	S	S	.	.			trans	-63.4	123	-179.2	65.7	0	0	0	0	110	E832 Y836	E832-S834 PolarHBondContact O-N 3.46Å; E832-S834 VanDerWaalsContact O-N 3.08Å; S834-Y836 PolarHBondContact O-N 2.86Å; S834-Y836 PolarHBondContact OG-O 3.47Å
835	V	74.8	Confident	60.7	Low	92 Å²	92	93.9 Å²	93.9	56%	0.558	51%	0.507	S	S	*	.	S	Bend	trans	-57.2	-8.7	175.7	-179.7	0	0	0	0	112.9	K692 L693 E833	K692-V835 CarbonylContact C-O 3.44Å; K692-V835 VanDerWaalsContact CA-O 3.31Å; K692-V835 WeakPolarHBondContact CA-O 3.4Å; L693-V835 PolarHBondContact N-O 2.69Å; E833-V835 PolarHBondContact O-N 3.29Å
836	Y	81.3	Confident	63.5	Low	72 Å²	72	89.3 Å²	89.3	28%	0.282	49%	0.488	S	S	.	.	B	Isolated β-bridge	trans	-114.7	148.8	-176.7	-60.8	-83.6	0	0	0	113.4	L693 S834 T838	L693-Y836 HydrophobicContact CB-CD1 3.9Å; L693-Y836 HydrophobicContact CB-CE1 4.09Å; L693-Y836 CarbonylContact O-C 3.54Å; L693-Y836 WeakPolarHBondContact O-CA 3.44Å; S834-Y836 PolarHBondContact O-N 2.86Å; S834-Y836 PolarHBondContact OG-O 3.47Å; Y836-T838 PolarHBondContact O-N 3.17Å
837	V	81.1	Confident	66.2	Low	13 Å²	13	87.4 Å²	87.4	8%	0.079	47%	0.472	C	S	.	.			trans	-70.6	113	169.5	-176.9	0	0	0	0	108.4	V677 K692 L693	V677-V837 HydrophobicContact CB-CG1 4.44Å; V677-V837 HydrophobicContact CG1-CG1 3.85Å; V677-V837 HydrophobicContact CG2-CG1 3.7Å; K692-V837 HydrophobicContact CB-CG2 3.62Å; L693-V837 PolarHBondContact O-N 3.01Å
838	T	79.2	Confident	68.6	Low	93 Å²	93	82.7 Å²	82.7	57%	0.571	46%	0.456	S	S	*	.			trans	-112.6	139.4	177.4	47.6	0	0	0	0	110.1	Y836	Y836-T838 PolarHBondContact O-N 3.17Å
839	G	83.3	Confident	70.3	Confident	22 Å²	22	81.2 Å²	81.2	23%	0.227	43%	0.432	C	S	.	.			trans	-99.7	179.5	177.6	0	0	0	0	0	113.1	E675 T841	E675-G839 WeakPolarHBondContact O-CA 3.47Å; G839-T841 PolarHBondContact O-N 2.89Å
840	Q	84.9	Confident	71.4	Confident	43 Å²	43	81.5 Å²	81.5	20%	0.201	42%	0.423	C	S	.	.			trans	-64.4	125.6	180	-75	179.2	-7.4	0	0	111.6	L676 S678 E842 Y843	L676-Q840 HydrophobicContact CB-CB 4.08Å; L676-Q840 PolarHBondContact O-N 3.13Å; S678-Q840 PolarHBondContact OG-NE2 3Å; Q840-E842 WeakPolarHBondContact CA-OE2 3.32Å; Q840-E842 WeakPolarHBondContact CB-OE1 3.25Å; Q840-E842 WeakPolarHBondContact CB-OE2 3.48Å; Q840-E842 VanDerWaalsContact CD-OE1 3.27Å; Q840-E842 VanDerWaalsContact CG-OE1 3.29Å; Q840-E842 WeakPolarHBondContact CG-OE1 3.47Å; Q840-Y843 HydrophobicContact CB-CD2 4.16Å; Q840-Y843 HydrophobicContact CB-CE2 4.42Å
841	T	82.4	Confident	71.9	Confident	85 Å²	85	76.7 Å²	76.7	52%	0.521	40%	0.404	S	S	.	.			trans	-106.5	-5.1	-176.8	59.8	0	0	0	0	113	K809 G839 Y843	K809-T841 WeakPolarHBondContact CD-O 3.26Å; K809-T841 WeakPolarHBondContact CE-O 3.48Å; K809-T841 PolarHBondContact NZ-O 3.36Å; G839-T841 PolarHBondContact O-N 2.89Å; T841-Y843 PolarHBondContact O-N 2.97Å
842	E	84.2	Confident	72.6	Confident	68 Å²	68	72.9 Å²	72.9	32%	0.318	38%	0.378	S	S	.	.	S	Bend	trans	-73.6	-7.4	176.4	67.1	-85.4	-158	0	0	113.6	K809 Q840	K809-E842 WeakPolarHBondContact CB-O 3.41Å; K809-E842 PolarHBondContact N-O 3.41Å; Q840-E842 WeakPolarHBondContact CA-OE2 3.32Å; Q840-E842 WeakPolarHBondContact CB-OE1 3.25Å; Q840-E842 WeakPolarHBondContact CB-OE2 3.48Å; Q840-E842 VanDerWaalsContact CD-OE1 3.27Å; Q840-E842 VanDerWaalsContact CG-OE1 3.29Å; Q840-E842 WeakPolarHBondContact CG-OE1 3.47Å
843	Y	87.3	Confident	73.1	Confident	24 Å²	24	64.8 Å²	64.8	9%	0.094	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	151.1	174.5	-62.5	-86.1	0	0	0	112.5	P650 V651 L676 L806 Q807 E808 K809 Q840 T841	P650-Y843 HydrophobicContact CB-CD2 4.01Å; P650-Y843 HydrophobicContact CB-CE1 4.24Å; P650-Y843 HydrophobicContact CB-CE2 3.65Å; P650-Y843 HydrophobicContact CB-CG 4.48Å; P650-Y843 HydrophobicContact CG-CD2 4.39Å; P650-Y843 HydrophobicContact CG-CE2 3.58Å; V651-Y843 HydrophobicContact CG2-CD1 4.26Å; V651-Y843 HydrophobicContact CG2-CE1 3.8Å; L676-Y843 HydrophobicContact CD1-CD2 4.26Å; L676-Y843 HydrophobicContact CD1-CG 4.33Å; L806-Y843 HydrophobicContact CD2-CD1 3.89Å; L806-Y843 HydrophobicContact CD2-CG 3.87Å; L806-Y843 HydrophobicContact CG-CD1 4.03Å; L806-Y843 HydrophobicContact CG-CG 4.17Å; Q807-Y843 CarbonylContact O-C 3.42Å; Q807-Y843 VanDerWaalsContact O-CA 3.25Å; Q807-Y843 WeakPolarHBondContact O-CA 3.31Å; E808-Y843 HydrophobicContact CB-CE1 4.4Å; K809-Y843 VanDerWaalsContact CE-O 3.25Å; K809-Y843 WeakPolarHBondContact CE-O 3.37Å; Q840-Y843 HydrophobicContact CB-CD2 4.16Å; Q840-Y843 HydrophobicContact CB-CE2 4.42Å; T841-Y843 PolarHBondContact O-N 2.97Å
844	E	87.3	Confident	73.2	Confident	123 Å²	123	56.9 Å²	56.9	58%	0.575	30%	0.304	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.6	132.8	174.8	-178.8	169.6	-159.7	0	0	109.5	Q807 K809	Q807-E844 PolarHBondContact N-O 2.89Å; Q807-E844 PolarHBondContact O-N 3.34Å; K809-E844 HydrophobicContact CG-CB 3.85Å
845	L	89.8	Confident	73.1	Confident	32 Å²	32	54.7 Å²	54.7	17%	0.168	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	114.8	177.4	175.2	67.3	0	0	0	110.5	L654 R726 L806 L847	L654-L845 HydrophobicContact CD2-CD1 3.64Å; R726-L845 HydrophobicContact CB-CD2 4.03Å; L806-L845 HydrophobicContact CD1-CB 4.3Å; L845-L847 HydrophobicContact CD2-CB 4.24Å; L845-L847 HydrophobicContact CG-CB 4.16Å
846	F	87.7	Confident	72.6	Confident	106 Å²	106	51.6 Å²	51.6	47%	0.465	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	121.8	158.9	178.2	-94.8	0	0	0	108.8	G804 A805 K848	G804-F846 WeakPolarHBondContact CA-O 3.46Å; A805-F846 PolarHBondContact N-O 3.27Å; A805-F846 WeakPolarHBondContact O-CB 3.39Å; A805-F846 PolarHBondContact O-N 2.91Å; F846-K848 HydrophobicContact CZ-CB 4.45Å
847	L	85.3	Confident	72.2	Confident	30 Å²	30	55.1 Å²	55.1	16%	0.157	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	131.6	174.2	-169.8	76.5	0	0	0	110.8	R726 A730 Y802 E803 L845 E849	R726-L847 HydrophobicContact CG-CD2 3.72Å; A730-L847 HydrophobicContact CB-CD1 4.45Å; A730-L847 HydrophobicContact CB-CD2 4.17Å; Y802-L847 HydrophobicContact CD2-CD1 3.92Å; Y802-L847 HydrophobicContact CG-CD1 4.27Å; E803-L847 CarbonylContact O-C 3.58Å; E803-L847 WeakPolarHBondContact O-CA 3.09Å; L845-L847 HydrophobicContact CD2-CB 4.24Å; L845-L847 HydrophobicContact CG-CB 4.16Å; L847-E849 HydrophobicContact CD2-CG 4.04Å; L847-E849 HydrophobicContact CG-CG 4.19Å
848	K	81.7	Confident	71.8	Confident	77 Å²	77	60.6 Å²	60.6	34%	0.335	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	123	175.4	172.3	-174.3	160.2	-142.5	0	108.3	Y802 E803 F846 M850	Y802-K848 CarbonylContact C-O 3.58Å; Y802-K848 WeakPolarHBondContact CA-O 3.4Å; Y802-K848 WeakPolarHBondContact CB-O 3.15Å; E803-K848 HydrophobicContact CB-CB 4.43Å; E803-K848 VanDerWaalsContact CD-NZ 3.32Å; E803-K848 PolarHBondContact N-O 2.99Å; E803-K848 PolarHBondContact O-N 3.2Å; E803-K848 IonicContact OE1-NZ 3.29Å; E803-K848 PolarHBondContact OE1-NZ 3.1Å; E803-K848 WeakPolarHBondContact OE2-CD 3.4Å; E803-K848 IonicContact OE2-NZ 2.85Å; E803-K848 PolarHBondContact OE2-NZ 3.29Å; E803-K848 VanDerWaalsContact OE2-NZ 3.1Å; F846-K848 HydrophobicContact CZ-CB 4.45Å; K848-M850 HydrophobicContact CG-CE 4.26Å; K848-M850 HydrophobicContact CG-SD 4.38Å
849	E	67.1	Low	71.8	Confident	71 Å²	71	57.3 Å²	57.3	33%	0.332	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	116.6	-172.4	-58.3	175.5	-125.5	0	0	110.7	R726 R733 L847	R726-E849 IonicContact CZ-OE1 3.44Å; R726-E849 IonicContact NE-OE1 2.69Å; R726-E849 IonicContact NH2-OE1 3.34Å; R726-E849 PolarHBondContact NH2-OE1 3.2Å; R733-E849 IonicContact CZ-OE2 2.77Å; R733-E849 IonicContact NE-OE2 3.65Å; R733-E849 IonicContact NH2-OE1 3.15Å; R733-E849 PolarHBondContact NH2-OE1 2.91Å; R733-E849 IonicContact NH2-OE2 3.62Å; R733-E849 PolarHBondContact NH2-OE2 3.47Å; L847-E849 HydrophobicContact CD2-CG 4.04Å; L847-E849 HydrophobicContact CG-CG 4.19Å
850	M	50.6	Low	71.3	Confident	111 Å²	111	59.6 Å²	59.6	55%	0.547	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	77	-177.1	-62.6	-175.1	175	0	0	112.5	E799 I800 L801 K848	E799-M850 VanDerWaalsContact CG-O 3.25Å; E799-M850 WeakPolarHBondContact CG-O 3.31Å; I800-M850 CarbonylContact C-O 3.47Å; I800-M850 VanDerWaalsContact CA-O 3.27Å; I800-M850 WeakPolarHBondContact CA-O 3.49Å; I800-M850 PolarHBondContact N-O 2.99Å; I800-M850 CarbonylContact O-C 3.45Å; I800-M850 PolarHBondContact O-N 2.9Å; L801-M850 PolarHBondContact O-N 3.37Å; K848-M850 HydrophobicContact CG-CE 4.26Å; K848-M850 HydrophobicContact CG-SD 4.38Å
851	A	42.9	Very low	71.1	Confident	41 Å²	41	61.8 Å²	61.8	34%	0.339	31%	0.305	S	S	.	.			trans	-16	-128.6	-160.9	0	0	0	0	0	127.4	E799 I800 L801	E799-A851 CarbonylContact C-O 3.35Å; E799-A851 VanDerWaalsContact CD-C 3.49Å; E799-A851 VanDerWaalsContact CD-CB 3.49Å; E799-A851 VanDerWaalsContact CD-N 3.34Å; E799-A851 WeakPolarHBondContact OE1-CA 3.44Å; E799-A851 WeakPolarHBondContact OE1-CB 3.48Å; E799-A851 PolarHBondContact OE1-N 2.81Å; E799-A851 VanDerWaalsContact OE2-C 3.26Å; E799-A851 WeakPolarHBondContact OE2-CA 3.43Å; E799-A851 WeakPolarHBondContact OE2-CB 3.3Å; I800-A851 CarbonylContact C-O 3.59Å; I800-A851 WeakPolarHBondContact CA-O 3.27Å; I800-A851 PolarHBondContact N-O 3.29Å; L801-A851 WeakPolarHBondContact CA-O 3.35Å; L801-A851 VanDerWaalsContact CD2-C 3.48Å; L801-A851 HydrophobicContact CD2-CB 4.05Å; L801-A851 WeakPolarHBondContact CD2-O 3.23Å; L801-A851 WeakPolarHBondContact CG-O 3.45Å; L801-A851 PolarHBondContact N-O 3.23Å
852	S	45.8	Very low	71.1	Confident	22 Å²	22	57.8 Å²	57.8	15%	0.154	28%	0.28	C	S	.	.			trans	-108.7	155.8	-152.9	69.9	0	0	0	0	121.5	E798 E799	E798-S852 WeakPolarHBondContact CB-O 3.12Å; E799-S852 VanDerWaalsContact CB-N 3.25Å; E799-S852 WeakPolarHBondContact CB-O 3.48Å; E799-S852 PolarHBondContact N-O 3.43Å; E799-S852 PolarHBondContact OE2-N 3.39Å
853	V	46.8	Very low	70.9	Confident	18 Å²	18	54.6 Å²	54.6	11%	0.109	27%	0.266	C	S	.	.			trans	-90.2	151.7	174.6	178.8	0	0	0	0	113.4	S768 L797 E799	S768-V853 WeakPolarHBondContact O-CB 3.5Å; S768-V853 VanDerWaalsContact O-O 3.11Å; L797-V853 HydrophobicContact CD1-CG2 3.52Å; L797-V853 HydrophobicContact CG-CG2 4.39Å; E799-V853 WeakPolarHBondContact O-CG2 3.21Å
854	S	53.3	Low	70.6	Confident	2 Å²	2	55.8 Å²	55.8	1%	0.014	28%	0.277	C	S	.	.	B	Isolated β-bridge	trans	-146.5	169.3	166.6	82.1	0	0	0	0	116.7	N796 E798 R860	N796-S854 PolarHBondContact N-O 3.5Å; N796-S854 PolarHBondContact O-N 2.93Å; E798-S854 PolarHBondContact OE1-OG 3.25Å; E798-S854 WeakPolarHBondContact OE2-CB 3.38Å; E798-S854 PolarHBondContact OE2-OG 3.18Å; S854-R860 PolarHBondContact OG-NE 2.96Å; S854-R860 PolarHBondContact OG-NH1 3.37Å; S854-R860 VanDerWaalsContact OG-NH1 3.13Å; S854-R860 PolarHBondContact OG-NH2 2.95Å
855	M	57.5	Low	70.5	Confident	3 Å²	3	51.5 Å²	51.5	2%	0.015	26%	0.259	C	S	.	.			trans	-63.5	157	177.9	-67.4	-69.1	-50.2	0	0	111.7	R761 A766 N859 R860 P953 F955	R761-M855 PolarHBondContact NH1-SD 3.13Å; R761-M855 VanDerWaalsContact NH1-SD 3.35Å; A766-M855 WeakPolarHBondContact O-CB 3.26Å; A766-M855 WeakPolarHBondContact O-CG 3.39Å; M855-N859 HydrophobicContact CE-CB 3.84Å; M855-R860 HydrophobicContact CB-CG 3.76Å; M855-R860 PolarHBondContact O-NE 3.36Å; M855-R860 PolarHBondContact O-NH2 3.34Å; M855-R860 VanDerWaalsContact O-NH2 3.16Å; M855-P953 HydrophobicContact CE-CB 3.78Å; M855-P953 HydrophobicContact CE-CG 3.57Å; M855-F955 HydrophobicContact CE-CZ 4.5Å; M855-F955 HydrophobicContact SD-CZ 4.31Å
856	P	65.6	Low	70.2	Confident	28 Å²	28	50 Å²	50	18%	0.182	25%	0.251	C	S	.	.			trans	-59	152.9	175.2	-14.5	31.1	0	0	0	110	E858 N859 R860	P856-E858 VanDerWaalsContact C-N 3.27Å; P856-E858 PolarHBondContact O-N 3.24Å; P856-N859 VanDerWaalsContact CB-OD1 3.29Å; P856-N859 WeakPolarHBondContact CB-OD1 3.38Å; P856-N859 WeakPolarHBondContact CD-OD1 3.19Å; P856-N859 VanDerWaalsContact CG-OD1 3.25Å; P856-N859 WeakPolarHBondContact CG-OD1 3.39Å; P856-N859 PolarHBondContact O-N 2.93Å; P856-R860 PolarHBondContact O-N 3.43Å; P856-R860 VanDerWaalsContact O-N 3.07Å
857	K	72.1	Confident	69.8	Low	145 Å²	145	47.6 Å²	47.6	63%	0.63	24%	0.24	S	C	*	.	H	α-helix	trans	-59.6	-40.3	-171.6	-172.5	-179.4	175.3	-174.7	0	111.5	R860 I861	K857-R860 PolarHBondContact O-N 2.85Å; K857-I861 HydrophobicContact CG-CD1 3.91Å; K857-I861 VanDerWaalsContact O-CG1 3.27Å; K857-I861 WeakPolarHBondContact O-CG1 3.17Å; K857-I861 PolarHBondContact O-N 2.87Å
858	E	74	Confident	69.5	Low	128 Å²	128	52 Å²	52	60%	0.598	26%	0.258	S	S	*	.	H	α-helix	trans	-54.7	-58.8	173.1	-69.5	118.3	-132.5	0	0	111.7	P856 R860 I861 A862	P856-E858 VanDerWaalsContact C-N 3.27Å; P856-E858 PolarHBondContact O-N 3.24Å; E858-R860 VanDerWaalsContact C-N 3.27Å; E858-R860 PolarHBondContact O-N 3.22Å; E858-I861 WeakPolarHBondContact O-CB 3.35Å; E858-I861 PolarHBondContact O-N 3.41Å; E858-A862 WeakPolarHBondContact O-CB 3.43Å; E858-A862 PolarHBondContact O-N 3.2Å
859	N	78.8	Confident	69.4	Low	24 Å²	24	50.3 Å²	50.3	13%	0.128	25%	0.251	C	S	.	.	H	α-helix	trans	-60.5	-33.9	-178	-49.6	73.9	0	0	0	113	M855 P856 M863 D951	M855-N859 HydrophobicContact CE-CB 3.84Å; P856-N859 VanDerWaalsContact CB-OD1 3.29Å; P856-N859 WeakPolarHBondContact CB-OD1 3.38Å; P856-N859 WeakPolarHBondContact CD-OD1 3.19Å; P856-N859 VanDerWaalsContact CG-OD1 3.25Å; P856-N859 WeakPolarHBondContact CG-OD1 3.39Å; P856-N859 PolarHBondContact O-N 2.93Å; N859-M863 WeakPolarHBondContact O-CB 3.49Å; N859-M863 WeakPolarHBondContact O-CG 3.26Å; N859-M863 PolarHBondContact O-N 3.47Å; N859-D951 VanDerWaalsContact CG-O 3.26Å; N859-D951 PolarHBondContact ND2-O 3.02Å
860	R	72.3	Confident	69.8	Low	71 Å²	71	48.6 Å²	48.6	27%	0.268	24%	0.243	S	C	.	.	H	α-helix	trans	-66.7	-46.6	173.6	-76.9	-169.9	-85.1	177.5	-9.7	111.5	A766 E798 S854 M855 P856 K857 E858 S864	A766-R860 HydrophobicContact CB-CG 4.21Å; E798-R860 IonicContact OE1-CZ 3.93Å; E798-R860 IonicContact OE1-NH1 2.83Å; E798-R860 PolarHBondContact OE1-NH1 2.98Å; E798-R860 IonicContact OE1-NH2 3.86Å; E798-R860 PolarHBondContact OE1-NH2 3.48Å; E798-R860 IonicContact OE2-NH1 3.79Å; S854-R860 PolarHBondContact OG-NE 2.96Å; S854-R860 PolarHBondContact OG-NH1 3.37Å; S854-R860 VanDerWaalsContact OG-NH1 3.13Å; S854-R860 PolarHBondContact OG-NH2 2.95Å; M855-R860 HydrophobicContact CB-CG 3.76Å; M855-R860 PolarHBondContact O-NE 3.36Å; M855-R860 PolarHBondContact O-NH2 3.34Å; M855-R860 VanDerWaalsContact O-NH2 3.16Å; P856-R860 PolarHBondContact O-N 3.43Å; P856-R860 VanDerWaalsContact O-N 3.07Å; K857-R860 PolarHBondContact O-N 2.85Å; E858-R860 VanDerWaalsContact C-N 3.27Å; E858-R860 PolarHBondContact O-N 3.22Å; R860-S864 VanDerWaalsContact O-CB 3.29Å; R860-S864 WeakPolarHBondContact O-CB 3.48Å; R860-S864 PolarHBondContact O-N 2.65Å; R860-S864 PolarHBondContact O-OG 2.7Å
861	I	80.8	Confident	70.6	Confident	88 Å²	88	46.6 Å²	46.6	45%	0.451	25%	0.245	S	C	.	.	H	α-helix	trans	-57.9	-53.6	175.4	-70.6	166.9	0	0	0	108.6	K857 E858 M863 S864 T865	K857-I861 HydrophobicContact CG-CD1 3.91Å; K857-I861 VanDerWaalsContact O-CG1 3.27Å; K857-I861 WeakPolarHBondContact O-CG1 3.17Å; K857-I861 PolarHBondContact O-N 2.87Å; E858-I861 WeakPolarHBondContact O-CB 3.35Å; E858-I861 PolarHBondContact O-N 3.41Å; I861-M863 PolarHBondContact O-N 3.03Å; I861-S864 PolarHBondContact O-N 3.45Å; I861-S864 PolarHBondContact O-OG 2.99Å; I861-T865 WeakPolarHBondContact O-CB 3.11Å; I861-T865 PolarHBondContact O-N 3.34Å; I861-T865 PolarHBondContact O-OG1 2.72Å; I861-T865 VanDerWaalsContact O-OG1 3.05Å
862	A	82.5	Confident	71.8	Confident	1 Å²	1	53 Å²	53	1%	0.008	26%	0.26	C	S	.	.	H	α-helix	trans	-52	-52.8	179	0	0	0	0	0	113.2	E858 S864 T865 L866 I948 D951 L952	E858-A862 WeakPolarHBondContact O-CB 3.43Å; E858-A862 PolarHBondContact O-N 3.2Å; A862-S864 VanDerWaalsContact C-N 3.33Å; A862-S864 PolarHBondContact O-N 2.95Å; A862-T865 PolarHBondContact O-N 3.14Å; A862-L866 VanDerWaalsContact O-CB 3.31Å; A862-L866 WeakPolarHBondContact O-CB 3.47Å; A862-L866 WeakPolarHBondContact O-CG 3.48Å; A862-L866 PolarHBondContact O-N 2.84Å; A862-I948 HydrophobicContact CB-CG2 3.93Å; A862-I948 WeakPolarHBondContact CB-O 3.45Å; A862-D951 HydrophobicContact CB-CB 3.73Å; A862-L952 HydrophobicContact CB-CD2 4.17Å
863	M	80.8	Confident	72.4	Confident	2 Å²	2	53.3 Å²	53.3	1%	0.01	26%	0.26	C	S	.	.	H	α-helix	trans	-61	-38.7	176.4	-76.5	-167.5	-178.3	0	0	113.4	R761 A766 N859 I861 R867 L952 P953 A956 Y960	R761-M863 PolarHBondContact NH2-SD 2.69Å; A766-M863 HydrophobicContact CB-CB 4.38Å; A766-M863 HydrophobicContact CB-SD 3.87Å; N859-M863 WeakPolarHBondContact O-CB 3.49Å; N859-M863 WeakPolarHBondContact O-CG 3.26Å; N859-M863 PolarHBondContact O-N 3.47Å; I861-M863 PolarHBondContact O-N 3.03Å; M863-R867 WeakPolarHBondContact O-CG 3.17Å; M863-R867 PolarHBondContact O-N 3.17Å; M863-L952 HydrophobicContact CB-CD2 4.44Å; M863-L952 HydrophobicContact CE-CD2 3.99Å; M863-L952 HydrophobicContact CG-CD2 3.42Å; M863-L952 VanDerWaalsContact CG-CD2 3.42Å; M863-P953 HydrophobicContact CE-CG 3.66Å; M863-A956 HydrophobicContact CE-CB 3.35Å; M863-Y960 WeakPolarHBondContact CB-OH 3.17Å; M863-Y960 HydrophobicContact CE-CE2 4.07Å; M863-Y960 HydrophobicContact CG-CE2 3.97Å; M863-Y960 WeakPolarHBondContact CG-OH 3.4Å; M863-Y960 HydrophobicContact SD-CE2 4.12Å
864	S	80.9	Confident	72.8	Confident	48 Å²	48	59 Å²	59	34%	0.336	29%	0.289	S	S	.	.	H	α-helix	trans	-73.6	-38.1	-179.1	80.1	0	0	0	0	112.4	R860 I861 A862 K868	R860-S864 VanDerWaalsContact O-CB 3.29Å; R860-S864 WeakPolarHBondContact O-CB 3.48Å; R860-S864 PolarHBondContact O-N 2.65Å; R860-S864 PolarHBondContact O-OG 2.7Å; I861-S864 PolarHBondContact O-N 3.45Å; I861-S864 PolarHBondContact O-OG 2.99Å; A862-S864 VanDerWaalsContact C-N 3.33Å; A862-S864 PolarHBondContact O-N 2.95Å; S864-K868 VanDerWaalsContact O-CG 3.31Å; S864-K868 WeakPolarHBondContact O-CG 3.28Å; S864-K868 PolarHBondContact O-N 2.93Å; S864-K868 VanDerWaalsContact O-N 3.13Å
865	T	83.6	Confident	72.7	Confident	33 Å²	33	63.8 Å²	63.8	20%	0.202	32%	0.319	C	S	.	.	H	α-helix	trans	-68.7	-53.6	176.1	-58.5	0	0	0	0	109.1	I861 A862 R867 K868 E869 I948	I861-T865 WeakPolarHBondContact O-CB 3.11Å; I861-T865 PolarHBondContact O-N 3.34Å; I861-T865 PolarHBondContact O-OG1 2.72Å; I861-T865 VanDerWaalsContact O-OG1 3.05Å; A862-T865 PolarHBondContact O-N 3.14Å; T865-R867 PolarHBondContact O-N 3.38Å; T865-R867 VanDerWaalsContact O-N 3.13Å; T865-K868 WeakPolarHBondContact O-CA 3.19Å; T865-K868 WeakPolarHBondContact O-CB 3.49Å; T865-K868 PolarHBondContact O-N 2.82Å; T865-E869 HydrophobicContact CG2-CG 4.21Å; T865-E869 WeakPolarHBondContact O-CG 3.45Å; T865-E869 PolarHBondContact O-N 3.12Å; T865-I948 HydrophobicContact CG2-CD1 3.82Å; T865-I948 HydrophobicContact CG2-CG2 4.47Å
866	L	84	Confident	72.5	Confident	0 Å²	0	64.7 Å²	64.7	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-52.4	-40.1	176.8	-80.5	169.2	0	0	0	112.6	A862 E869 L870 M945 I948 L952 Y960 I964	A862-L866 VanDerWaalsContact O-CB 3.31Å; A862-L866 WeakPolarHBondContact O-CB 3.47Å; A862-L866 WeakPolarHBondContact O-CG 3.48Å; A862-L866 PolarHBondContact O-N 2.84Å; L866-E869 PolarHBondContact O-N 3.21Å; L866-L870 WeakPolarHBondContact O-CB 3.11Å; L866-L870 WeakPolarHBondContact O-CD1 3.34Å; L866-L870 WeakPolarHBondContact O-CG 3.49Å; L866-L870 PolarHBondContact O-N 3.44Å; L866-M945 HydrophobicContact CD2-CE 3.53Å; L866-M945 HydrophobicContact CD2-SD 4.12Å; L866-I948 HydrophobicContact CD1-CG2 4.17Å; L866-I948 HydrophobicContact CD2-CB 4.22Å; L866-I948 HydrophobicContact CD2-CG2 4.35Å; L866-I948 HydrophobicContact CG-CB 4.12Å; L866-I948 HydrophobicContact CG-CG2 3.72Å; L866-L952 HydrophobicContact CD1-CD1 3.75Å; L866-L952 HydrophobicContact CD1-CD2 4.05Å; L866-L952 HydrophobicContact CD1-CG 4.04Å; L866-Y960 HydrophobicContact CB-CD1 4.06Å; L866-Y960 HydrophobicContact CB-CE1 4.01Å; L866-Y960 HydrophobicContact CD1-CD1 3.97Å; L866-Y960 HydrophobicContact CD1-CE1 4.45Å; L866-I964 HydrophobicContact CD2-CD1 4.02Å; L866-I964 HydrophobicContact CD2-CG1 4.48Å
867	R	78.7	Confident	71.7	Confident	57 Å²	57	68.8 Å²	68.8	22%	0.215	35%	0.348	C	S	.	.	H	α-helix	trans	-68.4	-38.4	174.8	-78	-173.7	-173.1	138	7.2	114.2	P763 L764 M863 T865 E869 A871 Y960	P763-R867 PolarHBondContact O-NH1 2.76Å; P763-R867 PolarHBondContact O-NH2 2.9Å; L764-R867 PolarHBondContact O-NH1 2.86Å; M863-R867 WeakPolarHBondContact O-CG 3.17Å; M863-R867 PolarHBondContact O-N 3.17Å; T865-R867 PolarHBondContact O-N 3.38Å; T865-R867 VanDerWaalsContact O-N 3.13Å; R867-E869 VanDerWaalsContact C-N 3.34Å; R867-A871 WeakPolarHBondContact O-CB 3.22Å; R867-A871 PolarHBondContact O-N 2.93Å; R867-Y960 HydrophobicContact CG-CE1 4.21Å; R867-Y960 PolarHBondContact NE-OH 3.49Å; R867-Y960 PolarHBondContact NH2-OH 2.96Å
868	K	80.4	Confident	70.8	Confident	123 Å²	123	62.1 Å²	62.1	54%	0.535	32%	0.319	S	S	.	.	H	α-helix	trans	-63.6	-43.7	174.8	-73.8	166.7	-178.2	172	0	110.3	S864 T865 A871 R872	S864-K868 VanDerWaalsContact O-CG 3.31Å; S864-K868 WeakPolarHBondContact O-CG 3.28Å; S864-K868 PolarHBondContact O-N 2.93Å; S864-K868 VanDerWaalsContact O-N 3.13Å; T865-K868 WeakPolarHBondContact O-CA 3.19Å; T865-K868 WeakPolarHBondContact O-CB 3.49Å; T865-K868 PolarHBondContact O-N 2.82Å; K868-A871 PolarHBondContact O-N 2.95Å; K868-R872 VanDerWaalsContact O-CB 3.23Å; K868-R872 WeakPolarHBondContact O-CB 3.37Å; K868-R872 WeakPolarHBondContact O-CG 3.3Å; K868-R872 PolarHBondContact O-N 2.69Å
869	E	79.4	Confident	69.8	Low	41 Å²	41	58.4 Å²	58.4	19%	0.192	31%	0.306	C	S	.	.	H	α-helix	trans	-67	-49.2	176.7	-56.2	-54.3	166.3	0	0	111.5	T865 L866 R867 A871 R872 I873 Y944 M945	T865-E869 HydrophobicContact CG2-CG 4.21Å; T865-E869 WeakPolarHBondContact O-CG 3.45Å; T865-E869 PolarHBondContact O-N 3.12Å; L866-E869 PolarHBondContact O-N 3.21Å; R867-E869 VanDerWaalsContact C-N 3.34Å; E869-A871 PolarHBondContact O-N 2.79Å; E869-A871 VanDerWaalsContact O-N 3.12Å; E869-R872 CarbonylContact O-C 3.58Å; E869-R872 WeakPolarHBondContact O-CA 3.39Å; E869-R872 PolarHBondContact O-N 3.14Å; E869-I873 WeakPolarHBondContact O-CG1 3.14Å; E869-I873 PolarHBondContact O-N 3.01Å; E869-Y944 HydrophobicContact CG-CE1 3.82Å; E869-Y944 PolarHBondContact OE1-OH 3.24Å; E869-M945 HydrophobicContact CB-CE 3.94Å; E869-M945 HydrophobicContact CB-SD 3.57Å; E869-M945 VanDerWaalsContact CB-SD 3.57Å; E869-M945 HydrophobicContact CG-SD 4.13Å
870	L	74.6	Confident	68.4	Low	34 Å²	34	59.6 Å²	59.6	18%	0.178	31%	0.314	C	S	.	.	H	α-helix	trans	-56.8	-27.5	174.7	-73.1	164.9	0	0	0	113.4	L866 I873 M945 Y960 A963 I964	L866-L870 WeakPolarHBondContact O-CB 3.11Å; L866-L870 WeakPolarHBondContact O-CD1 3.34Å; L866-L870 WeakPolarHBondContact O-CG 3.49Å; L866-L870 PolarHBondContact O-N 3.44Å; L870-I873 HydrophobicContact CD2-CD1 4.19Å; L870-M945 HydrophobicContact CD2-CE 4.08Å; L870-M945 HydrophobicContact CG-CE 3.93Å; L870-Y960 HydrophobicContact CD1-CD1 4.34Å; L870-A963 HydrophobicContact CD1-CB 3.91Å; L870-A963 HydrophobicContact CD2-CB 4.22Å; L870-A963 WeakPolarHBondContact CD2-O 3.46Å; L870-I964 HydrophobicContact CD2-CG1 4.23Å
871	A	68.9	Low	67.1	Low	70 Å²	70	60.5 Å²	60.5	58%	0.579	32%	0.321	S	S	*	.	H	α-helix	trans	-88.5	-16.9	175.1	0	0	0	0	0	113.9	R867 K868 E869	R867-A871 WeakPolarHBondContact O-CB 3.22Å; R867-A871 PolarHBondContact O-N 2.93Å; K868-A871 PolarHBondContact O-N 2.95Å; E869-A871 PolarHBondContact O-N 2.79Å; E869-A871 VanDerWaalsContact O-N 3.12Å
872	R	66.3	Low	65.8	Low	174 Å²	174	56.3 Å²	56.3	66%	0.657	30%	0.3	S	S	*	.	H	α-helix	trans	-103.6	-1.9	-179.1	-80	176.9	169.8	-173.5	-5.7	114	K868 E869 D874	K868-R872 VanDerWaalsContact O-CB 3.23Å; K868-R872 WeakPolarHBondContact O-CB 3.37Å; K868-R872 WeakPolarHBondContact O-CG 3.3Å; K868-R872 PolarHBondContact O-N 2.69Å; E869-R872 CarbonylContact O-C 3.58Å; E869-R872 WeakPolarHBondContact O-CA 3.39Å; E869-R872 PolarHBondContact O-N 3.14Å; R872-D874 PolarHBondContact O-N 2.95Å
873	I	59.9	Low	64.7	Low	30 Å²	30	56.6 Å²	56.6	15%	0.154	30%	0.302	C	S	.	.			trans	-63.6	102.8	-174.7	-32.5	168.8	0	0	0	109.6	E869 L870 W941 L971	E869-I873 WeakPolarHBondContact O-CG1 3.14Å; E869-I873 PolarHBondContact O-N 3.01Å; L870-I873 HydrophobicContact CD2-CD1 4.19Å; I873-W941 HydrophobicContact CD1-CH2 4.04Å; I873-W941 HydrophobicContact CD1-CZ2 3.57Å; I873-W941 HydrophobicContact CG1-CZ2 3.94Å; I873-W941 HydrophobicContact CG2-CZ2 3.94Å; I873-L971 HydrophobicContact CB-CD1 3.51Å; I873-L971 HydrophobicContact CD1-CD1 4.04Å; I873-L971 HydrophobicContact CG1-CD1 4.4Å; I873-L971 HydrophobicContact CG2-CD1 3.27Å
874	D	54.2	Low	63.6	Low	136 Å²	136	57.9 Å²	57.9	73%	0.727	31%	0.308	S	S	*	.			trans	-75.6	177.5	174.1	-78	-41.5	0	0	0	110.6	R872 I876	R872-D874 PolarHBondContact O-N 2.95Å; D874-I876 PolarHBondContact O-N 3.12Å
875	V	50.6	Low	62.6	Low	103 Å²	103	57.3 Å²	57.3	62%	0.624	30%	0.299	S	S	*	.			trans	-64	103.9	179	-177.1	0	0	0	0	109.8	T877	V875-T877 PolarHBondContact O-N 3.42Å; V875-T877 VanDerWaalsContact O-N 3.14Å; V875-T877 PolarHBondContact O-OG1 3.16Å
876	I	54.5	Low	61.4	Low	23 Å²	23	55.9 Å²	55.9	12%	0.118	29%	0.29	C	S	.	.			trans	-56.1	119.5	168.2	-58.6	176.4	0	0	0	107.3	D874 L878 V938	D874-I876 PolarHBondContact O-N 3.12Å; I876-L878 HydrophobicContact CG2-CD2 3.68Å; I876-L878 HydrophobicContact CG2-CG 4.15Å; I876-L878 PolarHBondContact O-N 3.43Å; I876-V938 HydrophobicContact CG2-CG2 4.05Å
877	T	49	Very low	60.1	Low	113 Å²	113	55.9 Å²	55.9	69%	0.693	29%	0.291	S	S	*	.			trans	-82.3	69.2	-175.1	-54.7	0	0	0	0	109.9	V875	V875-T877 PolarHBondContact O-N 3.42Å; V875-T877 VanDerWaalsContact O-N 3.14Å; V875-T877 PolarHBondContact O-OG1 3.16Å
878	L	52.3	Low	59.2	Low	5 Å²	5	55 Å²	55	3%	0.026	29%	0.291	C	S	.	.			trans	-57.3	127.4	-176.4	-67.5	179.6	0	0	0	111.7	I876 I886 V938 M972 A975 K979	I876-L878 HydrophobicContact CG2-CD2 3.68Å; I876-L878 HydrophobicContact CG2-CG 4.15Å; I876-L878 PolarHBondContact O-N 3.43Å; L878-I886 HydrophobicContact CD1-CD1 3.46Å; L878-I886 VanDerWaalsContact CD1-CD1 3.46Å; L878-I886 HydrophobicContact CD2-CD1 3.45Å; L878-I886 VanDerWaalsContact CD2-CD1 3.45Å; L878-I886 HydrophobicContact CG-CD1 4.06Å; L878-V938 HydrophobicContact CD2-CG2 3.49Å; L878-V938 VanDerWaalsContact CD2-CG2 3.49Å; L878-M972 HydrophobicContact CD1-CB 4Å; L878-M972 HydrophobicContact CD1-CG 4.07Å; L878-A975 HydrophobicContact CD1-CB 3.99Å; L878-A975 HydrophobicContact CG-CB 4.37Å; L878-K979 WeakPolarHBondContact O-CE 3.39Å; L878-K979 PolarHBondContact O-NZ 2.88Å
879	P	53.1	Low	58.3	Low	51 Å²	51	49.9 Å²	49.9	33%	0.331	27%	0.268	S	S	.	.			trans	-70.3	151.3	165.7	30.3	-33.4	0	0	0	109.7	E881 S882 G934	P879-E881 PolarHBondContact O-N 3.41Å; P879-E881 VanDerWaalsContact O-N 3.09Å; P879-S882 PolarHBondContact O-N 3.03Å; P879-S882 PolarHBondContact O-OG 3.05Å; P879-G934 WeakPolarHBondContact CD-O 3.25Å; P879-G934 WeakPolarHBondContact CG-O 3.33Å
880	T	48.8	Very low	57.3	Low	48 Å²	48	48.5 Å²	48.5	29%	0.294	26%	0.261	S	S	.	.	G	3₁₀ helix	trans	-62.5	-19.8	-175.9	-45.6	0	0	0	0	112.9	S882 L883 K979 E1072	T880-S882 VanDerWaalsContact C-N 3.33Å; T880-S882 PolarHBondContact O-N 3.4Å; T880-L883 HydrophobicContact CG2-CD1 3.76Å; T880-L883 WeakPolarHBondContact O-CD1 3.4Å; T880-L883 VanDerWaalsContact O-CG 3.27Å; T880-L883 WeakPolarHBondContact O-CG 3.42Å; T880-K979 PolarHBondContact OG1-NZ 2.96Å; T880-E1072 HydrophobicContact CG2-CG 3.76Å
881	E	46.8	Very low	56.2	Low	90 Å²	90	47.5 Å²	47.5	42%	0.421	26%	0.257	S	S	.	.	G	3₁₀ helix	trans	-71.7	-23.8	176.7	-54.1	-175.1	153.7	0	0	113.2	P879	P879-E881 PolarHBondContact O-N 3.41Å; P879-E881 VanDerWaalsContact O-N 3.09Å
882	S	52.6	Low	55.4	Low	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-80.1	-12.6	-177.1	65.2	0	0	0	0	114.8	P879 T880 Q884 E885 I886	P879-S882 PolarHBondContact O-N 3.03Å; P879-S882 PolarHBondContact O-OG 3.05Å; T880-S882 VanDerWaalsContact C-N 3.33Å; T880-S882 PolarHBondContact O-N 3.4Å; S882-Q884 VanDerWaalsContact C-N 3.33Å; S882-Q884 PolarHBondContact O-N 3.39Å; S882-E885 PolarHBondContact O-N 2.78Å; S882-I886 WeakPolarHBondContact O-CG1 3.43Å; S882-I886 PolarHBondContact O-N 3.39Å
883	L	58.5	Low	55.4	Low	8 Å²	8	40.7 Å²	40.7	4%	0.042	23%	0.229	C	C	.	.	H	α-helix	trans	-64.2	-34.1	-166.3	-54.1	172.4	0	0	0	112.9	T880 A887 I976 L999	T880-L883 HydrophobicContact CG2-CD1 3.76Å; T880-L883 WeakPolarHBondContact O-CD1 3.4Å; T880-L883 VanDerWaalsContact O-CG 3.27Å; T880-L883 WeakPolarHBondContact O-CG 3.42Å; L883-A887 WeakPolarHBondContact O-CB 3.21Å; L883-A887 PolarHBondContact O-N 2.7Å; L883-I976 HydrophobicContact CD2-CG1 3.58Å; L883-L999 HydrophobicContact CB-CD1 4.23Å; L883-L999 HydrophobicContact CB-CD2 4.01Å
884	Q	58.4	Low	56.4	Low	29 Å²	29	40.6 Å²	40.6	14%	0.136	23%	0.228	C	C	.	.	H	α-helix	trans	-66	-47.4	176.6	169.1	74.4	69.8	0	0	112.1	S882 I886 A887 D888 L999 I1000 C1002	S882-Q884 VanDerWaalsContact C-N 3.33Å; S882-Q884 PolarHBondContact O-N 3.39Å; Q884-I886 PolarHBondContact O-N 2.79Å; Q884-A887 CarbonylContact O-C 3.59Å; Q884-A887 WeakPolarHBondContact O-CB 3.4Å; Q884-A887 PolarHBondContact O-N 2.92Å; Q884-A887 VanDerWaalsContact O-N 3.12Å; Q884-D888 PolarHBondContact NE2-OD1 2.71Å; Q884-D888 PolarHBondContact O-N 3.35Å; Q884-L999 PolarHBondContact OE1-O 3.32Å; Q884-L999 VanDerWaalsContact OE1-O 3.07Å; Q884-I1000 VanDerWaalsContact NE2-C 3.32Å; Q884-I1000 PolarHBondContact NE2-O 3.39Å; Q884-I1000 PolarHBondContact OE1-O 3.25Å; Q884-C1002 VanDerWaalsContact OE1-N 3.08Å; Q884-C1002 PolarHBondContact OE1-O 2.9Å
885	E	60.7	Low	57.7	Low	35 Å²	35	34.2 Å²	34.2	16%	0.164	19%	0.194	C	C	.	.	H	α-helix	trans	-67.1	-29.8	-178	-62.7	-155.1	149.2	0	0	112.4	S882 D888 F889 F929 T932 T935	S882-E885 PolarHBondContact O-N 2.78Å; E885-D888 WeakPolarHBondContact O-CB 3.24Å; E885-D888 PolarHBondContact O-N 2.86Å; E885-F889 WeakPolarHBondContact O-CB 3.44Å; E885-F889 PolarHBondContact O-N 2.86Å; E885-F929 HydrophobicContact CB-CE1 4.36Å; E885-T932 VanDerWaalsContact CD-CB 3.48Å; E885-T932 VanDerWaalsContact CD-OG1 3.3Å; E885-T932 VanDerWaalsContact OE1-CB 3.24Å; E885-T932 WeakPolarHBondContact OE1-CB 3.48Å; E885-T932 PolarHBondContact OE1-OG1 2.68Å; E885-T932 WeakPolarHBondContact OE2-CB 3.32Å; E885-T935 HydrophobicContact CB-CG2 4.4Å; E885-T935 PolarHBondContact OE2-OG1 2.76Å
886	I	57.5	Low	59.3	Low	3 Å²	3	31.5 Å²	31.5	2%	0.015	17%	0.173	C	C	.	.	H	α-helix	trans	-73.8	-33.5	174.9	-69.4	174.4	0	0	0	111.2	L878 S882 Q884 F889 R890 F929 M972 I976	L878-I886 HydrophobicContact CD1-CD1 3.46Å; L878-I886 VanDerWaalsContact CD1-CD1 3.46Å; L878-I886 HydrophobicContact CD2-CD1 3.45Å; L878-I886 VanDerWaalsContact CD2-CD1 3.45Å; L878-I886 HydrophobicContact CG-CD1 4.06Å; S882-I886 WeakPolarHBondContact O-CG1 3.43Å; S882-I886 PolarHBondContact O-N 3.39Å; Q884-I886 PolarHBondContact O-N 2.79Å; I886-F889 WeakPolarHBondContact O-CB 3.41Å; I886-F889 PolarHBondContact O-N 2.62Å; I886-R890 PolarHBondContact O-N 2.92Å; I886-F929 HydrophobicContact CG1-CE1 4.18Å; I886-M972 HydrophobicContact CB-SD 4.31Å; I886-M972 HydrophobicContact CD1-CB 4.45Å; I886-M972 HydrophobicContact CD1-CG 4.18Å; I886-M972 HydrophobicContact CD1-SD 3.69Å; I886-M972 HydrophobicContact CG1-SD 3.65Å; I886-M972 HydrophobicContact CG2-CB 3.62Å; I886-M972 HydrophobicContact CG2-CE 4.14Å; I886-M972 HydrophobicContact CG2-CG 4.22Å; I886-M972 HydrophobicContact CG2-SD 3.82Å; I886-I976 HydrophobicContact CG2-CD1 3.68Å
887	A	57.2	Low	60.8	Low	1 Å²	1	33.6 Å²	33.6	1%	0.008	18%	0.182	C	C	.	.	H	α-helix	trans	-72.1	-37	170.4	0	0	0	0	0	111.8	L883 Q884 F889 R890 S891 L999 I1000	L883-A887 WeakPolarHBondContact O-CB 3.21Å; L883-A887 PolarHBondContact O-N 2.7Å; Q884-A887 CarbonylContact O-C 3.59Å; Q884-A887 WeakPolarHBondContact O-CB 3.4Å; Q884-A887 PolarHBondContact O-N 2.92Å; Q884-A887 VanDerWaalsContact O-N 3.12Å; A887-F889 PolarHBondContact O-N 3.12Å; A887-R890 WeakPolarHBondContact O-CA 3.31Å; A887-R890 VanDerWaalsContact O-CB 3.27Å; A887-R890 WeakPolarHBondContact O-CB 3.31Å; A887-R890 PolarHBondContact O-N 3.34Å; A887-S891 PolarHBondContact O-N 3.18Å; A887-S891 VanDerWaalsContact O-N 3.07Å; A887-L999 HydrophobicContact CB-CB 3.3Å; A887-L999 HydrophobicContact CB-CD1 3.97Å; A887-L999 HydrophobicContact CB-CG 4.28Å; A887-I1000 HydrophobicContact CB-CG2 3.6Å
888	D	60.3	Low	62.6	Low	39 Å²	39	28.2 Å²	28.2	21%	0.209	15%	0.149	C	C	.	.	H	α-helix	trans	-61.4	-35.3	170.1	-76	2.9	0	0	0	111.7	Q884 E885 R890 S891 A892 R928	Q884-D888 PolarHBondContact NE2-OD1 2.71Å; Q884-D888 PolarHBondContact O-N 3.35Å; E885-D888 WeakPolarHBondContact O-CB 3.24Å; E885-D888 PolarHBondContact O-N 2.86Å; D888-R890 PolarHBondContact O-N 3.1Å; D888-S891 WeakPolarHBondContact CA-OG 3.32Å; D888-S891 CarbonylContact O-C 3.52Å; D888-S891 PolarHBondContact O-N 3.47Å; D888-S891 PolarHBondContact O-OG 2.88Å; D888-A892 VanDerWaalsContact O-CB 3.29Å; D888-A892 WeakPolarHBondContact O-CB 3.18Å; D888-A892 PolarHBondContact O-N 3.05Å; D888-R928 VanDerWaalsContact CB-NH2 3.33Å; D888-R928 IonicContact OD2-NH2 2.78Å; D888-R928 PolarHBondContact OD2-NH2 2.83Å; D888-R928 VanDerWaalsContact OD2-NH2 3.08Å
889	F	60.1	Low	63.9	Low	15 Å²	15	31.1 Å²	31.1	7%	0.066	17%	0.167	C	C	.	.	H	α-helix	trans	-63.8	-29.4	174	-175.9	-95.2	0	0	0	112.3	E885 I886 A887 V895 I925 F929 F942 I965 M972	E885-F889 WeakPolarHBondContact O-CB 3.44Å; E885-F889 PolarHBondContact O-N 2.86Å; I886-F889 WeakPolarHBondContact O-CB 3.41Å; I886-F889 PolarHBondContact O-N 2.62Å; A887-F889 PolarHBondContact O-N 3.12Å; F889-V895 HydrophobicContact CD1-CG2 4.34Å; F889-V895 HydrophobicContact CE1-CG2 4.32Å; F889-I925 HydrophobicContact CE2-CD1 4.28Å; F889-I925 HydrophobicContact CE2-CG1 4.48Å; F889-I925 HydrophobicContact CE2-CG2 3.89Å; F889-F929 HydrophobicContact CB-CZ 4.11Å; F889-F929 AromaticContact CD2-CE2 3.67Å; F889-F929 HydrophobicContact CD2-CE2 3.67Å; F889-F929 AromaticContact CD2-CZ 3.68Å; F889-F929 HydrophobicContact CD2-CZ 3.68Å; F889-F929 AromaticContact CE2-CE2 3.85Å; F889-F929 HydrophobicContact CE2-CE2 3.85Å; F889-F929 HydrophobicContact CE2-CZ 4.24Å; F889-F929 HydrophobicContact CG-CE2 4.45Å; F889-F929 HydrophobicContact CG-CZ 4.03Å; F889-F942 HydrophobicContact CE2-CZ 4.09Å; F889-F942 HydrophobicContact CZ-CE1 4.36Å; F889-F942 AromaticContact CZ-CZ 3.77Å; F889-F942 HydrophobicContact CZ-CZ 3.77Å; F889-I965 HydrophobicContact CE1-CG2 3.93Å; F889-I965 HydrophobicContact CE2-CD1 4.05Å; F889-I965 HydrophobicContact CZ-CB 4.47Å; F889-I965 HydrophobicContact CZ-CD1 3.58Å; F889-I965 HydrophobicContact CZ-CG2 3.8Å; F889-M972 HydrophobicContact CD1-CE 3.87Å; F889-M972 HydrophobicContact CE1-CE 3.92Å
890	R	58.4	Low	65.3	Low	12 Å²	12	30.5 Å²	30.5	5%	0.045	16%	0.161	C	C	.	.	H	α-helix	trans	-71.2	-43.9	169.2	-169.6	-171.7	-177.7	-175.3	8.5	112	I886 A887 D888 Y969 T993 S997 F1495	I886-R890 PolarHBondContact O-N 2.92Å; A887-R890 WeakPolarHBondContact O-CA 3.31Å; A887-R890 VanDerWaalsContact O-CB 3.27Å; A887-R890 WeakPolarHBondContact O-CB 3.31Å; A887-R890 PolarHBondContact O-N 3.34Å; D888-R890 PolarHBondContact O-N 3.1Å; R890-Y969 HydrophobicContact CB-CE2 3.86Å; R890-Y969 WeakPolarHBondContact CD-OH 3.47Å; R890-Y969 HydrophobicContact CG-CE2 3.7Å; R890-Y969 PolarHBondContact NE-OH 2.93Å; R890-Y969 VanDerWaalsContact NE-OH 3.07Å; R890-T993 PolarHBondContact NH1-O 3.37Å; R890-S997 PolarHBondContact NH1-OG 3.16Å; R890-F1495 HydrophobicContact CG-CD2 3.62Å; R890-F1495 HydrophobicContact CG-CE2 3.95Å; R890-F1495 HydrophobicContact CG-CG 4.26Å; R890-F1495 VanDerWaalsContact NE-CG 3.3Å
891	S	51.1	Low	67	Low	13 Å²	13	28.4 Å²	28.4	9%	0.091	15%	0.148	C	C	.	.	H	α-helix	trans	-81.6	-8	-176.1	67.8	0	0	0	0	114.7	A887 D888 D893	A887-S891 PolarHBondContact O-N 3.18Å; A887-S891 VanDerWaalsContact O-N 3.07Å; D888-S891 WeakPolarHBondContact CA-OG 3.32Å; D888-S891 CarbonylContact O-C 3.52Å; D888-S891 PolarHBondContact O-N 3.47Å; D888-S891 PolarHBondContact O-OG 2.88Å; S891-D893 PolarHBondContact O-N 2.84Å
892	A	52.2	Low	68.7	Low	35 Å²	35	26.3 Å²	26.3	29%	0.289	14%	0.137	S	C	.	.	S	Bend	trans	-74.6	27.1	178.8	0	0	0	0	0	114.4	D888 I894	D888-A892 VanDerWaalsContact O-CB 3.29Å; D888-A892 WeakPolarHBondContact O-CB 3.18Å; D888-A892 PolarHBondContact O-N 3.05Å; A892-I894 WeakPolarHBondContact O-CG1 3.44Å; A892-I894 PolarHBondContact O-N 3.35Å
893	D	67.3	Low	69.8	Low	65 Å²	65	31.8 Å²	31.8	35%	0.348	16%	0.158	S	C	.	.	S	Bend	trans	57	-24.1	-177.6	-57.7	-39	0	0	0	117.3	S891 V895 Y896 H897 P1493	S891-D893 PolarHBondContact O-N 2.84Å; D893-V895 PolarHBondContact O-N 2.87Å; D893-Y896 WeakPolarHBondContact O-CB 3.49Å; D893-Y896 PolarHBondContact O-N 2.73Å; D893-H897 PolarHBondContact O-CD2 3.26Å; D893-H897 PolarHBondContact O-N 3.26Å; D893-P1493 WeakPolarHBondContact OD1-CB 3.17Å
894	I	81.1	Confident	70.5	Confident	29 Å²	29	37.2 Å²	37.2	15%	0.149	19%	0.187	C	C	.	.	H	α-helix	trans	-60.4	-46.8	-172.3	-67.6	157.1	0	0	0	111.6	A892 Y896 H897 L898 L921 F961 I965	A892-I894 WeakPolarHBondContact O-CG1 3.44Å; A892-I894 PolarHBondContact O-N 3.35Å; I894-Y896 PolarHBondContact O-N 2.81Å; I894-H897 PolarHBondContact O-N 2.81Å; I894-L898 HydrophobicContact CG2-CD1 3.56Å; I894-L898 HydrophobicContact CG2-CG 4.17Å; I894-L898 WeakPolarHBondContact O-CB 3.43Å; I894-L898 WeakPolarHBondContact O-CG 3.29Å; I894-L898 PolarHBondContact O-N 3.11Å; I894-L921 HydrophobicContact CD1-CD1 3.87Å; I894-L921 HydrophobicContact CD1-CD2 4.33Å; I894-F961 HydrophobicContact CG2-CE1 4.01Å; I894-F961 HydrophobicContact CG2-CZ 4.44Å; I894-I965 HydrophobicContact CG2-CG2 4.41Å
895	V	81.8	Confident	71.4	Confident	2 Å²	2	38.1 Å²	38.1	1%	0.012	19%	0.193	C	C	.	.	H	α-helix	trans	-62.9	-43.7	179.5	179.6	0	0	0	0	110.6	F889 D893 L898 T899 I965 Y969	F889-V895 HydrophobicContact CD1-CG2 4.34Å; F889-V895 HydrophobicContact CE1-CG2 4.32Å; D893-V895 PolarHBondContact O-N 2.87Å; V895-L898 PolarHBondContact O-N 3.42Å; V895-T899 WeakPolarHBondContact O-CB 3.32Å; V895-T899 PolarHBondContact O-N 3.5Å; V895-T899 PolarHBondContact O-OG1 3.06Å; V895-I965 HydrophobicContact CG2-CG2 4.17Å; V895-Y969 HydrophobicContact CG1-CD1 4.1Å; V895-Y969 HydrophobicContact CG1-CE1 4.21Å; V895-Y969 HydrophobicContact CG1-CG 4.3Å; V895-Y969 HydrophobicContact CG2-CD2 4.43Å; V895-Y969 HydrophobicContact CG2-CG 4.48Å
896	Y	83.1	Confident	72.4	Confident	45 Å²	45	39.3 Å²	39.3	18%	0.176	20%	0.2	C	C	.	.	H	α-helix	trans	-59	-49.4	176.3	175.7	-92.4	0	0	0	112.3	D893 I894 T899 N900 N1491 P1493 F1495	D893-Y896 WeakPolarHBondContact O-CB 3.49Å; D893-Y896 PolarHBondContact O-N 2.73Å; I894-Y896 PolarHBondContact O-N 2.81Å; Y896-T899 PolarHBondContact O-N 2.89Å; Y896-N900 WeakPolarHBondContact CE1-ND2 3.47Å; Y896-N900 VanDerWaalsContact CZ-ND2 3.3Å; Y896-N900 WeakPolarHBondContact O-CB 3.19Å; Y896-N900 PolarHBondContact O-N 2.85Å; Y896-N900 PolarHBondContact O-ND2 3.15Å; Y896-N1491 VanDerWaalsContact CE2-O 3.24Å; Y896-N1491 WeakPolarHBondContact CE2-O 3.38Å; Y896-N1491 VanDerWaalsContact CZ-O 3.31Å; Y896-N1491 PolarHBondContact OH-O 3.15Å; Y896-P1493 HydrophobicContact CD1-CB 4.16Å; Y896-P1493 HydrophobicContact CD1-CG 4.1Å; Y896-P1493 HydrophobicContact CE1-CG 3.97Å; Y896-P1493 HydrophobicContact CG-CB 4.19Å; Y896-P1493 HydrophobicContact CG-CG 4.46Å; Y896-F1495 HydrophobicContact CD2-CE1 4.48Å; Y896-F1495 HydrophobicContact CD2-CZ 4.18Å
897	H	86	Confident	73.6	Confident	67 Å²	67	40 Å²	40	31%	0.31	20%	0.203	S	C	.	.	H	α-helix	trans	-65.5	-42.7	178	-72.7	-63.7	0	0	0	112	D893 I894 N900 M901 L911	D893-H897 PolarHBondContact O-CD2 3.26Å; D893-H897 PolarHBondContact O-N 3.26Å; I894-H897 PolarHBondContact O-N 2.81Å; H897-N900 PolarHBondContact O-N 3.23Å; H897-M901 HydrophobicContact CB-CE 4.5Å; H897-M901 WeakPolarHBondContact O-CB 3.44Å; H897-M901 VanDerWaalsContact O-CG 3.24Å; H897-M901 WeakPolarHBondContact O-CG 3.44Å; H897-M901 PolarHBondContact O-N 2.88Å; H897-L911 HydrophobicContact CB-CD2 4.23Å
898	L	86.3	Confident	74.9	Confident	1 Å²	1	46.7 Å²	46.7	1%	0.005	24%	0.239	C	C	.	.	H	α-helix	trans	-60.1	-47.6	175.9	-72	168.4	0	0	0	111.7	I894 V895 N900 M901 K902 F961 D962 I965	I894-L898 HydrophobicContact CG2-CD1 3.56Å; I894-L898 HydrophobicContact CG2-CG 4.17Å; I894-L898 WeakPolarHBondContact O-CB 3.43Å; I894-L898 WeakPolarHBondContact O-CG 3.29Å; I894-L898 PolarHBondContact O-N 3.11Å; V895-L898 PolarHBondContact O-N 3.42Å; L898-N900 VanDerWaalsContact C-N 3.33Å; L898-N900 PolarHBondContact O-N 2.8Å; L898-M901 HydrophobicContact CB-CE 4.44Å; L898-M901 HydrophobicContact CD2-CE 3.62Å; L898-M901 HydrophobicContact CG-CE 4.13Å; L898-M901 PolarHBondContact O-N 3.18Å; L898-K902 WeakPolarHBondContact O-CB 3.41Å; L898-K902 PolarHBondContact O-N 3.31Å; L898-F961 HydrophobicContact CD1-CD1 4.2Å; L898-F961 HydrophobicContact CD1-CE1 4.07Å; L898-F961 HydrophobicContact CD2-CD1 4.03Å; L898-F961 HydrophobicContact CD2-CE1 4.42Å; L898-D962 HydrophobicContact CD2-CB 4.03Å; L898-I965 HydrophobicContact CD1-CB 3.79Å; L898-I965 HydrophobicContact CD1-CG1 4.14Å; L898-I965 HydrophobicContact CD1-CG2 3.51Å
899	T	81.4	Confident	76.2	Confident	66 Å²	66	47.2 Å²	47.2	41%	0.405	24%	0.24	S	C	.	.	H	α-helix	trans	-58.9	-43.1	176.9	-59.3	0	0	0	0	111.6	V895 Y896 R903	V895-T899 WeakPolarHBondContact O-CB 3.32Å; V895-T899 PolarHBondContact O-N 3.5Å; V895-T899 PolarHBondContact O-OG1 3.06Å; Y896-T899 PolarHBondContact O-N 2.89Å; T899-R903 WeakPolarHBondContact O-CB 3.47Å; T899-R903 PolarHBondContact O-N 3.31Å
900	N	81.9	Confident	77.6	Confident	37 Å²	37	50.5 Å²	50.5	20%	0.198	26%	0.263	C	S	.	.	H	α-helix	trans	-70.7	-43.1	178.5	-84.8	-52.7	0	0	0	113.4	Y896 H897 L898 K902 R903 L904	Y896-N900 WeakPolarHBondContact CE1-ND2 3.47Å; Y896-N900 VanDerWaalsContact CZ-ND2 3.3Å; Y896-N900 WeakPolarHBondContact O-CB 3.19Å; Y896-N900 PolarHBondContact O-N 2.85Å; Y896-N900 PolarHBondContact O-ND2 3.15Å; H897-N900 PolarHBondContact O-N 3.23Å; L898-N900 VanDerWaalsContact C-N 3.33Å; L898-N900 PolarHBondContact O-N 2.8Å; N900-K902 VanDerWaalsContact C-N 3.33Å; N900-K902 PolarHBondContact O-N 3.29Å; N900-R903 PolarHBondContact O-N 2.8Å; N900-R903 PolarHBondContact OD1-NH2 3.13Å; N900-L904 PolarHBondContact O-N 2.73Å
901	M	85.2	Confident	79.1	Confident	4 Å²	4	51.1 Å²	51.1	2%	0.02	27%	0.267	C	S	.	.	H	α-helix	trans	-59.5	-45	173.4	-71.8	-176.8	-61.5	0	0	111	F617 H897 L898 L904 N905 N906 H909 L911 C912	F617-M901 HydrophobicContact CE2-CB 4.01Å; F617-M901 HydrophobicContact CZ-CB 3.73Å; H897-M901 HydrophobicContact CB-CE 4.5Å; H897-M901 WeakPolarHBondContact O-CB 3.44Å; H897-M901 VanDerWaalsContact O-CG 3.24Å; H897-M901 WeakPolarHBondContact O-CG 3.44Å; H897-M901 PolarHBondContact O-N 2.88Å; L898-M901 HydrophobicContact CB-CE 4.44Å; L898-M901 HydrophobicContact CD2-CE 3.62Å; L898-M901 HydrophobicContact CG-CE 4.13Å; L898-M901 PolarHBondContact O-N 3.18Å; M901-L904 CarbonylContact O-C 3.48Å; M901-L904 PolarHBondContact O-N 3.41Å; M901-N905 CarbonylContact O-C 3.51Å; M901-N905 VanDerWaalsContact O-CA 3.26Å; M901-N905 WeakPolarHBondContact O-CA 3.43Å; M901-N905 PolarHBondContact O-N 3.12Å; M901-N906 PolarHBondContact O-N 3.21Å; M901-H909 HydrophobicContact CG-CB 3.73Å; M901-H909 HydrophobicContact SD-CB 3.46Å; M901-H909 WeakPolarHBondContact SD-CB 3.38Å; M901-H909 PolarHBondContact SD-ND1 2.85Å; M901-L911 HydrophobicContact CE-CB 4.25Å; M901-L911 HydrophobicContact CE-CD2 3.8Å; M901-L911 HydrophobicContact CE-CG 4.21Å; M901-L911 HydrophobicContact SD-CB 4.2Å; M901-C912 PolarHBondContact SD-SG 3.25Å
902	K	81.4	Confident	81	Confident	46 Å²	46	50.5 Å²	50.5	20%	0.2	26%	0.263	C	S	.	.	H	α-helix	trans	-63.4	-43.6	177.7	-175.6	174.1	-160.4	156.1	0	112.7	F617 L618 L898 N900 L904 N905 D962	F617-K902 HydrophobicContact CB-CB 4.45Å; F617-K902 HydrophobicContact CB-CG 3.96Å; F617-K902 HydrophobicContact CD1-CB 4.29Å; F617-K902 HydrophobicContact CG-CB 4.18Å; F617-K902 HydrophobicContact CG-CG 4.23Å; L618-K902 VanDerWaalsContact O-CE 3.25Å; L618-K902 WeakPolarHBondContact O-CE 3.15Å; L618-K902 PolarHBondContact O-NZ 2.91Å; L898-K902 WeakPolarHBondContact O-CB 3.41Å; L898-K902 PolarHBondContact O-N 3.31Å; N900-K902 VanDerWaalsContact C-N 3.33Å; N900-K902 PolarHBondContact O-N 3.29Å; K902-L904 VanDerWaalsContact C-N 3.25Å; K902-L904 PolarHBondContact O-N 2.91Å; K902-N905 PolarHBondContact O-N 3.27Å; K902-D962 WeakPolarHBondContact CD-OD2 3.43Å; K902-D962 VanDerWaalsContact CE-OD2 3.31Å; K902-D962 WeakPolarHBondContact CE-OD2 3.31Å; K902-D962 IonicContact NZ-OD1 3.45Å; K902-D962 IonicContact NZ-OD2 2.73Å; K902-D962 PolarHBondContact NZ-OD2 2.95Å
903	R	75.1	Confident	82.8	Confident	115 Å²	115	52.4 Å²	52.4	43%	0.434	27%	0.266	S	S	.	.	H	α-helix	trans	-57.5	-37.9	176.8	177.5	172.5	67.2	148.6	-5.8	112.4	L624 L626 T899 N900	L624-R903 HydrophobicContact CD1-CB 4.38Å; L624-R903 HydrophobicContact CD1-CG 3.85Å; L626-R903 VanDerWaalsContact CD1-O 3.29Å; L626-R903 WeakPolarHBondContact CD1-O 3.19Å; T899-R903 WeakPolarHBondContact O-CB 3.47Å; T899-R903 PolarHBondContact O-N 3.31Å; N900-R903 PolarHBondContact O-N 2.8Å; N900-R903 PolarHBondContact OD1-NH2 3.13Å
904	L	73.8	Confident	83.9	Confident	123 Å²	123	53.6 Å²	53.6	64%	0.644	27%	0.269	S	S	*	.	H	α-helix	trans	-96.8	-2.8	-179.9	-62.5	177.2	0	0	0	113.5	N900 M901 K902 N906	N900-L904 PolarHBondContact O-N 2.73Å; M901-L904 CarbonylContact O-C 3.48Å; M901-L904 PolarHBondContact O-N 3.41Å; K902-L904 VanDerWaalsContact C-N 3.25Å; K902-L904 PolarHBondContact O-N 2.91Å; L904-N906 HydrophobicContact CB-CB 4.18Å; L904-N906 PolarHBondContact O-N 3.16Å
905	N	78	Confident	84.4	Confident	48 Å²	48	52.3 Å²	52.3	26%	0.257	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	45.7	39.2	-164.6	-169.8	72.5	0	0	0	112.6	S616 F617 M901 K902 I907	S616-N905 VanDerWaalsContact OG-CG 3.23Å; S616-N905 PolarHBondContact OG-ND2 3.3Å; S616-N905 PolarHBondContact OG-OD1 2.84Å; F617-N905 PolarHBondContact N-OD1 3.36Å; M901-N905 CarbonylContact O-C 3.51Å; M901-N905 VanDerWaalsContact O-CA 3.26Å; M901-N905 WeakPolarHBondContact O-CA 3.43Å; M901-N905 PolarHBondContact O-N 3.12Å; K902-N905 PolarHBondContact O-N 3.27Å; N905-I907 PolarHBondContact O-N 3.49Å
906	N	81.4	Confident	84.9	Confident	59 Å²	59	54.9 Å²	54.9	32%	0.316	27%	0.272	S	S	.	.			trans	-79.5	85	-177.1	-174.9	0.7	0	0	0	110.6	M901 L904 D908 H909	M901-N906 PolarHBondContact O-N 3.21Å; L904-N906 HydrophobicContact CB-CB 4.18Å; L904-N906 PolarHBondContact O-N 3.16Å; N906-D908 PolarHBondContact O-N 3.22Å; N906-D908 PolarHBondContact OD1-N 3.11Å; N906-H909 PolarHBondContact OD1-N 3Å
907	I	82.8	Confident	85.2	Confident	18 Å²	18	59.2 Å²	59.2	9%	0.092	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-19.7	179.1	-62.4	156.3	0	0	0	111.2	P613 F617 N905 H909 C912 R916	P613-I907 HydrophobicContact CB-CD1 3.72Å; P613-I907 HydrophobicContact CG-CD1 4.24Å; F617-I907 HydrophobicContact CE2-CG1 4.46Å; N905-I907 PolarHBondContact O-N 3.49Å; I907-H909 VanDerWaalsContact C-N 3.33Å; I907-C912 WeakPolarHBondContact O-CB 3.3Å; I907-R916 PolarHBondContact O-NH2 3.36Å
908	D	83.6	Confident	85.4	Confident	142 Å²	142	57 Å²	57	76%	0.759	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.4	-1.2	-177.8	-58.4	-38.2	0	0	0	113.5	N906	N906-D908 PolarHBondContact O-N 3.22Å; N906-D908 PolarHBondContact OD1-N 3.11Å
909	H	88.3	Confident	85.7	Confident	49 Å²	49	58.7 Å²	58.7	23%	0.227	30%	0.298	C	S	.	.	S	Bend	trans	-62.8	141	178.8	-174.5	-90.7	0	0	0	112.1	M901 N906 I907 L911 C912 E913	M901-H909 HydrophobicContact CG-CB 3.73Å; M901-H909 HydrophobicContact SD-CB 3.46Å; M901-H909 WeakPolarHBondContact SD-CB 3.38Å; M901-H909 PolarHBondContact SD-ND1 2.85Å; N906-H909 PolarHBondContact OD1-N 3Å; I907-H909 VanDerWaalsContact C-N 3.33Å; H909-L911 VanDerWaalsContact C-N 3.26Å; H909-L911 PolarHBondContact ND1-N 3.29Å; H909-L911 PolarHBondContact O-N 3.11Å; H909-L911 VanDerWaalsContact O-N 3.07Å; H909-C912 WeakPolarHBondContact O-CA 3.34Å; H909-C912 VanDerWaalsContact O-CB 3.27Å; H909-C912 WeakPolarHBondContact O-CB 3.16Å; H909-C912 PolarHBondContact O-N 3.4Å; H909-E913 PolarHBondContact O-N 2.76Å
910	P	90.1	Very high	86.2	Confident	84 Å²	84	62.3 Å²	62.3	55%	0.545	31%	0.305	S	S	.	.	H	α-helix	trans	-54.8	-33.4	-174.6	-29.8	36.1	0	0	0	115.6	C912 E913 H914	P910-C912 VanDerWaalsContact C-N 3.33Å; P910-C912 PolarHBondContact O-N 2.98Å; P910-E913 WeakPolarHBondContact O-CB 3.3Å; P910-E913 PolarHBondContact O-N 3.24Å; P910-E913 VanDerWaalsContact O-N 3.14Å; P910-H914 PolarHBondContact O-N 2.92Å
911	L	90.4	Very high	86.6	Confident	26 Å²	26	60.9 Å²	60.9	14%	0.136	30%	0.297	C	S	.	.	H	α-helix	trans	-63.5	-36.2	174.9	-177.8	55.8	0	0	0	112.6	H897 M901 H909 E913 H914 L915 L921	H897-L911 HydrophobicContact CB-CD2 4.23Å; M901-L911 HydrophobicContact CE-CB 4.25Å; M901-L911 HydrophobicContact CE-CD2 3.8Å; M901-L911 HydrophobicContact CE-CG 4.21Å; M901-L911 HydrophobicContact SD-CB 4.2Å; H909-L911 VanDerWaalsContact C-N 3.26Å; H909-L911 PolarHBondContact ND1-N 3.29Å; H909-L911 PolarHBondContact O-N 3.11Å; H909-L911 VanDerWaalsContact O-N 3.07Å; L911-E913 VanDerWaalsContact C-N 3.29Å; L911-E913 PolarHBondContact O-N 2.93Å; L911-H914 PolarHBondContact O-N 3.43Å; L911-L915 HydrophobicContact CD1-CG 4.48Å; L911-L915 HydrophobicContact CG-CD1 4.31Å; L911-L915 VanDerWaalsContact O-CG 3.27Å; L911-L915 WeakPolarHBondContact O-CG 3.37Å; L911-L915 PolarHBondContact O-N 3.26Å; L911-L915 VanDerWaalsContact O-N 3.08Å; L911-L921 HydrophobicContact CD1-CD2 4.04Å
912	C	90.4	Very high	86.9	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-63.4	-38.8	172.9	-65.3	0	0	0	0	110.9	M901 I907 H909 P910 L915 R916 P958	M901-C912 PolarHBondContact SD-SG 3.25Å; I907-C912 WeakPolarHBondContact O-CB 3.3Å; H909-C912 WeakPolarHBondContact O-CA 3.34Å; H909-C912 VanDerWaalsContact O-CB 3.27Å; H909-C912 WeakPolarHBondContact O-CB 3.16Å; H909-C912 PolarHBondContact O-N 3.4Å; P910-C912 VanDerWaalsContact C-N 3.33Å; P910-C912 PolarHBondContact O-N 2.98Å; C912-L915 PolarHBondContact O-N 3.01Å; C912-R916 WeakPolarHBondContact O-CG 3.15Å; C912-R916 PolarHBondContact O-N 3.04Å; C912-R916 VanDerWaalsContact O-N 3.11Å; C912-P958 HydrophobicContact CB-CB 4.02Å; C912-P958 HydrophobicContact CB-CG 3.9Å; C912-P958 WeakPolarHBondContact O-CG 3.01Å
913	E	89.4	Confident	87.4	Confident	74 Å²	74	60.8 Å²	60.8	35%	0.346	30%	0.298	S	S	.	.	H	α-helix	trans	-68.7	-43.1	178.3	-175.2	52.8	-149.9	0	0	112	H909 P910 L911 L915 R916 Q917	H909-E913 PolarHBondContact O-N 2.76Å; P910-E913 WeakPolarHBondContact O-CB 3.3Å; P910-E913 PolarHBondContact O-N 3.24Å; P910-E913 VanDerWaalsContact O-N 3.14Å; L911-E913 VanDerWaalsContact C-N 3.29Å; L911-E913 PolarHBondContact O-N 2.93Å; E913-L915 VanDerWaalsContact C-N 3.28Å; E913-L915 PolarHBondContact O-N 3.25Å; E913-R916 WeakPolarHBondContact O-CB 3.31Å; E913-R916 PolarHBondContact O-N 2.86Å; E913-R916 WeakPolarHBondContact OE2-CD 3.21Å; E913-R916 IonicContact OE2-CZ 2.77Å; E913-R916 IonicContact OE2-NE 2.71Å; E913-R916 IonicContact OE2-NH1 2.73Å; E913-R916 PolarHBondContact OE2-NH1 3.35Å; E913-Q917 WeakPolarHBondContact O-CG 3.41Å; E913-Q917 PolarHBondContact O-N 2.76Å; E913-Q917 VanDerWaalsContact O-N 3.08Å; E913-Q917 PolarHBondContact OE1-NE2 2.97Å
914	H	91	Very high	88	Confident	90 Å²	90	61.2 Å²	61.2	42%	0.417	30%	0.301	S	S	.	.	H	α-helix	trans	-59.5	-37.7	173	-67.8	178.1	0	0	0	112.6	P910 L911 R916 Q917 G918	P910-H914 PolarHBondContact O-N 2.92Å; L911-H914 PolarHBondContact O-N 3.43Å; H914-R916 VanDerWaalsContact C-N 3.31Å; H914-R916 PolarHBondContact O-N 2.63Å; H914-Q917 PolarHBondContact O-N 3.07Å; H914-G918 PolarHBondContact O-N 2.73Å
915	L	92.1	Very high	88.6	Confident	2 Å²	2	55.7 Å²	55.7	1%	0.01	27%	0.272	C	S	.	.	H	α-helix	trans	-69.9	-23.4	175.3	-70.9	168	0	0	0	113.4	L911 C912 E913 L921 K957 P958 F961	L911-L915 HydrophobicContact CD1-CG 4.48Å; L911-L915 HydrophobicContact CG-CD1 4.31Å; L911-L915 VanDerWaalsContact O-CG 3.27Å; L911-L915 WeakPolarHBondContact O-CG 3.37Å; L911-L915 PolarHBondContact O-N 3.26Å; L911-L915 VanDerWaalsContact O-N 3.08Å; C912-L915 PolarHBondContact O-N 3.01Å; E913-L915 VanDerWaalsContact C-N 3.28Å; E913-L915 PolarHBondContact O-N 3.25Å; L915-L921 HydrophobicContact CD2-CD2 4.32Å; L915-K957 VanDerWaalsContact O-CB 3.28Å; L915-K957 WeakPolarHBondContact O-CB 3.44Å; L915-K957 WeakPolarHBondContact O-CD 3.29Å; L915-P958 HydrophobicContact CB-CG 4.25Å; L915-F961 HydrophobicContact CD1-CB 4.1Å; L915-F961 HydrophobicContact CD1-CD1 3.53Å; L915-F961 HydrophobicContact CD1-CE1 4.13Å; L915-F961 HydrophobicContact CD1-CG 3.91Å; L915-F961 HydrophobicContact CD2-CB 4.35Å; L915-F961 HydrophobicContact CD2-CD1 3.93Å; L915-F961 HydrophobicContact CD2-CD2 3.87Å; L915-F961 HydrophobicContact CD2-CE1 4.15Å; L915-F961 HydrophobicContact CD2-CE2 4.11Å; L915-F961 HydrophobicContact CD2-CG 3.79Å; L915-F961 HydrophobicContact CD2-CZ 4.25Å; L915-F961 HydrophobicContact CG-CD1 4.41Å
916	R	90.5	Very high	89	Confident	57 Å²	57	54 Å²	54	22%	0.215	26%	0.264	C	S	.	.	H	α-helix	trans	-74.6	-36.5	169.6	-68.5	177.6	-163.3	111.8	10	111.8	I907 C912 E913 H914 A954 P958	I907-R916 PolarHBondContact O-NH2 3.36Å; C912-R916 WeakPolarHBondContact O-CG 3.15Å; C912-R916 PolarHBondContact O-N 3.04Å; C912-R916 VanDerWaalsContact O-N 3.11Å; E913-R916 WeakPolarHBondContact O-CB 3.31Å; E913-R916 PolarHBondContact O-N 2.86Å; E913-R916 WeakPolarHBondContact OE2-CD 3.21Å; E913-R916 IonicContact OE2-CZ 2.77Å; E913-R916 IonicContact OE2-NE 2.71Å; E913-R916 IonicContact OE2-NH1 2.73Å; E913-R916 PolarHBondContact OE2-NH1 3.35Å; H914-R916 VanDerWaalsContact C-N 3.31Å; H914-R916 PolarHBondContact O-N 2.63Å; R916-A954 HydrophobicContact CB-CB 4.16Å; R916-A954 HydrophobicContact CG-CB 4.48Å; R916-A954 WeakPolarHBondContact CG-O 3.31Å; R916-P958 HydrophobicContact CG-CG 4.3Å
917	Q	90.7	Very high	89.2	Confident	135 Å²	135	57.6 Å²	57.6	63%	0.631	28%	0.276	S	S	*	.	H	α-helix	trans	-78.4	-27.1	-172.7	-69.9	174.7	7	0	0	113.9	E913 H914	E913-Q917 WeakPolarHBondContact O-CG 3.41Å; E913-Q917 PolarHBondContact O-N 2.76Å; E913-Q917 VanDerWaalsContact O-N 3.08Å; E913-Q917 PolarHBondContact OE1-NE2 2.97Å; H914-Q917 PolarHBondContact O-N 3.07Å
918	G	90.2	Very high	89.1	Confident	21 Å²	21	60.6 Å²	60.6	22%	0.216	29%	0.286	C	S	.	.			trans	177.8	166.3	173.3	0	0	0	0	0	116	H914 W920	H914-G918 PolarHBondContact O-N 2.73Å; G918-W920 VanDerWaalsContact C-N 3.33Å; G918-W920 PolarHBondContact O-N 3.06Å
919	D	92	Very high	88.9	Confident	36 Å²	36	54 Å²	54	19%	0.193	25%	0.251	C	S	.	.	S	Bend	trans	-93	18.7	-169	-54.7	-53.5	0	0	0	114.3	L921 P922 D923 Y949 K950 K957	D919-L921 PolarHBondContact O-N 3.15Å; D919-P922 HydrophobicContact CB-CG 4.39Å; D919-P922 WeakPolarHBondContact O-CB 3.22Å; D919-P922 VanDerWaalsContact O-CD 3.27Å; D919-P922 WeakPolarHBondContact O-CD 3.43Å; D919-D923 PolarHBondContact O-N 3.39Å; D919-Y949 VanDerWaalsContact OD1-CE1 3.28Å; D919-Y949 WeakPolarHBondContact OD1-CE1 3.42Å; D919-K950 HydrophobicContact CB-CG 4.31Å; D919-K957 WeakPolarHBondContact OD1-CD 3.41Å; D919-K957 WeakPolarHBondContact OD1-CE 3.49Å; D919-K957 IonicContact OD1-NZ 3Å; D919-K957 PolarHBondContact OD1-NZ 2.92Å; D919-K957 IonicContact OD2-NZ 3.08Å; D919-K957 PolarHBondContact OD2-NZ 2.87Å
920	W	92.6	Very high	88.4	Confident	143 Å²	143	55.2 Å²	55.2	54%	0.542	27%	0.265	S	S	.	.	H	α-helix	trans	-58.9	-33.2	-176.3	71.3	-91	0	0	0	113.2	G918 Y924	G918-W920 VanDerWaalsContact C-N 3.33Å; G918-W920 PolarHBondContact O-N 3.06Å; W920-Y924 VanDerWaalsContact O-CB 3.26Å; W920-Y924 WeakPolarHBondContact O-CB 3.29Å; W920-Y924 PolarHBondContact O-N 3.03Å
921	L	90.5	Very high	87.5	Confident	6 Å²	6	55.1 Å²	55.1	3%	0.031	27%	0.272	C	S	.	.	H	α-helix	trans	-75.9	-47.9	-178.6	-178.3	60.2	0	0	0	112.2	I894 L911 L915 D919 D923 Y924 I925 F961	I894-L921 HydrophobicContact CD1-CD1 3.87Å; I894-L921 HydrophobicContact CD1-CD2 4.33Å; L911-L921 HydrophobicContact CD1-CD2 4.04Å; L915-L921 HydrophobicContact CD2-CD2 4.32Å; D919-L921 PolarHBondContact O-N 3.15Å; L921-D923 VanDerWaalsContact C-N 3.35Å; L921-D923 PolarHBondContact O-N 2.87Å; L921-Y924 HydrophobicContact CD1-CD1 4.25Å; L921-Y924 PolarHBondContact O-N 2.88Å; L921-I925 HydrophobicContact CD1-CD1 4.33Å; L921-I925 HydrophobicContact CD1-CG1 4.46Å; L921-I925 HydrophobicContact CG-CD1 4.25Å; L921-I925 WeakPolarHBondContact O-CG1 3.26Å; L921-I925 PolarHBondContact O-N 3.42Å; L921-F961 HydrophobicContact CD2-CE1 3.94Å; L921-F961 HydrophobicContact CD2-CE2 4.38Å; L921-F961 HydrophobicContact CD2-CZ 3.54Å; L921-F961 HydrophobicContact CG-CE2 4.27Å; L921-F961 HydrophobicContact CG-CZ 3.76Å
922	P	90.8	Very high	86.4	Confident	0 Å²	0	56 Å²	56	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-44.8	-54	161.5	-31.3	32.8	0	0	0	113.9	D919 Y924 I925 T926 F946 Y949 F961	D919-P922 HydrophobicContact CB-CG 4.39Å; D919-P922 WeakPolarHBondContact O-CB 3.22Å; D919-P922 VanDerWaalsContact O-CD 3.27Å; D919-P922 WeakPolarHBondContact O-CD 3.43Å; P922-Y924 VanDerWaalsContact C-N 3.31Å; P922-Y924 PolarHBondContact O-N 3.43Å; P922-I925 PolarHBondContact O-N 2.89Å; P922-T926 PolarHBondContact O-N 3.49Å; P922-T926 VanDerWaalsContact O-N 3.1Å; P922-T926 PolarHBondContact O-OG1 3.01Å; P922-F946 HydrophobicContact CB-CB 4.14Å; P922-F946 HydrophobicContact CB-CD1 3.71Å; P922-F946 HydrophobicContact CB-CD2 3.98Å; P922-F946 HydrophobicContact CB-CE1 4.03Å; P922-F946 HydrophobicContact CB-CE2 4.27Å; P922-F946 HydrophobicContact CB-CG 3.7Å; P922-F946 HydrophobicContact CB-CZ 4.3Å; P922-F946 HydrophobicContact CG-CD1 4.18Å; P922-F946 HydrophobicContact CG-CE1 4.22Å; P922-Y949 HydrophobicContact CG-CD1 4.08Å; P922-Y949 HydrophobicContact CG-CE1 3.58Å; P922-F961 HydrophobicContact CG-CD2 4.05Å; P922-F961 HydrophobicContact CG-CE2 3.97Å
923	D	90.9	Very high	85	Confident	48 Å²	48	63.6 Å²	63.6	26%	0.257	31%	0.314	S	S	.	.	H	α-helix	trans	-62	-37.8	-179.1	-79.2	-15.2	0	0	0	112.4	D919 L921 K927 K950	D919-D923 PolarHBondContact O-N 3.39Å; L921-D923 VanDerWaalsContact C-N 3.35Å; L921-D923 PolarHBondContact O-N 2.87Å; D923-K927 WeakPolarHBondContact O-CB 3.46Å; D923-K927 WeakPolarHBondContact O-CD 3.42Å; D923-K927 WeakPolarHBondContact O-CG 3.42Å; D923-K927 PolarHBondContact O-N 3Å; D923-K950 VanDerWaalsContact OD1-CE 3.28Å; D923-K950 WeakPolarHBondContact OD1-CE 3.28Å; D923-K950 IonicContact OD1-NZ 3.44Å; D923-K950 PolarHBondContact OD1-NZ 3.17Å
924	Y	88.5	Confident	83.8	Confident	125 Å²	125	60.7 Å²	60.7	49%	0.49	30%	0.303	S	S	.	.	H	α-helix	trans	-65	-42.1	176	173.4	-102.6	0	0	0	112.1	W920 L921 P922 K927 R928	W920-Y924 VanDerWaalsContact O-CB 3.26Å; W920-Y924 WeakPolarHBondContact O-CB 3.29Å; W920-Y924 PolarHBondContact O-N 3.03Å; L921-Y924 HydrophobicContact CD1-CD1 4.25Å; L921-Y924 PolarHBondContact O-N 2.88Å; P922-Y924 VanDerWaalsContact C-N 3.31Å; P922-Y924 PolarHBondContact O-N 3.43Å; Y924-K927 PolarHBondContact O-N 3.18Å; Y924-R928 WeakPolarHBondContact O-CB 3.46Å; Y924-R928 PolarHBondContact O-N 2.94Å
925	I	86.2	Confident	83	Confident	6 Å²	6	56.4 Å²	56.4	3%	0.031	28%	0.283	C	S	.	.	H	α-helix	trans	-63.6	-49.1	178.9	-70.8	167.9	0	0	0	110.7	F889 L921 P922 K927 R928 F929 F942 F946 F961 I965	F889-I925 HydrophobicContact CE2-CD1 4.28Å; F889-I925 HydrophobicContact CE2-CG1 4.48Å; F889-I925 HydrophobicContact CE2-CG2 3.89Å; L921-I925 HydrophobicContact CD1-CD1 4.33Å; L921-I925 HydrophobicContact CD1-CG1 4.46Å; L921-I925 HydrophobicContact CG-CD1 4.25Å; L921-I925 WeakPolarHBondContact O-CG1 3.26Å; L921-I925 PolarHBondContact O-N 3.42Å; P922-I925 PolarHBondContact O-N 2.89Å; I925-K927 PolarHBondContact O-N 3.16Å; I925-R928 PolarHBondContact O-N 2.88Å; I925-F929 HydrophobicContact CG2-CD2 3.85Å; I925-F929 HydrophobicContact CG2-CE2 3.81Å; I925-F929 WeakPolarHBondContact O-CD2 3.46Å; I925-F929 PolarHBondContact O-N 3.1Å; I925-F929 VanDerWaalsContact O-N 3.08Å; I925-F942 HydrophobicContact CG2-CD1 4.34Å; I925-F942 HydrophobicContact CG2-CD2 4.35Å; I925-F942 HydrophobicContact CG2-CE1 4.44Å; I925-F942 HydrophobicContact CG2-CE2 4.48Å; I925-F942 HydrophobicContact CG2-CG 4.3Å; I925-F946 HydrophobicContact CB-CE2 4.2Å; I925-F946 HydrophobicContact CG2-CE2 4.02Å; I925-F961 HydrophobicContact CD1-CE2 4.06Å; I925-F961 HydrophobicContact CD1-CZ 3.83Å; I925-I965 HydrophobicContact CD1-CD1 3.62Å
926	T	87.2	Confident	82.1	Confident	13 Å²	13	58.3 Å²	58.3	8%	0.08	30%	0.3	C	S	.	.	H	α-helix	trans	-58.7	-48.8	176	-58.1	0	0	0	0	111.2	P922 R928 F929 S930 S939 N943	P922-T926 PolarHBondContact O-N 3.49Å; P922-T926 VanDerWaalsContact O-N 3.1Å; P922-T926 PolarHBondContact O-OG1 3.01Å; T926-R928 VanDerWaalsContact C-N 3.3Å; T926-R928 PolarHBondContact O-N 3.08Å; T926-F929 PolarHBondContact O-N 2.84Å; T926-S930 WeakPolarHBondContact O-CB 3.49Å; T926-S930 PolarHBondContact O-N 3.41Å; T926-S939 PolarHBondContact O-OG 2.8Å; T926-S939 VanDerWaalsContact O-OG 3.07Å; T926-N943 HydrophobicContact CG2-CB 3.68Å
927	K	85.4	Confident	81.4	Confident	134 Å²	134	61.7 Å²	61.7	58%	0.583	32%	0.318	S	S	*	.	H	α-helix	trans	-59.8	-39.1	178.7	-74.4	166	-173.6	162.2	0	112.2	D923 Y924 I925 S930 A931	D923-K927 WeakPolarHBondContact O-CB 3.46Å; D923-K927 WeakPolarHBondContact O-CD 3.42Å; D923-K927 WeakPolarHBondContact O-CG 3.42Å; D923-K927 PolarHBondContact O-N 3Å; Y924-K927 PolarHBondContact O-N 3.18Å; I925-K927 PolarHBondContact O-N 3.16Å; K927-S930 WeakPolarHBondContact CA-OG 3.39Å; K927-S930 PolarHBondContact O-N 3.4Å; K927-S930 PolarHBondContact O-OG 2.7Å; K927-A931 PolarHBondContact O-N 2.95Å
928	R	79.8	Confident	80.9	Confident	81 Å²	81	55.3 Å²	55.3	31%	0.306	29%	0.288	S	S	.	.	H	α-helix	trans	-61.9	-53.2	176.7	-174.3	175.9	-178.9	169.7	3.1	111.5	D888 Y924 I925 T926 S930 A931	D888-R928 VanDerWaalsContact CB-NH2 3.33Å; D888-R928 IonicContact OD2-NH2 2.78Å; D888-R928 PolarHBondContact OD2-NH2 2.83Å; D888-R928 VanDerWaalsContact OD2-NH2 3.08Å; Y924-R928 WeakPolarHBondContact O-CB 3.46Å; Y924-R928 PolarHBondContact O-N 2.94Å; I925-R928 PolarHBondContact O-N 2.88Å; T926-R928 VanDerWaalsContact C-N 3.3Å; T926-R928 PolarHBondContact O-N 3.08Å; R928-S930 PolarHBondContact O-N 3.25Å; R928-A931 WeakPolarHBondContact O-CB 3.43Å; R928-A931 PolarHBondContact O-N 3.08Å; R928-A931 VanDerWaalsContact O-N 3.16Å
929	F	79.2	Confident	80.6	Confident	4 Å²	4	54.8 Å²	54.8	2%	0.018	28%	0.281	C	S	.	.	H	α-helix	trans	-65.7	-25.6	178.6	-74.9	-63	0	0	0	113.3	E885 I886 F889 I925 T926 A931 T935 V938 F942	E885-F929 HydrophobicContact CB-CE1 4.36Å; I886-F929 HydrophobicContact CG1-CE1 4.18Å; F889-F929 HydrophobicContact CB-CZ 4.11Å; F889-F929 AromaticContact CD2-CE2 3.67Å; F889-F929 HydrophobicContact CD2-CE2 3.67Å; F889-F929 AromaticContact CD2-CZ 3.68Å; F889-F929 HydrophobicContact CD2-CZ 3.68Å; F889-F929 AromaticContact CE2-CE2 3.85Å; F889-F929 HydrophobicContact CE2-CE2 3.85Å; F889-F929 HydrophobicContact CE2-CZ 4.24Å; F889-F929 HydrophobicContact CG-CE2 4.45Å; F889-F929 HydrophobicContact CG-CZ 4.03Å; I925-F929 HydrophobicContact CG2-CD2 3.85Å; I925-F929 HydrophobicContact CG2-CE2 3.81Å; I925-F929 WeakPolarHBondContact O-CD2 3.46Å; I925-F929 PolarHBondContact O-N 3.1Å; I925-F929 VanDerWaalsContact O-N 3.08Å; T926-F929 PolarHBondContact O-N 2.84Å; F929-A931 VanDerWaalsContact C-N 3.27Å; F929-A931 PolarHBondContact O-N 2.82Å; F929-T935 HydrophobicContact CD1-CG2 3.83Å; F929-T935 HydrophobicContact CE1-CG2 4.34Å; F929-T935 WeakPolarHBondContact O-CB 3.39Å; F929-T935 PolarHBondContact O-OG1 2.9Å; F929-V938 HydrophobicContact CD1-CG1 4.21Å; F929-V938 HydrophobicContact CD2-CG1 4.42Å; F929-V938 HydrophobicContact CE1-CG1 4.28Å; F929-V938 HydrophobicContact CE2-CG1 4.49Å; F929-V938 HydrophobicContact CG-CG1 4.28Å; F929-V938 HydrophobicContact CZ-CG1 4.41Å; F929-F942 AromaticContact CD2-CD2 3.6Å; F929-F942 HydrophobicContact CD2-CD2 3.6Å; F929-F942 AromaticContact CD2-CE2 3.72Å; F929-F942 HydrophobicContact CD2-CE2 3.72Å; F929-F942 AromaticContact CE2-CD2 3.71Å; F929-F942 HydrophobicContact CE2-CD2 3.71Å; F929-F942 AromaticContact CE2-CE2 3.3Å; F929-F942 HydrophobicContact CE2-CE2 3.3Å; F929-F942 HydrophobicContact CE2-CZ 4.13Å; F929-F942 HydrophobicContact CZ-CE2 4.02Å
930	S	79.5	Confident	80.2	Confident	75 Å²	75	59.7 Å²	59.7	52%	0.524	30%	0.303	S	S	.	.	H	α-helix	trans	-71.1	-19.3	175.4	77.4	0	0	0	0	114.2	T926 K927 R928 T932 S939	T926-S930 WeakPolarHBondContact O-CB 3.49Å; T926-S930 PolarHBondContact O-N 3.41Å; K927-S930 WeakPolarHBondContact CA-OG 3.39Å; K927-S930 PolarHBondContact O-N 3.4Å; K927-S930 PolarHBondContact O-OG 2.7Å; R928-S930 PolarHBondContact O-N 3.25Å; S930-T932 VanDerWaalsContact C-N 3.27Å; S930-T932 PolarHBondContact O-N 3.28Å; S930-S939 WeakPolarHBondContact CA-OG 3.4Å; S930-S939 WeakPolarHBondContact CB-OG 3.46Å; S930-S939 PolarHBondContact N-OG 2.78Å
931	A	70.8	Confident	79.9	Confident	82 Å²	82	55.1 Å²	55.1	68%	0.678	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-17.5	-177.2	0	0	0	0	0	113.4	K927 R928 F929	K927-A931 PolarHBondContact O-N 2.95Å; R928-A931 WeakPolarHBondContact O-CB 3.43Å; R928-A931 PolarHBondContact O-N 3.08Å; R928-A931 VanDerWaalsContact O-N 3.16Å; F929-A931 VanDerWaalsContact C-N 3.27Å; F929-A931 PolarHBondContact O-N 2.82Å
932	T	66.1	Low	79.8	Confident	45 Å²	45	54.8 Å²	54.8	28%	0.276	28%	0.284	S	S	.	.	S	Bend	trans	-118	128.9	-174.8	-74.9	0	0	0	0	111	E885 S930 G934 T935	E885-T932 VanDerWaalsContact CD-CB 3.48Å; E885-T932 VanDerWaalsContact CD-OG1 3.3Å; E885-T932 VanDerWaalsContact OE1-CB 3.24Å; E885-T932 WeakPolarHBondContact OE1-CB 3.48Å; E885-T932 PolarHBondContact OE1-OG1 2.68Å; E885-T932 WeakPolarHBondContact OE2-CB 3.32Å; S930-T932 VanDerWaalsContact C-N 3.27Å; S930-T932 PolarHBondContact O-N 3.28Å; T932-G934 VanDerWaalsContact C-N 3.29Å; T932-G934 PolarHBondContact O-N 2.9Å; T932-T935 WeakPolarHBondContact CB-OG1 3.23Å; T932-T935 PolarHBondContact O-N 3.42Å; T932-T935 VanDerWaalsContact O-N 3.11Å; T932-T935 PolarHBondContact O-OG1 2.9Å
933	Q	62.3	Low	79.7	Confident	159 Å²	159	58.3 Å²	58.3	74%	0.743	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	-61.8	-35.7	-172.9	-170.6	175.6	5.2	0	0	112.9	T935	Q933-T935 VanDerWaalsContact C-N 3.25Å; Q933-T935 PolarHBondContact O-N 3.14Å
934	G	64.5	Low	79.7	Confident	12 Å²	12	61.3 Å²	61.3	12%	0.124	31%	0.311	C	S	.	.	G	3₁₀ helix	trans	-73.2	-10.1	178.6	0	0	0	0	0	114.9	P879 T932	P879-G934 WeakPolarHBondContact CD-O 3.25Å; P879-G934 WeakPolarHBondContact CG-O 3.33Å; T932-G934 VanDerWaalsContact C-N 3.29Å; T932-G934 PolarHBondContact O-N 2.9Å
935	T	72.7	Confident	79.7	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-112.2	9.9	-179.2	42.9	0	0	0	0	112.8	E885 F929 T932 Q933 E937 V938 S939	E885-T935 HydrophobicContact CB-CG2 4.4Å; E885-T935 PolarHBondContact OE2-OG1 2.76Å; F929-T935 HydrophobicContact CD1-CG2 3.83Å; F929-T935 HydrophobicContact CE1-CG2 4.34Å; F929-T935 WeakPolarHBondContact O-CB 3.39Å; F929-T935 PolarHBondContact O-OG1 2.9Å; T932-T935 WeakPolarHBondContact CB-OG1 3.23Å; T932-T935 PolarHBondContact O-N 3.42Å; T932-T935 VanDerWaalsContact O-N 3.11Å; T932-T935 PolarHBondContact O-OG1 2.9Å; Q933-T935 VanDerWaalsContact C-N 3.25Å; Q933-T935 PolarHBondContact O-N 3.14Å; T935-E937 PolarHBondContact O-N 3.01Å; T935-V938 CarbonylContact O-C 3.58Å; T935-V938 WeakPolarHBondContact O-CB 3.37Å; T935-V938 PolarHBondContact O-N 2.82Å; T935-V938 VanDerWaalsContact O-N 3.09Å; T935-S939 WeakPolarHBondContact O-CB 3.47Å; T935-S939 PolarHBondContact O-N 2.79Å
936	A	72.9	Confident	80.1	Confident	43 Å²	43	55.1 Å²	55.1	36%	0.355	29%	0.286	S	S	.	.	H	α-helix	trans	-53.6	-49.7	179.7	0	0	0	0	0	112.7	V938 S939 E940	A936-V938 VanDerWaalsContact C-N 3.31Å; A936-V938 PolarHBondContact O-N 3.03Å; A936-S939 CarbonylContact O-C 3.45Å; A936-S939 WeakPolarHBondContact O-CB 3.39Å; A936-S939 PolarHBondContact O-N 2.93Å; A936-S939 VanDerWaalsContact O-N 3.16Å; A936-E940 WeakPolarHBondContact O-CG 3.23Å; A936-E940 PolarHBondContact O-N 2.81Å
937	E	76.4	Confident	80.3	Confident	127 Å²	127	59 Å²	59	59%	0.593	30%	0.303	S	S	*	.	H	α-helix	trans	-62	-36.8	177.5	-62.6	-178.1	-178.9	0	0	112.7	T935 E940 W941	T935-E937 PolarHBondContact O-N 3.01Å; E937-E940 PolarHBondContact O-N 3.35Å; E937-W941 WeakPolarHBondContact O-CB 3.48Å; E937-W941 PolarHBondContact O-N 3.2Å
938	V	79.7	Confident	80.6	Confident	2 Å²	2	53.7 Å²	53.7	1%	0.012	28%	0.282	C	S	.	.	H	α-helix	trans	-68.7	-40.4	176.3	-179.7	0	0	0	0	110.4	I876 L878 F929 T935 A936 W941 F942 M972	I876-V938 HydrophobicContact CG2-CG2 4.05Å; L878-V938 HydrophobicContact CD2-CG2 3.49Å; L878-V938 VanDerWaalsContact CD2-CG2 3.49Å; F929-V938 HydrophobicContact CD1-CG1 4.21Å; F929-V938 HydrophobicContact CD2-CG1 4.42Å; F929-V938 HydrophobicContact CE1-CG1 4.28Å; F929-V938 HydrophobicContact CE2-CG1 4.49Å; F929-V938 HydrophobicContact CG-CG1 4.28Å; F929-V938 HydrophobicContact CZ-CG1 4.41Å; T935-V938 CarbonylContact O-C 3.58Å; T935-V938 WeakPolarHBondContact O-CB 3.37Å; T935-V938 PolarHBondContact O-N 2.82Å; T935-V938 VanDerWaalsContact O-N 3.09Å; A936-V938 VanDerWaalsContact C-N 3.31Å; A936-V938 PolarHBondContact O-N 3.03Å; V938-W941 PolarHBondContact O-N 3.08Å; V938-F942 HydrophobicContact CG1-CD2 3.72Å; V938-F942 HydrophobicContact CG1-CE2 3.64Å; V938-F942 VanDerWaalsContact O-CD2 3.25Å; V938-F942 WeakPolarHBondContact O-CD2 3.34Å; V938-F942 PolarHBondContact O-N 3.39Å; V938-M972 HydrophobicContact CG1-SD 4.31Å
939	S	83.9	Confident	81.1	Confident	9 Å²	9	49.9 Å²	49.9	6%	0.063	27%	0.267	C	S	.	.	H	α-helix	trans	-65.4	-42.9	174.7	-171.9	0	0	0	0	111.8	T926 S930 T935 A936 F942 N943	T926-S939 PolarHBondContact O-OG 2.8Å; T926-S939 VanDerWaalsContact O-OG 3.07Å; S930-S939 WeakPolarHBondContact CA-OG 3.4Å; S930-S939 WeakPolarHBondContact CB-OG 3.46Å; S930-S939 PolarHBondContact N-OG 2.78Å; T935-S939 WeakPolarHBondContact O-CB 3.47Å; T935-S939 PolarHBondContact O-N 2.79Å; A936-S939 CarbonylContact O-C 3.45Å; A936-S939 WeakPolarHBondContact O-CB 3.39Å; A936-S939 PolarHBondContact O-N 2.93Å; A936-S939 VanDerWaalsContact O-N 3.16Å; S939-F942 PolarHBondContact O-N 3.45Å; S939-N943 WeakPolarHBondContact O-CB 3.41Å; S939-N943 PolarHBondContact O-N 2.75Å
940	E	85.2	Confident	81.8	Confident	139 Å²	139	52.5 Å²	52.5	65%	0.65	28%	0.278	S	S	*	.	H	α-helix	trans	-63.4	-42	175.7	-75.3	179.5	-177.1	0	0	111	A936 E937 N943 Y944	A936-E940 WeakPolarHBondContact O-CG 3.23Å; A936-E940 PolarHBondContact O-N 2.81Å; E937-E940 PolarHBondContact O-N 3.35Å; E940-N943 PolarHBondContact O-N 2.8Å; E940-Y944 WeakPolarHBondContact O-CB 3.42Å; E940-Y944 PolarHBondContact O-N 2.88Å
941	W	85.2	Confident	82.2	Confident	47 Å²	47	53 Å²	53	18%	0.178	28%	0.276	C	S	.	.	H	α-helix	trans	-63.5	-48.4	174.2	-175.8	87.2	0	0	0	112.3	I873 E937 V938 N943 Y944 M945 I964 A968	I873-W941 HydrophobicContact CD1-CH2 4.04Å; I873-W941 HydrophobicContact CD1-CZ2 3.57Å; I873-W941 HydrophobicContact CG1-CZ2 3.94Å; I873-W941 HydrophobicContact CG2-CZ2 3.94Å; E937-W941 WeakPolarHBondContact O-CB 3.48Å; E937-W941 PolarHBondContact O-N 3.2Å; V938-W941 PolarHBondContact O-N 3.08Å; W941-N943 VanDerWaalsContact C-N 3.3Å; W941-N943 PolarHBondContact O-N 3.13Å; W941-Y944 PolarHBondContact O-N 2.86Å; W941-M945 HydrophobicContact CD2-CG 3.94Å; W941-M945 HydrophobicContact CE3-CG 4.17Å; W941-M945 HydrophobicContact CH2-CE 4.37Å; W941-M945 HydrophobicContact CH2-CG 3.88Å; W941-M945 HydrophobicContact CZ2-CE 4.06Å; W941-M945 HydrophobicContact CZ2-CG 3.61Å; W941-M945 HydrophobicContact CZ2-SD 4.11Å; W941-M945 HydrophobicContact CZ3-CG 4.13Å; W941-M945 WeakPolarHBondContact O-CB 3.26Å; W941-M945 VanDerWaalsContact O-CG 3.28Å; W941-M945 WeakPolarHBondContact O-CG 3.26Å; W941-M945 PolarHBondContact O-N 2.9Å; W941-I964 HydrophobicContact CH2-CG2 4.11Å; W941-I964 HydrophobicContact CZ3-CG2 4.06Å; W941-A968 HydrophobicContact CH2-CB 4.14Å; W941-A968 HydrophobicContact CZ3-CB 3.77Å
942	F	88.3	Confident	82.9	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-61.6	-39.1	174.8	-85.8	-62.5	0	0	0	111.6	F889 I925 F929 V938 S939 M945 F946 I964 I965 A968	F889-F942 HydrophobicContact CE2-CZ 4.09Å; F889-F942 HydrophobicContact CZ-CE1 4.36Å; F889-F942 AromaticContact CZ-CZ 3.77Å; F889-F942 HydrophobicContact CZ-CZ 3.77Å; I925-F942 HydrophobicContact CG2-CD1 4.34Å; I925-F942 HydrophobicContact CG2-CD2 4.35Å; I925-F942 HydrophobicContact CG2-CE1 4.44Å; I925-F942 HydrophobicContact CG2-CE2 4.48Å; I925-F942 HydrophobicContact CG2-CG 4.3Å; F929-F942 AromaticContact CD2-CD2 3.6Å; F929-F942 HydrophobicContact CD2-CD2 3.6Å; F929-F942 AromaticContact CD2-CE2 3.72Å; F929-F942 HydrophobicContact CD2-CE2 3.72Å; F929-F942 AromaticContact CE2-CD2 3.71Å; F929-F942 HydrophobicContact CE2-CD2 3.71Å; F929-F942 AromaticContact CE2-CE2 3.3Å; F929-F942 HydrophobicContact CE2-CE2 3.3Å; F929-F942 HydrophobicContact CE2-CZ 4.13Å; F929-F942 HydrophobicContact CZ-CE2 4.02Å; V938-F942 HydrophobicContact CG1-CD2 3.72Å; V938-F942 HydrophobicContact CG1-CE2 3.64Å; V938-F942 VanDerWaalsContact O-CD2 3.25Å; V938-F942 WeakPolarHBondContact O-CD2 3.34Å; V938-F942 PolarHBondContact O-N 3.39Å; S939-F942 PolarHBondContact O-N 3.45Å; F942-M945 PolarHBondContact O-N 2.93Å; F942-F946 HydrophobicContact CB-CD2 4.06Å; F942-F946 HydrophobicContact CB-CE2 4.1Å; F942-F946 HydrophobicContact CD1-CD2 4.16Å; F942-F946 AromaticContact CD1-CE2 3.48Å; F942-F946 HydrophobicContact CD1-CE2 3.48Å; F942-F946 VanDerWaalsContact CD1-CE2 3.48Å; F942-F946 AromaticContact CD1-CZ 3.92Å; F942-F946 HydrophobicContact CD1-CZ 3.92Å; F942-F946 HydrophobicContact CE1-CE2 4.25Å; F942-F946 HydrophobicContact CE1-CZ 4.34Å; F942-F946 HydrophobicContact CG-CE2 4.11Å; F942-F946 WeakPolarHBondContact O-CB 3.47Å; F942-F946 WeakPolarHBondContact O-CD2 3.37Å; F942-F946 WeakPolarHBondContact O-CG 3.41Å; F942-F946 PolarHBondContact O-N 2.9Å; F942-I964 HydrophobicContact CD1-CG2 4.09Å; F942-I964 HydrophobicContact CE1-CG2 4.01Å; F942-I965 HydrophobicContact CE1-CD1 4.35Å; F942-A968 HydrophobicContact CE1-CB 4.01Å; F942-A968 HydrophobicContact CE2-CB 4.44Å; F942-A968 HydrophobicContact CZ-CB 3.58Å
943	N	90.2	Very high	83.8	Confident	73 Å²	73	47.9 Å²	47.9	39%	0.39	24%	0.235	S	C	.	.	H	α-helix	trans	-62.7	-49.8	176.3	-164.8	56.7	0	0	0	111.1	T926 S939 E940 W941 M945 F946 E947	T926-N943 HydrophobicContact CG2-CB 3.68Å; S939-N943 WeakPolarHBondContact O-CB 3.41Å; S939-N943 PolarHBondContact O-N 2.75Å; E940-N943 PolarHBondContact O-N 2.8Å; W941-N943 VanDerWaalsContact C-N 3.3Å; W941-N943 PolarHBondContact O-N 3.13Å; N943-M945 VanDerWaalsContact C-N 3.35Å; N943-M945 PolarHBondContact O-N 2.57Å; N943-F946 PolarHBondContact O-N 3.41Å; N943-E947 WeakPolarHBondContact O-CB 3.47Å; N943-E947 WeakPolarHBondContact O-CG 3.29Å; N943-E947 PolarHBondContact O-N 3.02Å
944	Y	89.9	Confident	84.9	Confident	111 Å²	111	42.5 Å²	42.5	44%	0.435	22%	0.218	S	C	.	.	H	α-helix	trans	-56.1	-47.7	175.7	173.4	-112.3	0	0	0	111.9	E869 E940 W941 I948	E869-Y944 HydrophobicContact CG-CE1 3.82Å; E869-Y944 PolarHBondContact OE1-OH 3.24Å; E940-Y944 WeakPolarHBondContact O-CB 3.42Å; E940-Y944 PolarHBondContact O-N 2.88Å; W941-Y944 PolarHBondContact O-N 2.86Å; Y944-I948 HydrophobicContact CD1-CD1 4.38Å; Y944-I948 HydrophobicContact CD2-CD1 4.29Å; Y944-I948 HydrophobicContact CE1-CD1 4.04Å; Y944-I948 HydrophobicContact CE2-CD1 3.91Å; Y944-I948 WeakPolarHBondContact O-CD1 3.25Å; Y944-I948 WeakPolarHBondContact O-CG1 3.2Å; Y944-I948 PolarHBondContact O-N 3.09Å
945	M	89.4	Confident	85.8	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-66.3	-38.5	177.7	-66.1	-63.3	-74.4	0	0	112.5	L866 E869 L870 W941 F942 N943 Y949 I964	L866-M945 HydrophobicContact CD2-CE 3.53Å; L866-M945 HydrophobicContact CD2-SD 4.12Å; E869-M945 HydrophobicContact CB-CE 3.94Å; E869-M945 HydrophobicContact CB-SD 3.57Å; E869-M945 VanDerWaalsContact CB-SD 3.57Å; E869-M945 HydrophobicContact CG-SD 4.13Å; L870-M945 HydrophobicContact CD2-CE 4.08Å; L870-M945 HydrophobicContact CG-CE 3.93Å; W941-M945 HydrophobicContact CD2-CG 3.94Å; W941-M945 HydrophobicContact CE3-CG 4.17Å; W941-M945 HydrophobicContact CH2-CE 4.37Å; W941-M945 HydrophobicContact CH2-CG 3.88Å; W941-M945 HydrophobicContact CZ2-CE 4.06Å; W941-M945 HydrophobicContact CZ2-CG 3.61Å; W941-M945 HydrophobicContact CZ2-SD 4.11Å; W941-M945 HydrophobicContact CZ3-CG 4.13Å; W941-M945 WeakPolarHBondContact O-CB 3.26Å; W941-M945 VanDerWaalsContact O-CG 3.28Å; W941-M945 WeakPolarHBondContact O-CG 3.26Å; W941-M945 PolarHBondContact O-N 2.9Å; F942-M945 PolarHBondContact O-N 2.93Å; N943-M945 VanDerWaalsContact C-N 3.35Å; N943-M945 PolarHBondContact O-N 2.57Å; M945-Y949 WeakPolarHBondContact O-CB 3.32Å; M945-Y949 PolarHBondContact O-N 3.49Å; M945-I964 HydrophobicContact CB-CD1 4.46Å; M945-I964 HydrophobicContact CB-CG2 4.33Å; M945-I964 HydrophobicContact CE-CG1 4.07Å
946	F	93.5	Very high	86.4	Confident	1 Å²	1	44.4 Å²	44.4	0%	0.004	22%	0.224	C	C	.	.	H	α-helix	trans	-81.1	-24.1	-177.4	-71.2	-44.6	0	0	0	114.3	P922 I925 F942 N943 Y949 K950 F961 I964 I965	P922-F946 HydrophobicContact CB-CB 4.14Å; P922-F946 HydrophobicContact CB-CD1 3.71Å; P922-F946 HydrophobicContact CB-CD2 3.98Å; P922-F946 HydrophobicContact CB-CE1 4.03Å; P922-F946 HydrophobicContact CB-CE2 4.27Å; P922-F946 HydrophobicContact CB-CG 3.7Å; P922-F946 HydrophobicContact CB-CZ 4.3Å; P922-F946 HydrophobicContact CG-CD1 4.18Å; P922-F946 HydrophobicContact CG-CE1 4.22Å; I925-F946 HydrophobicContact CB-CE2 4.2Å; I925-F946 HydrophobicContact CG2-CE2 4.02Å; F942-F946 HydrophobicContact CB-CD2 4.06Å; F942-F946 HydrophobicContact CB-CE2 4.1Å; F942-F946 HydrophobicContact CD1-CD2 4.16Å; F942-F946 AromaticContact CD1-CE2 3.48Å; F942-F946 HydrophobicContact CD1-CE2 3.48Å; F942-F946 VanDerWaalsContact CD1-CE2 3.48Å; F942-F946 AromaticContact CD1-CZ 3.92Å; F942-F946 HydrophobicContact CD1-CZ 3.92Å; F942-F946 HydrophobicContact CE1-CE2 4.25Å; F942-F946 HydrophobicContact CE1-CZ 4.34Å; F942-F946 HydrophobicContact CG-CE2 4.11Å; F942-F946 WeakPolarHBondContact O-CB 3.47Å; F942-F946 WeakPolarHBondContact O-CD2 3.37Å; F942-F946 WeakPolarHBondContact O-CG 3.41Å; F942-F946 PolarHBondContact O-N 2.9Å; N943-F946 PolarHBondContact O-N 3.41Å; F946-Y949 HydrophobicContact CD1-CD1 4.31Å; F946-Y949 HydrophobicContact CD1-CG 4.1Å; F946-Y949 WeakPolarHBondContact O-CB 3.4Å; F946-Y949 PolarHBondContact O-N 3.45Å; F946-K950 WeakPolarHBondContact O-CG 3.47Å; F946-K950 PolarHBondContact O-N 2.6Å; F946-K950 VanDerWaalsContact O-N 3.15Å; F946-F961 AromaticContact CE1-CD2 3.92Å; F946-F961 HydrophobicContact CE1-CD2 3.92Å; F946-F961 HydrophobicContact CE1-CE2 4.1Å; F946-F961 HydrophobicContact CZ-CD2 4.28Å; F946-F961 HydrophobicContact CZ-CE2 4.02Å; F946-I964 HydrophobicContact CD1-CD1 4.14Å; F946-I964 HydrophobicContact CE1-CB 4.42Å; F946-I964 HydrophobicContact CE1-CD1 4.04Å; F946-I964 HydrophobicContact CE1-CG2 3.89Å; F946-I964 HydrophobicContact CZ-CG2 4.01Å; F946-I965 HydrophobicContact CZ-CD1 4.09Å
947	E	92.5	Very high	87.3	Confident	94 Å²	94	43.3 Å²	43.3	44%	0.439	21%	0.211	S	C	.	.	H	α-helix	trans	-64.6	-45.4	167.3	-72.2	-58.3	111.5	0	0	110.4	N943 Y949 K950	N943-E947 WeakPolarHBondContact O-CB 3.47Å; N943-E947 WeakPolarHBondContact O-CG 3.29Å; N943-E947 PolarHBondContact O-N 3.02Å; E947-Y949 VanDerWaalsContact C-N 3.26Å; E947-Y949 PolarHBondContact O-N 2.97Å; E947-K950 PolarHBondContact O-N 2.94Å; E947-K950 WeakPolarHBondContact OE1-CE 3.29Å; E947-K950 IonicContact OE1-NZ 3.56Å; E947-K950 PolarHBondContact OE1-NZ 3.23Å
948	I	90.9	Very high	88	Confident	24 Å²	24	37.5 Å²	37.5	12%	0.123	18%	0.184	C	C	.	.	H	α-helix	trans	-66.4	-30.6	175	-52.1	158.1	0	0	0	111.4	A862 T865 L866 Y944	A862-I948 HydrophobicContact CB-CG2 3.93Å; A862-I948 WeakPolarHBondContact CB-O 3.45Å; T865-I948 HydrophobicContact CG2-CD1 3.82Å; T865-I948 HydrophobicContact CG2-CG2 4.47Å; L866-I948 HydrophobicContact CD1-CG2 4.17Å; L866-I948 HydrophobicContact CD2-CB 4.22Å; L866-I948 HydrophobicContact CD2-CG2 4.35Å; L866-I948 HydrophobicContact CG-CB 4.12Å; L866-I948 HydrophobicContact CG-CG2 3.72Å; Y944-I948 HydrophobicContact CD1-CD1 4.38Å; Y944-I948 HydrophobicContact CD2-CD1 4.29Å; Y944-I948 HydrophobicContact CE1-CD1 4.04Å; Y944-I948 HydrophobicContact CE2-CD1 3.91Å; Y944-I948 WeakPolarHBondContact O-CD1 3.25Å; Y944-I948 WeakPolarHBondContact O-CG1 3.2Å; Y944-I948 PolarHBondContact O-N 3.09Å
949	Y	91.3	Very high	88.4	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-66.4	-32.1	176.3	173	-89	0	0	0	113.7	D919 P922 M945 F946 E947 D951 L952 K957 F961 I964	D919-Y949 VanDerWaalsContact OD1-CE1 3.28Å; D919-Y949 WeakPolarHBondContact OD1-CE1 3.42Å; P922-Y949 HydrophobicContact CG-CD1 4.08Å; P922-Y949 HydrophobicContact CG-CE1 3.58Å; M945-Y949 WeakPolarHBondContact O-CB 3.32Å; M945-Y949 PolarHBondContact O-N 3.49Å; F946-Y949 HydrophobicContact CD1-CD1 4.31Å; F946-Y949 HydrophobicContact CD1-CG 4.1Å; F946-Y949 WeakPolarHBondContact O-CB 3.4Å; F946-Y949 PolarHBondContact O-N 3.45Å; E947-Y949 VanDerWaalsContact C-N 3.26Å; E947-Y949 PolarHBondContact O-N 2.97Å; Y949-D951 PolarHBondContact O-N 2.92Å; Y949-L952 HydrophobicContact CD2-CD1 3.61Å; Y949-L952 HydrophobicContact CE2-CD1 4.14Å; Y949-L952 HydrophobicContact CG-CD1 4.22Å; Y949-L952 WeakPolarHBondContact O-CB 3.23Å; Y949-L952 VanDerWaalsContact O-CG 3.29Å; Y949-L952 WeakPolarHBondContact O-CG 3.48Å; Y949-L952 PolarHBondContact O-N 3.05Å; Y949-K957 HydrophobicContact CE1-CD 4.17Å; Y949-K957 HydrophobicContact CE1-CG 4.24Å; Y949-K957 HydrophobicContact CE2-CB 4.28Å; Y949-K957 HydrophobicContact CE2-CG 4.4Å; Y949-K957 VanDerWaalsContact CE2-O 3.28Å; Y949-K957 WeakPolarHBondContact CE2-O 3.38Å; Y949-K957 WeakPolarHBondContact OH-CB 3.5Å; Y949-K957 PolarHBondContact OH-O 3.43Å; Y949-K957 VanDerWaalsContact OH-O 3.11Å; Y949-F961 HydrophobicContact CE2-CB 3.79Å; Y949-F961 HydrophobicContact CE2-CD2 4.47Å; Y949-I964 HydrophobicContact CD2-CD1 3.95Å
950	K	91.8	Very high	88.7	Confident	59 Å²	59	37.4 Å²	37.4	26%	0.257	18%	0.183	S	C	.	.	H	α-helix	trans	-61.6	-33.1	-178.4	-76.1	163.6	-174.5	177.9	0	112.1	D919 D923 F946 E947 L952	D919-K950 HydrophobicContact CB-CG 4.31Å; D923-K950 VanDerWaalsContact OD1-CE 3.28Å; D923-K950 WeakPolarHBondContact OD1-CE 3.28Å; D923-K950 IonicContact OD1-NZ 3.44Å; D923-K950 PolarHBondContact OD1-NZ 3.17Å; F946-K950 WeakPolarHBondContact O-CG 3.47Å; F946-K950 PolarHBondContact O-N 2.6Å; F946-K950 VanDerWaalsContact O-N 3.15Å; E947-K950 PolarHBondContact O-N 2.94Å; E947-K950 WeakPolarHBondContact OE1-CE 3.29Å; E947-K950 IonicContact OE1-NZ 3.56Å; E947-K950 PolarHBondContact OE1-NZ 3.23Å; K950-L952 PolarHBondContact O-N 3.16Å
951	D	88.9	Confident	89	Confident	87 Å²	87	30.8 Å²	30.8	47%	0.465	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-1.6	174.3	-65.2	-21.9	0	0	0	114.1	N859 A862 Y949	N859-D951 VanDerWaalsContact CG-O 3.26Å; N859-D951 PolarHBondContact ND2-O 3.02Å; A862-D951 HydrophobicContact CB-CB 3.73Å; Y949-D951 PolarHBondContact O-N 2.92Å
952	L	86.4	Confident	89.1	Confident	6 Å²	6	28.5 Å²	28.5	3%	0.031	14%	0.143	C	C	.	.	S	Bend	trans	-76.4	143.9	176	-65.2	179.8	0	0	0	112.2	A862 M863 L866 Y949 K950 K957 Y960	A862-L952 HydrophobicContact CB-CD2 4.17Å; M863-L952 HydrophobicContact CB-CD2 4.44Å; M863-L952 HydrophobicContact CE-CD2 3.99Å; M863-L952 HydrophobicContact CG-CD2 3.42Å; M863-L952 VanDerWaalsContact CG-CD2 3.42Å; L866-L952 HydrophobicContact CD1-CD1 3.75Å; L866-L952 HydrophobicContact CD1-CD2 4.05Å; L866-L952 HydrophobicContact CD1-CG 4.04Å; Y949-L952 HydrophobicContact CD2-CD1 3.61Å; Y949-L952 HydrophobicContact CE2-CD1 4.14Å; Y949-L952 HydrophobicContact CG-CD1 4.22Å; Y949-L952 WeakPolarHBondContact O-CB 3.23Å; Y949-L952 VanDerWaalsContact O-CG 3.29Å; Y949-L952 WeakPolarHBondContact O-CG 3.48Å; Y949-L952 PolarHBondContact O-N 3.05Å; K950-L952 PolarHBondContact O-N 3.16Å; L952-K957 HydrophobicContact CB-CG 4.14Å; L952-K957 WeakPolarHBondContact O-CE 3.32Å; L952-Y960 VanDerWaalsContact CD1-CB 3.42Å; L952-Y960 HydrophobicContact CD1-CD1 4.28Å; L952-Y960 HydrophobicContact CD1-CD2 3.91Å; L952-Y960 HydrophobicContact CD1-CG 3.62Å
953	P	84	Confident	89	Confident	12 Å²	12	29.2 Å²	29.2	8%	0.078	15%	0.149	C	C	.	.			trans	-68.7	145.5	172	34.6	-37.6	0	0	0	110.2	M855 M863 F955 A956 K957	M855-P953 HydrophobicContact CE-CB 3.78Å; M855-P953 HydrophobicContact CE-CG 3.57Å; M863-P953 HydrophobicContact CE-CG 3.66Å; P953-F955 VanDerWaalsContact C-N 3.33Å; P953-F955 HydrophobicContact CB-CD1 3.96Å; P953-F955 HydrophobicContact CB-CE1 3.45Å; P953-F955 VanDerWaalsContact CB-CE1 3.45Å; P953-F955 HydrophobicContact CB-CZ 4.01Å; P953-F955 HydrophobicContact CG-CD1 4.17Å; P953-F955 HydrophobicContact CG-CE1 3.44Å; P953-F955 VanDerWaalsContact CG-CE1 3.44Å; P953-F955 HydrophobicContact CG-CE2 4.2Å; P953-F955 HydrophobicContact CG-CZ 3.41Å; P953-F955 VanDerWaalsContact CG-CZ 3.41Å; P953-F955 PolarHBondContact O-N 3.47Å; P953-F955 VanDerWaalsContact O-N 3.13Å; P953-A956 HydrophobicContact CG-CB 3.95Å; P953-A956 PolarHBondContact O-N 2.68Å; P953-K957 PolarHBondContact O-N 3.37Å
954	A	86.4	Confident	88.9	Confident	47 Å²	47	25.7 Å²	25.7	39%	0.388	13%	0.13	S	C	.	.	G	3₁₀ helix	trans	-47.2	-48.6	-173	0	0	0	0	0	114	R916 A956 K957 P958	R916-A954 HydrophobicContact CB-CB 4.16Å; R916-A954 HydrophobicContact CG-CB 4.48Å; R916-A954 WeakPolarHBondContact CG-O 3.31Å; A954-A956 PolarHBondContact O-N 2.89Å; A954-A956 VanDerWaalsContact O-N 3.08Å; A954-K957 WeakPolarHBondContact O-CB 3.32Å; A954-K957 PolarHBondContact O-N 3.04Å; A954-P958 WeakPolarHBondContact O-CD 3.25Å
955	F	83.1	Confident	88.7	Confident	50 Å²	50	20.4 Å²	20.4	22%	0.219	11%	0.11	C	C	.	.	G	3₁₀ helix	trans	-59.7	-24.3	-178.6	70.4	-95.7	0	0	0	114.4	V614 M855 P953	V614-F955 HydrophobicContact CG1-CD2 3.77Å; V614-F955 HydrophobicContact CG1-CE2 4.28Å; V614-F955 HydrophobicContact CG1-CG 4.24Å; M855-F955 HydrophobicContact CE-CZ 4.5Å; M855-F955 HydrophobicContact SD-CZ 4.31Å; P953-F955 VanDerWaalsContact C-N 3.33Å; P953-F955 HydrophobicContact CB-CD1 3.96Å; P953-F955 HydrophobicContact CB-CE1 3.45Å; P953-F955 VanDerWaalsContact CB-CE1 3.45Å; P953-F955 HydrophobicContact CB-CZ 4.01Å; P953-F955 HydrophobicContact CG-CD1 4.17Å; P953-F955 HydrophobicContact CG-CE1 3.44Å; P953-F955 VanDerWaalsContact CG-CE1 3.44Å; P953-F955 HydrophobicContact CG-CE2 4.2Å; P953-F955 HydrophobicContact CG-CZ 3.41Å; P953-F955 VanDerWaalsContact CG-CZ 3.41Å; P953-F955 PolarHBondContact O-N 3.47Å; P953-F955 VanDerWaalsContact O-N 3.13Å
956	A	84.8	Confident	88.3	Confident	2 Å²	2	21.6 Å²	21.6	2%	0.017	12%	0.116	C	C	.	.	G	3₁₀ helix	trans	-93.4	-14.5	179.8	0	0	0	0	0	113.1	M863 P953 A954 C959 Y960	M863-A956 HydrophobicContact CE-CB 3.35Å; P953-A956 HydrophobicContact CG-CB 3.95Å; P953-A956 PolarHBondContact O-N 2.68Å; A954-A956 PolarHBondContact O-N 2.89Å; A954-A956 VanDerWaalsContact O-N 3.08Å; A956-C959 PolarHBondContact O-N 3.21Å; A956-C959 PolarHBondContact O-SG 3.47Å; A956-Y960 HydrophobicContact CB-CD2 4.16Å; A956-Y960 HydrophobicContact CB-CE2 4.41Å; A956-Y960 PolarHBondContact O-N 2.82Å; A956-Y960 VanDerWaalsContact O-N 3.17Å
957	K	91.2	Very high	87.6	Confident	20 Å²	20	22.5 Å²	22.5	9%	0.087	13%	0.125	C	C	.	.	H	α-helix	trans	-54.7	-43	179.5	-75.4	-168	176.2	-169.7	0	112.7	L915 D919 Y949 L952 P953 A954 C959 F961	L915-K957 VanDerWaalsContact O-CB 3.28Å; L915-K957 WeakPolarHBondContact O-CB 3.44Å; L915-K957 WeakPolarHBondContact O-CD 3.29Å; D919-K957 WeakPolarHBondContact OD1-CD 3.41Å; D919-K957 WeakPolarHBondContact OD1-CE 3.49Å; D919-K957 IonicContact OD1-NZ 3Å; D919-K957 PolarHBondContact OD1-NZ 2.92Å; D919-K957 IonicContact OD2-NZ 3.08Å; D919-K957 PolarHBondContact OD2-NZ 2.87Å; Y949-K957 HydrophobicContact CE1-CD 4.17Å; Y949-K957 HydrophobicContact CE1-CG 4.24Å; Y949-K957 HydrophobicContact CE2-CB 4.28Å; Y949-K957 HydrophobicContact CE2-CG 4.4Å; Y949-K957 VanDerWaalsContact CE2-O 3.28Å; Y949-K957 WeakPolarHBondContact CE2-O 3.38Å; Y949-K957 WeakPolarHBondContact OH-CB 3.5Å; Y949-K957 PolarHBondContact OH-O 3.43Å; Y949-K957 VanDerWaalsContact OH-O 3.11Å; L952-K957 HydrophobicContact CB-CG 4.14Å; L952-K957 WeakPolarHBondContact O-CE 3.32Å; P953-K957 PolarHBondContact O-N 3.37Å; A954-K957 WeakPolarHBondContact O-CB 3.32Å; A954-K957 PolarHBondContact O-N 3.04Å; K957-C959 PolarHBondContact O-N 3.49Å; K957-F961 WeakPolarHBondContact O-CB 3.18Å; K957-F961 PolarHBondContact O-N 2.87Å
958	P	90.7	Very high	87	Confident	4 Å²	4	18 Å²	18	3%	0.026	10%	0.104	C	C	.	.	H	α-helix	trans	-61.4	-43.7	176.6	-26.3	36.2	0	0	0	114.8	C912 L915 R916 A954 D962	C912-P958 HydrophobicContact CB-CB 4.02Å; C912-P958 HydrophobicContact CB-CG 3.9Å; C912-P958 WeakPolarHBondContact O-CG 3.01Å; L915-P958 HydrophobicContact CB-CG 4.25Å; R916-P958 HydrophobicContact CG-CG 4.3Å; A954-P958 WeakPolarHBondContact O-CD 3.25Å; P958-D962 PolarHBondContact O-N 3.23Å
959	C	89.2	Confident	86.4	Confident	5 Å²	5	18.5 Å²	18.5	3%	0.034	11%	0.105	C	C	.	.	H	α-helix	trans	-78.2	-30.4	-173.4	69.7	0	0	0	0	113.5	S616 A956 K957 A963	S616-C959 VanDerWaalsContact O-CB 3.29Å; S616-C959 WeakPolarHBondContact O-CB 3.43Å; A956-C959 PolarHBondContact O-N 3.21Å; A956-C959 PolarHBondContact O-SG 3.47Å; K957-C959 PolarHBondContact O-N 3.49Å; C959-A963 PolarHBondContact O-N 3.15Å
960	Y	89.5	Confident	85.8	Confident	4 Å²	4	21.9 Å²	21.9	2%	0.016	13%	0.126	C	C	.	.	H	α-helix	trans	-79.3	-33.7	171.4	-81.3	-90.3	0	0	0	112.5	L618 M863 L866 R867 L870 L952 A956 A963 I964	L618-Y960 HydrophobicContact CD1-CD1 4.35Å; L618-Y960 HydrophobicContact CD1-CE1 4.28Å; M863-Y960 WeakPolarHBondContact CB-OH 3.17Å; M863-Y960 HydrophobicContact CE-CE2 4.07Å; M863-Y960 HydrophobicContact CG-CE2 3.97Å; M863-Y960 WeakPolarHBondContact CG-OH 3.4Å; M863-Y960 HydrophobicContact SD-CE2 4.12Å; L866-Y960 HydrophobicContact CB-CD1 4.06Å; L866-Y960 HydrophobicContact CB-CE1 4.01Å; L866-Y960 HydrophobicContact CD1-CD1 3.97Å; L866-Y960 HydrophobicContact CD1-CE1 4.45Å; R867-Y960 HydrophobicContact CG-CE1 4.21Å; R867-Y960 PolarHBondContact NE-OH 3.49Å; R867-Y960 PolarHBondContact NH2-OH 2.96Å; L870-Y960 HydrophobicContact CD1-CD1 4.34Å; L952-Y960 VanDerWaalsContact CD1-CB 3.42Å; L952-Y960 HydrophobicContact CD1-CD1 4.28Å; L952-Y960 HydrophobicContact CD1-CD2 3.91Å; L952-Y960 HydrophobicContact CD1-CG 3.62Å; A956-Y960 HydrophobicContact CB-CD2 4.16Å; A956-Y960 HydrophobicContact CB-CE2 4.41Å; A956-Y960 PolarHBondContact O-N 2.82Å; A956-Y960 VanDerWaalsContact O-N 3.17Å; Y960-A963 PolarHBondContact O-N 2.98Å; Y960-I964 VanDerWaalsContact O-CG1 3.28Å; Y960-I964 WeakPolarHBondContact O-CG1 3.49Å; Y960-I964 PolarHBondContact O-N 2.9Å
961	F	91.8	Very high	85.1	Confident	0 Å²	0	20.6 Å²	20.6	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-60	-50.1	172	-175	-100.6	0	0	0	110.2	I894 L898 L915 L921 P922 I925 F946 Y949 K957 A963 I964 I965	I894-F961 HydrophobicContact CG2-CE1 4.01Å; I894-F961 HydrophobicContact CG2-CZ 4.44Å; L898-F961 HydrophobicContact CD1-CD1 4.2Å; L898-F961 HydrophobicContact CD1-CE1 4.07Å; L898-F961 HydrophobicContact CD2-CD1 4.03Å; L898-F961 HydrophobicContact CD2-CE1 4.42Å; L915-F961 HydrophobicContact CD1-CB 4.1Å; L915-F961 HydrophobicContact CD1-CD1 3.53Å; L915-F961 HydrophobicContact CD1-CE1 4.13Å; L915-F961 HydrophobicContact CD1-CG 3.91Å; L915-F961 HydrophobicContact CD2-CB 4.35Å; L915-F961 HydrophobicContact CD2-CD1 3.93Å; L915-F961 HydrophobicContact CD2-CD2 3.87Å; L915-F961 HydrophobicContact CD2-CE1 4.15Å; L915-F961 HydrophobicContact CD2-CE2 4.11Å; L915-F961 HydrophobicContact CD2-CG 3.79Å; L915-F961 HydrophobicContact CD2-CZ 4.25Å; L915-F961 HydrophobicContact CG-CD1 4.41Å; L921-F961 HydrophobicContact CD2-CE1 3.94Å; L921-F961 HydrophobicContact CD2-CE2 4.38Å; L921-F961 HydrophobicContact CD2-CZ 3.54Å; L921-F961 HydrophobicContact CG-CE2 4.27Å; L921-F961 HydrophobicContact CG-CZ 3.76Å; P922-F961 HydrophobicContact CG-CD2 4.05Å; P922-F961 HydrophobicContact CG-CE2 3.97Å; I925-F961 HydrophobicContact CD1-CE2 4.06Å; I925-F961 HydrophobicContact CD1-CZ 3.83Å; F946-F961 AromaticContact CE1-CD2 3.92Å; F946-F961 HydrophobicContact CE1-CD2 3.92Å; F946-F961 HydrophobicContact CE1-CE2 4.1Å; F946-F961 HydrophobicContact CZ-CD2 4.28Å; F946-F961 HydrophobicContact CZ-CE2 4.02Å; Y949-F961 HydrophobicContact CE2-CB 3.79Å; Y949-F961 HydrophobicContact CE2-CD2 4.47Å; K957-F961 WeakPolarHBondContact O-CB 3.18Å; K957-F961 PolarHBondContact O-N 2.87Å; F961-A963 VanDerWaalsContact C-N 3.31Å; F961-A963 PolarHBondContact O-N 3.43Å; F961-I964 PolarHBondContact O-N 2.8Å; F961-I965 HydrophobicContact CD1-CG1 3.97Å; F961-I965 HydrophobicContact CD2-CG1 4.26Å; F961-I965 HydrophobicContact CE1-CD1 4.28Å; F961-I965 HydrophobicContact CE1-CG1 3.73Å; F961-I965 HydrophobicContact CE2-CD1 3.99Å; F961-I965 HydrophobicContact CE2-CG1 4.01Å; F961-I965 HydrophobicContact CG-CG1 4.23Å; F961-I965 HydrophobicContact CZ-CD1 3.79Å; F961-I965 HydrophobicContact CZ-CG1 3.74Å; F961-I965 WeakPolarHBondContact O-CB 3.5Å; F961-I965 WeakPolarHBondContact O-CG1 3.32Å; F961-I965 PolarHBondContact O-N 2.9Å
962	D	87.9	Confident	84.5	Confident	0 Å²	0	16.5 Å²	16.5	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-50.4	-48.7	171.5	169.4	68.4	0	0	0	112.7	F617 L898 K902 P958 I965 N966	F617-D962 HydrophobicContact CD1-CB 3.66Å; F617-D962 HydrophobicContact CE1-CB 3.79Å; L898-D962 HydrophobicContact CD2-CB 4.03Å; K902-D962 WeakPolarHBondContact CD-OD2 3.43Å; K902-D962 VanDerWaalsContact CE-OD2 3.31Å; K902-D962 WeakPolarHBondContact CE-OD2 3.31Å; K902-D962 IonicContact NZ-OD1 3.45Å; K902-D962 IonicContact NZ-OD2 2.73Å; K902-D962 PolarHBondContact NZ-OD2 2.95Å; P958-D962 PolarHBondContact O-N 3.23Å; D962-I965 PolarHBondContact O-N 3.36Å; D962-N966 VanDerWaalsContact O-CB 3.3Å; D962-N966 WeakPolarHBondContact O-CB 3.36Å; D962-N966 PolarHBondContact O-N 3.32Å; D962-N966 PolarHBondContact OD1-ND2 2.57Å
963	A	85.3	Confident	84.2	Confident	14 Å²	14	17 Å²	17	12%	0.116	10%	0.103	C	C	.	.	H	α-helix	trans	-66.4	-39	-177.1	0	0	0	0	0	113.4	L618 L870 C959 Y960 F961 G967	L618-A963 HydrophobicContact CD1-CB 3.87Å; L870-A963 HydrophobicContact CD1-CB 3.91Å; L870-A963 HydrophobicContact CD2-CB 4.22Å; L870-A963 WeakPolarHBondContact CD2-O 3.46Å; C959-A963 PolarHBondContact O-N 3.15Å; Y960-A963 PolarHBondContact O-N 2.98Å; F961-A963 VanDerWaalsContact C-N 3.31Å; F961-A963 PolarHBondContact O-N 3.43Å; A963-G967 WeakPolarHBondContact O-CA 3.48Å; A963-G967 PolarHBondContact O-N 2.83Å
964	I	87.8	Confident	84	Confident	0 Å²	0	20.9 Å²	20.9	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-64.8	-50.7	174.9	-66.1	164.3	0	0	0	109.9	L866 L870 W941 F942 M945 F946 Y949 Y960 F961 A968	L866-I964 HydrophobicContact CD2-CD1 4.02Å; L866-I964 HydrophobicContact CD2-CG1 4.48Å; L870-I964 HydrophobicContact CD2-CG1 4.23Å; W941-I964 HydrophobicContact CH2-CG2 4.11Å; W941-I964 HydrophobicContact CZ3-CG2 4.06Å; F942-I964 HydrophobicContact CD1-CG2 4.09Å; F942-I964 HydrophobicContact CE1-CG2 4.01Å; M945-I964 HydrophobicContact CB-CD1 4.46Å; M945-I964 HydrophobicContact CB-CG2 4.33Å; M945-I964 HydrophobicContact CE-CG1 4.07Å; F946-I964 HydrophobicContact CD1-CD1 4.14Å; F946-I964 HydrophobicContact CE1-CB 4.42Å; F946-I964 HydrophobicContact CE1-CD1 4.04Å; F946-I964 HydrophobicContact CE1-CG2 3.89Å; F946-I964 HydrophobicContact CZ-CG2 4.01Å; Y949-I964 HydrophobicContact CD2-CD1 3.95Å; Y960-I964 VanDerWaalsContact O-CG1 3.28Å; Y960-I964 WeakPolarHBondContact O-CG1 3.49Å; Y960-I964 PolarHBondContact O-N 2.9Å; F961-I964 PolarHBondContact O-N 2.8Å; I964-A968 WeakPolarHBondContact O-CB 3.49Å; I964-A968 PolarHBondContact O-N 2.91Å
965	I	86.5	Confident	83.6	Confident	0 Å²	0	18.9 Å²	18.9	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-64.9	-50.8	-176.7	-62.6	-67.7	0	0	0	111.6	F889 I894 V895 L898 I925 F942 F946 F961 D962 Y969	F889-I965 HydrophobicContact CE1-CG2 3.93Å; F889-I965 HydrophobicContact CE2-CD1 4.05Å; F889-I965 HydrophobicContact CZ-CB 4.47Å; F889-I965 HydrophobicContact CZ-CD1 3.58Å; F889-I965 HydrophobicContact CZ-CG2 3.8Å; I894-I965 HydrophobicContact CG2-CG2 4.41Å; V895-I965 HydrophobicContact CG2-CG2 4.17Å; L898-I965 HydrophobicContact CD1-CB 3.79Å; L898-I965 HydrophobicContact CD1-CG1 4.14Å; L898-I965 HydrophobicContact CD1-CG2 3.51Å; I925-I965 HydrophobicContact CD1-CD1 3.62Å; F942-I965 HydrophobicContact CE1-CD1 4.35Å; F946-I965 HydrophobicContact CZ-CD1 4.09Å; F961-I965 HydrophobicContact CD1-CG1 3.97Å; F961-I965 HydrophobicContact CD2-CG1 4.26Å; F961-I965 HydrophobicContact CE1-CD1 4.28Å; F961-I965 HydrophobicContact CE1-CG1 3.73Å; F961-I965 HydrophobicContact CE2-CD1 3.99Å; F961-I965 HydrophobicContact CE2-CG1 4.01Å; F961-I965 HydrophobicContact CG-CG1 4.23Å; F961-I965 HydrophobicContact CZ-CD1 3.79Å; F961-I965 HydrophobicContact CZ-CG1 3.74Å; F961-I965 WeakPolarHBondContact O-CB 3.5Å; F961-I965 WeakPolarHBondContact O-CG1 3.32Å; F961-I965 PolarHBondContact O-N 2.9Å; D962-I965 PolarHBondContact O-N 3.36Å; I965-Y969 WeakPolarHBondContact O-CB 3.31Å; I965-Y969 PolarHBondContact O-N 2.87Å
966	N	81.4	Confident	83.4	Confident	24 Å²	24	16.7 Å²	16.7	13%	0.128	10%	0.097	C	C	.	.	H	α-helix	trans	-71.9	-30.3	179.7	-88	-51	0	0	0	112.8	D962 T970	D962-N966 VanDerWaalsContact O-CB 3.3Å; D962-N966 WeakPolarHBondContact O-CB 3.36Å; D962-N966 PolarHBondContact O-N 3.32Å; D962-N966 PolarHBondContact OD1-ND2 2.57Å; N966-T970 WeakPolarHBondContact O-CB 3.3Å; N966-T970 PolarHBondContact O-N 3.34Å; N966-T970 PolarHBondContact O-OG1 3.19Å
967	G	77.9	Confident	83.4	Confident	20 Å²	20	17.4 Å²	17.4	21%	0.206	10%	0.101	C	C	.	.	H	α-helix	trans	-63.5	-53.6	173	0	0	0	0	0	111.4	A963 T970 L971	A963-G967 WeakPolarHBondContact O-CA 3.48Å; A963-G967 PolarHBondContact O-N 2.83Å; G967-T970 PolarHBondContact O-N 2.83Å; G967-L971 PolarHBondContact O-N 3Å
968	A	79.8	Confident	83.1	Confident	0 Å²	0	20.1 Å²	20.1	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-57.3	-51.2	173.8	0	0	0	0	0	111.4	W941 F942 I964 T970 L971 M972	W941-A968 HydrophobicContact CH2-CB 4.14Å; W941-A968 HydrophobicContact CZ3-CB 3.77Å; F942-A968 HydrophobicContact CE1-CB 4.01Å; F942-A968 HydrophobicContact CE2-CB 4.44Å; F942-A968 HydrophobicContact CZ-CB 3.58Å; I964-A968 WeakPolarHBondContact O-CB 3.49Å; I964-A968 PolarHBondContact O-N 2.91Å; A968-T970 VanDerWaalsContact C-N 3.28Å; A968-T970 PolarHBondContact O-N 2.95Å; A968-L971 PolarHBondContact O-N 3.41Å; A968-L971 VanDerWaalsContact O-N 3.15Å; A968-M972 HydrophobicContact CB-CE 4.09Å; A968-M972 WeakPolarHBondContact O-CB 3.49Å; A968-M972 WeakPolarHBondContact O-CG 3.36Å; A968-M972 PolarHBondContact O-N 2.77Å
969	Y	79.8	Confident	82.5	Confident	35 Å²	35	24.3 Å²	24.3	14%	0.137	14%	0.14	C	C	.	.	H	α-helix	trans	-55.5	-40.9	-179.3	174	-106.1	0	0	0	113	R890 V895 I965 T973	R890-Y969 HydrophobicContact CB-CE2 3.86Å; R890-Y969 WeakPolarHBondContact CD-OH 3.47Å; R890-Y969 HydrophobicContact CG-CE2 3.7Å; R890-Y969 PolarHBondContact NE-OH 2.93Å; R890-Y969 VanDerWaalsContact NE-OH 3.07Å; V895-Y969 HydrophobicContact CG1-CD1 4.1Å; V895-Y969 HydrophobicContact CG1-CE1 4.21Å; V895-Y969 HydrophobicContact CG1-CG 4.3Å; V895-Y969 HydrophobicContact CG2-CD2 4.43Å; V895-Y969 HydrophobicContact CG2-CG 4.48Å; I965-Y969 WeakPolarHBondContact O-CB 3.31Å; I965-Y969 PolarHBondContact O-N 2.87Å; Y969-T973 WeakPolarHBondContact O-CB 3.35Å; Y969-T973 PolarHBondContact O-N 3.03Å; Y969-T973 PolarHBondContact O-OG1 3.43Å
970	T	77.5	Confident	82.4	Confident	71 Å²	71	24.5 Å²	24.5	44%	0.436	14%	0.14	S	C	.	.	H	α-helix	trans	-65.1	-44.7	178.5	-60.5	0	0	0	0	111.8	N966 G967 A968 T973 N974	N966-T970 WeakPolarHBondContact O-CB 3.3Å; N966-T970 PolarHBondContact O-N 3.34Å; N966-T970 PolarHBondContact O-OG1 3.19Å; G967-T970 PolarHBondContact O-N 2.83Å; A968-T970 VanDerWaalsContact C-N 3.28Å; A968-T970 PolarHBondContact O-N 2.95Å; T970-T973 PolarHBondContact O-N 3Å; T970-N974 VanDerWaalsContact O-CG 3.24Å; T970-N974 PolarHBondContact O-N 3.21Å; T970-N974 PolarHBondContact O-ND2 2.67Å
971	L	76.9	Confident	82.3	Confident	32 Å²	32	25.7 Å²	25.7	17%	0.168	15%	0.149	C	C	.	.	H	α-helix	trans	-69	-44.3	179.7	-69.8	161.3	0	0	0	111.8	I873 G967 A968 T973 N974 A975	I873-L971 HydrophobicContact CB-CD1 3.51Å; I873-L971 HydrophobicContact CD1-CD1 4.04Å; I873-L971 HydrophobicContact CG1-CD1 4.4Å; I873-L971 HydrophobicContact CG2-CD1 3.27Å; G967-L971 PolarHBondContact O-N 3Å; A968-L971 PolarHBondContact O-N 3.41Å; A968-L971 VanDerWaalsContact O-N 3.15Å; L971-T973 VanDerWaalsContact C-N 3.3Å; L971-T973 PolarHBondContact O-N 3.13Å; L971-N974 PolarHBondContact O-N 3.42Å; L971-A975 WeakPolarHBondContact O-CB 3.05Å; L971-A975 PolarHBondContact O-N 2.86Å
972	M	77.4	Confident	82.1	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-60.3	-42.5	175.4	-66.5	-172.5	-61	0	0	110.8	L878 I886 F889 V938 A968 A975 I976	L878-M972 HydrophobicContact CD1-CB 4Å; L878-M972 HydrophobicContact CD1-CG 4.07Å; I886-M972 HydrophobicContact CB-SD 4.31Å; I886-M972 HydrophobicContact CD1-CB 4.45Å; I886-M972 HydrophobicContact CD1-CG 4.18Å; I886-M972 HydrophobicContact CD1-SD 3.69Å; I886-M972 HydrophobicContact CG1-SD 3.65Å; I886-M972 HydrophobicContact CG2-CB 3.62Å; I886-M972 HydrophobicContact CG2-CE 4.14Å; I886-M972 HydrophobicContact CG2-CG 4.22Å; I886-M972 HydrophobicContact CG2-SD 3.82Å; F889-M972 HydrophobicContact CD1-CE 3.87Å; F889-M972 HydrophobicContact CE1-CE 3.92Å; V938-M972 HydrophobicContact CG1-SD 4.31Å; A968-M972 HydrophobicContact CB-CE 4.09Å; A968-M972 WeakPolarHBondContact O-CB 3.49Å; A968-M972 WeakPolarHBondContact O-CG 3.36Å; A968-M972 PolarHBondContact O-N 2.77Å; M972-A975 PolarHBondContact O-N 2.93Å; M972-I976 WeakPolarHBondContact O-CB 3.5Å; M972-I976 WeakPolarHBondContact O-CD1 3.29Å; M972-I976 WeakPolarHBondContact O-CG1 3.39Å; M972-I976 PolarHBondContact O-N 2.87Å
973	T	79.3	Confident	82.1	Confident	16 Å²	16	30.9 Å²	30.9	10%	0.098	18%	0.182	C	C	.	.	H	α-helix	trans	-59.2	-47.7	172.8	-66.3	0	0	0	0	112.3	Y969 T970 L971 A975 I976 L977 I996	Y969-T973 WeakPolarHBondContact O-CB 3.35Å; Y969-T973 PolarHBondContact O-N 3.03Å; Y969-T973 PolarHBondContact O-OG1 3.43Å; T970-T973 PolarHBondContact O-N 3Å; L971-T973 VanDerWaalsContact C-N 3.3Å; L971-T973 PolarHBondContact O-N 3.13Å; T973-A975 PolarHBondContact O-N 2.85Å; T973-I976 WeakPolarHBondContact O-CB 3.33Å; T973-I976 PolarHBondContact O-N 2.67Å; T973-L977 HydrophobicContact CG2-CD1 3.89Å; T973-L977 HydrophobicContact CG2-CG 4.42Å; T973-L977 VanDerWaalsContact O-CG 3.29Å; T973-L977 WeakPolarHBondContact O-CG 3.41Å; T973-L977 PolarHBondContact O-N 2.99Å; T973-I996 HydrophobicContact CG2-CD1 3.46Å; T973-I996 VanDerWaalsContact CG2-CD1 3.46Å; T973-I996 HydrophobicContact CG2-CG1 4.29Å
974	N	80.2	Confident	82.3	Confident	94 Å²	94	30.2 Å²	30.2	50%	0.503	18%	0.177	S	C	.	.	H	α-helix	trans	-64.5	-41	179.2	-69.3	-22.1	0	0	0	112	T970 L971 L977 S978	T970-N974 VanDerWaalsContact O-CG 3.24Å; T970-N974 PolarHBondContact O-N 3.21Å; T970-N974 PolarHBondContact O-ND2 2.67Å; L971-N974 PolarHBondContact O-N 3.42Å; N974-L977 PolarHBondContact O-N 3.31Å; N974-S978 WeakPolarHBondContact O-CB 3.23Å; N974-S978 PolarHBondContact O-N 2.87Å; N974-S978 PolarHBondContact O-OG 3.43Å
975	A	78	Confident	82.3	Confident	6 Å²	6	35 Å²	35	5%	0.05	20%	0.199	C	C	.	.	H	α-helix	trans	-65.2	-40.9	176	0	0	0	0	0	112	L878 L971 M972 T973 S978	L878-A975 HydrophobicContact CD1-CB 3.99Å; L878-A975 HydrophobicContact CG-CB 4.37Å; L971-A975 WeakPolarHBondContact O-CB 3.05Å; L971-A975 PolarHBondContact O-N 2.86Å; M972-A975 PolarHBondContact O-N 2.93Å; T973-A975 PolarHBondContact O-N 2.85Å; A975-S978 PolarHBondContact O-OG 2.91Å
976	I	79.3	Confident	82.3	Confident	3 Å²	3	38.3 Å²	38.3	2%	0.015	22%	0.217	C	C	.	.	H	α-helix	trans	-54.4	-57.2	169.8	-76.6	158.6	0	0	0	110	L883 I886 M972 T973 S978 K979 M980 I996 L999	L883-I976 HydrophobicContact CD2-CG1 3.58Å; I886-I976 HydrophobicContact CG2-CD1 3.68Å; M972-I976 WeakPolarHBondContact O-CB 3.5Å; M972-I976 WeakPolarHBondContact O-CD1 3.29Å; M972-I976 WeakPolarHBondContact O-CG1 3.39Å; M972-I976 PolarHBondContact O-N 2.87Å; T973-I976 WeakPolarHBondContact O-CB 3.33Å; T973-I976 PolarHBondContact O-N 2.67Å; I976-S978 VanDerWaalsContact C-N 3.34Å; I976-S978 PolarHBondContact O-N 2.65Å; I976-K979 PolarHBondContact O-N 3.46Å; I976-K979 VanDerWaalsContact O-N 3.12Å; I976-M980 HydrophobicContact CG2-CE 3.6Å; I976-I996 HydrophobicContact CG2-CG1 4.4Å; I976-L999 HydrophobicContact CD1-CD1 3.62Å; I976-L999 HydrophobicContact CG1-CD1 3.97Å; I976-L999 HydrophobicContact CG2-CD1 3.84Å
977	L	84.5	Confident	82.5	Confident	18 Å²	18	37.4 Å²	37.4	9%	0.094	21%	0.214	C	C	.	.	H	α-helix	trans	-64.1	-37.3	-173.3	-66.9	172.4	0	0	0	112.1	T973 N974 K979 M980 V984 Q985 H992 I996	T973-L977 HydrophobicContact CG2-CD1 3.89Å; T973-L977 HydrophobicContact CG2-CG 4.42Å; T973-L977 VanDerWaalsContact O-CG 3.29Å; T973-L977 WeakPolarHBondContact O-CG 3.41Å; T973-L977 PolarHBondContact O-N 2.99Å; N974-L977 PolarHBondContact O-N 3.31Å; L977-K979 PolarHBondContact O-N 2.5Å; L977-K979 VanDerWaalsContact O-N 3.14Å; L977-M980 PolarHBondContact O-N 3.37Å; L977-M980 VanDerWaalsContact O-N 3.11Å; L977-V984 HydrophobicContact CD2-CG1 3.71Å; L977-Q985 WeakPolarHBondContact O-CG 3.48Å; L977-H992 HydrophobicContact CD1-CB 3.95Å; L977-H992 HydrophobicContact CD2-CB 3.98Å; L977-I996 HydrophobicContact CD2-CG1 4.24Å
978	S	83.7	Confident	82.8	Confident	76 Å²	76	36.6 Å²	36.6	53%	0.531	21%	0.205	S	C	.	.	H	α-helix	trans	-62.2	-19	176.8	71.7	0	0	0	0	114.7	N974 A975 I976 Q985	N974-S978 WeakPolarHBondContact O-CB 3.23Å; N974-S978 PolarHBondContact O-N 2.87Å; N974-S978 PolarHBondContact O-OG 3.43Å; A975-S978 PolarHBondContact O-OG 2.91Å; I976-S978 VanDerWaalsContact C-N 3.34Å; I976-S978 PolarHBondContact O-N 2.65Å; S978-Q985 PolarHBondContact O-NE2 3.41Å; S978-Q985 VanDerWaalsContact O-NE2 3.14Å
979	K	79.8	Confident	83.2	Confident	93 Å²	93	38.7 Å²	38.7	40%	0.404	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.8	-12.5	177.7	-71.6	-175.1	171.9	-167	0	113.8	L878 T880 I976 L977	L878-K979 WeakPolarHBondContact O-CE 3.39Å; L878-K979 PolarHBondContact O-NZ 2.88Å; T880-K979 PolarHBondContact OG1-NZ 2.96Å; I976-K979 PolarHBondContact O-N 3.46Å; I976-K979 VanDerWaalsContact O-N 3.12Å; L977-K979 PolarHBondContact O-N 2.5Å; L977-K979 VanDerWaalsContact O-N 3.14Å
980	M	86.2	Confident	83.7	Confident	9 Å²	9	37.1 Å²	37.1	4%	0.044	21%	0.212	C	C	.	.	S	Bend	trans	-83.9	172.5	-178.9	-64.2	-163.4	177.4	0	0	111.7	I976 L977 V984 Q985 A995 L999 P1067 R1069	I976-M980 HydrophobicContact CG2-CE 3.6Å; L977-M980 PolarHBondContact O-N 3.37Å; L977-M980 VanDerWaalsContact O-N 3.11Å; M980-V984 HydrophobicContact CB-CB 3.76Å; M980-V984 HydrophobicContact CB-CG1 3.85Å; M980-V984 HydrophobicContact CB-CG2 4.15Å; M980-V984 HydrophobicContact CG-CG1 4.43Å; M980-V984 HydrophobicContact SD-CB 4.45Å; M980-V984 HydrophobicContact SD-CG1 3.85Å; M980-V984 HydrophobicContact SD-CG2 4.33Å; M980-Q985 PolarHBondContact O-NE2 3.03Å; M980-A995 HydrophobicContact CE-CB 4.35Å; M980-A995 HydrophobicContact SD-CB 3.65Å; M980-L999 HydrophobicContact CE-CD2 3.86Å; M980-L999 HydrophobicContact CE-CG 4.32Å; M980-P1067 CarbonylContact C-O 3.54Å; M980-P1067 VanDerWaalsContact CA-O 3.29Å; M980-P1067 WeakPolarHBondContact CA-O 3.32Å; M980-P1067 WeakPolarHBondContact CB-O 3.26Å; M980-P1067 HydrophobicContact SD-CB 3.99Å; M980-R1069 HydrophobicContact CE-CG 4.48Å
981	S	87.4	Confident	84.4	Confident	29 Å²	29	34.2 Å²	34.2	20%	0.203	20%	0.195	C	C	.	.			trans	-59.1	160.8	-177.9	72.4	0	0	0	0	113.3	F983 V984 Q985 I1066 P1067	S981-F983 PolarHBondContact O-N 3.4Å; S981-F983 VanDerWaalsContact O-N 3.14Å; S981-V984 PolarHBondContact O-N 2.9Å; S981-Q985 WeakPolarHBondContact O-CG 3.36Å; S981-Q985 PolarHBondContact O-N 3.41Å; S981-I1066 WeakPolarHBondContact CB-O 3.21Å; S981-I1066 PolarHBondContact OG-O 3.41Å; S981-P1067 PolarHBondContact N-O 2.93Å
982	S	86.8	Confident	85	Confident	84 Å²	84	35 Å²	35	59%	0.587	20%	0.197	S	C	*	.	H	α-helix	trans	-59.3	-24.1	175.3	57.9	0	0	0	0	113.6	N986	S982-N986 VanDerWaalsContact O-CB 3.32Å; S982-N986 WeakPolarHBondContact O-CB 3.4Å; S982-N986 PolarHBondContact O-N 3.44Å; S982-N986 VanDerWaalsContact O-N 3.16Å; S982-N986 PolarHBondContact O-ND2 2.76Å
983	F	89.1	Confident	85.6	Confident	25 Å²	25	35.7 Å²	35.7	11%	0.11	20%	0.202	C	C	.	.	H	α-helix	trans	-67.3	-42.1	171.2	164	-103.4	0	0	0	111.7	S981 G987 V991 I1066 M1523 L1526 Y1527	S981-F983 PolarHBondContact O-N 3.4Å; S981-F983 VanDerWaalsContact O-N 3.14Å; F983-G987 PolarHBondContact O-N 2.87Å; F983-V991 HydrophobicContact CD1-CG1 4.35Å; F983-V991 HydrophobicContact CE1-CG1 3.76Å; F983-V991 HydrophobicContact CZ-CG1 3.96Å; F983-V991 HydrophobicContact CZ-CG2 4.08Å; F983-I1066 HydrophobicContact CD1-CG2 3.48Å; F983-I1066 VanDerWaalsContact CD1-CG2 3.48Å; F983-I1066 HydrophobicContact CE1-CG2 3.52Å; F983-M1523 HydrophobicContact CE1-SD 3.74Å; F983-M1523 HydrophobicContact CZ-SD 4.39Å; F983-L1526 HydrophobicContact CZ-CB 4.19Å; F983-Y1527 HydrophobicContact CB-CD2 4.22Å; F983-Y1527 HydrophobicContact CB-CE2 4.25Å; F983-Y1527 AromaticContact CD1-CD2 3.87Å; F983-Y1527 HydrophobicContact CD1-CD2 3.87Å; F983-Y1527 AromaticContact CD2-CD2 3.85Å; F983-Y1527 HydrophobicContact CD2-CD2 3.85Å; F983-Y1527 HydrophobicContact CE1-CD2 4.17Å; F983-Y1527 HydrophobicContact CE2-CD2 4.18Å; F983-Y1527 AromaticContact CG-CD2 3.68Å; F983-Y1527 HydrophobicContact CG-CD2 3.68Å; F983-Y1527 HydrophobicContact CG-CE2 4.22Å; F983-Y1527 HydrophobicContact CZ-CD2 4.32Å
984	V	89.7	Confident	86.2	Confident	0 Å²	0	35 Å²	35	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-71.7	-48.3	176.4	178.8	0	0	0	0	110.5	L977 M980 S981 N986 G987 V991 H992 A995 P1067	L977-V984 HydrophobicContact CD2-CG1 3.71Å; M980-V984 HydrophobicContact CB-CB 3.76Å; M980-V984 HydrophobicContact CB-CG1 3.85Å; M980-V984 HydrophobicContact CB-CG2 4.15Å; M980-V984 HydrophobicContact CG-CG1 4.43Å; M980-V984 HydrophobicContact SD-CB 4.45Å; M980-V984 HydrophobicContact SD-CG1 3.85Å; M980-V984 HydrophobicContact SD-CG2 4.33Å; S981-V984 PolarHBondContact O-N 2.9Å; V984-N986 VanDerWaalsContact C-N 3.27Å; V984-N986 PolarHBondContact O-N 2.88Å; V984-G987 WeakPolarHBondContact O-CA 3.21Å; V984-G987 PolarHBondContact O-N 2.9Å; V984-V991 HydrophobicContact CG2-CG1 4.38Å; V984-H992 PolarHBondContact O-CD2 3.19Å; V984-H992 PolarHBondContact O-NE2 3.31Å; V984-A995 HydrophobicContact CG1-CB 3.72Å; V984-A995 HydrophobicContact CG2-CB 4.19Å; V984-P1067 HydrophobicContact CG2-CB 4.21Å
985	Q	88	Confident	86.7	Confident	99 Å²	99	30.5 Å²	30.5	46%	0.463	17%	0.173	S	C	.	.	H	α-helix	trans	-59.1	-35	-178.1	-67	179.4	15.5	0	0	113.8	L977 S978 M980 S981 G987	L977-Q985 WeakPolarHBondContact O-CG 3.48Å; S978-Q985 PolarHBondContact O-NE2 3.41Å; S978-Q985 VanDerWaalsContact O-NE2 3.14Å; M980-Q985 PolarHBondContact O-NE2 3.03Å; S981-Q985 WeakPolarHBondContact O-CG 3.36Å; S981-Q985 PolarHBondContact O-N 3.41Å; Q985-G987 VanDerWaalsContact C-N 3.34Å
986	N	85.1	Confident	87.1	Confident	70 Å²	70	30.6 Å²	30.6	37%	0.374	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.8	11.6	177.5	-60.8	-60.5	0	0	0	112.7	S75 I76 S982 V984	S75-N986 WeakPolarHBondContact CB-O 3.14Å; I76-N986 HydrophobicContact CB-CB 4.29Å; I76-N986 HydrophobicContact CD1-CB 4.08Å; I76-N986 WeakPolarHBondContact CD1-OD1 3.29Å; I76-N986 HydrophobicContact CG1-CB 4.14Å; I76-N986 PolarHBondContact N-O 3.01Å; S982-N986 VanDerWaalsContact O-CB 3.32Å; S982-N986 WeakPolarHBondContact O-CB 3.4Å; S982-N986 PolarHBondContact O-N 3.44Å; S982-N986 VanDerWaalsContact O-N 3.16Å; S982-N986 PolarHBondContact O-ND2 2.76Å; V984-N986 VanDerWaalsContact C-N 3.27Å; V984-N986 PolarHBondContact O-N 2.88Å
987	G	85.3	Confident	87.5	Confident	6 Å²	6	30.5 Å²	30.5	6%	0.062	17%	0.172	C	C	.	.			trans	-83.3	168.7	-173	0	0	0	0	0	114.1	S75 F983 V984 Q985 H992	S75-G987 WeakPolarHBondContact CB-O 2.94Å; F983-G987 PolarHBondContact O-N 2.87Å; V984-G987 WeakPolarHBondContact O-CA 3.21Å; V984-G987 PolarHBondContact O-N 2.9Å; Q985-G987 VanDerWaalsContact C-N 3.34Å; G987-H992 PolarHBondContact O-CE1 2.87Å; G987-H992 VanDerWaalsContact O-CE1 3.27Å; G987-H992 PolarHBondContact O-NE2 3.46Å
988	G	85.6	Confident	87.7	Confident	2 Å²	2	29.6 Å²	29.6	2%	0.021	17%	0.168	C	C	.	.			trans	-80.8	172.7	174.2	0	0	0	0	0	113.6	D80 L990 V991 H992	D80-G988 WeakPolarHBondContact OD2-CA 3.36Å; G988-L990 PolarHBondContact O-N 3.38Å; G988-L990 VanDerWaalsContact O-N 3.17Å; G988-V991 WeakPolarHBondContact O-CB 3.44Å; G988-V991 PolarHBondContact O-N 3.1Å; G988-H992 PolarHBondContact O-N 3.1Å
989	P	87.1	Confident	87.7	Confident	45 Å²	45	26 Å²	26	29%	0.292	14%	0.143	S	C	.	.	H	α-helix	trans	-52.7	-35.7	175.5	-28.7	37.6	0	0	0	114.3	F82 T993 W1486	F82-P989 WeakPolarHBondContact O-CG 3.49Å; P989-T993 WeakPolarHBondContact O-CB 3.26Å; P989-T993 PolarHBondContact O-N 2.94Å; P989-T993 PolarHBondContact O-OG1 2.88Å; P989-W1486 HydrophobicContact CB-CH2 3.5Å; P989-W1486 HydrophobicContact CB-CZ2 4.06Å; P989-W1486 HydrophobicContact CB-CZ3 4.08Å
990	L	91	Very high	87.9	Confident	1 Å²	1	21.9 Å²	21.9	1%	0.005	13%	0.125	C	C	.	.	H	α-helix	trans	-67.2	-43.1	174.4	175.9	61.5	0	0	0	112.1	F82 G988 T993 L994 L1482 W1486 I1489 L1526	F82-L990 HydrophobicContact CB-CB 4.24Å; F82-L990 HydrophobicContact CD1-CB 3.93Å; F82-L990 HydrophobicContact CD1-CD2 3.93Å; F82-L990 HydrophobicContact CD2-CB 4.33Å; F82-L990 HydrophobicContact CD2-CD2 4.2Å; F82-L990 HydrophobicContact CE1-CB 4.46Å; F82-L990 HydrophobicContact CE1-CD2 3.59Å; F82-L990 HydrophobicContact CE2-CD2 3.88Å; F82-L990 HydrophobicContact CG-CB 3.9Å; F82-L990 HydrophobicContact CG-CD2 4.26Å; F82-L990 HydrophobicContact CZ-CD2 3.59Å; G988-L990 PolarHBondContact O-N 3.38Å; G988-L990 VanDerWaalsContact O-N 3.17Å; L990-T993 PolarHBondContact O-N 2.7Å; L990-L994 HydrophobicContact CD1-CD1 3.8Å; L990-L994 HydrophobicContact CD1-CG 3.97Å; L990-L994 HydrophobicContact CG-CD1 3.95Å; L990-L994 WeakPolarHBondContact O-CB 3.21Å; L990-L994 VanDerWaalsContact O-CG 3.32Å; L990-L994 WeakPolarHBondContact O-CG 3.46Å; L990-L994 PolarHBondContact O-N 2.89Å; L990-L1482 HydrophobicContact CD2-CB 4.43Å; L990-W1486 HydrophobicContact CB-CD2 4.44Å; L990-W1486 HydrophobicContact CB-CE3 3.79Å; L990-W1486 HydrophobicContact CB-CZ3 4.28Å; L990-W1486 HydrophobicContact CD1-CB 4.21Å; L990-W1486 HydrophobicContact CD1-CE3 3.85Å; L990-W1486 HydrophobicContact CG-CE3 4.4Å; L990-I1489 HydrophobicContact CD1-CD1 4.08Å; L990-L1526 HydrophobicContact CD2-CD1 3.88Å; L990-L1526 HydrophobicContact CD2-CD2 4.04Å; L990-L1526 HydrophobicContact CG-CD1 3.87Å
991	V	92	Very high	88	Confident	11 Å²	11	21.4 Å²	21.4	7%	0.067	12%	0.123	C	C	.	.	H	α-helix	trans	-63.4	-50.3	177.1	177	0	0	0	0	110.1	F983 V984 G988 T993 L994 A995 M1523 L1526	F983-V991 HydrophobicContact CD1-CG1 4.35Å; F983-V991 HydrophobicContact CE1-CG1 3.76Å; F983-V991 HydrophobicContact CZ-CG1 3.96Å; F983-V991 HydrophobicContact CZ-CG2 4.08Å; V984-V991 HydrophobicContact CG2-CG1 4.38Å; G988-V991 WeakPolarHBondContact O-CB 3.44Å; G988-V991 PolarHBondContact O-N 3.1Å; V991-T993 VanDerWaalsContact C-N 3.29Å; V991-T993 PolarHBondContact O-N 2.83Å; V991-L994 PolarHBondContact O-N 2.98Å; V991-A995 WeakPolarHBondContact O-CB 3.38Å; V991-A995 PolarHBondContact O-N 2.79Å; V991-M1523 HydrophobicContact CG1-SD 4.22Å; V991-L1526 HydrophobicContact CG2-CB 4.39Å; V991-L1526 HydrophobicContact CG2-CD1 4.17Å
992	H	90	Very high	87.7	Confident	48 Å²	48	20.2 Å²	20.2	22%	0.222	11%	0.114	C	C	.	.	H	α-helix	trans	-55.5	-46.1	175.2	-65.8	156.4	0	0	0	111.6	L977 V984 G987 G988 A995 I996	L977-H992 HydrophobicContact CD1-CB 3.95Å; L977-H992 HydrophobicContact CD2-CB 3.98Å; V984-H992 PolarHBondContact O-CD2 3.19Å; V984-H992 PolarHBondContact O-NE2 3.31Å; G987-H992 PolarHBondContact O-CE1 2.87Å; G987-H992 VanDerWaalsContact O-CE1 3.27Å; G987-H992 PolarHBondContact O-NE2 3.46Å; G988-H992 PolarHBondContact O-N 3.1Å; H992-A995 PolarHBondContact O-N 2.94Å; H992-I996 VanDerWaalsContact O-CD1 3.27Å; H992-I996 WeakPolarHBondContact O-CD1 3.49Å; H992-I996 WeakPolarHBondContact O-CG1 3.49Å; H992-I996 PolarHBondContact O-N 3.15Å
993	T	88.9	Confident	87.1	Confident	15 Å²	15	16.3 Å²	16.3	9%	0.092	9%	0.087	C	C	.	.	H	α-helix	trans	-62.2	-49.9	-178.9	-72.3	0	0	0	0	112.2	R890 P989 L990 V991 A995 I996 S997 W1486 I1489	R890-T993 PolarHBondContact NH1-O 3.37Å; P989-T993 WeakPolarHBondContact O-CB 3.26Å; P989-T993 PolarHBondContact O-N 2.94Å; P989-T993 PolarHBondContact O-OG1 2.88Å; L990-T993 PolarHBondContact O-N 2.7Å; V991-T993 VanDerWaalsContact C-N 3.29Å; V991-T993 PolarHBondContact O-N 2.83Å; T993-A995 VanDerWaalsContact C-N 3.28Å; T993-A995 PolarHBondContact O-N 3.27Å; T993-I996 PolarHBondContact O-N 2.89Å; T993-S997 WeakPolarHBondContact O-CB 3.37Å; T993-S997 PolarHBondContact O-N 2.91Å; T993-S997 PolarHBondContact O-OG 3.44Å; T993-W1486 HydrophobicContact CG2-CZ3 4.39Å; T993-I1489 HydrophobicContact CG2-CB 4.47Å; T993-I1489 HydrophobicContact CG2-CG2 3.28Å
994	L	92.3	Very high	86.3	Confident	0 Å²	0	18 Å²	18	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-63.2	-35.1	175.9	-70.2	167.3	0	0	0	111.8	L990 V991 S997 S998 I1489 L1497 I1519 I1522 M1523 L1526	L990-L994 HydrophobicContact CD1-CD1 3.8Å; L990-L994 HydrophobicContact CD1-CG 3.97Å; L990-L994 HydrophobicContact CG-CD1 3.95Å; L990-L994 WeakPolarHBondContact O-CB 3.21Å; L990-L994 VanDerWaalsContact O-CG 3.32Å; L990-L994 WeakPolarHBondContact O-CG 3.46Å; L990-L994 PolarHBondContact O-N 2.89Å; V991-L994 PolarHBondContact O-N 2.98Å; L994-S997 CarbonylContact O-C 3.37Å; L994-S997 PolarHBondContact O-N 3.37Å; L994-S998 WeakPolarHBondContact O-CB 3.24Å; L994-S998 PolarHBondContact O-N 3.39Å; L994-I1489 HydrophobicContact CD2-CD1 3.63Å; L994-I1489 HydrophobicContact CG-CD1 4.32Å; L994-L1497 HydrophobicContact CD2-CD1 4.19Å; L994-I1519 HydrophobicContact CD2-CD1 3.49Å; L994-I1519 VanDerWaalsContact CD2-CD1 3.49Å; L994-I1519 HydrophobicContact CD2-CG2 4.29Å; L994-I1522 HydrophobicContact CD1-CG2 3.8Å; L994-M1523 HydrophobicContact CB-CE 3.56Å; L994-L1526 HydrophobicContact CD1-CD1 3.33Å
995	A	90.4	Very high	85.6	Confident	0 Å²	0	19.4 Å²	19.4	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-68.9	-42.1	179.6	0	0	0	0	0	111.7	M980 V984 V991 H992 T993 S998 M1523	M980-A995 HydrophobicContact CE-CB 4.35Å; M980-A995 HydrophobicContact SD-CB 3.65Å; V984-A995 HydrophobicContact CG1-CB 3.72Å; V984-A995 HydrophobicContact CG2-CB 4.19Å; V991-A995 WeakPolarHBondContact O-CB 3.38Å; V991-A995 PolarHBondContact O-N 2.79Å; H992-A995 PolarHBondContact O-N 2.94Å; T993-A995 VanDerWaalsContact C-N 3.28Å; T993-A995 PolarHBondContact O-N 3.27Å; A995-S998 WeakPolarHBondContact O-CB 3.2Å; A995-S998 PolarHBondContact O-N 3.49Å; A995-S998 PolarHBondContact O-OG 2.94Å; A995-M1523 HydrophobicContact CB-CE 3.71Å; A995-M1523 VanDerWaalsContact N-CE 3.29Å
996	I	87.5	Confident	84.8	Confident	8 Å²	8	18.7 Å²	18.7	4%	0.041	12%	0.115	C	C	.	.	H	α-helix	trans	-65.3	-43.6	171.5	-60.2	152.8	0	0	0	110	T973 I976 L977 H992 T993 S998 L999	T973-I996 HydrophobicContact CG2-CD1 3.46Å; T973-I996 VanDerWaalsContact CG2-CD1 3.46Å; T973-I996 HydrophobicContact CG2-CG1 4.29Å; I976-I996 HydrophobicContact CG2-CG1 4.4Å; L977-I996 HydrophobicContact CD2-CG1 4.24Å; H992-I996 VanDerWaalsContact O-CD1 3.27Å; H992-I996 WeakPolarHBondContact O-CD1 3.49Å; H992-I996 WeakPolarHBondContact O-CG1 3.49Å; H992-I996 PolarHBondContact O-N 3.15Å; T993-I996 PolarHBondContact O-N 2.89Å; I996-S998 PolarHBondContact O-N 2.94Å; I996-L999 WeakPolarHBondContact O-CB 3.28Å; I996-L999 VanDerWaalsContact O-CG 3.31Å; I996-L999 WeakPolarHBondContact O-CG 3.26Å; I996-L999 PolarHBondContact O-N 2.85Å; I996-L999 VanDerWaalsContact O-N 3.08Å
997	S	87.5	Confident	84.4	Confident	1 Å²	1	18.3 Å²	18.3	1%	0.007	12%	0.118	C	C	.	.	H	α-helix	trans	-69.5	-15.1	177.7	-55.5	0	0	0	0	113.4	R890 T993 L994 L999 I1000 F1001 F1495	R890-S997 PolarHBondContact NH1-OG 3.16Å; T993-S997 WeakPolarHBondContact O-CB 3.37Å; T993-S997 PolarHBondContact O-N 2.91Å; T993-S997 PolarHBondContact O-OG 3.44Å; L994-S997 CarbonylContact O-C 3.37Å; L994-S997 PolarHBondContact O-N 3.37Å; S997-L999 PolarHBondContact O-N 2.83Å; S997-I1000 WeakPolarHBondContact O-CG1 3.45Å; S997-F1001 VanDerWaalsContact O-CE2 3.24Å; S997-F1001 WeakPolarHBondContact O-CE2 3.43Å; S997-F1495 WeakPolarHBondContact CB-O 3.24Å; S997-F1495 PolarHBondContact OG-O 3.08Å
998	S	88.2	Confident	83.9	Confident	0 Å²	0	18 Å²	18	0%	0	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-17	170.9	82.5	0	0	0	0	113.2	L994 A995 I996 R1069	L994-S998 WeakPolarHBondContact O-CB 3.24Å; L994-S998 PolarHBondContact O-N 3.39Å; A995-S998 WeakPolarHBondContact O-CB 3.2Å; A995-S998 PolarHBondContact O-N 3.49Å; A995-S998 PolarHBondContact O-OG 2.94Å; I996-S998 PolarHBondContact O-N 2.94Å; S998-R1069 PolarHBondContact O-NH1 2.81Å; S998-R1069 PolarHBondContact OG-NH1 3.46Å
999	L	84.2	Confident	83.5	Confident	1 Å²	1	22.5 Å²	22.5	1%	0.005	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-40.2	-179.4	-62.2	176.8	0	0	0	111.7	L883 Q884 A887 I976 M980 I996 S997 F1001 C1002	L883-L999 HydrophobicContact CB-CD1 4.23Å; L883-L999 HydrophobicContact CB-CD2 4.01Å; Q884-L999 PolarHBondContact OE1-O 3.32Å; Q884-L999 VanDerWaalsContact OE1-O 3.07Å; A887-L999 HydrophobicContact CB-CB 3.3Å; A887-L999 HydrophobicContact CB-CD1 3.97Å; A887-L999 HydrophobicContact CB-CG 4.28Å; I976-L999 HydrophobicContact CD1-CD1 3.62Å; I976-L999 HydrophobicContact CG1-CD1 3.97Å; I976-L999 HydrophobicContact CG2-CD1 3.84Å; M980-L999 HydrophobicContact CE-CD2 3.86Å; M980-L999 HydrophobicContact CE-CG 4.32Å; I996-L999 WeakPolarHBondContact O-CB 3.28Å; I996-L999 VanDerWaalsContact O-CG 3.31Å; I996-L999 WeakPolarHBondContact O-CG 3.26Å; I996-L999 PolarHBondContact O-N 2.85Å; I996-L999 VanDerWaalsContact O-N 3.08Å; S997-L999 PolarHBondContact O-N 2.83Å; L999-F1001 PolarHBondContact O-N 2.88Å; L999-C1002 PolarHBondContact O-N 3.34Å
1000	I	84	Confident	83.1	Confident	5 Å²	5	21 Å²	21	3%	0.026	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-21.8	-171.1	70.3	-170.4	0	0	0	114.1	Q884 A887 S997 I1041 A1514	Q884-I1000 VanDerWaalsContact NE2-C 3.32Å; Q884-I1000 PolarHBondContact NE2-O 3.39Å; Q884-I1000 PolarHBondContact OE1-O 3.25Å; A887-I1000 HydrophobicContact CB-CG2 3.6Å; S997-I1000 WeakPolarHBondContact O-CG1 3.45Å; I1000-I1041 HydrophobicContact CB-CD1 4.05Å; I1000-I1041 HydrophobicContact CD1-CD1 4.29Å; I1000-I1041 HydrophobicContact CG1-CD1 3.87Å; I1000-I1041 VanDerWaalsContact O-CD1 3.26Å; I1000-I1041 WeakPolarHBondContact O-CD1 3.39Å; I1000-A1514 HydrophobicContact CD1-CB 3.87Å
1001	F	86.8	Confident	82.3	Confident	0 Å²	0	21.3 Å²	21.3	0%	0	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-17.2	-179.1	-52.8	-73.2	0	0	0	113.5	S997 L999 T1036 I1037 A1038 I1041 R1050 L1063 A1514 A1516 I1519	S997-F1001 VanDerWaalsContact O-CE2 3.24Å; S997-F1001 WeakPolarHBondContact O-CE2 3.43Å; L999-F1001 PolarHBondContact O-N 2.88Å; F1001-T1036 VanDerWaalsContact O-O 3.1Å; F1001-I1037 HydrophobicContact CB-CG2 4.33Å; F1001-I1037 CarbonylContact O-C 3.56Å; F1001-I1037 VanDerWaalsContact O-CA 3.31Å; F1001-I1037 WeakPolarHBondContact O-CA 3.42Å; F1001-A1038 PolarHBondContact O-N 2.94Å; F1001-I1041 HydrophobicContact CD1-CD1 4.16Å; F1001-I1041 HydrophobicContact CD1-CG1 4.22Å; F1001-I1041 HydrophobicContact CE1-CD1 4.35Å; F1001-I1041 HydrophobicContact CE1-CG1 4.28Å; F1001-R1050 PolarHBondContact O-NH2 3.46Å; F1001-L1063 HydrophobicContact CB-CD1 4.2Å; F1001-L1063 HydrophobicContact CD2-CD1 4.28Å; F1001-L1063 HydrophobicContact CD2-CD2 4.36Å; F1001-A1514 HydrophobicContact CE1-CB 4.02Å; F1001-A1514 HydrophobicContact CZ-CB 3.95Å; F1001-A1516 HydrophobicContact CB-CB 4.17Å; F1001-A1516 HydrophobicContact CD1-CB 3.9Å; F1001-A1516 HydrophobicContact CD2-CB 4.2Å; F1001-A1516 HydrophobicContact CE1-CB 4.36Å; F1001-A1516 HydrophobicContact CG-CB 3.81Å; F1001-I1519 HydrophobicContact CE2-CB 4.28Å; F1001-I1519 HydrophobicContact CE2-CG1 3.94Å; F1001-I1519 HydrophobicContact CZ-CG1 4.28Å
1002	C	81.7	Confident	81.4	Confident	4 Å²	4	26 Å²	26	3%	0.027	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	90	-162.9	-64.1	0	0	0	0	111.7	Q884 L999 T1035 R1069	Q884-C1002 VanDerWaalsContact OE1-N 3.08Å; Q884-C1002 PolarHBondContact OE1-O 2.9Å; L999-C1002 PolarHBondContact O-N 3.34Å; C1002-T1035 HydrophobicContact CB-CG2 4.24Å; C1002-R1069 VanDerWaalsContact CB-NH2 3.31Å
1003	G	75.4	Confident	80.7	Confident	2 Å²	2	25.9 Å²	25.9	2%	0.021	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	158.4	-178.7	0	0	0	0	0	114.1	T1036 R1050	G1003-T1036 PolarHBondContact N-O 2.74Å; G1003-T1036 VanDerWaalsContact N-O 3.1Å; G1003-T1036 PolarHBondContact O-N 2.82Å; G1003-T1036 PolarHBondContact O-OG1 3.19Å; G1003-R1050 PolarHBondContact O-NH2 3.29Å
1004	P	71.5	Confident	79.9	Confident	61 Å²	61	25.6 Å²	25.6	40%	0.396	15%	0.146	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	134.5	168.7	28.6	-32.6	0	0	0	110.2	Q1033	P1004-Q1033 HydrophobicContact CB-CB 3.94Å
1005	V	74.6	Confident	78.8	Confident	28 Å²	28	30.9 Å²	30.9	17%	0.17	18%	0.183	C	C	.	.			trans	-132.9	115.8	176.7	-179.9	0	0	0	0	110.1	S1007 G1008 A1046 R1050	V1005-S1007 WeakPolarHBondContact CG1-OG 3.34Å; V1005-S1007 PolarHBondContact O-N 2.88Å; V1005-G1008 CarbonylContact O-C 3.5Å; V1005-G1008 PolarHBondContact O-N 2.88Å; V1005-G1008 VanDerWaalsContact O-N 3.07Å; V1005-A1046 HydrophobicContact CG1-CB 4.26Å; V1005-R1050 VanDerWaalsContact CG2-CZ 3.45Å
1006	S	71.3	Confident	77.7	Confident	85 Å²	85	39.4 Å²	39.4	59%	0.594	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-31.7	-176.5	59.1	0	0	0	0	114
1007	S	76.1	Confident	76.8	Confident	62 Å²	62	39.7 Å²	39.7	43%	0.434	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.9	-1	-179.9	60.6	0	0	0	0	114.9	V1005 G1047	V1005-S1007 WeakPolarHBondContact CG1-OG 3.34Å; V1005-S1007 PolarHBondContact O-N 2.88Å; S1007-G1047 CarbonylContact O-C 3.45Å; S1007-G1047 VanDerWaalsContact O-CA 3.26Å; S1007-G1047 WeakPolarHBondContact O-CA 3.45Å; S1007-G1047 PolarHBondContact OG-N 2.86Å
1008	G	76.5	Confident	75.4	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	26%	0.256	C	S	.	.	S	Bend	trans	-141.5	53	-175.8	0	0	0	0	0	111.8	V1005 N1051	V1005-G1008 CarbonylContact O-C 3.5Å; V1005-G1008 PolarHBondContact O-N 2.88Å; V1005-G1008 VanDerWaalsContact O-N 3.07Å; G1008-N1051 PolarHBondContact O-ND2 3.13Å
1009	K	76	Confident	73.6	Confident	95 Å²	95	52.3 Å²	52.3	41%	0.413	28%	0.279	S	S	.	.	P	Polyproline II helix	trans	-76.3	136.2	-177	-59	-168.9	-177.5	-164.4	0	112.1	N1032	K1009-N1032 WeakPolarHBondContact CE-O 3.44Å; K1009-N1032 PolarHBondContact NZ-O 2.78Å
1010	L	78.9	Confident	71.7	Confident	13 Å²	13	53.9 Å²	53.9	7%	0.068	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-80.7	165.7	160.7	-70.4	176.1	0	0	0	109.7	T1036 N1051 Y1100 L1101 Y1105 V1118	L1010-T1036 HydrophobicContact CD1-CG2 4.16Å; L1010-T1036 HydrophobicContact CG-CG2 4.1Å; L1010-N1051 HydrophobicContact CD2-CB 4.04Å; L1010-Y1100 HydrophobicContact CB-CE1 4.15Å; L1010-Y1100 VanDerWaalsContact CB-OH 3.26Å; L1010-Y1100 WeakPolarHBondContact CB-OH 3.38Å; L1010-Y1100 HydrophobicContact CD1-CE1 4.16Å; L1010-Y1100 PolarHBondContact O-OH 3Å; L1010-L1101 HydrophobicContact CD1-CD2 3.71Å; L1010-Y1105 HydrophobicContact CD1-CD2 4.18Å; L1010-Y1105 HydrophobicContact CD1-CE2 3.71Å; L1010-Y1105 HydrophobicContact CD2-CD2 4.41Å; L1010-Y1105 HydrophobicContact CD2-CE1 4.33Å; L1010-Y1105 HydrophobicContact CD2-CE2 3.89Å; L1010-Y1105 HydrophobicContact CG-CE2 4.49Å; L1010-V1118 HydrophobicContact CD2-CB 4.06Å; L1010-V1118 HydrophobicContact CD2-CG1 4.03Å; L1010-V1118 HydrophobicContact CD2-CG2 4.15Å
1011	P	75.6	Confident	69.3	Low	9 Å²	9	63.3 Å²	63.3	6%	0.058	33%	0.331	C	S	.	.	P	Polyproline II helix	trans	-63.1	167.1	-179.5	-22.1	32.9	0	0	0	114.7	Y1100 L1108 H1121 Y1160	P1011-Y1100 PolarHBondContact O-OH 2.73Å; P1011-L1108 HydrophobicContact CG-CD1 3.95Å; P1011-L1108 HydrophobicContact CG-CD2 3.56Å; P1011-L1108 HydrophobicContact CG-CG 3.68Å; P1011-H1121 HydrophobicContact CG-CB 4.34Å; P1011-Y1160 HydrophobicContact CB-CD2 4.24Å; P1011-Y1160 HydrophobicContact CB-CE2 3.39Å; P1011-Y1160 HydrophobicContact CG-CE2 4.14Å
1012	E	72.5	Confident	66.9	Low	109 Å²	109	70.8 Å²	70.8	51%	0.509	37%	0.366	S	S	.	.	P	Polyproline II helix	trans	-76.3	154.2	175	-64.2	174.4	179	0	0	111.6	N1032 Y1160	E1012-N1032 PolarHBondContact OE1-ND2 3Å; E1012-Y1160 PolarHBondContact N-OH 3.41Å
1013	L	74.7	Confident	64.7	Low	46 Å²	46	72 Å²	72	24%	0.241	37%	0.371	C	S	.	.	P	Polyproline II helix	trans	-86.9	160.2	173	-66.5	-177.1	0	0	0	111.8	L1017 Y1100 L1103 I1158	L1013-L1017 HydrophobicContact CD1-CD1 4.43Å; L1013-Y1100 HydrophobicContact CD1-CD2 3.77Å; L1013-Y1100 HydrophobicContact CD2-CD2 3.89Å; L1013-Y1100 HydrophobicContact CD2-CE2 4.33Å; L1013-Y1100 HydrophobicContact CG-CD2 3.64Å; L1013-Y1100 HydrophobicContact CG-CE2 4.05Å; L1013-L1103 HydrophobicContact CD2-CB 3.66Å; L1013-L1103 HydrophobicContact CD2-CD1 4.26Å; L1013-I1158 VanDerWaalsContact O-CD1 3.23Å; L1013-I1158 WeakPolarHBondContact O-CD1 3.12Å
1014	S	71.4	Confident	62.6	Low	8 Å²	8	76 Å²	76	6%	0.056	40%	0.403	C	S	.	.	P	Polyproline II helix	trans	-60.6	135.8	174.5	175.7	0	0	0	0	112.1	Y1016 L1017 P1156 D1174	S1014-Y1016 PolarHBondContact O-N 2.82Å; S1014-Y1016 PolarHBondContact OG-N 3.24Å; S1014-L1017 VanDerWaalsContact O-CB 3.26Å; S1014-L1017 WeakPolarHBondContact O-CB 3.46Å; S1014-L1017 PolarHBondContact O-N 2.9Å; S1014-L1017 VanDerWaalsContact O-N 3.16Å; S1014-P1156 WeakPolarHBondContact CB-O 3.05Å; S1014-D1174 WeakPolarHBondContact CB-OD1 3.32Å; S1014-D1174 WeakPolarHBondContact CB-OD2 3.47Å; S1014-D1174 PolarHBondContact OG-OD1 2.78Å; S1014-D1174 PolarHBondContact OG-OD2 3.21Å
1015	S	69.3	Low	60.7	Low	112 Å²	112	79.8 Å²	79.8	78%	0.783	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-13.6	169.7	53	0	0	0	0	113.9
1016	Y	68.9	Low	58.8	Low	178 Å²	178	79.5 Å²	79.5	70%	0.698	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.9	-1.8	174.2	-57.8	-68.3	0	0	0	113.2	S1014 Q1018 D1174	S1014-Y1016 PolarHBondContact O-N 2.82Å; S1014-Y1016 PolarHBondContact OG-N 3.24Å; Y1016-Q1018 PolarHBondContact O-N 2.84Å; Y1016-D1174 HydrophobicContact CD2-CB 4.49Å; Y1016-D1174 VanDerWaalsContact CD2-OD2 3.31Å; Y1016-D1174 WeakPolarHBondContact CD2-OD2 3.44Å
1017	L	68.9	Low	56.8	Low	15 Å²	15	81.1 Å²	81.1	8%	0.079	43%	0.432	C	S	.	.	S	Bend	trans	-64.5	123.3	178.5	-164.6	133.9	0	0	0	109.4	L1013 S1014 L1019 L1103 D1155 P1156	L1013-L1017 HydrophobicContact CD1-CD1 4.43Å; S1014-L1017 VanDerWaalsContact O-CB 3.26Å; S1014-L1017 WeakPolarHBondContact O-CB 3.46Å; S1014-L1017 PolarHBondContact O-N 2.9Å; S1014-L1017 VanDerWaalsContact O-N 3.16Å; L1017-L1019 VanDerWaalsContact C-N 3.29Å; L1017-L1019 HydrophobicContact CD2-CD2 3.57Å; L1017-L1019 HydrophobicContact CD2-CG 3.88Å; L1017-L1019 PolarHBondContact O-N 3.48Å; L1017-L1103 HydrophobicContact CD1-CD1 3.38Å; L1017-D1155 HydrophobicContact CD1-CB 4.22Å; L1017-P1156 HydrophobicContact CB-CG 4.03Å
1018	Q	56.4	Low	54.6	Low	172 Å²	172	81 Å²	81	80%	0.804	43%	0.432	S	S	*	.			trans	-72.4	89.2	178.3	-66	-170	15.1	0	0	109.5	Y1016 R1099	Y1016-Q1018 PolarHBondContact O-N 2.84Å; Q1018-R1099 PolarHBondContact O-NH1 2.77Å; Q1018-R1099 PolarHBondContact O-NH2 3.29Å
1019	L	51.5	Low	52.7	Low	93 Å²	93	86.6 Å²	86.6	49%	0.487	47%	0.47	S	S	.	.			trans	-77.2	147.6	163	-64.2	172	0	0	0	109.1	L1017 K1021	L1017-L1019 VanDerWaalsContact C-N 3.29Å; L1017-L1019 HydrophobicContact CD2-CD2 3.57Å; L1017-L1019 HydrophobicContact CD2-CG 3.88Å; L1017-L1019 PolarHBondContact O-N 3.48Å; L1019-K1021 PolarHBondContact O-N 3.08Å
1020	P	43.1	Very low	50.8	Low	34 Å²	34	87.9 Å²	87.9	22%	0.221	48%	0.482	C	S	.	.			trans	-53.8	133.3	176.8	-26.5	35.9	0	0	0	112.3	Q1022 E1023 L1093	P1020-Q1022 PolarHBondContact O-N 2.89Å; P1020-E1023 PolarHBondContact O-N 2.69Å; P1020-L1093 HydrophobicContact CB-CD1 4Å; P1020-L1093 HydrophobicContact CG-CD1 4.43Å
1021	K	34.6	Very low	48.9	Very low	203 Å²	203	88.6 Å²	88.6	88%	0.883	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	0.1	-169.4	-77	-176	175.7	177.5	0	116.2	L1019 E1023	L1019-K1021 PolarHBondContact O-N 3.08Å; K1021-E1023 VanDerWaalsContact C-N 3.32Å
1022	Q	35.9	Very low	47.2	Very low	158 Å²	158	92.1 Å²	92.1	74%	0.738	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	1.2	173.9	-74.4	-175.3	-31.7	0	0	113.8	P1020	P1020-Q1022 PolarHBondContact O-N 2.89Å
1023	E	35.9	Very low	46.2	Very low	29 Å²	29	91.1 Å²	91.1	14%	0.136	50%	0.503	C	S	.	.	S	Bend	trans	-108.1	-13.6	-177.4	-74	172.1	88.4	0	0	116.1	P1020 K1021 T1025 A1026 Y1075	P1020-E1023 PolarHBondContact O-N 2.69Å; K1021-E1023 VanDerWaalsContact C-N 3.32Å; E1023-T1025 PolarHBondContact O-N 3.12Å; E1023-A1026 PolarHBondContact O-N 2.68Å; E1023-Y1075 VanDerWaalsContact CD-CD2 3.46Å; E1023-Y1075 HydrophobicContact CG-CD1 3.66Å; E1023-Y1075 HydrophobicContact CG-CD2 3.97Å; E1023-Y1075 HydrophobicContact CG-CE1 3.22Å; E1023-Y1075 HydrophobicContact CG-CE2 3.56Å; E1023-Y1075 HydrophobicContact CG-CG 4.01Å; E1023-Y1075 WeakPolarHBondContact CG-OH 3.26Å; E1023-Y1075 WeakPolarHBondContact OE1-CD2 3.47Å; E1023-Y1075 VanDerWaalsContact OE1-CE2 3.32Å; E1023-Y1075 WeakPolarHBondContact OE1-CE2 3.35Å; E1023-Y1075 WeakPolarHBondContact OE2-CE2 3.31Å; E1023-Y1075 PolarHBondContact OE2-OH 2.72Å
1024	A	31.4	Very low	45.7	Very low	85 Å²	85	92 Å²	92	70%	0.702	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-13.2	-166	0	0	0	0	0	115.4
1025	T	31.3	Very low	45.8	Very low	142 Å²	142	92.4 Å²	92.4	87%	0.871	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.1	5.5	-178.5	47.5	0	0	0	0	114.4	E1023	E1023-T1025 PolarHBondContact O-N 3.12Å
1026	A	33.8	Very low	46.4	Very low	21 Å²	21	87.1 Å²	87.1	17%	0.174	47%	0.472	C	S	.	.			trans	-113.8	11.6	-171	0	0	0	0	0	115.5	E1023 S1028	E1023-A1026 PolarHBondContact O-N 2.68Å; A1026-S1028 PolarHBondContact O-N 2.77Å
1027	V	29.6	Very low	47.4	Very low	120 Å²	120	78.7 Å²	78.7	73%	0.727	44%	0.439	S	S	*	.			trans	-82.4	83.9	-176.8	-170.3	0	0	0	0	111.4	A1031	V1027-A1031 HydrophobicContact CG1-CB 4.33Å
1028	S	30.3	Very low	48.4	Very low	60 Å²	60	78 Å²	78	42%	0.42	44%	0.436	S	S	.	.			trans	-82.2	157.1	163.6	58	0	0	0	0	111.3	A1026 D1030 A1031	A1026-S1028 PolarHBondContact O-N 2.77Å; S1028-D1030 PolarHBondContact O-N 3.41Å; S1028-A1031 WeakPolarHBondContact O-CB 3.48Å; S1028-A1031 PolarHBondContact O-N 2.9Å; S1028-A1031 VanDerWaalsContact O-N 3.09Å
1029	S	37.3	Very low	49.9	Very low	116 Å²	116	69.9 Å²	69.9	81%	0.811	40%	0.398	S	S	*	.	G	3₁₀ helix	trans	-62	-17.8	-168.2	46.3	0	0	0	0	116	A1031	S1029-A1031 PolarHBondContact O-N 3Å
1030	D	36.6	Very low	51.8	Low	123 Å²	123	65.5 Å²	65.5	66%	0.658	38%	0.375	S	S	*	.	G	3₁₀ helix	trans	-83.9	8.9	176.8	-69.1	-45.7	0	0	0	113.7	S1028 N1032 R1074	S1028-D1030 PolarHBondContact O-N 3.41Å; D1030-N1032 PolarHBondContact O-N 2.92Å; D1030-R1074 PolarHBondContact O-NH1 2.72Å; D1030-R1074 PolarHBondContact O-NH2 3.2Å
1031	A	37.2	Very low	53.9	Low	28 Å²	28	64.7 Å²	64.7	23%	0.231	37%	0.369	C	S	.	.	G	3₁₀ helix	trans	-53.4	-21.8	-179.9	0	0	0	0	0	115.4	V1027 S1028 S1029 Q1033 R1074	V1027-A1031 HydrophobicContact CG1-CB 4.33Å; S1028-A1031 WeakPolarHBondContact O-CB 3.48Å; S1028-A1031 PolarHBondContact O-N 2.9Å; S1028-A1031 VanDerWaalsContact O-N 3.09Å; S1029-A1031 PolarHBondContact O-N 3Å; A1031-Q1033 PolarHBondContact O-N 3.06Å; A1031-R1074 PolarHBondContact O-NH1 3.34Å
1032	N	40.9	Very low	56.5	Low	82 Å²	82	57.9 Å²	57.9	44%	0.439	35%	0.345	S	S	.	.			trans	-77.4	47.7	-172.1	-80	2.3	0	0	0	115.3	K1009 E1012 D1030	K1009-N1032 WeakPolarHBondContact CE-O 3.44Å; K1009-N1032 PolarHBondContact NZ-O 2.78Å; E1012-N1032 PolarHBondContact OE1-ND2 3Å; D1030-N1032 PolarHBondContact O-N 2.92Å
1033	Q	50.7	Low	58.9	Low	89 Å²	89	54.1 Å²	54.1	42%	0.416	33%	0.33	S	S	.	.			trans	-134	85.2	172.2	-70.7	-156.7	39.1	0	0	109.9	P1004 A1031	P1004-Q1033 HydrophobicContact CB-CB 3.94Å; A1031-Q1033 PolarHBondContact O-N 3.06Å
1034	M	64.8	Low	61.4	Low	64 Å²	64	55.9 Å²	55.9	32%	0.315	34%	0.336	S	S	.	.			trans	-95.6	149.9	173.6	-71.5	-79	172.8	0	0	110.7	A1073 Y1100	M1034-A1073 HydrophobicContact SD-CB 4.09Å; M1034-Y1100 HydrophobicContact CB-CD1 3.9Å; M1034-Y1100 HydrophobicContact CB-CD2 4.06Å; M1034-Y1100 HydrophobicContact CB-CE1 3.42Å; M1034-Y1100 VanDerWaalsContact CB-CE1 3.42Å; M1034-Y1100 HydrophobicContact CB-CE2 3.64Å; M1034-Y1100 HydrophobicContact CB-CG 4.21Å; M1034-Y1100 HydrophobicContact CG-CD2 3.89Å; M1034-Y1100 HydrophobicContact CG-CE1 4.29Å; M1034-Y1100 HydrophobicContact CG-CE2 3.6Å; M1034-Y1100 HydrophobicContact CG-CG 4.39Å; M1034-Y1100 HydrophobicContact SD-CD2 4.05Å; M1034-Y1100 HydrophobicContact SD-CE2 4.38Å; M1034-Y1100 HydrophobicContact SD-CG 4.32Å
1035	T	74.2	Confident	63.9	Low	16 Å²	16	54.3 Å²	54.3	10%	0.098	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	139.8	-174.9	-57.4	0	0	0	0	112.7	C1002 E1072 L1097	C1002-T1035 HydrophobicContact CB-CG2 4.24Å; T1035-E1072 PolarHBondContact OG1-O 3.2Å; T1035-L1097 HydrophobicContact CG2-CD1 3.88Å; T1035-L1097 HydrophobicContact CG2-CD2 4.11Å
1036	T	81.8	Confident	66.4	Low	1 Å²	1	49.8 Å²	49.8	1%	0.006	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	151.7	178.9	61.5	0	0	0	0	110.9	F1001 G1003 L1010 R1050 N1051	F1001-T1036 VanDerWaalsContact O-O 3.1Å; G1003-T1036 PolarHBondContact N-O 2.74Å; G1003-T1036 VanDerWaalsContact N-O 3.1Å; G1003-T1036 PolarHBondContact O-N 2.82Å; G1003-T1036 PolarHBondContact O-OG1 3.19Å; L1010-T1036 HydrophobicContact CD1-CG2 4.16Å; L1010-T1036 HydrophobicContact CG-CG2 4.1Å; T1036-R1050 PolarHBondContact O-NH2 2.94Å; T1036-R1050 PolarHBondContact OG1-NE 3.39Å; T1036-N1051 WeakPolarHBondContact CB-OD1 3.43Å; T1036-N1051 WeakPolarHBondContact CG2-OD1 3.42Å
1037	I	88.4	Confident	68.6	Low	2 Å²	2	49.9 Å²	49.9	1%	0.01	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	118.1	176.3	-55.6	-175.2	0	0	0	109.5	F1001 T1056 L1060 L1063 L1064 L1101 A1516	F1001-I1037 HydrophobicContact CB-CG2 4.33Å; F1001-I1037 CarbonylContact O-C 3.56Å; F1001-I1037 VanDerWaalsContact O-CA 3.31Å; F1001-I1037 WeakPolarHBondContact O-CA 3.42Å; I1037-T1056 HydrophobicContact CB-CG2 4.36Å; I1037-T1056 HydrophobicContact CD1-CG2 4.12Å; I1037-T1056 HydrophobicContact CG1-CG2 4.42Å; I1037-L1060 HydrophobicContact CD1-CB 3.75Å; I1037-L1063 HydrophobicContact CG2-CD1 4.01Å; I1037-L1064 HydrophobicContact CD1-CD1 4.16Å; I1037-L1101 HydrophobicContact CD1-CD1 3.83Å; I1037-L1101 HydrophobicContact CG1-CD1 4.04Å; I1037-A1516 HydrophobicContact CG2-CB 4.1Å
1038	A	89.8	Confident	70.7	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	28%	0.284	C	S	.	.	B	Isolated β-bridge	trans	-72.5	136.7	166.2	0	0	0	0	0	110.2	F1001 G1040 Y1044 A1516	F1001-A1038 PolarHBondContact O-N 2.94Å; A1038-G1040 VanDerWaalsContact C-N 3.32Å; A1038-G1040 PolarHBondContact O-N 3.02Å; A1038-Y1044 VanDerWaalsContact CB-O 3.31Å; A1038-Y1044 WeakPolarHBondContact CB-O 3.15Å; A1038-A1516 VanDerWaalsContact O-CB 3.29Å; A1038-A1516 WeakPolarHBondContact O-CB 3.42Å
1039	A	89.9	Confident	73.2	Confident	2 Å²	2	47 Å²	47	2%	0.017	28%	0.28	C	S	.	.	S	Bend	trans	-60.6	-42.8	173.6	0	0	0	0	0	111.7	Y1044 W1052 D1055 Q1515 A1516	A1039-Y1044 HydrophobicContact CB-CD2 3.96Å; A1039-Y1044 HydrophobicContact CB-CE2 4.49Å; A1039-Y1044 HydrophobicContact CB-CG 3.96Å; A1039-W1052 HydrophobicContact CB-CB 4.45Å; A1039-W1052 HydrophobicContact CB-CG 4.43Å; A1039-D1055 HydrophobicContact CB-CB 3.75Å; A1039-Q1515 PolarHBondContact O-NE2 2.74Å; A1039-Q1515 VanDerWaalsContact O-NE2 3.12Å; A1039-Q1515 PolarHBondContact O-OE1 3.01Å; A1039-A1516 WeakPolarHBondContact O-CB 3.39Å; A1039-A1516 PolarHBondContact O-N 3.19Å
1040	G	90.3	Very high	75.5	Confident	0 Å²	0	42 Å²	42	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-169.7	166.3	176.8	0	0	0	0	0	113.2	A1038 Y1044 A1514	A1038-G1040 VanDerWaalsContact C-N 3.32Å; A1038-G1040 PolarHBondContact O-N 3.02Å; G1040-Y1044 CarbonylContact O-C 3.49Å; G1040-Y1044 WeakPolarHBondContact O-CA 3.5Å; G1040-Y1044 WeakPolarHBondContact O-CB 3.26Å; G1040-Y1044 WeakPolarHBondContact O-CD2 3.13Å; G1040-Y1044 PolarHBondContact O-N 3.38Å; G1040-A1514 CarbonylContact C-O 3.56Å; G1040-A1514 WeakPolarHBondContact CA-O 3.34Å
1041	I	88.2	Confident	77.9	Confident	18 Å²	18	36.1 Å²	36.1	9%	0.092	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	139	-171.4	-57.1	178.4	0	0	0	108.3	I1000 F1001 W1494 C1512 P1513 A1514	I1000-I1041 HydrophobicContact CB-CD1 4.05Å; I1000-I1041 HydrophobicContact CD1-CD1 4.29Å; I1000-I1041 HydrophobicContact CG1-CD1 3.87Å; I1000-I1041 VanDerWaalsContact O-CD1 3.26Å; I1000-I1041 WeakPolarHBondContact O-CD1 3.39Å; F1001-I1041 HydrophobicContact CD1-CD1 4.16Å; F1001-I1041 HydrophobicContact CD1-CG1 4.22Å; F1001-I1041 HydrophobicContact CE1-CD1 4.35Å; F1001-I1041 HydrophobicContact CE1-CG1 4.28Å; I1041-W1494 HydrophobicContact CB-CZ3 4.34Å; I1041-W1494 HydrophobicContact CG2-CE3 4.12Å; I1041-W1494 HydrophobicContact CG2-CH2 3.92Å; I1041-W1494 HydrophobicContact CG2-CZ3 3.38Å; I1041-C1512 WeakPolarHBondContact O-CB 3.38Å; I1041-P1513 VanDerWaalsContact O-CD 3.31Å; I1041-P1513 WeakPolarHBondContact O-CD 2.93Å; I1041-A1514 HydrophobicContact CB-CB 4.34Å; I1041-A1514 PolarHBondContact N-O 3.41Å
1042	P	87.5	Confident	80.4	Confident	59 Å²	59	36.7 Å²	36.7	38%	0.383	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	cis	-83.9	-17.2	4.8	32.6	-35	0	0	0	115.6	Y1044 S1045	P1042-Y1044 VanDerWaalsContact C-N 3.31Å; P1042-Y1044 PolarHBondContact O-N 2.86Å; P1042-Y1044 VanDerWaalsContact O-N 3.16Å; P1042-S1045 VanDerWaalsContact O-CB 3.27Å; P1042-S1045 WeakPolarHBondContact O-CB 3.07Å; P1042-S1045 PolarHBondContact O-N 2.93Å; P1042-S1045 VanDerWaalsContact O-N 3.14Å; P1042-S1045 PolarHBondContact O-OG 2.9Å
1043	N	87	Confident	82.8	Confident	80 Å²	80	32.8 Å²	32.8	43%	0.428	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-26.3	-162.8	-59.1	-15.8	0	0	0	115.3
1044	Y	88.6	Confident	84.7	Confident	65 Å²	65	29.2 Å²	29.2	26%	0.255	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-114.5	20.9	-179.8	-45.6	-81.1	0	0	0	112.2	A1038 A1039 G1040 P1042 A1046 L1049 R1050 W1052 C1512	A1038-Y1044 VanDerWaalsContact CB-O 3.31Å; A1038-Y1044 WeakPolarHBondContact CB-O 3.15Å; A1039-Y1044 HydrophobicContact CB-CD2 3.96Å; A1039-Y1044 HydrophobicContact CB-CE2 4.49Å; A1039-Y1044 HydrophobicContact CB-CG 3.96Å; G1040-Y1044 CarbonylContact O-C 3.49Å; G1040-Y1044 WeakPolarHBondContact O-CA 3.5Å; G1040-Y1044 WeakPolarHBondContact O-CB 3.26Å; G1040-Y1044 WeakPolarHBondContact O-CD2 3.13Å; G1040-Y1044 PolarHBondContact O-N 3.38Å; P1042-Y1044 VanDerWaalsContact C-N 3.31Å; P1042-Y1044 PolarHBondContact O-N 2.86Å; P1042-Y1044 VanDerWaalsContact O-N 3.16Å; Y1044-A1046 PolarHBondContact O-N 3.24Å; Y1044-L1049 HydrophobicContact CD1-CB 4.14Å; Y1044-L1049 WeakPolarHBondContact CD1-O 3.17Å; Y1044-R1050 WeakPolarHBondContact O-CA 3.46Å; Y1044-R1050 WeakPolarHBondContact O-CD 3.05Å; Y1044-W1052 AromaticContact CD1-NE1 3.4Å; Y1044-W1052 AromaticContact CE1-CE2 3.95Å; Y1044-W1052 AromaticContact CE1-CZ2 3.99Å; Y1044-W1052 HydrophobicContact CE1-CZ2 3.99Å; Y1044-W1052 AromaticContact CE1-NE1 3.67Å; Y1044-C1512 VanDerWaalsContact CE2-SG 3.56Å
1045	S	84.1	Confident	86	Confident	53 Å²	53	27.1 Å²	27.1	37%	0.371	16%	0.16	S	C	.	.	S	Bend	trans	-65.8	-32.9	-178.3	54.7	0	0	0	0	114	P1042 R1050	P1042-S1045 VanDerWaalsContact O-CB 3.27Å; P1042-S1045 WeakPolarHBondContact O-CB 3.07Å; P1042-S1045 PolarHBondContact O-N 2.93Å; P1042-S1045 VanDerWaalsContact O-N 3.14Å; P1042-S1045 PolarHBondContact O-OG 2.9Å; S1045-R1050 WeakPolarHBondContact O-CD 3.41Å; S1045-R1050 PolarHBondContact O-NH1 3.29Å
1046	A	84.1	Confident	86.9	Confident	47 Å²	47	26.4 Å²	26.4	39%	0.388	16%	0.156	S	C	.	.	S	Bend	trans	-152.2	173.5	-171.1	0	0	0	0	0	114.4	V1005 Y1044	V1005-A1046 HydrophobicContact CG1-CB 4.26Å; Y1044-A1046 PolarHBondContact O-N 3.24Å
1047	G	79.7	Confident	87.5	Confident	22 Å²	22	26.8 Å²	26.8	23%	0.227	16%	0.157	C	C	.	.	G	3₁₀ helix	trans	65.6	-155	172.7	0	0	0	0	0	114.3	S1007 L1049 R1050	S1007-G1047 CarbonylContact O-C 3.45Å; S1007-G1047 VanDerWaalsContact O-CA 3.26Å; S1007-G1047 WeakPolarHBondContact O-CA 3.45Å; S1007-G1047 PolarHBondContact OG-N 2.86Å; G1047-L1049 PolarHBondContact O-N 3.39Å; G1047-R1050 WeakPolarHBondContact O-CB 3.3Å; G1047-R1050 PolarHBondContact O-N 3.31Å; G1047-R1050 VanDerWaalsContact O-N 3.07Å
1048	S	73.3	Confident	87.8	Confident	57 Å²	57	27 Å²	27	40%	0.399	16%	0.158	S	C	.	.	G	3₁₀ helix	trans	-60.5	-10.2	179.1	56.1	0	0	0	0	115.3	R1117 C1119	S1048-R1117 WeakPolarHBondContact O-CD 2.97Å; S1048-R1117 VanDerWaalsContact O-CG 3.3Å; S1048-R1117 WeakPolarHBondContact O-CG 3.3Å; S1048-R1117 PolarHBondContact O-NE 3.27Å; S1048-C1119 VanDerWaalsContact CB-SG 3.57Å
1049	L	82.4	Confident	88	Confident	64 Å²	64	27 Å²	27	34%	0.335	16%	0.158	S	C	.	.	G	3₁₀ helix	trans	-97.5	-9.3	179.5	-68.9	178.4	0	0	0	113.3	Y1044 G1047 W1052	Y1044-L1049 HydrophobicContact CD1-CB 4.14Å; Y1044-L1049 WeakPolarHBondContact CD1-O 3.17Å; G1047-L1049 PolarHBondContact O-N 3.39Å; L1049-W1052 PolarHBondContact O-NE1 3.38Å
1050	R	85.9	Confident	88.1	Confident	10 Å²	10	27 Å²	27	4%	0.038	16%	0.158	C	C	.	.	S	Bend	trans	-57.6	-55.9	-176.4	-179.6	65.9	177.8	-164.8	12.1	113.1	F1001 G1003 V1005 T1036 Y1044 S1045 G1047	F1001-R1050 PolarHBondContact O-NH2 3.46Å; G1003-R1050 PolarHBondContact O-NH2 3.29Å; V1005-R1050 VanDerWaalsContact CG2-CZ 3.45Å; T1036-R1050 PolarHBondContact O-NH2 2.94Å; T1036-R1050 PolarHBondContact OG1-NE 3.39Å; Y1044-R1050 WeakPolarHBondContact O-CA 3.46Å; Y1044-R1050 WeakPolarHBondContact O-CD 3.05Å; S1045-R1050 WeakPolarHBondContact O-CD 3.41Å; S1045-R1050 PolarHBondContact O-NH1 3.29Å; G1047-R1050 WeakPolarHBondContact O-CB 3.3Å; G1047-R1050 PolarHBondContact O-N 3.31Å; G1047-R1050 VanDerWaalsContact O-N 3.07Å
1051	N	87.8	Confident	88.1	Confident	0 Å²	0	28 Å²	28	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	109.5	-166.5	-62.4	-59.8	0	0	0	112.1	G1008 L1010 T1036 R1117 V1118	G1008-N1051 PolarHBondContact O-ND2 3.13Å; L1010-N1051 HydrophobicContact CD2-CB 4.04Å; T1036-N1051 WeakPolarHBondContact CB-OD1 3.43Å; T1036-N1051 WeakPolarHBondContact CG2-OD1 3.42Å; N1051-R1117 WeakPolarHBondContact O-CA 3.34Å; N1051-V1118 HydrophobicContact CB-CB 3.87Å; N1051-V1118 HydrophobicContact CB-CG2 4.47Å; N1051-V1118 PolarHBondContact O-N 3.5Å
1052	W	89.7	Confident	88.3	Confident	39 Å²	39	27.1 Å²	27.1	15%	0.148	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	119.9	169.9	-72.2	73.5	0	0	0	109.5	A1039 Y1044 L1049 R1054 D1055 T1056 T1116	A1039-W1052 HydrophobicContact CB-CB 4.45Å; A1039-W1052 HydrophobicContact CB-CG 4.43Å; Y1044-W1052 AromaticContact CD1-NE1 3.4Å; Y1044-W1052 AromaticContact CE1-CE2 3.95Å; Y1044-W1052 AromaticContact CE1-CZ2 3.99Å; Y1044-W1052 HydrophobicContact CE1-CZ2 3.99Å; Y1044-W1052 AromaticContact CE1-NE1 3.67Å; L1049-W1052 PolarHBondContact O-NE1 3.38Å; W1052-R1054 PolarHBondContact O-N 2.95Å; W1052-D1055 HydrophobicContact CB-CB 4.03Å; W1052-T1056 VanDerWaalsContact O-CB 3.28Å; W1052-T1056 WeakPolarHBondContact O-CB 3.33Å; W1052-T1056 PolarHBondContact O-N 3.22Å; W1052-T1056 PolarHBondContact O-OG1 2.81Å; W1052-T1116 WeakPolarHBondContact CA-O 3.21Å; W1052-T1116 HydrophobicContact CE3-CG2 4.06Å; W1052-T1116 HydrophobicContact CZ3-CG2 3.96Å
1053	S	90.6	Very high	88.5	Confident	0 Å²	0	24.3 Å²	24.3	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-58.3	-48.6	-175.5	50.9	0	0	0	0	112.1	T1056 F1057 P1115 T1116 S1131	S1053-T1056 WeakPolarHBondContact O-CB 3.1Å; S1053-T1056 PolarHBondContact O-N 2.98Å; S1053-F1057 WeakPolarHBondContact O-CD2 3.25Å; S1053-F1057 PolarHBondContact O-N 3.35Å; S1053-P1115 VanDerWaalsContact CB-O 3.27Å; S1053-P1115 WeakPolarHBondContact CB-O 3.38Å; S1053-P1115 PolarHBondContact OG-O 2.85Å; S1053-T1116 PolarHBondContact N-O 3.35Å; S1053-S1131 VanDerWaalsContact OG-CB 3.26Å; S1053-S1131 WeakPolarHBondContact OG-CB 3.2Å; S1053-S1131 PolarHBondContact OG-OG 2.66Å
1054	R	91.3	Very high	88.5	Confident	14 Å²	14	20.5 Å²	20.5	5%	0.053	12%	0.119	C	C	.	.	H	α-helix	trans	-60.8	-56.8	-176.5	-174	174.7	59.2	-140.3	-9.6	111.3	W1052 T1056 F1057 I1058 D1130 S1131 T1246 D1249	W1052-R1054 PolarHBondContact O-N 2.95Å; R1054-T1056 VanDerWaalsContact C-N 3.3Å; R1054-T1056 PolarHBondContact O-N 3.42Å; R1054-F1057 PolarHBondContact O-N 3.37Å; R1054-F1057 VanDerWaalsContact O-N 3.13Å; R1054-I1058 HydrophobicContact CG-CD1 3.8Å; R1054-I1058 WeakPolarHBondContact O-CG1 3.14Å; R1054-I1058 PolarHBondContact O-N 3.07Å; R1054-D1130 WeakPolarHBondContact CD-OD2 3.43Å; R1054-S1131 WeakPolarHBondContact CB-OG 3.28Å; R1054-S1131 PolarHBondContact N-OG 2.85Å; R1054-T1246 PolarHBondContact NH1-O 2.83Å; R1054-D1249 IonicContact CZ-OD2 2.8Å; R1054-D1249 VanDerWaalsContact CZ-OD2 3.23Å; R1054-D1249 IonicContact NH1-OD2 3.98Å; R1054-D1249 PolarHBondContact NH1-OD2 3.09Å; R1054-D1249 IonicContact NH2-OD2 2.75Å; R1054-D1249 PolarHBondContact NH2-OD2 2.75Å
1055	D	92.4	Very high	88.5	Confident	20 Å²	20	17.5 Å²	17.5	11%	0.107	11%	0.107	C	C	.	.	H	α-helix	trans	-61.6	-38.1	-179.8	-61	-115	0	0	0	111.6	A1039 W1052 A1059 Q1515 T1517	A1039-D1055 HydrophobicContact CB-CB 3.75Å; W1052-D1055 HydrophobicContact CB-CB 4.03Å; D1055-A1059 WeakPolarHBondContact O-CB 3.15Å; D1055-A1059 PolarHBondContact O-N 3.18Å; D1055-Q1515 PolarHBondContact OD1-NE2 3.27Å; D1055-T1517 HydrophobicContact CB-CG2 4.22Å
1056	T	92.1	Very high	88.9	Confident	2 Å²	2	15.1 Å²	15.1	1%	0.012	9%	0.09	C	C	.	.	H	α-helix	trans	-54.4	-58.7	170.1	-58	0	0	0	0	109.8	I1037 W1052 S1053 R1054 I1058 A1059 L1060 L1101 Y1105	I1037-T1056 HydrophobicContact CB-CG2 4.36Å; I1037-T1056 HydrophobicContact CD1-CG2 4.12Å; I1037-T1056 HydrophobicContact CG1-CG2 4.42Å; W1052-T1056 VanDerWaalsContact O-CB 3.28Å; W1052-T1056 WeakPolarHBondContact O-CB 3.33Å; W1052-T1056 PolarHBondContact O-N 3.22Å; W1052-T1056 PolarHBondContact O-OG1 2.81Å; S1053-T1056 WeakPolarHBondContact O-CB 3.1Å; S1053-T1056 PolarHBondContact O-N 2.98Å; R1054-T1056 VanDerWaalsContact C-N 3.3Å; R1054-T1056 PolarHBondContact O-N 3.42Å; T1056-I1058 PolarHBondContact O-N 3.33Å; T1056-A1059 PolarHBondContact O-N 2.9Å; T1056-L1060 VanDerWaalsContact O-CB 3.31Å; T1056-L1060 WeakPolarHBondContact O-CB 3.16Å; T1056-L1060 PolarHBondContact O-N 2.88Å; T1056-L1101 HydrophobicContact CG2-CD1 4.32Å; T1056-L1101 HydrophobicContact CG2-CD2 4.43Å; T1056-Y1105 HydrophobicContact CG2-CE2 4.14Å; T1056-Y1105 PolarHBondContact OG1-OH 3.17Å
1057	F	94.4	Very high	89.1	Confident	8 Å²	8	12.9 Å²	12.9	4%	0.035	7%	0.072	C	C	.	.	H	α-helix	trans	-75.6	-24.9	-171.6	-63.3	-55.3	0	0	0	115.1	S1053 R1054 L1060 Y1105 L1114 W1134 W1135 A1138	S1053-F1057 WeakPolarHBondContact O-CD2 3.25Å; S1053-F1057 PolarHBondContact O-N 3.35Å; R1054-F1057 PolarHBondContact O-N 3.37Å; R1054-F1057 VanDerWaalsContact O-N 3.13Å; F1057-L1060 HydrophobicContact CD1-CD1 4.08Å; F1057-L1060 HydrophobicContact CD1-CD2 4.5Å; F1057-L1060 HydrophobicContact CE1-CD1 4.28Å; F1057-Y1105 HydrophobicContact CE1-CD2 4.48Å; F1057-Y1105 HydrophobicContact CE2-CD1 4.25Å; F1057-Y1105 AromaticContact CE2-CD2 3.94Å; F1057-Y1105 HydrophobicContact CE2-CD2 3.94Å; F1057-Y1105 HydrophobicContact CE2-CE2 4.38Å; F1057-Y1105 AromaticContact CE2-CG 3.84Å; F1057-Y1105 HydrophobicContact CE2-CG 3.84Å; F1057-Y1105 AromaticContact CZ-CD2 3.46Å; F1057-Y1105 HydrophobicContact CZ-CD2 3.46Å; F1057-Y1105 VanDerWaalsContact CZ-CD2 3.46Å; F1057-Y1105 HydrophobicContact CZ-CE2 4.1Å; F1057-Y1105 AromaticContact CZ-CG 3.68Å; F1057-Y1105 HydrophobicContact CZ-CG 3.68Å; F1057-L1114 HydrophobicContact CE2-CD1 4Å; F1057-W1134 HydrophobicContact CB-CB 3.91Å; F1057-W1135 HydrophobicContact CD2-CB 3.69Å; F1057-W1135 HydrophobicContact CD2-CG 4.45Å; F1057-W1135 AromaticContact CE1-CD1 3.72Å; F1057-W1135 HydrophobicContact CE2-CB 3.82Å; F1057-W1135 AromaticContact CE2-CD1 3.77Å; F1057-W1135 HydrophobicContact CE2-CG 4.14Å; F1057-W1135 HydrophobicContact CG-CB 4.12Å; F1057-W1135 HydrophobicContact CZ-CB 4.32Å; F1057-W1135 AromaticContact CZ-CD1 3.43Å; F1057-W1135 VanDerWaalsContact CZ-CD1 3.43Å; F1057-W1135 HydrophobicContact CZ-CG 4.23Å; F1057-A1138 HydrophobicContact CB-CB 4.24Å; F1057-A1138 HydrophobicContact CD1-CB 3.73Å; F1057-A1138 HydrophobicContact CG-CB 4.3Å
1058	I	94.4	Very high	89.3	Confident	7 Å²	7	12.6 Å²	12.6	4%	0.036	7%	0.069	C	C	.	.	H	α-helix	trans	-68.2	-45.2	167.9	-66.7	170.3	0	0	0	109.9	R1054 T1056 W1134 W1449 T1517	R1054-I1058 HydrophobicContact CG-CD1 3.8Å; R1054-I1058 WeakPolarHBondContact O-CG1 3.14Å; R1054-I1058 PolarHBondContact O-N 3.07Å; T1056-I1058 PolarHBondContact O-N 3.33Å; I1058-W1134 HydrophobicContact CD1-CD2 4.21Å; I1058-W1134 HydrophobicContact CD1-CH2 4.44Å; I1058-W1134 HydrophobicContact CD1-CZ2 4Å; I1058-W1134 HydrophobicContact CG1-CD2 3.63Å; I1058-W1134 HydrophobicContact CG1-CE3 3.73Å; I1058-W1134 HydrophobicContact CG1-CG 4.15Å; I1058-W1134 HydrophobicContact CG1-CH2 4.12Å; I1058-W1134 HydrophobicContact CG1-CZ2 4.05Å; I1058-W1134 HydrophobicContact CG1-CZ3 3.98Å; I1058-W1449 HydrophobicContact CD1-CH2 4.29Å; I1058-W1449 HydrophobicContact CD1-CZ3 4.35Å; I1058-W1449 HydrophobicContact CG2-CE3 4.01Å; I1058-W1449 HydrophobicContact CG2-CZ3 4.2Å; I1058-T1517 HydrophobicContact CB-CG2 3.9Å; I1058-T1517 HydrophobicContact CG2-CG2 3.7Å
1059	A	94.5	Very high	89.6	Confident	0 Å²	0	10.5 Å²	10.5	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-76.6	-28.9	-174.3	0	0	0	0	0	114	D1055 T1056 R1061 G1062 L1063 A1516 T1517 A1520	D1055-A1059 WeakPolarHBondContact O-CB 3.15Å; D1055-A1059 PolarHBondContact O-N 3.18Å; T1056-A1059 PolarHBondContact O-N 2.9Å; A1059-R1061 VanDerWaalsContact C-N 3.32Å; A1059-R1061 PolarHBondContact O-N 2.76Å; A1059-G1062 PolarHBondContact O-N 3.09Å; A1059-L1063 HydrophobicContact CB-CD1 3.84Å; A1059-L1063 HydrophobicContact CB-CG 4.08Å; A1059-L1063 WeakPolarHBondContact O-CG 3.4Å; A1059-L1063 PolarHBondContact O-N 2.98Å; A1059-A1516 HydrophobicContact CB-CB 3.84Å; A1059-T1517 HydrophobicContact CB-CG2 4.16Å; A1059-A1520 VanDerWaalsContact CA-CB 3.47Å; A1059-A1520 HydrophobicContact CB-CB 3.95Å; A1059-A1520 WeakPolarHBondContact O-CB 3.35Å
1060	L	91.1	Very high	88.8	Confident	1 Å²	1	9 Å²	9	1%	0.005	4%	0.042	C	C	.	.	H	α-helix	trans	-70.7	-18.4	-161.9	115.4	-179.5	0	0	0	115.5	I1037 T1056 F1057 L1064 L1065 F1098 L1101 A1138	I1037-L1060 HydrophobicContact CD1-CB 3.75Å; T1056-L1060 VanDerWaalsContact O-CB 3.31Å; T1056-L1060 WeakPolarHBondContact O-CB 3.16Å; T1056-L1060 PolarHBondContact O-N 2.88Å; F1057-L1060 HydrophobicContact CD1-CD1 4.08Å; F1057-L1060 HydrophobicContact CD1-CD2 4.5Å; F1057-L1060 HydrophobicContact CE1-CD1 4.28Å; L1060-L1064 HydrophobicContact CB-CD1 4.3Å; L1060-L1064 WeakPolarHBondContact O-CB 3.31Å; L1060-L1064 PolarHBondContact O-N 2.99Å; L1060-L1064 VanDerWaalsContact O-N 3.11Å; L1060-L1065 PolarHBondContact O-N 2.94Å; L1060-F1098 HydrophobicContact CD1-CD1 4.34Å; L1060-F1098 HydrophobicContact CD1-CD2 3.87Å; L1060-F1098 HydrophobicContact CD1-CE1 4.14Å; L1060-F1098 HydrophobicContact CD1-CE2 3.68Å; L1060-F1098 HydrophobicContact CD1-CG 4.23Å; L1060-F1098 HydrophobicContact CD1-CZ 3.86Å; L1060-F1098 HydrophobicContact CD2-CD2 4.31Å; L1060-F1098 HydrophobicContact CD2-CE1 4.32Å; L1060-F1098 HydrophobicContact CD2-CE2 3.34Å; L1060-F1098 HydrophobicContact CD2-CZ 3.37Å; L1060-F1098 HydrophobicContact CG-CD2 3.69Å; L1060-F1098 HydrophobicContact CG-CE1 4.44Å; L1060-F1098 HydrophobicContact CG-CE2 3.2Å; L1060-F1098 HydrophobicContact CG-CZ 3.67Å; L1060-L1101 HydrophobicContact CD1-CB 4.35Å; L1060-L1101 HydrophobicContact CD1-CD1 4.02Å; L1060-A1138 HydrophobicContact CD2-CB 3.65Å
1061	R	91.6	Very high	87.5	Confident	22 Å²	22	10.9 Å²	10.9	8%	0.083	6%	0.055	C	C	.	.	I	π-helix	trans	-68.2	-53.2	170.6	174.2	175.3	-178.7	-104.9	0.6	110.2	A1059 L1065 I1066 M1145 E1524 D1528	A1059-R1061 VanDerWaalsContact C-N 3.32Å; A1059-R1061 PolarHBondContact O-N 2.76Å; R1061-L1065 HydrophobicContact CB-CD1 4.32Å; R1061-L1065 HydrophobicContact CG-CD1 4.32Å; R1061-L1065 PolarHBondContact O-N 3.45Å; R1061-I1066 HydrophobicContact CG-CD1 4.27Å; R1061-I1066 HydrophobicContact CG-CG1 4.46Å; R1061-I1066 PolarHBondContact O-N 3.48Å; R1061-M1145 HydrophobicContact CG-SD 4.33Å; R1061-E1524 WeakPolarHBondContact CB-OE1 3.34Å; R1061-E1524 WeakPolarHBondContact CD-OE2 3.36Å; R1061-E1524 HydrophobicContact CG-CG 4.2Å; R1061-E1524 IonicContact CZ-OE2 3.37Å; R1061-E1524 IonicContact NE-OE2 2.68Å; R1061-E1524 VanDerWaalsContact NH1-CG 3.3Å; R1061-E1524 IonicContact NH1-OE2 3.72Å; R1061-E1524 PolarHBondContact NH1-OE2 3.14Å; R1061-D1528 IonicContact NH2-OD1 3.74Å; R1061-D1528 PolarHBondContact NH2-OD1 3Å
1062	G	92.6	Very high	85.7	Confident	0 Å²	0	11.8 Å²	11.8	0%	0	6%	0.059	C	C	.	.	I	π-helix	trans	-68.4	-34.6	178.6	0	0	0	0	0	115	A1059 P1067 E1524	A1059-G1062 PolarHBondContact O-N 3.09Å; G1062-P1067 VanDerWaalsContact O-CD 3.26Å; G1062-P1067 WeakPolarHBondContact O-CD 3.49Å; G1062-P1067 WeakPolarHBondContact O-CG 3.23Å; G1062-E1524 PolarHBondContact N-OE1 2.96Å
1063	L	90.7	Very high	83.2	Confident	0 Å²	0	10.7 Å²	10.7	0%	0	6%	0.059	C	C	.	.	I	π-helix	trans	-81.8	-32.7	-180	-59	-173.7	0	0	0	114.2	F1001 I1037 A1059 P1067 R1069 A1516 I1519 A1520	F1001-L1063 HydrophobicContact CB-CD1 4.2Å; F1001-L1063 HydrophobicContact CD2-CD1 4.28Å; F1001-L1063 HydrophobicContact CD2-CD2 4.36Å; I1037-L1063 HydrophobicContact CG2-CD1 4.01Å; A1059-L1063 HydrophobicContact CB-CD1 3.84Å; A1059-L1063 HydrophobicContact CB-CG 4.08Å; A1059-L1063 WeakPolarHBondContact O-CG 3.4Å; A1059-L1063 PolarHBondContact O-N 2.98Å; L1063-P1067 WeakPolarHBondContact O-CG 3.3Å; L1063-R1069 PolarHBondContact O-NH1 2.88Å; L1063-A1516 HydrophobicContact CD1-CB 3.89Å; L1063-I1519 HydrophobicContact CD2-CB 4.26Å; L1063-I1519 HydrophobicContact CD2-CG2 3.87Å; L1063-A1520 HydrophobicContact CD2-CB 4.13Å; L1063-A1520 HydrophobicContact CG-CB 4.11Å
1064	L	87.9	Confident	80.6	Confident	0 Å²	0	13.6 Å²	13.6	0%	0	7%	0.069	C	C	.	.	I	π-helix	trans	-119.6	-51.3	-169.6	-56.7	178.8	0	0	0	114.1	I1037 L1060 G1068 R1069 L1097 F1098 L1101	I1037-L1064 HydrophobicContact CD1-CD1 4.16Å; L1060-L1064 HydrophobicContact CB-CD1 4.3Å; L1060-L1064 WeakPolarHBondContact O-CB 3.31Å; L1060-L1064 PolarHBondContact O-N 2.99Å; L1060-L1064 VanDerWaalsContact O-N 3.11Å; L1064-G1068 PolarHBondContact O-N 2.68Å; L1064-R1069 HydrophobicContact CD2-CB 4.12Å; L1064-R1069 PolarHBondContact O-N 2.81Å; L1064-L1097 HydrophobicContact CD1-CD2 3.61Å; L1064-L1097 HydrophobicContact CD1-CG 4.02Å; L1064-L1097 HydrophobicContact CD2-CD2 3.65Å; L1064-L1097 HydrophobicContact CG-CD2 4.28Å; L1064-F1098 HydrophobicContact CB-CD2 4.41Å; L1064-L1101 HydrophobicContact CD1-CD1 4.04Å
1065	L	88.7	Confident	77.8	Confident	2 Å²	2	17.2 Å²	17.2	1%	0.01	8%	0.084	C	C	.	.	I	π-helix	trans	-69.6	-52.1	-175.5	-63	175.6	0	0	0	112.2	L1060 R1061 G1068 Y1070 F1098 H1141 Y1142 M1145 V1146	L1060-L1065 PolarHBondContact O-N 2.94Å; R1061-L1065 HydrophobicContact CB-CD1 4.32Å; R1061-L1065 HydrophobicContact CG-CD1 4.32Å; R1061-L1065 PolarHBondContact O-N 3.45Å; L1065-G1068 PolarHBondContact O-N 3.13Å; L1065-Y1070 HydrophobicContact CD2-CD1 4.04Å; L1065-Y1070 HydrophobicContact CD2-CE1 3.68Å; L1065-F1098 HydrophobicContact CD1-CD2 4.38Å; L1065-F1098 HydrophobicContact CD1-CE2 3.47Å; L1065-F1098 VanDerWaalsContact CD1-CE2 3.47Å; L1065-F1098 HydrophobicContact CD1-CZ 3.82Å; L1065-F1098 HydrophobicContact CD2-CD2 3.49Å; L1065-F1098 VanDerWaalsContact CD2-CD2 3.49Å; L1065-F1098 HydrophobicContact CD2-CE2 3.43Å; L1065-F1098 VanDerWaalsContact CD2-CE2 3.43Å; L1065-F1098 HydrophobicContact CD2-CG 4.25Å; L1065-F1098 HydrophobicContact CD2-CZ 4.16Å; L1065-F1098 HydrophobicContact CG-CD2 3.77Å; L1065-F1098 HydrophobicContact CG-CE2 3.3Å; L1065-F1098 HydrophobicContact CG-CZ 4.13Å; L1065-H1141 HydrophobicContact CD1-CB 3.74Å; L1065-Y1142 HydrophobicContact CD2-CD2 4.36Å; L1065-M1145 HydrophobicContact CB-CE 3.83Å; L1065-M1145 HydrophobicContact CB-SD 3.84Å; L1065-M1145 HydrophobicContact CD1-CB 4.44Å; L1065-M1145 HydrophobicContact CD1-SD 3.84Å; L1065-M1145 HydrophobicContact CG-SD 4.46Å; L1065-V1146 HydrophobicContact CD2-CG2 3.66Å
1066	I	91.4	Very high	74.8	Confident	3 Å²	3	17.4 Å²	17.4	2%	0.015	9%	0.088	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-43.1	-178.3	-72.4	170.6	0	0	0	111.6	S981 F983 R1061 G1068 M1145 M1523 E1524 Y1527	S981-I1066 WeakPolarHBondContact CB-O 3.21Å; S981-I1066 PolarHBondContact OG-O 3.41Å; F983-I1066 HydrophobicContact CD1-CG2 3.48Å; F983-I1066 VanDerWaalsContact CD1-CG2 3.48Å; F983-I1066 HydrophobicContact CE1-CG2 3.52Å; R1061-I1066 HydrophobicContact CG-CD1 4.27Å; R1061-I1066 HydrophobicContact CG-CG1 4.46Å; R1061-I1066 PolarHBondContact O-N 3.48Å; I1066-G1068 PolarHBondContact O-N 3.35Å; I1066-M1145 HydrophobicContact CG1-CE 3.91Å; I1066-M1523 HydrophobicContact CB-CG 4.49Å; I1066-M1523 HydrophobicContact CG2-CG 3.89Å; I1066-M1523 HydrophobicContact CG2-SD 4.44Å; I1066-E1524 HydrophobicContact CD1-CB 4.19Å; I1066-E1524 HydrophobicContact CD1-CG 3.56Å; I1066-Y1527 HydrophobicContact CD1-CD1 4.06Å; I1066-Y1527 HydrophobicContact CD1-CD2 4.46Å; I1066-Y1527 HydrophobicContact CD1-CG 3.84Å; I1066-Y1527 HydrophobicContact CG1-CD1 4.25Å; I1066-Y1527 HydrophobicContact CG1-CD2 4.17Å; I1066-Y1527 HydrophobicContact CG1-CG 3.99Å; I1066-Y1527 HydrophobicContact CG2-CD2 3.75Å; I1066-Y1527 HydrophobicContact CG2-CE2 4.49Å; I1066-Y1527 HydrophobicContact CG2-CG 4.08Å
1067	P	88.7	Confident	71.7	Confident	0 Å²	0	25 Å²	25	0%	0	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-4.2	171.9	-24.7	38.7	0	0	0	115.4	M980 S981 V984 G1062 L1063 R1069	M980-P1067 CarbonylContact C-O 3.54Å; M980-P1067 VanDerWaalsContact CA-O 3.29Å; M980-P1067 WeakPolarHBondContact CA-O 3.32Å; M980-P1067 WeakPolarHBondContact CB-O 3.26Å; M980-P1067 HydrophobicContact SD-CB 3.99Å; S981-P1067 PolarHBondContact N-O 2.93Å; V984-P1067 HydrophobicContact CG2-CB 4.21Å; G1062-P1067 VanDerWaalsContact O-CD 3.26Å; G1062-P1067 WeakPolarHBondContact O-CD 3.49Å; G1062-P1067 WeakPolarHBondContact O-CG 3.23Å; L1063-P1067 WeakPolarHBondContact O-CG 3.3Å; P1067-R1069 VanDerWaalsContact C-N 3.26Å; P1067-R1069 HydrophobicContact CB-CG 3.99Å; P1067-R1069 PolarHBondContact O-N 2.88Å
1068	G	84	Confident	68.5	Low	16 Å²	16	32.8 Å²	32.8	17%	0.165	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.9	17.5	-178.5	0	0	0	0	0	114.8	L1064 L1065 I1066 Y1070	L1064-G1068 PolarHBondContact O-N 2.68Å; L1065-G1068 PolarHBondContact O-N 3.13Å; I1066-G1068 PolarHBondContact O-N 3.35Å; G1068-Y1070 WeakPolarHBondContact O-CD2 3.32Å; G1068-Y1070 PolarHBondContact O-N 2.73Å
1069	R	78.7	Confident	65.3	Low	13 Å²	13	34 Å²	34	5%	0.049	17%	0.173	C	C	.	.			trans	-79.4	53.1	-177.6	-67.6	166.4	61.6	-159.3	3	111.7	M980 S998 C1002 L1063 L1064 P1067 T1071 E1072	M980-R1069 HydrophobicContact CE-CG 4.48Å; S998-R1069 PolarHBondContact O-NH1 2.81Å; S998-R1069 PolarHBondContact OG-NH1 3.46Å; C1002-R1069 VanDerWaalsContact CB-NH2 3.31Å; L1063-R1069 PolarHBondContact O-NH1 2.88Å; L1064-R1069 HydrophobicContact CD2-CB 4.12Å; L1064-R1069 PolarHBondContact O-N 2.81Å; P1067-R1069 VanDerWaalsContact C-N 3.26Å; P1067-R1069 HydrophobicContact CB-CG 3.99Å; P1067-R1069 PolarHBondContact O-N 2.88Å; R1069-T1071 VanDerWaalsContact C-N 3.28Å; R1069-T1071 PolarHBondContact O-N 2.91Å; R1069-E1072 IonicContact CZ-OE1 2.7Å; R1069-E1072 VanDerWaalsContact CZ-OE1 3.29Å; R1069-E1072 IonicContact CZ-OE2 3.33Å; R1069-E1072 IonicContact NE-OE1 3.57Å; R1069-E1072 PolarHBondContact NE-OE1 2.75Å; R1069-E1072 IonicContact NE-OE2 2.73Å; R1069-E1072 IonicContact NH2-OE1 2.69Å; R1069-E1072 PolarHBondContact NH2-OE1 3.41Å; R1069-E1072 IonicContact NH2-OE2 3.7Å; R1069-E1072 PolarHBondContact NH2-OE2 3.46Å
1070	Y	67	Low	62	Low	31 Å²	31	44.1 Å²	44.1	12%	0.122	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73	-22.3	-179.5	-46.1	-60	0	0	0	112.9	L1065 G1068 L1094 C1096 L1097 M1145 V1146	L1065-Y1070 HydrophobicContact CD2-CD1 4.04Å; L1065-Y1070 HydrophobicContact CD2-CE1 3.68Å; G1068-Y1070 WeakPolarHBondContact O-CD2 3.32Å; G1068-Y1070 PolarHBondContact O-N 2.73Å; Y1070-L1094 WeakPolarHBondContact CB-O 3.35Å; Y1070-L1094 HydrophobicContact CD2-CD2 3.6Å; Y1070-L1094 HydrophobicContact CD2-CG 4.09Å; Y1070-L1094 HydrophobicContact CE2-CD2 4.08Å; Y1070-C1096 PolarHBondContact O-N 2.92Å; Y1070-C1096 VanDerWaalsContact O-N 3.13Å; Y1070-L1097 PolarHBondContact O-N 2.89Å; Y1070-M1145 PolarHBondContact OH-O 3.39Å; Y1070-V1146 HydrophobicContact CD1-CG2 3.82Å; Y1070-V1146 HydrophobicContact CE1-CG2 3.62Å
1071	T	58	Low	59	Low	50 Å²	50	48.6 Å²	48.6	31%	0.307	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.4	4.1	-164.5	48.4	0	0	0	0	116.1	R1069 A1073 L1094	R1069-T1071 VanDerWaalsContact C-N 3.28Å; R1069-T1071 PolarHBondContact O-N 2.91Å; T1071-A1073 PolarHBondContact O-N 3.06Å; T1071-L1094 HydrophobicContact CG2-CD1 3.74Å; T1071-L1094 HydrophobicContact CG2-CG 3.96Å
1072	E	50.4	Low	56	Low	19 Å²	19	57.8 Å²	57.8	9%	0.089	30%	0.296	C	S	.	.			trans	-74.7	38.9	-176.7	-88.5	177.3	-154.6	0	0	115.1	T880 T1035 R1069 L1097	T880-E1072 HydrophobicContact CG2-CG 3.76Å; T1035-E1072 PolarHBondContact OG1-O 3.2Å; R1069-E1072 IonicContact CZ-OE1 2.7Å; R1069-E1072 VanDerWaalsContact CZ-OE1 3.29Å; R1069-E1072 IonicContact CZ-OE2 3.33Å; R1069-E1072 IonicContact NE-OE1 3.57Å; R1069-E1072 PolarHBondContact NE-OE1 2.75Å; R1069-E1072 IonicContact NE-OE2 2.73Å; R1069-E1072 IonicContact NH2-OE1 2.69Å; R1069-E1072 PolarHBondContact NH2-OE1 3.41Å; R1069-E1072 IonicContact NH2-OE2 3.7Å; R1069-E1072 PolarHBondContact NH2-OE2 3.46Å; E1072-L1097 HydrophobicContact CB-CB 4.1Å; E1072-L1097 HydrophobicContact CB-CD2 3.51Å; E1072-L1097 HydrophobicContact CB-CG 4.31Å
1073	A	37.2	Very low	52.9	Low	17 Å²	17	63.2 Å²	63.2	14%	0.14	33%	0.333	C	S	.	.	S	Bend	trans	-120.2	151.4	161.1	0	0	0	0	0	110.1	M1034 T1071 C1096	M1034-A1073 HydrophobicContact SD-CB 4.09Å; T1071-A1073 PolarHBondContact O-N 3.06Å; A1073-C1096 HydrophobicContact CB-CB 3.67Å
1074	R	36	Very low	50	Low	61 Å²	61	71.6 Å²	71.6	23%	0.23	38%	0.377	C	S	.	.			trans	-73.6	129.2	-152.7	172.3	176.6	-179.1	176	-3.7	116	D1030 A1031 A1076	D1030-R1074 PolarHBondContact O-NH1 2.72Å; D1030-R1074 PolarHBondContact O-NH2 3.2Å; A1031-R1074 PolarHBondContact O-NH1 3.34Å; R1074-A1076 HydrophobicContact CG-CB 3.81Å
1075	Y	32.6	Very low	47.3	Very low	89 Å²	89	80.4 Å²	80.4	35%	0.349	42%	0.415	S	S	.	.			trans	-105.6	106.2	164.1	-113.5	-95.8	0	0	0	107.8	E1023	E1023-Y1075 VanDerWaalsContact CD-CD2 3.46Å; E1023-Y1075 HydrophobicContact CG-CD1 3.66Å; E1023-Y1075 HydrophobicContact CG-CD2 3.97Å; E1023-Y1075 HydrophobicContact CG-CE1 3.22Å; E1023-Y1075 HydrophobicContact CG-CE2 3.56Å; E1023-Y1075 HydrophobicContact CG-CG 4.01Å; E1023-Y1075 WeakPolarHBondContact CG-OH 3.26Å; E1023-Y1075 WeakPolarHBondContact OE1-CD2 3.47Å; E1023-Y1075 VanDerWaalsContact OE1-CE2 3.32Å; E1023-Y1075 WeakPolarHBondContact OE1-CE2 3.35Å; E1023-Y1075 WeakPolarHBondContact OE2-CE2 3.31Å; E1023-Y1075 PolarHBondContact OE2-OH 2.72Å
1076	A	29.1	Very low	44.7	Very low	25 Å²	25	86.6 Å²	86.6	21%	0.207	46%	0.456	C	S	.	.			trans	-111.3	32.7	-163.7	0	0	0	0	0	118	R1074	R1074-A1076 HydrophobicContact CG-CB 3.81Å
1077	Y	26.8	Very low	41.7	Very low	162 Å²	162	92.4 Å²	92.4	64%	0.635	49%	0.492	S	S	*	.			trans	-162	93.1	157.9	-148.7	-100.3	0	0	0	114.3	G1079	Y1077-G1079 WeakPolarHBondContact CE1-O 3.33Å
1078	L	26.9	Very low	39.1	Very low	171 Å²	171	98.1 Å²	98.1	90%	0.895	53%	0.532	S	S	*	.			trans	-120.6	56.4	162	-89.8	171.6	0	0	0	110.9
1079	G	26.8	Very low	36.6	Very low	33 Å²	33	107.6 Å²	107.6	34%	0.34	56%	0.564	S	S	.	*	S	Bend	trans	-119.6	99.6	171.4	0	0	0	0	0	111.4	Y1077	Y1077-G1079 WeakPolarHBondContact CE1-O 3.33Å
1080	K	26.7	Very low	34.3	Very low	211 Å²	211	110.6 Å²	110.6	92%	0.917	60%	0.599	S	S	*	*	S	Bend	trans	82.9	74.2	179.3	-52.5	175.4	178.9	176.1	0	117.5
1081	A	27.4	Very low	32.6	Very low	96 Å²	96	117.3 Å²	117.3	79%	0.793	64%	0.636	S	S	*	*			trans	-155.5	94	143.9	0	0	0	0	0	110.2
1082	F	28.3	Very low	31.3	Very low	215 Å²	215	121.6 Å²	121.6	94%	0.943	65%	0.653	S	S	*	*			trans	-74.8	154.7	172.3	-122.4	-99.4	0	0	0	110.5
1083	S	28	Very low	30.6	Very low	113 Å²	113	124.6 Å²	124.6	79%	0.79	67%	0.669	S	S	*	*			trans	74.2	92.6	172.2	-175.3	0	0	0	0	117.6
1084	L	28.8	Very low	30.7	Very low	177 Å²	177	127.8 Å²	127.8	93%	0.927	68%	0.683	S	S	*	*			trans	-152.5	142.9	137.4	-105.6	163.7	0	0	0	109.7
1085	K	31.4	Very low	31.2	Very low	184 Å²	184	126.3 Å²	126.3	80%	0.8	68%	0.68	S	S	*	*			trans	-76.1	150.4	-173.2	-73.8	178.8	176.1	178	0	112	T1087	K1085-T1087 PolarHBondContact O-N 3.16Å
1086	P	34.9	Very low	32.2	Very low	132 Å²	132	123 Å²	123	86%	0.857	67%	0.669	S	S	*	*			trans	-69.6	123.6	-179.8	29	-34.4	0	0	0	111.2
1087	T	28	Very low	33.5	Very low	125 Å²	125	121.8 Å²	121.8	77%	0.767	66%	0.66	S	S	*	*			trans	-107.5	150.6	167.9	45.3	0	0	0	0	110.5	K1085 Y1089	K1085-T1087 PolarHBondContact O-N 3.16Å; T1087-Y1089 VanDerWaalsContact C-N 3.28Å; T1087-Y1089 PolarHBondContact O-N 2.86Å
1088	S	34.8	Very low	35.4	Very low	120 Å²	120	114.1 Å²	114.1	84%	0.839	63%	0.629	S	S	*	*	S	Bend	trans	-80.9	42.8	-155.3	51.4	0	0	0	0	116.3
1089	Y	31.3	Very low	37.6	Very low	215 Å²	215	107.1 Å²	107.1	84%	0.843	59%	0.591	S	S	*	*			trans	-107.5	40.8	176.8	-78	-78.5	0	0	0	113.1	T1087 L1091	T1087-Y1089 VanDerWaalsContact C-N 3.28Å; T1087-Y1089 PolarHBondContact O-N 2.86Å; Y1089-L1091 PolarHBondContact O-N 3.06Å
1090	G	30.4	Very low	39.9	Very low	77 Å²	77	106 Å²	106	79%	0.794	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.2	11.1	-168.6	0	0	0	0	0	118.1
1091	L	31.3	Very low	42.7	Very low	172 Å²	172	96 Å²	96	90%	0.901	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.1	2.6	-168.5	-138.2	81.9	0	0	0	116.8	Y1089	Y1089-L1091 PolarHBondContact O-N 3.06Å
1092	Q	31.5	Very low	45.5	Very low	139 Å²	139	91.4 Å²	91.4	65%	0.65	50%	0.495	S	S	*	.	S	Bend	trans	-122.2	30.3	-171.1	-152.9	160.4	8.4	0	0	114.4
1093	L	35.3	Very low	48.3	Very low	83 Å²	83	81.4 Å²	81.4	44%	0.435	45%	0.452	S	S	.	.			trans	-118.7	26.9	-169	-144.8	84.5	0	0	0	115	P1020	P1020-L1093 HydrophobicContact CB-CD1 4Å; P1020-L1093 HydrophobicContact CG-CD1 4.43Å
1094	L	39.1	Very low	51.1	Low	83 Å²	83	76.1 Å²	76.1	44%	0.435	42%	0.415	S	S	.	.			trans	-119	22	-155.3	-140.1	77.6	0	0	0	117.3	Y1070 T1071	Y1070-L1094 WeakPolarHBondContact CB-O 3.35Å; Y1070-L1094 HydrophobicContact CD2-CD2 3.6Å; Y1070-L1094 HydrophobicContact CD2-CG 4.09Å; Y1070-L1094 HydrophobicContact CE2-CD2 4.08Å; T1071-L1094 HydrophobicContact CG2-CD1 3.74Å; T1071-L1094 HydrophobicContact CG2-CG 3.96Å
1095	L	45.9	Very low	53.9	Low	31 Å²	31	67.7 Å²	67.7	16%	0.162	37%	0.371	C	S	.	.			trans	-112.2	4.9	-156.6	-72.3	166.4	0	0	0	118.4	R1099 Y1142 V1146	L1095-R1099 WeakPolarHBondContact O-CB 3.06Å; L1095-R1099 WeakPolarHBondContact O-CD 3.08Å; L1095-Y1142 VanDerWaalsContact CD2-OH 3.24Å; L1095-Y1142 WeakPolarHBondContact CD2-OH 3.32Å; L1095-V1146 HydrophobicContact CD2-CG1 3.78Å
1096	C	53.9	Low	56.7	Low	18 Å²	18	59 Å²	59	12%	0.122	33%	0.333	C	S	.	.	H	α-helix	trans	-90.9	-36.1	-149.7	-51.3	0	0	0	0	118.7	Y1070 A1073 Y1100	Y1070-C1096 PolarHBondContact O-N 2.92Å; Y1070-C1096 VanDerWaalsContact O-N 3.13Å; A1073-C1096 HydrophobicContact CB-CB 3.67Å; C1096-Y1100 PolarHBondContact O-N 3.01Å
1097	L	56.9	Low	59	Low	1 Å²	1	52.7 Å²	52.7	1%	0.005	29%	0.292	C	S	.	.	H	α-helix	trans	-78.4	-54.5	-174.2	176.1	57	0	0	0	114.1	T1035 L1064 Y1070 E1072 R1099 Y1100 L1101	T1035-L1097 HydrophobicContact CG2-CD1 3.88Å; T1035-L1097 HydrophobicContact CG2-CD2 4.11Å; L1064-L1097 HydrophobicContact CD1-CD2 3.61Å; L1064-L1097 HydrophobicContact CD1-CG 4.02Å; L1064-L1097 HydrophobicContact CD2-CD2 3.65Å; L1064-L1097 HydrophobicContact CG-CD2 4.28Å; Y1070-L1097 PolarHBondContact O-N 2.89Å; E1072-L1097 HydrophobicContact CB-CB 4.1Å; E1072-L1097 HydrophobicContact CB-CD2 3.51Å; E1072-L1097 HydrophobicContact CB-CG 4.31Å; L1097-R1099 PolarHBondContact O-N 3.31Å; L1097-Y1100 WeakPolarHBondContact O-CA 3.41Å; L1097-Y1100 VanDerWaalsContact O-CB 3.29Å; L1097-Y1100 WeakPolarHBondContact O-CB 3.42Å; L1097-Y1100 PolarHBondContact O-N 3.22Å; L1097-L1101 HydrophobicContact CD1-CG 4.49Å; L1097-L1101 PolarHBondContact O-N 3.31Å
1098	F	67.1	Low	61.8	Low	1 Å²	1	46.9 Å²	46.9	0%	0.004	26%	0.256	C	S	.	.	H	α-helix	trans	-64.1	-37.3	-172.1	-166.6	-67.5	0	0	0	111	L1060 L1064 L1065 Y1100 L1101 I1102 A1138 Y1142	L1060-F1098 HydrophobicContact CD1-CD1 4.34Å; L1060-F1098 HydrophobicContact CD1-CD2 3.87Å; L1060-F1098 HydrophobicContact CD1-CE1 4.14Å; L1060-F1098 HydrophobicContact CD1-CE2 3.68Å; L1060-F1098 HydrophobicContact CD1-CG 4.23Å; L1060-F1098 HydrophobicContact CD1-CZ 3.86Å; L1060-F1098 HydrophobicContact CD2-CD2 4.31Å; L1060-F1098 HydrophobicContact CD2-CE1 4.32Å; L1060-F1098 HydrophobicContact CD2-CE2 3.34Å; L1060-F1098 HydrophobicContact CD2-CZ 3.37Å; L1060-F1098 HydrophobicContact CG-CD2 3.69Å; L1060-F1098 HydrophobicContact CG-CE1 4.44Å; L1060-F1098 HydrophobicContact CG-CE2 3.2Å; L1060-F1098 HydrophobicContact CG-CZ 3.67Å; L1064-F1098 HydrophobicContact CB-CD2 4.41Å; L1065-F1098 HydrophobicContact CD1-CD2 4.38Å; L1065-F1098 HydrophobicContact CD1-CE2 3.47Å; L1065-F1098 VanDerWaalsContact CD1-CE2 3.47Å; L1065-F1098 HydrophobicContact CD1-CZ 3.82Å; L1065-F1098 HydrophobicContact CD2-CD2 3.49Å; L1065-F1098 VanDerWaalsContact CD2-CD2 3.49Å; L1065-F1098 HydrophobicContact CD2-CE2 3.43Å; L1065-F1098 VanDerWaalsContact CD2-CE2 3.43Å; L1065-F1098 HydrophobicContact CD2-CG 4.25Å; L1065-F1098 HydrophobicContact CD2-CZ 4.16Å; L1065-F1098 HydrophobicContact CG-CD2 3.77Å; L1065-F1098 HydrophobicContact CG-CE2 3.3Å; L1065-F1098 HydrophobicContact CG-CZ 4.13Å; F1098-Y1100 PolarHBondContact O-N 3.07Å; F1098-L1101 PolarHBondContact O-N 2.95Å; F1098-I1102 HydrophobicContact CD1-CD1 3.67Å; F1098-I1102 HydrophobicContact CD1-CG1 4.13Å; F1098-I1102 HydrophobicContact CE1-CD1 3.4Å; F1098-I1102 VanDerWaalsContact CE1-CD1 3.4Å; F1098-I1102 HydrophobicContact CE1-CG1 3.99Å; F1098-I1102 PolarHBondContact O-N 3.15Å; F1098-I1102 VanDerWaalsContact O-N 3.07Å; F1098-A1138 WeakPolarHBondContact CE1-O 3.48Å; F1098-A1138 HydrophobicContact CZ-CB 4.31Å; F1098-A1138 WeakPolarHBondContact CZ-O 3.46Å; F1098-Y1142 HydrophobicContact CB-CD2 3.91Å; F1098-Y1142 HydrophobicContact CB-CE2 3.79Å; F1098-Y1142 AromaticContact CD1-CD2 3.13Å; F1098-Y1142 HydrophobicContact CD1-CD2 3.13Å; F1098-Y1142 AromaticContact CD1-CE2 3.79Å; F1098-Y1142 HydrophobicContact CD1-CE2 3.79Å; F1098-Y1142 AromaticContact CD1-CG 3.83Å; F1098-Y1142 HydrophobicContact CD1-CG 3.83Å; F1098-Y1142 HydrophobicContact CD2-CD2 4.31Å; F1098-Y1142 VanDerWaalsContact CE1-CB 3.5Å; F1098-Y1142 AromaticContact CE1-CD2 3.59Å; F1098-Y1142 HydrophobicContact CE1-CD2 3.59Å; F1098-Y1142 AromaticContact CE1-CG 3.88Å; F1098-Y1142 HydrophobicContact CE1-CG 3.88Å; F1098-Y1142 AromaticContact CG-CD2 3.55Å; F1098-Y1142 HydrophobicContact CG-CD2 3.55Å; F1098-Y1142 AromaticContact CG-CE2 3.98Å; F1098-Y1142 HydrophobicContact CG-CE2 3.98Å; F1098-Y1142 HydrophobicContact CZ-CD2 4.29Å
1099	R	72	Confident	64.2	Low	24 Å²	24	41.1 Å²	41.1	9%	0.091	22%	0.216	C	C	.	.	H	α-helix	trans	-54.3	-46.5	169.6	-166.9	173.5	-176.4	-160.4	1.2	111.4	Q1018 L1095 L1097 L1101 I1102 L1103 I1152 D1155	Q1018-R1099 PolarHBondContact O-NH1 2.77Å; Q1018-R1099 PolarHBondContact O-NH2 3.29Å; L1095-R1099 WeakPolarHBondContact O-CB 3.06Å; L1095-R1099 WeakPolarHBondContact O-CD 3.08Å; L1097-R1099 PolarHBondContact O-N 3.31Å; R1099-L1101 PolarHBondContact O-N 3.29Å; R1099-I1102 PolarHBondContact O-N 2.87Å; R1099-L1103 HydrophobicContact CG-CD1 3.8Å; R1099-L1103 WeakPolarHBondContact O-CB 3.2Å; R1099-L1103 WeakPolarHBondContact O-CD1 3.42Å; R1099-L1103 WeakPolarHBondContact O-CG 3.32Å; R1099-L1103 PolarHBondContact O-N 2.8Å; R1099-L1103 VanDerWaalsContact O-N 3.09Å; R1099-I1152 HydrophobicContact CG-CD1 4.37Å; R1099-I1152 HydrophobicContact CG-CG1 4.33Å; R1099-D1155 WeakPolarHBondContact CG-OD2 3.24Å; R1099-D1155 IonicContact CZ-OD1 3.55Å; R1099-D1155 IonicContact CZ-OD2 2.71Å; R1099-D1155 IonicContact NE-OD1 2.72Å; R1099-D1155 PolarHBondContact NE-OD1 3.25Å; R1099-D1155 IonicContact NE-OD2 3.46Å; R1099-D1155 PolarHBondContact NE-OD2 2.83Å; R1099-D1155 IonicContact NH2-OD1 2.97Å; R1099-D1155 PolarHBondContact NH2-OD1 3.13Å; R1099-D1155 IonicContact NH2-OD2 3.07Å
1100	Y	75.1	Confident	66.6	Low	10 Å²	10	33.5 Å²	33.5	4%	0.039	19%	0.187	C	C	.	.	H	α-helix	trans	-56.7	-50.3	174.5	175.3	-102.9	0	0	0	112.8	L1010 P1011 L1013 M1034 C1096 L1097 F1098 L1103 S1104	L1010-Y1100 HydrophobicContact CB-CE1 4.15Å; L1010-Y1100 VanDerWaalsContact CB-OH 3.26Å; L1010-Y1100 WeakPolarHBondContact CB-OH 3.38Å; L1010-Y1100 HydrophobicContact CD1-CE1 4.16Å; L1010-Y1100 PolarHBondContact O-OH 3Å; P1011-Y1100 PolarHBondContact O-OH 2.73Å; L1013-Y1100 HydrophobicContact CD1-CD2 3.77Å; L1013-Y1100 HydrophobicContact CD2-CD2 3.89Å; L1013-Y1100 HydrophobicContact CD2-CE2 4.33Å; L1013-Y1100 HydrophobicContact CG-CD2 3.64Å; L1013-Y1100 HydrophobicContact CG-CE2 4.05Å; M1034-Y1100 HydrophobicContact CB-CD1 3.9Å; M1034-Y1100 HydrophobicContact CB-CD2 4.06Å; M1034-Y1100 HydrophobicContact CB-CE1 3.42Å; M1034-Y1100 VanDerWaalsContact CB-CE1 3.42Å; M1034-Y1100 HydrophobicContact CB-CE2 3.64Å; M1034-Y1100 HydrophobicContact CB-CG 4.21Å; M1034-Y1100 HydrophobicContact CG-CD2 3.89Å; M1034-Y1100 HydrophobicContact CG-CE1 4.29Å; M1034-Y1100 HydrophobicContact CG-CE2 3.6Å; M1034-Y1100 HydrophobicContact CG-CG 4.39Å; M1034-Y1100 HydrophobicContact SD-CD2 4.05Å; M1034-Y1100 HydrophobicContact SD-CE2 4.38Å; M1034-Y1100 HydrophobicContact SD-CG 4.32Å; C1096-Y1100 PolarHBondContact O-N 3.01Å; L1097-Y1100 WeakPolarHBondContact O-CA 3.41Å; L1097-Y1100 VanDerWaalsContact O-CB 3.29Å; L1097-Y1100 WeakPolarHBondContact O-CB 3.42Å; L1097-Y1100 PolarHBondContact O-N 3.22Å; F1098-Y1100 PolarHBondContact O-N 3.07Å; Y1100-L1103 PolarHBondContact O-N 3.23Å; Y1100-S1104 WeakPolarHBondContact CD2-OG 3.32Å; Y1100-S1104 WeakPolarHBondContact CE2-OG 3.47Å; Y1100-S1104 VanDerWaalsContact CZ-OG 3.22Å; Y1100-S1104 WeakPolarHBondContact O-CB 3.35Å; Y1100-S1104 PolarHBondContact O-N 3.32Å; Y1100-S1104 PolarHBondContact O-OG 2.83Å
1101	L	84.8	Confident	68.8	Low	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-63.6	-44.8	-177.6	-68.4	172.5	0	0	0	111.9	L1010 I1037 T1056 L1060 L1064 L1097 F1098 R1099 Y1105	L1010-L1101 HydrophobicContact CD1-CD2 3.71Å; I1037-L1101 HydrophobicContact CD1-CD1 3.83Å; I1037-L1101 HydrophobicContact CG1-CD1 4.04Å; T1056-L1101 HydrophobicContact CG2-CD1 4.32Å; T1056-L1101 HydrophobicContact CG2-CD2 4.43Å; L1060-L1101 HydrophobicContact CD1-CB 4.35Å; L1060-L1101 HydrophobicContact CD1-CD1 4.02Å; L1064-L1101 HydrophobicContact CD1-CD1 4.04Å; L1097-L1101 HydrophobicContact CD1-CG 4.49Å; L1097-L1101 PolarHBondContact O-N 3.31Å; F1098-L1101 PolarHBondContact O-N 2.95Å; R1099-L1101 PolarHBondContact O-N 3.29Å; L1101-Y1105 WeakPolarHBondContact O-CD2 3.43Å; L1101-Y1105 PolarHBondContact O-N 3.48Å
1102	I	87.6	Confident	71.2	Confident	0 Å²	0	24 Å²	24	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-56.4	-54.8	175.4	-78.9	175.9	0	0	0	110.9	F1098 R1099 A1106 W1135 I1139 I1152 L1177	F1098-I1102 HydrophobicContact CD1-CD1 3.67Å; F1098-I1102 HydrophobicContact CD1-CG1 4.13Å; F1098-I1102 HydrophobicContact CE1-CD1 3.4Å; F1098-I1102 VanDerWaalsContact CE1-CD1 3.4Å; F1098-I1102 HydrophobicContact CE1-CG1 3.99Å; F1098-I1102 PolarHBondContact O-N 3.15Å; F1098-I1102 VanDerWaalsContact O-N 3.07Å; R1099-I1102 PolarHBondContact O-N 2.87Å; I1102-A1106 VanDerWaalsContact O-CB 3.29Å; I1102-A1106 WeakPolarHBondContact O-CB 3.41Å; I1102-A1106 PolarHBondContact O-N 3.39Å; I1102-W1135 HydrophobicContact CG2-CZ2 4.42Å; I1102-W1135 PolarHBondContact O-NE1 2.84Å; I1102-W1135 VanDerWaalsContact O-NE1 3.09Å; I1102-I1139 HydrophobicContact CD1-CB 4.14Å; I1102-I1139 HydrophobicContact CD1-CG1 3.52Å; I1102-I1139 HydrophobicContact CG1-CG1 3.99Å; I1102-I1139 HydrophobicContact CG2-CD1 4.38Å; I1102-I1139 HydrophobicContact CG2-CG1 3.97Å; I1102-I1152 HydrophobicContact CB-CD1 4.17Å; I1102-I1152 HydrophobicContact CD1-CD1 3.59Å; I1102-I1152 HydrophobicContact CG1-CD1 4.46Å; I1102-I1152 HydrophobicContact CG2-CD1 4.02Å; I1102-L1177 HydrophobicContact CG2-CD1 4.02Å; I1102-L1177 HydrophobicContact CG2-CD2 3.71Å
1103	L	87.3	Confident	73.7	Confident	5 Å²	5	17.6 Å²	17.6	3%	0.026	9%	0.09	C	C	.	.	H	α-helix	trans	-73	-35.3	-168	-61.3	170.2	0	0	0	111.8	L1013 L1017 R1099 Y1100 A1106 G1107 D1155 V1157 L1177	L1013-L1103 HydrophobicContact CD2-CB 3.66Å; L1013-L1103 HydrophobicContact CD2-CD1 4.26Å; L1017-L1103 HydrophobicContact CD1-CD1 3.38Å; R1099-L1103 HydrophobicContact CG-CD1 3.8Å; R1099-L1103 WeakPolarHBondContact O-CB 3.2Å; R1099-L1103 WeakPolarHBondContact O-CD1 3.42Å; R1099-L1103 WeakPolarHBondContact O-CG 3.32Å; R1099-L1103 PolarHBondContact O-N 2.8Å; R1099-L1103 VanDerWaalsContact O-N 3.09Å; Y1100-L1103 PolarHBondContact O-N 3.23Å; L1103-A1106 WeakPolarHBondContact O-CB 3.3Å; L1103-A1106 PolarHBondContact O-N 2.8Å; L1103-G1107 PolarHBondContact O-N 2.93Å; L1103-D1155 HydrophobicContact CD1-CB 3.81Å; L1103-D1155 HydrophobicContact CD2-CB 3.69Å; L1103-D1155 HydrophobicContact CG-CB 4.42Å; L1103-V1157 HydrophobicContact CD2-CG2 3.56Å; L1103-L1177 HydrophobicContact CD2-CB 4.11Å; L1103-L1177 HydrophobicContact CD2-CD1 4.28Å; L1103-L1177 HydrophobicContact CD2-CD2 4.12Å; L1103-L1177 HydrophobicContact CD2-CG 4.39Å
1104	S	85.2	Confident	76.2	Confident	2 Å²	2	13.7 Å²	13.7	1%	0.014	7%	0.069	C	C	.	.	H	α-helix	trans	-65.7	-43.9	177.6	-57.8	0	0	0	0	112.2	Y1100 G1107	Y1100-S1104 WeakPolarHBondContact CD2-OG 3.32Å; Y1100-S1104 WeakPolarHBondContact CE2-OG 3.47Å; Y1100-S1104 VanDerWaalsContact CZ-OG 3.22Å; Y1100-S1104 WeakPolarHBondContact O-CB 3.35Å; Y1100-S1104 PolarHBondContact O-N 3.32Å; Y1100-S1104 PolarHBondContact O-OG 2.83Å; S1104-G1107 PolarHBondContact O-N 3.16Å
1105	Y	88.9	Confident	78.3	Confident	0 Å²	0	9.8 Å²	9.8	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-70.3	-35.2	172.9	-83.3	-82.3	0	0	0	111.8	L1010 T1056 F1057 L1101 G1107 L1108 M1109 L1114 V1118	L1010-Y1105 HydrophobicContact CD1-CD2 4.18Å; L1010-Y1105 HydrophobicContact CD1-CE2 3.71Å; L1010-Y1105 HydrophobicContact CD2-CD2 4.41Å; L1010-Y1105 HydrophobicContact CD2-CE1 4.33Å; L1010-Y1105 HydrophobicContact CD2-CE2 3.89Å; L1010-Y1105 HydrophobicContact CG-CE2 4.49Å; T1056-Y1105 HydrophobicContact CG2-CE2 4.14Å; T1056-Y1105 PolarHBondContact OG1-OH 3.17Å; F1057-Y1105 HydrophobicContact CE1-CD2 4.48Å; F1057-Y1105 HydrophobicContact CE2-CD1 4.25Å; F1057-Y1105 AromaticContact CE2-CD2 3.94Å; F1057-Y1105 HydrophobicContact CE2-CD2 3.94Å; F1057-Y1105 HydrophobicContact CE2-CE2 4.38Å; F1057-Y1105 AromaticContact CE2-CG 3.84Å; F1057-Y1105 HydrophobicContact CE2-CG 3.84Å; F1057-Y1105 AromaticContact CZ-CD2 3.46Å; F1057-Y1105 HydrophobicContact CZ-CD2 3.46Å; F1057-Y1105 VanDerWaalsContact CZ-CD2 3.46Å; F1057-Y1105 HydrophobicContact CZ-CE2 4.1Å; F1057-Y1105 AromaticContact CZ-CG 3.68Å; F1057-Y1105 HydrophobicContact CZ-CG 3.68Å; L1101-Y1105 WeakPolarHBondContact O-CD2 3.43Å; L1101-Y1105 PolarHBondContact O-N 3.48Å; Y1105-G1107 PolarHBondContact O-N 3.47Å; Y1105-L1108 WeakPolarHBondContact O-CB 3.47Å; Y1105-L1108 PolarHBondContact O-N 3.31Å; Y1105-L1108 VanDerWaalsContact O-N 3.09Å; Y1105-M1109 PolarHBondContact O-N 3.16Å; Y1105-L1114 WeakPolarHBondContact O-CD2 3.28Å; Y1105-V1118 HydrophobicContact CD1-CG2 4.35Å; Y1105-V1118 HydrophobicContact CE1-CG2 3.69Å
1106	A	89.1	Confident	80.1	Confident	0 Å²	0	9 Å²	9	0%	0	5%	0.045	C	C	.	.	H	α-helix	trans	-57.1	-38.6	173.1	0	0	0	0	0	112	I1102 L1103 L1108 M1109 W1135 V1157 R1159 L1177 T1180	I1102-A1106 VanDerWaalsContact O-CB 3.29Å; I1102-A1106 WeakPolarHBondContact O-CB 3.41Å; I1102-A1106 PolarHBondContact O-N 3.39Å; L1103-A1106 WeakPolarHBondContact O-CB 3.3Å; L1103-A1106 PolarHBondContact O-N 2.8Å; A1106-L1108 VanDerWaalsContact C-N 3.3Å; A1106-L1108 PolarHBondContact O-N 2.83Å; A1106-M1109 WeakPolarHBondContact O-CB 3.47Å; A1106-M1109 PolarHBondContact O-N 3.3Å; A1106-M1109 VanDerWaalsContact O-N 3.15Å; A1106-W1135 HydrophobicContact CB-CH2 4.42Å; A1106-W1135 HydrophobicContact CB-CZ2 3.58Å; A1106-V1157 HydrophobicContact CB-CG1 3.66Å; A1106-V1157 HydrophobicContact CB-CG2 4.05Å; A1106-R1159 PolarHBondContact O-NE 3.13Å; A1106-L1177 HydrophobicContact CB-CD1 4.12Å; A1106-T1180 HydrophobicContact CB-CG2 3.97Å
1107	G	84.4	Confident	81.4	Confident	1 Å²	1	10.2 Å²	10.2	1%	0.01	5%	0.047	C	C	.	.	H	α-helix	trans	-63.3	-31.4	176	0	0	0	0	0	114.6	L1103 S1104 Y1105 M1109 I1158 Y1160	L1103-G1107 PolarHBondContact O-N 2.93Å; S1104-G1107 PolarHBondContact O-N 3.16Å; Y1105-G1107 PolarHBondContact O-N 3.47Å; G1107-M1109 VanDerWaalsContact C-N 3.32Å; G1107-I1158 WeakPolarHBondContact CA-O 3.33Å; G1107-Y1160 PolarHBondContact O-N 3.26Å
1108	L	85.9	Confident	82.3	Confident	2 Å²	2	10.2 Å²	10.2	1%	0.01	5%	0.047	C	C	.	.	H	α-helix	trans	-80.7	-9.4	176	-62.8	175.3	0	0	0	113.8	P1011 Y1105 A1106 K1110 P1115 V1118 H1121	P1011-L1108 HydrophobicContact CG-CD1 3.95Å; P1011-L1108 HydrophobicContact CG-CD2 3.56Å; P1011-L1108 HydrophobicContact CG-CG 3.68Å; Y1105-L1108 WeakPolarHBondContact O-CB 3.47Å; Y1105-L1108 PolarHBondContact O-N 3.31Å; Y1105-L1108 VanDerWaalsContact O-N 3.09Å; A1106-L1108 VanDerWaalsContact C-N 3.3Å; A1106-L1108 PolarHBondContact O-N 2.83Å; L1108-K1110 PolarHBondContact O-N 3.12Å; L1108-P1115 HydrophobicContact CB-CG 3.92Å; L1108-P1115 HydrophobicContact CD1-CG 3.94Å; L1108-V1118 HydrophobicContact CD1-CB 4.31Å; L1108-V1118 HydrophobicContact CD1-CG1 3.73Å; L1108-V1118 HydrophobicContact CD1-CG2 3.53Å; L1108-H1121 HydrophobicContact CD2-CB 4.08Å
1109	M	86.1	Confident	82.2	Confident	0 Å²	0	11.4 Å²	11.4	0%	0	6%	0.055	C	C	.	.			trans	-60.7	129.6	-175.7	-172.3	-169	-69.2	0	0	111.7	Y1105 A1106 G1107 M1113 L1114 V1132 W1135 R1159 C1161 T1180 A1184	Y1105-M1109 PolarHBondContact O-N 3.16Å; A1106-M1109 WeakPolarHBondContact O-CB 3.47Å; A1106-M1109 PolarHBondContact O-N 3.3Å; A1106-M1109 VanDerWaalsContact O-N 3.15Å; G1107-M1109 VanDerWaalsContact C-N 3.32Å; M1109-M1113 WeakPolarHBondContact CA-O 3.27Å; M1109-L1114 HydrophobicContact CB-CD2 3.9Å; M1109-L1114 HydrophobicContact CE-CD2 4.36Å; M1109-L1114 HydrophobicContact CG-CD2 4.25Å; M1109-V1132 HydrophobicContact CE-CG2 4.45Å; M1109-W1135 HydrophobicContact CE-CE3 3.91Å; M1109-W1135 HydrophobicContact CE-CH2 3.47Å; M1109-W1135 VanDerWaalsContact CE-CH2 3.47Å; M1109-W1135 HydrophobicContact CE-CZ2 4.25Å; M1109-W1135 HydrophobicContact CE-CZ3 3.26Å; M1109-R1159 PolarHBondContact O-NH2 3.05Å; M1109-C1161 WeakPolarHBondContact O-CB 3.38Å; M1109-T1180 HydrophobicContact CB-CG2 4.49Å; M1109-T1180 HydrophobicContact CE-CG2 3.66Å; M1109-T1180 HydrophobicContact SD-CG2 3.87Å; M1109-A1184 HydrophobicContact CE-CB 3.63Å; M1109-A1184 HydrophobicContact SD-CB 3.46Å; M1109-A1184 WeakPolarHBondContact SD-CB 3.25Å
1110	K	80.2	Confident	81.6	Confident	54 Å²	54	13.3 Å²	13.3	24%	0.235	7%	0.067	C	C	.	.	B	Isolated β-bridge	trans	-136.9	126.4	-177.2	-171.7	170.6	-178.1	164.3	0	110.2	L1108 G1112 M1113 F1126 C1161 F1196	L1108-K1110 PolarHBondContact O-N 3.12Å; K1110-G1112 PolarHBondContact O-N 2.8Å; K1110-G1112 VanDerWaalsContact O-N 3.16Å; K1110-M1113 PolarHBondContact N-O 3.37Å; K1110-M1113 PolarHBondContact O-N 3.15Å; K1110-F1126 HydrophobicContact CB-CE1 3.8Å; K1110-F1126 HydrophobicContact CB-CZ 3.69Å; K1110-F1126 HydrophobicContact CD-CE2 4.28Å; K1110-F1126 HydrophobicContact CD-CZ 4.2Å; K1110-C1161 HydrophobicContact CB-CB 3.8Å; K1110-C1161 HydrophobicContact CD-CB 4.24Å; K1110-C1161 HydrophobicContact CG-CB 4.07Å; K1110-F1196 HydrophobicContact CD-CE1 4.36Å
1111	N	77.5	Confident	80.7	Confident	49 Å²	49	17.4 Å²	17.4	26%	0.262	9%	0.086	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.4	34.4	-178.1	-61.5	-34.9	0	0	0	113.8	M1113 T1187 V1194	N1111-M1113 VanDerWaalsContact C-N 3.31Å; N1111-M1113 PolarHBondContact O-N 3.26Å; N1111-T1187 VanDerWaalsContact O-CG2 3.3Å; N1111-T1187 WeakPolarHBondContact O-CG2 3.31Å; N1111-V1194 HydrophobicContact CB-CG1 4.04Å; N1111-V1194 HydrophobicContact CB-CG2 4.41Å; N1111-V1194 WeakPolarHBondContact ND2-CG1 3.29Å
1112	G	81.6	Confident	79.3	Confident	0 Å²	0	21.4 Å²	21.4	0%	0	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.1	15.7	-177.9	0	0	0	0	0	115.9	K1110	K1110-G1112 PolarHBondContact O-N 2.8Å; K1110-G1112 VanDerWaalsContact O-N 3.16Å
1113	M	84.1	Confident	78.1	Confident	6 Å²	6	22.9 Å²	22.9	3%	0.03	12%	0.122	C	C	.	.	B	Isolated β-bridge	trans	-120.5	154.3	170.7	-63.5	-164.2	-58.3	0	0	111.6	M1109 K1110 N1111 F1126 R1129 F1196 V1225	M1109-M1113 WeakPolarHBondContact CA-O 3.27Å; K1110-M1113 PolarHBondContact N-O 3.37Å; K1110-M1113 PolarHBondContact O-N 3.15Å; N1111-M1113 VanDerWaalsContact C-N 3.31Å; N1111-M1113 PolarHBondContact O-N 3.26Å; M1113-F1126 HydrophobicContact CB-CD1 4.45Å; M1113-R1129 HydrophobicContact SD-CB 4.46Å; M1113-F1196 HydrophobicContact CE-CD2 4.16Å; M1113-F1196 HydrophobicContact CE-CE2 3.27Å; M1113-F1196 HydrophobicContact CE-CZ 3.83Å; M1113-V1225 HydrophobicContact CE-CB 4.19Å; M1113-V1225 HydrophobicContact CE-CG1 4.03Å; M1113-V1225 HydrophobicContact SD-CG1 3.85Å
1114	L	87.8	Confident	77.3	Confident	1 Å²	1	23 Å²	23	1%	0.005	12%	0.123	C	C	.	.			trans	-96.3	151.9	169.7	-66.8	-177	0	0	0	110.5	F1057 Y1105 M1109 V1132 W1135	F1057-L1114 HydrophobicContact CE2-CD1 4Å; Y1105-L1114 WeakPolarHBondContact O-CD2 3.28Å; M1109-L1114 HydrophobicContact CB-CD2 3.9Å; M1109-L1114 HydrophobicContact CE-CD2 4.36Å; M1109-L1114 HydrophobicContact CG-CD2 4.25Å; L1114-V1132 HydrophobicContact CG-CB 4.44Å; L1114-W1135 HydrophobicContact CD1-CB 3.42Å; L1114-W1135 VanDerWaalsContact CD1-CB 3.42Å; L1114-W1135 HydrophobicContact CD1-CD2 4.06Å; L1114-W1135 HydrophobicContact CD1-CG 3.59Å
1115	P	84	Confident	76.8	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.135	C	C	.	.			trans	-72.8	129.6	174.4	30	-34.4	0	0	0	110.9	S1053 L1108 R1117 V1118 A1124 R1125 F1126	S1053-P1115 VanDerWaalsContact CB-O 3.27Å; S1053-P1115 WeakPolarHBondContact CB-O 3.38Å; S1053-P1115 PolarHBondContact OG-O 2.85Å; L1108-P1115 HydrophobicContact CB-CG 3.92Å; L1108-P1115 HydrophobicContact CD1-CG 3.94Å; P1115-R1117 PolarHBondContact O-N 2.87Å; P1115-V1118 HydrophobicContact CB-CG2 4.42Å; P1115-V1118 HydrophobicContact CG-CG2 3.77Å; P1115-A1124 HydrophobicContact CB-CB 3.71Å; P1115-A1124 HydrophobicContact CG-CB 4.08Å; P1115-R1125 CarbonylContact C-O 3.5Å; P1115-R1125 VanDerWaalsContact CA-O 3.27Å; P1115-R1125 WeakPolarHBondContact CA-O 3.45Å; P1115-R1125 WeakPolarHBondContact CB-O 3.24Å; P1115-F1126 HydrophobicContact CB-CD1 4.23Å; P1115-F1126 HydrophobicContact CB-CD2 4.43Å; P1115-F1126 HydrophobicContact CB-CE1 3.99Å; P1115-F1126 HydrophobicContact CB-CE2 4.19Å; P1115-F1126 HydrophobicContact CB-CG 4.44Å; P1115-F1126 HydrophobicContact CB-CZ 3.96Å; P1115-F1126 HydrophobicContact CG-CE1 4.4Å; P1115-F1126 HydrophobicContact CG-CZ 4.36Å
1116	T	82.5	Confident	76.2	Confident	16 Å²	16	26.8 Å²	26.8	10%	0.098	14%	0.137	C	C	.	.	S	Bend	trans	-53.4	-40	173.5	-44.6	0	0	0	0	111.9	W1052 S1053 R1125 G1127 C1128	W1052-T1116 WeakPolarHBondContact CA-O 3.21Å; W1052-T1116 HydrophobicContact CE3-CG2 4.06Å; W1052-T1116 HydrophobicContact CZ3-CG2 3.96Å; S1053-T1116 PolarHBondContact N-O 3.35Å; T1116-R1125 PolarHBondContact N-O 3.22Å; T1116-G1127 PolarHBondContact OG1-N 3.4Å; T1116-C1128 VanDerWaalsContact CA-SG 3.54Å; T1116-C1128 HydrophobicContact CG2-CB 4.15Å; T1116-C1128 WeakPolarHBondContact OG1-CB 3.44Å; T1116-C1128 PolarHBondContact OG1-N 3.16Å; T1116-C1128 PolarHBondContact OG1-SG 3.44Å
1117	R	80.8	Confident	75.4	Confident	43 Å²	43	28.2 Å²	28.2	16%	0.162	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	133.1	-177.4	-162.6	178.9	80.1	-175.6	6.6	111.4	S1048 N1051 P1115 R1125	S1048-R1117 WeakPolarHBondContact O-CD 2.97Å; S1048-R1117 VanDerWaalsContact O-CG 3.3Å; S1048-R1117 WeakPolarHBondContact O-CG 3.3Å; S1048-R1117 PolarHBondContact O-NE 3.27Å; N1051-R1117 WeakPolarHBondContact O-CA 3.34Å; P1115-R1117 PolarHBondContact O-N 2.87Å; R1117-R1125 PolarHBondContact N-O 2.77Å; R1117-R1125 PolarHBondContact O-N 2.87Å
1118	V	77.2	Confident	75.3	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	114.4	179	-170.6	0	0	0	0	109.7	L1010 N1051 Y1105 L1108 P1115	L1010-V1118 HydrophobicContact CD2-CB 4.06Å; L1010-V1118 HydrophobicContact CD2-CG1 4.03Å; L1010-V1118 HydrophobicContact CD2-CG2 4.15Å; N1051-V1118 HydrophobicContact CB-CB 3.87Å; N1051-V1118 HydrophobicContact CB-CG2 4.47Å; N1051-V1118 PolarHBondContact O-N 3.5Å; Y1105-V1118 HydrophobicContact CD1-CG2 4.35Å; Y1105-V1118 HydrophobicContact CE1-CG2 3.69Å; L1108-V1118 HydrophobicContact CD1-CB 4.31Å; L1108-V1118 HydrophobicContact CD1-CG1 3.73Å; L1108-V1118 HydrophobicContact CD1-CG2 3.53Å; P1115-V1118 HydrophobicContact CB-CG2 4.42Å; P1115-V1118 HydrophobicContact CG-CG2 3.77Å
1119	C	64.8	Low	75.4	Confident	26 Å²	26	28.7 Å²	28.7	18%	0.176	15%	0.154	C	C	.	.	S	Bend	trans	-100.4	-50.5	173.6	-31.7	0	0	0	0	109.4	S1048 S1123	S1048-C1119 VanDerWaalsContact CB-SG 3.57Å; C1119-S1123 WeakPolarHBondContact CB-OG 3.33Å
1120	D	59.7	Low	75.6	Confident	64 Å²	64	28.7 Å²	28.7	34%	0.342	15%	0.154	S	C	.	.	S	Bend	trans	-146.1	174.9	162.9	64.4	69.9	0	0	0	109	T1122 S1123 A1124	D1120-T1122 PolarHBondContact O-N 3.39Å; D1120-T1122 VanDerWaalsContact OD1-CA 3.24Å; D1120-T1122 WeakPolarHBondContact OD1-CA 3.35Å; D1120-T1122 VanDerWaalsContact OD1-CB 3.27Å; D1120-T1122 WeakPolarHBondContact OD1-CB 3.08Å; D1120-T1122 PolarHBondContact OD1-N 3.14Å; D1120-T1122 PolarHBondContact OD1-OG1 3.48Å; D1120-S1123 PolarHBondContact N-OG 3.15Å; D1120-S1123 PolarHBondContact O-N 2.76Å; D1120-S1123 PolarHBondContact OD1-N 2.99Å; D1120-S1123 PolarHBondContact OD1-OG 2.64Å; D1120-S1123 WeakPolarHBondContact OD2-CB 3.29Å; D1120-S1123 PolarHBondContact OD2-OG 2.96Å; D1120-A1124 PolarHBondContact O-N 2.91Å
1121	H	54.5	Low	76.1	Confident	96 Å²	96	26.1 Å²	26.1	44%	0.444	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-13.2	-177.4	65.9	-94.4	0	0	0	114.5	P1011 L1108 Y1160	P1011-H1121 HydrophobicContact CG-CB 4.34Å; L1108-H1121 HydrophobicContact CD2-CB 4.08Å; H1121-Y1160 HydrophobicContact CB-CD1 4.36Å
1122	T	56.3	Low	76.9	Confident	85 Å²	85	23.9 Å²	23.9	52%	0.521	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.9	-31.1	177.6	78.5	0	0	0	0	113.1	D1120 Q1199	D1120-T1122 PolarHBondContact O-N 3.39Å; D1120-T1122 VanDerWaalsContact OD1-CA 3.24Å; D1120-T1122 WeakPolarHBondContact OD1-CA 3.35Å; D1120-T1122 VanDerWaalsContact OD1-CB 3.27Å; D1120-T1122 WeakPolarHBondContact OD1-CB 3.08Å; D1120-T1122 PolarHBondContact OD1-N 3.14Å; D1120-T1122 PolarHBondContact OD1-OG1 3.48Å; T1122-Q1199 PolarHBondContact O-NE2 3.44Å
1123	S	62	Low	77.5	Confident	31 Å²	31	24 Å²	24	22%	0.217	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.2	10.3	-173.3	69.4	0	0	0	0	114.8	C1119 D1120 R1125	C1119-S1123 WeakPolarHBondContact CB-OG 3.33Å; D1120-S1123 PolarHBondContact N-OG 3.15Å; D1120-S1123 PolarHBondContact O-N 2.76Å; D1120-S1123 PolarHBondContact OD1-N 2.99Å; D1120-S1123 PolarHBondContact OD1-OG 2.64Å; D1120-S1123 WeakPolarHBondContact OD2-CB 3.29Å; D1120-S1123 PolarHBondContact OD2-OG 2.96Å; S1123-R1125 PolarHBondContact O-N 3.16Å
1124	A	71	Confident	78	Confident	7 Å²	7	23.8 Å²	23.8	6%	0.058	13%	0.131	C	C	.	.			trans	-53.2	129	175.3	0	0	0	0	0	112.6	P1115 D1120 F1126	P1115-A1124 HydrophobicContact CB-CB 3.71Å; P1115-A1124 HydrophobicContact CG-CB 4.08Å; D1120-A1124 PolarHBondContact O-N 2.91Å; A1124-F1126 HydrophobicContact CB-CE2 4.32Å
1125	R	74.1	Confident	78.4	Confident	70 Å²	70	23.8 Å²	23.8	26%	0.264	13%	0.13	S	C	.	.	B	Isolated β-bridge	trans	-98.5	128.7	-178.1	-72	-170.4	173.7	177.7	3.3	110.9	P1115 T1116 R1117 S1123 S1203	P1115-R1125 CarbonylContact C-O 3.5Å; P1115-R1125 VanDerWaalsContact CA-O 3.27Å; P1115-R1125 WeakPolarHBondContact CA-O 3.45Å; P1115-R1125 WeakPolarHBondContact CB-O 3.24Å; T1116-R1125 PolarHBondContact N-O 3.22Å; R1117-R1125 PolarHBondContact N-O 2.77Å; R1117-R1125 PolarHBondContact O-N 2.87Å; S1123-R1125 PolarHBondContact O-N 3.16Å; R1125-S1203 PolarHBondContact NE-OG 3.09Å; R1125-S1203 VanDerWaalsContact NE-OG 3.08Å; R1125-S1203 PolarHBondContact NH2-OG 3.06Å
1126	F	77.4	Confident	79	Confident	11 Å²	11	23.8 Å²	23.8	5%	0.048	13%	0.13	C	C	.	.			trans	-107.7	118.7	176.4	-62.2	-98.4	0	0	0	109.5	K1110 M1113 P1115 A1124 F1196	K1110-F1126 HydrophobicContact CB-CE1 3.8Å; K1110-F1126 HydrophobicContact CB-CZ 3.69Å; K1110-F1126 HydrophobicContact CD-CE2 4.28Å; K1110-F1126 HydrophobicContact CD-CZ 4.2Å; M1113-F1126 HydrophobicContact CB-CD1 4.45Å; P1115-F1126 HydrophobicContact CB-CD1 4.23Å; P1115-F1126 HydrophobicContact CB-CD2 4.43Å; P1115-F1126 HydrophobicContact CB-CE1 3.99Å; P1115-F1126 HydrophobicContact CB-CE2 4.19Å; P1115-F1126 HydrophobicContact CB-CG 4.44Å; P1115-F1126 HydrophobicContact CB-CZ 3.96Å; P1115-F1126 HydrophobicContact CG-CE1 4.4Å; P1115-F1126 HydrophobicContact CG-CZ 4.36Å; A1124-F1126 HydrophobicContact CB-CE2 4.32Å; F1126-F1196 HydrophobicContact CB-CD1 3.91Å; F1126-F1196 HydrophobicContact CB-CE1 3.76Å; F1126-F1196 HydrophobicContact CB-CE2 4.45Å; F1126-F1196 HydrophobicContact CB-CG 4.32Å; F1126-F1196 HydrophobicContact CB-CZ 4.05Å; F1126-F1196 HydrophobicContact CD1-CE1 4.21Å; F1126-F1196 HydrophobicContact CD1-CZ 4.27Å; F1126-F1196 HydrophobicContact CD2-CD1 4.22Å; F1126-F1196 AromaticContact CD2-CE1 3.81Å; F1126-F1196 HydrophobicContact CD2-CE1 3.81Å; F1126-F1196 HydrophobicContact CE2-CE1 4.49Å; F1126-F1196 HydrophobicContact CG-CD1 4.2Å; F1126-F1196 AromaticContact CG-CE1 3.66Å; F1126-F1196 HydrophobicContact CG-CE1 3.66Å; F1126-F1196 HydrophobicContact CG-CZ 4.08Å
1127	G	73	Confident	79.6	Confident	31 Å²	31	23.4 Å²	23.4	32%	0.32	13%	0.128	S	C	.	.			trans	-147.6	-15.3	173	0	0	0	0	0	114.7	T1116	T1116-G1127 PolarHBondContact OG1-N 3.4Å
1128	C	81.4	Confident	80.2	Confident	3 Å²	3	21.4 Å²	21.4	2%	0.02	12%	0.121	C	C	.	.			trans	-102.6	138.3	-177.7	63.3	0	0	0	0	112	T1116 D1130 S1131 G1245	T1116-C1128 VanDerWaalsContact CA-SG 3.54Å; T1116-C1128 HydrophobicContact CG2-CB 4.15Å; T1116-C1128 WeakPolarHBondContact OG1-CB 3.44Å; T1116-C1128 PolarHBondContact OG1-N 3.16Å; T1116-C1128 PolarHBondContact OG1-SG 3.44Å; C1128-D1130 WeakPolarHBondContact CB-OD1 3.31Å; C1128-S1131 VanDerWaalsContact SG-CB 3.56Å; C1128-S1131 PolarHBondContact SG-OG 2.84Å; C1128-G1245 CarbonylContact C-O 3.53Å; C1128-G1245 WeakPolarHBondContact CA-O 3.17Å
1129	R	86.9	Confident	81	Confident	9 Å²	9	21.4 Å²	21.4	3%	0.034	12%	0.121	C	C	.	.	S	Bend	trans	-99.5	-13.5	174.5	61.6	174	-179.5	139.8	-8	113.5	M1113 G1238 G1245 R1267 G1269 I1274	M1113-R1129 HydrophobicContact SD-CB 4.46Å; R1129-G1238 VanDerWaalsContact CZ-O 3.26Å; R1129-G1238 PolarHBondContact NH1-O 2.79Å; R1129-G1238 PolarHBondContact NH2-O 2.98Å; R1129-G1245 VanDerWaalsContact CG-O 3.28Å; R1129-G1245 WeakPolarHBondContact CG-O 3.3Å; R1129-G1245 PolarHBondContact N-O 3.14Å; R1129-R1267 PolarHBondContact NH2-O 2.85Å; R1129-G1269 VanDerWaalsContact CZ-O 3.3Å; R1129-G1269 PolarHBondContact NH1-O 2.88Å; R1129-G1269 PolarHBondContact NH2-O 3.44Å; R1129-I1274 HydrophobicContact CG-CD1 4.42Å
1130	D	90.9	Very high	82.4	Confident	0 Å²	0	22.4 Å²	22.4	0%	0	12%	0.122	C	C	.	.	S	Bend	trans	-84	-32.9	-177.6	65.2	-13.7	0	0	0	113.6	R1054 C1128 V1132 W1133 W1134 T1246 W1247 I1274	R1054-D1130 WeakPolarHBondContact CD-OD2 3.43Å; C1128-D1130 WeakPolarHBondContact CB-OD1 3.31Å; D1130-V1132 PolarHBondContact O-N 3.19Å; D1130-V1132 VanDerWaalsContact O-N 3.11Å; D1130-W1133 WeakPolarHBondContact O-CA 3.26Å; D1130-W1133 WeakPolarHBondContact O-CB 3.3Å; D1130-W1133 PolarHBondContact O-N 3.43Å; D1130-W1134 PolarHBondContact O-N 2.94Å; D1130-T1246 VanDerWaalsContact OD2-C 3.25Å; D1130-W1247 PolarHBondContact OD2-N 3.32Å; D1130-I1274 HydrophobicContact CB-CD1 3.83Å; D1130-I1274 HydrophobicContact CB-CG1 4.21Å
1131	S	91.9	Very high	84	Confident	0 Å²	0	21.1 Å²	21.1	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-56.6	-32.3	-174	-75.7	0	0	0	0	114.7	S1053 R1054 C1128 W1133 W1135	S1053-S1131 VanDerWaalsContact OG-CB 3.26Å; S1053-S1131 WeakPolarHBondContact OG-CB 3.2Å; S1053-S1131 PolarHBondContact OG-OG 2.66Å; R1054-S1131 WeakPolarHBondContact CB-OG 3.28Å; R1054-S1131 PolarHBondContact N-OG 2.85Å; C1128-S1131 VanDerWaalsContact SG-CB 3.56Å; C1128-S1131 PolarHBondContact SG-OG 2.84Å; S1131-W1133 VanDerWaalsContact C-N 3.32Å; S1131-W1135 WeakPolarHBondContact O-CB 3.16Å; S1131-W1135 PolarHBondContact O-N 2.73Å
1132	V	92.7	Very high	85.6	Confident	2 Å²	2	16.7 Å²	16.7	1%	0.012	9%	0.093	C	C	.	.	H	α-helix	trans	-67.5	-34.6	175.2	64.8	0	0	0	0	111.7	M1109 L1114 D1130 W1135 L1136 A1184 I1188	M1109-V1132 HydrophobicContact CE-CG2 4.45Å; L1114-V1132 HydrophobicContact CG-CB 4.44Å; D1130-V1132 PolarHBondContact O-N 3.19Å; D1130-V1132 VanDerWaalsContact O-N 3.11Å; V1132-W1135 HydrophobicContact CG2-CE3 4.25Å; V1132-L1136 HydrophobicContact CG2-CD1 4.4Å; V1132-L1136 VanDerWaalsContact O-CG 3.24Å; V1132-L1136 WeakPolarHBondContact O-CG 3.45Å; V1132-L1136 PolarHBondContact O-N 2.7Å; V1132-A1184 HydrophobicContact CG2-CB 4.1Å; V1132-I1188 HydrophobicContact CG1-CD1 3.83Å
1133	W	95	Very high	87.2	Confident	3 Å²	3	13.4 Å²	13.4	1%	0.011	7%	0.073	C	C	.	.	H	α-helix	trans	-73	-41.8	176.2	-62.9	105.9	0	0	0	111.4	D1130 S1131 W1135 L1136 L1137 I1188 V1236 I1274 I1277 S1278	D1130-W1133 WeakPolarHBondContact O-CA 3.26Å; D1130-W1133 WeakPolarHBondContact O-CB 3.3Å; D1130-W1133 PolarHBondContact O-N 3.43Å; S1131-W1133 VanDerWaalsContact C-N 3.32Å; W1133-W1135 VanDerWaalsContact C-N 3.33Å; W1133-W1135 PolarHBondContact O-N 3.22Å; W1133-L1136 HydrophobicContact CE3-CD1 3.96Å; W1133-L1136 HydrophobicContact CZ3-CD1 4.12Å; W1133-L1136 PolarHBondContact O-N 3.11Å; W1133-L1137 WeakPolarHBondContact O-CB 3.38Å; W1133-L1137 PolarHBondContact O-N 2.74Å; W1133-I1188 HydrophobicContact CZ2-CD1 3.81Å; W1133-I1188 HydrophobicContact CZ2-CG2 4.11Å; W1133-V1236 HydrophobicContact CH2-CG2 3.85Å; W1133-V1236 HydrophobicContact CZ2-CB 4.31Å; W1133-V1236 HydrophobicContact CZ2-CG1 3.91Å; W1133-V1236 HydrophobicContact CZ2-CG2 3.44Å; W1133-V1236 VanDerWaalsContact CZ2-CG2 3.44Å; W1133-I1274 HydrophobicContact CG-CG2 4.11Å; W1133-I1277 HydrophobicContact CB-CB 4.35Å; W1133-I1277 HydrophobicContact CB-CG2 3.72Å; W1133-I1277 WeakPolarHBondContact O-CG2 3.18Å; W1133-S1278 VanDerWaalsContact CZ3-CB 3.46Å
1134	W	95.2	Very high	88.5	Confident	2 Å²	2	15.6 Å²	15.6	1%	0.008	8%	0.082	C	C	.	.	H	α-helix	trans	-59.7	-41	171.2	-70.1	116.1	0	0	0	112.6	F1057 I1058 D1130 L1137 A1138 I1277 I1374 I1378	F1057-W1134 HydrophobicContact CB-CB 3.91Å; I1058-W1134 HydrophobicContact CD1-CD2 4.21Å; I1058-W1134 HydrophobicContact CD1-CH2 4.44Å; I1058-W1134 HydrophobicContact CD1-CZ2 4Å; I1058-W1134 HydrophobicContact CG1-CD2 3.63Å; I1058-W1134 HydrophobicContact CG1-CE3 3.73Å; I1058-W1134 HydrophobicContact CG1-CG 4.15Å; I1058-W1134 HydrophobicContact CG1-CH2 4.12Å; I1058-W1134 HydrophobicContact CG1-CZ2 4.05Å; I1058-W1134 HydrophobicContact CG1-CZ3 3.98Å; D1130-W1134 PolarHBondContact O-N 2.94Å; W1134-L1137 HydrophobicContact CE3-CD2 3.94Å; W1134-L1137 HydrophobicContact CZ3-CD2 3.9Å; W1134-L1137 PolarHBondContact O-N 2.83Å; W1134-A1138 WeakPolarHBondContact O-CB 3.27Å; W1134-A1138 PolarHBondContact O-N 3.15Å; W1134-I1277 HydrophobicContact CD2-CD1 3.93Å; W1134-I1277 HydrophobicContact CE3-CD1 4Å; W1134-I1277 HydrophobicContact CH2-CD1 3.87Å; W1134-I1277 HydrophobicContact CZ2-CD1 3.77Å; W1134-I1277 HydrophobicContact CZ3-CD1 3.97Å; W1134-I1374 HydrophobicContact CH2-CG2 3.66Å; W1134-I1374 HydrophobicContact CZ2-CG2 4.28Å; W1134-I1378 HydrophobicContact CH2-CD1 4.22Å; W1134-I1378 HydrophobicContact CZ3-CD1 4.06Å
1135	W	95.6	Very high	89.2	Confident	0 Å²	0	17.3 Å²	17.3	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-64.4	-42.8	173.8	171.1	75.6	0	0	0	112.8	F1057 I1102 A1106 M1109 L1114 S1131 V1132 W1133 L1137 A1138 I1139 L1177 T1180 I1181	F1057-W1135 HydrophobicContact CD2-CB 3.69Å; F1057-W1135 HydrophobicContact CD2-CG 4.45Å; F1057-W1135 AromaticContact CE1-CD1 3.72Å; F1057-W1135 HydrophobicContact CE2-CB 3.82Å; F1057-W1135 AromaticContact CE2-CD1 3.77Å; F1057-W1135 HydrophobicContact CE2-CG 4.14Å; F1057-W1135 HydrophobicContact CG-CB 4.12Å; F1057-W1135 HydrophobicContact CZ-CB 4.32Å; F1057-W1135 AromaticContact CZ-CD1 3.43Å; F1057-W1135 VanDerWaalsContact CZ-CD1 3.43Å; F1057-W1135 HydrophobicContact CZ-CG 4.23Å; I1102-W1135 HydrophobicContact CG2-CZ2 4.42Å; I1102-W1135 PolarHBondContact O-NE1 2.84Å; I1102-W1135 VanDerWaalsContact O-NE1 3.09Å; A1106-W1135 HydrophobicContact CB-CH2 4.42Å; A1106-W1135 HydrophobicContact CB-CZ2 3.58Å; M1109-W1135 HydrophobicContact CE-CE3 3.91Å; M1109-W1135 HydrophobicContact CE-CH2 3.47Å; M1109-W1135 VanDerWaalsContact CE-CH2 3.47Å; M1109-W1135 HydrophobicContact CE-CZ2 4.25Å; M1109-W1135 HydrophobicContact CE-CZ3 3.26Å; L1114-W1135 HydrophobicContact CD1-CB 3.42Å; L1114-W1135 VanDerWaalsContact CD1-CB 3.42Å; L1114-W1135 HydrophobicContact CD1-CD2 4.06Å; L1114-W1135 HydrophobicContact CD1-CG 3.59Å; S1131-W1135 WeakPolarHBondContact O-CB 3.16Å; S1131-W1135 PolarHBondContact O-N 2.73Å; V1132-W1135 HydrophobicContact CG2-CE3 4.25Å; W1133-W1135 VanDerWaalsContact C-N 3.33Å; W1133-W1135 PolarHBondContact O-N 3.22Å; W1135-L1137 VanDerWaalsContact C-N 3.33Å; W1135-L1137 PolarHBondContact O-N 3.27Å; W1135-A1138 WeakPolarHBondContact O-CB 3.28Å; W1135-A1138 PolarHBondContact O-N 3.07Å; W1135-I1139 HydrophobicContact CD2-CD1 3.77Å; W1135-I1139 HydrophobicContact CE3-CD1 4Å; W1135-I1139 HydrophobicContact CG-CD1 4.42Å; W1135-I1139 HydrophobicContact CH2-CD1 3.77Å; W1135-I1139 HydrophobicContact CZ2-CD1 3.57Å; W1135-I1139 HydrophobicContact CZ3-CD1 3.97Å; W1135-I1139 WeakPolarHBondContact O-CG1 3.42Å; W1135-I1139 PolarHBondContact O-N 3.46Å; W1135-L1177 HydrophobicContact CH2-CD1 4.01Å; W1135-L1177 HydrophobicContact CZ2-CD1 3.61Å; W1135-T1180 HydrophobicContact CH2-CG2 4.19Å; W1135-I1181 HydrophobicContact CH2-CG1 3.7Å; W1135-I1181 HydrophobicContact CZ3-CG1 4.11Å
1136	L	96.5	Very high	89.6	Confident	0 Å²	0	14.4 Å²	14.4	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-63.2	-38.8	174.8	-71	166.7	0	0	0	112	V1132 W1133 I1139 K1140 I1181 I1185 V1281	V1132-L1136 HydrophobicContact CG2-CD1 4.4Å; V1132-L1136 VanDerWaalsContact O-CG 3.24Å; V1132-L1136 WeakPolarHBondContact O-CG 3.45Å; V1132-L1136 PolarHBondContact O-N 2.7Å; W1133-L1136 HydrophobicContact CE3-CD1 3.96Å; W1133-L1136 HydrophobicContact CZ3-CD1 4.12Å; W1133-L1136 PolarHBondContact O-N 3.11Å; L1136-I1139 HydrophobicContact CD2-CD1 4.21Å; L1136-I1139 PolarHBondContact O-N 3.37Å; L1136-K1140 PolarHBondContact O-N 2.98Å; L1136-I1181 HydrophobicContact CD2-CB 4.31Å; L1136-I1181 HydrophobicContact CD2-CG1 4.02Å; L1136-I1181 HydrophobicContact CD2-CG2 3.71Å; L1136-I1185 HydrophobicContact CD1-CD1 4.14Å; L1136-I1185 HydrophobicContact CD1-CG1 3.95Å; L1136-I1185 HydrophobicContact CD2-CD1 4.41Å; L1136-V1281 HydrophobicContact CB-CB 4.41Å; L1136-V1281 HydrophobicContact CB-CG1 3.84Å; L1136-V1281 HydrophobicContact CB-CG2 3.65Å; L1136-V1281 HydrophobicContact CD1-CG1 4.14Å; L1136-V1281 HydrophobicContact CG-CG1 4.38Å
1137	L	96.1	Very high	89.7	Confident	8 Å²	8	17.8 Å²	17.8	4%	0.042	10%	0.103	C	C	.	.	H	α-helix	trans	-65.7	-39.6	173.8	-174.6	68	0	0	0	112.2	W1133 W1134 W1135 I1139 K1140 H1141 I1277 I1378	W1133-L1137 WeakPolarHBondContact O-CB 3.38Å; W1133-L1137 PolarHBondContact O-N 2.74Å; W1134-L1137 HydrophobicContact CE3-CD2 3.94Å; W1134-L1137 HydrophobicContact CZ3-CD2 3.9Å; W1134-L1137 PolarHBondContact O-N 2.83Å; W1135-L1137 VanDerWaalsContact C-N 3.33Å; W1135-L1137 PolarHBondContact O-N 3.27Å; L1137-I1139 VanDerWaalsContact C-N 3.34Å; L1137-I1139 PolarHBondContact O-N 2.85Å; L1137-K1140 HydrophobicContact CD1-CD 4.39Å; L1137-K1140 WeakPolarHBondContact O-CB 3.26Å; L1137-K1140 PolarHBondContact O-N 3.48Å; L1137-H1141 PolarHBondContact O-CD2 3.31Å; L1137-H1141 VanDerWaalsContact O-CD2 3.31Å; L1137-H1141 PolarHBondContact O-N 3.19Å; L1137-I1277 HydrophobicContact CB-CG2 4Å; L1137-I1277 HydrophobicContact CD2-CG1 4.37Å; L1137-I1277 HydrophobicContact CD2-CG2 4.44Å; L1137-I1378 HydrophobicContact CD1-CG2 3.98Å; L1137-I1378 HydrophobicContact CD2-CD1 3.75Å; L1137-I1378 HydrophobicContact CD2-CG1 4.26Å; L1137-I1378 HydrophobicContact CD2-CG2 4.37Å
1138	A	93.3	Very high	90	Very high	2 Å²	2	19.9 Å²	19.9	2%	0.017	11%	0.107	C	C	.	.	H	α-helix	trans	-60.1	-41.6	172.6	0	0	0	0	0	112	F1057 L1060 F1098 W1134 W1135 H1141 Y1142	F1057-A1138 HydrophobicContact CB-CB 4.24Å; F1057-A1138 HydrophobicContact CD1-CB 3.73Å; F1057-A1138 HydrophobicContact CG-CB 4.3Å; L1060-A1138 HydrophobicContact CD2-CB 3.65Å; F1098-A1138 WeakPolarHBondContact CE1-O 3.48Å; F1098-A1138 HydrophobicContact CZ-CB 4.31Å; F1098-A1138 WeakPolarHBondContact CZ-O 3.46Å; W1134-A1138 WeakPolarHBondContact O-CB 3.27Å; W1134-A1138 PolarHBondContact O-N 3.15Å; W1135-A1138 WeakPolarHBondContact O-CB 3.28Å; W1135-A1138 PolarHBondContact O-N 3.07Å; A1138-H1141 PolarHBondContact O-N 2.84Å; A1138-Y1142 PolarHBondContact O-N 3.28Å
1139	I	93.2	Very high	90.1	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-62.9	-44.2	173.7	-58.1	154.6	0	0	0	110.8	I1102 W1135 L1136 L1137 H1141 Y1142 T1143 I1152 M1153 I1181 W1284	I1102-I1139 HydrophobicContact CD1-CB 4.14Å; I1102-I1139 HydrophobicContact CD1-CG1 3.52Å; I1102-I1139 HydrophobicContact CG1-CG1 3.99Å; I1102-I1139 HydrophobicContact CG2-CD1 4.38Å; I1102-I1139 HydrophobicContact CG2-CG1 3.97Å; W1135-I1139 HydrophobicContact CD2-CD1 3.77Å; W1135-I1139 HydrophobicContact CE3-CD1 4Å; W1135-I1139 HydrophobicContact CG-CD1 4.42Å; W1135-I1139 HydrophobicContact CH2-CD1 3.77Å; W1135-I1139 HydrophobicContact CZ2-CD1 3.57Å; W1135-I1139 HydrophobicContact CZ3-CD1 3.97Å; W1135-I1139 WeakPolarHBondContact O-CG1 3.42Å; W1135-I1139 PolarHBondContact O-N 3.46Å; L1136-I1139 HydrophobicContact CD2-CD1 4.21Å; L1136-I1139 PolarHBondContact O-N 3.37Å; L1137-I1139 VanDerWaalsContact C-N 3.34Å; L1137-I1139 PolarHBondContact O-N 2.85Å; I1139-H1141 PolarHBondContact O-N 3.44Å; I1139-Y1142 WeakPolarHBondContact O-CB 3.36Å; I1139-Y1142 PolarHBondContact O-N 3.46Å; I1139-T1143 PolarHBondContact O-N 2.88Å; I1139-T1143 PolarHBondContact O-OG1 2.99Å; I1139-I1152 HydrophobicContact CG2-CG2 4.43Å; I1139-M1153 HydrophobicContact CG2-CE 4.45Å; I1139-I1181 HydrophobicContact CD1-CD1 3.89Å; I1139-I1181 HydrophobicContact CD1-CG1 4.06Å; I1139-I1181 HydrophobicContact CG2-CD1 4.37Å; I1139-W1284 HydrophobicContact CB-CH2 4.04Å; I1139-W1284 HydrophobicContact CG2-CH2 3.57Å; I1139-W1284 HydrophobicContact CG2-CZ2 3.97Å
1140	K	94.3	Very high	90	Very high	46 Å²	46	22.1 Å²	22.1	20%	0.2	12%	0.117	C	C	.	.	H	α-helix	trans	-54.7	-51.8	173.7	174.1	-177.9	-174.3	-56.8	0	111.5	L1136 L1137 Y1142 T1143 D1144 W1284	L1136-K1140 PolarHBondContact O-N 2.98Å; L1137-K1140 HydrophobicContact CD1-CD 4.39Å; L1137-K1140 WeakPolarHBondContact O-CB 3.26Å; L1137-K1140 PolarHBondContact O-N 3.48Å; K1140-Y1142 VanDerWaalsContact C-N 3.26Å; K1140-Y1142 PolarHBondContact O-N 2.9Å; K1140-T1143 PolarHBondContact O-N 2.93Å; K1140-T1143 VanDerWaalsContact O-N 3.16Å; K1140-T1143 PolarHBondContact O-OG1 3.3Å; K1140-D1144 WeakPolarHBondContact CG-OD2 3.42Å; K1140-D1144 IonicContact NZ-OD2 3.49Å; K1140-D1144 PolarHBondContact NZ-OD2 3.4Å; K1140-D1144 VanDerWaalsContact O-CG 3.25Å; K1140-D1144 PolarHBondContact O-N 3.17Å; K1140-W1284 HydrophobicContact CB-CD2 3.78Å; K1140-W1284 HydrophobicContact CB-CE3 4.12Å; K1140-W1284 HydrophobicContact CB-CG 4.02Å; K1140-W1284 HydrophobicContact CB-CZ2 4.33Å; K1140-W1284 HydrophobicContact CD-CB 3.77Å; K1140-W1284 HydrophobicContact CD-CG 3.96Å; K1140-W1284 HydrophobicContact CG-CB 4.08Å; K1140-W1284 HydrophobicContact CG-CD2 4.01Å; K1140-W1284 HydrophobicContact CG-CG 3.68Å
1141	H	92.3	Very high	89.8	Confident	37 Å²	37	26.1 Å²	26.1	17%	0.171	14%	0.136	C	C	.	.	H	α-helix	trans	-61.3	-33.5	179.1	-70.5	-44.6	0	0	0	113	L1065 L1137 A1138 I1139 D1144 M1145	L1065-H1141 HydrophobicContact CD1-CB 3.74Å; L1137-H1141 PolarHBondContact O-CD2 3.31Å; L1137-H1141 VanDerWaalsContact O-CD2 3.31Å; L1137-H1141 PolarHBondContact O-N 3.19Å; A1138-H1141 PolarHBondContact O-N 2.84Å; I1139-H1141 PolarHBondContact O-N 3.44Å; H1141-D1144 PolarHBondContact O-N 3.08Å; H1141-M1145 VanDerWaalsContact O-CB 3.28Å; H1141-M1145 WeakPolarHBondContact O-CB 3.49Å; H1141-M1145 WeakPolarHBondContact O-CG 3.47Å; H1141-M1145 PolarHBondContact O-N 2.82Å
1142	Y	89.3	Confident	89.5	Confident	3 Å²	3	26.2 Å²	26.2	1%	0.012	14%	0.137	C	C	.	.	H	α-helix	trans	-63.1	-50.3	172	-172.3	-98.4	0	0	0	112.2	L1065 L1095 F1098 A1138 I1139 K1140 D1144 M1145 V1146 G1149 I1152	L1065-Y1142 HydrophobicContact CD2-CD2 4.36Å; L1095-Y1142 VanDerWaalsContact CD2-OH 3.24Å; L1095-Y1142 WeakPolarHBondContact CD2-OH 3.32Å; F1098-Y1142 HydrophobicContact CB-CD2 3.91Å; F1098-Y1142 HydrophobicContact CB-CE2 3.79Å; F1098-Y1142 AromaticContact CD1-CD2 3.13Å; F1098-Y1142 HydrophobicContact CD1-CD2 3.13Å; F1098-Y1142 AromaticContact CD1-CE2 3.79Å; F1098-Y1142 HydrophobicContact CD1-CE2 3.79Å; F1098-Y1142 AromaticContact CD1-CG 3.83Å; F1098-Y1142 HydrophobicContact CD1-CG 3.83Å; F1098-Y1142 HydrophobicContact CD2-CD2 4.31Å; F1098-Y1142 VanDerWaalsContact CE1-CB 3.5Å; F1098-Y1142 AromaticContact CE1-CD2 3.59Å; F1098-Y1142 HydrophobicContact CE1-CD2 3.59Å; F1098-Y1142 AromaticContact CE1-CG 3.88Å; F1098-Y1142 HydrophobicContact CE1-CG 3.88Å; F1098-Y1142 AromaticContact CG-CD2 3.55Å; F1098-Y1142 HydrophobicContact CG-CD2 3.55Å; F1098-Y1142 AromaticContact CG-CE2 3.98Å; F1098-Y1142 HydrophobicContact CG-CE2 3.98Å; F1098-Y1142 HydrophobicContact CZ-CD2 4.29Å; A1138-Y1142 PolarHBondContact O-N 3.28Å; I1139-Y1142 WeakPolarHBondContact O-CB 3.36Å; I1139-Y1142 PolarHBondContact O-N 3.46Å; K1140-Y1142 VanDerWaalsContact C-N 3.26Å; K1140-Y1142 PolarHBondContact O-N 2.9Å; Y1142-D1144 PolarHBondContact O-N 3.17Å; Y1142-M1145 PolarHBondContact O-N 3.47Å; Y1142-V1146 HydrophobicContact CD2-CB 4.19Å; Y1142-V1146 HydrophobicContact CD2-CG2 3.44Å; Y1142-V1146 VanDerWaalsContact CD2-CG2 3.44Å; Y1142-V1146 HydrophobicContact CE1-CB 4.45Å; Y1142-V1146 HydrophobicContact CE2-CB 4.09Å; Y1142-V1146 HydrophobicContact CE2-CG1 4.08Å; Y1142-V1146 HydrophobicContact CE2-CG2 3.59Å; Y1142-V1146 HydrophobicContact CG-CB 4.47Å; Y1142-V1146 HydrophobicContact CG-CG2 4.03Å; Y1142-V1146 WeakPolarHBondContact O-CB 3.41Å; Y1142-V1146 WeakPolarHBondContact O-CG2 3.49Å; Y1142-V1146 PolarHBondContact O-N 3.37Å; Y1142-G1149 WeakPolarHBondContact CD1-O 3.44Å; Y1142-G1149 WeakPolarHBondContact CE1-O 3.43Å; Y1142-I1152 HydrophobicContact CD1-CB 4.15Å; Y1142-I1152 HydrophobicContact CD1-CD1 3.89Å; Y1142-I1152 HydrophobicContact CD1-CG2 3.9Å; Y1142-I1152 HydrophobicContact CE1-CB 3.77Å; Y1142-I1152 HydrophobicContact CE1-CD1 3.75Å; Y1142-I1152 HydrophobicContact CE1-CG1 4.22Å; Y1142-I1152 HydrophobicContact CE1-CG2 4.04Å; Y1142-I1152 HydrophobicContact CG-CD1 4.47Å
1143	T	89.8	Confident	89.2	Confident	17 Å²	17	26.1 Å²	26.1	10%	0.104	14%	0.136	C	C	.	.	H	α-helix	trans	-64.1	-28.6	179	57.5	0	0	0	0	112.9	I1139 K1140 I1152 W1284 M1288	I1139-T1143 PolarHBondContact O-N 2.88Å; I1139-T1143 PolarHBondContact O-OG1 2.99Å; K1140-T1143 PolarHBondContact O-N 2.93Å; K1140-T1143 VanDerWaalsContact O-N 3.16Å; K1140-T1143 PolarHBondContact O-OG1 3.3Å; T1143-I1152 HydrophobicContact CG2-CG2 4.39Å; T1143-W1284 HydrophobicContact CG2-CZ2 3.92Å; T1143-W1284 PolarHBondContact OG1-NE1 2.66Å; T1143-M1288 HydrophobicContact CG2-CE 4.29Å
1144	D	88.2	Confident	88.9	Confident	76 Å²	76	30.8 Å²	30.8	41%	0.406	15%	0.154	S	C	.	.	H	α-helix	trans	-81.5	-30.2	178.5	-66.9	-25.4	0	0	0	113.2	K1140 H1141 Y1142	K1140-D1144 WeakPolarHBondContact CG-OD2 3.42Å; K1140-D1144 IonicContact NZ-OD2 3.49Å; K1140-D1144 PolarHBondContact NZ-OD2 3.4Å; K1140-D1144 VanDerWaalsContact O-CG 3.25Å; K1140-D1144 PolarHBondContact O-N 3.17Å; H1141-D1144 PolarHBondContact O-N 3.08Å; Y1142-D1144 PolarHBondContact O-N 3.17Å
1145	M	85.9	Confident	88.5	Confident	44 Å²	44	31.1 Å²	31.1	22%	0.217	16%	0.155	C	C	.	.	H	α-helix	trans	-110.5	-24.9	-169.4	-63.8	-174.8	66.9	0	0	115.2	R1061 L1065 I1066 Y1070 H1141 Y1142	R1061-M1145 HydrophobicContact CG-SD 4.33Å; L1065-M1145 HydrophobicContact CB-CE 3.83Å; L1065-M1145 HydrophobicContact CB-SD 3.84Å; L1065-M1145 HydrophobicContact CD1-CB 4.44Å; L1065-M1145 HydrophobicContact CD1-SD 3.84Å; L1065-M1145 HydrophobicContact CG-SD 4.46Å; I1066-M1145 HydrophobicContact CG1-CE 3.91Å; Y1070-M1145 PolarHBondContact OH-O 3.39Å; H1141-M1145 VanDerWaalsContact O-CB 3.28Å; H1141-M1145 WeakPolarHBondContact O-CB 3.49Å; H1141-M1145 WeakPolarHBondContact O-CG 3.47Å; H1141-M1145 PolarHBondContact O-N 2.82Å; Y1142-M1145 PolarHBondContact O-N 3.47Å
1146	V	83.7	Confident	87.9	Confident	8 Å²	8	31.9 Å²	31.9	5%	0.048	16%	0.161	C	C	.	.	S	Bend	trans	-94.9	134.5	-175.3	-175.7	0	0	0	0	110.3	L1065 Y1070 L1095 Y1142 N1148 G1149	L1065-V1146 HydrophobicContact CD2-CG2 3.66Å; Y1070-V1146 HydrophobicContact CD1-CG2 3.82Å; Y1070-V1146 HydrophobicContact CE1-CG2 3.62Å; L1095-V1146 HydrophobicContact CD2-CG1 3.78Å; Y1142-V1146 HydrophobicContact CD2-CB 4.19Å; Y1142-V1146 HydrophobicContact CD2-CG2 3.44Å; Y1142-V1146 VanDerWaalsContact CD2-CG2 3.44Å; Y1142-V1146 HydrophobicContact CE1-CB 4.45Å; Y1142-V1146 HydrophobicContact CE2-CB 4.09Å; Y1142-V1146 HydrophobicContact CE2-CG1 4.08Å; Y1142-V1146 HydrophobicContact CE2-CG2 3.59Å; Y1142-V1146 HydrophobicContact CG-CB 4.47Å; Y1142-V1146 HydrophobicContact CG-CG2 4.03Å; Y1142-V1146 WeakPolarHBondContact O-CB 3.41Å; Y1142-V1146 WeakPolarHBondContact O-CG2 3.49Å; Y1142-V1146 PolarHBondContact O-N 3.37Å; V1146-N1148 PolarHBondContact O-N 3.34Å; V1146-G1149 WeakPolarHBondContact O-CA 3.35Å; V1146-G1149 PolarHBondContact O-N 3.03Å
1147	P	79.5	Confident	87.4	Confident	83 Å²	83	32 Å²	32	54%	0.539	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.7	125.8	172.6	-25.3	34.8	0	0	0	111	G1149	P1147-G1149 PolarHBondContact O-N 3.45Å
1148	N	79.5	Confident	86.7	Confident	74 Å²	74	32.5 Å²	32.5	40%	0.396	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.9	27.2	-171.4	-57.6	-6.3	0	0	0	115.1	V1146 Q1150 E1151	V1146-N1148 PolarHBondContact O-N 3.34Å; N1148-Q1150 VanDerWaalsContact CA-OE1 3.31Å; N1148-Q1150 PolarHBondContact O-N 3.49Å; N1148-E1151 HydrophobicContact CB-CG 4.13Å; N1148-E1151 VanDerWaalsContact CB-OE1 3.31Å; N1148-E1151 WeakPolarHBondContact CB-OE1 3.37Å; N1148-E1151 PolarHBondContact ND2-OE1 3.42Å; N1148-E1151 VanDerWaalsContact ND2-OE1 3.09Å; N1148-E1151 WeakPolarHBondContact O-CB 3.37Å; N1148-E1151 WeakPolarHBondContact O-CG 3.43Å; N1148-E1151 PolarHBondContact O-N 2.93Å
1149	G	82.8	Confident	86.2	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	16%	0.164	C	C	.	.	G	3₁₀ helix	trans	-55.3	-23.3	-176	0	0	0	0	0	114.7	Y1142 V1146 P1147 E1151 I1152	Y1142-G1149 WeakPolarHBondContact CD1-O 3.44Å; Y1142-G1149 WeakPolarHBondContact CE1-O 3.43Å; V1146-G1149 WeakPolarHBondContact O-CA 3.35Å; V1146-G1149 PolarHBondContact O-N 3.03Å; P1147-G1149 PolarHBondContact O-N 3.45Å; G1149-E1151 PolarHBondContact O-N 3.01Å; G1149-I1152 WeakPolarHBondContact O-CG2 3.46Å; G1149-I1152 PolarHBondContact O-N 3.07Å
1150	Q	85.2	Confident	85.1	Confident	59 Å²	59	35.7 Å²	35.7	28%	0.276	18%	0.176	S	C	.	.	G	3₁₀ helix	trans	-58.4	-28.1	172.7	68.5	-78.6	4.6	0	0	114.3	N1148 I1152 M1153 W1154 M1288	N1148-Q1150 VanDerWaalsContact CA-OE1 3.31Å; N1148-Q1150 PolarHBondContact O-N 3.49Å; Q1150-I1152 PolarHBondContact O-N 3.13Å; Q1150-M1153 WeakPolarHBondContact O-CB 3.32Å; Q1150-M1153 WeakPolarHBondContact O-CG 3.27Å; Q1150-M1153 PolarHBondContact O-N 3.1Å; Q1150-M1153 VanDerWaalsContact O-N 3.1Å; Q1150-W1154 WeakPolarHBondContact O-CZ3 3.47Å; Q1150-M1288 HydrophobicContact CB-CE 3.95Å
1151	E	85	Confident	83.5	Confident	84 Å²	84	34.6 Å²	34.6	39%	0.393	17%	0.174	S	C	.	.	G	3₁₀ helix	trans	-57.6	-25.8	-178.7	-70.4	177.3	-165.7	0	0	112.7	N1148 G1149 M1153 W1154	N1148-E1151 HydrophobicContact CB-CG 4.13Å; N1148-E1151 VanDerWaalsContact CB-OE1 3.31Å; N1148-E1151 WeakPolarHBondContact CB-OE1 3.37Å; N1148-E1151 PolarHBondContact ND2-OE1 3.42Å; N1148-E1151 VanDerWaalsContact ND2-OE1 3.09Å; N1148-E1151 WeakPolarHBondContact O-CB 3.37Å; N1148-E1151 WeakPolarHBondContact O-CG 3.43Å; N1148-E1151 PolarHBondContact O-N 2.93Å; G1149-E1151 PolarHBondContact O-N 3.01Å; E1151-M1153 PolarHBondContact O-N 2.81Å; E1151-W1154 PolarHBondContact O-N 3.29Å; E1151-W1154 VanDerWaalsContact O-N 3.1Å
1152	I	86	Confident	81.7	Confident	3 Å²	3	34.2 Å²	34.2	2%	0.015	18%	0.175	C	C	.	.	G	3₁₀ helix	trans	-56.5	-25.2	177.4	-156.8	176.9	0	0	0	113.3	R1099 I1102 I1139 Y1142 T1143 G1149 Q1150 W1154 D1155 L1177	R1099-I1152 HydrophobicContact CG-CD1 4.37Å; R1099-I1152 HydrophobicContact CG-CG1 4.33Å; I1102-I1152 HydrophobicContact CB-CD1 4.17Å; I1102-I1152 HydrophobicContact CD1-CD1 3.59Å; I1102-I1152 HydrophobicContact CG1-CD1 4.46Å; I1102-I1152 HydrophobicContact CG2-CD1 4.02Å; I1139-I1152 HydrophobicContact CG2-CG2 4.43Å; Y1142-I1152 HydrophobicContact CD1-CB 4.15Å; Y1142-I1152 HydrophobicContact CD1-CD1 3.89Å; Y1142-I1152 HydrophobicContact CD1-CG2 3.9Å; Y1142-I1152 HydrophobicContact CE1-CB 3.77Å; Y1142-I1152 HydrophobicContact CE1-CD1 3.75Å; Y1142-I1152 HydrophobicContact CE1-CG1 4.22Å; Y1142-I1152 HydrophobicContact CE1-CG2 4.04Å; Y1142-I1152 HydrophobicContact CG-CD1 4.47Å; T1143-I1152 HydrophobicContact CG2-CG2 4.39Å; G1149-I1152 WeakPolarHBondContact O-CG2 3.46Å; G1149-I1152 PolarHBondContact O-N 3.07Å; Q1150-I1152 PolarHBondContact O-N 3.13Å; I1152-W1154 PolarHBondContact O-N 3Å; I1152-D1155 WeakPolarHBondContact CG1-OD2 3.49Å; I1152-D1155 WeakPolarHBondContact O-CB 3.35Å; I1152-D1155 PolarHBondContact O-N 2.82Å; I1152-L1177 HydrophobicContact CB-CD2 4.41Å; I1152-L1177 HydrophobicContact CD1-CD2 4.17Å; I1152-L1177 HydrophobicContact CG1-CD2 3.79Å; I1152-L1177 HydrophobicContact CG2-CD2 4.11Å; I1152-L1177 WeakPolarHBondContact O-CB 3.34Å; I1152-L1177 WeakPolarHBondContact O-CD2 3.48Å
1153	M	88	Confident	79.8	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-57.5	-33.4	178.3	-71.4	-63.7	-174.5	0	0	112.4	I1139 Q1150 E1151 L1177 F1178 I1181 W1284 M1288 Y1294	I1139-M1153 HydrophobicContact CG2-CE 4.45Å; Q1150-M1153 WeakPolarHBondContact O-CB 3.32Å; Q1150-M1153 WeakPolarHBondContact O-CG 3.27Å; Q1150-M1153 PolarHBondContact O-N 3.1Å; Q1150-M1153 VanDerWaalsContact O-N 3.1Å; E1151-M1153 PolarHBondContact O-N 2.81Å; M1153-L1177 PolarHBondContact O-N 3.06Å; M1153-F1178 HydrophobicContact CB-CB 4.32Å; M1153-F1178 VanDerWaalsContact O-CD1 3.3Å; M1153-F1178 WeakPolarHBondContact O-CD1 3.32Å; M1153-F1178 PolarHBondContact O-N 3.37Å; M1153-F1178 HydrophobicContact SD-CB 4.23Å; M1153-I1181 HydrophobicContact CE-CD1 4.22Å; M1153-I1181 HydrophobicContact SD-CD1 3.76Å; M1153-W1284 HydrophobicContact CE-CH2 3.38Å; M1153-W1284 HydrophobicContact CE-CZ2 3.4Å; M1153-W1284 VanDerWaalsContact CE-CZ2 3.4Å; M1153-W1284 HydrophobicContact CE-CZ3 4.41Å; M1153-M1288 HydrophobicContact CE-CE 3.81Å; M1153-M1288 HydrophobicContact CG-CE 4.23Å; M1153-Y1294 HydrophobicContact CE-CD2 4.15Å; M1153-Y1294 HydrophobicContact SD-CD2 3.98Å; M1153-Y1294 HydrophobicContact SD-CE2 4.31Å
1154	W	88.3	Confident	77.5	Confident	101 Å²	101	46 Å²	46	38%	0.383	23%	0.227	S	C	.	.	G	3₁₀ helix	trans	-92.2	5.9	-179.8	-64.6	-91.9	0	0	0	113.7	Q1150 E1151 I1152 H1176 Q1293	Q1150-W1154 WeakPolarHBondContact O-CZ3 3.47Å; E1151-W1154 PolarHBondContact O-N 3.29Å; E1151-W1154 VanDerWaalsContact O-N 3.1Å; I1152-W1154 PolarHBondContact O-N 3Å; W1154-H1176 PolarHBondContact O-CE1 3.07Å; W1154-H1176 PolarHBondContact O-ND1 2.66Å; W1154-Q1293 HydrophobicContact CH2-CB 4.35Å
1155	D	85.6	Confident	75.3	Confident	8 Å²	8	45.7 Å²	45.7	4%	0.043	23%	0.232	C	C	.	.			trans	-71.3	135.9	178.3	-78.5	-25.8	0	0	0	112.7	L1017 R1099 L1103 I1152 H1176 L1177	L1017-D1155 HydrophobicContact CD1-CB 4.22Å; R1099-D1155 WeakPolarHBondContact CG-OD2 3.24Å; R1099-D1155 IonicContact CZ-OD1 3.55Å; R1099-D1155 IonicContact CZ-OD2 2.71Å; R1099-D1155 IonicContact NE-OD1 2.72Å; R1099-D1155 PolarHBondContact NE-OD1 3.25Å; R1099-D1155 IonicContact NE-OD2 3.46Å; R1099-D1155 PolarHBondContact NE-OD2 2.83Å; R1099-D1155 IonicContact NH2-OD1 2.97Å; R1099-D1155 PolarHBondContact NH2-OD1 3.13Å; R1099-D1155 IonicContact NH2-OD2 3.07Å; L1103-D1155 HydrophobicContact CD1-CB 3.81Å; L1103-D1155 HydrophobicContact CD2-CB 3.69Å; L1103-D1155 HydrophobicContact CG-CB 4.42Å; I1152-D1155 WeakPolarHBondContact CG1-OD2 3.49Å; I1152-D1155 WeakPolarHBondContact O-CB 3.35Å; I1152-D1155 PolarHBondContact O-N 2.82Å; D1155-H1176 CarbonylContact O-C 3.5Å; D1155-H1176 VanDerWaalsContact O-CA 3.3Å; D1155-H1176 WeakPolarHBondContact O-CA 3.35Å; D1155-L1177 PolarHBondContact O-N 3.37Å
1156	P	84.3	Confident	73.1	Confident	17 Å²	17	54.6 Å²	54.6	11%	0.11	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	128.5	175.4	27.5	-31.4	0	0	0	111.8	S1014 L1017 D1174	S1014-P1156 WeakPolarHBondContact CB-O 3.05Å; L1017-P1156 HydrophobicContact CB-CG 4.03Å; P1156-D1174 HydrophobicContact CB-CB 4.09Å
1157	V	85	Confident	70.9	Confident	1 Å²	1	62 Å²	62	1%	0.006	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	119.6	177.2	179.4	0	0	0	0	110.1	L1103 A1106 R1159 D1174 Q1175 L1177	L1103-V1157 HydrophobicContact CD2-CG2 3.56Å; A1106-V1157 HydrophobicContact CB-CG1 3.66Å; A1106-V1157 HydrophobicContact CB-CG2 4.05Å; V1157-R1159 PolarHBondContact O-N 3.39Å; V1157-R1159 VanDerWaalsContact O-N 3.14Å; V1157-D1174 VanDerWaalsContact C-OD1 3.29Å; V1157-Q1175 PolarHBondContact N-O 3.15Å; V1157-Q1175 PolarHBondContact O-N 3.22Å; V1157-L1177 HydrophobicContact CG2-CB 4.14Å; V1157-L1177 HydrophobicContact CG2-CD1 4.22Å
1158	I	82.3	Confident	69	Low	19 Å²	19	67.9 Å²	67.9	10%	0.097	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	107.4	170.4	-70.6	-174	0	0	0	109.4	L1013 G1107 Y1160 P1172 D1174	L1013-I1158 VanDerWaalsContact O-CD1 3.23Å; L1013-I1158 WeakPolarHBondContact O-CD1 3.12Å; G1107-I1158 WeakPolarHBondContact CA-O 3.33Å; I1158-Y1160 HydrophobicContact CB-CE2 4.02Å; I1158-Y1160 HydrophobicContact CG2-CD2 3.84Å; I1158-Y1160 HydrophobicContact CG2-CE1 4.09Å; I1158-Y1160 HydrophobicContact CG2-CE2 3.24Å; I1158-Y1160 HydrophobicContact CG2-CG 4.46Å; I1158-Y1160 WeakPolarHBondContact O-CD2 3.43Å; I1158-Y1160 PolarHBondContact O-N 3.44Å; I1158-P1172 HydrophobicContact CB-CB 4.3Å; I1158-P1172 HydrophobicContact CG2-CB 3.38Å; I1158-P1172 HydrophobicContact CG2-CG 3.88Å; I1158-D1174 VanDerWaalsContact CA-OD1 3.22Å; I1158-D1174 WeakPolarHBondContact CA-OD1 3.45Å; I1158-D1174 WeakPolarHBondContact CG1-OD1 3.45Å; I1158-D1174 PolarHBondContact N-OD1 2.64Å; I1158-D1174 VanDerWaalsContact N-OD1 3.12Å
1159	R	81.9	Confident	67.1	Low	7 Å²	7	74.4 Å²	74.4	3%	0.026	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	99	179.2	-63.2	-54.6	-59.6	-82.5	-5.3	112.9	A1106 M1109 V1157 Q1175 T1180 E1183	A1106-R1159 PolarHBondContact O-NE 3.13Å; M1109-R1159 PolarHBondContact O-NH2 3.05Å; V1157-R1159 PolarHBondContact O-N 3.39Å; V1157-R1159 VanDerWaalsContact O-N 3.14Å; R1159-Q1175 HydrophobicContact CG-CG 3.74Å; R1159-T1180 PolarHBondContact NH1-OG1 3.29Å; R1159-E1183 IonicContact CZ-OE2 2.75Å; R1159-E1183 VanDerWaalsContact CZ-OE2 3.24Å; R1159-E1183 IonicContact NH1-OE2 2.82Å; R1159-E1183 PolarHBondContact NH1-OE2 3.48Å; R1159-E1183 IonicContact NH2-OE2 3.24Å; R1159-E1183 PolarHBondContact NH2-OE2 2.92Å
1160	Y	69.8	Low	65.1	Low	62 Å²	62	80.1 Å²	80.1	24%	0.243	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72	-28.7	172.6	-60.7	-93.3	0	0	0	112.9	P1011 E1012 G1107 H1121 I1158	P1011-Y1160 HydrophobicContact CB-CD2 4.24Å; P1011-Y1160 HydrophobicContact CB-CE2 3.39Å; P1011-Y1160 HydrophobicContact CG-CE2 4.14Å; E1012-Y1160 PolarHBondContact N-OH 3.41Å; G1107-Y1160 PolarHBondContact O-N 3.26Å; H1121-Y1160 HydrophobicContact CB-CD1 4.36Å; I1158-Y1160 HydrophobicContact CB-CE2 4.02Å; I1158-Y1160 HydrophobicContact CG2-CD2 3.84Å; I1158-Y1160 HydrophobicContact CG2-CE1 4.09Å; I1158-Y1160 HydrophobicContact CG2-CE2 3.24Å; I1158-Y1160 HydrophobicContact CG2-CG 4.46Å; I1158-Y1160 WeakPolarHBondContact O-CD2 3.43Å; I1158-Y1160 PolarHBondContact O-N 3.44Å
1161	C	61.9	Low	63	Low	24 Å²	24	87.1 Å²	87.1	16%	0.162	40%	0.395	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115	32.2	-171.1	-74.6	0	0	0	0	114.7	M1109 K1110	M1109-C1161 WeakPolarHBondContact O-CB 3.38Å; K1110-C1161 HydrophobicContact CB-CB 3.8Å; K1110-C1161 HydrophobicContact CD-CB 4.24Å; K1110-C1161 HydrophobicContact CG-CB 4.07Å
1162	S	53.5	Low	61.5	Low	29 Å²	29	86 Å²	86	20%	0.203	40%	0.395	C	S	.	.			trans	-59.4	153.6	176.9	-179.8	0	0	0	0	113.2	E1164 S1165	S1162-E1164 PolarHBondContact O-N 3.36Å; S1162-E1164 PolarHBondContact OG-N 3.3Å; S1162-S1165 PolarHBondContact O-N 2.95Å; S1162-S1165 PolarHBondContact O-OG 3.43Å; S1162-S1165 VanDerWaalsContact O-OG 3.08Å
1163	K	49.2	Very low	60.6	Low	100 Å²	100	88.7 Å²	88.7	44%	0.435	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-22.9	175.6	-74.2	168.3	176.2	124.7	0	113.1	E1183 T1187	K1163-E1183 WeakPolarHBondContact CE-OE1 3.46Å; K1163-E1183 IonicContact NZ-OE1 2.63Å; K1163-E1183 PolarHBondContact NZ-OE1 3.44Å; K1163-T1187 PolarHBondContact NZ-OG1 3Å
1164	E	41.7	Very low	60.1	Low	166 Å²	166	91 Å²	91	78%	0.776	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.6	-14.1	-174.8	-59.7	-170.5	163.3	0	0	114	S1162 R1166	S1162-E1164 PolarHBondContact O-N 3.36Å; S1162-E1164 PolarHBondContact OG-N 3.3Å; E1164-R1166 PolarHBondContact O-N 3.35Å
1165	S	41.7	Very low	59.9	Low	71 Å²	71	88 Å²	88	50%	0.497	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.4	26.2	-174.5	66	0	0	0	0	115.4	S1162 H1167	S1162-S1165 PolarHBondContact O-N 2.95Å; S1162-S1165 PolarHBondContact O-OG 3.43Å; S1162-S1165 VanDerWaalsContact O-OG 3.08Å; S1165-H1167 PolarHBondContact O-N 3.12Å
1166	R	40.3	Very low	60.1	Low	230 Å²	230	91.4 Å²	91.4	87%	0.868	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-8.9	167.2	-77.8	-173.6	172.8	-177	-1.8	113.1	E1164	E1164-R1166 PolarHBondContact O-N 3.35Å
1167	H	37.9	Very low	60.4	Low	163 Å²	163	90.6 Å²	90.6	76%	0.755	43%	0.427	S	S	*	.	S	Bend	trans	-119	151	-176.8	-66.6	-18.6	0	0	0	112.8	S1165	S1165-H1167 PolarHBondContact O-N 3.12Å
1168	K	39.5	Very low	60.7	Low	207 Å²	207	91.6 Å²	91.6	90%	0.9	43%	0.431	S	S	*	.	S	Bend	trans	-54.6	136.1	-160.2	-62.2	166.5	178.9	174	0	113.8
1169	R	40.1	Very low	61.1	Low	212 Å²	212	93.2 Å²	93.2	80%	0.8	44%	0.44	S	S	*	.	S	Bend	trans	78.1	118.8	176.1	-57.1	-178.3	175.3	-178.1	-1.8	114.7	Y1171	R1169-Y1171 PolarHBondContact O-N 3.09Å; R1169-Y1171 VanDerWaalsContact O-N 3.12Å
1170	P	39.8	Very low	61.5	Low	120 Å²	120	92.9 Å²	92.9	78%	0.779	44%	0.438	S	S	*	.			trans	-81.1	92.5	177.1	33.6	-31.9	0	0	0	109.9	P1172	P1170-P1172 WeakPolarHBondContact O-CD 3.49Å
1171	Y	41.3	Very low	62.6	Low	206 Å²	206	90 Å²	90	81%	0.808	43%	0.427	S	S	*	.			trans	-81.2	114.4	147.6	-78	-82.8	0	0	0	106.3	R1169 S1173	R1169-Y1171 PolarHBondContact O-N 3.09Å; R1169-Y1171 VanDerWaalsContact O-N 3.12Å; Y1171-S1173 PolarHBondContact O-N 2.95Å
1172	P	54.4	Low	64.1	Low	60 Å²	60	89.6 Å²	89.6	39%	0.39	42%	0.423	S	S	.	.			trans	-64.6	123.6	173	26.2	-31.7	0	0	0	109.1	I1158 P1170 D1174	I1158-P1172 HydrophobicContact CB-CB 4.3Å; I1158-P1172 HydrophobicContact CG2-CB 3.38Å; I1158-P1172 HydrophobicContact CG2-CG 3.88Å; P1170-P1172 WeakPolarHBondContact O-CD 3.49Å; P1172-D1174 PolarHBondContact O-N 3.31Å
1173	S	66.7	Low	65.8	Low	59 Å²	59	89.7 Å²	89.7	41%	0.413	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	115	165.5	58.3	0	0	0	0	107.9	Y1171	Y1171-S1173 PolarHBondContact O-N 2.95Å
1174	D	77.2	Confident	67.7	Low	49 Å²	49	85 Å²	85	26%	0.262	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	133.4	168.9	-79.9	-39	0	0	0	110.2	S1014 Y1016 P1156 V1157 I1158 P1172	S1014-D1174 WeakPolarHBondContact CB-OD1 3.32Å; S1014-D1174 WeakPolarHBondContact CB-OD2 3.47Å; S1014-D1174 PolarHBondContact OG-OD1 2.78Å; S1014-D1174 PolarHBondContact OG-OD2 3.21Å; Y1016-D1174 HydrophobicContact CD2-CB 4.49Å; Y1016-D1174 VanDerWaalsContact CD2-OD2 3.31Å; Y1016-D1174 WeakPolarHBondContact CD2-OD2 3.44Å; P1156-D1174 HydrophobicContact CB-CB 4.09Å; V1157-D1174 VanDerWaalsContact C-OD1 3.29Å; I1158-D1174 VanDerWaalsContact CA-OD1 3.22Å; I1158-D1174 WeakPolarHBondContact CA-OD1 3.45Å; I1158-D1174 WeakPolarHBondContact CG1-OD1 3.45Å; I1158-D1174 PolarHBondContact N-OD1 2.64Å; I1158-D1174 VanDerWaalsContact N-OD1 3.12Å; P1172-D1174 PolarHBondContact O-N 3.31Å
1175	Q	84.5	Confident	70.1	Confident	38 Å²	38	77 Å²	77	18%	0.178	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	149.3	173.3	68.4	178.1	46.3	0	0	109.6	V1157 R1159 I1179 T1180	V1157-Q1175 PolarHBondContact N-O 3.15Å; V1157-Q1175 PolarHBondContact O-N 3.22Å; R1159-Q1175 HydrophobicContact CG-CG 3.74Å; Q1175-I1179 HydrophobicContact CB-CB 4.44Å; Q1175-I1179 HydrophobicContact CB-CD1 4.26Å; Q1175-I1179 HydrophobicContact CG-CB 4.46Å; Q1175-T1180 PolarHBondContact NE2-OG1 3.46Å
1176	H	89	Confident	72.4	Confident	80 Å²	80	74.7 Å²	74.7	37%	0.37	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.9	146.6	177.3	-61	-66.1	0	0	0	112.1	W1154 D1155 F1178 I1179 T1180	W1154-H1176 PolarHBondContact O-CE1 3.07Å; W1154-H1176 PolarHBondContact O-ND1 2.66Å; D1155-H1176 CarbonylContact O-C 3.5Å; D1155-H1176 VanDerWaalsContact O-CA 3.3Å; D1155-H1176 WeakPolarHBondContact O-CA 3.35Å; H1176-F1178 HydrophobicContact CB-CD1 3.45Å; H1176-F1178 VanDerWaalsContact CB-CD1 3.45Å; H1176-F1178 HydrophobicContact CB-CE1 3.35Å; H1176-F1178 HydrophobicContact CB-CG 4.33Å; H1176-F1178 HydrophobicContact CB-CZ 4.18Å; H1176-F1178 AromaticContact CD2-CE1 3.7Å; H1176-F1178 AromaticContact CG-CE1 3.69Å; H1176-F1178 PolarHBondContact O-N 3.28Å; H1176-I1179 HydrophobicContact CB-CD1 4.3Å; H1176-I1179 HydrophobicContact CB-CG1 4.33Å; H1176-I1179 WeakPolarHBondContact O-CB 3.18Å; H1176-I1179 PolarHBondContact O-N 3.49Å; H1176-T1180 PolarHBondContact O-N 3.14Å
1177	L	90.3	Very high	74.5	Confident	0 Å²	0	64 Å²	64	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-52.7	-40.2	178.4	175.8	60.9	0	0	0	112.4	I1102 L1103 A1106 W1135 I1152 M1153 D1155 V1157 I1179 T1180 I1181	I1102-L1177 HydrophobicContact CG2-CD1 4.02Å; I1102-L1177 HydrophobicContact CG2-CD2 3.71Å; L1103-L1177 HydrophobicContact CD2-CB 4.11Å; L1103-L1177 HydrophobicContact CD2-CD1 4.28Å; L1103-L1177 HydrophobicContact CD2-CD2 4.12Å; L1103-L1177 HydrophobicContact CD2-CG 4.39Å; A1106-L1177 HydrophobicContact CB-CD1 4.12Å; W1135-L1177 HydrophobicContact CH2-CD1 4.01Å; W1135-L1177 HydrophobicContact CZ2-CD1 3.61Å; I1152-L1177 HydrophobicContact CB-CD2 4.41Å; I1152-L1177 HydrophobicContact CD1-CD2 4.17Å; I1152-L1177 HydrophobicContact CG1-CD2 3.79Å; I1152-L1177 HydrophobicContact CG2-CD2 4.11Å; I1152-L1177 WeakPolarHBondContact O-CB 3.34Å; I1152-L1177 WeakPolarHBondContact O-CD2 3.48Å; M1153-L1177 PolarHBondContact O-N 3.06Å; D1155-L1177 PolarHBondContact O-N 3.37Å; V1157-L1177 HydrophobicContact CG2-CB 4.14Å; V1157-L1177 HydrophobicContact CG2-CD1 4.22Å; L1177-I1179 PolarHBondContact O-N 2.56Å; L1177-T1180 WeakPolarHBondContact O-CA 3.38Å; L1177-T1180 WeakPolarHBondContact O-CB 3.46Å; L1177-T1180 PolarHBondContact O-N 3.49Å; L1177-I1181 HydrophobicContact CD1-CD1 4.34Å; L1177-I1181 HydrophobicContact CD1-CG1 4.23Å; L1177-I1181 HydrophobicContact CD2-CD1 4.45Å; L1177-I1181 HydrophobicContact CG-CD1 3.95Å; L1177-I1181 HydrophobicContact CG-CG1 4.32Å; L1177-I1181 WeakPolarHBondContact O-CG1 3.36Å; L1177-I1181 PolarHBondContact O-N 3.19Å
1178	F	92.6	Very high	76.9	Confident	22 Å²	22	56.5 Å²	56.5	10%	0.096	27%	0.271	C	S	.	.	H	α-helix	trans	-58.1	-31.9	177.7	79	-104	0	0	0	112.8	M1153 H1176 Q1182 Y1294 P1295 Y1296	M1153-F1178 HydrophobicContact CB-CB 4.32Å; M1153-F1178 VanDerWaalsContact O-CD1 3.3Å; M1153-F1178 WeakPolarHBondContact O-CD1 3.32Å; M1153-F1178 PolarHBondContact O-N 3.37Å; M1153-F1178 HydrophobicContact SD-CB 4.23Å; H1176-F1178 HydrophobicContact CB-CD1 3.45Å; H1176-F1178 VanDerWaalsContact CB-CD1 3.45Å; H1176-F1178 HydrophobicContact CB-CE1 3.35Å; H1176-F1178 HydrophobicContact CB-CG 4.33Å; H1176-F1178 HydrophobicContact CB-CZ 4.18Å; H1176-F1178 AromaticContact CD2-CE1 3.7Å; H1176-F1178 AromaticContact CG-CE1 3.69Å; H1176-F1178 PolarHBondContact O-N 3.28Å; F1178-Q1182 WeakPolarHBondContact O-CB 3.46Å; F1178-Q1182 PolarHBondContact O-N 3.12Å; F1178-Y1294 HydrophobicContact CB-CD2 3.99Å; F1178-Y1294 HydrophobicContact CB-CE2 3.75Å; F1178-Y1294 PolarHBondContact O-OH 2.84Å; F1178-P1295 HydrophobicContact CD1-CG 4.33Å; F1178-P1295 HydrophobicContact CD2-CB 4.37Å; F1178-P1295 HydrophobicContact CD2-CG 3.81Å; F1178-P1295 HydrophobicContact CE1-CG 4.21Å; F1178-P1295 HydrophobicContact CE2-CB 4.1Å; F1178-P1295 HydrophobicContact CE2-CG 3.69Å; F1178-P1295 HydrophobicContact CG-CG 4.18Å; F1178-P1295 HydrophobicContact CZ-CG 3.92Å; F1178-Y1296 HydrophobicContact CD2-CD2 4.22Å; F1178-Y1296 AromaticContact CD2-CE2 3.58Å; F1178-Y1296 HydrophobicContact CD2-CE2 3.58Å; F1178-Y1296 AromaticContact CE2-CE2 3.84Å; F1178-Y1296 HydrophobicContact CE2-CE2 3.84Å
1179	I	90.7	Very high	79.2	Confident	53 Å²	53	46.7 Å²	46.7	27%	0.272	23%	0.229	S	C	.	.	H	α-helix	trans	-71.3	-39.2	175.2	-55	175.9	0	0	0	110.1	Q1175 H1176 L1177 Q1182 E1183	Q1175-I1179 HydrophobicContact CB-CB 4.44Å; Q1175-I1179 HydrophobicContact CB-CD1 4.26Å; Q1175-I1179 HydrophobicContact CG-CB 4.46Å; H1176-I1179 HydrophobicContact CB-CD1 4.3Å; H1176-I1179 HydrophobicContact CB-CG1 4.33Å; H1176-I1179 WeakPolarHBondContact O-CB 3.18Å; H1176-I1179 PolarHBondContact O-N 3.49Å; L1177-I1179 PolarHBondContact O-N 2.56Å; I1179-Q1182 PolarHBondContact O-N 2.82Å; I1179-E1183 WeakPolarHBondContact O-CB 3.34Å; I1179-E1183 PolarHBondContact O-N 3.02Å
1180	T	90.3	Very high	81.3	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-65.8	-42.4	176.2	-56.6	0	0	0	0	111.8	A1106 M1109 W1135 R1159 Q1175 H1176 L1177 E1183 A1184	A1106-T1180 HydrophobicContact CB-CG2 3.97Å; M1109-T1180 HydrophobicContact CB-CG2 4.49Å; M1109-T1180 HydrophobicContact CE-CG2 3.66Å; M1109-T1180 HydrophobicContact SD-CG2 3.87Å; W1135-T1180 HydrophobicContact CH2-CG2 4.19Å; R1159-T1180 PolarHBondContact NH1-OG1 3.29Å; Q1175-T1180 PolarHBondContact NE2-OG1 3.46Å; H1176-T1180 PolarHBondContact O-N 3.14Å; L1177-T1180 WeakPolarHBondContact O-CA 3.38Å; L1177-T1180 WeakPolarHBondContact O-CB 3.46Å; L1177-T1180 PolarHBondContact O-N 3.49Å; T1180-E1183 PolarHBondContact O-N 3.17Å; T1180-A1184 PolarHBondContact O-N 2.83Å
1181	I	93	Very high	82.8	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-58.6	-51.2	172.4	-67.5	170	0	0	0	110.1	W1135 L1136 I1139 M1153 L1177 E1183 A1184 I1185 L1285 Y1294	W1135-I1181 HydrophobicContact CH2-CG1 3.7Å; W1135-I1181 HydrophobicContact CZ3-CG1 4.11Å; L1136-I1181 HydrophobicContact CD2-CB 4.31Å; L1136-I1181 HydrophobicContact CD2-CG1 4.02Å; L1136-I1181 HydrophobicContact CD2-CG2 3.71Å; I1139-I1181 HydrophobicContact CD1-CD1 3.89Å; I1139-I1181 HydrophobicContact CD1-CG1 4.06Å; I1139-I1181 HydrophobicContact CG2-CD1 4.37Å; M1153-I1181 HydrophobicContact CE-CD1 4.22Å; M1153-I1181 HydrophobicContact SD-CD1 3.76Å; L1177-I1181 HydrophobicContact CD1-CD1 4.34Å; L1177-I1181 HydrophobicContact CD1-CG1 4.23Å; L1177-I1181 HydrophobicContact CD2-CD1 4.45Å; L1177-I1181 HydrophobicContact CG-CD1 3.95Å; L1177-I1181 HydrophobicContact CG-CG1 4.32Å; L1177-I1181 WeakPolarHBondContact O-CG1 3.36Å; L1177-I1181 PolarHBondContact O-N 3.19Å; I1181-E1183 VanDerWaalsContact C-N 3.32Å; I1181-E1183 PolarHBondContact O-N 3.23Å; I1181-A1184 WeakPolarHBondContact O-CB 3.5Å; I1181-A1184 PolarHBondContact O-N 3.26Å; I1181-A1184 VanDerWaalsContact O-N 3.15Å; I1181-I1185 HydrophobicContact CG2-CD1 3.82Å; I1181-I1185 WeakPolarHBondContact O-CG1 3.41Å; I1181-I1185 PolarHBondContact O-N 3.49Å; I1181-L1285 HydrophobicContact CG2-CD1 4.43Å; I1181-L1285 HydrophobicContact CG2-CD2 4.44Å; I1181-Y1294 HydrophobicContact CB-CE2 4.41Å; I1181-Y1294 HydrophobicContact CG2-CE2 4.12Å; I1181-Y1294 WeakPolarHBondContact CG2-OH 3.2Å
1182	Q	92.9	Very high	83.9	Confident	16 Å²	16	30.9 Å²	30.9	8%	0.075	17%	0.167	C	C	.	.	H	α-helix	trans	-62.5	-38.4	179.9	-167.3	68.5	5.1	0	0	112.5	F1178 I1179 A1184 C1186 Y1294 Y1296 G1298	F1178-Q1182 WeakPolarHBondContact O-CB 3.46Å; F1178-Q1182 PolarHBondContact O-N 3.12Å; I1179-Q1182 PolarHBondContact O-N 2.82Å; Q1182-A1184 VanDerWaalsContact C-N 3.34Å; Q1182-C1186 WeakPolarHBondContact O-CB 3.24Å; Q1182-C1186 PolarHBondContact O-N 3.28Å; Q1182-C1186 PolarHBondContact O-SG 2.92Å; Q1182-Y1294 WeakPolarHBondContact CB-OH 3.07Å; Q1182-Y1294 PolarHBondContact N-OH 3.08Å; Q1182-Y1294 PolarHBondContact OE1-OH 3.32Å; Q1182-Y1296 HydrophobicContact CB-CD2 3.53Å; Q1182-Y1296 HydrophobicContact CB-CE2 3.32Å; Q1182-Y1296 HydrophobicContact CB-CG 4.42Å; Q1182-Y1296 VanDerWaalsContact CD-CD2 3.42Å; Q1182-Y1296 HydrophobicContact CG-CD1 4.2Å; Q1182-Y1296 HydrophobicContact CG-CD2 3.37Å; Q1182-Y1296 HydrophobicContact CG-CE1 4.26Å; Q1182-Y1296 HydrophobicContact CG-CE2 3.41Å; Q1182-Y1296 VanDerWaalsContact CG-CE2 3.41Å; Q1182-Y1296 HydrophobicContact CG-CG 3.77Å; Q1182-G1298 PolarHBondContact NE2-O 3.05Å
1183	E	88.8	Confident	83.9	Confident	32 Å²	32	35 Å²	35	15%	0.15	18%	0.179	C	C	.	.	H	α-helix	trans	-61.6	-43.6	175.2	-163.2	-150	164.8	0	0	111.3	R1159 K1163 I1179 T1180 I1181 T1187	R1159-E1183 IonicContact CZ-OE2 2.75Å; R1159-E1183 VanDerWaalsContact CZ-OE2 3.24Å; R1159-E1183 IonicContact NH1-OE2 2.82Å; R1159-E1183 PolarHBondContact NH1-OE2 3.48Å; R1159-E1183 IonicContact NH2-OE2 3.24Å; R1159-E1183 PolarHBondContact NH2-OE2 2.92Å; K1163-E1183 WeakPolarHBondContact CE-OE1 3.46Å; K1163-E1183 IonicContact NZ-OE1 2.63Å; K1163-E1183 PolarHBondContact NZ-OE1 3.44Å; I1179-E1183 WeakPolarHBondContact O-CB 3.34Å; I1179-E1183 PolarHBondContact O-N 3.02Å; T1180-E1183 PolarHBondContact O-N 3.17Å; I1181-E1183 VanDerWaalsContact C-N 3.32Å; I1181-E1183 PolarHBondContact O-N 3.23Å; E1183-T1187 VanDerWaalsContact O-CB 3.24Å; E1183-T1187 WeakPolarHBondContact O-CB 3.42Å; E1183-T1187 PolarHBondContact O-N 2.88Å; E1183-T1187 PolarHBondContact O-OG1 3.45Å
1184	A	89.6	Confident	83.3	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-58.5	-58	178.9	0	0	0	0	0	110.8	M1109 V1132 T1180 I1181 Q1182 C1186 T1187 I1188	M1109-A1184 HydrophobicContact CE-CB 3.63Å; M1109-A1184 HydrophobicContact SD-CB 3.46Å; M1109-A1184 WeakPolarHBondContact SD-CB 3.25Å; V1132-A1184 HydrophobicContact CG2-CB 4.1Å; T1180-A1184 PolarHBondContact O-N 2.83Å; I1181-A1184 WeakPolarHBondContact O-CB 3.5Å; I1181-A1184 PolarHBondContact O-N 3.26Å; I1181-A1184 VanDerWaalsContact O-N 3.15Å; Q1182-A1184 VanDerWaalsContact C-N 3.34Å; A1184-C1186 PolarHBondContact O-N 3.25Å; A1184-T1187 PolarHBondContact O-N 3.34Å; A1184-T1187 VanDerWaalsContact O-N 3.14Å; A1184-I1188 WeakPolarHBondContact O-CG1 3.39Å; A1184-I1188 PolarHBondContact O-N 2.76Å
1185	I	91.3	Very high	81.9	Confident	0 Å²	0	33 Å²	33	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-67.7	-41.8	-173.5	-58.1	173.5	0	0	0	110.2	L1136 I1181 T1187 I1188 F1189 V1281 I1282 L1285 V1299 W1312 W1315	L1136-I1185 HydrophobicContact CD1-CD1 4.14Å; L1136-I1185 HydrophobicContact CD1-CG1 3.95Å; L1136-I1185 HydrophobicContact CD2-CD1 4.41Å; I1181-I1185 HydrophobicContact CG2-CD1 3.82Å; I1181-I1185 WeakPolarHBondContact O-CG1 3.41Å; I1181-I1185 PolarHBondContact O-N 3.49Å; I1185-T1187 VanDerWaalsContact C-N 3.31Å; I1185-T1187 PolarHBondContact O-N 3.05Å; I1185-I1188 PolarHBondContact O-N 2.92Å; I1185-F1189 WeakPolarHBondContact O-CB 3.48Å; I1185-F1189 PolarHBondContact O-N 2.77Å; I1185-V1281 HydrophobicContact CD1-CG1 4.45Å; I1185-I1282 HydrophobicContact CG2-CD1 4.22Å; I1185-L1285 HydrophobicContact CD1-CD1 3.34Å; I1185-V1299 HydrophobicContact CG2-CG1 3.88Å; I1185-W1312 HydrophobicContact CG2-CH2 4.27Å; I1185-W1312 HydrophobicContact CG2-CZ3 4.05Å; I1185-W1315 HydrophobicContact CG2-CH2 3.7Å; I1185-W1315 HydrophobicContact CG2-CZ3 3.54Å
1186	C	89.5	Confident	80.2	Confident	22 Å²	22	31.9 Å²	31.9	15%	0.149	17%	0.169	C	C	.	.	H	α-helix	trans	-62.6	-36	173.9	-70.7	0	0	0	0	112.7	Q1182 A1184 Q1190	Q1182-C1186 WeakPolarHBondContact O-CB 3.24Å; Q1182-C1186 PolarHBondContact O-N 3.28Å; Q1182-C1186 PolarHBondContact O-SG 2.92Å; A1184-C1186 PolarHBondContact O-N 3.25Å; C1186-Q1190 WeakPolarHBondContact O-CB 3.37Å; C1186-Q1190 VanDerWaalsContact O-CG 3.25Å; C1186-Q1190 WeakPolarHBondContact O-CG 3.29Å; C1186-Q1190 PolarHBondContact O-N 2.99Å
1187	T	85.9	Confident	77.9	Confident	4 Å²	4	30.9 Å²	30.9	3%	0.025	17%	0.166	C	C	.	.	H	α-helix	trans	-72.2	-39.3	-179.5	-55.9	0	0	0	0	111.4	N1111 K1163 E1183 A1184 I1185	N1111-T1187 VanDerWaalsContact O-CG2 3.3Å; N1111-T1187 WeakPolarHBondContact O-CG2 3.31Å; K1163-T1187 PolarHBondContact NZ-OG1 3Å; E1183-T1187 VanDerWaalsContact O-CB 3.24Å; E1183-T1187 WeakPolarHBondContact O-CB 3.42Å; E1183-T1187 PolarHBondContact O-N 2.88Å; E1183-T1187 PolarHBondContact O-OG1 3.45Å; A1184-T1187 PolarHBondContact O-N 3.34Å; A1184-T1187 VanDerWaalsContact O-N 3.14Å; I1185-T1187 VanDerWaalsContact C-N 3.31Å; I1185-T1187 PolarHBondContact O-N 3.05Å
1188	I	87.9	Confident	75.4	Confident	7 Å²	7	37.8 Å²	37.8	4%	0.036	20%	0.201	C	C	.	.	H	α-helix	trans	-68.4	-44.3	172.8	-58.3	162.1	0	0	0	110.3	V1132 W1133 A1184 I1185 Q1190 G1191 G1228 V1229 V1236	V1132-I1188 HydrophobicContact CG1-CD1 3.83Å; W1133-I1188 HydrophobicContact CZ2-CD1 3.81Å; W1133-I1188 HydrophobicContact CZ2-CG2 4.11Å; A1184-I1188 WeakPolarHBondContact O-CG1 3.39Å; A1184-I1188 PolarHBondContact O-N 2.76Å; I1185-I1188 PolarHBondContact O-N 2.92Å; I1188-Q1190 PolarHBondContact O-N 3.31Å; I1188-G1191 PolarHBondContact O-N 3.47Å; I1188-G1228 WeakPolarHBondContact O-CA 3.41Å; I1188-V1229 HydrophobicContact CG2-CG2 4.28Å; I1188-V1236 HydrophobicContact CG2-CG1 4.38Å
1189	F	88	Confident	72.8	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-62.2	-29.9	179.2	-172.7	-102.7	0	0	0	113	I1185 G1191 V1229 K1231 V1299 C1301 W1310 W1315	I1185-F1189 WeakPolarHBondContact O-CB 3.48Å; I1185-F1189 PolarHBondContact O-N 2.77Å; F1189-G1191 PolarHBondContact O-N 2.87Å; F1189-V1229 HydrophobicContact CB-CG2 4.45Å; F1189-V1229 HydrophobicContact CD2-CB 3.89Å; F1189-V1229 HydrophobicContact CD2-CG1 3.94Å; F1189-V1229 HydrophobicContact CD2-CG2 4.01Å; F1189-V1229 HydrophobicContact CE2-CB 4.4Å; F1189-V1229 HydrophobicContact CE2-CG1 4.07Å; F1189-K1231 HydrophobicContact CZ-CD 4.43Å; F1189-K1231 VanDerWaalsContact CZ-NZ 3.33Å; F1189-K1231 PolarHBondContact O-NZ 3.19Å; F1189-V1299 HydrophobicContact CB-CB 4.5Å; F1189-V1299 HydrophobicContact CB-CG2 4.48Å; F1189-V1299 HydrophobicContact CD1-CB 3.93Å; F1189-V1299 HydrophobicContact CD1-CG2 3.65Å; F1189-V1299 HydrophobicContact CD2-CG2 3.83Å; F1189-V1299 HydrophobicContact CE1-CB 4.32Å; F1189-V1299 HydrophobicContact CE1-CG2 3.69Å; F1189-V1299 HydrophobicContact CE2-CG2 3.89Å; F1189-V1299 HydrophobicContact CG-CB 4.13Å; F1189-V1299 HydrophobicContact CG-CG2 3.72Å; F1189-V1299 HydrophobicContact CZ-CG2 3.81Å; F1189-C1301 HydrophobicContact CD1-CB 3.85Å; F1189-C1301 HydrophobicContact CE1-CB 3.68Å; F1189-W1310 AromaticContact CE2-CD2 3.88Å; F1189-W1310 HydrophobicContact CE2-CD2 3.88Å; F1189-W1310 AromaticContact CE2-CE3 3.44Å; F1189-W1310 HydrophobicContact CE2-CE3 3.44Å; F1189-W1310 VanDerWaalsContact CE2-CE3 3.44Å; F1189-W1310 HydrophobicContact CE2-CH2 4.34Å; F1189-W1310 AromaticContact CE2-CZ3 3.71Å; F1189-W1310 HydrophobicContact CE2-CZ3 3.71Å; F1189-W1310 HydrophobicContact CZ-CB 4.35Å; F1189-W1310 AromaticContact CZ-CD2 3.6Å; F1189-W1310 HydrophobicContact CZ-CD2 3.6Å; F1189-W1310 AromaticContact CZ-CE3 3.7Å; F1189-W1310 HydrophobicContact CZ-CE3 3.7Å; F1189-W1310 AromaticContact CZ-CG 3.91Å; F1189-W1310 HydrophobicContact CZ-CG 3.91Å; F1189-W1310 HydrophobicContact CZ-CZ3 4.23Å; F1189-W1315 HydrophobicContact CB-CH2 4.31Å; F1189-W1315 HydrophobicContact CB-CZ3 4.46Å; F1189-W1315 HydrophobicContact CD2-CD2 4.43Å; F1189-W1315 HydrophobicContact CD2-CE3 4.14Å; F1189-W1315 AromaticContact CD2-CH2 3.81Å; F1189-W1315 HydrophobicContact CD2-CH2 3.81Å; F1189-W1315 HydrophobicContact CD2-CZ2 4.1Å; F1189-W1315 AromaticContact CD2-CZ3 3.81Å; F1189-W1315 HydrophobicContact CD2-CZ3 3.81Å; F1189-W1315 HydrophobicContact CE2-CD2 4.41Å; F1189-W1315 HydrophobicContact CE2-CE3 4.34Å; F1189-W1315 HydrophobicContact CE2-CZ3 4.47Å; F1189-W1315 HydrophobicContact CG-CH2 4.48Å; F1189-W1315 HydrophobicContact CG-CZ3 4.39Å
1190	Q	82.9	Confident	70.3	Confident	64 Å²	64	39.2 Å²	39.2	30%	0.299	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-24.1	173.9	-80.6	170.4	21.5	0	0	113.6	C1186 I1188	C1186-Q1190 WeakPolarHBondContact O-CB 3.37Å; C1186-Q1190 VanDerWaalsContact O-CG 3.25Å; C1186-Q1190 WeakPolarHBondContact O-CG 3.29Å; C1186-Q1190 PolarHBondContact O-N 2.99Å; I1188-Q1190 PolarHBondContact O-N 3.31Å
1191	G	71.9	Confident	67.6	Low	38 Å²	38	46.3 Å²	46.3	39%	0.392	23%	0.234	S	C	.	.			trans	70	104.7	-173.9	0	0	0	0	0	111.4	I1188 F1189	I1188-G1191 PolarHBondContact O-N 3.47Å; F1189-G1191 PolarHBondContact O-N 2.87Å
1192	R	64.4	Low	64.8	Low	104 Å²	104	56 Å²	56	39%	0.392	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	132.2	179.9	-65	-172.9	-178.5	-156.5	-1.9	111.3	V1194 A1227	R1192-V1194 HydrophobicContact CB-CG2 3.89Å; R1192-V1194 PolarHBondContact O-N 3.39Å; R1192-A1227 PolarHBondContact N-O 3.21Å; R1192-A1227 PolarHBondContact O-N 3.28Å
1193	K	55.5	Low	62.1	Low	148 Å²	148	56 Å²	56	64%	0.643	27%	0.273	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.4	100.4	158.4	-73.7	-178.2	171.4	177.8	0	108.3	E1226	K1193-E1226 WeakPolarHBondContact CE-OE1 3.43Å; K1193-E1226 WeakPolarHBondContact CE-OE2 3.3Å; K1193-E1226 HydrophobicContact CG-CB 4.16Å; K1193-E1226 HydrophobicContact CG-CG 3.96Å; K1193-E1226 WeakPolarHBondContact CG-OE1 3.4Å; K1193-E1226 IonicContact NZ-OE2 2.68Å
1194	V	53.8	Low	59.5	Low	21 Å²	21	57.9 Å²	57.9	13%	0.127	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	93.6	178.4	-162.2	0	0	0	0	109	N1111 R1192 F1196 V1225	N1111-V1194 HydrophobicContact CB-CG1 4.04Å; N1111-V1194 HydrophobicContact CB-CG2 4.41Å; N1111-V1194 WeakPolarHBondContact ND2-CG1 3.29Å; R1192-V1194 HydrophobicContact CB-CG2 3.89Å; R1192-V1194 PolarHBondContact O-N 3.39Å; V1194-F1196 HydrophobicContact CB-CD2 4.34Å; V1194-F1196 HydrophobicContact CB-CE2 3.84Å; V1194-F1196 HydrophobicContact CG1-CD2 3.86Å; V1194-F1196 HydrophobicContact CG1-CE2 3.22Å; V1194-F1196 HydrophobicContact CG1-CZ 3.82Å; V1194-F1196 WeakPolarHBondContact O-CD2 3.46Å; V1194-F1196 PolarHBondContact O-N 3.3Å; V1194-V1225 PolarHBondContact N-O 3.04Å; V1194-V1225 PolarHBondContact O-N 3.05Å
1195	G	47.2	Very low	56.8	Low	44 Å²	44	63 Å²	63	45%	0.454	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	112.3	173.7	0	0	0	0	0	112	L1197	G1195-L1197 PolarHBondContact O-N 3.14Å
1196	F	49.2	Very low	54.1	Low	15 Å²	15	67.3 Å²	67.3	7%	0.066	35%	0.345	C	S	.	.			trans	-89.7	35.6	176.8	-79.5	-95.4	0	0	0	113.5	K1110 M1113 F1126 V1194 I1198 F1223	K1110-F1196 HydrophobicContact CD-CE1 4.36Å; M1113-F1196 HydrophobicContact CE-CD2 4.16Å; M1113-F1196 HydrophobicContact CE-CE2 3.27Å; M1113-F1196 HydrophobicContact CE-CZ 3.83Å; F1126-F1196 HydrophobicContact CB-CD1 3.91Å; F1126-F1196 HydrophobicContact CB-CE1 3.76Å; F1126-F1196 HydrophobicContact CB-CE2 4.45Å; F1126-F1196 HydrophobicContact CB-CG 4.32Å; F1126-F1196 HydrophobicContact CB-CZ 4.05Å; F1126-F1196 HydrophobicContact CD1-CE1 4.21Å; F1126-F1196 HydrophobicContact CD1-CZ 4.27Å; F1126-F1196 HydrophobicContact CD2-CD1 4.22Å; F1126-F1196 AromaticContact CD2-CE1 3.81Å; F1126-F1196 HydrophobicContact CD2-CE1 3.81Å; F1126-F1196 HydrophobicContact CE2-CE1 4.49Å; F1126-F1196 HydrophobicContact CG-CD1 4.2Å; F1126-F1196 AromaticContact CG-CE1 3.66Å; F1126-F1196 HydrophobicContact CG-CE1 3.66Å; F1126-F1196 HydrophobicContact CG-CZ 4.08Å; V1194-F1196 HydrophobicContact CB-CD2 4.34Å; V1194-F1196 HydrophobicContact CB-CE2 3.84Å; V1194-F1196 HydrophobicContact CG1-CD2 3.86Å; V1194-F1196 HydrophobicContact CG1-CE2 3.22Å; V1194-F1196 HydrophobicContact CG1-CZ 3.82Å; V1194-F1196 WeakPolarHBondContact O-CD2 3.46Å; V1194-F1196 PolarHBondContact O-N 3.3Å; F1196-I1198 PolarHBondContact O-N 2.69Å; F1196-I1198 VanDerWaalsContact O-N 3.13Å; F1196-F1223 PolarHBondContact N-O 3.49Å
1197	L	40.6	Very low	51.4	Low	59 Å²	59	72.5 Å²	72.5	31%	0.309	37%	0.367	S	S	.	.	H	α-helix	trans	-56.3	-28	177.7	-97.4	159.9	0	0	0	114.1	G1195 R1201	G1195-L1197 PolarHBondContact O-N 3.14Å; L1197-R1201 WeakPolarHBondContact O-CD 3.49Å; L1197-R1201 VanDerWaalsContact O-CG 3.3Å; L1197-R1201 WeakPolarHBondContact O-CG 3.27Å
1198	I	37.1	Very low	48.6	Very low	145 Å²	145	83.5 Å²	83.5	74%	0.744	41%	0.408	S	S	*	.	H	α-helix	trans	-90.3	-32.2	-164.2	-62	176.5	0	0	0	113.7	F1196	F1196-I1198 PolarHBondContact O-N 2.69Å; F1196-I1198 VanDerWaalsContact O-N 3.13Å
1199	Q	38.3	Very low	46	Very low	56 Å²	56	89 Å²	89	26%	0.262	44%	0.438	S	S	.	.	H	α-helix	trans	-97.8	-30.9	-172.6	-149.9	157.2	-6.8	0	0	112.9	T1122 R1201 R1202 S1203	T1122-Q1199 PolarHBondContact O-NE2 3.44Å; Q1199-R1201 VanDerWaalsContact C-N 3.34Å; Q1199-R1201 PolarHBondContact O-N 3.15Å; Q1199-R1202 PolarHBondContact O-N 3.41Å; Q1199-S1203 PolarHBondContact O-N 2.87Å
1200	Q	38.2	Very low	43.3	Very low	49 Å²	49	94.6 Å²	94.6	23%	0.229	47%	0.472	C	S	.	.	H	α-helix	trans	-57.3	-46.4	168.4	-72.2	-104.4	6.7	0	0	111	R1202 S1203 S1204 F1223	Q1200-R1202 PolarHBondContact O-N 3.07Å; Q1200-S1203 PolarHBondContact O-N 3.05Å; Q1200-S1203 PolarHBondContact O-OG 2.75Å; Q1200-S1204 PolarHBondContact O-N 3.26Å; Q1200-S1204 PolarHBondContact O-OG 3.13Å; Q1200-F1223 HydrophobicContact CB-CE1 4.3Å; Q1200-F1223 HydrophobicContact CB-CZ 4.43Å; Q1200-F1223 HydrophobicContact CG-CD1 3.95Å; Q1200-F1223 HydrophobicContact CG-CE1 3.87Å; Q1200-F1223 HydrophobicContact CG-CZ 4.49Å; Q1200-F1223 VanDerWaalsContact OE1-CE1 3.28Å
1201	R	34.2	Very low	41	Very low	149 Å²	149	96.9 Å²	96.9	56%	0.562	49%	0.487	S	S	*	.	H	α-helix	trans	-58.3	-14.4	176.7	-77.4	-176.3	-179.6	-171.7	2.6	115	L1197 Q1199 I1205 E1220	L1197-R1201 WeakPolarHBondContact O-CD 3.49Å; L1197-R1201 VanDerWaalsContact O-CG 3.3Å; L1197-R1201 WeakPolarHBondContact O-CG 3.27Å; Q1199-R1201 VanDerWaalsContact C-N 3.34Å; Q1199-R1201 PolarHBondContact O-N 3.15Å; R1201-I1205 WeakPolarHBondContact O-CD1 3.5Å; R1201-I1205 WeakPolarHBondContact O-CG1 3.25Å; R1201-E1220 IonicContact CZ-OE1 3.88Å; R1201-E1220 IonicContact NH2-OE1 2.74Å; R1201-E1220 PolarHBondContact NH2-OE1 2.91Å
1202	R	34.7	Very low	39.3	Very low	202 Å²	202	97.2 Å²	97.2	76%	0.762	49%	0.486	S	S	*	.	H	α-helix	trans	-95.1	-35.2	171.9	-85.9	-177.2	167.9	163.3	-3.1	113.3	Q1199 Q1200 S1204 I1205	Q1199-R1202 PolarHBondContact O-N 3.41Å; Q1200-R1202 PolarHBondContact O-N 3.07Å; R1202-S1204 VanDerWaalsContact C-N 3.34Å; R1202-S1204 PolarHBondContact O-N 2.96Å; R1202-I1205 PolarHBondContact O-N 3.27Å
1203	S	35.8	Very low	37.8	Very low	18 Å²	18	99.6 Å²	99.6	13%	0.126	50%	0.499	C	S	.	.	H	α-helix	trans	-77.8	-15.9	179.8	83.7	0	0	0	0	114.3	R1125 Q1199 Q1200 I1205 S1206	R1125-S1203 PolarHBondContact NE-OG 3.09Å; R1125-S1203 VanDerWaalsContact NE-OG 3.08Å; R1125-S1203 PolarHBondContact NH2-OG 3.06Å; Q1199-S1203 PolarHBondContact O-N 2.87Å; Q1200-S1203 PolarHBondContact O-N 3.05Å; Q1200-S1203 PolarHBondContact O-OG 2.75Å; S1203-I1205 VanDerWaalsContact C-N 3.34Å; S1203-S1206 PolarHBondContact O-OG 3.4Å; S1203-S1206 VanDerWaalsContact O-OG 3.08Å
1204	S	33.6	Very low	36.8	Very low	70 Å²	70	101.6 Å²	101.6	49%	0.49	51%	0.51	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-3.7	169.6	53.6	0	0	0	0	113.6	Q1200 R1202	Q1200-S1204 PolarHBondContact O-N 3.26Å; Q1200-S1204 PolarHBondContact O-OG 3.13Å; R1202-S1204 VanDerWaalsContact C-N 3.34Å; R1202-S1204 PolarHBondContact O-N 2.96Å
1205	I	33	Very low	35.9	Very low	109 Å²	109	105.1 Å²	105.1	56%	0.559	53%	0.528	S	S	*	.	S	Bend	trans	-88.1	-20.5	175.7	-67.2	174.4	0	0	0	111.7	R1201 R1202 S1203	R1201-I1205 WeakPolarHBondContact O-CD1 3.5Å; R1201-I1205 WeakPolarHBondContact O-CG1 3.25Å; R1202-I1205 PolarHBondContact O-N 3.27Å; S1203-I1205 VanDerWaalsContact C-N 3.34Å
1206	S	33.8	Very low	35.7	Very low	89 Å²	89	105.7 Å²	105.7	62%	0.622	53%	0.526	S	S	*	.	S	Bend	trans	-77.2	-19.3	177.6	51.1	0	0	0	0	114	S1203 R1208	S1203-S1206 PolarHBondContact O-OG 3.4Å; S1203-S1206 VanDerWaalsContact O-OG 3.08Å; S1206-R1208 VanDerWaalsContact C-N 3.35Å; S1206-R1208 PolarHBondContact O-N 3.47Å; S1206-R1208 VanDerWaalsContact O-N 3.08Å
1207	E	34	Very low	35.4	Very low	131 Å²	131	107.3 Å²	107.3	61%	0.612	55%	0.547	S	S	*	.	S	Bend	trans	-74.3	93	161.6	-76.8	167.8	-143.7	0	0	107.6	N1209	E1207-N1209 PolarHBondContact O-N 3.02Å
1208	R	27.9	Very low	35.8	Very low	235 Å²	235	108 Å²	108	89%	0.887	55%	0.553	S	S	*	*			trans	-70.7	71.5	-177.5	-78.8	-176	-85.9	173.6	-7.9	111.9	S1206	S1206-R1208 VanDerWaalsContact C-N 3.35Å; S1206-R1208 PolarHBondContact O-N 3.47Å; S1206-R1208 VanDerWaalsContact O-N 3.08Å
1209	N	31.2	Very low	36.9	Very low	122 Å²	122	103.7 Å²	103.7	65%	0.652	53%	0.531	S	S	*	.			trans	-140.7	113.5	158.3	-92.5	-23.4	0	0	0	108.8	E1207 D1211 A1212	E1207-N1209 PolarHBondContact O-N 3.02Å; N1209-D1211 PolarHBondContact O-N 3.05Å; N1209-D1211 VanDerWaalsContact O-N 3.16Å; N1209-A1212 VanDerWaalsContact O-CB 3.32Å; N1209-A1212 WeakPolarHBondContact O-CB 3.43Å; N1209-A1212 PolarHBondContact O-N 2.74Å; N1209-A1212 VanDerWaalsContact O-N 3.13Å
1210	T	32	Very low	38.1	Very low	118 Å²	118	105.8 Å²	105.8	72%	0.724	54%	0.541	S	S	*	.	G	3₁₀ helix	trans	-60.6	-24	-178.9	29.6	0	0	0	0	113.4	A1212 K1213	T1210-A1212 PolarHBondContact O-N 3.16Å; T1210-K1213 PolarHBondContact O-N 2.7Å
1211	D	35.4	Very low	39.7	Very low	113 Å²	113	109.5 Å²	109.5	60%	0.604	56%	0.557	S	S	*	*	G	3₁₀ helix	trans	-72.8	-15.2	-179.6	-50	-30.4	0	0	0	112.8	N1209 K1213 N1215	N1209-D1211 PolarHBondContact O-N 3.05Å; N1209-D1211 VanDerWaalsContact O-N 3.16Å; D1211-K1213 PolarHBondContact O-N 3.24Å; D1211-N1215 PolarHBondContact O-N 2.62Å
1212	A	35.2	Very low	41.4	Very low	45 Å²	45	103.2 Å²	103.2	37%	0.372	54%	0.538	S	S	.	.	G	3₁₀ helix	trans	-65.9	-17.6	175.7	0	0	0	0	0	113.4	N1209 T1210 N1215 S1216	N1209-A1212 VanDerWaalsContact O-CB 3.32Å; N1209-A1212 WeakPolarHBondContact O-CB 3.43Å; N1209-A1212 PolarHBondContact O-N 2.74Å; N1209-A1212 VanDerWaalsContact O-N 3.13Å; T1210-A1212 PolarHBondContact O-N 3.16Å; A1212-N1215 CarbonylContact O-C 3.51Å; A1212-S1216 WeakPolarHBondContact O-CA 3.34Å; A1212-S1216 VanDerWaalsContact O-CB 3.3Å; A1212-S1216 WeakPolarHBondContact O-CB 3.4Å; A1212-S1216 PolarHBondContact O-N 3.39Å
1213	K	34	Very low	43	Very low	154 Å²	154	95.7 Å²	95.7	67%	0.67	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-53.5	-179.5	-77.7	-177.9	177.7	174.4	0	112.7	T1210 D1211 N1215 S1216	T1210-K1213 PolarHBondContact O-N 2.7Å; D1211-K1213 PolarHBondContact O-N 3.24Å; K1213-N1215 VanDerWaalsContact C-N 3.32Å; K1213-S1216 WeakPolarHBondContact O-CB 3.21Å; K1213-S1216 PolarHBondContact O-N 3.09Å; K1213-S1216 PolarHBondContact O-OG 3.01Å
1214	Q	33.2	Very low	44.7	Very low	190 Å²	190	97 Å²	97	89%	0.888	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-36.1	175.7	-79.7	-178.6	-31.8	0	0	111.2	S1216	Q1214-S1216 PolarHBondContact O-N 2.87Å
1215	N	35.6	Very low	46.4	Very low	94 Å²	94	93.9 Å²	93.9	50%	0.503	50%	0.496	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	9.1	174.9	-78.6	-38.8	0	0	0	114.8	D1211 A1212 K1213 R1260	D1211-N1215 PolarHBondContact O-N 2.62Å; A1212-N1215 CarbonylContact O-C 3.51Å; K1213-N1215 VanDerWaalsContact C-N 3.32Å; N1215-R1260 PolarHBondContact O-NH1 2.7Å; N1215-R1260 VanDerWaalsContact O-NH1 3.13Å; N1215-R1260 PolarHBondContact O-NH2 2.9Å
1216	S	43.4	Very low	48.3	Very low	57 Å²	57	91.6 Å²	91.6	40%	0.399	48%	0.483	S	S	.	.			trans	-75.2	-42.5	-174.3	59.7	0	0	0	0	113.2	A1212 K1213 Q1214 V1218 R1260	A1212-S1216 WeakPolarHBondContact O-CA 3.34Å; A1212-S1216 VanDerWaalsContact O-CB 3.3Å; A1212-S1216 WeakPolarHBondContact O-CB 3.4Å; A1212-S1216 PolarHBondContact O-N 3.39Å; K1213-S1216 WeakPolarHBondContact O-CB 3.21Å; K1213-S1216 PolarHBondContact O-N 3.09Å; K1213-S1216 PolarHBondContact O-OG 3.01Å; Q1214-S1216 PolarHBondContact O-N 2.87Å; S1216-V1218 WeakPolarHBondContact O-CG2 3.44Å; S1216-V1218 PolarHBondContact O-N 2.93Å; S1216-V1218 VanDerWaalsContact O-N 3.1Å; S1216-R1260 PolarHBondContact O-NE 2.9Å; S1216-R1260 PolarHBondContact O-NH2 3.39Å
1217	G	42.9	Very low	50.6	Low	49 Å²	49	88 Å²	88	51%	0.505	46%	0.459	S	S	.	.			trans	59.3	19.8	171.3	0	0	0	0	0	115.8
1218	V	47.6	Very low	53.2	Low	72 Å²	72	81.8 Å²	81.8	44%	0.436	43%	0.43	S	S	.	.			trans	-85.5	123.3	-173.2	-162.3	0	0	0	0	111.1	S1216 E1220 F1223	S1216-V1218 WeakPolarHBondContact O-CG2 3.44Å; S1216-V1218 PolarHBondContact O-N 2.93Å; S1216-V1218 VanDerWaalsContact O-N 3.1Å; V1218-E1220 PolarHBondContact O-N 2.86Å; V1218-E1220 VanDerWaalsContact O-N 3.16Å; V1218-F1223 HydrophobicContact CB-CE2 3.95Å; V1218-F1223 HydrophobicContact CB-CZ 4.09Å; V1218-F1223 HydrophobicContact CG1-CD2 4.36Å; V1218-F1223 HydrophobicContact CG1-CE1 4.2Å; V1218-F1223 HydrophobicContact CG1-CE2 3.49Å; V1218-F1223 VanDerWaalsContact CG1-CE2 3.49Å; V1218-F1223 HydrophobicContact CG1-CZ 3.42Å; V1218-F1223 VanDerWaalsContact CG1-CZ 3.42Å; V1218-F1223 HydrophobicContact CG2-CZ 4.36Å
1219	N	60.8	Low	56.2	Low	55 Å²	55	70.8 Å²	70.8	29%	0.294	39%	0.389	S	S	.	.			trans	-63.4	112.1	170.7	-178.1	-8.9	0	0	0	109.8	K1221 G1222 H1242	N1219-K1221 PolarHBondContact O-N 3.41Å; N1219-K1221 WeakPolarHBondContact OD1-CB 3.49Å; N1219-K1221 PolarHBondContact OD1-N 3.05Å; N1219-K1221 VanDerWaalsContact OD1-N 3.13Å; N1219-G1222 PolarHBondContact O-N 3.15Å; N1219-H1242 PolarHBondContact ND2-CD2 3.31Å; N1219-H1242 PolarHBondContact ND2-CE1 3.35Å; N1219-H1242 PolarHBondContact ND2-ND1 3.23Å
1220	E	64.3	Low	59	Low	101 Å²	101	66.7 Å²	66.7	47%	0.472	37%	0.367	S	S	.	.	G	3₁₀ helix	trans	-58.7	-24.8	-176.6	-65.6	-160.7	133.6	0	0	113.1	R1201 V1218 G1222 F1223	R1201-E1220 IonicContact CZ-OE1 3.88Å; R1201-E1220 IonicContact NH2-OE1 2.74Å; R1201-E1220 PolarHBondContact NH2-OE1 2.91Å; V1218-E1220 PolarHBondContact O-N 2.86Å; V1218-E1220 VanDerWaalsContact O-N 3.16Å; E1220-G1222 PolarHBondContact O-N 3.01Å; E1220-F1223 PolarHBondContact O-N 3.36Å; E1220-F1223 VanDerWaalsContact O-N 3.15Å
1221	K	70.2	Confident	61.6	Low	126 Å²	126	64.8 Å²	64.8	55%	0.548	35%	0.349	S	S	.	.	G	3₁₀ helix	trans	-62.4	-29	173.8	-62.2	179.9	176.2	-178.2	0	113	N1219 F1223 V1224 N1240 H1242	N1219-K1221 PolarHBondContact O-N 3.41Å; N1219-K1221 WeakPolarHBondContact OD1-CB 3.49Å; N1219-K1221 PolarHBondContact OD1-N 3.05Å; N1219-K1221 VanDerWaalsContact OD1-N 3.13Å; K1221-F1223 PolarHBondContact O-N 3.09Å; K1221-V1224 WeakPolarHBondContact O-CB 3.32Å; K1221-V1224 PolarHBondContact O-N 2.87Å; K1221-V1224 VanDerWaalsContact O-N 3.09Å; K1221-N1240 PolarHBondContact O-ND2 3.47Å; K1221-N1240 VanDerWaalsContact O-ND2 3.14Å; K1221-H1242 HydrophobicContact CB-CB 4.29Å; K1221-H1242 WeakPolarHBondContact CD-CD2 3.32Å; K1221-H1242 WeakPolarHBondContact CD-NE2 3.21Å
1222	G	69.9	Low	64.2	Low	17 Å²	17	67.2 Å²	67.2	18%	0.175	36%	0.356	C	S	.	.	G	3₁₀ helix	trans	-66.6	-20.4	176.3	0	0	0	0	0	113.7	N1219 E1220 H1242 N1243	N1219-G1222 PolarHBondContact O-N 3.15Å; E1220-G1222 PolarHBondContact O-N 3.01Å; G1222-H1242 WeakPolarHBondContact CA-O 3.3Å; G1222-N1243 WeakPolarHBondContact O-CB 3.45Å
1223	F	68.6	Low	67	Low	45 Å²	45	66.1 Å²	66.1	20%	0.197	35%	0.345	C	S	.	.	G	3₁₀ helix	trans	-89.7	-2.1	173.4	-60.3	-50.6	0	0	0	114	F1196 Q1200 V1218 E1220 K1221 V1225	F1196-F1223 PolarHBondContact N-O 3.49Å; Q1200-F1223 HydrophobicContact CB-CE1 4.3Å; Q1200-F1223 HydrophobicContact CB-CZ 4.43Å; Q1200-F1223 HydrophobicContact CG-CD1 3.95Å; Q1200-F1223 HydrophobicContact CG-CE1 3.87Å; Q1200-F1223 HydrophobicContact CG-CZ 4.49Å; Q1200-F1223 VanDerWaalsContact OE1-CE1 3.28Å; V1218-F1223 HydrophobicContact CB-CE2 3.95Å; V1218-F1223 HydrophobicContact CB-CZ 4.09Å; V1218-F1223 HydrophobicContact CG1-CD2 4.36Å; V1218-F1223 HydrophobicContact CG1-CE1 4.2Å; V1218-F1223 HydrophobicContact CG1-CE2 3.49Å; V1218-F1223 VanDerWaalsContact CG1-CE2 3.49Å; V1218-F1223 HydrophobicContact CG1-CZ 3.42Å; V1218-F1223 VanDerWaalsContact CG1-CZ 3.42Å; V1218-F1223 HydrophobicContact CG2-CZ 4.36Å; E1220-F1223 PolarHBondContact O-N 3.36Å; E1220-F1223 VanDerWaalsContact O-N 3.15Å; K1221-F1223 PolarHBondContact O-N 3.09Å; F1223-V1225 PolarHBondContact O-N 3.49Å
1224	V	71.7	Confident	69.8	Low	44 Å²	44	58.8 Å²	58.8	27%	0.267	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	99.2	172.2	-175.4	0	0	0	0	108	K1221 E1226 N1240 N1243	K1221-V1224 WeakPolarHBondContact O-CB 3.32Å; K1221-V1224 PolarHBondContact O-N 2.87Å; K1221-V1224 VanDerWaalsContact O-N 3.09Å; V1224-E1226 PolarHBondContact O-N 2.74Å; V1224-N1240 PolarHBondContact O-ND2 2.79Å; V1224-N1240 VanDerWaalsContact O-ND2 3.1Å; V1224-N1243 PolarHBondContact O-ND2 3.39Å
1225	V	69	Low	72.7	Confident	5 Å²	5	49.8 Å²	49.8	3%	0.03	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	103.2	172.5	-175.2	0	0	0	0	107.6	M1113 V1194 F1223	M1113-V1225 HydrophobicContact CE-CB 4.19Å; M1113-V1225 HydrophobicContact CE-CG1 4.03Å; M1113-V1225 HydrophobicContact SD-CG1 3.85Å; V1194-V1225 PolarHBondContact N-O 3.04Å; V1194-V1225 PolarHBondContact O-N 3.05Å; F1223-V1225 PolarHBondContact O-N 3.49Å
1226	E	74.1	Confident	75.4	Confident	61 Å²	61	45.4 Å²	45.4	29%	0.285	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	133.7	164.1	-174.2	153.2	-149	0	0	108.9	K1193 V1224 F1237 G1238 G1239	K1193-E1226 WeakPolarHBondContact CE-OE1 3.43Å; K1193-E1226 WeakPolarHBondContact CE-OE2 3.3Å; K1193-E1226 HydrophobicContact CG-CB 4.16Å; K1193-E1226 HydrophobicContact CG-CG 3.96Å; K1193-E1226 WeakPolarHBondContact CG-OE1 3.4Å; K1193-E1226 IonicContact NZ-OE2 2.68Å; V1224-E1226 PolarHBondContact O-N 2.74Å; E1226-F1237 HydrophobicContact CG-CE2 4.49Å; E1226-G1238 CarbonylContact O-C 3.43Å; E1226-G1238 WeakPolarHBondContact O-CA 3.28Å; E1226-G1239 PolarHBondContact O-N 2.95Å
1227	A	82.2	Confident	77.7	Confident	14 Å²	14	45.9 Å²	45.9	12%	0.116	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	137.3	172.2	0	0	0	0	0	109.2	R1192 F1237	R1192-A1227 PolarHBondContact N-O 3.21Å; R1192-A1227 PolarHBondContact O-N 3.28Å; A1227-F1237 WeakPolarHBondContact CA-O 3.43Å
1228	G	88.1	Confident	79.8	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.1	-179.6	-173.3	0	0	0	0	0	113.5	I1188 V1236 F1237	I1188-G1228 WeakPolarHBondContact O-CA 3.41Å; G1228-V1236 WeakPolarHBondContact O-CA 3.37Å; G1228-F1237 PolarHBondContact N-O 2.84Å; G1228-F1237 PolarHBondContact O-N 2.94Å
1229	V	90.1	Very high	81.6	Confident	4 Å²	4	40.6 Å²	40.6	2%	0.024	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	119.6	174.5	178.1	0	0	0	0	108.4	I1188 F1189 K1231 G1234 F1235 V1236 W1310 W1315	I1188-V1229 HydrophobicContact CG2-CG2 4.28Å; F1189-V1229 HydrophobicContact CB-CG2 4.45Å; F1189-V1229 HydrophobicContact CD2-CB 3.89Å; F1189-V1229 HydrophobicContact CD2-CG1 3.94Å; F1189-V1229 HydrophobicContact CD2-CG2 4.01Å; F1189-V1229 HydrophobicContact CE2-CB 4.4Å; F1189-V1229 HydrophobicContact CE2-CG1 4.07Å; V1229-K1231 WeakPolarHBondContact O-CD 3.36Å; V1229-K1231 WeakPolarHBondContact O-CE 3.5Å; V1229-K1231 PolarHBondContact O-N 3.23Å; V1229-K1231 PolarHBondContact O-NZ 3.24Å; V1229-G1234 WeakPolarHBondContact CG1-O 3.31Å; V1229-F1235 CarbonylContact C-O 3.59Å; V1229-F1235 WeakPolarHBondContact CA-O 3.49Å; V1229-V1236 HydrophobicContact CG2-CG2 4.28Å; V1229-W1310 HydrophobicContact CG1-CZ3 4.42Å; V1229-W1315 HydrophobicContact CB-CZ2 4.31Å; V1229-W1315 HydrophobicContact CG1-CZ2 3.8Å; V1229-W1315 HydrophobicContact CG2-CH2 4.02Å; V1229-W1315 HydrophobicContact CG2-CZ2 3.56Å
1230	D	90.4	Very high	82.8	Confident	36 Å²	36	38.9 Å²	38.9	19%	0.193	19%	0.194	C	C	.	.			trans	-63.1	128.1	175.9	169.5	23.2	0	0	0	109.1	Q1232 T1233 G1234 F1235 F1237	D1230-Q1232 VanDerWaalsContact C-N 3.29Å; D1230-Q1232 PolarHBondContact O-N 3.09Å; D1230-Q1232 PolarHBondContact OD1-N 2.77Å; D1230-T1233 WeakPolarHBondContact CB-OG1 3.44Å; D1230-T1233 WeakPolarHBondContact OD2-CB 3.43Å; D1230-T1233 VanDerWaalsContact OD2-CG2 3.3Å; D1230-T1233 WeakPolarHBondContact OD2-CG2 3.29Å; D1230-T1233 PolarHBondContact OD2-N 2.97Å; D1230-T1233 PolarHBondContact OD2-OG1 3.24Å; D1230-G1234 WeakPolarHBondContact O-CA 3.47Å; D1230-G1234 PolarHBondContact O-N 2.68Å; D1230-F1235 PolarHBondContact N-O 2.89Å; D1230-F1237 HydrophobicContact CB-CD1 4.2Å
1231	K	87.7	Confident	83.8	Confident	79 Å²	79	37.6 Å²	37.6	34%	0.343	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-17.4	-176.2	-55.6	-50.1	179.2	-163.1	0	113	F1189 V1229 W1310 K1318	F1189-K1231 HydrophobicContact CZ-CD 4.43Å; F1189-K1231 VanDerWaalsContact CZ-NZ 3.33Å; F1189-K1231 PolarHBondContact O-NZ 3.19Å; V1229-K1231 WeakPolarHBondContact O-CD 3.36Å; V1229-K1231 WeakPolarHBondContact O-CE 3.5Å; V1229-K1231 PolarHBondContact O-N 3.23Å; V1229-K1231 PolarHBondContact O-NZ 3.24Å; K1231-W1310 HydrophobicContact CB-CZ2 4.29Å; K1231-W1310 HydrophobicContact CD-CH2 4.25Å; K1231-W1310 HydrophobicContact CD-CZ2 4.14Å; K1231-W1310 WeakPolarHBondContact O-CH2 3.37Å; K1231-W1310 WeakPolarHBondContact O-CZ2 3.49Å; K1231-K1318 PolarHBondContact O-NZ 3.2Å
1232	Q	89.6	Confident	84.4	Confident	163 Å²	163	33.9 Å²	33.9	76%	0.762	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-67.6	174.4	-59	-171.6	6.7	0	0	110.3	D1230 K1318	D1230-Q1232 VanDerWaalsContact C-N 3.29Å; D1230-Q1232 PolarHBondContact O-N 3.09Å; D1230-Q1232 PolarHBondContact OD1-N 2.77Å; Q1232-K1318 PolarHBondContact O-NZ 2.98Å; Q1232-K1318 VanDerWaalsContact O-NZ 3.11Å
1233	T	93.1	Very high	85	Confident	23 Å²	23	33.4 Å²	33.4	14%	0.141	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78	-23.5	-175.7	61.1	0	0	0	0	114.7	D1230 F1235 K1318 I1319 A1322	D1230-T1233 WeakPolarHBondContact CB-OG1 3.44Å; D1230-T1233 WeakPolarHBondContact OD2-CB 3.43Å; D1230-T1233 VanDerWaalsContact OD2-CG2 3.3Å; D1230-T1233 WeakPolarHBondContact OD2-CG2 3.29Å; D1230-T1233 PolarHBondContact OD2-N 2.97Å; D1230-T1233 PolarHBondContact OD2-OG1 3.24Å; T1233-F1235 HydrophobicContact CG2-CD2 4.08Å; T1233-F1235 HydrophobicContact CG2-CE2 3.95Å; T1233-F1235 HydrophobicContact CG2-CZ 4.36Å; T1233-F1235 PolarHBondContact O-N 3.3Å; T1233-F1235 WeakPolarHBondContact OG1-CB 3.37Å; T1233-F1235 WeakPolarHBondContact OG1-CD2 3.45Å; T1233-F1235 VanDerWaalsContact OG1-CG 3.27Å; T1233-F1235 WeakPolarHBondContact OG1-CG 3.46Å; T1233-F1235 PolarHBondContact OG1-N 2.82Å; T1233-F1235 VanDerWaalsContact OG1-N 3.15Å; T1233-K1318 CarbonylContact O-C 3.59Å; T1233-K1318 VanDerWaalsContact O-O 3.08Å; T1233-I1319 WeakPolarHBondContact O-CA 3.28Å; T1233-I1319 PolarHBondContact O-N 3.07Å; T1233-A1322 HydrophobicContact CG2-CB 3.99Å
1234	G	92.5	Very high	85.8	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.161	C	C	.	.			trans	77.5	1.6	-169	0	0	0	0	0	114.2	V1229 D1230 W1315 I1319	V1229-G1234 WeakPolarHBondContact CG1-O 3.31Å; D1230-G1234 WeakPolarHBondContact O-CA 3.47Å; D1230-G1234 PolarHBondContact O-N 2.68Å; G1234-W1315 PolarHBondContact O-NE1 3.38Å; G1234-I1319 WeakPolarHBondContact O-CG1 3.47Å
1235	F	95.3	Very high	86.4	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.149	C	C	.	.			trans	-69.6	143.5	-179.4	-61.1	-17.7	0	0	0	112.5	V1229 D1230 T1233 F1237 V1275 I1319 A1322 F1323 F1327 V1357	V1229-F1235 CarbonylContact C-O 3.59Å; V1229-F1235 WeakPolarHBondContact CA-O 3.49Å; D1230-F1235 PolarHBondContact N-O 2.89Å; T1233-F1235 HydrophobicContact CG2-CD2 4.08Å; T1233-F1235 HydrophobicContact CG2-CE2 3.95Å; T1233-F1235 HydrophobicContact CG2-CZ 4.36Å; T1233-F1235 PolarHBondContact O-N 3.3Å; T1233-F1235 WeakPolarHBondContact OG1-CB 3.37Å; T1233-F1235 WeakPolarHBondContact OG1-CD2 3.45Å; T1233-F1235 VanDerWaalsContact OG1-CG 3.27Å; T1233-F1235 WeakPolarHBondContact OG1-CG 3.46Å; T1233-F1235 PolarHBondContact OG1-N 2.82Å; T1233-F1235 VanDerWaalsContact OG1-N 3.15Å; F1235-F1237 PolarHBondContact O-N 3.47Å; F1235-V1275 HydrophobicContact CB-CG2 3.92Å; F1235-V1275 HydrophobicContact CD1-CG1 3.56Å; F1235-V1275 HydrophobicContact CD1-CG2 4.3Å; F1235-V1275 HydrophobicContact CE1-CG1 3.96Å; F1235-V1275 HydrophobicContact CG-CG1 4.17Å; F1235-V1275 HydrophobicContact CG-CG2 4.07Å; F1235-I1319 HydrophobicContact CD1-CG1 4.45Å; F1235-I1319 HydrophobicContact CD1-CG2 4.12Å; F1235-I1319 HydrophobicContact CE1-CG2 4.08Å; F1235-A1322 HydrophobicContact CE1-CB 3.84Å; F1235-A1322 HydrophobicContact CZ-CB 3.7Å; F1235-F1323 HydrophobicContact CE1-CB 4.45Å; F1235-F1327 HydrophobicContact CD2-CE2 4.14Å; F1235-F1327 HydrophobicContact CE1-CE2 4.36Å; F1235-F1327 HydrophobicContact CE2-CD2 4.27Å; F1235-F1327 AromaticContact CE2-CE2 3.7Å; F1235-F1327 HydrophobicContact CE2-CE2 3.7Å; F1235-F1327 HydrophobicContact CZ-CD2 4.16Å; F1235-F1327 AromaticContact CZ-CE2 3.83Å; F1235-F1327 HydrophobicContact CZ-CE2 3.83Å; F1235-V1357 HydrophobicContact CE2-CG1 4.49Å
1236	V	92.6	Very high	87.4	Confident	3 Å²	3	29.6 Å²	29.6	2%	0.018	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	118	169.3	-179.8	0	0	0	0	109.1	W1133 I1188 G1228 V1229 S1270 I1274	W1133-V1236 HydrophobicContact CH2-CG2 3.85Å; W1133-V1236 HydrophobicContact CZ2-CB 4.31Å; W1133-V1236 HydrophobicContact CZ2-CG1 3.91Å; W1133-V1236 HydrophobicContact CZ2-CG2 3.44Å; W1133-V1236 VanDerWaalsContact CZ2-CG2 3.44Å; I1188-V1236 HydrophobicContact CG2-CG1 4.38Å; G1228-V1236 WeakPolarHBondContact O-CA 3.37Å; V1229-V1236 HydrophobicContact CG2-CG2 4.28Å; V1236-S1270 WeakPolarHBondContact O-CA 3.43Å; V1236-I1274 HydrophobicContact CB-CG2 4.17Å; V1236-I1274 HydrophobicContact CG1-CG2 3.97Å
1237	F	91	Very high	88.3	Confident	66 Å²	66	27 Å²	27	29%	0.289	14%	0.135	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	171.9	178.6	76.6	-89.7	0	0	0	111.6	E1226 A1227 G1228 D1230 F1235 G1269	E1226-F1237 HydrophobicContact CG-CE2 4.49Å; A1227-F1237 WeakPolarHBondContact CA-O 3.43Å; G1228-F1237 PolarHBondContact N-O 2.84Å; G1228-F1237 PolarHBondContact O-N 2.94Å; D1230-F1237 HydrophobicContact CB-CD1 4.2Å; F1235-F1237 PolarHBondContact O-N 3.47Å; F1237-G1269 WeakPolarHBondContact CA-O 3.28Å
1238	G	87.2	Confident	88.7	Confident	2 Å²	2	26.3 Å²	26.3	2%	0.021	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	151.7	-171.2	178.8	0	0	0	0	0	113.4	R1129 E1226 D1268 G1269	R1129-G1238 VanDerWaalsContact CZ-O 3.26Å; R1129-G1238 PolarHBondContact NH1-O 2.79Å; R1129-G1238 PolarHBondContact NH2-O 2.98Å; E1226-G1238 CarbonylContact O-C 3.43Å; E1226-G1238 WeakPolarHBondContact O-CA 3.28Å; G1238-D1268 CarbonylContact O-C 3.55Å; G1238-D1268 VanDerWaalsContact O-CA 3.31Å; G1238-D1268 WeakPolarHBondContact O-CA 3.44Å; G1238-G1269 PolarHBondContact N-O 3.39Å; G1238-G1269 VanDerWaalsContact N-O 3.16Å; G1238-G1269 PolarHBondContact O-N 3.49Å
1239	G	84.8	Confident	88.7	Confident	8 Å²	8	28.4 Å²	28.4	8%	0.082	14%	0.141	C	C	.	.			trans	78.2	-177.3	-171	0	0	0	0	0	113.1	E1226 N1243	E1226-G1239 PolarHBondContact O-N 2.95Å; G1239-N1243 WeakPolarHBondContact CA-OD1 3.49Å
1240	N	86	Confident	88.6	Confident	20 Å²	20	29.8 Å²	29.8	11%	0.107	15%	0.147	C	C	.	.			trans	-159.7	169.3	167.1	64.2	57.5	0	0	0	108.6	K1221 V1224 H1242 N1243	K1221-N1240 PolarHBondContact O-ND2 3.47Å; K1221-N1240 VanDerWaalsContact O-ND2 3.14Å; V1224-N1240 PolarHBondContact O-ND2 2.79Å; V1224-N1240 VanDerWaalsContact O-ND2 3.1Å; N1240-H1242 PolarHBondContact O-N 3.32Å; N1240-H1242 WeakPolarHBondContact OD1-CA 3.36Å; N1240-H1242 WeakPolarHBondContact OD1-CB 3.23Å; N1240-H1242 PolarHBondContact OD1-N 3.34Å; N1240-N1243 PolarHBondContact N-ND2 3.05Å; N1240-N1243 PolarHBondContact N-OD1 3.45Å; N1240-N1243 VanDerWaalsContact N-OD1 3.11Å; N1240-N1243 PolarHBondContact ND2-ND2 3.08Å; N1240-N1243 PolarHBondContact O-N 3.39Å; N1240-N1243 PolarHBondContact O-OD1 3.28Å; N1240-N1243 PolarHBondContact OD1-N 2.81Å
1241	Q	85.8	Confident	88.4	Confident	73 Å²	73	31.3 Å²	31.3	34%	0.341	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-16.3	-178.7	-77.3	178.4	23	0	0	116.1	E1360 V1361	Q1241-E1360 HydrophobicContact CG-CB 3.96Å; Q1241-E1360 WeakPolarHBondContact CG-OE2 3.05Å; Q1241-E1360 PolarHBondContact NE2-OE2 2.93Å; Q1241-V1361 HydrophobicContact CG-CG2 3.85Å; Q1241-V1361 VanDerWaalsContact NE2-CG2 3.3Å
1242	H	82.6	Confident	88.2	Confident	48 Å²	48	27.8 Å²	27.8	22%	0.222	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.9	1.7	-176.9	-50	-53.8	0	0	0	113.8	N1219 K1221 G1222 N1240	N1219-H1242 PolarHBondContact ND2-CD2 3.31Å; N1219-H1242 PolarHBondContact ND2-CE1 3.35Å; N1219-H1242 PolarHBondContact ND2-ND1 3.23Å; K1221-H1242 HydrophobicContact CB-CB 4.29Å; K1221-H1242 WeakPolarHBondContact CD-CD2 3.32Å; K1221-H1242 WeakPolarHBondContact CD-NE2 3.21Å; G1222-H1242 WeakPolarHBondContact CA-O 3.3Å; N1240-H1242 PolarHBondContact O-N 3.32Å; N1240-H1242 WeakPolarHBondContact OD1-CA 3.36Å; N1240-H1242 WeakPolarHBondContact OD1-CB 3.23Å; N1240-H1242 PolarHBondContact OD1-N 3.34Å
1243	N	83	Confident	88	Confident	8 Å²	8	22.8 Å²	22.8	4%	0.043	12%	0.123	C	C	.	.			trans	-124.9	160.7	172.5	67.1	49.8	0	0	0	111.3	G1222 V1224 G1239 N1240 A1263 P1266	G1222-N1243 WeakPolarHBondContact O-CB 3.45Å; V1224-N1243 PolarHBondContact O-ND2 3.39Å; G1239-N1243 WeakPolarHBondContact CA-OD1 3.49Å; N1240-N1243 PolarHBondContact N-ND2 3.05Å; N1240-N1243 PolarHBondContact N-OD1 3.45Å; N1240-N1243 VanDerWaalsContact N-OD1 3.11Å; N1240-N1243 PolarHBondContact ND2-ND2 3.08Å; N1240-N1243 PolarHBondContact O-N 3.39Å; N1240-N1243 PolarHBondContact O-OD1 3.28Å; N1240-N1243 PolarHBondContact OD1-N 2.81Å; N1243-A1263 WeakPolarHBondContact O-CB 3.43Å; N1243-P1266 VanDerWaalsContact O-CA 3.27Å; N1243-P1266 WeakPolarHBondContact O-CA 3.44Å; N1243-P1266 WeakPolarHBondContact O-CB 3.5Å
1244	A	84.7	Confident	87.8	Confident	11 Å²	11	21.7 Å²	21.7	9%	0.091	12%	0.116	C	C	.	.			trans	-126.6	76.1	178.1	0	0	0	0	0	108.1	T1246 D1249 I1251 A1263	A1244-T1246 VanDerWaalsContact C-N 3.32Å; A1244-T1246 PolarHBondContact O-N 3.29Å; A1244-D1249 HydrophobicContact CB-CB 4.49Å; A1244-I1251 HydrophobicContact CB-CD1 3.62Å; A1244-A1263 HydrophobicContact CB-CB 4.01Å
1245	G	84.6	Confident	87.4	Confident	2 Å²	2	27.8 Å²	27.8	2%	0.021	15%	0.145	C	C	.	.			trans	-82.1	-0.6	-166.8	0	0	0	0	0	115.9	C1128 R1129	C1128-G1245 CarbonylContact C-O 3.53Å; C1128-G1245 WeakPolarHBondContact CA-O 3.17Å; R1129-G1245 VanDerWaalsContact CG-O 3.28Å; R1129-G1245 WeakPolarHBondContact CG-O 3.3Å; R1129-G1245 PolarHBondContact N-O 3.14Å
1246	T	91	Very high	86.9	Confident	0 Å²	0	33 Å²	33	0%	0	17%	0.172	C	C	.	.	S	Bend	trans	-101.8	-166.4	-178	74.4	0	0	0	0	110.8	R1054 D1130 A1244 M1248 R1267 A1271 I1274	R1054-T1246 PolarHBondContact NH1-O 2.83Å; D1130-T1246 VanDerWaalsContact OD2-C 3.25Å; A1244-T1246 VanDerWaalsContact C-N 3.32Å; A1244-T1246 PolarHBondContact O-N 3.29Å; T1246-M1248 PolarHBondContact O-N 3.12Å; T1246-M1248 PolarHBondContact OG1-N 3.16Å; T1246-R1267 HydrophobicContact CG2-CB 3.87Å; T1246-R1267 PolarHBondContact OG1-NH1 3Å; T1246-R1267 VanDerWaalsContact OG1-NH1 3.09Å; T1246-A1271 HydrophobicContact CG2-CB 4.29Å; T1246-I1274 HydrophobicContact CG2-CD1 4.11Å
1247	W	91.2	Very high	86.5	Confident	7 Å²	7	33.9 Å²	33.9	3%	0.027	18%	0.178	C	C	.	.	S	Bend	trans	-67.9	-21.9	172.1	80.3	-98.3	0	0	0	112.9	D1130 D1249 N1371 T1407 H1437 W1447 W1449 L1450	D1130-W1247 PolarHBondContact OD2-N 3.32Å; W1247-D1249 VanDerWaalsContact C-N 3.32Å; W1247-D1249 PolarHBondContact O-N 3.37Å; W1247-D1249 VanDerWaalsContact O-N 3.14Å; W1247-N1371 PolarHBondContact NE1-OD1 2.95Å; W1247-T1407 HydrophobicContact CH2-CG2 3.63Å; W1247-T1407 HydrophobicContact CZ2-CG2 4.3Å; W1247-H1437 AromaticContact CE3-ND1 3.93Å; W1247-H1437 AromaticContact CZ3-CE1 3.89Å; W1247-H1437 AromaticContact CZ3-ND1 3.47Å; W1247-H1437 WeakPolarHBondContact CZ3-ND1 3.49Å; W1247-H1437 PolarHBondContact O-CE1 3.47Å; W1247-W1447 HydrophobicContact CH2-CD2 4.23Å; W1247-W1447 HydrophobicContact CH2-CG 4.2Å; W1247-W1447 AromaticContact CZ3-CD2 3.79Å; W1247-W1447 HydrophobicContact CZ3-CD2 3.79Å; W1247-W1447 AromaticContact CZ3-CE2 3.84Å; W1247-W1447 HydrophobicContact CZ3-CE3 4.02Å; W1247-W1447 HydrophobicContact CZ3-CG 4.24Å; W1247-W1447 HydrophobicContact CZ3-CH2 4.28Å; W1247-W1447 HydrophobicContact CZ3-CZ2 4.09Å; W1247-W1447 HydrophobicContact CZ3-CZ3 4.25Å; W1247-W1449 HydrophobicContact CD2-CH2 4.42Å; W1247-W1449 AromaticContact CD2-CZ2 3.66Å; W1247-W1449 HydrophobicContact CD2-CZ2 3.66Å; W1247-W1449 AromaticContact CE2-CZ2 3.69Å; W1247-W1449 AromaticContact CE3-CZ2 3.88Å; W1247-W1449 HydrophobicContact CE3-CZ2 3.88Å; W1247-W1449 HydrophobicContact CG-CH2 4.49Å; W1247-W1449 HydrophobicContact CG-CZ2 4.11Å; W1247-W1449 HydrophobicContact CH2-CZ2 4.13Å; W1247-W1449 AromaticContact CZ2-CZ2 3.91Å; W1247-W1449 HydrophobicContact CZ2-CZ2 3.91Å; W1247-W1449 HydrophobicContact CZ3-CZ2 4.12Å; W1247-W1449 AromaticContact CZ3-NE1 3.99Å; W1247-L1450 HydrophobicContact CH2-CD1 3.62Å; W1247-L1450 HydrophobicContact CH2-CG 4.38Å; W1247-L1450 HydrophobicContact CZ2-CD1 3.68Å; W1247-L1450 HydrophobicContact CZ2-CD2 4.06Å; W1247-L1450 HydrophobicContact CZ2-CG 4.32Å
1248	M	91.2	Very high	86.2	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.19	C	C	.	.			trans	-84.2	69.9	173.7	-61.9	-171.8	171.7	0	0	110.7	T1246 T1265 N1371 T1407 H1437	T1246-M1248 PolarHBondContact O-N 3.12Å; T1246-M1248 PolarHBondContact OG1-N 3.16Å; M1248-T1265 HydrophobicContact CB-CG2 3.92Å; M1248-T1265 HydrophobicContact CG-CG2 4.42Å; M1248-T1265 HydrophobicContact SD-CG2 3.61Å; M1248-N1371 VanDerWaalsContact CE-ND2 3.32Å; M1248-N1371 WeakPolarHBondContact CE-ND2 3.28Å; M1248-T1407 HydrophobicContact CE-CG2 4.09Å; M1248-H1437 HydrophobicContact CB-CB 3.92Å; M1248-H1437 HydrophobicContact CG-CB 3.88Å; M1248-H1437 HydrophobicContact SD-CB 4.04Å
1249	D	87.6	Confident	86.1	Confident	44 Å²	44	35.6 Å²	35.6	24%	0.235	19%	0.189	C	C	.	.			trans	-98.1	14.4	-162.2	64.9	5	0	0	0	116.7	R1054 A1244 W1247 I1251 H1437	R1054-D1249 IonicContact CZ-OD2 2.8Å; R1054-D1249 VanDerWaalsContact CZ-OD2 3.23Å; R1054-D1249 IonicContact NH1-OD2 3.98Å; R1054-D1249 PolarHBondContact NH1-OD2 3.09Å; R1054-D1249 IonicContact NH2-OD2 2.75Å; R1054-D1249 PolarHBondContact NH2-OD2 2.75Å; A1244-D1249 HydrophobicContact CB-CB 4.49Å; W1247-D1249 VanDerWaalsContact C-N 3.32Å; W1247-D1249 PolarHBondContact O-N 3.37Å; W1247-D1249 VanDerWaalsContact O-N 3.14Å; D1249-I1251 PolarHBondContact O-N 2.86Å; D1249-H1437 PolarHBondContact N-NE2 2.93Å
1250	K	87.9	Confident	86	Confident	33 Å²	33	39.1 Å²	39.1	14%	0.143	20%	0.2	C	C	.	.	P	Polyproline II helix	trans	-65.4	119.5	-179.5	-174.6	66.6	-175.7	-155.5	0	113.2	A1264 N1432 G1433 F1434 L1436	K1250-A1264 HydrophobicContact CB-CB 4.11Å; K1250-A1264 HydrophobicContact CG-CB 4.14Å; K1250-A1264 WeakPolarHBondContact O-CB 3.36Å; K1250-A1264 PolarHBondContact O-N 2.83Å; K1250-N1432 WeakPolarHBondContact CE-O 3.28Å; K1250-N1432 PolarHBondContact NZ-O 3.32Å; K1250-G1433 WeakPolarHBondContact CE-O 3.37Å; K1250-G1433 PolarHBondContact NZ-O 3.47Å; K1250-F1434 WeakPolarHBondContact CG-O 3.42Å; K1250-L1436 HydrophobicContact CB-CB 3.86Å; K1250-L1436 HydrophobicContact CB-CD2 4.08Å; K1250-L1436 HydrophobicContact CD-CB 4.03Å; K1250-L1436 HydrophobicContact CD-CD2 4.09Å; K1250-L1436 HydrophobicContact CG-CB 3.88Å; K1250-L1436 HydrophobicContact CG-CD2 4.49Å
1251	I	86	Confident	85.8	Confident	68 Å²	68	38.8 Å²	38.8	35%	0.349	20%	0.201	S	C	.	.	B	Isolated β-bridge	trans	-102.4	139	165.7	-52.5	-58.4	0	0	0	109.4	A1244 D1249 A1263	A1244-I1251 HydrophobicContact CB-CD1 3.62Å; D1249-I1251 PolarHBondContact O-N 2.86Å; I1251-A1263 HydrophobicContact CD1-CB 3.75Å
1252	G	84.6	Confident	85.8	Confident	5 Å²	5	39.4 Å²	39.4	5%	0.052	20%	0.203	C	C	.	.	P	Polyproline II helix	trans	-71.3	153.7	175.1	0	0	0	0	0	113.2	N1259 R1260 G1261 K1262	G1252-N1259 CarbonylContact C-O 3.58Å; G1252-N1259 WeakPolarHBondContact CA-O 3.13Å; G1252-N1259 WeakPolarHBondContact CA-OD1 3.46Å; G1252-R1260 WeakPolarHBondContact O-CA 3.31Å; G1252-G1261 PolarHBondContact O-N 3.1Å; G1252-K1262 PolarHBondContact N-O 2.59Å
1253	S	85.6	Confident	86	Confident	57 Å²	57	37.6 Å²	37.6	40%	0.399	20%	0.197	S	C	.	.			trans	-138.2	-7.6	-177.3	51.9	0	0	0	0	114.2	N1259 N1432	S1253-N1259 PolarHBondContact N-OD1 2.94Å; S1253-N1432 WeakPolarHBondContact OG-CB 3.19Å
1254	S	87.7	Confident	86.2	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.198	C	C	.	.			trans	-71.7	132.5	178.7	178.7	0	0	0	0	111.8	I1256 C1257 N1259 R1260 D1424 N1432	S1254-I1256 PolarHBondContact OG-N 3.37Å; S1254-C1257 VanDerWaalsContact CB-SG 3.59Å; S1254-C1257 PolarHBondContact OG-N 2.93Å; S1254-N1259 WeakPolarHBondContact CB-OD1 3.43Å; S1254-N1259 PolarHBondContact N-OD1 3.2Å; S1254-N1259 PolarHBondContact O-N 2.69Å; S1254-N1259 VanDerWaalsContact O-N 3.13Å; S1254-R1260 WeakPolarHBondContact O-CB 3.36Å; S1254-R1260 PolarHBondContact O-N 2.85Å; S1254-D1424 WeakPolarHBondContact CB-OD1 3.34Å; S1254-D1424 PolarHBondContact OG-OD1 3.28Å; S1254-N1432 VanDerWaalsContact CA-ND2 3.33Å; S1254-N1432 WeakPolarHBondContact CA-ND2 3.1Å; S1254-N1432 PolarHBondContact N-ND2 3.41Å
1255	Q	85.3	Confident	86.4	Confident	129 Å²	129	37.3 Å²	37.3	60%	0.603	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86	-24.7	166.2	-69.7	176.6	-37.9	0	0	111.9	C1257 D1258	Q1255-C1257 PolarHBondContact O-N 3.45Å; Q1255-D1258 PolarHBondContact O-N 2.92Å
1256	I	85.3	Confident	86.7	Confident	110 Å²	110	38.5 Å²	38.5	56%	0.564	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-42.4	-174.7	-55.1	-179.5	0	0	0	111	S1254 D1424 A1426	S1254-I1256 PolarHBondContact OG-N 3.37Å; I1256-D1424 HydrophobicContact CD1-CB 4.15Å; I1256-A1426 HydrophobicContact CG2-CB 4.37Å
1257	C	83.6	Confident	86.7	Confident	21 Å²	21	38.8 Å²	38.8	14%	0.142	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.7	15	178.9	72	0	0	0	0	113.7	S1254 Q1255 N1259 A1426 N1428 A1431	S1254-C1257 VanDerWaalsContact CB-SG 3.59Å; S1254-C1257 PolarHBondContact OG-N 2.93Å; Q1255-C1257 PolarHBondContact O-N 3.45Å; C1257-N1259 VanDerWaalsContact C-N 3.25Å; C1257-N1259 PolarHBondContact O-N 3.08Å; C1257-N1259 VanDerWaalsContact SG-CB 3.58Å; C1257-N1259 VanDerWaalsContact SG-CG 3.51Å; C1257-N1259 PolarHBondContact SG-ND2 3.06Å; C1257-A1426 WeakPolarHBondContact CB-O 3.41Å; C1257-N1428 HydrophobicContact CB-CB 4.16Å; C1257-A1431 HydrophobicContact CB-CB 4.45Å; C1257-A1431 WeakPolarHBondContact SG-CB 2.99Å
1258	D	84.1	Confident	86.7	Confident	104 Å²	104	38.6 Å²	38.6	56%	0.556	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.7	37.7	-175.2	-173.1	52.4	0	0	0	113.9	Q1255 K1262	Q1255-D1258 PolarHBondContact O-N 2.92Å; D1258-K1262 WeakPolarHBondContact O-CD 3.28Å; D1258-K1262 WeakPolarHBondContact O-CE 3.46Å; D1258-K1262 PolarHBondContact O-NZ 3.29Å; D1258-K1262 IonicContact OD2-NZ 3.78Å; D1258-K1262 PolarHBondContact OD2-NZ 3.4Å
1259	N	85.8	Confident	86.7	Confident	0 Å²	0	39 Å²	39	0%	0	21%	0.206	C	C	.	.			trans	-91.8	-6.2	177.3	85.9	10.7	0	0	0	114	G1252 S1253 S1254 C1257 G1261 K1262 N1428 A1431 F1434	G1252-N1259 CarbonylContact C-O 3.58Å; G1252-N1259 WeakPolarHBondContact CA-O 3.13Å; G1252-N1259 WeakPolarHBondContact CA-OD1 3.46Å; S1253-N1259 PolarHBondContact N-OD1 2.94Å; S1254-N1259 WeakPolarHBondContact CB-OD1 3.43Å; S1254-N1259 PolarHBondContact N-OD1 3.2Å; S1254-N1259 PolarHBondContact O-N 2.69Å; S1254-N1259 VanDerWaalsContact O-N 3.13Å; C1257-N1259 VanDerWaalsContact C-N 3.25Å; C1257-N1259 PolarHBondContact O-N 3.08Å; C1257-N1259 VanDerWaalsContact SG-CB 3.58Å; C1257-N1259 VanDerWaalsContact SG-CG 3.51Å; C1257-N1259 PolarHBondContact SG-ND2 3.06Å; N1259-G1261 PolarHBondContact O-N 3.19Å; N1259-K1262 WeakPolarHBondContact O-CB 3.29Å; N1259-K1262 PolarHBondContact O-N 3.12Å; N1259-N1428 WeakPolarHBondContact CB-OD1 3.48Å; N1259-N1428 PolarHBondContact ND2-O 2.7Å; N1259-A1431 PolarHBondContact ND2-O 3.37Å; N1259-F1434 HydrophobicContact CB-CD2 4.22Å; N1259-F1434 HydrophobicContact CB-CE2 4.11Å; N1259-F1434 WeakPolarHBondContact ND2-CD2 3.04Å
1260	R	83.3	Confident	87	Confident	82 Å²	82	36.9 Å²	36.9	31%	0.309	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.6	123.8	-178.5	-173	165.8	-173.7	154.2	11.8	113	N1215 S1216 G1252 S1254 K1262	N1215-R1260 PolarHBondContact O-NH1 2.7Å; N1215-R1260 VanDerWaalsContact O-NH1 3.13Å; N1215-R1260 PolarHBondContact O-NH2 2.9Å; S1216-R1260 PolarHBondContact O-NE 2.9Å; S1216-R1260 PolarHBondContact O-NH2 3.39Å; G1252-R1260 WeakPolarHBondContact O-CA 3.31Å; S1254-R1260 WeakPolarHBondContact O-CB 3.36Å; S1254-R1260 PolarHBondContact O-N 2.85Å; R1260-K1262 PolarHBondContact O-N 3.3Å
1261	G	81.2	Confident	87.4	Confident	13 Å²	13	35.3 Å²	35.3	13%	0.134	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.8	2.3	178.8	0	0	0	0	0	115.2	G1252 N1259	G1252-G1261 PolarHBondContact O-N 3.1Å; N1259-G1261 PolarHBondContact O-N 3.19Å
1262	K	86.2	Confident	87.9	Confident	85 Å²	85	32.1 Å²	32.1	37%	0.37	17%	0.172	S	C	.	.			trans	-86.5	139	171.1	-58.2	179	-174.3	163.9	0	108.7	G1252 D1258 N1259 R1260	G1252-K1262 PolarHBondContact N-O 2.59Å; D1258-K1262 WeakPolarHBondContact O-CD 3.28Å; D1258-K1262 WeakPolarHBondContact O-CE 3.46Å; D1258-K1262 PolarHBondContact O-NZ 3.29Å; D1258-K1262 IonicContact OD2-NZ 3.78Å; D1258-K1262 PolarHBondContact OD2-NZ 3.4Å; N1259-K1262 WeakPolarHBondContact O-CB 3.29Å; N1259-K1262 PolarHBondContact O-N 3.12Å; R1260-K1262 PolarHBondContact O-N 3.3Å
1263	A	87	Confident	88.5	Confident	11 Å²	11	31.9 Å²	31.9	9%	0.091	17%	0.17	C	C	.	.	B	Isolated β-bridge	trans	-80.7	128.8	175.5	0	0	0	0	0	109.7	N1243 A1244 I1251 T1265 P1266	N1243-A1263 WeakPolarHBondContact O-CB 3.43Å; A1244-A1263 HydrophobicContact CB-CB 4.01Å; I1251-A1263 HydrophobicContact CD1-CB 3.75Å; A1263-T1265 VanDerWaalsContact C-N 3.32Å; A1263-P1266 HydrophobicContact CB-CB 4.1Å; A1263-P1266 HydrophobicContact CB-CG 3.89Å
1264	A	87.1	Confident	89	Confident	8 Å²	8	29.2 Å²	29.2	7%	0.066	15%	0.151	C	C	.	.	S	Bend	trans	-69.9	-33.8	-179.5	0	0	0	0	0	112	K1250 F1434 Q1438	K1250-A1264 HydrophobicContact CB-CB 4.11Å; K1250-A1264 HydrophobicContact CG-CB 4.14Å; K1250-A1264 WeakPolarHBondContact O-CB 3.36Å; K1250-A1264 PolarHBondContact O-N 2.83Å; A1264-F1434 HydrophobicContact CB-CD1 3.93Å; A1264-F1434 HydrophobicContact CB-CD2 3.81Å; A1264-F1434 HydrophobicContact CB-CE1 3.84Å; A1264-F1434 HydrophobicContact CB-CE2 3.73Å; A1264-F1434 HydrophobicContact CB-CG 3.92Å; A1264-F1434 HydrophobicContact CB-CZ 3.75Å; A1264-F1434 WeakPolarHBondContact CB-O 3.47Å; A1264-Q1438 PolarHBondContact O-NE2 3.24Å
1265	T	88.9	Confident	89.4	Confident	4 Å²	4	29.2 Å²	29.2	3%	0.025	15%	0.151	C	C	.	.	S	Bend	trans	-143	74.5	-177.3	-49.6	0	0	0	0	108.1	M1248 A1263 R1267 Q1438	M1248-T1265 HydrophobicContact CB-CG2 3.92Å; M1248-T1265 HydrophobicContact CG-CG2 4.42Å; M1248-T1265 HydrophobicContact SD-CG2 3.61Å; A1263-T1265 VanDerWaalsContact C-N 3.32Å; T1265-R1267 VanDerWaalsContact C-N 3.32Å; T1265-R1267 HydrophobicContact CG2-CG 3.74Å; T1265-R1267 PolarHBondContact O-N 3.08Å; T1265-Q1438 PolarHBondContact OG1-NE2 3.03Å; T1265-Q1438 VanDerWaalsContact OG1-NE2 3.14Å
1266	P	89.3	Confident	90	Very high	27 Å²	27	23 Å²	23	18%	0.175	12%	0.122	C	C	.	.			trans	-58.9	-42.8	-167.8	-20.3	28.5	0	0	0	113.1	N1243 A1263 D1268	N1243-P1266 VanDerWaalsContact O-CA 3.27Å; N1243-P1266 WeakPolarHBondContact O-CA 3.44Å; N1243-P1266 WeakPolarHBondContact O-CB 3.5Å; A1263-P1266 HydrophobicContact CB-CB 4.1Å; A1263-P1266 HydrophobicContact CB-CG 3.89Å; P1266-D1268 PolarHBondContact O-N 3.14Å
1267	R	92.3	Very high	90.6	Very high	6 Å²	6	17.8 Å²	17.8	2%	0.023	10%	0.095	C	C	.	.			trans	47.5	48.1	-177.7	-60.2	-179.5	73.4	-126.7	-0	111.3	R1129 T1246 T1265 E1273 D1355 T1356 N1371	R1129-R1267 PolarHBondContact NH2-O 2.85Å; T1246-R1267 HydrophobicContact CG2-CB 3.87Å; T1246-R1267 PolarHBondContact OG1-NH1 3Å; T1246-R1267 VanDerWaalsContact OG1-NH1 3.09Å; T1265-R1267 VanDerWaalsContact C-N 3.32Å; T1265-R1267 HydrophobicContact CG2-CG 3.74Å; T1265-R1267 PolarHBondContact O-N 3.08Å; R1267-E1273 IonicContact CZ-OE1 3.38Å; R1267-E1273 IonicContact CZ-OE2 3.96Å; R1267-E1273 IonicContact NH1-OE1 2.89Å; R1267-E1273 PolarHBondContact NH1-OE1 3.33Å; R1267-E1273 IonicContact NH1-OE2 2.85Å; R1267-E1273 IonicContact NH2-OE1 3.24Å; R1267-E1273 PolarHBondContact NH2-OE1 3.17Å; R1267-E1273 IonicContact NH2-OE2 2.66Å; R1267-E1273 PolarHBondContact NH2-OE2 3.47Å; R1267-D1355 WeakPolarHBondContact CD-OD2 3.33Å; R1267-D1355 IonicContact CZ-OD1 2.64Å; R1267-D1355 IonicContact CZ-OD2 2.72Å; R1267-D1355 VanDerWaalsContact NE-CG 3.35Å; R1267-D1355 IonicContact NE-OD1 3.63Å; R1267-D1355 PolarHBondContact NE-OD1 2.91Å; R1267-D1355 IonicContact NE-OD2 3.34Å; R1267-D1355 PolarHBondContact NE-OD2 3.46Å; R1267-D1355 IonicContact NH2-OD1 2.73Å; R1267-D1355 PolarHBondContact NH2-OD1 3.44Å; R1267-D1355 IonicContact NH2-OD2 3.61Å; R1267-T1356 HydrophobicContact CB-CG2 3.97Å; R1267-T1356 HydrophobicContact CG-CG2 4.44Å; R1267-N1371 PolarHBondContact NH2-ND2 3.31Å; R1267-N1371 VanDerWaalsContact NH2-ND2 3.2Å
1268	D	90.4	Very high	91.2	Very high	3 Å²	3	16.8 Å²	16.8	2%	0.016	9%	0.089	C	C	.	.			trans	-69.5	171.8	168.6	58.7	-68.7	0	0	0	111	G1238 P1266 S1359 E1360	G1238-D1268 CarbonylContact O-C 3.55Å; G1238-D1268 VanDerWaalsContact O-CA 3.31Å; G1238-D1268 WeakPolarHBondContact O-CA 3.44Å; P1266-D1268 PolarHBondContact O-N 3.14Å; D1268-S1359 PolarHBondContact O-OG 3.2Å; D1268-S1359 WeakPolarHBondContact OD2-CA 3.27Å; D1268-E1360 PolarHBondContact OD2-N 2.9Å
1269	G	91.7	Very high	91.9	Very high	8 Å²	8	12.2 Å²	12.2	8%	0.082	6%	0.064	C	C	.	.	S	Bend	trans	73.5	-145.7	-168.9	0	0	0	0	0	112.4	R1129 F1237 G1238 N1358	R1129-G1269 VanDerWaalsContact CZ-O 3.3Å; R1129-G1269 PolarHBondContact NH1-O 2.88Å; R1129-G1269 PolarHBondContact NH2-O 3.44Å; F1237-G1269 WeakPolarHBondContact CA-O 3.28Å; G1238-G1269 PolarHBondContact N-O 3.39Å; G1238-G1269 VanDerWaalsContact N-O 3.16Å; G1238-G1269 PolarHBondContact O-N 3.49Å; G1269-N1358 WeakPolarHBondContact CA-O 3.49Å
1270	S	94.7	Very high	92.4	Very high	1 Å²	1	12.5 Å²	12.5	1%	0.007	7%	0.066	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	101.6	-174.4	-45.8	0	0	0	0	110.6	V1236 T1356 V1357	V1236-S1270 WeakPolarHBondContact O-CA 3.43Å; S1270-T1356 CarbonylContact O-C 3.38Å; S1270-T1356 VanDerWaalsContact O-CA 3.28Å; S1270-T1356 WeakPolarHBondContact O-CA 3.47Å; S1270-V1357 PolarHBondContact N-O 3.37Å; S1270-V1357 PolarHBondContact O-N 3.49Å; S1270-V1357 PolarHBondContact OG-O 3.08Å
1271	A	95.2	Very high	93.1	Very high	0 Å²	0	8.6 Å²	8.6	0%	0	5%	0.051	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	133.5	178.5	0	0	0	0	0	111.2	T1246 E1273 I1274 V1275 T1356	T1246-A1271 HydrophobicContact CG2-CB 4.29Å; A1271-E1273 VanDerWaalsContact C-N 3.34Å; A1271-E1273 PolarHBondContact O-N 2.91Å; A1271-I1274 HydrophobicContact CB-CB 4.36Å; A1271-I1274 HydrophobicContact CB-CD1 3.98Å; A1271-I1274 HydrophobicContact CB-CG1 4.05Å; A1271-I1274 PolarHBondContact O-N 3.2Å; A1271-V1275 PolarHBondContact O-N 3.21Å; A1271-T1356 HydrophobicContact CB-CG2 4.3Å
1272	V	97.3	Very high	93.8	Very high	0 Å²	0	8 Å²	8	0%	0	5%	0.045	C	C	.	.	H	α-helix	trans	-56	-42.5	-169	65.9	0	0	0	0	113.7	V1275 A1276 F1323 F1327 D1355 N1371 F1372 A1375	V1272-V1275 PolarHBondContact O-N 3.18Å; V1272-A1276 PolarHBondContact O-N 3.34Å; V1272-A1276 VanDerWaalsContact O-N 3.11Å; V1272-F1323 HydrophobicContact CG2-CE2 4.06Å; V1272-F1323 HydrophobicContact CG2-CZ 3.83Å; V1272-F1327 HydrophobicContact CB-CD1 3.89Å; V1272-F1327 HydrophobicContact CB-CE1 3.61Å; V1272-F1327 HydrophobicContact CB-CZ 4.35Å; V1272-F1327 HydrophobicContact CG2-CD1 3.8Å; V1272-F1327 HydrophobicContact CG2-CE1 3.94Å; V1272-F1327 HydrophobicContact CG2-CG 4.33Å; V1272-D1355 PolarHBondContact N-O 3.29Å; V1272-N1371 HydrophobicContact CG1-CB 3.75Å; V1272-F1372 HydrophobicContact CG1-CB 4.24Å; V1272-F1372 HydrophobicContact CG2-CB 4.16Å; V1272-A1375 HydrophobicContact CG2-CB 4Å
1273	E	96.3	Very high	94.3	Very high	0 Å²	0	8.2 Å²	8.2	0%	0	5%	0.046	C	C	.	.	H	α-helix	trans	-71.3	-35.5	178.6	79.6	-72.6	-175	0	0	112.4	R1267 A1271 V1275 A1276 I1277 I1374	R1267-E1273 IonicContact CZ-OE1 3.38Å; R1267-E1273 IonicContact CZ-OE2 3.96Å; R1267-E1273 IonicContact NH1-OE1 2.89Å; R1267-E1273 PolarHBondContact NH1-OE1 3.33Å; R1267-E1273 IonicContact NH1-OE2 2.85Å; R1267-E1273 IonicContact NH2-OE1 3.24Å; R1267-E1273 PolarHBondContact NH2-OE1 3.17Å; R1267-E1273 IonicContact NH2-OE2 2.66Å; R1267-E1273 PolarHBondContact NH2-OE2 3.47Å; A1271-E1273 VanDerWaalsContact C-N 3.34Å; A1271-E1273 PolarHBondContact O-N 2.91Å; E1273-V1275 VanDerWaalsContact C-N 3.35Å; E1273-A1276 PolarHBondContact O-N 3.24Å; E1273-I1277 WeakPolarHBondContact O-CB 3.43Å; E1273-I1277 WeakPolarHBondContact O-CD1 3.44Å; E1273-I1277 WeakPolarHBondContact O-CG1 3.39Å; E1273-I1277 PolarHBondContact O-N 3.15Å; E1273-I1374 HydrophobicContact CB-CB 3.92Å; E1273-I1374 HydrophobicContact CB-CD1 4.34Å; E1273-I1374 HydrophobicContact CB-CG2 3.83Å; E1273-I1374 HydrophobicContact CG-CD1 4.38Å; E1273-I1374 HydrophobicContact CG-CG2 4.5Å
1274	I	96	Very high	94.7	Very high	1 Å²	1	8 Å²	8	1%	0.005	4%	0.043	C	C	.	.	H	α-helix	trans	-68	-38.9	177.4	-57.7	-178	0	0	0	110.1	R1129 D1130 W1133 V1236 T1246 A1271 S1278	R1129-I1274 HydrophobicContact CG-CD1 4.42Å; D1130-I1274 HydrophobicContact CB-CD1 3.83Å; D1130-I1274 HydrophobicContact CB-CG1 4.21Å; W1133-I1274 HydrophobicContact CG-CG2 4.11Å; V1236-I1274 HydrophobicContact CB-CG2 4.17Å; V1236-I1274 HydrophobicContact CG1-CG2 3.97Å; T1246-I1274 HydrophobicContact CG2-CD1 4.11Å; A1271-I1274 HydrophobicContact CB-CB 4.36Å; A1271-I1274 HydrophobicContact CB-CD1 3.98Å; A1271-I1274 HydrophobicContact CB-CG1 4.05Å; A1271-I1274 PolarHBondContact O-N 3.2Å; I1274-S1278 VanDerWaalsContact O-CB 3.28Å; I1274-S1278 WeakPolarHBondContact O-CB 3.47Å; I1274-S1278 PolarHBondContact O-N 2.95Å; I1274-S1278 PolarHBondContact O-OG 2.85Å
1275	V	97.5	Very high	95.1	Very high	0 Å²	0	7.7 Å²	7.7	0%	0	4%	0.04	C	C	.	.	H	α-helix	trans	-61.8	-48.5	174.4	175.1	0	0	0	0	110.6	F1235 A1271 V1272 E1273 S1278 Y1279 I1319 F1323 F1327	F1235-V1275 HydrophobicContact CB-CG2 3.92Å; F1235-V1275 HydrophobicContact CD1-CG1 3.56Å; F1235-V1275 HydrophobicContact CD1-CG2 4.3Å; F1235-V1275 HydrophobicContact CE1-CG1 3.96Å; F1235-V1275 HydrophobicContact CG-CG1 4.17Å; F1235-V1275 HydrophobicContact CG-CG2 4.07Å; A1271-V1275 PolarHBondContact O-N 3.21Å; V1272-V1275 PolarHBondContact O-N 3.18Å; E1273-V1275 VanDerWaalsContact C-N 3.35Å; V1275-S1278 PolarHBondContact O-N 3.05Å; V1275-S1278 PolarHBondContact O-OG 3.35Å; V1275-Y1279 PolarHBondContact O-N 3.31Å; V1275-I1319 HydrophobicContact CG1-CG2 3.69Å; V1275-F1323 HydrophobicContact CG1-CD2 3.93Å; V1275-F1323 HydrophobicContact CG1-CE2 4.25Å; V1275-F1327 HydrophobicContact CB-CE2 4.45Å; V1275-F1327 HydrophobicContact CB-CZ 4.44Å; V1275-F1327 HydrophobicContact CG1-CE2 4.34Å; V1275-F1327 HydrophobicContact CG2-CE2 4.26Å; V1275-F1327 HydrophobicContact CG2-CZ 4.02Å
1276	A	97.6	Very high	95.4	Very high	0 Å²	0	9.1 Å²	9.1	0%	0	5%	0.047	C	C	.	.	H	α-helix	trans	-64.5	-43.2	178.6	0	0	0	0	0	113.6	V1272 E1273 S1278 Y1279 A1280 A1375 A1379 L1382	V1272-A1276 PolarHBondContact O-N 3.34Å; V1272-A1276 VanDerWaalsContact O-N 3.11Å; E1273-A1276 PolarHBondContact O-N 3.24Å; A1276-S1278 VanDerWaalsContact C-N 3.32Å; A1276-S1278 PolarHBondContact O-N 3.37Å; A1276-Y1279 PolarHBondContact O-N 3.11Å; A1276-A1280 PolarHBondContact O-N 3.17Å; A1276-A1375 VanDerWaalsContact CB-CA 3.47Å; A1276-A1375 HydrophobicContact CB-CB 3.38Å; A1276-A1379 HydrophobicContact CB-CB 4.1Å; A1276-L1382 HydrophobicContact CB-CD1 4.16Å
1277	I	97.5	Very high	95.7	Very high	0 Å²	0	12.8 Å²	12.8	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-61	-43.9	173.8	-63.7	160.8	0	0	0	110.3	W1133 W1134 L1137 E1273 Y1279 A1280 V1281 I1378	W1133-I1277 HydrophobicContact CB-CB 4.35Å; W1133-I1277 HydrophobicContact CB-CG2 3.72Å; W1133-I1277 WeakPolarHBondContact O-CG2 3.18Å; W1134-I1277 HydrophobicContact CD2-CD1 3.93Å; W1134-I1277 HydrophobicContact CE3-CD1 4Å; W1134-I1277 HydrophobicContact CH2-CD1 3.87Å; W1134-I1277 HydrophobicContact CZ2-CD1 3.77Å; W1134-I1277 HydrophobicContact CZ3-CD1 3.97Å; L1137-I1277 HydrophobicContact CB-CG2 4Å; L1137-I1277 HydrophobicContact CD2-CG1 4.37Å; L1137-I1277 HydrophobicContact CD2-CG2 4.44Å; E1273-I1277 WeakPolarHBondContact O-CB 3.43Å; E1273-I1277 WeakPolarHBondContact O-CD1 3.44Å; E1273-I1277 WeakPolarHBondContact O-CG1 3.39Å; E1273-I1277 PolarHBondContact O-N 3.15Å; I1277-Y1279 VanDerWaalsContact C-N 3.34Å; I1277-Y1279 PolarHBondContact O-N 2.78Å; I1277-A1280 PolarHBondContact O-N 2.69Å; I1277-V1281 HydrophobicContact CG2-CG2 4.26Å; I1277-V1281 WeakPolarHBondContact O-CB 3.11Å; I1277-V1281 VanDerWaalsContact O-CG2 3.29Å; I1277-V1281 WeakPolarHBondContact O-CG2 3.46Å; I1277-V1281 PolarHBondContact O-N 3.44Å; I1277-I1378 HydrophobicContact CD1-CD1 4.24Å; I1277-I1378 HydrophobicContact CG1-CD1 3.66Å; I1277-I1378 HydrophobicContact CG1-CG2 4.12Å
1278	S	96.6	Very high	95.7	Very high	0 Å²	0	12.9 Å²	12.9	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-61.2	-43	177.4	77	0	0	0	0	111.6	W1133 I1274 V1275 A1276 V1281 I1282	W1133-S1278 VanDerWaalsContact CZ3-CB 3.46Å; I1274-S1278 VanDerWaalsContact O-CB 3.28Å; I1274-S1278 WeakPolarHBondContact O-CB 3.47Å; I1274-S1278 PolarHBondContact O-N 2.95Å; I1274-S1278 PolarHBondContact O-OG 2.85Å; V1275-S1278 PolarHBondContact O-N 3.05Å; V1275-S1278 PolarHBondContact O-OG 3.35Å; A1276-S1278 VanDerWaalsContact C-N 3.32Å; A1276-S1278 PolarHBondContact O-N 3.37Å; S1278-V1281 PolarHBondContact O-N 3.41Å; S1278-I1282 WeakPolarHBondContact O-CB 3.49Å; S1278-I1282 WeakPolarHBondContact O-CG1 3.19Å; S1278-I1282 PolarHBondContact O-N 2.99Å
1279	Y	97.9	Very high	95.9	Very high	8 Å²	8	13.9 Å²	13.9	3%	0.031	7%	0.07	C	C	.	.	H	α-helix	trans	-60.9	-48.9	175	173.9	-92.9	0	0	0	112.2	V1275 A1276 I1277 V1281 I1282 K1283 A1316 I1319 M1320 A1379 E1381 L1382	V1275-Y1279 PolarHBondContact O-N 3.31Å; A1276-Y1279 PolarHBondContact O-N 3.11Å; I1277-Y1279 VanDerWaalsContact C-N 3.34Å; I1277-Y1279 PolarHBondContact O-N 2.78Å; Y1279-V1281 VanDerWaalsContact C-N 3.32Å; Y1279-V1281 PolarHBondContact O-N 3.08Å; Y1279-I1282 PolarHBondContact O-N 3.48Å; Y1279-K1283 HydrophobicContact CE1-CD 3.89Å; Y1279-K1283 VanDerWaalsContact O-CB 3.31Å; Y1279-K1283 WeakPolarHBondContact O-CB 3.49Å; Y1279-K1283 PolarHBondContact O-N 3.29Å; Y1279-A1316 HydrophobicContact CD2-CB 4.21Å; Y1279-A1316 HydrophobicContact CE2-CB 3.93Å; Y1279-A1316 WeakPolarHBondContact CE2-O 2.96Å; Y1279-I1319 HydrophobicContact CD2-CB 4.06Å; Y1279-I1319 HydrophobicContact CD2-CG2 4.13Å; Y1279-I1319 HydrophobicContact CG-CG2 4.44Å; Y1279-M1320 HydrophobicContact CE2-CB 4.05Å; Y1279-A1379 HydrophobicContact CD1-CB 3.74Å; Y1279-A1379 HydrophobicContact CE1-CB 4.33Å; Y1279-E1381 HydrophobicContact CE1-CG 3.61Å; Y1279-E1381 WeakPolarHBondContact CE1-OE1 3.36Å; Y1279-E1381 WeakPolarHBondContact OH-CG 3.46Å; Y1279-L1382 HydrophobicContact CD1-CD1 3.99Å; Y1279-L1382 HydrophobicContact CD1-CD2 3.99Å; Y1279-L1382 HydrophobicContact CD1-CG 3.89Å; Y1279-L1382 HydrophobicContact CD2-CD2 3.77Å; Y1279-L1382 HydrophobicContact CE1-CD2 4.08Å; Y1279-L1382 HydrophobicContact CE1-CG 4.13Å; Y1279-L1382 HydrophobicContact CE2-CD2 3.84Å; Y1279-L1382 HydrophobicContact CG-CD1 3.96Å; Y1279-L1382 HydrophobicContact CG-CD2 3.82Å; Y1279-L1382 HydrophobicContact CG-CG 4.1Å
1280	A	97	Very high	96	Very high	6 Å²	6	19.5 Å²	19.5	5%	0.05	10%	0.098	C	C	.	.	H	α-helix	trans	-60.9	-40.2	-179.9	0	0	0	0	0	112.3	A1276 I1277 W1284 I1378	A1276-A1280 PolarHBondContact O-N 3.17Å; I1277-A1280 PolarHBondContact O-N 2.69Å; A1280-W1284 VanDerWaalsContact O-CB 3.27Å; A1280-W1284 WeakPolarHBondContact O-CB 3.42Å; A1280-W1284 PolarHBondContact O-N 2.91Å; A1280-I1378 HydrophobicContact CB-CG2 3.69Å
1281	V	96.9	Very high	95.8	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-66.2	-46.1	174.1	168.8	0	0	0	0	111.3	L1136 I1185 I1277 S1278 Y1279 W1284 L1285	L1136-V1281 HydrophobicContact CB-CB 4.41Å; L1136-V1281 HydrophobicContact CB-CG1 3.84Å; L1136-V1281 HydrophobicContact CB-CG2 3.65Å; L1136-V1281 HydrophobicContact CD1-CG1 4.14Å; L1136-V1281 HydrophobicContact CG-CG1 4.38Å; I1185-V1281 HydrophobicContact CD1-CG1 4.45Å; I1277-V1281 HydrophobicContact CG2-CG2 4.26Å; I1277-V1281 WeakPolarHBondContact O-CB 3.11Å; I1277-V1281 VanDerWaalsContact O-CG2 3.29Å; I1277-V1281 WeakPolarHBondContact O-CG2 3.46Å; I1277-V1281 PolarHBondContact O-N 3.44Å; S1278-V1281 PolarHBondContact O-N 3.41Å; Y1279-V1281 VanDerWaalsContact C-N 3.32Å; Y1279-V1281 PolarHBondContact O-N 3.08Å; V1281-W1284 HydrophobicContact CG1-CE3 4.28Å; V1281-W1284 HydrophobicContact CG1-CZ3 4.45Å; V1281-W1284 PolarHBondContact O-N 3.32Å; V1281-L1285 HydrophobicContact CG1-CD1 4.21Å; V1281-L1285 WeakPolarHBondContact O-CG 3.48Å; V1281-L1285 PolarHBondContact O-N 2.8Å
1282	I	97	Very high	95.6	Very high	0 Å²	0	27 Å²	27	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-66.6	-39.5	-179	-67.7	-66.8	0	0	0	111.4	I1185 S1278 Y1279 L1285 N1286 W1312 W1315 A1316	I1185-I1282 HydrophobicContact CG2-CD1 4.22Å; S1278-I1282 WeakPolarHBondContact O-CB 3.49Å; S1278-I1282 WeakPolarHBondContact O-CG1 3.19Å; S1278-I1282 PolarHBondContact O-N 2.99Å; Y1279-I1282 PolarHBondContact O-N 3.48Å; I1282-L1285 PolarHBondContact O-N 2.99Å; I1282-N1286 PolarHBondContact O-N 3.06Å; I1282-W1312 HydrophobicContact CD1-CE3 3.51Å; I1282-W1312 HydrophobicContact CD1-CZ3 3.43Å; I1282-W1312 VanDerWaalsContact CD1-CZ3 3.43Å; I1282-W1312 HydrophobicContact CG2-CB 4.35Å; I1282-W1312 HydrophobicContact CG2-CE3 4.23Å; I1282-W1312 VanDerWaalsContact CG2-O 3.3Å; I1282-W1312 WeakPolarHBondContact CG2-O 3.46Å; I1282-W1315 HydrophobicContact CD1-CD2 3.99Å; I1282-W1315 HydrophobicContact CD1-CE3 3.46Å; I1282-W1315 VanDerWaalsContact CD1-CE3 3.46Å; I1282-W1315 HydrophobicContact CD1-CH2 3.86Å; I1282-W1315 HydrophobicContact CD1-CZ2 4.35Å; I1282-W1315 HydrophobicContact CD1-CZ3 3.4Å; I1282-W1315 HydrophobicContact CG1-CD2 4.17Å; I1282-W1315 HydrophobicContact CG1-CE3 4.15Å; I1282-W1315 HydrophobicContact CG1-CH2 4.46Å; I1282-W1315 HydrophobicContact CG1-CZ2 4.49Å; I1282-W1315 HydrophobicContact CG1-CZ3 4.31Å; I1282-W1315 HydrophobicContact CG2-CB 4.04Å; I1282-W1315 HydrophobicContact CG2-CD2 4.43Å; I1282-W1315 HydrophobicContact CG2-CG 4.26Å; I1282-A1316 HydrophobicContact CG2-CB 4.2Å
1283	K	95.8	Very high	95.2	Very high	90 Å²	90	29.8 Å²	29.8	39%	0.391	16%	0.161	S	C	.	.	H	α-helix	trans	-64.5	-40.2	173.4	-175.6	174.2	-180	175.4	0	111.9	Y1279 N1286 K1287 E1381	Y1279-K1283 HydrophobicContact CE1-CD 3.89Å; Y1279-K1283 VanDerWaalsContact O-CB 3.31Å; Y1279-K1283 WeakPolarHBondContact O-CB 3.49Å; Y1279-K1283 PolarHBondContact O-N 3.29Å; K1283-N1286 WeakPolarHBondContact O-CB 3.31Å; K1283-N1286 PolarHBondContact O-N 2.81Å; K1283-K1287 PolarHBondContact O-N 3.23Å; K1283-K1287 VanDerWaalsContact O-N 3.08Å; K1283-E1381 WeakPolarHBondContact CD-OE1 3.36Å; K1283-E1381 WeakPolarHBondContact CE-OE1 3.46Å; K1283-E1381 IonicContact NZ-OE1 2.64Å; K1283-E1381 PolarHBondContact NZ-OE1 3.2Å
1284	W	95.7	Very high	95	Very high	7 Å²	7	30 Å²	30	3%	0.027	16%	0.162	C	C	.	.	H	α-helix	trans	-65.4	-42.5	173	164.3	74.7	0	0	0	112.5	I1139 K1140 T1143 M1153 A1280 V1281 N1286 K1287 M1288	I1139-W1284 HydrophobicContact CB-CH2 4.04Å; I1139-W1284 HydrophobicContact CG2-CH2 3.57Å; I1139-W1284 HydrophobicContact CG2-CZ2 3.97Å; K1140-W1284 HydrophobicContact CB-CD2 3.78Å; K1140-W1284 HydrophobicContact CB-CE3 4.12Å; K1140-W1284 HydrophobicContact CB-CG 4.02Å; K1140-W1284 HydrophobicContact CB-CZ2 4.33Å; K1140-W1284 HydrophobicContact CD-CB 3.77Å; K1140-W1284 HydrophobicContact CD-CG 3.96Å; K1140-W1284 HydrophobicContact CG-CB 4.08Å; K1140-W1284 HydrophobicContact CG-CD2 4.01Å; K1140-W1284 HydrophobicContact CG-CG 3.68Å; T1143-W1284 HydrophobicContact CG2-CZ2 3.92Å; T1143-W1284 PolarHBondContact OG1-NE1 2.66Å; M1153-W1284 HydrophobicContact CE-CH2 3.38Å; M1153-W1284 HydrophobicContact CE-CZ2 3.4Å; M1153-W1284 VanDerWaalsContact CE-CZ2 3.4Å; M1153-W1284 HydrophobicContact CE-CZ3 4.41Å; A1280-W1284 VanDerWaalsContact O-CB 3.27Å; A1280-W1284 WeakPolarHBondContact O-CB 3.42Å; A1280-W1284 PolarHBondContact O-N 2.91Å; V1281-W1284 HydrophobicContact CG1-CE3 4.28Å; V1281-W1284 HydrophobicContact CG1-CZ3 4.45Å; V1281-W1284 PolarHBondContact O-N 3.32Å; W1284-N1286 VanDerWaalsContact C-N 3.29Å; W1284-N1286 PolarHBondContact O-N 2.99Å; W1284-K1287 WeakPolarHBondContact O-CB 3.12Å; W1284-K1287 PolarHBondContact O-N 2.88Å; W1284-K1287 VanDerWaalsContact O-N 3.15Å; W1284-M1288 HydrophobicContact CD2-CG 4.32Å; W1284-M1288 HydrophobicContact CG-CG 4.35Å; W1284-M1288 HydrophobicContact CZ2-CG 4.42Å; W1284-M1288 WeakPolarHBondContact O-CG 3.38Å; W1284-M1288 PolarHBondContact O-N 3.24Å
1285	L	95.8	Very high	94.8	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-63.9	-33.7	173.8	-70.6	176.9	0	0	0	112.4	I1181 I1185 V1281 I1282 A1289 Y1294 W1312	I1181-L1285 HydrophobicContact CG2-CD1 4.43Å; I1181-L1285 HydrophobicContact CG2-CD2 4.44Å; I1185-L1285 HydrophobicContact CD1-CD1 3.34Å; V1281-L1285 HydrophobicContact CG1-CD1 4.21Å; V1281-L1285 WeakPolarHBondContact O-CG 3.48Å; V1281-L1285 PolarHBondContact O-N 2.8Å; I1282-L1285 PolarHBondContact O-N 2.99Å; L1285-A1289 VanDerWaalsContact O-CB 3.22Å; L1285-A1289 WeakPolarHBondContact O-CB 3.41Å; L1285-A1289 PolarHBondContact O-N 2.79Å; L1285-Y1294 HydrophobicContact CD2-CD1 4.02Å; L1285-Y1294 HydrophobicContact CD2-CD2 3.98Å; L1285-Y1294 HydrophobicContact CD2-CE1 3.91Å; L1285-Y1294 HydrophobicContact CD2-CE2 3.87Å; L1285-Y1294 HydrophobicContact CD2-CG 4.05Å; L1285-W1312 HydrophobicContact CB-CD2 4.06Å; L1285-W1312 HydrophobicContact CB-CE3 4.47Å; L1285-W1312 HydrophobicContact CB-CG 4.29Å; L1285-W1312 HydrophobicContact CD1-CE3 4.44Å; L1285-W1312 HydrophobicContact CD1-CH2 4Å; L1285-W1312 HydrophobicContact CD1-CZ2 4.25Å; L1285-W1312 HydrophobicContact CD1-CZ3 4.09Å
1286	N	96	Very high	94.6	Very high	35 Å²	35	37.4 Å²	37.4	19%	0.187	20%	0.2	C	C	.	.	H	α-helix	trans	-60.8	-47.2	170.9	-162.6	61.1	0	0	0	111.4	I1282 K1283 W1284 A1289 N1290 W1312 E1313	I1282-N1286 PolarHBondContact O-N 3.06Å; K1283-N1286 WeakPolarHBondContact O-CB 3.31Å; K1283-N1286 PolarHBondContact O-N 2.81Å; W1284-N1286 VanDerWaalsContact C-N 3.29Å; W1284-N1286 PolarHBondContact O-N 2.99Å; N1286-A1289 PolarHBondContact O-N 2.82Å; N1286-N1290 WeakPolarHBondContact O-CB 3.45Å; N1286-N1290 PolarHBondContact O-N 3.33Å; N1286-N1290 PolarHBondContact O-ND2 3.4Å; N1286-W1312 HydrophobicContact CB-CB 3.63Å; N1286-W1312 WeakPolarHBondContact OD1-CB 3.17Å; N1286-E1313 PolarHBondContact OD1-N 2.94Å; N1286-E1313 VanDerWaalsContact OD1-N 3.14Å
1287	K	94.7	Very high	94.3	Very high	103 Å²	103	40.6 Å²	40.6	45%	0.448	23%	0.227	S	C	.	.	H	α-helix	trans	-58.8	-54	174.6	179.8	-171.3	169.5	-169.2	0	111.1	K1283 W1284 A1289 N1290 E1291	K1283-K1287 PolarHBondContact O-N 3.23Å; K1283-K1287 VanDerWaalsContact O-N 3.08Å; W1284-K1287 WeakPolarHBondContact O-CB 3.12Å; W1284-K1287 PolarHBondContact O-N 2.88Å; W1284-K1287 VanDerWaalsContact O-N 3.15Å; K1287-A1289 VanDerWaalsContact C-N 3.3Å; K1287-A1289 PolarHBondContact O-N 3.47Å; K1287-N1290 PolarHBondContact O-N 2.75Å; K1287-N1290 VanDerWaalsContact O-N 3.13Å; K1287-E1291 VanDerWaalsContact CE-CD 3.42Å; K1287-E1291 WeakPolarHBondContact CE-OE1 3.4Å; K1287-E1291 WeakPolarHBondContact CE-OE2 3.39Å; K1287-E1291 HydrophobicContact CG-CG 4.46Å; K1287-E1291 WeakPolarHBondContact CG-OE1 3.45Å; K1287-E1291 IonicContact NZ-OE1 3.23Å; K1287-E1291 WeakPolarHBondContact O-CG 3.4Å; K1287-E1291 PolarHBondContact O-N 3.41Å
1288	M	93.4	Very high	94.1	Very high	8 Å²	8	40.8 Å²	40.8	4%	0.039	23%	0.229	C	C	.	.	H	α-helix	trans	-60.7	-36.9	-178.2	-67.2	-70.3	-74.7	0	0	112.6	T1143 Q1150 M1153 W1284 G1292 Q1293 Y1294	T1143-M1288 HydrophobicContact CG2-CE 4.29Å; Q1150-M1288 HydrophobicContact CB-CE 3.95Å; M1153-M1288 HydrophobicContact CE-CE 3.81Å; M1153-M1288 HydrophobicContact CG-CE 4.23Å; W1284-M1288 HydrophobicContact CD2-CG 4.32Å; W1284-M1288 HydrophobicContact CG-CG 4.35Å; W1284-M1288 HydrophobicContact CZ2-CG 4.42Å; W1284-M1288 WeakPolarHBondContact O-CG 3.38Å; W1284-M1288 PolarHBondContact O-N 3.24Å; M1288-G1292 PolarHBondContact O-N 2.83Å; M1288-Q1293 HydrophobicContact CB-CB 4.48Å; M1288-Q1293 HydrophobicContact CE-CB 3.57Å; M1288-Q1293 HydrophobicContact CE-CG 4.47Å; M1288-Q1293 CarbonylContact O-C 3.5Å; M1288-Q1293 WeakPolarHBondContact O-CA 3.42Å; M1288-Q1293 PolarHBondContact O-N 2.87Å; M1288-Q1293 HydrophobicContact SD-CB 4.11Å; M1288-Y1294 PolarHBondContact O-N 2.82Å; M1288-Y1294 VanDerWaalsContact O-N 3.12Å
1289	A	93.3	Very high	93.8	Very high	24 Å²	24	40.8 Å²	40.8	20%	0.198	23%	0.229	C	C	.	.	H	α-helix	trans	-68.1	-42.3	175.4	0	0	0	0	0	111.9	L1285 N1286 K1287 E1291 G1292	L1285-A1289 VanDerWaalsContact O-CB 3.22Å; L1285-A1289 WeakPolarHBondContact O-CB 3.41Å; L1285-A1289 PolarHBondContact O-N 2.79Å; N1286-A1289 PolarHBondContact O-N 2.82Å; K1287-A1289 VanDerWaalsContact C-N 3.3Å; K1287-A1289 PolarHBondContact O-N 3.47Å; A1289-E1291 VanDerWaalsContact C-N 3.31Å; A1289-E1291 PolarHBondContact O-N 3Å; A1289-G1292 PolarHBondContact O-N 2.99Å; A1289-G1292 VanDerWaalsContact O-N 3.13Å
1290	N	93.2	Very high	93.2	Very high	127 Å²	127	45.9 Å²	45.9	68%	0.679	25%	0.251	S	S	*	.	H	α-helix	trans	-66.9	-31.5	176.7	-68.9	-11.9	0	0	0	112.6	N1286 K1287 G1292	N1286-N1290 WeakPolarHBondContact O-CB 3.45Å; N1286-N1290 PolarHBondContact O-N 3.33Å; N1286-N1290 PolarHBondContact O-ND2 3.4Å; K1287-N1290 PolarHBondContact O-N 2.75Å; K1287-N1290 VanDerWaalsContact O-N 3.13Å; N1290-G1292 PolarHBondContact O-N 2.93Å
1291	E	92.2	Very high	92.1	Very high	101 Å²	101	45.7 Å²	45.7	47%	0.472	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	3.3	174	-69	172.6	171.5	0	0	113.3	K1287 A1289 Q1293	K1287-E1291 VanDerWaalsContact CE-CD 3.42Å; K1287-E1291 WeakPolarHBondContact CE-OE1 3.4Å; K1287-E1291 WeakPolarHBondContact CE-OE2 3.39Å; K1287-E1291 HydrophobicContact CG-CG 4.46Å; K1287-E1291 WeakPolarHBondContact CG-OE1 3.45Å; K1287-E1291 IonicContact NZ-OE1 3.23Å; K1287-E1291 WeakPolarHBondContact O-CG 3.4Å; K1287-E1291 PolarHBondContact O-N 3.41Å; A1289-E1291 VanDerWaalsContact C-N 3.31Å; A1289-E1291 PolarHBondContact O-N 3Å; E1291-Q1293 HydrophobicContact CB-CG 4.12Å; E1291-Q1293 PolarHBondContact O-N 3.14Å; E1291-Q1293 PolarHBondContact O-NE2 2.77Å
1292	G	89.3	Confident	90.8	Very high	56 Å²	56	53.4 Å²	53.4	58%	0.577	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.8	6.1	-178.4	0	0	0	0	0	114.9	M1288 A1289 N1290	M1288-G1292 PolarHBondContact O-N 2.83Å; A1289-G1292 PolarHBondContact O-N 2.99Å; A1289-G1292 VanDerWaalsContact O-N 3.13Å; N1290-G1292 PolarHBondContact O-N 2.93Å
1293	Q	89.4	Confident	88.9	Confident	59 Å²	59	57.8 Å²	57.8	28%	0.276	31%	0.306	S	S	.	.	S	Bend	trans	-87	-4.3	-177.6	-55.8	-58.2	-49.8	0	0	113.8	W1154 M1288 E1291	W1154-Q1293 HydrophobicContact CH2-CB 4.35Å; M1288-Q1293 HydrophobicContact CB-CB 4.48Å; M1288-Q1293 HydrophobicContact CE-CB 3.57Å; M1288-Q1293 HydrophobicContact CE-CG 4.47Å; M1288-Q1293 CarbonylContact O-C 3.5Å; M1288-Q1293 WeakPolarHBondContact O-CA 3.42Å; M1288-Q1293 PolarHBondContact O-N 2.87Å; M1288-Q1293 HydrophobicContact SD-CB 4.11Å; E1291-Q1293 HydrophobicContact CB-CG 4.12Å; E1291-Q1293 PolarHBondContact O-N 3.14Å; E1291-Q1293 PolarHBondContact O-NE2 2.77Å
1294	Y	93.2	Very high	87	Confident	5 Å²	5	59.1 Å²	59.1	2%	0.02	33%	0.334	C	S	.	.	S	Bend	trans	-138.4	116.7	176.9	-168.6	-105.1	0	0	0	111.5	M1153 F1178 I1181 Q1182 L1285 M1288 Y1296 W1312	M1153-Y1294 HydrophobicContact CE-CD2 4.15Å; M1153-Y1294 HydrophobicContact SD-CD2 3.98Å; M1153-Y1294 HydrophobicContact SD-CE2 4.31Å; F1178-Y1294 HydrophobicContact CB-CD2 3.99Å; F1178-Y1294 HydrophobicContact CB-CE2 3.75Å; F1178-Y1294 PolarHBondContact O-OH 2.84Å; I1181-Y1294 HydrophobicContact CB-CE2 4.41Å; I1181-Y1294 HydrophobicContact CG2-CE2 4.12Å; I1181-Y1294 WeakPolarHBondContact CG2-OH 3.2Å; Q1182-Y1294 WeakPolarHBondContact CB-OH 3.07Å; Q1182-Y1294 PolarHBondContact N-OH 3.08Å; Q1182-Y1294 PolarHBondContact OE1-OH 3.32Å; L1285-Y1294 HydrophobicContact CD2-CD1 4.02Å; L1285-Y1294 HydrophobicContact CD2-CD2 3.98Å; L1285-Y1294 HydrophobicContact CD2-CE1 3.91Å; L1285-Y1294 HydrophobicContact CD2-CE2 3.87Å; L1285-Y1294 HydrophobicContact CD2-CG 4.05Å; M1288-Y1294 PolarHBondContact O-N 2.82Å; M1288-Y1294 VanDerWaalsContact O-N 3.12Å; Y1294-Y1296 WeakPolarHBondContact CD1-O 3.32Å; Y1294-Y1296 AromaticContact CE1-CD2 3.92Å; Y1294-Y1296 HydrophobicContact CE1-CD2 3.92Å; Y1294-Y1296 HydrophobicContact CE1-CG 4.39Å; Y1294-Y1296 AromaticContact CZ-CD2 3.94Å; Y1294-Y1296 PolarHBondContact O-N 2.7Å; Y1294-W1312 AromaticContact CE1-CZ2 3.81Å; Y1294-W1312 HydrophobicContact CE1-CZ2 3.81Å
1295	P	92	Very high	85.2	Confident	77 Å²	77	64.1 Å²	64.1	50%	0.5	37%	0.37	S	S	.	.	S	Bend	trans	-67.7	-6.6	-168.2	-27.5	37.6	0	0	0	117.8	F1178	F1178-P1295 HydrophobicContact CD1-CG 4.33Å; F1178-P1295 HydrophobicContact CD2-CB 4.37Å; F1178-P1295 HydrophobicContact CD2-CG 3.81Å; F1178-P1295 HydrophobicContact CE1-CG 4.21Å; F1178-P1295 HydrophobicContact CE2-CB 4.1Å; F1178-P1295 HydrophobicContact CE2-CG 3.69Å; F1178-P1295 HydrophobicContact CG-CG 4.18Å; F1178-P1295 HydrophobicContact CZ-CG 3.92Å
1296	Y	92.8	Very high	84	Confident	80 Å²	80	73.8 Å²	73.8	31%	0.314	41%	0.407	S	S	.	.			trans	-113.1	129.2	-175.8	-56.1	-70.1	0	0	0	111.2	F1178 Q1182 Y1294 W1312	F1178-Y1296 HydrophobicContact CD2-CD2 4.22Å; F1178-Y1296 AromaticContact CD2-CE2 3.58Å; F1178-Y1296 HydrophobicContact CD2-CE2 3.58Å; F1178-Y1296 AromaticContact CE2-CE2 3.84Å; F1178-Y1296 HydrophobicContact CE2-CE2 3.84Å; Q1182-Y1296 HydrophobicContact CB-CD2 3.53Å; Q1182-Y1296 HydrophobicContact CB-CE2 3.32Å; Q1182-Y1296 HydrophobicContact CB-CG 4.42Å; Q1182-Y1296 VanDerWaalsContact CD-CD2 3.42Å; Q1182-Y1296 HydrophobicContact CG-CD1 4.2Å; Q1182-Y1296 HydrophobicContact CG-CD2 3.37Å; Q1182-Y1296 HydrophobicContact CG-CE1 4.26Å; Q1182-Y1296 HydrophobicContact CG-CE2 3.41Å; Q1182-Y1296 VanDerWaalsContact CG-CE2 3.41Å; Q1182-Y1296 HydrophobicContact CG-CG 3.77Å; Y1294-Y1296 WeakPolarHBondContact CD1-O 3.32Å; Y1294-Y1296 AromaticContact CE1-CD2 3.92Å; Y1294-Y1296 HydrophobicContact CE1-CD2 3.92Å; Y1294-Y1296 HydrophobicContact CE1-CG 4.39Å; Y1294-Y1296 AromaticContact CZ-CD2 3.94Å; Y1294-Y1296 PolarHBondContact O-N 2.7Å; Y1296-W1312 PolarHBondContact O-NE1 3.45Å
1297	A	91.4	Very high	83	Confident	67 Å²	67	77.3 Å²	77.3	55%	0.554	42%	0.422	S	S	*	.	S	Bend	trans	-85.4	1.3	178.8	0	0	0	0	0	115	T1311 W1312	A1297-T1311 WeakPolarHBondContact O-CA 3.42Å; A1297-W1312 VanDerWaalsContact C-CD1 3.5Å; A1297-W1312 PolarHBondContact O-N 3.16Å
1298	G	92.6	Very high	82.4	Confident	4 Å²	4	74.9 Å²	74.9	4%	0.041	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	167.2	-164.1	-176.5	0	0	0	0	0	113.9	Q1182 W1310	Q1182-G1298 PolarHBondContact NE2-O 3.05Å; G1298-W1310 CarbonylContact C-O 3.35Å; G1298-W1310 WeakPolarHBondContact CA-O 3.48Å
1299	V	91	Very high	82.2	Confident	0 Å²	0	79.1 Å²	79.1	0%	0	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	143.4	-179.3	-74.3	0	0	0	0	113.1	I1185 F1189 F1309 W1310 W1312 W1315	I1185-V1299 HydrophobicContact CG2-CG1 3.88Å; F1189-V1299 HydrophobicContact CB-CB 4.5Å; F1189-V1299 HydrophobicContact CB-CG2 4.48Å; F1189-V1299 HydrophobicContact CD1-CB 3.93Å; F1189-V1299 HydrophobicContact CD1-CG2 3.65Å; F1189-V1299 HydrophobicContact CD2-CG2 3.83Å; F1189-V1299 HydrophobicContact CE1-CB 4.32Å; F1189-V1299 HydrophobicContact CE1-CG2 3.69Å; F1189-V1299 HydrophobicContact CE2-CG2 3.89Å; F1189-V1299 HydrophobicContact CG-CB 4.13Å; F1189-V1299 HydrophobicContact CG-CG2 3.72Å; F1189-V1299 HydrophobicContact CZ-CG2 3.81Å; V1299-F1309 WeakPolarHBondContact O-CA 3.4Å; V1299-F1309 VanDerWaalsContact O-CD2 3.24Å; V1299-F1309 WeakPolarHBondContact O-CD2 3.42Å; V1299-W1310 HydrophobicContact CG2-CB 4.26Å; V1299-W1310 PolarHBondContact N-O 3.14Å; V1299-W1310 PolarHBondContact O-N 3.03Å; V1299-W1312 HydrophobicContact CG1-CH2 3.52Å; V1299-W1312 HydrophobicContact CG1-CZ3 3.59Å; V1299-W1315 HydrophobicContact CG1-CZ3 3.96Å; V1299-W1315 HydrophobicContact CG2-CE3 3.71Å; V1299-W1315 HydrophobicContact CG2-CZ3 3.79Å
1300	K	85.4	Confident	82.1	Confident	114 Å²	114	79.1 Å²	79.1	50%	0.496	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	128.5	177.4	-67	-177.1	177.5	-169.4	0	111.2	F1309	K1300-F1309 HydrophobicContact CG-CB 4.42Å; K1300-F1309 HydrophobicContact CG-CD2 3.59Å; K1300-F1309 HydrophobicContact CG-CE2 4.34Å; K1300-F1309 HydrophobicContact CG-CG 4.42Å
1301	C	73.2	Confident	82.2	Confident	2 Å²	2	75.3 Å²	75.3	1%	0.014	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	121.1	173.5	-171.1	0	0	0	0	110.2	F1189 N1303 E1307 V1308	F1189-C1301 HydrophobicContact CD1-CB 3.85Å; F1189-C1301 HydrophobicContact CE1-CB 3.68Å; C1301-N1303 PolarHBondContact O-N 3.14Å; C1301-N1303 PolarHBondContact SG-OD1 3.2Å; C1301-E1307 CarbonylContact O-C 3.59Å; C1301-E1307 WeakPolarHBondContact O-CA 3.19Å; C1301-V1308 HydrophobicContact CB-CB 4.47Å; C1301-V1308 PolarHBondContact N-O 3.06Å; C1301-V1308 PolarHBondContact O-N 2.88Å
1302	K	68.7	Low	82.3	Confident	163 Å²	163	70.5 Å²	70.5	71%	0.709	39%	0.388	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90	99.1	171.4	-65.4	-170.4	178.1	-171.6	0	109.4
1303	N	57.4	Low	82.6	Confident	91 Å²	91	73 Å²	73	49%	0.487	39%	0.385	S	S	.	.			trans	-81.3	160.9	163.2	-68	3.2	0	0	0	108.8	C1301 S1305 R1306	C1301-N1303 PolarHBondContact O-N 3.14Å; C1301-N1303 PolarHBondContact SG-OD1 3.2Å; N1303-S1305 PolarHBondContact O-N 3.18Å; N1303-R1306 WeakPolarHBondContact CB-O 3.48Å; N1303-R1306 PolarHBondContact N-O 3.42Å; N1303-R1306 PolarHBondContact O-N 3.23Å
1304	A	55.6	Low	82.9	Confident	118 Å²	118	73.1 Å²	73.1	98%	0.975	39%	0.389	S	S	*	.	S	Bend	trans	-58.2	-12.2	-173.7	0	0	0	0	0	115.7
1305	S	58.7	Low	83	Confident	113 Å²	113	72.9 Å²	72.9	79%	0.79	39%	0.388	S	S	*	.	S	Bend	trans	-137.1	-9.6	179.6	56.4	0	0	0	0	115.9	N1303	N1303-S1305 PolarHBondContact O-N 3.18Å
1306	R	70.6	Confident	83.2	Confident	202 Å²	202	69.5 Å²	69.5	76%	0.762	37%	0.367	S	S	*	.			trans	-150.7	141.6	178.5	-68.4	-170.3	177.3	174	-0.8	111.8	N1303	N1303-R1306 WeakPolarHBondContact CB-O 3.48Å; N1303-R1306 PolarHBondContact N-O 3.42Å; N1303-R1306 PolarHBondContact O-N 3.23Å
1307	E	74.8	Confident	83.4	Confident	109 Å²	109	69.2 Å²	69.2	51%	0.509	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	126.6	168.3	-171.9	166.4	-139.9	0	0	109.7	C1301	C1301-E1307 CarbonylContact O-C 3.59Å; C1301-E1307 WeakPolarHBondContact O-CA 3.19Å
1308	V	81.8	Confident	83.6	Confident	52 Å²	52	69 Å²	69	32%	0.315	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	120.1	177.9	179.8	0	0	0	0	108.5	C1301	C1301-V1308 HydrophobicContact CB-CB 4.47Å; C1301-V1308 PolarHBondContact N-O 3.06Å; C1301-V1308 PolarHBondContact O-N 2.88Å
1309	F	89.6	Confident	83.8	Confident	98 Å²	98	68.9 Å²	68.9	43%	0.43	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	130.1	175	176.8	-113	0	0	0	110.3	V1299 K1300 T1311	V1299-F1309 WeakPolarHBondContact O-CA 3.4Å; V1299-F1309 VanDerWaalsContact O-CD2 3.24Å; V1299-F1309 WeakPolarHBondContact O-CD2 3.42Å; K1300-F1309 HydrophobicContact CG-CB 4.42Å; K1300-F1309 HydrophobicContact CG-CD2 3.59Å; K1300-F1309 HydrophobicContact CG-CE2 4.34Å; K1300-F1309 HydrophobicContact CG-CG 4.42Å; F1309-T1311 HydrophobicContact CE1-CG2 3.86Å; F1309-T1311 HydrophobicContact CZ-CG2 4.31Å
1310	W	91.9	Very high	84	Confident	23 Å²	23	72.9 Å²	72.9	9%	0.087	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	132.4	168.3	-71.5	3.2	0	0	0	108.8	F1189 V1229 K1231 G1298 V1299 T1314 W1315 K1318	F1189-W1310 AromaticContact CE2-CD2 3.88Å; F1189-W1310 HydrophobicContact CE2-CD2 3.88Å; F1189-W1310 AromaticContact CE2-CE3 3.44Å; F1189-W1310 HydrophobicContact CE2-CE3 3.44Å; F1189-W1310 VanDerWaalsContact CE2-CE3 3.44Å; F1189-W1310 HydrophobicContact CE2-CH2 4.34Å; F1189-W1310 AromaticContact CE2-CZ3 3.71Å; F1189-W1310 HydrophobicContact CE2-CZ3 3.71Å; F1189-W1310 HydrophobicContact CZ-CB 4.35Å; F1189-W1310 AromaticContact CZ-CD2 3.6Å; F1189-W1310 HydrophobicContact CZ-CD2 3.6Å; F1189-W1310 AromaticContact CZ-CE3 3.7Å; F1189-W1310 HydrophobicContact CZ-CE3 3.7Å; F1189-W1310 AromaticContact CZ-CG 3.91Å; F1189-W1310 HydrophobicContact CZ-CG 3.91Å; F1189-W1310 HydrophobicContact CZ-CZ3 4.23Å; V1229-W1310 HydrophobicContact CG1-CZ3 4.42Å; K1231-W1310 HydrophobicContact CB-CZ2 4.29Å; K1231-W1310 HydrophobicContact CD-CH2 4.25Å; K1231-W1310 HydrophobicContact CD-CZ2 4.14Å; K1231-W1310 WeakPolarHBondContact O-CH2 3.37Å; K1231-W1310 WeakPolarHBondContact O-CZ2 3.49Å; G1298-W1310 CarbonylContact C-O 3.35Å; G1298-W1310 WeakPolarHBondContact CA-O 3.48Å; V1299-W1310 HydrophobicContact CG2-CB 4.26Å; V1299-W1310 PolarHBondContact N-O 3.14Å; V1299-W1310 PolarHBondContact O-N 3.03Å; W1310-T1314 HydrophobicContact CG-CG2 4.45Å; W1310-W1315 HydrophobicContact CE3-CB 3.8Å; W1310-W1315 AromaticContact CE3-CD1 3.97Å; W1310-W1315 HydrophobicContact CE3-CD2 4.22Å; W1310-W1315 AromaticContact CE3-CG 3.71Å; W1310-W1315 HydrophobicContact CE3-CG 3.71Å; W1310-W1315 HydrophobicContact CZ3-CB 4.41Å; W1310-W1315 AromaticContact CZ3-CD1 3.73Å; W1310-W1315 AromaticContact CZ3-CG 3.97Å; W1310-W1315 HydrophobicContact CZ3-CG 3.97Å; W1310-K1318 HydrophobicContact CD2-CD 4.29Å; W1310-K1318 HydrophobicContact CE3-CD 4.05Å; W1310-K1318 HydrophobicContact CH2-CD 3.4Å; W1310-K1318 HydrophobicContact CZ2-CD 3.66Å; W1310-K1318 HydrophobicContact CZ3-CD 3.6Å
1311	T	94.5	Very high	84.5	Confident	47 Å²	47	70.4 Å²	70.4	29%	0.288	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	157.8	164.5	64.2	0	0	0	0	110.1	A1297 F1309 E1313 T1314 W1315	A1297-T1311 WeakPolarHBondContact O-CA 3.42Å; F1309-T1311 HydrophobicContact CE1-CG2 3.86Å; F1309-T1311 HydrophobicContact CZ-CG2 4.31Å; T1311-E1313 VanDerWaalsContact C-N 3.32Å; T1311-E1313 PolarHBondContact O-N 3.15Å; T1311-T1314 PolarHBondContact O-N 3.21Å; T1311-T1314 VanDerWaalsContact O-N 3.17Å; T1311-T1314 WeakPolarHBondContact OG1-CB 3.42Å; T1311-T1314 PolarHBondContact OG1-N 3.17Å; T1311-T1314 VanDerWaalsContact OG1-N 3.14Å; T1311-T1314 PolarHBondContact OG1-OG1 3.42Å; T1311-W1315 PolarHBondContact O-N 3.35Å; T1311-W1315 VanDerWaalsContact O-N 3.11Å
1312	W	95.4	Very high	85.6	Confident	1 Å²	1	71 Å²	71	0%	0.004	38%	0.381	C	S	.	.	H	α-helix	trans	-57.2	-46	176.6	-58.3	124.2	0	0	0	111.9	I1185 I1282 L1285 N1286 Y1294 Y1296 A1297 V1299 T1314 W1315 A1316	I1185-W1312 HydrophobicContact CG2-CH2 4.27Å; I1185-W1312 HydrophobicContact CG2-CZ3 4.05Å; I1282-W1312 HydrophobicContact CD1-CE3 3.51Å; I1282-W1312 HydrophobicContact CD1-CZ3 3.43Å; I1282-W1312 VanDerWaalsContact CD1-CZ3 3.43Å; I1282-W1312 HydrophobicContact CG2-CB 4.35Å; I1282-W1312 HydrophobicContact CG2-CE3 4.23Å; I1282-W1312 VanDerWaalsContact CG2-O 3.3Å; I1282-W1312 WeakPolarHBondContact CG2-O 3.46Å; L1285-W1312 HydrophobicContact CB-CD2 4.06Å; L1285-W1312 HydrophobicContact CB-CE3 4.47Å; L1285-W1312 HydrophobicContact CB-CG 4.29Å; L1285-W1312 HydrophobicContact CD1-CE3 4.44Å; L1285-W1312 HydrophobicContact CD1-CH2 4Å; L1285-W1312 HydrophobicContact CD1-CZ2 4.25Å; L1285-W1312 HydrophobicContact CD1-CZ3 4.09Å; N1286-W1312 HydrophobicContact CB-CB 3.63Å; N1286-W1312 WeakPolarHBondContact OD1-CB 3.17Å; Y1294-W1312 AromaticContact CE1-CZ2 3.81Å; Y1294-W1312 HydrophobicContact CE1-CZ2 3.81Å; Y1296-W1312 PolarHBondContact O-NE1 3.45Å; A1297-W1312 VanDerWaalsContact C-CD1 3.5Å; A1297-W1312 PolarHBondContact O-N 3.16Å; V1299-W1312 HydrophobicContact CG1-CH2 3.52Å; V1299-W1312 HydrophobicContact CG1-CZ3 3.59Å; W1312-T1314 PolarHBondContact O-N 3.38Å; W1312-W1315 HydrophobicContact CE3-CE3 4.38Å; W1312-W1315 HydrophobicContact CZ3-CE3 4.25Å; W1312-W1315 HydrophobicContact CZ3-CZ3 4.14Å; W1312-W1315 PolarHBondContact O-N 3.01Å; W1312-A1316 PolarHBondContact O-N 3.48Å
1313	E	95.2	Very high	87	Confident	109 Å²	109	63.2 Å²	63.2	51%	0.509	35%	0.348	S	S	.	.	H	α-helix	trans	-55	-46.9	172.3	-179.5	175.2	-149.3	0	0	113.2	N1286 T1311 W1315 A1316 N1317	N1286-E1313 PolarHBondContact OD1-N 2.94Å; N1286-E1313 VanDerWaalsContact OD1-N 3.14Å; T1311-E1313 VanDerWaalsContact C-N 3.32Å; T1311-E1313 PolarHBondContact O-N 3.15Å; E1313-W1315 PolarHBondContact O-N 2.84Å; E1313-A1316 PolarHBondContact O-N 3.35Å; E1313-N1317 WeakPolarHBondContact CG-ND2 3.13Å; E1313-N1317 WeakPolarHBondContact O-CB 3.23Å; E1313-N1317 VanDerWaalsContact O-CG 3.28Å; E1313-N1317 PolarHBondContact O-N 3.39Å; E1313-N1317 PolarHBondContact O-ND2 2.98Å
1314	T	94.9	Very high	88.8	Confident	60 Å²	60	60.8 Å²	60.8	37%	0.368	33%	0.333	S	S	.	.	H	α-helix	trans	-59.1	-38.5	178.2	-61.5	0	0	0	0	111.5	W1310 T1311 W1312 K1318	W1310-T1314 HydrophobicContact CG-CG2 4.45Å; T1311-T1314 PolarHBondContact O-N 3.21Å; T1311-T1314 VanDerWaalsContact O-N 3.17Å; T1311-T1314 WeakPolarHBondContact OG1-CB 3.42Å; T1311-T1314 PolarHBondContact OG1-N 3.17Å; T1311-T1314 VanDerWaalsContact OG1-N 3.14Å; T1311-T1314 PolarHBondContact OG1-OG1 3.42Å; W1312-T1314 PolarHBondContact O-N 3.38Å; T1314-K1318 WeakPolarHBondContact O-CG 3.48Å; T1314-K1318 PolarHBondContact O-N 3.3Å
1315	W	95.9	Very high	90.6	Very high	0 Å²	0	63.6 Å²	63.6	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-73	-46.1	178.1	-168.9	-4	0	0	0	111.6	I1185 F1189 V1229 G1234 I1282 V1299 W1310 T1311 W1312 E1313 N1317 K1318 I1319	I1185-W1315 HydrophobicContact CG2-CH2 3.7Å; I1185-W1315 HydrophobicContact CG2-CZ3 3.54Å; F1189-W1315 HydrophobicContact CB-CH2 4.31Å; F1189-W1315 HydrophobicContact CB-CZ3 4.46Å; F1189-W1315 HydrophobicContact CD2-CD2 4.43Å; F1189-W1315 HydrophobicContact CD2-CE3 4.14Å; F1189-W1315 AromaticContact CD2-CH2 3.81Å; F1189-W1315 HydrophobicContact CD2-CH2 3.81Å; F1189-W1315 HydrophobicContact CD2-CZ2 4.1Å; F1189-W1315 AromaticContact CD2-CZ3 3.81Å; F1189-W1315 HydrophobicContact CD2-CZ3 3.81Å; F1189-W1315 HydrophobicContact CE2-CD2 4.41Å; F1189-W1315 HydrophobicContact CE2-CE3 4.34Å; F1189-W1315 HydrophobicContact CE2-CZ3 4.47Å; F1189-W1315 HydrophobicContact CG-CH2 4.48Å; F1189-W1315 HydrophobicContact CG-CZ3 4.39Å; V1229-W1315 HydrophobicContact CB-CZ2 4.31Å; V1229-W1315 HydrophobicContact CG1-CZ2 3.8Å; V1229-W1315 HydrophobicContact CG2-CH2 4.02Å; V1229-W1315 HydrophobicContact CG2-CZ2 3.56Å; G1234-W1315 PolarHBondContact O-NE1 3.38Å; I1282-W1315 HydrophobicContact CD1-CD2 3.99Å; I1282-W1315 HydrophobicContact CD1-CE3 3.46Å; I1282-W1315 VanDerWaalsContact CD1-CE3 3.46Å; I1282-W1315 HydrophobicContact CD1-CH2 3.86Å; I1282-W1315 HydrophobicContact CD1-CZ2 4.35Å; I1282-W1315 HydrophobicContact CD1-CZ3 3.4Å; I1282-W1315 HydrophobicContact CG1-CD2 4.17Å; I1282-W1315 HydrophobicContact CG1-CE3 4.15Å; I1282-W1315 HydrophobicContact CG1-CH2 4.46Å; I1282-W1315 HydrophobicContact CG1-CZ2 4.49Å; I1282-W1315 HydrophobicContact CG1-CZ3 4.31Å; I1282-W1315 HydrophobicContact CG2-CB 4.04Å; I1282-W1315 HydrophobicContact CG2-CD2 4.43Å; I1282-W1315 HydrophobicContact CG2-CG 4.26Å; V1299-W1315 HydrophobicContact CG1-CZ3 3.96Å; V1299-W1315 HydrophobicContact CG2-CE3 3.71Å; V1299-W1315 HydrophobicContact CG2-CZ3 3.79Å; W1310-W1315 HydrophobicContact CE3-CB 3.8Å; W1310-W1315 AromaticContact CE3-CD1 3.97Å; W1310-W1315 HydrophobicContact CE3-CD2 4.22Å; W1310-W1315 AromaticContact CE3-CG 3.71Å; W1310-W1315 HydrophobicContact CE3-CG 3.71Å; W1310-W1315 HydrophobicContact CZ3-CB 4.41Å; W1310-W1315 AromaticContact CZ3-CD1 3.73Å; W1310-W1315 AromaticContact CZ3-CG 3.97Å; W1310-W1315 HydrophobicContact CZ3-CG 3.97Å; T1311-W1315 PolarHBondContact O-N 3.35Å; T1311-W1315 VanDerWaalsContact O-N 3.11Å; W1312-W1315 HydrophobicContact CE3-CE3 4.38Å; W1312-W1315 HydrophobicContact CZ3-CE3 4.25Å; W1312-W1315 HydrophobicContact CZ3-CZ3 4.14Å; W1312-W1315 PolarHBondContact O-N 3.01Å; E1313-W1315 PolarHBondContact O-N 2.84Å; W1315-N1317 VanDerWaalsContact C-N 3.32Å; W1315-N1317 PolarHBondContact O-N 3.21Å; W1315-K1318 WeakPolarHBondContact O-CB 3.3Å; W1315-K1318 PolarHBondContact O-N 2.71Å; W1315-I1319 PolarHBondContact O-N 3.47Å; W1315-I1319 VanDerWaalsContact O-N 3.15Å
1316	A	95.8	Very high	92.3	Very high	7 Å²	7	59.3 Å²	59.3	6%	0.058	29%	0.294	C	S	.	.	H	α-helix	trans	-55.6	-47.3	175.3	0	0	0	0	0	111.6	Y1279 I1282 W1312 E1313 K1318 I1319 M1320	Y1279-A1316 HydrophobicContact CD2-CB 4.21Å; Y1279-A1316 HydrophobicContact CE2-CB 3.93Å; Y1279-A1316 WeakPolarHBondContact CE2-O 2.96Å; I1282-A1316 HydrophobicContact CG2-CB 4.2Å; W1312-A1316 PolarHBondContact O-N 3.48Å; E1313-A1316 PolarHBondContact O-N 3.35Å; A1316-K1318 VanDerWaalsContact C-N 3.32Å; A1316-K1318 PolarHBondContact O-N 2.8Å; A1316-I1319 PolarHBondContact O-N 2.61Å; A1316-M1320 WeakPolarHBondContact O-CB 3.31Å; A1316-M1320 PolarHBondContact O-N 3.11Å
1317	N	96.6	Very high	93.5	Very high	73 Å²	73	49.7 Å²	49.7	39%	0.39	26%	0.257	S	S	.	.	H	α-helix	trans	-63.9	-33.9	179.4	-71.8	-18.2	0	0	0	112.9	E1313 W1315 A1321	E1313-N1317 WeakPolarHBondContact CG-ND2 3.13Å; E1313-N1317 WeakPolarHBondContact O-CB 3.23Å; E1313-N1317 VanDerWaalsContact O-CG 3.28Å; E1313-N1317 PolarHBondContact O-N 3.39Å; E1313-N1317 PolarHBondContact O-ND2 2.98Å; W1315-N1317 VanDerWaalsContact C-N 3.32Å; W1315-N1317 PolarHBondContact O-N 3.21Å; N1317-A1321 VanDerWaalsContact O-CB 3.24Å; N1317-A1321 WeakPolarHBondContact O-CB 3.37Å; N1317-A1321 PolarHBondContact O-N 2.93Å
1318	K	95.9	Very high	94.5	Very high	64 Å²	64	46.1 Å²	46.1	28%	0.278	24%	0.239	S	C	.	.	H	α-helix	trans	-63.1	-48.8	173	-83.6	173.7	159.5	-76	0	112.3	K1231 Q1232 T1233 W1310 T1314 W1315 A1316 A1321 A1322	K1231-K1318 PolarHBondContact O-NZ 3.2Å; Q1232-K1318 PolarHBondContact O-NZ 2.98Å; Q1232-K1318 VanDerWaalsContact O-NZ 3.11Å; T1233-K1318 CarbonylContact O-C 3.59Å; T1233-K1318 VanDerWaalsContact O-O 3.08Å; W1310-K1318 HydrophobicContact CD2-CD 4.29Å; W1310-K1318 HydrophobicContact CE3-CD 4.05Å; W1310-K1318 HydrophobicContact CH2-CD 3.4Å; W1310-K1318 HydrophobicContact CZ2-CD 3.66Å; W1310-K1318 HydrophobicContact CZ3-CD 3.6Å; T1314-K1318 WeakPolarHBondContact O-CG 3.48Å; T1314-K1318 PolarHBondContact O-N 3.3Å; W1315-K1318 WeakPolarHBondContact O-CB 3.3Å; W1315-K1318 PolarHBondContact O-N 2.71Å; A1316-K1318 VanDerWaalsContact C-N 3.32Å; A1316-K1318 PolarHBondContact O-N 2.8Å; K1318-A1321 PolarHBondContact O-N 3.35Å; K1318-A1322 WeakPolarHBondContact O-CB 3.21Å; K1318-A1322 PolarHBondContact O-N 2.95Å
1319	I	96.8	Very high	94.9	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-61	-49.3	178.2	-62.4	166.2	0	0	0	109.5	T1233 G1234 F1235 V1275 Y1279 W1315 A1316 A1321 A1322 F1323 L1382	T1233-I1319 WeakPolarHBondContact O-CA 3.28Å; T1233-I1319 PolarHBondContact O-N 3.07Å; G1234-I1319 WeakPolarHBondContact O-CG1 3.47Å; F1235-I1319 HydrophobicContact CD1-CG1 4.45Å; F1235-I1319 HydrophobicContact CD1-CG2 4.12Å; F1235-I1319 HydrophobicContact CE1-CG2 4.08Å; V1275-I1319 HydrophobicContact CG1-CG2 3.69Å; Y1279-I1319 HydrophobicContact CD2-CB 4.06Å; Y1279-I1319 HydrophobicContact CD2-CG2 4.13Å; Y1279-I1319 HydrophobicContact CG-CG2 4.44Å; W1315-I1319 PolarHBondContact O-N 3.47Å; W1315-I1319 VanDerWaalsContact O-N 3.15Å; A1316-I1319 PolarHBondContact O-N 2.61Å; I1319-A1321 PolarHBondContact O-N 3.09Å; I1319-A1322 PolarHBondContact O-N 3.32Å; I1319-A1322 VanDerWaalsContact O-N 3.14Å; I1319-F1323 WeakPolarHBondContact O-CB 3.44Å; I1319-F1323 PolarHBondContact O-N 3.06Å; I1319-L1382 HydrophobicContact CG2-CD1 4.5Å; I1319-L1382 HydrophobicContact CG2-CD2 4.17Å
1320	M	96.3	Very high	94.8	Very high	85 Å²	85	43.5 Å²	43.5	42%	0.419	23%	0.232	S	C	.	.	H	α-helix	trans	-58.3	-44.7	-179.8	-168.3	175.4	74.4	0	0	112.6	Y1279 A1316 A1322 L1382	Y1279-M1320 HydrophobicContact CE2-CB 4.05Å; A1316-M1320 WeakPolarHBondContact O-CB 3.31Å; A1316-M1320 PolarHBondContact O-N 3.11Å; M1320-A1322 PolarHBondContact O-N 3.2Å; M1320-L1382 HydrophobicContact CB-CD2 4.15Å; M1320-L1382 HydrophobicContact CG-CD2 4.36Å
1321	A	95.5	Very high	94.4	Very high	62 Å²	62	47 Å²	47	51%	0.512	25%	0.253	S	S	.	.	H	α-helix	trans	-70.5	-16.8	179.9	0	0	0	0	0	114.6	N1317 K1318 I1319 K1325	N1317-A1321 VanDerWaalsContact O-CB 3.24Å; N1317-A1321 WeakPolarHBondContact O-CB 3.37Å; N1317-A1321 PolarHBondContact O-N 2.93Å; K1318-A1321 PolarHBondContact O-N 3.35Å; I1319-A1321 PolarHBondContact O-N 3.09Å; A1321-K1325 PolarHBondContact O-NZ 3.42Å
1322	A	96	Very high	93.3	Very high	14 Å²	14	49 Å²	49	12%	0.116	26%	0.261	C	S	.	.	H	α-helix	trans	-106	-28.1	-178	0	0	0	0	0	114	T1233 F1235 K1318 I1319 M1320 S1326	T1233-A1322 HydrophobicContact CG2-CB 3.99Å; F1235-A1322 HydrophobicContact CE1-CB 3.84Å; F1235-A1322 HydrophobicContact CZ-CB 3.7Å; K1318-A1322 WeakPolarHBondContact O-CB 3.21Å; K1318-A1322 PolarHBondContact O-N 2.95Å; I1319-A1322 PolarHBondContact O-N 3.32Å; I1319-A1322 VanDerWaalsContact O-N 3.14Å; M1320-A1322 PolarHBondContact O-N 3.2Å; A1322-S1326 VanDerWaalsContact O-CB 3.29Å; A1322-S1326 WeakPolarHBondContact O-CB 3.49Å; A1322-S1326 PolarHBondContact O-N 3.43Å; A1322-S1326 VanDerWaalsContact O-N 3.07Å; A1322-S1326 PolarHBondContact O-OG 2.84Å
1323	F	97.5	Very high	91.5	Very high	0 Å²	0	56 Å²	56	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-55.9	-65.2	-168.7	-174.5	-90.8	0	0	0	112.6	F1235 V1272 V1275 I1319 K1325 S1326 F1327 Y1353 L1382 F1383	F1235-F1323 HydrophobicContact CE1-CB 4.45Å; V1272-F1323 HydrophobicContact CG2-CE2 4.06Å; V1272-F1323 HydrophobicContact CG2-CZ 3.83Å; V1275-F1323 HydrophobicContact CG1-CD2 3.93Å; V1275-F1323 HydrophobicContact CG1-CE2 4.25Å; I1319-F1323 WeakPolarHBondContact O-CB 3.44Å; I1319-F1323 PolarHBondContact O-N 3.06Å; F1323-K1325 VanDerWaalsContact C-N 3.31Å; F1323-K1325 PolarHBondContact O-N 3.3Å; F1323-S1326 PolarHBondContact O-N 3.46Å; F1323-F1327 AromaticContact CD2-CD2 3.64Å; F1323-F1327 HydrophobicContact CD2-CD2 3.64Å; F1323-F1327 AromaticContact CD2-CE2 3.93Å; F1323-F1327 HydrophobicContact CD2-CE2 3.93Å; F1323-F1327 AromaticContact CE2-CD2 3.71Å; F1323-F1327 HydrophobicContact CE2-CD2 3.71Å; F1323-F1327 AromaticContact CE2-CE2 3.98Å; F1323-F1327 HydrophobicContact CE2-CE2 3.98Å; F1323-F1327 HydrophobicContact CE2-CG 4.22Å; F1323-F1327 HydrophobicContact CG-CD2 4.16Å; F1323-F1327 HydrophobicContact CZ-CB 4.47Å; F1323-F1327 HydrophobicContact CZ-CD2 4.27Å; F1323-F1327 HydrophobicContact CZ-CG 4.39Å; F1323-F1327 PolarHBondContact O-N 3.25Å; F1323-Y1353 HydrophobicContact CE1-CD1 4.3Å; F1323-Y1353 HydrophobicContact CE1-CE1 4.33Å; F1323-L1382 HydrophobicContact CB-CB 4.43Å; F1323-L1382 HydrophobicContact CB-CD2 4.23Å; F1323-L1382 HydrophobicContact CD1-CB 3.75Å; F1323-L1382 VanDerWaalsContact CD1-O 3.24Å; F1323-L1382 WeakPolarHBondContact CD1-O 3.32Å; F1323-L1382 HydrophobicContact CD2-CB 4.43Å; F1323-L1382 HydrophobicContact CD2-CD1 3.95Å; F1323-L1382 HydrophobicContact CE1-CB 4.06Å; F1323-L1382 HydrophobicContact CE2-CD1 4.16Å; F1323-L1382 HydrophobicContact CG-CB 3.95Å; F1323-L1382 HydrophobicContact CG-CD1 4.24Å; F1323-L1382 HydrophobicContact CG-CD2 4.45Å; F1323-L1382 HydrophobicContact CG-CG 4.46Å; F1323-F1383 HydrophobicContact CE1-CD1 4.05Å; F1323-F1383 HydrophobicContact CE1-CD2 4.22Å; F1323-F1383 AromaticContact CE1-CE1 3.68Å; F1323-F1383 HydrophobicContact CE1-CE1 3.68Å; F1323-F1383 AromaticContact CE1-CE2 3.86Å; F1323-F1383 HydrophobicContact CE1-CE2 3.86Å; F1323-F1383 HydrophobicContact CE1-CG 4.29Å; F1323-F1383 AromaticContact CE1-CZ 3.57Å; F1323-F1383 HydrophobicContact CE1-CZ 3.57Å; F1323-F1383 AromaticContact CZ-CE1 3.93Å; F1323-F1383 HydrophobicContact CZ-CE1 3.93Å; F1323-F1383 AromaticContact CZ-CE2 3.89Å; F1323-F1383 HydrophobicContact CZ-CE2 3.89Å; F1323-F1383 AromaticContact CZ-CZ 3.46Å; F1323-F1383 HydrophobicContact CZ-CZ 3.46Å; F1323-F1383 VanDerWaalsContact CZ-CZ 3.46Å
1324	E	95.2	Very high	89.4	Confident	40 Å²	40	59 Å²	59	19%	0.187	31%	0.31	C	S	.	.	H	α-helix	trans	-55.2	-46.8	-176.1	-167.7	63.8	-155.6	0	0	111.3	S1326 W1328 Y1353 D1384 N1387	E1324-S1326 PolarHBondContact O-N 3.38Å; E1324-W1328 WeakPolarHBondContact O-CB 3.46Å; E1324-W1328 PolarHBondContact O-N 3.19Å; E1324-Y1353 PolarHBondContact OE1-OH 3.33Å; E1324-Y1353 WeakPolarHBondContact OE2-CE1 3.24Å; E1324-Y1353 PolarHBondContact OE2-OH 3.01Å; E1324-Y1353 VanDerWaalsContact OE2-OH 3.13Å; E1324-D1384 PolarHBondContact OE2-N 2.96Å; E1324-N1387 PolarHBondContact OE1-ND2 2.78Å
1325	K	93.8	Very high	87	Confident	176 Å²	176	61 Å²	61	77%	0.765	33%	0.327	S	S	*	.	H	α-helix	trans	-62.4	-27.2	179.1	-63.7	173.2	-173.3	154.8	0	114.1	A1321 F1323	A1321-K1325 PolarHBondContact O-NZ 3.42Å; F1323-K1325 VanDerWaalsContact C-N 3.31Å; F1323-K1325 PolarHBondContact O-N 3.3Å
1326	S	94.4	Very high	84.7	Confident	24 Å²	24	66.8 Å²	66.8	17%	0.168	35%	0.354	C	S	.	.	H	α-helix	trans	-95.6	-39.6	-174.8	-54.9	0	0	0	0	112.2	A1322 F1323 E1324 K1354	A1322-S1326 VanDerWaalsContact O-CB 3.29Å; A1322-S1326 WeakPolarHBondContact O-CB 3.49Å; A1322-S1326 PolarHBondContact O-N 3.43Å; A1322-S1326 VanDerWaalsContact O-N 3.07Å; A1322-S1326 PolarHBondContact O-OG 2.84Å; F1323-S1326 PolarHBondContact O-N 3.46Å; E1324-S1326 PolarHBondContact O-N 3.38Å; S1326-K1354 WeakPolarHBondContact O-CD 3.44Å; S1326-K1354 WeakPolarHBondContact O-CE 3.25Å; S1326-K1354 PolarHBondContact O-NZ 3.33Å
1327	F	95.9	Very high	82	Confident	0 Å²	0	76.6 Å²	76.6	0%	0	40%	0.395	C	S	.	.	H	α-helix	trans	-95.9	-31.4	-173.3	-76.5	-83.9	0	0	0	113.9	F1235 V1272 V1275 F1323 Y1353 K1354 V1357	F1235-F1327 HydrophobicContact CD2-CE2 4.14Å; F1235-F1327 HydrophobicContact CE1-CE2 4.36Å; F1235-F1327 HydrophobicContact CE2-CD2 4.27Å; F1235-F1327 AromaticContact CE2-CE2 3.7Å; F1235-F1327 HydrophobicContact CE2-CE2 3.7Å; F1235-F1327 HydrophobicContact CZ-CD2 4.16Å; F1235-F1327 AromaticContact CZ-CE2 3.83Å; F1235-F1327 HydrophobicContact CZ-CE2 3.83Å; V1272-F1327 HydrophobicContact CB-CD1 3.89Å; V1272-F1327 HydrophobicContact CB-CE1 3.61Å; V1272-F1327 HydrophobicContact CB-CZ 4.35Å; V1272-F1327 HydrophobicContact CG2-CD1 3.8Å; V1272-F1327 HydrophobicContact CG2-CE1 3.94Å; V1272-F1327 HydrophobicContact CG2-CG 4.33Å; V1275-F1327 HydrophobicContact CB-CE2 4.45Å; V1275-F1327 HydrophobicContact CB-CZ 4.44Å; V1275-F1327 HydrophobicContact CG1-CE2 4.34Å; V1275-F1327 HydrophobicContact CG2-CE2 4.26Å; V1275-F1327 HydrophobicContact CG2-CZ 4.02Å; F1323-F1327 AromaticContact CD2-CD2 3.64Å; F1323-F1327 HydrophobicContact CD2-CD2 3.64Å; F1323-F1327 AromaticContact CD2-CE2 3.93Å; F1323-F1327 HydrophobicContact CD2-CE2 3.93Å; F1323-F1327 AromaticContact CE2-CD2 3.71Å; F1323-F1327 HydrophobicContact CE2-CD2 3.71Å; F1323-F1327 AromaticContact CE2-CE2 3.98Å; F1323-F1327 HydrophobicContact CE2-CE2 3.98Å; F1323-F1327 HydrophobicContact CE2-CG 4.22Å; F1323-F1327 HydrophobicContact CG-CD2 4.16Å; F1323-F1327 HydrophobicContact CZ-CB 4.47Å; F1323-F1327 HydrophobicContact CZ-CD2 4.27Å; F1323-F1327 HydrophobicContact CZ-CG 4.39Å; F1323-F1327 PolarHBondContact O-N 3.25Å; F1327-Y1353 HydrophobicContact CB-CD1 3.99Å; F1327-Y1353 CarbonylContact O-C 3.58Å; F1327-Y1353 WeakPolarHBondContact O-CA 3.37Å; F1327-K1354 HydrophobicContact CD1-CB 4.11Å; F1327-K1354 WeakPolarHBondContact CD1-O 3.49Å; F1327-K1354 WeakPolarHBondContact O-CG 3.2Å; F1327-K1354 PolarHBondContact O-N 3.37Å; F1327-V1357 HydrophobicContact CD1-CG2 3.74Å; F1327-V1357 HydrophobicContact CD2-CG2 4.12Å; F1327-V1357 HydrophobicContact CE1-CB 4.33Å; F1327-V1357 HydrophobicContact CE1-CG2 3.6Å; F1327-V1357 HydrophobicContact CE2-CG2 3.99Å; F1327-V1357 HydrophobicContact CG-CG2 4Å; F1327-V1357 HydrophobicContact CZ-CB 4.16Å; F1327-V1357 HydrophobicContact CZ-CG2 3.73Å
1328	W	95.3	Very high	79.3	Confident	34 Å²	34	77.7 Å²	77.7	13%	0.129	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	138.2	-179.6	-178.5	-127.1	0	0	0	111.9	E1324 Y1353 N1387 I1390 A1391	E1324-W1328 WeakPolarHBondContact O-CB 3.46Å; E1324-W1328 PolarHBondContact O-N 3.19Å; W1328-Y1353 HydrophobicContact CB-CD1 4.39Å; W1328-Y1353 HydrophobicContact CB-CE1 4.08Å; W1328-Y1353 HydrophobicContact CE3-CD1 4.18Å; W1328-Y1353 HydrophobicContact CE3-CD2 4Å; W1328-Y1353 AromaticContact CE3-CE1 3.88Å; W1328-Y1353 HydrophobicContact CE3-CE1 3.88Å; W1328-Y1353 AromaticContact CE3-CE2 3.65Å; W1328-Y1353 HydrophobicContact CE3-CE2 3.65Å; W1328-Y1353 HydrophobicContact CE3-CG 4.24Å; W1328-Y1353 AromaticContact CE3-CZ 3.59Å; W1328-Y1353 HydrophobicContact CZ3-CD2 4.14Å; W1328-Y1353 AromaticContact CZ3-CE2 3.74Å; W1328-Y1353 HydrophobicContact CZ3-CE2 3.74Å; W1328-N1387 HydrophobicContact CD2-CB 3.86Å; W1328-N1387 HydrophobicContact CE3-CB 3.84Å; W1328-N1387 HydrophobicContact CH2-CB 3.65Å; W1328-N1387 WeakPolarHBondContact CH2-O 3.16Å; W1328-N1387 HydrophobicContact CZ2-CB 3.66Å; W1328-N1387 VanDerWaalsContact CZ2-CG 3.45Å; W1328-N1387 VanDerWaalsContact CZ2-OD1 3.22Å; W1328-N1387 WeakPolarHBondContact CZ2-OD1 3.28Å; W1328-N1387 HydrophobicContact CZ3-CB 3.72Å; W1328-N1387 WeakPolarHBondContact CZ3-O 3.5Å; W1328-N1387 PolarHBondContact NE1-ND2 2.87Å; W1328-N1387 PolarHBondContact NE1-OD1 3.34Å; W1328-I1390 HydrophobicContact CH2-CB 4.31Å; W1328-I1390 HydrophobicContact CH2-CG2 4.28Å; W1328-A1391 HydrophobicContact CZ3-CB 4.24Å
1329	I	91.3	Very high	76.5	Confident	10 Å²	10	79.8 Å²	79.8	5%	0.051	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	101.9	170.2	-48.3	176.5	0	0	0	108.1	N1349 T1350 G1351 Y1352 K1354 T1366	I1329-N1349 WeakPolarHBondContact CG2-O 3.47Å; I1329-T1350 HydrophobicContact CG2-CG2 3.9Å; I1329-G1351 WeakPolarHBondContact O-CA 3.43Å; I1329-G1351 PolarHBondContact O-N 3.3Å; I1329-Y1352 WeakPolarHBondContact CB-O 3.31Å; I1329-Y1352 HydrophobicContact CD1-CD2 4.24Å; I1329-Y1352 HydrophobicContact CD1-CE2 3.82Å; I1329-Y1352 WeakPolarHBondContact CG1-O 3.33Å; I1329-Y1352 PolarHBondContact N-O 3.24Å; I1329-K1354 HydrophobicContact CD1-CG 3.79Å; I1329-K1354 HydrophobicContact CG1-CG 3.71Å; I1329-T1366 HydrophobicContact CD1-CG2 4.3Å
1330	P	87.3	Confident	74	Confident	85 Å²	85	86 Å²	86	55%	0.552	47%	0.468	S	S	*	.	P	Polyproline II helix	trans	-57.3	146.5	-179.3	-24.6	33.9	0	0	0	112.9	I1332 T1350	P1330-I1332 PolarHBondContact O-N 2.9Å; P1330-T1350 WeakPolarHBondContact O-CB 3.47Å; P1330-T1350 VanDerWaalsContact O-CG2 3.28Å; P1330-T1350 WeakPolarHBondContact O-CG2 3.34Å
1331	L	82.9	Confident	71.2	Confident	97 Å²	97	86.4 Å²	86.4	51%	0.508	48%	0.48	S	S	.	.	P	Polyproline II helix	trans	-60.5	129.7	172.1	-69.8	168.4	0	0	0	111	K1333 I1390	L1331-K1333 PolarHBondContact O-N 2.83Å; L1331-I1390 HydrophobicContact CD1-CD1 4.26Å
1332	I	72	Confident	68.3	Low	89 Å²	89	88.8 Å²	88.8	46%	0.456	49%	0.488	S	S	.	.	P	Polyproline II helix	trans	-63	125.9	164.9	-68.2	157.6	0	0	0	107.7	P1330 T1350	P1330-I1332 PolarHBondContact O-N 2.9Å; I1332-T1350 HydrophobicContact CD1-CG2 3.73Å; I1332-T1350 HydrophobicContact CG1-CG2 3.72Å
1333	K	57.4	Low	65.7	Low	146 Å²	146	97.6 Å²	97.6	64%	0.635	53%	0.527	S	S	*	.	P	Polyproline II helix	trans	-84.6	137.1	168.9	-65.5	178	179.5	176.6	0	108.5	L1331 S1335 E1336	L1331-K1333 PolarHBondContact O-N 2.83Å; K1333-S1335 PolarHBondContact O-N 3.36Å; K1333-E1336 PolarHBondContact O-N 3.26Å
1334	D	50.6	Low	63.2	Low	173 Å²	173	99.6 Å²	99.6	93%	0.925	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-16.3	-177	-65.9	-52.4	0	0	0	114.7
1335	S	45.6	Very low	61	Low	103 Å²	103	102.8 Å²	102.8	72%	0.72	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.7	-16.8	174	54.7	0	0	0	0	114.8	K1333	K1333-S1335 PolarHBondContact O-N 3.36Å
1336	E	46.8	Very low	58.8	Low	120 Å²	120	96.4 Å²	96.4	56%	0.561	53%	0.532	S	S	*	.			trans	-101.7	84.6	-177.5	-72.8	-177.6	-162.3	0	0	111.9	K1333 T1338	K1333-E1336 PolarHBondContact O-N 3.26Å; E1336-T1338 PolarHBondContact O-N 3.41Å
1337	K	38.3	Very low	56.6	Low	213 Å²	213	101.8 Å²	101.8	93%	0.926	57%	0.566	S	S	*	*			trans	-64.5	82.4	161.5	-71.3	-175.3	179.1	-179.9	0	109.8
1338	T	41	Very low	54.9	Low	96 Å²	96	104.3 Å²	104.3	59%	0.589	59%	0.592	S	S	*	*			trans	-77.4	151	174.2	33.8	0	0	0	0	111.4	E1336	E1336-T1338 PolarHBondContact O-N 3.41Å
1339	P	37.4	Very low	53.6	Low	108 Å²	108	103.5 Å²	103.5	70%	0.701	59%	0.591	S	S	*	*			trans	-77.1	144.9	-158.7	-16.3	32.2	0	0	0	113.8	S1341	P1339-S1341 PolarHBondContact O-N 3.01Å
1340	S	43.5	Very low	53.4	Low	130 Å²	130	104 Å²	104	91%	0.909	59%	0.594	S	S	*	*	S	Bend	trans	-74.2	60.7	174.8	59.4	0	0	0	0	112.9
1341	S	37.8	Very low	53.5	Low	95 Å²	95	100 Å²	100	66%	0.664	57%	0.568	S	S	*	*			trans	-168.4	75	173	60.8	0	0	0	0	114.3	P1339	P1339-S1341 PolarHBondContact O-N 3.01Å
1342	T	34.7	Very low	54	Low	112 Å²	112	95.3 Å²	95.3	69%	0.687	54%	0.544	S	S	*	.			trans	-150.7	134.1	145.3	35.4	0	0	0	0	109.3	S1344	T1342-S1344 PolarHBondContact O-N 2.89Å
1343	E	41.6	Very low	55.1	Low	199 Å²	199	91.1 Å²	91.1	93%	0.93	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	19	-176.6	-59	178.2	133.6	0	0	114
1344	S	45.5	Very low	56.9	Low	42 Å²	42	86.3 Å²	86.3	29%	0.294	50%	0.501	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110	-14	-164.4	59.4	0	0	0	0	115.6	T1342 W1363	T1342-S1344 PolarHBondContact O-N 2.89Å; S1344-W1363 WeakPolarHBondContact O-CA 3.14Å
1345	Q	48.5	Very low	58.9	Low	106 Å²	106	78.3 Å²	78.3	50%	0.495	46%	0.458	S	S	.	.			trans	-138.2	122.3	178.1	-68.4	-168.3	-11.6	0	0	111.9	T1366	Q1345-T1366 HydrophobicContact CG-CG2 4.19Å
1346	P	47.7	Very low	61.2	Low	43 Å²	43	73.4 Å²	73.4	28%	0.279	42%	0.424	S	S	.	.			trans	-62.8	138.7	164.8	-19.2	31.9	0	0	0	110.7
1347	P	48.6	Very low	63.5	Low	136 Å²	136	68.2 Å²	68.2	88%	0.883	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	137.6	179.3	24.9	-33.2	0	0	0	111.9
1348	G	58.3	Low	66	Low	53 Å²	53	62.8 Å²	62.8	55%	0.546	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	97.7	-1.7	179.7	0	0	0	0	0	116.1	T1350 K1394	G1348-T1350 PolarHBondContact O-N 3Å; G1348-T1350 VanDerWaalsContact O-N 3.09Å; G1348-K1394 PolarHBondContact O-NZ 2.96Å
1349	N	69	Low	68.2	Low	18 Å²	18	58.4 Å²	58.4	10%	0.096	36%	0.355	C	S	.	.			trans	-86.6	56.8	-172.7	-86.2	-6.8	0	0	0	115.3	I1329 Y1352 T1366	I1329-N1349 WeakPolarHBondContact CG2-O 3.47Å; N1349-Y1352 VanDerWaalsContact C-CE1 3.42Å; N1349-Y1352 HydrophobicContact CB-CE1 4.43Å; N1349-Y1352 WeakPolarHBondContact CB-OH 3.5Å; N1349-Y1352 PolarHBondContact OD1-OH 3.21Å; N1349-T1366 PolarHBondContact ND2-O 3.04Å
1350	T	86.3	Confident	70.6	Confident	20 Å²	20	58.6 Å²	58.6	12%	0.123	35%	0.346	C	S	.	.			trans	-129.4	162.3	177	58.2	0	0	0	0	115.6	I1329 P1330 I1332 G1348 Y1352 K1394	I1329-T1350 HydrophobicContact CG2-CG2 3.9Å; P1330-T1350 WeakPolarHBondContact O-CB 3.47Å; P1330-T1350 VanDerWaalsContact O-CG2 3.28Å; P1330-T1350 WeakPolarHBondContact O-CG2 3.34Å; I1332-T1350 HydrophobicContact CD1-CG2 3.73Å; I1332-T1350 HydrophobicContact CG1-CG2 3.72Å; G1348-T1350 PolarHBondContact O-N 3Å; G1348-T1350 VanDerWaalsContact O-N 3.09Å; T1350-Y1352 WeakPolarHBondContact O-CD1 3.39Å; T1350-K1394 PolarHBondContact O-NZ 3.41Å
1351	G	90.4	Very high	72.5	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	31%	0.312	C	S	.	.	S	Bend	trans	82.6	43.6	178.7	0	0	0	0	0	113.8	I1329	I1329-G1351 WeakPolarHBondContact O-CA 3.43Å; I1329-G1351 PolarHBondContact O-N 3.3Å
1352	Y	93.1	Very high	74.8	Confident	0 Å²	0	54 Å²	54	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.2	179.3	176	59.3	-83.8	0	0	0	110	I1329 N1349 T1350 T1366 L1368 K1394	I1329-Y1352 WeakPolarHBondContact CB-O 3.31Å; I1329-Y1352 HydrophobicContact CD1-CD2 4.24Å; I1329-Y1352 HydrophobicContact CD1-CE2 3.82Å; I1329-Y1352 WeakPolarHBondContact CG1-O 3.33Å; I1329-Y1352 PolarHBondContact N-O 3.24Å; N1349-Y1352 VanDerWaalsContact C-CE1 3.42Å; N1349-Y1352 HydrophobicContact CB-CE1 4.43Å; N1349-Y1352 WeakPolarHBondContact CB-OH 3.5Å; N1349-Y1352 PolarHBondContact OD1-OH 3.21Å; T1350-Y1352 WeakPolarHBondContact O-CD1 3.39Å; Y1352-T1366 PolarHBondContact OH-O 2.87Å; Y1352-L1368 HydrophobicContact CD1-CD1 4.32Å; Y1352-L1368 HydrophobicContact CD2-CB 4.21Å; Y1352-L1368 HydrophobicContact CD2-CD1 3.64Å; Y1352-L1368 HydrophobicContact CD2-CG 4.5Å; Y1352-L1368 HydrophobicContact CE1-CB 4.27Å; Y1352-L1368 HydrophobicContact CE2-CB 3.66Å; Y1352-L1368 HydrophobicContact CE2-CD1 4.01Å; Y1352-L1368 HydrophobicContact CE2-CG 4.41Å; Y1352-L1368 HydrophobicContact CG-CD1 3.8Å; Y1352-K1394 HydrophobicContact CD1-CD 3.71Å; Y1352-K1394 HydrophobicContact CE1-CD 4.35Å
1353	Y	95.4	Very high	77.1	Confident	1 Å²	1	53 Å²	53	0%	0.004	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	137	-179.5	-64.5	-91.5	0	0	0	112	F1323 E1324 F1327 W1328 F1372 M1376 F1383 N1387 A1391	F1323-Y1353 HydrophobicContact CE1-CD1 4.3Å; F1323-Y1353 HydrophobicContact CE1-CE1 4.33Å; E1324-Y1353 PolarHBondContact OE1-OH 3.33Å; E1324-Y1353 WeakPolarHBondContact OE2-CE1 3.24Å; E1324-Y1353 PolarHBondContact OE2-OH 3.01Å; E1324-Y1353 VanDerWaalsContact OE2-OH 3.13Å; F1327-Y1353 HydrophobicContact CB-CD1 3.99Å; F1327-Y1353 CarbonylContact O-C 3.58Å; F1327-Y1353 WeakPolarHBondContact O-CA 3.37Å; W1328-Y1353 HydrophobicContact CB-CD1 4.39Å; W1328-Y1353 HydrophobicContact CB-CE1 4.08Å; W1328-Y1353 HydrophobicContact CE3-CD1 4.18Å; W1328-Y1353 HydrophobicContact CE3-CD2 4Å; W1328-Y1353 AromaticContact CE3-CE1 3.88Å; W1328-Y1353 HydrophobicContact CE3-CE1 3.88Å; W1328-Y1353 AromaticContact CE3-CE2 3.65Å; W1328-Y1353 HydrophobicContact CE3-CE2 3.65Å; W1328-Y1353 HydrophobicContact CE3-CG 4.24Å; W1328-Y1353 AromaticContact CE3-CZ 3.59Å; W1328-Y1353 HydrophobicContact CZ3-CD2 4.14Å; W1328-Y1353 AromaticContact CZ3-CE2 3.74Å; W1328-Y1353 HydrophobicContact CZ3-CE2 3.74Å; Y1353-F1372 HydrophobicContact CD2-CD2 4.17Å; Y1353-F1372 HydrophobicContact CD2-CG 4.41Å; Y1353-F1372 HydrophobicContact CG-CB 4.45Å; Y1353-M1376 HydrophobicContact CD2-CE 3.85Å; Y1353-M1376 HydrophobicContact CE2-CE 3.61Å; Y1353-F1383 HydrophobicContact CD1-CD1 4.27Å; Y1353-F1383 HydrophobicContact CD1-CE1 4.03Å; Y1353-F1383 HydrophobicContact CD2-CD1 4.12Å; Y1353-F1383 AromaticContact CD2-CE1 3.93Å; Y1353-F1383 HydrophobicContact CD2-CE1 3.93Å; Y1353-F1383 AromaticContact CE1-CD1 3.78Å; Y1353-F1383 HydrophobicContact CE1-CD1 3.78Å; Y1353-F1383 HydrophobicContact CE1-CE1 4.03Å; Y1353-F1383 AromaticContact CE2-CD1 3.63Å; Y1353-F1383 HydrophobicContact CE2-CD1 3.63Å; Y1353-F1383 AromaticContact CE2-CE1 3.94Å; Y1353-F1383 HydrophobicContact CE2-CE1 3.94Å; Y1353-F1383 HydrophobicContact CG-CD1 4.43Å; Y1353-F1383 AromaticContact CG-CE1 4Å; Y1353-F1383 HydrophobicContact CG-CE1 4Å; Y1353-F1383 AromaticContact CZ-CD1 3.45Å; Y1353-F1383 VanDerWaalsContact CZ-CD1 3.45Å; Y1353-F1383 AromaticContact CZ-CE1 3.99Å; Y1353-N1387 VanDerWaalsContact OH-CB 3.25Å; Y1353-N1387 WeakPolarHBondContact OH-CB 3.03Å; Y1353-A1391 HydrophobicContact CD2-CB 3.78Å; Y1353-A1391 HydrophobicContact CE2-CB 3.84Å
1354	K	94.7	Very high	79.2	Confident	44 Å²	44	44.4 Å²	44.4	19%	0.191	25%	0.246	C	C	.	.			trans	-52.7	148.5	171.9	-68.4	176.3	-165.7	166.7	0	111.4	S1326 F1327 I1329 V1357 E1365	S1326-K1354 WeakPolarHBondContact O-CD 3.44Å; S1326-K1354 WeakPolarHBondContact O-CE 3.25Å; S1326-K1354 PolarHBondContact O-NZ 3.33Å; F1327-K1354 HydrophobicContact CD1-CB 4.11Å; F1327-K1354 WeakPolarHBondContact CD1-O 3.49Å; F1327-K1354 WeakPolarHBondContact O-CG 3.2Å; F1327-K1354 PolarHBondContact O-N 3.37Å; I1329-K1354 HydrophobicContact CD1-CG 3.79Å; I1329-K1354 HydrophobicContact CG1-CG 3.71Å; K1354-V1357 HydrophobicContact CD-CG2 4.21Å; K1354-E1365 VanDerWaalsContact CA-O 3.29Å; K1354-E1365 WeakPolarHBondContact CA-O 3.37Å; K1354-E1365 WeakPolarHBondContact CB-O 3.49Å; K1354-E1365 HydrophobicContact CD-CB 4.46Å
1355	D	93.5	Very high	81.2	Confident	5 Å²	5	43.1 Å²	43.1	3%	0.027	24%	0.236	C	C	.	.	S	Bend	trans	-75.4	-37.1	174.1	-178.9	52.9	0	0	0	112.3	R1267 V1272 E1365 R1369 N1371	R1267-D1355 WeakPolarHBondContact CD-OD2 3.33Å; R1267-D1355 IonicContact CZ-OD1 2.64Å; R1267-D1355 IonicContact CZ-OD2 2.72Å; R1267-D1355 VanDerWaalsContact NE-CG 3.35Å; R1267-D1355 IonicContact NE-OD1 3.63Å; R1267-D1355 PolarHBondContact NE-OD1 2.91Å; R1267-D1355 IonicContact NE-OD2 3.34Å; R1267-D1355 PolarHBondContact NE-OD2 3.46Å; R1267-D1355 IonicContact NH2-OD1 2.73Å; R1267-D1355 PolarHBondContact NH2-OD1 3.44Å; R1267-D1355 IonicContact NH2-OD2 3.61Å; V1272-D1355 PolarHBondContact N-O 3.29Å; D1355-E1365 PolarHBondContact N-O 2.9Å; D1355-E1365 VanDerWaalsContact N-O 3.12Å; D1355-R1369 HydrophobicContact CB-CB 4.36Å; D1355-R1369 HydrophobicContact CB-CG 4.34Å; D1355-R1369 IonicContact OD2-NE 3.16Å; D1355-N1371 PolarHBondContact OD1-ND2 3.15Å
1356	T	94.2	Very high	83.1	Confident	1 Å²	1	38.4 Å²	38.4	1%	0.006	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	156.1	-177.3	45.6	0	0	0	0	111.2	R1267 S1270 A1271 S1359 E1365	R1267-T1356 HydrophobicContact CB-CG2 3.97Å; R1267-T1356 HydrophobicContact CG-CG2 4.44Å; S1270-T1356 CarbonylContact O-C 3.38Å; S1270-T1356 VanDerWaalsContact O-CA 3.28Å; S1270-T1356 WeakPolarHBondContact O-CA 3.47Å; A1271-T1356 HydrophobicContact CB-CG2 4.3Å; T1356-S1359 WeakPolarHBondContact CB-OG 3.4Å; T1356-S1359 PolarHBondContact OG1-OG 2.89Å; T1356-E1365 WeakPolarHBondContact O-CB 3.44Å; T1356-E1365 WeakPolarHBondContact O-CG 3.47Å
1357	V	93.3	Very high	85	Confident	10 Å²	10	36.5 Å²	36.5	6%	0.061	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	134.9	171.3	170.4	0	0	0	0	109.5	F1235 S1270 F1327 K1354	F1235-V1357 HydrophobicContact CE2-CG1 4.49Å; S1270-V1357 PolarHBondContact N-O 3.37Å; S1270-V1357 PolarHBondContact O-N 3.49Å; S1270-V1357 PolarHBondContact OG-O 3.08Å; F1327-V1357 HydrophobicContact CD1-CG2 3.74Å; F1327-V1357 HydrophobicContact CD2-CG2 4.12Å; F1327-V1357 HydrophobicContact CE1-CB 4.33Å; F1327-V1357 HydrophobicContact CE1-CG2 3.6Å; F1327-V1357 HydrophobicContact CE2-CG2 3.99Å; F1327-V1357 HydrophobicContact CG-CG2 4Å; F1327-V1357 HydrophobicContact CZ-CB 4.16Å; F1327-V1357 HydrophobicContact CZ-CG2 3.73Å; K1354-V1357 HydrophobicContact CD-CG2 4.21Å
1358	N	90.9	Very high	87	Confident	100 Å²	100	30 Å²	30	54%	0.535	16%	0.159	S	C	.	.	S	Bend	trans	65.7	41.8	-176.9	-61.7	-31.2	0	0	0	114.1	G1269 E1365	G1269-N1358 WeakPolarHBondContact CA-O 3.49Å; N1358-E1365 WeakPolarHBondContact CA-OE1 3.29Å; N1358-E1365 PolarHBondContact N-OE1 3.22Å
1359	S	88.1	Confident	88.7	Confident	3 Å²	3	27.8 Å²	27.8	2%	0.021	13%	0.134	C	C	.	.			trans	-76.7	149.8	167.6	-48.7	0	0	0	0	110.3	D1268 T1356 V1361 K1362 E1365	D1268-S1359 PolarHBondContact O-OG 3.2Å; D1268-S1359 WeakPolarHBondContact OD2-CA 3.27Å; T1356-S1359 WeakPolarHBondContact CB-OG 3.4Å; T1356-S1359 PolarHBondContact OG1-OG 2.89Å; S1359-V1361 VanDerWaalsContact C-N 3.29Å; S1359-K1362 WeakPolarHBondContact O-CE 3.46Å; S1359-K1362 PolarHBondContact O-NZ 3.37Å; S1359-E1365 PolarHBondContact N-OE1 3.11Å
1360	E	86.8	Confident	89.9	Confident	112 Å²	112	27 Å²	27	52%	0.523	13%	0.13	S	C	.	.	S	Bend	trans	-64.3	-37.1	173.2	-65.4	174.8	-164.7	0	0	110.6	Q1241 D1268	Q1241-E1360 HydrophobicContact CG-CB 3.96Å; Q1241-E1360 WeakPolarHBondContact CG-OE2 3.05Å; Q1241-E1360 PolarHBondContact NE2-OE2 2.93Å; D1268-E1360 PolarHBondContact OD2-N 2.9Å
1361	V	85	Confident	90.4	Very high	31 Å²	31	26 Å²	26	19%	0.188	12%	0.124	C	C	.	.	S	Bend	trans	-90.2	108.5	172.5	-176.7	0	0	0	0	109.5	Q1241 S1359 W1363 S1364	Q1241-V1361 HydrophobicContact CG-CG2 3.85Å; Q1241-V1361 VanDerWaalsContact NE2-CG2 3.3Å; S1359-V1361 VanDerWaalsContact C-N 3.29Å; V1361-W1363 HydrophobicContact CG1-CD2 3.73Å; V1361-W1363 HydrophobicContact CG1-CG 3.95Å; V1361-W1363 HydrophobicContact CG1-CH2 4.41Å; V1361-W1363 HydrophobicContact CG1-CZ2 3.66Å; V1361-W1363 VanDerWaalsContact CG1-NE1 3.26Å; V1361-W1363 PolarHBondContact O-N 3.49Å; V1361-S1364 PolarHBondContact O-N 2.74Å; V1361-S1364 PolarHBondContact O-OG 3.01Å
1362	K	84.5	Confident	90.7	Very high	98 Å²	98	26.1 Å²	26.1	43%	0.426	12%	0.124	S	C	.	.	G	3₁₀ helix	trans	-69.1	-35.8	-173.1	-71.4	-70.4	143.8	-157.7	0	114.6	S1359 S1364 E1365	S1359-K1362 WeakPolarHBondContact O-CE 3.46Å; S1359-K1362 PolarHBondContact O-NZ 3.37Å; K1362-S1364 VanDerWaalsContact C-N 3.28Å; K1362-S1364 PolarHBondContact O-N 3.38Å; K1362-E1365 IonicContact NZ-OE1 2.73Å; K1362-E1365 PolarHBondContact NZ-OE1 2.87Å; K1362-E1365 WeakPolarHBondContact O-CB 3.24Å; K1362-E1365 PolarHBondContact O-N 2.95Å
1363	W	84.1	Confident	90.9	Very high	92 Å²	92	26.1 Å²	26.1	35%	0.348	13%	0.125	S	C	.	.	G	3₁₀ helix	trans	-68.8	-25	-179.9	60.6	-107.3	0	0	0	113.2	S1344 V1361 E1365 T1366 Q1367 W1413	S1344-W1363 WeakPolarHBondContact O-CA 3.14Å; V1361-W1363 HydrophobicContact CG1-CD2 3.73Å; V1361-W1363 HydrophobicContact CG1-CG 3.95Å; V1361-W1363 HydrophobicContact CG1-CH2 4.41Å; V1361-W1363 HydrophobicContact CG1-CZ2 3.66Å; V1361-W1363 VanDerWaalsContact CG1-NE1 3.26Å; V1361-W1363 PolarHBondContact O-N 3.49Å; W1363-E1365 VanDerWaalsContact C-N 3.26Å; W1363-E1365 PolarHBondContact O-N 3.4Å; W1363-T1366 PolarHBondContact O-N 2.98Å; W1363-T1366 PolarHBondContact O-OG1 3.41Å; W1363-T1366 VanDerWaalsContact O-OG1 3.14Å; W1363-Q1367 HydrophobicContact CE3-CG 4.34Å; W1363-Q1367 HydrophobicContact CZ3-CG 4.43Å; W1363-W1413 HydrophobicContact CH2-CH2 4.46Å; W1363-W1413 AromaticContact CH2-CZ2 3.65Å; W1363-W1413 HydrophobicContact CH2-CZ2 3.65Å; W1363-W1413 AromaticContact CZ2-CZ2 3.9Å; W1363-W1413 HydrophobicContact CZ2-CZ2 3.9Å; W1363-W1413 HydrophobicContact CZ3-CZ2 4.11Å
1364	S	84.5	Confident	91	Very high	17 Å²	17	26.1 Å²	26.1	12%	0.119	13%	0.125	C	C	.	.	G	3₁₀ helix	trans	-71.4	-21.2	179.5	59.8	0	0	0	0	113.2	V1361 K1362 T1366	V1361-S1364 PolarHBondContact O-N 2.74Å; V1361-S1364 PolarHBondContact O-OG 3.01Å; K1362-S1364 VanDerWaalsContact C-N 3.28Å; K1362-S1364 PolarHBondContact O-N 3.38Å; S1364-T1366 PolarHBondContact O-N 2.92Å
1365	E	88.5	Confident	91.1	Very high	16 Å²	16	24 Å²	24	8%	0.075	12%	0.115	C	C	.	.	G	3₁₀ helix	trans	-61.1	-34.4	173.3	-62.5	-172.6	-175.7	0	0	111.7	K1354 D1355 T1356 N1358 S1359 K1362 W1363	K1354-E1365 VanDerWaalsContact CA-O 3.29Å; K1354-E1365 WeakPolarHBondContact CA-O 3.37Å; K1354-E1365 WeakPolarHBondContact CB-O 3.49Å; K1354-E1365 HydrophobicContact CD-CB 4.46Å; D1355-E1365 PolarHBondContact N-O 2.9Å; D1355-E1365 VanDerWaalsContact N-O 3.12Å; T1356-E1365 WeakPolarHBondContact O-CB 3.44Å; T1356-E1365 WeakPolarHBondContact O-CG 3.47Å; N1358-E1365 WeakPolarHBondContact CA-OE1 3.29Å; N1358-E1365 PolarHBondContact N-OE1 3.22Å; S1359-E1365 PolarHBondContact N-OE1 3.11Å; K1362-E1365 IonicContact NZ-OE1 2.73Å; K1362-E1365 PolarHBondContact NZ-OE1 2.87Å; K1362-E1365 WeakPolarHBondContact O-CB 3.24Å; K1362-E1365 PolarHBondContact O-N 2.95Å; W1363-E1365 VanDerWaalsContact C-N 3.26Å; W1363-E1365 PolarHBondContact O-N 3.4Å
1366	T	87.3	Confident	91.3	Very high	6 Å²	6	24 Å²	24	4%	0.037	12%	0.115	C	C	.	.	G	3₁₀ helix	trans	-99.4	13.1	-173	64.2	0	0	0	0	114	I1329 Q1345 N1349 Y1352 W1363 S1364	I1329-T1366 HydrophobicContact CD1-CG2 4.3Å; Q1345-T1366 HydrophobicContact CG-CG2 4.19Å; N1349-T1366 PolarHBondContact ND2-O 3.04Å; Y1352-T1366 PolarHBondContact OH-O 2.87Å; W1363-T1366 PolarHBondContact O-N 2.98Å; W1363-T1366 PolarHBondContact O-OG1 3.41Å; W1363-T1366 VanDerWaalsContact O-OG1 3.14Å; S1364-T1366 PolarHBondContact O-N 2.92Å
1367	Q	89.2	Confident	91.4	Very high	3 Å²	3	24.6 Å²	24.6	1%	0.014	12%	0.119	C	C	.	.	S	Bend	trans	-75.1	127.9	172.1	-69.2	-169.4	-63.6	0	0	110.8	W1363 R1369 L1408 D1412	W1363-Q1367 HydrophobicContact CE3-CG 4.34Å; W1363-Q1367 HydrophobicContact CZ3-CG 4.43Å; Q1367-R1369 HydrophobicContact CB-CG 4.33Å; Q1367-R1369 PolarHBondContact O-N 3.13Å; Q1367-R1369 VanDerWaalsContact O-N 3.12Å; Q1367-L1408 HydrophobicContact CB-CD1 3.76Å; Q1367-L1408 HydrophobicContact CG-CD1 4.17Å; Q1367-D1412 WeakPolarHBondContact CG-OD2 3.09Å; Q1367-D1412 VanDerWaalsContact NE2-CG 3.26Å; Q1367-D1412 PolarHBondContact NE2-OD1 3.14Å; Q1367-D1412 PolarHBondContact NE2-OD2 3.38Å
1368	L	91	Very high	91.6	Very high	1 Å²	1	25.3 Å²	25.3	1%	0.005	12%	0.122	C	C	.	.			trans	-68.7	109.2	174.2	172.6	56.7	0	0	0	110.1	Y1352 F1372 K1394 K1398 L1399 N1409	Y1352-L1368 HydrophobicContact CD1-CD1 4.32Å; Y1352-L1368 HydrophobicContact CD2-CB 4.21Å; Y1352-L1368 HydrophobicContact CD2-CD1 3.64Å; Y1352-L1368 HydrophobicContact CD2-CG 4.5Å; Y1352-L1368 HydrophobicContact CE1-CB 4.27Å; Y1352-L1368 HydrophobicContact CE2-CB 3.66Å; Y1352-L1368 HydrophobicContact CE2-CD1 4.01Å; Y1352-L1368 HydrophobicContact CE2-CG 4.41Å; Y1352-L1368 HydrophobicContact CG-CD1 3.8Å; L1368-F1372 HydrophobicContact CD1-CE1 3.97Å; L1368-K1394 HydrophobicContact CD2-CD 4.31Å; L1368-K1394 HydrophobicContact CD2-CG 4.27Å; L1368-K1398 HydrophobicContact CD2-CB 3.81Å; L1368-K1398 HydrophobicContact CD2-CG 4.08Å; L1368-L1399 HydrophobicContact CD1-CD1 3.97Å; L1368-L1399 HydrophobicContact CG-CD1 4.04Å; L1368-L1399 HydrophobicContact CG-CD2 4.24Å; L1368-L1399 HydrophobicContact CG-CG 4.2Å; L1368-N1409 HydrophobicContact CB-CB 3.92Å; L1368-N1409 HydrophobicContact CD2-CB 4.11Å; L1368-N1409 HydrophobicContact CG-CB 4.17Å; L1368-N1409 PolarHBondContact O-N 3.19Å; L1368-N1409 VanDerWaalsContact O-N 3.08Å
1369	R	92.9	Very high	91.8	Very high	5 Å²	5	20.6 Å²	20.6	2%	0.019	10%	0.097	C	C	.	.			trans	-131.1	153.9	179.8	-61	-164.2	-175.9	-92.5	0.4	110.9	D1355 Q1367 N1371 F1372 T1407 L1408 H1437	D1355-R1369 HydrophobicContact CB-CB 4.36Å; D1355-R1369 HydrophobicContact CB-CG 4.34Å; D1355-R1369 IonicContact OD2-NE 3.16Å; Q1367-R1369 HydrophobicContact CB-CG 4.33Å; Q1367-R1369 PolarHBondContact O-N 3.13Å; Q1367-R1369 VanDerWaalsContact O-N 3.12Å; R1369-N1371 PolarHBondContact O-N 3.4Å; R1369-F1372 WeakPolarHBondContact O-CD1 3.47Å; R1369-F1372 VanDerWaalsContact O-CE1 3.29Å; R1369-F1372 WeakPolarHBondContact O-CE1 3.29Å; R1369-T1407 WeakPolarHBondContact CG-O 3.44Å; R1369-T1407 PolarHBondContact NH1-O 3.49Å; R1369-L1408 HydrophobicContact CG-CD1 4.37Å; R1369-H1437 PolarHBondContact NH1-O 2.94Å
1370	P	94.4	Very high	92.1	Very high	1 Å²	1	22.8 Å²	22.8	1%	0.006	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-1.6	-175.8	32.1	-37.5	0	0	0	114.2	F1372 L1373 L1399 M1405 K1406 L1450	P1370-F1372 PolarHBondContact O-N 3.38Å; P1370-L1373 HydrophobicContact CB-CD1 3.92Å; P1370-L1373 WeakPolarHBondContact O-CB 3.43Å; P1370-L1373 WeakPolarHBondContact O-CG 3.31Å; P1370-L1373 PolarHBondContact O-N 2.84Å; P1370-L1399 HydrophobicContact CB-CD1 4.1Å; P1370-M1405 HydrophobicContact CB-CB 4.24Å; P1370-M1405 HydrophobicContact CG-CB 4.47Å; P1370-K1406 WeakPolarHBondContact CD-O 3.28Å; P1370-K1406 WeakPolarHBondContact CG-O 3.45Å; P1370-L1450 HydrophobicContact CB-CD1 4.44Å; P1370-L1450 HydrophobicContact CG-CD1 3.64Å
1371	N	96.3	Very high	92.4	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-62.8	-27.3	-171.8	-64.4	-46.5	0	0	0	113.7	W1247 M1248 R1267 V1272 D1355 R1369 L1373 I1374 A1375	W1247-N1371 PolarHBondContact NE1-OD1 2.95Å; M1248-N1371 VanDerWaalsContact CE-ND2 3.32Å; M1248-N1371 WeakPolarHBondContact CE-ND2 3.28Å; R1267-N1371 PolarHBondContact NH2-ND2 3.31Å; R1267-N1371 VanDerWaalsContact NH2-ND2 3.2Å; V1272-N1371 HydrophobicContact CG1-CB 3.75Å; D1355-N1371 PolarHBondContact OD1-ND2 3.15Å; R1369-N1371 PolarHBondContact O-N 3.4Å; N1371-L1373 PolarHBondContact O-N 3.05Å; N1371-I1374 WeakPolarHBondContact O-CB 3.33Å; N1371-I1374 PolarHBondContact O-N 2.91Å; N1371-A1375 PolarHBondContact O-N 3.17Å
1372	F	96.7	Very high	93	Very high	2 Å²	2	20.1 Å²	20.1	1%	0.009	10%	0.097	C	C	.	.	H	α-helix	trans	-67.1	-22	174.9	70.4	-100	0	0	0	113	V1272 Y1353 L1368 R1369 P1370 I1374 A1375 M1376 A1391 A1395	V1272-F1372 HydrophobicContact CG1-CB 4.24Å; V1272-F1372 HydrophobicContact CG2-CB 4.16Å; Y1353-F1372 HydrophobicContact CD2-CD2 4.17Å; Y1353-F1372 HydrophobicContact CD2-CG 4.41Å; Y1353-F1372 HydrophobicContact CG-CB 4.45Å; L1368-F1372 HydrophobicContact CD1-CE1 3.97Å; R1369-F1372 WeakPolarHBondContact O-CD1 3.47Å; R1369-F1372 VanDerWaalsContact O-CE1 3.29Å; R1369-F1372 WeakPolarHBondContact O-CE1 3.29Å; P1370-F1372 PolarHBondContact O-N 3.38Å; F1372-I1374 VanDerWaalsContact C-N 3.31Å; F1372-A1375 WeakPolarHBondContact O-CB 3.34Å; F1372-A1375 PolarHBondContact O-N 2.82Å; F1372-M1376 HydrophobicContact CD2-CE 3.66Å; F1372-M1376 HydrophobicContact CD2-SD 3.8Å; F1372-M1376 HydrophobicContact CE2-CE 3.93Å; F1372-M1376 HydrophobicContact CE2-SD 4.1Å; F1372-M1376 WeakPolarHBondContact O-CG 3.42Å; F1372-M1376 PolarHBondContact O-N 3.34Å; F1372-A1391 HydrophobicContact CD2-CB 4.44Å; F1372-A1391 HydrophobicContact CE2-CB 3.68Å; F1372-A1391 HydrophobicContact CZ-CB 3.99Å; F1372-A1391 WeakPolarHBondContact CZ-O 3.24Å; F1372-A1395 HydrophobicContact CZ-CB 3.95Å
1373	L	97.5	Very high	93.5	Very high	1 Å²	1	16.4 Å²	16.4	1%	0.005	8%	0.081	C	C	.	.	H	α-helix	trans	-67.2	-35.5	174.3	-55.3	169.6	0	0	0	111.1	P1370 N1371 A1375 M1376 V1377 V1392 A1395 M1405 F1454 A1457	P1370-L1373 HydrophobicContact CB-CD1 3.92Å; P1370-L1373 WeakPolarHBondContact O-CB 3.43Å; P1370-L1373 WeakPolarHBondContact O-CG 3.31Å; P1370-L1373 PolarHBondContact O-N 2.84Å; N1371-L1373 PolarHBondContact O-N 3.05Å; L1373-A1375 VanDerWaalsContact C-N 3.33Å; L1373-M1376 HydrophobicContact CD2-SD 4.3Å; L1373-M1376 PolarHBondContact O-N 2.83Å; L1373-V1377 WeakPolarHBondContact O-CG2 3.49Å; L1373-V1377 PolarHBondContact O-N 3.26Å; L1373-V1392 HydrophobicContact CD2-CG2 3.7Å; L1373-A1395 HydrophobicContact CD1-CB 4.19Å; L1373-A1395 HydrophobicContact CD2-CB 4.21Å; L1373-M1405 HydrophobicContact CD1-CE 4.05Å; L1373-F1454 HydrophobicContact CD1-CB 3.95Å; L1373-F1454 HydrophobicContact CD1-CD2 4.01Å; L1373-F1454 HydrophobicContact CD1-CG 4.46Å; L1373-F1454 HydrophobicContact CD2-CD2 4.45Å; L1373-A1457 HydrophobicContact CB-CB 4.48Å; L1373-A1457 HydrophobicContact CD2-CB 4.24Å
1374	I	97.6	Very high	94	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-62.2	-46.1	172.1	-55	168.2	0	0	0	109.5	W1134 E1273 N1371 F1372 V1377 I1378 W1449 L1450 Y1453	W1134-I1374 HydrophobicContact CH2-CG2 3.66Å; W1134-I1374 HydrophobicContact CZ2-CG2 4.28Å; E1273-I1374 HydrophobicContact CB-CB 3.92Å; E1273-I1374 HydrophobicContact CB-CD1 4.34Å; E1273-I1374 HydrophobicContact CB-CG2 3.83Å; E1273-I1374 HydrophobicContact CG-CD1 4.38Å; E1273-I1374 HydrophobicContact CG-CG2 4.5Å; N1371-I1374 WeakPolarHBondContact O-CB 3.33Å; N1371-I1374 PolarHBondContact O-N 2.91Å; F1372-I1374 VanDerWaalsContact C-N 3.31Å; I1374-V1377 PolarHBondContact O-N 2.97Å; I1374-I1378 HydrophobicContact CG2-CD1 3.58Å; I1374-I1378 WeakPolarHBondContact O-CD1 3.5Å; I1374-I1378 VanDerWaalsContact O-CG1 3.28Å; I1374-I1378 WeakPolarHBondContact O-CG1 3.48Å; I1374-I1378 PolarHBondContact O-N 3.26Å; I1374-W1449 HydrophobicContact CD1-CH2 3.59Å; I1374-W1449 HydrophobicContact CD1-CZ3 4.01Å; I1374-W1449 HydrophobicContact CG1-CH2 4.46Å; I1374-W1449 HydrophobicContact CG1-CZ3 4.42Å; I1374-L1450 HydrophobicContact CD1-CD2 3.79Å; I1374-L1450 HydrophobicContact CG1-CD2 4.13Å; I1374-Y1453 HydrophobicContact CB-CD1 4.22Å; I1374-Y1453 HydrophobicContact CB-CG 4.43Å; I1374-Y1453 HydrophobicContact CG1-CD1 4.29Å; I1374-Y1453 HydrophobicContact CG1-CD2 4.24Å; I1374-Y1453 HydrophobicContact CG1-CG 4Å; I1374-Y1453 HydrophobicContact CG2-CD1 4.16Å; I1374-Y1453 HydrophobicContact CG2-CE1 3.94Å
1375	A	97.6	Very high	94.3	Very high	0 Å²	0	19 Å²	19	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-61.9	-44.3	178.6	0	0	0	0	0	112.6	V1272 A1276 N1371 F1372 L1373 V1377 I1378 A1379 F1383	V1272-A1375 HydrophobicContact CG2-CB 4Å; A1276-A1375 VanDerWaalsContact CB-CA 3.47Å; A1276-A1375 HydrophobicContact CB-CB 3.38Å; N1371-A1375 PolarHBondContact O-N 3.17Å; F1372-A1375 WeakPolarHBondContact O-CB 3.34Å; F1372-A1375 PolarHBondContact O-N 2.82Å; L1373-A1375 VanDerWaalsContact C-N 3.33Å; A1375-V1377 PolarHBondContact O-N 3.23Å; A1375-I1378 PolarHBondContact O-N 3.38Å; A1375-A1379 PolarHBondContact O-N 3.41Å; A1375-F1383 HydrophobicContact CB-CE2 4.06Å; A1375-F1383 HydrophobicContact CB-CZ 3.65Å
1376	M	96.6	Very high	94.5	Very high	4 Å²	4	21.9 Å²	21.9	2%	0.02	12%	0.121	C	C	.	.	H	α-helix	trans	-57.8	-44.5	176.8	-74.7	171.6	169.1	0	0	112.7	Y1353 F1372 L1373 I1378 P1380 F1383 A1388 A1391 V1392 A1457 Q1460 I1461	Y1353-M1376 HydrophobicContact CD2-CE 3.85Å; Y1353-M1376 HydrophobicContact CE2-CE 3.61Å; F1372-M1376 HydrophobicContact CD2-CE 3.66Å; F1372-M1376 HydrophobicContact CD2-SD 3.8Å; F1372-M1376 HydrophobicContact CE2-CE 3.93Å; F1372-M1376 HydrophobicContact CE2-SD 4.1Å; F1372-M1376 WeakPolarHBondContact O-CG 3.42Å; F1372-M1376 PolarHBondContact O-N 3.34Å; L1373-M1376 HydrophobicContact CD2-SD 4.3Å; L1373-M1376 PolarHBondContact O-N 2.83Å; M1376-I1378 VanDerWaalsContact C-N 3.35Å; M1376-I1378 PolarHBondContact O-N 3.33Å; M1376-P1380 WeakPolarHBondContact O-CA 3.31Å; M1376-P1380 WeakPolarHBondContact O-CB 3.11Å; M1376-P1380 WeakPolarHBondContact O-CD 3.15Å; M1376-P1380 VanDerWaalsContact O-N 3.09Å; M1376-F1383 HydrophobicContact CB-CE2 4.27Å; M1376-F1383 HydrophobicContact CB-CZ 4.34Å; M1376-F1383 HydrophobicContact CE-CD1 3.53Å; M1376-F1383 HydrophobicContact CE-CE1 3.68Å; M1376-F1383 HydrophobicContact CE-CG 4.4Å; M1376-F1383 HydrophobicContact CG-CD1 3.64Å; M1376-F1383 HydrophobicContact CG-CD2 3.96Å; M1376-F1383 HydrophobicContact CG-CE1 3.45Å; M1376-F1383 VanDerWaalsContact CG-CE1 3.45Å; M1376-F1383 HydrophobicContact CG-CE2 3.79Å; M1376-F1383 HydrophobicContact CG-CG 3.91Å; M1376-F1383 HydrophobicContact CG-CZ 3.53Å; M1376-F1383 HydrophobicContact SD-CD1 4.49Å; M1376-F1383 HydrophobicContact SD-CE1 4.41Å; M1376-A1388 HydrophobicContact CE-CB 3.69Å; M1376-A1391 HydrophobicContact CE-CB 4.04Å; M1376-V1392 HydrophobicContact CE-CG2 4.22Å; M1376-V1392 HydrophobicContact SD-CG2 3.55Å; M1376-V1392 VanDerWaalsContact SD-CG2 3.55Å; M1376-A1457 HydrophobicContact CB-CB 4.21Å; M1376-A1457 HydrophobicContact SD-CB 4.49Å; M1376-Q1460 PolarHBondContact O-OE1 3.22Å; M1376-I1461 HydrophobicContact SD-CD1 4.05Å
1377	V	96.6	Very high	94.9	Very high	15 Å²	15	23.1 Å²	23.1	9%	0.091	13%	0.128	C	C	.	.	H	α-helix	trans	-67.9	-35.4	-179.4	171.8	0	0	0	0	112.6	L1373 I1374 A1375 Y1453 R1456 A1457	L1373-V1377 WeakPolarHBondContact O-CG2 3.49Å; L1373-V1377 PolarHBondContact O-N 3.26Å; I1374-V1377 PolarHBondContact O-N 2.97Å; A1375-V1377 PolarHBondContact O-N 3.23Å; V1377-Y1453 HydrophobicContact CB-CD1 3.85Å; V1377-Y1453 HydrophobicContact CB-CE1 4.3Å; V1377-Y1453 HydrophobicContact CG1-CD1 3.96Å; V1377-Y1453 HydrophobicContact CG1-CE1 4.09Å; V1377-Y1453 HydrophobicContact CG2-CD1 4.05Å; V1377-Y1453 WeakPolarHBondContact CG2-O 3.28Å; V1377-R1456 HydrophobicContact CG1-CB 4.17Å; V1377-R1456 HydrophobicContact CG2-CB 3.64Å; V1377-A1457 HydrophobicContact CG2-CB 3.89Å
1378	I	96.7	Very high	95.1	Very high	25 Å²	25	23.1 Å²	23.1	13%	0.128	13%	0.128	C	C	.	.	H	α-helix	trans	-86.7	-31.9	-173.1	-66	172.1	0	0	0	112	W1134 L1137 I1277 A1280 I1374 A1375 M1376 Y1453	W1134-I1378 HydrophobicContact CH2-CD1 4.22Å; W1134-I1378 HydrophobicContact CZ3-CD1 4.06Å; L1137-I1378 HydrophobicContact CD1-CG2 3.98Å; L1137-I1378 HydrophobicContact CD2-CD1 3.75Å; L1137-I1378 HydrophobicContact CD2-CG1 4.26Å; L1137-I1378 HydrophobicContact CD2-CG2 4.37Å; I1277-I1378 HydrophobicContact CD1-CD1 4.24Å; I1277-I1378 HydrophobicContact CG1-CD1 3.66Å; I1277-I1378 HydrophobicContact CG1-CG2 4.12Å; A1280-I1378 HydrophobicContact CB-CG2 3.69Å; I1374-I1378 HydrophobicContact CG2-CD1 3.58Å; I1374-I1378 WeakPolarHBondContact O-CD1 3.5Å; I1374-I1378 VanDerWaalsContact O-CG1 3.28Å; I1374-I1378 WeakPolarHBondContact O-CG1 3.48Å; I1374-I1378 PolarHBondContact O-N 3.26Å; A1375-I1378 PolarHBondContact O-N 3.38Å; M1376-I1378 VanDerWaalsContact C-N 3.35Å; M1376-I1378 PolarHBondContact O-N 3.33Å; I1378-Y1453 HydrophobicContact CD1-CE1 4.18Å; I1378-Y1453 HydrophobicContact CG1-CE1 4.28Å
1379	A	96.3	Very high	95.2	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	14%	0.139	C	C	.	.			trans	-146.6	67.6	-178.2	0	0	0	0	0	111.1	A1276 Y1279 A1375 E1381 L1382 F1383	A1276-A1379 HydrophobicContact CB-CB 4.1Å; Y1279-A1379 HydrophobicContact CD1-CB 3.74Å; Y1279-A1379 HydrophobicContact CE1-CB 4.33Å; A1375-A1379 PolarHBondContact O-N 3.41Å; A1379-E1381 PolarHBondContact O-N 3.15Å; A1379-L1382 HydrophobicContact CB-CD1 3.74Å; A1379-L1382 HydrophobicContact CB-CG 4.01Å; A1379-L1382 WeakPolarHBondContact O-CB 3.36Å; A1379-L1382 PolarHBondContact O-N 3.01Å; A1379-L1382 VanDerWaalsContact O-N 3.17Å; A1379-F1383 WeakPolarHBondContact O-CD2 3.26Å
1380	P	94.4	Very high	95.3	Very high	50 Å²	50	27 Å²	27	33%	0.325	15%	0.15	S	C	.	.	G	3₁₀ helix	trans	-57.8	-32.8	-177.8	27.8	-40.3	0	0	0	112.9	M1376 L1382 F1383 Q1460	M1376-P1380 WeakPolarHBondContact O-CA 3.31Å; M1376-P1380 WeakPolarHBondContact O-CB 3.11Å; M1376-P1380 WeakPolarHBondContact O-CD 3.15Å; M1376-P1380 VanDerWaalsContact O-N 3.09Å; P1380-L1382 PolarHBondContact O-N 2.95Å; P1380-L1382 VanDerWaalsContact O-N 3.09Å; P1380-F1383 PolarHBondContact O-N 3.2Å; P1380-Q1460 VanDerWaalsContact CG-NE2 3.27Å
1381	E	93.9	Very high	95.3	Very high	80 Å²	80	27 Å²	27	37%	0.374	15%	0.15	S	C	.	.	G	3₁₀ helix	trans	-67.5	-5.3	-179.3	65	-94.1	-139.7	0	0	114.8	Y1279 K1283 A1379 F1383	Y1279-E1381 HydrophobicContact CE1-CG 3.61Å; Y1279-E1381 WeakPolarHBondContact CE1-OE1 3.36Å; Y1279-E1381 WeakPolarHBondContact OH-CG 3.46Å; K1283-E1381 WeakPolarHBondContact CD-OE1 3.36Å; K1283-E1381 WeakPolarHBondContact CE-OE1 3.46Å; K1283-E1381 IonicContact NZ-OE1 2.64Å; K1283-E1381 PolarHBondContact NZ-OE1 3.2Å; A1379-E1381 PolarHBondContact O-N 3.15Å; E1381-F1383 VanDerWaalsContact C-N 3.35Å
1382	L	96	Very high	95.3	Very high	7 Å²	7	27.2 Å²	27.2	4%	0.037	15%	0.151	C	C	.	.	G	3₁₀ helix	trans	-80.6	-16.3	169.7	-69	179.4	0	0	0	113.3	A1276 Y1279 I1319 M1320 F1323 A1379 P1380	A1276-L1382 HydrophobicContact CB-CD1 4.16Å; Y1279-L1382 HydrophobicContact CD1-CD1 3.99Å; Y1279-L1382 HydrophobicContact CD1-CD2 3.99Å; Y1279-L1382 HydrophobicContact CD1-CG 3.89Å; Y1279-L1382 HydrophobicContact CD2-CD2 3.77Å; Y1279-L1382 HydrophobicContact CE1-CD2 4.08Å; Y1279-L1382 HydrophobicContact CE1-CG 4.13Å; Y1279-L1382 HydrophobicContact CE2-CD2 3.84Å; Y1279-L1382 HydrophobicContact CG-CD1 3.96Å; Y1279-L1382 HydrophobicContact CG-CD2 3.82Å; Y1279-L1382 HydrophobicContact CG-CG 4.1Å; I1319-L1382 HydrophobicContact CG2-CD1 4.5Å; I1319-L1382 HydrophobicContact CG2-CD2 4.17Å; M1320-L1382 HydrophobicContact CB-CD2 4.15Å; M1320-L1382 HydrophobicContact CG-CD2 4.36Å; F1323-L1382 HydrophobicContact CB-CB 4.43Å; F1323-L1382 HydrophobicContact CB-CD2 4.23Å; F1323-L1382 HydrophobicContact CD1-CB 3.75Å; F1323-L1382 VanDerWaalsContact CD1-O 3.24Å; F1323-L1382 WeakPolarHBondContact CD1-O 3.32Å; F1323-L1382 HydrophobicContact CD2-CB 4.43Å; F1323-L1382 HydrophobicContact CD2-CD1 3.95Å; F1323-L1382 HydrophobicContact CE1-CB 4.06Å; F1323-L1382 HydrophobicContact CE2-CD1 4.16Å; F1323-L1382 HydrophobicContact CG-CB 3.95Å; F1323-L1382 HydrophobicContact CG-CD1 4.24Å; F1323-L1382 HydrophobicContact CG-CD2 4.45Å; F1323-L1382 HydrophobicContact CG-CG 4.46Å; A1379-L1382 HydrophobicContact CB-CD1 3.74Å; A1379-L1382 HydrophobicContact CB-CG 4.01Å; A1379-L1382 WeakPolarHBondContact O-CB 3.36Å; A1379-L1382 PolarHBondContact O-N 3.01Å; A1379-L1382 VanDerWaalsContact O-N 3.17Å; P1380-L1382 PolarHBondContact O-N 2.95Å; P1380-L1382 VanDerWaalsContact O-N 3.09Å
1383	F	95.9	Very high	95.2	Very high	20 Å²	20	32.8 Å²	32.8	9%	0.088	18%	0.177	C	C	.	.	S	Bend	trans	-106.6	137.7	-169.2	-65.8	-100.2	0	0	0	111.7	F1323 Y1353 A1375 M1376 A1379 P1380 E1381 A1388	F1323-F1383 HydrophobicContact CE1-CD1 4.05Å; F1323-F1383 HydrophobicContact CE1-CD2 4.22Å; F1323-F1383 AromaticContact CE1-CE1 3.68Å; F1323-F1383 HydrophobicContact CE1-CE1 3.68Å; F1323-F1383 AromaticContact CE1-CE2 3.86Å; F1323-F1383 HydrophobicContact CE1-CE2 3.86Å; F1323-F1383 HydrophobicContact CE1-CG 4.29Å; F1323-F1383 AromaticContact CE1-CZ 3.57Å; F1323-F1383 HydrophobicContact CE1-CZ 3.57Å; F1323-F1383 AromaticContact CZ-CE1 3.93Å; F1323-F1383 HydrophobicContact CZ-CE1 3.93Å; F1323-F1383 AromaticContact CZ-CE2 3.89Å; F1323-F1383 HydrophobicContact CZ-CE2 3.89Å; F1323-F1383 AromaticContact CZ-CZ 3.46Å; F1323-F1383 HydrophobicContact CZ-CZ 3.46Å; F1323-F1383 VanDerWaalsContact CZ-CZ 3.46Å; Y1353-F1383 HydrophobicContact CD1-CD1 4.27Å; Y1353-F1383 HydrophobicContact CD1-CE1 4.03Å; Y1353-F1383 HydrophobicContact CD2-CD1 4.12Å; Y1353-F1383 AromaticContact CD2-CE1 3.93Å; Y1353-F1383 HydrophobicContact CD2-CE1 3.93Å; Y1353-F1383 AromaticContact CE1-CD1 3.78Å; Y1353-F1383 HydrophobicContact CE1-CD1 3.78Å; Y1353-F1383 HydrophobicContact CE1-CE1 4.03Å; Y1353-F1383 AromaticContact CE2-CD1 3.63Å; Y1353-F1383 HydrophobicContact CE2-CD1 3.63Å; Y1353-F1383 AromaticContact CE2-CE1 3.94Å; Y1353-F1383 HydrophobicContact CE2-CE1 3.94Å; Y1353-F1383 HydrophobicContact CG-CD1 4.43Å; Y1353-F1383 AromaticContact CG-CE1 4Å; Y1353-F1383 HydrophobicContact CG-CE1 4Å; Y1353-F1383 AromaticContact CZ-CD1 3.45Å; Y1353-F1383 VanDerWaalsContact CZ-CD1 3.45Å; Y1353-F1383 AromaticContact CZ-CE1 3.99Å; A1375-F1383 HydrophobicContact CB-CE2 4.06Å; A1375-F1383 HydrophobicContact CB-CZ 3.65Å; M1376-F1383 HydrophobicContact CB-CE2 4.27Å; M1376-F1383 HydrophobicContact CB-CZ 4.34Å; M1376-F1383 HydrophobicContact CE-CD1 3.53Å; M1376-F1383 HydrophobicContact CE-CE1 3.68Å; M1376-F1383 HydrophobicContact CE-CG 4.4Å; M1376-F1383 HydrophobicContact CG-CD1 3.64Å; M1376-F1383 HydrophobicContact CG-CD2 3.96Å; M1376-F1383 HydrophobicContact CG-CE1 3.45Å; M1376-F1383 VanDerWaalsContact CG-CE1 3.45Å; M1376-F1383 HydrophobicContact CG-CE2 3.79Å; M1376-F1383 HydrophobicContact CG-CG 3.91Å; M1376-F1383 HydrophobicContact CG-CZ 3.53Å; M1376-F1383 HydrophobicContact SD-CD1 4.49Å; M1376-F1383 HydrophobicContact SD-CE1 4.41Å; A1379-F1383 WeakPolarHBondContact O-CD2 3.26Å; P1380-F1383 PolarHBondContact O-N 3.2Å; E1381-F1383 VanDerWaalsContact C-N 3.35Å; F1383-A1388 HydrophobicContact CB-CB 4.19Å
1384	D	94.1	Very high	94.9	Very high	76 Å²	76	34.7 Å²	34.7	41%	0.406	19%	0.186	S	C	.	.			trans	-69.3	132.5	162.3	175.9	-89.9	0	0	0	110.5	E1324 S1386 N1387 A1388	E1324-D1384 PolarHBondContact OE2-N 2.96Å; D1384-S1386 VanDerWaalsContact C-N 3.32Å; D1384-S1386 PolarHBondContact O-N 3.15Å; D1384-S1386 WeakPolarHBondContact OD1-CA 3.48Å; D1384-S1386 WeakPolarHBondContact OD1-CB 3.16Å; D1384-S1386 PolarHBondContact OD1-N 2.93Å; D1384-N1387 HydrophobicContact CB-CB 4.14Å; D1384-N1387 PolarHBondContact O-N 3.42Å; D1384-N1387 PolarHBondContact OD1-N 2.87Å; D1384-A1388 WeakPolarHBondContact O-CB 3.36Å; D1384-A1388 PolarHBondContact O-N 3.5Å
1385	I	91.8	Very high	94.7	Very high	87 Å²	87	34.7 Å²	34.7	45%	0.446	19%	0.186	S	C	.	.	H	α-helix	trans	-64.5	-35.4	-173.3	-62.3	168.3	0	0	0	111.9	T1389 A1464	I1385-T1389 WeakPolarHBondContact O-CB 3.43Å; I1385-T1389 PolarHBondContact O-N 3.24Å; I1385-T1389 PolarHBondContact O-OG1 2.87Å; I1385-A1464 HydrophobicContact CD1-CB 4.16Å; I1385-A1464 HydrophobicContact CG1-CB 4.48Å; I1385-A1464 HydrophobicContact CG2-CB 4.34Å
1386	S	92	Very high	94.6	Very high	76 Å²	76	36.4 Å²	36.4	53%	0.531	19%	0.193	S	C	.	.	H	α-helix	trans	-69.6	-49.4	179.3	-169.2	0	0	0	0	110.5	D1384 A1388 T1389 I1390	D1384-S1386 VanDerWaalsContact C-N 3.32Å; D1384-S1386 PolarHBondContact O-N 3.15Å; D1384-S1386 WeakPolarHBondContact OD1-CA 3.48Å; D1384-S1386 WeakPolarHBondContact OD1-CB 3.16Å; D1384-S1386 PolarHBondContact OD1-N 2.93Å; S1386-A1388 VanDerWaalsContact C-N 3.33Å; S1386-A1388 PolarHBondContact O-N 2.9Å; S1386-T1389 PolarHBondContact O-N 3.49Å; S1386-I1390 WeakPolarHBondContact O-CG1 3.26Å; S1386-I1390 PolarHBondContact O-N 2.86Å
1387	N	94.6	Very high	94.4	Very high	33 Å²	33	44.5 Å²	44.5	18%	0.176	23%	0.229	C	C	.	.	H	α-helix	trans	-62.8	-39.1	176.3	-67.5	-18.5	0	0	0	112	E1324 W1328 Y1353 D1384 I1390 A1391	E1324-N1387 PolarHBondContact OE1-ND2 2.78Å; W1328-N1387 HydrophobicContact CD2-CB 3.86Å; W1328-N1387 HydrophobicContact CE3-CB 3.84Å; W1328-N1387 HydrophobicContact CH2-CB 3.65Å; W1328-N1387 WeakPolarHBondContact CH2-O 3.16Å; W1328-N1387 HydrophobicContact CZ2-CB 3.66Å; W1328-N1387 VanDerWaalsContact CZ2-CG 3.45Å; W1328-N1387 VanDerWaalsContact CZ2-OD1 3.22Å; W1328-N1387 WeakPolarHBondContact CZ2-OD1 3.28Å; W1328-N1387 HydrophobicContact CZ3-CB 3.72Å; W1328-N1387 WeakPolarHBondContact CZ3-O 3.5Å; W1328-N1387 PolarHBondContact NE1-ND2 2.87Å; W1328-N1387 PolarHBondContact NE1-OD1 3.34Å; Y1353-N1387 VanDerWaalsContact OH-CB 3.25Å; Y1353-N1387 WeakPolarHBondContact OH-CB 3.03Å; D1384-N1387 HydrophobicContact CB-CB 4.14Å; D1384-N1387 PolarHBondContact O-N 3.42Å; D1384-N1387 PolarHBondContact OD1-N 2.87Å; N1387-I1390 PolarHBondContact O-N 2.9Å; N1387-A1391 WeakPolarHBondContact O-CB 3.45Å; N1387-A1391 PolarHBondContact O-N 3.5Å
1388	A	94.3	Very high	94.2	Very high	3 Å²	3	45.6 Å²	45.6	3%	0.025	23%	0.232	C	C	.	.	H	α-helix	trans	-62.7	-44	175.7	0	0	0	0	0	112.5	M1376 F1383 D1384 S1386 A1391 V1392 I1461	M1376-A1388 HydrophobicContact CE-CB 3.69Å; F1383-A1388 HydrophobicContact CB-CB 4.19Å; D1384-A1388 WeakPolarHBondContact O-CB 3.36Å; D1384-A1388 PolarHBondContact O-N 3.5Å; S1386-A1388 VanDerWaalsContact C-N 3.33Å; S1386-A1388 PolarHBondContact O-N 2.9Å; A1388-A1391 PolarHBondContact O-N 3.19Å; A1388-V1392 PolarHBondContact O-N 2.61Å; A1388-I1461 HydrophobicContact CB-CD1 3.76Å; A1388-I1461 HydrophobicContact CB-CG1 4.23Å
1389	T	93.5	Very high	93.9	Very high	37 Å²	37	44.4 Å²	44.4	23%	0.227	23%	0.226	C	C	.	.	H	α-helix	trans	-57.7	-52.2	176.8	-56.6	0	0	0	0	110.5	I1385 S1386 A1391 V1392 E1393 I1461	I1385-T1389 WeakPolarHBondContact O-CB 3.43Å; I1385-T1389 PolarHBondContact O-N 3.24Å; I1385-T1389 PolarHBondContact O-OG1 2.87Å; S1386-T1389 PolarHBondContact O-N 3.49Å; T1389-A1391 VanDerWaalsContact C-N 3.3Å; T1389-A1391 PolarHBondContact O-N 3.47Å; T1389-V1392 PolarHBondContact O-N 3.09Å; T1389-E1393 WeakPolarHBondContact O-CG 3.35Å; T1389-E1393 PolarHBondContact O-N 3.46Å; T1389-I1461 VanDerWaalsContact OG1-CG2 3.24Å; T1389-I1461 WeakPolarHBondContact OG1-CG2 3.43Å
1390	I	94.1	Very high	93.7	Very high	51 Å²	51	45.7 Å²	45.7	26%	0.262	23%	0.233	S	C	.	.	H	α-helix	trans	-57.2	-43.5	177.4	-63.8	163.4	0	0	0	111.1	W1328 L1331 S1386 N1387 K1394	W1328-I1390 HydrophobicContact CH2-CB 4.31Å; W1328-I1390 HydrophobicContact CH2-CG2 4.28Å; L1331-I1390 HydrophobicContact CD1-CD1 4.26Å; S1386-I1390 WeakPolarHBondContact O-CG1 3.26Å; S1386-I1390 PolarHBondContact O-N 2.86Å; N1387-I1390 PolarHBondContact O-N 2.9Å; I1390-K1394 WeakPolarHBondContact O-CB 3.22Å; I1390-K1394 PolarHBondContact O-N 2.8Å
1391	A	95.1	Very high	93.5	Very high	0 Å²	0	44 Å²	44	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-66.5	-40.7	-179.3	0	0	0	0	0	113.1	W1328 Y1353 F1372 M1376 N1387 A1388 T1389 K1394 A1395	W1328-A1391 HydrophobicContact CZ3-CB 4.24Å; Y1353-A1391 HydrophobicContact CD2-CB 3.78Å; Y1353-A1391 HydrophobicContact CE2-CB 3.84Å; F1372-A1391 HydrophobicContact CD2-CB 4.44Å; F1372-A1391 HydrophobicContact CE2-CB 3.68Å; F1372-A1391 HydrophobicContact CZ-CB 3.99Å; F1372-A1391 WeakPolarHBondContact CZ-O 3.24Å; M1376-A1391 HydrophobicContact CE-CB 4.04Å; N1387-A1391 WeakPolarHBondContact O-CB 3.45Å; N1387-A1391 PolarHBondContact O-N 3.5Å; A1388-A1391 PolarHBondContact O-N 3.19Å; T1389-A1391 VanDerWaalsContact C-N 3.3Å; T1389-A1391 PolarHBondContact O-N 3.47Å; A1391-K1394 PolarHBondContact O-N 3.25Å; A1391-A1395 WeakPolarHBondContact O-CB 2.8Å; A1391-A1395 PolarHBondContact O-N 3.39Å
1392	V	95.4	Very high	93.3	Very high	5 Å²	5	44.1 Å²	44.1	3%	0.03	23%	0.225	C	C	.	.	H	α-helix	trans	-72.5	-37.9	178.7	172	0	0	0	0	111.8	L1373 M1376 A1388 T1389 K1394 A1395 E1396 F1454 A1457 K1458 I1461	L1373-V1392 HydrophobicContact CD2-CG2 3.7Å; M1376-V1392 HydrophobicContact CE-CG2 4.22Å; M1376-V1392 HydrophobicContact SD-CG2 3.55Å; M1376-V1392 VanDerWaalsContact SD-CG2 3.55Å; A1388-V1392 PolarHBondContact O-N 2.61Å; T1389-V1392 PolarHBondContact O-N 3.09Å; V1392-K1394 VanDerWaalsContact C-N 3.33Å; V1392-K1394 PolarHBondContact O-N 3.13Å; V1392-A1395 PolarHBondContact O-N 3.43Å; V1392-E1396 PolarHBondContact O-N 2.99Å; V1392-F1454 HydrophobicContact CG1-CE2 4Å; V1392-A1457 HydrophobicContact CG2-CB 4.39Å; V1392-K1458 HydrophobicContact CG1-CB 3.96Å; V1392-K1458 HydrophobicContact CG1-CG 4.07Å; V1392-I1461 HydrophobicContact CB-CD1 4.03Å; V1392-I1461 HydrophobicContact CG2-CD1 3.35Å
1393	E	94.6	Very high	93.1	Very high	118 Å²	118	43.9 Å²	43.9	55%	0.551	22%	0.223	S	C	*	.	H	α-helix	trans	-61.8	-40.8	170.1	-71	-178.8	167.9	0	0	111.8	T1389 E1396 K1397	T1389-E1393 WeakPolarHBondContact O-CG 3.35Å; T1389-E1393 PolarHBondContact O-N 3.46Å; E1393-E1396 PolarHBondContact O-N 2.9Å; E1393-K1397 WeakPolarHBondContact O-CB 3.41Å; E1393-K1397 PolarHBondContact O-N 2.92Å
1394	K	92.7	Very high	93	Very high	42 Å²	42	42.9 Å²	42.9	18%	0.183	22%	0.219	C	C	.	.	H	α-helix	trans	-66.6	-39.7	175	-162.6	177.3	-171.1	-177.9	0	112	G1348 T1350 Y1352 L1368 I1390 A1391 V1392 K1397 K1398	G1348-K1394 PolarHBondContact O-NZ 2.96Å; T1350-K1394 PolarHBondContact O-NZ 3.41Å; Y1352-K1394 HydrophobicContact CD1-CD 3.71Å; Y1352-K1394 HydrophobicContact CE1-CD 4.35Å; L1368-K1394 HydrophobicContact CD2-CD 4.31Å; L1368-K1394 HydrophobicContact CD2-CG 4.27Å; I1390-K1394 WeakPolarHBondContact O-CB 3.22Å; I1390-K1394 PolarHBondContact O-N 2.8Å; A1391-K1394 PolarHBondContact O-N 3.25Å; V1392-K1394 VanDerWaalsContact C-N 3.33Å; V1392-K1394 PolarHBondContact O-N 3.13Å; K1394-K1397 PolarHBondContact O-N 2.91Å; K1394-K1398 HydrophobicContact CG-CG 4.26Å; K1394-K1398 VanDerWaalsContact O-CB 3.3Å; K1394-K1398 WeakPolarHBondContact O-CB 3.16Å; K1394-K1398 WeakPolarHBondContact O-CG 3.43Å; K1394-K1398 PolarHBondContact O-N 3.27Å
1395	A	93.7	Very high	93	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-63.9	-40.3	173.3	0	0	0	0	0	112	F1372 L1373 A1391 V1392 L1399 L1400	F1372-A1395 HydrophobicContact CZ-CB 3.95Å; L1373-A1395 HydrophobicContact CD1-CB 4.19Å; L1373-A1395 HydrophobicContact CD2-CB 4.21Å; A1391-A1395 WeakPolarHBondContact O-CB 2.8Å; A1391-A1395 PolarHBondContact O-N 3.39Å; V1392-A1395 PolarHBondContact O-N 3.43Å; A1395-L1399 HydrophobicContact CB-CD1 4.34Å; A1395-L1399 CarbonylContact O-C 3.57Å; A1395-L1399 VanDerWaalsContact O-CA 3.26Å; A1395-L1399 WeakPolarHBondContact O-CA 3.36Å; A1395-L1399 VanDerWaalsContact O-CB 3.26Å; A1395-L1399 WeakPolarHBondContact O-CB 3.39Å; A1395-L1399 PolarHBondContact O-N 2.68Å; A1395-L1400 PolarHBondContact O-N 3.02Å; A1395-L1400 VanDerWaalsContact O-N 3.16Å
1396	E	94.7	Very high	93	Very high	35 Å²	35	35.7 Å²	35.7	16%	0.164	18%	0.181	C	C	.	.	H	α-helix	trans	-61.8	-47.7	173.6	-175.4	162.2	-171.5	0	0	111.1	V1392 E1393 K1398 L1400 F1454 K1458 R1477	V1392-E1396 PolarHBondContact O-N 2.99Å; E1393-E1396 PolarHBondContact O-N 2.9Å; E1396-K1398 PolarHBondContact O-N 3.33Å; E1396-L1400 HydrophobicContact CG-CD2 3.97Å; E1396-L1400 WeakPolarHBondContact O-CB 3.02Å; E1396-F1454 HydrophobicContact CB-CE2 3.88Å; E1396-F1454 HydrophobicContact CB-CZ 3.7Å; E1396-F1454 HydrophobicContact CG-CZ 3.87Å; E1396-K1458 VanDerWaalsContact OE2-CE 3.32Å; E1396-K1458 WeakPolarHBondContact OE2-CE 3.17Å; E1396-K1458 IonicContact OE2-NZ 3.66Å; E1396-K1458 PolarHBondContact OE2-NZ 3.07Å; E1396-R1477 IonicContact OE1-CZ 3.1Å; E1396-R1477 IonicContact OE1-NE 2.68Å; E1396-R1477 PolarHBondContact OE1-NE 3.17Å; E1396-R1477 IonicContact OE1-NH2 2.84Å; E1396-R1477 PolarHBondContact OE1-NH2 3.22Å
1397	K	92.8	Very high	93	Very high	175 Å²	175	32.1 Å²	32.1	76%	0.761	16%	0.156	S	C	*	.	H	α-helix	trans	-67.2	-31.3	-177.8	-174.1	171.8	-177.6	174.8	0	114.1	E1393 K1394	E1393-K1397 WeakPolarHBondContact O-CB 3.41Å; E1393-K1397 PolarHBondContact O-N 2.92Å; K1394-K1397 PolarHBondContact O-N 2.91Å
1398	K	90.7	Very high	92.8	Very high	38 Å²	38	30.5 Å²	30.5	17%	0.165	15%	0.147	C	C	.	.	H	α-helix	trans	-111.2	-35.5	-171.5	-65.3	-68	-178.9	171.7	0	114.1	L1368 K1394 E1396 K1406 E1411	L1368-K1398 HydrophobicContact CD2-CB 3.81Å; L1368-K1398 HydrophobicContact CD2-CG 4.08Å; K1394-K1398 HydrophobicContact CG-CG 4.26Å; K1394-K1398 VanDerWaalsContact O-CB 3.3Å; K1394-K1398 WeakPolarHBondContact O-CB 3.16Å; K1394-K1398 WeakPolarHBondContact O-CG 3.43Å; K1394-K1398 PolarHBondContact O-N 3.27Å; E1396-K1398 PolarHBondContact O-N 3.33Å; K1398-K1406 WeakPolarHBondContact O-CD 3.31Å; K1398-K1406 PolarHBondContact O-NZ 3.41Å; K1398-E1411 WeakPolarHBondContact CE-OE2 3.36Å; K1398-E1411 IonicContact NZ-OE1 2.85Å; K1398-E1411 PolarHBondContact NZ-OE1 3.25Å; K1398-E1411 IonicContact NZ-OE2 3.08Å; K1398-E1411 PolarHBondContact NZ-OE2 2.92Å
1399	L	92.2	Very high	92.5	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-108.7	-16	-170.4	-56.6	-179.3	0	0	0	114.5	L1368 P1370 A1395 G1401 M1405 K1406 N1409	L1368-L1399 HydrophobicContact CD1-CD1 3.97Å; L1368-L1399 HydrophobicContact CG-CD1 4.04Å; L1368-L1399 HydrophobicContact CG-CD2 4.24Å; L1368-L1399 HydrophobicContact CG-CG 4.2Å; P1370-L1399 HydrophobicContact CB-CD1 4.1Å; A1395-L1399 HydrophobicContact CB-CD1 4.34Å; A1395-L1399 CarbonylContact O-C 3.57Å; A1395-L1399 VanDerWaalsContact O-CA 3.26Å; A1395-L1399 WeakPolarHBondContact O-CA 3.36Å; A1395-L1399 VanDerWaalsContact O-CB 3.26Å; A1395-L1399 WeakPolarHBondContact O-CB 3.39Å; A1395-L1399 PolarHBondContact O-N 2.68Å; L1399-G1401 PolarHBondContact O-N 3.14Å; L1399-M1405 HydrophobicContact CB-CE 3.84Å; L1399-M1405 WeakPolarHBondContact O-CA 3.45Å; L1399-K1406 HydrophobicContact CB-CB 4.48Å; L1399-K1406 HydrophobicContact CD2-CB 4.22Å; L1399-K1406 WeakPolarHBondContact O-CB 3.37Å; L1399-K1406 WeakPolarHBondContact O-CG 3.33Å; L1399-K1406 PolarHBondContact O-N 3.31Å; L1399-N1409 HydrophobicContact CD2-CB 4.32Å
1400	L	92.2	Very high	91.9	Very high	27 Å²	27	32.8 Å²	32.8	14%	0.141	16%	0.155	C	C	.	.	B	Isolated β-bridge	trans	-65.5	136	177.4	-174.1	64.5	0	0	0	111.1	A1395 E1396 M1405 K1406 M1451 F1454 R1477 I1481	A1395-L1400 PolarHBondContact O-N 3.02Å; A1395-L1400 VanDerWaalsContact O-N 3.16Å; E1396-L1400 HydrophobicContact CG-CD2 3.97Å; E1396-L1400 WeakPolarHBondContact O-CB 3.02Å; L1400-M1405 HydrophobicContact CD1-SD 3.78Å; L1400-K1406 WeakPolarHBondContact O-CE 3.41Å; L1400-M1451 HydrophobicContact CD1-CE 3.52Å; L1400-M1451 HydrophobicContact CD1-SD 3.58Å; L1400-M1451 VanDerWaalsContact CD1-SD 3.58Å; L1400-F1454 HydrophobicContact CD1-CD1 4.13Å; L1400-F1454 HydrophobicContact CD1-CE1 3.95Å; L1400-R1477 VanDerWaalsContact CD2-NH2 3.34Å; L1400-I1481 HydrophobicContact CD1-CD1 4.21Å; L1400-I1481 HydrophobicContact CD2-CD1 3.87Å; L1400-I1481 HydrophobicContact CD2-CG1 4.42Å
1401	G	90	Very high	91.4	Very high	14 Å²	14	36.3 Å²	36.3	14%	0.144	17%	0.17	C	C	.	.			trans	-120	-171.9	170.5	0	0	0	0	0	112.1	L1399 G1404 E1446	L1399-G1401 PolarHBondContact O-N 3.14Å; G1401-G1404 VanDerWaalsContact CA-O 3.26Å; G1401-G1404 WeakPolarHBondContact CA-O 3.24Å; G1401-G1404 PolarHBondContact N-O 3.36Å; G1401-E1446 VanDerWaalsContact CA-CD 3.42Å; G1401-E1446 VanDerWaalsContact CA-OE1 3.24Å; G1401-E1446 WeakPolarHBondContact CA-OE1 3.36Å
1402	H	89.7	Confident	91	Very high	83 Å²	83	37.1 Å²	37.1	38%	0.384	17%	0.174	S	C	.	.	S	Bend	trans	-70.6	-44.6	-178.5	-176.8	60.2	0	0	0	112.8	E1446 N1484	H1402-E1446 PolarHBondContact N-OE1 2.9Å; H1402-E1446 PolarHBondContact N-OE2 3.36Å; H1402-N1484 PolarHBondContact CE1-OD1 3.18Å; H1402-N1484 PolarHBondContact ND1-ND2 2.95Å; H1402-N1484 WeakPolarHBondContact O-CB 3.34Å; H1402-N1484 PolarHBondContact O-ND2 2.85Å
1403	L	92.1	Very high	90.4	Very high	1 Å²	1	44.2 Å²	44.2	1%	0.005	20%	0.201	C	C	.	.	S	Bend	trans	-122.3	-16.8	-179.1	-70.1	169.2	0	0	0	113.5	E1446 V1448 N1484 H1485 Y1488 T1501	L1403-E1446 PolarHBondContact N-OE2 2.65Å; L1403-V1448 HydrophobicContact CB-CG2 4.29Å; L1403-V1448 WeakPolarHBondContact O-CG1 3.37Å; L1403-N1484 HydrophobicContact CD2-CB 3.96Å; L1403-N1484 WeakPolarHBondContact CD2-O 3.32Å; L1403-H1485 PolarHBondContact O-NE2 3.09Å; L1403-Y1488 HydrophobicContact CD1-CD2 3.36Å; L1403-Y1488 HydrophobicContact CD1-CE2 3.94Å; L1403-Y1488 HydrophobicContact CD1-CG 3.89Å; L1403-T1501 HydrophobicContact CD1-CG2 4.08Å
1404	G	92.5	Very high	89.8	Confident	0 Å²	0	39 Å²	39	0%	0	18%	0.179	C	C	.	.	S	Bend	trans	-144.1	-174	178.6	0	0	0	0	0	114.2	G1401 E1446 W1447	G1401-G1404 VanDerWaalsContact CA-O 3.26Å; G1401-G1404 WeakPolarHBondContact CA-O 3.24Å; G1401-G1404 PolarHBondContact N-O 3.36Å; G1404-E1446 PolarHBondContact N-OE2 3.15Å; G1404-W1447 WeakPolarHBondContact CA-O 3.2Å
1405	M	93.6	Very high	89.4	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	17%	0.173	C	C	.	.	B	Isolated β-bridge	trans	-99.2	136.5	173	-58	-61.1	-70.2	0	0	110.8	P1370 L1373 L1399 L1400 W1447 L1450 M1451 F1454	P1370-M1405 HydrophobicContact CB-CB 4.24Å; P1370-M1405 HydrophobicContact CG-CB 4.47Å; L1373-M1405 HydrophobicContact CD1-CE 4.05Å; L1399-M1405 HydrophobicContact CB-CE 3.84Å; L1399-M1405 WeakPolarHBondContact O-CA 3.45Å; L1400-M1405 HydrophobicContact CD1-SD 3.78Å; M1405-W1447 PolarHBondContact N-O 3.44Å; M1405-W1447 PolarHBondContact O-N 3.11Å; M1405-L1450 HydrophobicContact CB-CB 3.77Å; M1405-L1450 HydrophobicContact CB-CD1 4.44Å; M1405-L1450 HydrophobicContact CG-CB 3.88Å; M1405-M1451 HydrophobicContact SD-CE 4.43Å; M1405-M1451 HydrophobicContact SD-SD 3.99Å; M1405-F1454 HydrophobicContact CE-CB 4.01Å; M1405-F1454 HydrophobicContact CE-CD1 4.47Å; M1405-F1454 HydrophobicContact CE-CD2 3.83Å; M1405-F1454 HydrophobicContact CE-CE2 4.49Å; M1405-F1454 HydrophobicContact CE-CG 3.82Å; M1405-F1454 HydrophobicContact CG-CB 4.05Å; M1405-F1454 HydrophobicContact SD-CB 3.73Å; M1405-F1454 HydrophobicContact SD-CD1 3.99Å; M1405-F1454 HydrophobicContact SD-CD2 4.37Å; M1405-F1454 HydrophobicContact SD-CG 3.75Å
1406	K	91.7	Very high	88.9	Confident	12 Å²	12	38 Å²	38	5%	0.052	17%	0.174	C	C	.	.			trans	-62.9	132.9	167.8	-55.7	163.9	-169.8	-179.9	0	109.1	P1370 K1398 L1399 L1400 L1408 E1410 Y1415 L1444 K1445	P1370-K1406 WeakPolarHBondContact CD-O 3.28Å; P1370-K1406 WeakPolarHBondContact CG-O 3.45Å; K1398-K1406 WeakPolarHBondContact O-CD 3.31Å; K1398-K1406 PolarHBondContact O-NZ 3.41Å; L1399-K1406 HydrophobicContact CB-CB 4.48Å; L1399-K1406 HydrophobicContact CD2-CB 4.22Å; L1399-K1406 WeakPolarHBondContact O-CB 3.37Å; L1399-K1406 WeakPolarHBondContact O-CG 3.33Å; L1399-K1406 PolarHBondContact O-N 3.31Å; L1400-K1406 WeakPolarHBondContact O-CE 3.41Å; K1406-L1408 VanDerWaalsContact C-N 3.31Å; K1406-E1410 IonicContact NZ-OE2 2.69Å; K1406-E1410 PolarHBondContact NZ-OE2 2.97Å; K1406-Y1415 HydrophobicContact CB-CE2 4.25Å; K1406-Y1415 WeakPolarHBondContact CD-OH 3.42Å; K1406-Y1415 WeakPolarHBondContact CG-OH 3.26Å; K1406-L1444 HydrophobicContact CD-CD2 4.28Å; K1406-K1445 WeakPolarHBondContact CA-O 3.32Å
1407	T	92	Very high	88.2	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	17%	0.166	C	C	.	.	S	Bend	trans	-85.1	-4.4	-177	50.5	0	0	0	0	114.6	W1247 M1248 R1369 H1437 W1447 L1450	W1247-T1407 HydrophobicContact CH2-CG2 3.63Å; W1247-T1407 HydrophobicContact CZ2-CG2 4.3Å; M1248-T1407 HydrophobicContact CE-CG2 4.09Å; R1369-T1407 WeakPolarHBondContact CG-O 3.44Å; R1369-T1407 PolarHBondContact NH1-O 3.49Å; T1407-H1437 VanDerWaalsContact CB-O 3.31Å; T1407-H1437 WeakPolarHBondContact CB-O 3.32Å; T1407-H1437 PolarHBondContact OG1-O 3.31Å; T1407-W1447 HydrophobicContact CG2-CB 4.26Å; T1407-W1447 HydrophobicContact CG2-CG 3.94Å; T1407-L1450 HydrophobicContact CG2-CD1 3.89Å
1408	L	90.6	Very high	87.8	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	15%	0.15	C	C	.	.	S	Bend	trans	-152.8	149.6	174.7	178.8	61.5	0	0	0	108.1	Q1367 R1369 K1406 D1412 A1414 Y1415 Q1438	Q1367-L1408 HydrophobicContact CB-CD1 3.76Å; Q1367-L1408 HydrophobicContact CG-CD1 4.17Å; R1369-L1408 HydrophobicContact CG-CD1 4.37Å; K1406-L1408 VanDerWaalsContact C-N 3.31Å; L1408-D1412 HydrophobicContact CD1-CB 3.96Å; L1408-D1412 HydrophobicContact CD2-CB 3.87Å; L1408-D1412 HydrophobicContact CG-CB 3.82Å; L1408-A1414 HydrophobicContact CD2-CB 3.82Å; L1408-Y1415 HydrophobicContact CB-CD2 4.06Å; L1408-Y1415 HydrophobicContact CG-CD2 4.47Å; L1408-Y1415 WeakPolarHBondContact O-CD2 3.37Å; L1408-Y1415 WeakPolarHBondContact O-CE2 3.43Å; L1408-Q1438 HydrophobicContact CD2-CB 4.49Å
1409	N	87.7	Confident	87.5	Confident	3 Å²	3	32.6 Å²	32.6	2%	0.016	15%	0.147	C	C	.	.			trans	-64.2	144	174.6	-176.5	26.8	0	0	0	111.7	L1368 L1399 E1411 D1412	L1368-N1409 HydrophobicContact CB-CB 3.92Å; L1368-N1409 HydrophobicContact CD2-CB 4.11Å; L1368-N1409 HydrophobicContact CG-CB 4.17Å; L1368-N1409 PolarHBondContact O-N 3.19Å; L1368-N1409 VanDerWaalsContact O-N 3.08Å; L1399-N1409 HydrophobicContact CD2-CB 4.32Å; N1409-E1411 VanDerWaalsContact C-N 3.26Å; N1409-E1411 PolarHBondContact ND2-OE2 3.07Å; N1409-E1411 PolarHBondContact O-N 3.31Å; N1409-D1412 VanDerWaalsContact O-CB 3.3Å; N1409-D1412 WeakPolarHBondContact O-CB 3.48Å; N1409-D1412 PolarHBondContact O-N 3Å; N1409-D1412 VanDerWaalsContact O-N 3.16Å
1410	E	81.1	Confident	87.2	Confident	84 Å²	84	34.2 Å²	34.2	39%	0.393	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-19.8	-174.3	67.7	-166.2	-167.5	0	0	115.6	K1406 D1412 Y1415 L1444	K1406-E1410 IonicContact NZ-OE2 2.69Å; K1406-E1410 PolarHBondContact NZ-OE2 2.97Å; E1410-D1412 VanDerWaalsContact C-N 3.3Å; E1410-Y1415 VanDerWaalsContact CA-CE1 3.44Å; E1410-Y1415 HydrophobicContact CB-CD1 3.65Å; E1410-Y1415 HydrophobicContact CB-CE1 3.28Å; E1410-L1444 WeakPolarHBondContact OE2-CD2 3.46Å
1411	E	84.6	Confident	86.7	Confident	126 Å²	126	34.9 Å²	34.9	59%	0.589	17%	0.168	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-6.8	176	-60.5	161.1	139.8	0	0	112.7	K1398 N1409	K1398-E1411 WeakPolarHBondContact CE-OE2 3.36Å; K1398-E1411 IonicContact NZ-OE1 2.85Å; K1398-E1411 PolarHBondContact NZ-OE1 3.25Å; K1398-E1411 IonicContact NZ-OE2 3.08Å; K1398-E1411 PolarHBondContact NZ-OE2 2.92Å; N1409-E1411 VanDerWaalsContact C-N 3.26Å; N1409-E1411 PolarHBondContact ND2-OE2 3.07Å; N1409-E1411 PolarHBondContact O-N 3.31Å
1412	D	85.5	Confident	86.4	Confident	16 Å²	16	38.2 Å²	38.2	9%	0.086	19%	0.194	C	C	.	.	S	Bend	trans	-72.1	145.1	175.6	-166	-70.3	0	0	0	110.6	Q1367 L1408 N1409 E1410 A1414 Y1415	Q1367-D1412 WeakPolarHBondContact CG-OD2 3.09Å; Q1367-D1412 VanDerWaalsContact NE2-CG 3.26Å; Q1367-D1412 PolarHBondContact NE2-OD1 3.14Å; Q1367-D1412 PolarHBondContact NE2-OD2 3.38Å; L1408-D1412 HydrophobicContact CD1-CB 3.96Å; L1408-D1412 HydrophobicContact CD2-CB 3.87Å; L1408-D1412 HydrophobicContact CG-CB 3.82Å; N1409-D1412 VanDerWaalsContact O-CB 3.3Å; N1409-D1412 WeakPolarHBondContact O-CB 3.48Å; N1409-D1412 PolarHBondContact O-N 3Å; N1409-D1412 VanDerWaalsContact O-N 3.16Å; E1410-D1412 VanDerWaalsContact C-N 3.3Å; D1412-A1414 PolarHBondContact O-N 3.3Å; D1412-A1414 WeakPolarHBondContact OD1-CB 3.47Å; D1412-A1414 PolarHBondContact OD1-N 3.05Å; D1412-Y1415 WeakPolarHBondContact O-CA 3.24Å; D1412-Y1415 PolarHBondContact O-N 3.25Å
1413	W	83.3	Confident	86.1	Confident	154 Å²	154	37.6 Å²	37.6	58%	0.583	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-25.2	-179	67.2	-90.3	0	0	0	113	W1363 Y1415 K1429	W1363-W1413 HydrophobicContact CH2-CH2 4.46Å; W1363-W1413 AromaticContact CH2-CZ2 3.65Å; W1363-W1413 HydrophobicContact CH2-CZ2 3.65Å; W1363-W1413 AromaticContact CZ2-CZ2 3.9Å; W1363-W1413 HydrophobicContact CZ2-CZ2 3.9Å; W1363-W1413 HydrophobicContact CZ3-CZ2 4.11Å; W1413-Y1415 PolarHBondContact O-N 3.31Å; W1413-K1429 WeakPolarHBondContact O-CE 3.42Å; W1413-K1429 PolarHBondContact O-NZ 3.43Å
1414	A	82.6	Confident	85.9	Confident	10 Å²	10	40.7 Å²	40.7	8%	0.083	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-1.4	169.3	0	0	0	0	0	112.1	L1408 D1412 N1416	L1408-A1414 HydrophobicContact CD2-CB 3.82Å; D1412-A1414 PolarHBondContact O-N 3.3Å; D1412-A1414 WeakPolarHBondContact OD1-CB 3.47Å; D1412-A1414 PolarHBondContact OD1-N 3.05Å; A1414-N1416 VanDerWaalsContact O-CB 3.24Å; A1414-N1416 WeakPolarHBondContact O-CB 3.49Å
1415	Y	83.8	Confident	85.6	Confident	18 Å²	18	42.2 Å²	42.2	7%	0.071	22%	0.223	C	C	.	.			trans	-62	136.7	179.2	-172.2	-25.2	0	0	0	116.4	K1406 L1408 E1410 D1412 W1413 Q1438 L1444	K1406-Y1415 HydrophobicContact CB-CE2 4.25Å; K1406-Y1415 WeakPolarHBondContact CD-OH 3.42Å; K1406-Y1415 WeakPolarHBondContact CG-OH 3.26Å; L1408-Y1415 HydrophobicContact CB-CD2 4.06Å; L1408-Y1415 HydrophobicContact CG-CD2 4.47Å; L1408-Y1415 WeakPolarHBondContact O-CD2 3.37Å; L1408-Y1415 WeakPolarHBondContact O-CE2 3.43Å; E1410-Y1415 VanDerWaalsContact CA-CE1 3.44Å; E1410-Y1415 HydrophobicContact CB-CD1 3.65Å; E1410-Y1415 HydrophobicContact CB-CE1 3.28Å; D1412-Y1415 WeakPolarHBondContact O-CA 3.24Å; D1412-Y1415 PolarHBondContact O-N 3.25Å; W1413-Y1415 PolarHBondContact O-N 3.31Å; Y1415-Q1438 WeakPolarHBondContact CB-O 3.15Å; Y1415-Q1438 WeakPolarHBondContact CD2-O 3.18Å; Y1415-L1444 HydrophobicContact CE1-CD2 4.2Å; Y1415-L1444 WeakPolarHBondContact OH-CA 3.29Å; Y1415-L1444 VanDerWaalsContact OH-CD2 3.25Å; Y1415-L1444 WeakPolarHBondContact OH-CD2 3.42Å
1416	N	83.3	Confident	85.2	Confident	3 Å²	3	46.1 Å²	46.1	2%	0.016	26%	0.255	C	S	.	.			trans	171.1	147.7	-131.6	-119	-114.5	0	0	0	109.7	A1414 K1429 G1439 P1440 H1441	A1414-N1416 VanDerWaalsContact O-CB 3.24Å; A1414-N1416 WeakPolarHBondContact O-CB 3.49Å; N1416-K1429 WeakPolarHBondContact ND2-CD 3.43Å; N1416-G1439 VanDerWaalsContact C-C 3.42Å; N1416-G1439 WeakPolarHBondContact CB-O 3.41Å; N1416-G1439 VanDerWaalsContact CG-O 3.28Å; N1416-G1439 CarbonylContact O-C 3.53Å; N1416-G1439 WeakPolarHBondContact O-CA 3.47Å; N1416-G1439 PolarHBondContact OD1-O 3.33Å; N1416-P1440 VanDerWaalsContact CA-C 3.48Å; N1416-P1440 VanDerWaalsContact OD1-C 3.32Å; N1416-P1440 WeakPolarHBondContact OD1-CA 3.38Å; N1416-H1441 VanDerWaalsContact CG-CA 3.46Å; N1416-H1441 VanDerWaalsContact ND2-CA 3.33Å; N1416-H1441 WeakPolarHBondContact ND2-CA 3.41Å; N1416-H1441 PolarHBondContact ND2-N 3.41Å; N1416-H1441 PolarHBondContact OD1-N 2.94Å
1417	G	81.1	Confident	84.8	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	26%	0.264	C	S	.	.			trans	-152.2	-29.3	166	0	0	0	0	0	126.7	Y1419 P1440 G1443 L1444	G1417-Y1419 PolarHBondContact O-N 2.91Å; G1417-P1440 VanDerWaalsContact C-CB 3.49Å; G1417-P1440 CarbonylContact C-O 3.58Å; G1417-P1440 VanDerWaalsContact CA-O 3.27Å; G1417-P1440 WeakPolarHBondContact CA-O 3.5Å; G1417-P1440 PolarHBondContact N-O 2.96Å; G1417-P1440 VanDerWaalsContact O-CD 3.24Å; G1417-P1440 WeakPolarHBondContact O-CD 3.46Å; G1417-G1443 VanDerWaalsContact CA-C 3.46Å; G1417-G1443 VanDerWaalsContact CA-O 3.22Å; G1417-G1443 WeakPolarHBondContact CA-O 3.38Å; G1417-L1444 CarbonylContact C-O 3.58Å; G1417-L1444 WeakPolarHBondContact CA-O 3.48Å; G1417-L1444 VanDerWaalsContact O-O 3.08Å
1418	Y	83.7	Confident	84.3	Confident	109 Å²	109	51 Å²	51	43%	0.427	28%	0.282	S	S	.	.			trans	-47.7	74.6	161	46.1	-165.9	0	0	0	122.4	S1420 P1440 T1442 N1502 K1503 A1506	Y1418-S1420 PolarHBondContact O-N 3.16Å; Y1418-P1440 VanDerWaalsContact CA-O 3.27Å; Y1418-P1440 WeakPolarHBondContact CA-O 3.48Å; Y1418-P1440 PolarHBondContact N-O 3.48Å; Y1418-P1440 WeakPolarHBondContact O-CB 3.39Å; Y1418-T1442 VanDerWaalsContact CD2-OG1 3.24Å; Y1418-T1442 WeakPolarHBondContact CD2-OG1 3.32Å; Y1418-T1442 WeakPolarHBondContact CE2-O 3.4Å; Y1418-N1502 HydrophobicContact CD1-CB 3.64Å; Y1418-N1502 HydrophobicContact CE1-CB 4.43Å; Y1418-N1502 HydrophobicContact CG-CB 4.14Å; Y1418-K1503 HydrophobicContact CD1-CB 4.44Å; Y1418-K1503 HydrophobicContact CE1-CB 3.84Å; Y1418-K1503 HydrophobicContact CE2-CB 4.01Å; Y1418-K1503 HydrophobicContact CE2-CD 4.45Å; Y1418-A1506 HydrophobicContact CE1-CB 4.45Å
1419	Y	85.1	Confident	83.9	Confident	25 Å²	25	53.8 Å²	53.8	10%	0.098	29%	0.294	C	S	.	.			trans	-71.6	127.3	-177.8	-175	-107.7	0	0	0	112.2	G1417 A1421 N1435 L1436 P1440 F1500 N1502 D1510	G1417-Y1419 PolarHBondContact O-N 2.91Å; Y1419-A1421 HydrophobicContact CE1-CB 4.36Å; Y1419-N1435 VanDerWaalsContact CD2-OD1 3.32Å; Y1419-N1435 WeakPolarHBondContact CD2-OD1 3.48Å; Y1419-L1436 HydrophobicContact CD2-CD1 4.05Å; Y1419-L1436 HydrophobicContact CE1-CD1 4.15Å; Y1419-L1436 HydrophobicContact CE2-CB 4Å; Y1419-L1436 HydrophobicContact CE2-CD1 3.44Å; Y1419-L1436 VanDerWaalsContact CE2-CD1 3.44Å; Y1419-L1436 HydrophobicContact CE2-CG 4.32Å; Y1419-P1440 HydrophobicContact CD2-CG 4.13Å; Y1419-P1440 HydrophobicContact CG-CG 4.4Å; Y1419-F1500 AromaticContact CD1-CE2 3.67Å; Y1419-F1500 HydrophobicContact CD1-CE2 3.67Å; Y1419-F1500 AromaticContact CD1-CZ 3.99Å; Y1419-F1500 HydrophobicContact CD1-CZ 3.99Å; Y1419-F1500 HydrophobicContact CE1-CE2 4.16Å; Y1419-F1500 AromaticContact CE1-CZ 3.99Å; Y1419-F1500 HydrophobicContact CE1-CZ 3.99Å; Y1419-F1500 HydrophobicContact CG-CE2 4.19Å; Y1419-N1502 PolarHBondContact N-OD1 2.98Å; Y1419-D1510 HydrophobicContact CD1-CB 3.86Å; Y1419-D1510 HydrophobicContact CE1-CB 3.58Å
1420	S	85.4	Confident	83.7	Confident	34 Å²	34	54.7 Å²	54.7	24%	0.238	30%	0.3	C	S	.	.			trans	-143	134.8	157.2	-172.3	0	0	0	0	112	Y1418 A1422 G1433 D1510	Y1418-S1420 PolarHBondContact O-N 3.16Å; S1420-A1422 VanDerWaalsContact C-N 3.34Å; S1420-A1422 PolarHBondContact OG-N 2.97Å; S1420-G1433 WeakPolarHBondContact O-CA 3.19Å; S1420-G1433 PolarHBondContact O-N 3.3Å; S1420-D1510 WeakPolarHBondContact CA-OD2 2.98Å; S1420-D1510 PolarHBondContact OG-OD2 3.32Å
1421	A	82	Confident	83.9	Confident	41 Å²	41	50.7 Å²	50.7	34%	0.339	28%	0.281	S	S	.	.	S	Bend	trans	-78.5	-19	172.3	0	0	0	0	0	112.8	Y1419 D1510	Y1419-A1421 HydrophobicContact CE1-CB 4.36Å; A1421-D1510 HydrophobicContact CB-CB 4.46Å; A1421-D1510 PolarHBondContact N-OD2 3.41Å
1422	A	83.9	Confident	84	Confident	83 Å²	83	46.1 Å²	46.1	69%	0.686	26%	0.261	S	S	*	.	S	Bend	trans	-88.5	-10.2	-174.7	0	0	0	0	0	114.4	S1420 D1424	S1420-A1422 VanDerWaalsContact C-N 3.34Å; S1420-A1422 PolarHBondContact OG-N 2.97Å; A1422-D1424 PolarHBondContact O-N 3.15Å
1423	V	83.6	Confident	84	Confident	70 Å²	70	45.4 Å²	45.4	42%	0.424	26%	0.257	S	S	.	.			trans	-87.6	102.1	179.5	176	0	0	0	0	109.4	A1431 N1432	V1423-A1431 CarbonylContact O-C 3.59Å; V1423-A1431 WeakPolarHBondContact O-CA 3.41Å; V1423-N1432 PolarHBondContact O-N 2.88Å
1424	D	86.8	Confident	84.2	Confident	66 Å²	66	39.4 Å²	39.4	35%	0.353	24%	0.235	S	C	.	.			trans	-97.9	126.7	163.6	-156.1	-15.4	0	0	0	109.2	S1254 I1256 A1422 N1432	S1254-D1424 WeakPolarHBondContact CB-OD1 3.34Å; S1254-D1424 PolarHBondContact OG-OD1 3.28Å; I1256-D1424 HydrophobicContact CD1-CB 4.15Å; A1422-D1424 PolarHBondContact O-N 3.15Å; D1424-N1432 WeakPolarHBondContact CB-OD1 3.44Å; D1424-N1432 PolarHBondContact OD2-ND2 2.96Å
1425	S	85.4	Confident	84.4	Confident	33 Å²	33	39 Å²	39	23%	0.231	23%	0.231	C	C	.	.			trans	-153.3	174.2	-171.3	88.3	0	0	0	0	112.2	D1427 A1431	S1425-D1427 VanDerWaalsContact C-N 3.26Å; S1425-D1427 PolarHBondContact O-N 3.39Å; S1425-D1427 PolarHBondContact OG-N 2.91Å; S1425-A1431 WeakPolarHBondContact O-CB 3.46Å
1426	A	85.5	Confident	84.5	Confident	81 Å²	81	39.2 Å²	39.2	67%	0.669	23%	0.233	S	C	*	.	S	Bend	trans	-73	-15.6	172.2	0	0	0	0	0	113.5	I1256 C1257 N1428	I1256-A1426 HydrophobicContact CG2-CB 4.37Å; C1257-A1426 WeakPolarHBondContact CB-O 3.41Å; A1426-N1428 PolarHBondContact O-N 2.99Å
1427	D	84.7	Confident	84.8	Confident	47 Å²	47	39.1 Å²	39.1	25%	0.251	23%	0.233	S	C	.	.			trans	-77.5	105.2	173.6	168	35.3	0	0	0	110.4	S1425 K1429 T1430 A1431 H1441	S1425-D1427 VanDerWaalsContact C-N 3.26Å; S1425-D1427 PolarHBondContact O-N 3.39Å; S1425-D1427 PolarHBondContact OG-N 2.91Å; D1427-K1429 PolarHBondContact O-N 3.12Å; D1427-K1429 VanDerWaalsContact O-N 3.11Å; D1427-K1429 WeakPolarHBondContact OD1-CB 3.26Å; D1427-K1429 WeakPolarHBondContact OD1-CG 3.27Å; D1427-K1429 PolarHBondContact OD1-N 3.04Å; D1427-T1430 PolarHBondContact O-N 3.09Å; D1427-T1430 PolarHBondContact O-OG1 3.24Å; D1427-T1430 VanDerWaalsContact OD2-CB 3.31Å; D1427-T1430 WeakPolarHBondContact OD2-CB 3.23Å; D1427-T1430 WeakPolarHBondContact OD2-CG2 3.48Å; D1427-T1430 PolarHBondContact OD2-N 2.78Å; D1427-T1430 VanDerWaalsContact OD2-N 3.14Å; D1427-T1430 PolarHBondContact OD2-OG1 2.96Å; D1427-A1431 WeakPolarHBondContact O-CB 3.44Å; D1427-A1431 PolarHBondContact O-N 2.91Å; D1427-H1441 IonicContact OD2-CD2 3.84Å; D1427-H1441 PolarHBondContact OD2-CD2 2.92Å
1428	N	81.7	Confident	85	Confident	68 Å²	68	40 Å²	40	36%	0.364	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-30.1	177.1	-172.1	2.9	0	0	0	113.3	C1257 N1259 A1426 F1434	C1257-N1428 HydrophobicContact CB-CB 4.16Å; N1259-N1428 WeakPolarHBondContact CB-OD1 3.48Å; N1259-N1428 PolarHBondContact ND2-O 2.7Å; A1426-N1428 PolarHBondContact O-N 2.99Å; N1428-F1434 WeakPolarHBondContact O-CB 3.34Å; N1428-F1434 VanDerWaalsContact O-CD1 3.26Å; N1428-F1434 WeakPolarHBondContact O-CD1 3.4Å
1429	K	81.2	Confident	84.3	Confident	58 Å²	58	34.8 Å²	34.8	25%	0.252	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-36.4	178.3	-52	-175	-165.3	175.2	0	111.8	W1413 N1416 D1427 N1435	W1413-K1429 WeakPolarHBondContact O-CE 3.42Å; W1413-K1429 PolarHBondContact O-NZ 3.43Å; N1416-K1429 WeakPolarHBondContact ND2-CD 3.43Å; D1427-K1429 PolarHBondContact O-N 3.12Å; D1427-K1429 VanDerWaalsContact O-N 3.11Å; D1427-K1429 WeakPolarHBondContact OD1-CB 3.26Å; D1427-K1429 WeakPolarHBondContact OD1-CG 3.27Å; D1427-K1429 PolarHBondContact OD1-N 3.04Å; K1429-N1435 WeakPolarHBondContact O-CB 3.44Å; K1429-N1435 VanDerWaalsContact O-CG 3.32Å; K1429-N1435 PolarHBondContact O-N 2.96Å; K1429-N1435 PolarHBondContact O-ND2 3.14Å
1430	T	83.7	Confident	82.7	Confident	23 Å²	23	33.7 Å²	33.7	14%	0.141	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.3	-27.3	-175.7	54.9	0	0	0	0	116.1	D1427 N1432 G1433 N1435 H1441	D1427-T1430 PolarHBondContact O-N 3.09Å; D1427-T1430 PolarHBondContact O-OG1 3.24Å; D1427-T1430 VanDerWaalsContact OD2-CB 3.31Å; D1427-T1430 WeakPolarHBondContact OD2-CB 3.23Å; D1427-T1430 WeakPolarHBondContact OD2-CG2 3.48Å; D1427-T1430 PolarHBondContact OD2-N 2.78Å; D1427-T1430 VanDerWaalsContact OD2-N 3.14Å; D1427-T1430 PolarHBondContact OD2-OG1 2.96Å; T1430-N1432 PolarHBondContact O-N 3.18Å; T1430-G1433 PolarHBondContact O-N 2.83Å; T1430-N1435 VanDerWaalsContact CA-ND2 3.3Å; T1430-N1435 WeakPolarHBondContact CA-ND2 3.4Å; T1430-N1435 WeakPolarHBondContact CG2-ND2 3.39Å; T1430-H1441 HydrophobicContact CG2-CB 3.8Å
1431	A	86.1	Confident	80.4	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-56	121.7	-171.9	0	0	0	0	0	113.6	C1257 N1259 V1423 S1425 D1427 G1433 F1434	C1257-A1431 HydrophobicContact CB-CB 4.45Å; C1257-A1431 WeakPolarHBondContact SG-CB 2.99Å; N1259-A1431 PolarHBondContact ND2-O 3.37Å; V1423-A1431 CarbonylContact O-C 3.59Å; V1423-A1431 WeakPolarHBondContact O-CA 3.41Å; S1425-A1431 WeakPolarHBondContact O-CB 3.46Å; D1427-A1431 WeakPolarHBondContact O-CB 3.44Å; D1427-A1431 PolarHBondContact O-N 2.91Å; A1431-G1433 PolarHBondContact O-N 3.22Å; A1431-F1434 PolarHBondContact O-N 3.41Å
1432	N	86.5	Confident	78.3	Confident	30 Å²	30	39 Å²	39	16%	0.16	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	50.7	33.6	-172.8	-66.1	-41.9	0	0	0	113.9	K1250 S1253 S1254 V1423 D1424 T1430	K1250-N1432 WeakPolarHBondContact CE-O 3.28Å; K1250-N1432 PolarHBondContact NZ-O 3.32Å; S1253-N1432 WeakPolarHBondContact OG-CB 3.19Å; S1254-N1432 VanDerWaalsContact CA-ND2 3.33Å; S1254-N1432 WeakPolarHBondContact CA-ND2 3.1Å; S1254-N1432 PolarHBondContact N-ND2 3.41Å; V1423-N1432 PolarHBondContact O-N 2.88Å; D1424-N1432 WeakPolarHBondContact CB-OD1 3.44Å; D1424-N1432 PolarHBondContact OD2-ND2 2.96Å; T1430-N1432 PolarHBondContact O-N 3.18Å
1433	G	83.8	Confident	75.9	Confident	0 Å²	0	36 Å²	36	0%	0	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	68.8	35.2	177.6	0	0	0	0	0	114.3	K1250 S1420 T1430 A1431 N1435 L1436	K1250-G1433 WeakPolarHBondContact CE-O 3.37Å; K1250-G1433 PolarHBondContact NZ-O 3.47Å; S1420-G1433 WeakPolarHBondContact O-CA 3.19Å; S1420-G1433 PolarHBondContact O-N 3.3Å; T1430-G1433 PolarHBondContact O-N 2.83Å; A1431-G1433 PolarHBondContact O-N 3.22Å; G1433-N1435 WeakPolarHBondContact CA-OD1 3.39Å; G1433-N1435 PolarHBondContact O-N 2.81Å; G1433-N1435 PolarHBondContact O-OD1 3.22Å; G1433-L1436 PolarHBondContact O-N 3.21Å
1434	F	87.5	Confident	74.3	Confident	29 Å²	29	33.4 Å²	33.4	13%	0.127	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-54.1	-38.6	179	-165.6	-112.8	0	0	0	112.5	K1250 N1259 A1264 N1428 A1431 L1436	K1250-F1434 WeakPolarHBondContact CG-O 3.42Å; N1259-F1434 HydrophobicContact CB-CD2 4.22Å; N1259-F1434 HydrophobicContact CB-CE2 4.11Å; N1259-F1434 WeakPolarHBondContact ND2-CD2 3.04Å; A1264-F1434 HydrophobicContact CB-CD1 3.93Å; A1264-F1434 HydrophobicContact CB-CD2 3.81Å; A1264-F1434 HydrophobicContact CB-CE1 3.84Å; A1264-F1434 HydrophobicContact CB-CE2 3.73Å; A1264-F1434 HydrophobicContact CB-CG 3.92Å; A1264-F1434 HydrophobicContact CB-CZ 3.75Å; A1264-F1434 WeakPolarHBondContact CB-O 3.47Å; N1428-F1434 WeakPolarHBondContact O-CB 3.34Å; N1428-F1434 VanDerWaalsContact O-CD1 3.26Å; N1428-F1434 WeakPolarHBondContact O-CD1 3.4Å; A1431-F1434 PolarHBondContact O-N 3.41Å; F1434-L1436 PolarHBondContact O-N 3.18Å
1435	N	87	Confident	73.3	Confident	2 Å²	2	30.3 Å²	30.3	1%	0.011	18%	0.178	C	C	.	.	G	3₁₀ helix	trans	-53.3	1.3	168.9	49.3	34.3	0	0	0	119.9	Y1419 K1429 T1430 G1433 H1437 Q1438 G1439 P1440	Y1419-N1435 VanDerWaalsContact CD2-OD1 3.32Å; Y1419-N1435 WeakPolarHBondContact CD2-OD1 3.48Å; K1429-N1435 WeakPolarHBondContact O-CB 3.44Å; K1429-N1435 VanDerWaalsContact O-CG 3.32Å; K1429-N1435 PolarHBondContact O-N 2.96Å; K1429-N1435 PolarHBondContact O-ND2 3.14Å; T1430-N1435 VanDerWaalsContact CA-ND2 3.3Å; T1430-N1435 WeakPolarHBondContact CA-ND2 3.4Å; T1430-N1435 WeakPolarHBondContact CG2-ND2 3.39Å; G1433-N1435 WeakPolarHBondContact CA-OD1 3.39Å; G1433-N1435 PolarHBondContact O-N 2.81Å; G1433-N1435 PolarHBondContact O-OD1 3.22Å; N1435-H1437 PolarHBondContact O-N 2.87Å; N1435-Q1438 PolarHBondContact O-N 3.44Å; N1435-G1439 WeakPolarHBondContact CA-O 3.46Å; N1435-G1439 WeakPolarHBondContact CB-O 3.36Å; N1435-G1439 CarbonylContact O-C 3.42Å; N1435-G1439 PolarHBondContact O-N 3.48Å; N1435-G1439 VanDerWaalsContact O-O 3.13Å; N1435-P1440 VanDerWaalsContact CB-CA 3.5Å; N1435-P1440 HydrophobicContact CB-CB 3.74Å; N1435-P1440 HydrophobicContact CB-CG 3.64Å; N1435-P1440 WeakPolarHBondContact ND2-CA 3.46Å; N1435-P1440 WeakPolarHBondContact ND2-CB 3.41Å
1436	L	87.4	Confident	73.3	Confident	22 Å²	22	28.7 Å²	28.7	12%	0.115	17%	0.167	C	C	.	.	G	3₁₀ helix	trans	-48.1	-35	-172.5	-174.1	70.4	0	0	0	114.8	K1250 Y1419 G1433 F1434 K1445 W1447 F1500	K1250-L1436 HydrophobicContact CB-CB 3.86Å; K1250-L1436 HydrophobicContact CB-CD2 4.08Å; K1250-L1436 HydrophobicContact CD-CB 4.03Å; K1250-L1436 HydrophobicContact CD-CD2 4.09Å; K1250-L1436 HydrophobicContact CG-CB 3.88Å; K1250-L1436 HydrophobicContact CG-CD2 4.49Å; Y1419-L1436 HydrophobicContact CD2-CD1 4.05Å; Y1419-L1436 HydrophobicContact CE1-CD1 4.15Å; Y1419-L1436 HydrophobicContact CE2-CB 4Å; Y1419-L1436 HydrophobicContact CE2-CD1 3.44Å; Y1419-L1436 VanDerWaalsContact CE2-CD1 3.44Å; Y1419-L1436 HydrophobicContact CE2-CG 4.32Å; G1433-L1436 PolarHBondContact O-N 3.21Å; F1434-L1436 PolarHBondContact O-N 3.18Å; L1436-K1445 PolarHBondContact O-NZ 2.94Å; L1436-W1447 HydrophobicContact CD1-CZ2 4.46Å; L1436-W1447 HydrophobicContact CG-CZ2 4.24Å; L1436-W1447 PolarHBondContact O-NE1 3.4Å; L1436-F1500 HydrophobicContact CD1-CE1 4.02Å; L1436-F1500 HydrophobicContact CD1-CZ 3.95Å
1437	H	89.1	Confident	73.6	Confident	1 Å²	1	26 Å²	26	1%	0.005	14%	0.139	C	C	.	.	G	3₁₀ helix	trans	-120.6	6	176.3	-48	-83.4	0	0	0	114.3	W1247 M1248 D1249 R1369 T1407 N1435 W1447	W1247-H1437 AromaticContact CE3-ND1 3.93Å; W1247-H1437 AromaticContact CZ3-CE1 3.89Å; W1247-H1437 AromaticContact CZ3-ND1 3.47Å; W1247-H1437 WeakPolarHBondContact CZ3-ND1 3.49Å; W1247-H1437 PolarHBondContact O-CE1 3.47Å; M1248-H1437 HydrophobicContact CB-CB 3.92Å; M1248-H1437 HydrophobicContact CG-CB 3.88Å; M1248-H1437 HydrophobicContact SD-CB 4.04Å; D1249-H1437 PolarHBondContact N-NE2 2.93Å; R1369-H1437 PolarHBondContact NH1-O 2.94Å; T1407-H1437 VanDerWaalsContact CB-O 3.31Å; T1407-H1437 WeakPolarHBondContact CB-O 3.32Å; T1407-H1437 PolarHBondContact OG1-O 3.31Å; N1435-H1437 PolarHBondContact O-N 2.87Å; H1437-W1447 AromaticContact CE1-CH2 3.93Å; H1437-W1447 AromaticContact CE1-CZ2 3.36Å; H1437-W1447 WeakPolarHBondContact CE1-CZ2 3.25Å; H1437-W1447 AromaticContact ND1-CE2 3.85Å; H1437-W1447 AromaticContact ND1-CZ2 3.56Å; H1437-W1447 AromaticContact ND1-NE1 3.92Å
1438	Q	85	Confident	74	Confident	18 Å²	18	23.8 Å²	23.8	8%	0.084	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100	-4.4	175.5	-57.6	-66.1	22.8	0	0	112.8	A1264 T1265 L1408 Y1415 N1435	A1264-Q1438 PolarHBondContact O-NE2 3.24Å; T1265-Q1438 PolarHBondContact OG1-NE2 3.03Å; T1265-Q1438 VanDerWaalsContact OG1-NE2 3.14Å; L1408-Q1438 HydrophobicContact CD2-CB 4.49Å; Y1415-Q1438 WeakPolarHBondContact CB-O 3.15Å; Y1415-Q1438 WeakPolarHBondContact CD2-O 3.18Å; N1435-Q1438 PolarHBondContact O-N 3.44Å
1439	G	68.5	Low	74.7	Confident	0 Å²	0	20.9 Å²	20.9	0%	0	11%	0.111	C	C	.	.			trans	76.9	150.5	-152.3	0	0	0	0	0	109.9	N1416 N1435	N1416-G1439 VanDerWaalsContact C-C 3.42Å; N1416-G1439 WeakPolarHBondContact CB-O 3.41Å; N1416-G1439 VanDerWaalsContact CG-O 3.28Å; N1416-G1439 CarbonylContact O-C 3.53Å; N1416-G1439 WeakPolarHBondContact O-CA 3.47Å; N1416-G1439 PolarHBondContact OD1-O 3.33Å; N1435-G1439 WeakPolarHBondContact CA-O 3.46Å; N1435-G1439 WeakPolarHBondContact CB-O 3.36Å; N1435-G1439 CarbonylContact O-C 3.42Å; N1435-G1439 PolarHBondContact O-N 3.48Å; N1435-G1439 VanDerWaalsContact O-O 3.13Å
1440	P	51.8	Low	75.4	Confident	1 Å²	1	18.2 Å²	18.2	1%	0.006	10%	0.1	C	C	.	.			trans	-107.9	99.4	168.5	-22.7	35.4	0	0	0	126.9	N1416 G1417 Y1418 Y1419 N1435 T1442 K1445	N1416-P1440 VanDerWaalsContact CA-C 3.48Å; N1416-P1440 VanDerWaalsContact OD1-C 3.32Å; N1416-P1440 WeakPolarHBondContact OD1-CA 3.38Å; G1417-P1440 VanDerWaalsContact C-CB 3.49Å; G1417-P1440 CarbonylContact C-O 3.58Å; G1417-P1440 VanDerWaalsContact CA-O 3.27Å; G1417-P1440 WeakPolarHBondContact CA-O 3.5Å; G1417-P1440 PolarHBondContact N-O 2.96Å; G1417-P1440 VanDerWaalsContact O-CD 3.24Å; G1417-P1440 WeakPolarHBondContact O-CD 3.46Å; Y1418-P1440 VanDerWaalsContact CA-O 3.27Å; Y1418-P1440 WeakPolarHBondContact CA-O 3.48Å; Y1418-P1440 PolarHBondContact N-O 3.48Å; Y1418-P1440 WeakPolarHBondContact O-CB 3.39Å; Y1419-P1440 HydrophobicContact CD2-CG 4.13Å; Y1419-P1440 HydrophobicContact CG-CG 4.4Å; N1435-P1440 VanDerWaalsContact CB-CA 3.5Å; N1435-P1440 HydrophobicContact CB-CB 3.74Å; N1435-P1440 HydrophobicContact CB-CG 3.64Å; N1435-P1440 WeakPolarHBondContact ND2-CA 3.46Å; N1435-P1440 WeakPolarHBondContact ND2-CB 3.41Å; P1440-T1442 PolarHBondContact O-N 2.89Å; P1440-K1445 HydrophobicContact CG-CD 4.04Å
1441	H	38.1	Very low	76	Confident	86 Å²	86	17.1 Å²	17.1	40%	0.398	9%	0.093	S	C	.	.	S	Bend	trans	26.3	-36.1	-168	-129.2	-52.8	0	0	0	126.8	N1416 D1427 T1430	N1416-H1441 VanDerWaalsContact CG-CA 3.46Å; N1416-H1441 VanDerWaalsContact ND2-CA 3.33Å; N1416-H1441 WeakPolarHBondContact ND2-CA 3.41Å; N1416-H1441 PolarHBondContact ND2-N 3.41Å; N1416-H1441 PolarHBondContact OD1-N 2.94Å; D1427-H1441 IonicContact OD2-CD2 3.84Å; D1427-H1441 PolarHBondContact OD2-CD2 2.92Å; T1430-H1441 HydrophobicContact CG2-CB 3.8Å
1442	T	37.7	Very low	76.5	Confident	100 Å²	100	17.1 Å²	17.1	61%	0.613	9%	0.093	S	C	*	.	S	Bend	trans	-117	40.5	-169.9	35.6	0	0	0	0	115.9	Y1418 P1440	Y1418-T1442 VanDerWaalsContact CD2-OG1 3.24Å; Y1418-T1442 WeakPolarHBondContact CD2-OG1 3.32Å; Y1418-T1442 WeakPolarHBondContact CE2-O 3.4Å; P1440-T1442 PolarHBondContact O-N 2.89Å
1443	G	32.9	Very low	77	Confident	21 Å²	21	16 Å²	16	22%	0.216	9%	0.086	C	C	.	.	S	Bend	trans	84.6	136.8	176.3	0	0	0	0	0	113.1	G1417 K1503	G1417-G1443 VanDerWaalsContact CA-C 3.46Å; G1417-G1443 VanDerWaalsContact CA-O 3.22Å; G1417-G1443 WeakPolarHBondContact CA-O 3.38Å; G1443-K1503 VanDerWaalsContact C-CG 3.47Å; G1443-K1503 WeakPolarHBondContact O-CB 3.41Å; G1443-K1503 WeakPolarHBondContact O-CD 3.38Å; G1443-K1503 WeakPolarHBondContact O-CG 3.46Å
1444	L	50.9	Low	77.7	Confident	16 Å²	16	16 Å²	16	8%	0.084	9%	0.086	C	C	.	.			trans	42.7	127.7	178.2	-17	-178.4	0	0	0	121.4	K1406 E1410 Y1415 G1417 N1502 K1503 D1504	K1406-L1444 HydrophobicContact CD-CD2 4.28Å; E1410-L1444 WeakPolarHBondContact OE2-CD2 3.46Å; Y1415-L1444 HydrophobicContact CE1-CD2 4.2Å; Y1415-L1444 WeakPolarHBondContact OH-CA 3.29Å; Y1415-L1444 VanDerWaalsContact OH-CD2 3.25Å; Y1415-L1444 WeakPolarHBondContact OH-CD2 3.42Å; G1417-L1444 CarbonylContact C-O 3.58Å; G1417-L1444 WeakPolarHBondContact CA-O 3.48Å; G1417-L1444 VanDerWaalsContact O-O 3.08Å; L1444-N1502 CarbonylContact O-C 3.54Å; L1444-N1502 VanDerWaalsContact O-C 3.29Å; L1444-K1503 HydrophobicContact CB-CB 4.41Å; L1444-K1503 HydrophobicContact CB-CG 3.68Å; L1444-K1503 HydrophobicContact CD1-CG 4.29Å; L1444-K1503 HydrophobicContact CG-CD 4.38Å; L1444-K1503 HydrophobicContact CG-CG 3.69Å; L1444-K1503 WeakPolarHBondContact O-CA 3.35Å; L1444-K1503 PolarHBondContact O-N 3.26Å; L1444-D1504 WeakPolarHBondContact CD1-OD1 3.39Å
1445	K	65.3	Low	78.1	Confident	0 Å²	0	14.6 Å²	14.6	0%	0	8%	0.08	C	C	.	.			trans	-135.3	144.1	161.8	-166.7	-168.5	170.5	176.3	0	107.3	K1406 L1436 P1440 F1500 T1501	K1406-K1445 WeakPolarHBondContact CA-O 3.32Å; L1436-K1445 PolarHBondContact O-NZ 2.94Å; P1440-K1445 HydrophobicContact CG-CD 4.04Å; K1445-F1500 VanDerWaalsContact CE-CG 3.41Å; K1445-T1501 WeakPolarHBondContact CG-O 3.49Å
1446	E	84.4	Confident	78.6	Confident	0 Å²	0	15.4 Å²	15.4	0%	0	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	127.1	-171.8	-48.9	171.9	-176.2	0	0	110.5	G1401 H1402 L1403 G1404 F1500 T1501 D1504 G1505	G1401-E1446 VanDerWaalsContact CA-CD 3.42Å; G1401-E1446 VanDerWaalsContact CA-OE1 3.24Å; G1401-E1446 WeakPolarHBondContact CA-OE1 3.36Å; H1402-E1446 PolarHBondContact N-OE1 2.9Å; H1402-E1446 PolarHBondContact N-OE2 3.36Å; L1403-E1446 PolarHBondContact N-OE2 2.65Å; G1404-E1446 PolarHBondContact N-OE2 3.15Å; E1446-F1500 CarbonylContact O-C 3.42Å; E1446-F1500 WeakPolarHBondContact O-CA 3.12Å; E1446-F1500 WeakPolarHBondContact O-CB 3.37Å; E1446-T1501 WeakPolarHBondContact CB-OG1 3.47Å; E1446-T1501 PolarHBondContact N-O 3.18Å; E1446-T1501 VanDerWaalsContact N-O 3.13Å; E1446-T1501 PolarHBondContact O-N 3.26Å; E1446-T1501 PolarHBondContact OE2-OG1 3.02Å; E1446-D1504 WeakPolarHBondContact OE1-CA 3.49Å; E1446-G1505 PolarHBondContact OE1-N 3.21Å
1447	W	92.1	Very high	79	Confident	25 Å²	25	14.4 Å²	14.4	10%	0.095	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	121.4	171.8	-82.7	79.8	0	0	0	109.4	W1247 G1404 M1405 T1407 L1436 H1437 W1449 L1450 F1500	W1247-W1447 HydrophobicContact CH2-CD2 4.23Å; W1247-W1447 HydrophobicContact CH2-CG 4.2Å; W1247-W1447 AromaticContact CZ3-CD2 3.79Å; W1247-W1447 HydrophobicContact CZ3-CD2 3.79Å; W1247-W1447 AromaticContact CZ3-CE2 3.84Å; W1247-W1447 HydrophobicContact CZ3-CE3 4.02Å; W1247-W1447 HydrophobicContact CZ3-CG 4.24Å; W1247-W1447 HydrophobicContact CZ3-CH2 4.28Å; W1247-W1447 HydrophobicContact CZ3-CZ2 4.09Å; W1247-W1447 HydrophobicContact CZ3-CZ3 4.25Å; G1404-W1447 WeakPolarHBondContact CA-O 3.2Å; M1405-W1447 PolarHBondContact N-O 3.44Å; M1405-W1447 PolarHBondContact O-N 3.11Å; T1407-W1447 HydrophobicContact CG2-CB 4.26Å; T1407-W1447 HydrophobicContact CG2-CG 3.94Å; L1436-W1447 HydrophobicContact CD1-CZ2 4.46Å; L1436-W1447 HydrophobicContact CG-CZ2 4.24Å; L1436-W1447 PolarHBondContact O-NE1 3.4Å; H1437-W1447 AromaticContact CE1-CH2 3.93Å; H1437-W1447 AromaticContact CE1-CZ2 3.36Å; H1437-W1447 WeakPolarHBondContact CE1-CZ2 3.25Å; H1437-W1447 AromaticContact ND1-CE2 3.85Å; H1437-W1447 AromaticContact ND1-CZ2 3.56Å; H1437-W1447 AromaticContact ND1-NE1 3.92Å; W1447-W1449 AromaticContact CE3-CD1 3.69Å; W1447-W1449 AromaticContact CE3-NE1 3.5Å; W1447-L1450 HydrophobicContact CB-CD1 3.76Å; W1447-L1450 HydrophobicContact CB-CG 4.25Å; W1447-F1500 HydrophobicContact CD2-CB 4.14Å; W1447-F1500 HydrophobicContact CD2-CD1 4.23Å; W1447-F1500 AromaticContact CE2-CD1 3.99Å; W1447-F1500 HydrophobicContact CE3-CD1 4.27Å; W1447-F1500 HydrophobicContact CG-CB 4.16Å; W1447-F1500 AromaticContact CH2-CD1 3.99Å; W1447-F1500 HydrophobicContact CH2-CD1 3.99Å; W1447-F1500 HydrophobicContact CH2-CE1 4.33Å; W1447-F1500 AromaticContact CZ2-CD1 3.89Å; W1447-F1500 HydrophobicContact CZ2-CD1 3.89Å; W1447-F1500 HydrophobicContact CZ2-CE1 4.29Å; W1447-F1500 HydrophobicContact CZ3-CD1 4.17Å
1448	V	94.6	Very high	79.3	Confident	0 Å²	0	15.8 Å²	15.8	0%	0	8%	0.084	C	C	.	.	S	Bend	trans	-73	-41.4	-166.9	177.6	0	0	0	0	112.3	L1403 L1450 M1451 L1497 P1498 A1499	L1403-V1448 HydrophobicContact CB-CG2 4.29Å; L1403-V1448 WeakPolarHBondContact O-CG1 3.37Å; V1448-L1450 PolarHBondContact O-N 2.95Å; V1448-L1450 VanDerWaalsContact O-N 3.15Å; V1448-M1451 WeakPolarHBondContact O-CB 3.48Å; V1448-M1451 PolarHBondContact O-N 2.89Å; V1448-L1497 HydrophobicContact CG1-CB 4.23Å; V1448-L1497 HydrophobicContact CG1-CD1 4.19Å; V1448-P1498 WeakPolarHBondContact CB-O 3.43Å; V1448-P1498 HydrophobicContact CG2-CG 4.17Å; V1448-P1498 WeakPolarHBondContact CG2-O 3.42Å; V1448-A1499 PolarHBondContact N-O 3.25Å
1449	W	95.7	Very high	79.7	Confident	6 Å²	6	15.1 Å²	15.1	2%	0.023	8%	0.081	C	C	.	.	H	α-helix	trans	-59.1	-30.3	179.9	75.5	-84.2	0	0	0	114	I1058 W1247 I1374 W1447 M1451 G1452 Y1453 T1517 C1521	I1058-W1449 HydrophobicContact CD1-CH2 4.29Å; I1058-W1449 HydrophobicContact CD1-CZ3 4.35Å; I1058-W1449 HydrophobicContact CG2-CE3 4.01Å; I1058-W1449 HydrophobicContact CG2-CZ3 4.2Å; W1247-W1449 HydrophobicContact CD2-CH2 4.42Å; W1247-W1449 AromaticContact CD2-CZ2 3.66Å; W1247-W1449 HydrophobicContact CD2-CZ2 3.66Å; W1247-W1449 AromaticContact CE2-CZ2 3.69Å; W1247-W1449 AromaticContact CE3-CZ2 3.88Å; W1247-W1449 HydrophobicContact CE3-CZ2 3.88Å; W1247-W1449 HydrophobicContact CG-CH2 4.49Å; W1247-W1449 HydrophobicContact CG-CZ2 4.11Å; W1247-W1449 HydrophobicContact CH2-CZ2 4.13Å; W1247-W1449 AromaticContact CZ2-CZ2 3.91Å; W1247-W1449 HydrophobicContact CZ2-CZ2 3.91Å; W1247-W1449 HydrophobicContact CZ3-CZ2 4.12Å; W1247-W1449 AromaticContact CZ3-NE1 3.99Å; I1374-W1449 HydrophobicContact CD1-CH2 3.59Å; I1374-W1449 HydrophobicContact CD1-CZ3 4.01Å; I1374-W1449 HydrophobicContact CG1-CH2 4.46Å; I1374-W1449 HydrophobicContact CG1-CZ3 4.42Å; W1447-W1449 AromaticContact CE3-CD1 3.69Å; W1447-W1449 AromaticContact CE3-NE1 3.5Å; W1449-M1451 PolarHBondContact O-N 2.86Å; W1449-G1452 PolarHBondContact O-N 3.08Å; W1449-G1452 VanDerWaalsContact O-N 3.15Å; W1449-Y1453 AromaticContact CE3-CD2 3.74Å; W1449-Y1453 HydrophobicContact CE3-CD2 3.74Å; W1449-Y1453 AromaticContact CE3-CE2 3.62Å; W1449-Y1453 HydrophobicContact CE3-CE2 3.62Å; W1449-Y1453 AromaticContact CZ3-CD2 3.73Å; W1449-Y1453 HydrophobicContact CZ3-CD2 3.73Å; W1449-Y1453 AromaticContact CZ3-CE2 3.48Å; W1449-Y1453 HydrophobicContact CZ3-CE2 3.48Å; W1449-Y1453 VanDerWaalsContact CZ3-CE2 3.48Å; W1449-T1517 WeakPolarHBondContact CB-O 3.26Å; W1449-C1521 HydrophobicContact CB-CB 4.25Å; W1449-C1521 WeakPolarHBondContact O-CB 3.24Å
1450	L	96.3	Very high	80.9	Confident	2 Å²	2	18.4 Å²	18.4	1%	0.01	10%	0.096	C	C	.	.	H	α-helix	trans	-66.2	-23.9	175.2	-66.8	172.1	0	0	0	112.7	W1247 P1370 I1374 M1405 T1407 W1447 V1448 G1452 Y1453 F1454	W1247-L1450 HydrophobicContact CH2-CD1 3.62Å; W1247-L1450 HydrophobicContact CH2-CG 4.38Å; W1247-L1450 HydrophobicContact CZ2-CD1 3.68Å; W1247-L1450 HydrophobicContact CZ2-CD2 4.06Å; W1247-L1450 HydrophobicContact CZ2-CG 4.32Å; P1370-L1450 HydrophobicContact CB-CD1 4.44Å; P1370-L1450 HydrophobicContact CG-CD1 3.64Å; I1374-L1450 HydrophobicContact CD1-CD2 3.79Å; I1374-L1450 HydrophobicContact CG1-CD2 4.13Å; M1405-L1450 HydrophobicContact CB-CB 3.77Å; M1405-L1450 HydrophobicContact CB-CD1 4.44Å; M1405-L1450 HydrophobicContact CG-CB 3.88Å; T1407-L1450 HydrophobicContact CG2-CD1 3.89Å; W1447-L1450 HydrophobicContact CB-CD1 3.76Å; W1447-L1450 HydrophobicContact CB-CG 4.25Å; V1448-L1450 PolarHBondContact O-N 2.95Å; V1448-L1450 VanDerWaalsContact O-N 3.15Å; L1450-G1452 VanDerWaalsContact C-N 3.28Å; L1450-G1452 PolarHBondContact O-N 3.11Å; L1450-Y1453 PolarHBondContact O-N 3.28Å; L1450-F1454 PolarHBondContact O-N 3.35Å
1451	M	95.9	Very high	82.7	Confident	0 Å²	0	19.5 Å²	19.5	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-60.7	-40.9	172.6	-171.8	68.4	80	0	0	110.8	L1400 M1405 V1448 W1449 Y1453 F1454 L1455 I1481 I1522	L1400-M1451 HydrophobicContact CD1-CE 3.52Å; L1400-M1451 HydrophobicContact CD1-SD 3.58Å; L1400-M1451 VanDerWaalsContact CD1-SD 3.58Å; M1405-M1451 HydrophobicContact SD-CE 4.43Å; M1405-M1451 HydrophobicContact SD-SD 3.99Å; V1448-M1451 WeakPolarHBondContact O-CB 3.48Å; V1448-M1451 PolarHBondContact O-N 2.89Å; W1449-M1451 PolarHBondContact O-N 2.86Å; M1451-Y1453 VanDerWaalsContact C-N 3.3Å; M1451-Y1453 PolarHBondContact O-N 2.94Å; M1451-F1454 PolarHBondContact O-N 3.18Å; M1451-F1454 VanDerWaalsContact O-N 3.17Å; M1451-F1454 HydrophobicContact SD-CD1 3.91Å; M1451-L1455 HydrophobicContact CG-CD1 3.97Å; M1451-L1455 HydrophobicContact CG-CG 4.15Å; M1451-L1455 VanDerWaalsContact O-CG 3.28Å; M1451-L1455 WeakPolarHBondContact O-CG 3.33Å; M1451-L1455 PolarHBondContact O-N 2.88Å; M1451-L1455 HydrophobicContact SD-CG 4.43Å; M1451-I1481 HydrophobicContact CE-CG2 3.82Å; M1451-I1481 HydrophobicContact CG-CG2 4.12Å; M1451-I1481 HydrophobicContact SD-CG2 3.54Å; M1451-I1481 VanDerWaalsContact SD-CG2 3.54Å; M1451-I1522 HydrophobicContact CB-CD1 4.04Å; M1451-I1522 HydrophobicContact CG-CD1 4.07Å
1452	G	96.3	Very high	85.2	Confident	0 Å²	0	15.5 Å²	15.5	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-56.4	-44.5	175.8	0	0	0	0	0	112.1	W1449 L1450 R1456 C1521	W1449-G1452 PolarHBondContact O-N 3.08Å; W1449-G1452 VanDerWaalsContact O-N 3.15Å; L1450-G1452 VanDerWaalsContact C-N 3.28Å; L1450-G1452 PolarHBondContact O-N 3.11Å; G1452-R1456 WeakPolarHBondContact O-CB 3.48Å; G1452-R1456 WeakPolarHBondContact O-CD 3.44Å; G1452-R1456 WeakPolarHBondContact O-CG 3.23Å; G1452-R1456 PolarHBondContact O-N 3.45Å; G1452-R1456 VanDerWaalsContact O-N 3.15Å; G1452-C1521 VanDerWaalsContact CA-O 3.26Å; G1452-C1521 WeakPolarHBondContact CA-O 3.34Å
1453	Y	97.5	Very high	87.6	Confident	7 Å²	7	12.7 Å²	12.7	3%	0.027	6%	0.064	C	C	.	.	H	α-helix	trans	-68.6	-39.4	175.4	-76.5	-80.4	0	0	0	113.3	I1374 V1377 I1378 W1449 L1450 M1451 R1456 A1457	I1374-Y1453 HydrophobicContact CB-CD1 4.22Å; I1374-Y1453 HydrophobicContact CB-CG 4.43Å; I1374-Y1453 HydrophobicContact CG1-CD1 4.29Å; I1374-Y1453 HydrophobicContact CG1-CD2 4.24Å; I1374-Y1453 HydrophobicContact CG1-CG 4Å; I1374-Y1453 HydrophobicContact CG2-CD1 4.16Å; I1374-Y1453 HydrophobicContact CG2-CE1 3.94Å; V1377-Y1453 HydrophobicContact CB-CD1 3.85Å; V1377-Y1453 HydrophobicContact CB-CE1 4.3Å; V1377-Y1453 HydrophobicContact CG1-CD1 3.96Å; V1377-Y1453 HydrophobicContact CG1-CE1 4.09Å; V1377-Y1453 HydrophobicContact CG2-CD1 4.05Å; V1377-Y1453 WeakPolarHBondContact CG2-O 3.28Å; I1378-Y1453 HydrophobicContact CD1-CE1 4.18Å; I1378-Y1453 HydrophobicContact CG1-CE1 4.28Å; W1449-Y1453 AromaticContact CE3-CD2 3.74Å; W1449-Y1453 HydrophobicContact CE3-CD2 3.74Å; W1449-Y1453 AromaticContact CE3-CE2 3.62Å; W1449-Y1453 HydrophobicContact CE3-CE2 3.62Å; W1449-Y1453 AromaticContact CZ3-CD2 3.73Å; W1449-Y1453 HydrophobicContact CZ3-CD2 3.73Å; W1449-Y1453 AromaticContact CZ3-CE2 3.48Å; W1449-Y1453 HydrophobicContact CZ3-CE2 3.48Å; W1449-Y1453 VanDerWaalsContact CZ3-CE2 3.48Å; L1450-Y1453 PolarHBondContact O-N 3.28Å; M1451-Y1453 VanDerWaalsContact C-N 3.3Å; M1451-Y1453 PolarHBondContact O-N 2.94Å; Y1453-R1456 PolarHBondContact O-N 2.77Å; Y1453-A1457 WeakPolarHBondContact O-CB 3.44Å; Y1453-A1457 PolarHBondContact O-N 2.82Å
1454	F	97.5	Very high	90.2	Very high	0 Å²	0	13.9 Å²	13.9	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-59.1	-51.2	174.1	168.9	-107.9	0	0	0	112.3	L1373 V1392 E1396 L1400 M1405 L1450 M1451 R1456 A1457 K1458 I1481	L1373-F1454 HydrophobicContact CD1-CB 3.95Å; L1373-F1454 HydrophobicContact CD1-CD2 4.01Å; L1373-F1454 HydrophobicContact CD1-CG 4.46Å; L1373-F1454 HydrophobicContact CD2-CD2 4.45Å; V1392-F1454 HydrophobicContact CG1-CE2 4Å; E1396-F1454 HydrophobicContact CB-CE2 3.88Å; E1396-F1454 HydrophobicContact CB-CZ 3.7Å; E1396-F1454 HydrophobicContact CG-CZ 3.87Å; L1400-F1454 HydrophobicContact CD1-CD1 4.13Å; L1400-F1454 HydrophobicContact CD1-CE1 3.95Å; M1405-F1454 HydrophobicContact CE-CB 4.01Å; M1405-F1454 HydrophobicContact CE-CD1 4.47Å; M1405-F1454 HydrophobicContact CE-CD2 3.83Å; M1405-F1454 HydrophobicContact CE-CE2 4.49Å; M1405-F1454 HydrophobicContact CE-CG 3.82Å; M1405-F1454 HydrophobicContact CG-CB 4.05Å; M1405-F1454 HydrophobicContact SD-CB 3.73Å; M1405-F1454 HydrophobicContact SD-CD1 3.99Å; M1405-F1454 HydrophobicContact SD-CD2 4.37Å; M1405-F1454 HydrophobicContact SD-CG 3.75Å; L1450-F1454 PolarHBondContact O-N 3.35Å; M1451-F1454 PolarHBondContact O-N 3.18Å; M1451-F1454 VanDerWaalsContact O-N 3.17Å; M1451-F1454 HydrophobicContact SD-CD1 3.91Å; F1454-R1456 VanDerWaalsContact C-N 3.31Å; F1454-R1456 PolarHBondContact O-N 2.88Å; F1454-A1457 PolarHBondContact O-N 2.9Å; F1454-K1458 HydrophobicContact CZ-CD 4.06Å; F1454-K1458 WeakPolarHBondContact O-CB 3.2Å; F1454-K1458 PolarHBondContact O-N 3.2Å; F1454-I1481 HydrophobicContact CE1-CD1 3.89Å
1455	L	96.8	Very high	91.8	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-61	-42.2	-178.7	-65.3	173.8	0	0	0	111.1	M1451 K1458 M1459 V1478 I1481 L1482 I1522 A1525	M1451-L1455 HydrophobicContact CG-CD1 3.97Å; M1451-L1455 HydrophobicContact CG-CG 4.15Å; M1451-L1455 VanDerWaalsContact O-CG 3.28Å; M1451-L1455 WeakPolarHBondContact O-CG 3.33Å; M1451-L1455 PolarHBondContact O-N 2.88Å; M1451-L1455 HydrophobicContact SD-CG 4.43Å; L1455-K1458 PolarHBondContact O-N 3.44Å; L1455-M1459 WeakPolarHBondContact O-CG 3.22Å; L1455-M1459 PolarHBondContact O-N 3.05Å; L1455-V1478 HydrophobicContact CD2-CB 4.29Å; L1455-V1478 HydrophobicContact CD2-CG1 4.21Å; L1455-V1478 HydrophobicContact CD2-CG2 3.97Å; L1455-I1481 HydrophobicContact CD2-CB 4.07Å; L1455-I1481 HydrophobicContact CD2-CD1 3.97Å; L1455-I1481 HydrophobicContact CD2-CG2 4Å; L1455-L1482 HydrophobicContact CD1-CD2 3.72Å; L1455-L1482 HydrophobicContact CD1-CG 3.94Å; L1455-I1522 HydrophobicContact CD1-CD1 4.43Å; L1455-A1525 HydrophobicContact CB-CB 4.08Å; L1455-A1525 HydrophobicContact CD1-CB 4.23Å
1456	R	96.8	Very high	92.4	Very high	19 Å²	19	22.4 Å²	22.4	7%	0.072	12%	0.119	C	C	.	.	H	α-helix	trans	-65.5	-47.3	177.4	-67.8	167.8	72.6	-164.5	3.4	112	V1377 G1452 Y1453 F1454 K1458 M1459 Q1460 E1524 A1525 D1528	V1377-R1456 HydrophobicContact CG1-CB 4.17Å; V1377-R1456 HydrophobicContact CG2-CB 3.64Å; G1452-R1456 WeakPolarHBondContact O-CB 3.48Å; G1452-R1456 WeakPolarHBondContact O-CD 3.44Å; G1452-R1456 WeakPolarHBondContact O-CG 3.23Å; G1452-R1456 PolarHBondContact O-N 3.45Å; G1452-R1456 VanDerWaalsContact O-N 3.15Å; Y1453-R1456 PolarHBondContact O-N 2.77Å; F1454-R1456 VanDerWaalsContact C-N 3.31Å; F1454-R1456 PolarHBondContact O-N 2.88Å; R1456-K1458 VanDerWaalsContact C-N 3.32Å; R1456-K1458 PolarHBondContact O-N 3.43Å; R1456-M1459 HydrophobicContact CG-CE 4.37Å; R1456-M1459 PolarHBondContact O-N 3.16Å; R1456-Q1460 VanDerWaalsContact O-CB 3.23Å; R1456-Q1460 WeakPolarHBondContact O-CB 3.21Å; R1456-Q1460 PolarHBondContact O-N 3.35Å; R1456-E1524 IonicContact CZ-OE2 2.69Å; R1456-E1524 IonicContact NH1-OE2 3.89Å; R1456-E1524 PolarHBondContact NH1-OE2 3.31Å; R1456-E1524 IonicContact NH2-OE2 3.46Å; R1456-A1525 HydrophobicContact CG-CB 3.94Å; R1456-D1528 HydrophobicContact CG-CB 4.5Å; R1456-D1528 IonicContact CZ-OD2 2.73Å; R1456-D1528 IonicContact NE-OD2 2.65Å; R1456-D1528 PolarHBondContact NE-OD2 3.25Å; R1456-D1528 IonicContact NH2-OD2 3.2Å; R1456-D1528 PolarHBondContact NH2-OD2 2.91Å; R1456-D1528 VanDerWaalsContact NH2-OD2 3.13Å
1457	A	96.3	Very high	92.4	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-58.5	-44.1	175.7	0	0	0	0	0	111.5	L1373 M1376 V1377 V1392 Y1453 F1454 Q1460 I1461	L1373-A1457 HydrophobicContact CB-CB 4.48Å; L1373-A1457 HydrophobicContact CD2-CB 4.24Å; M1376-A1457 HydrophobicContact CB-CB 4.21Å; M1376-A1457 HydrophobicContact SD-CB 4.49Å; V1377-A1457 HydrophobicContact CG2-CB 3.89Å; V1392-A1457 HydrophobicContact CG2-CB 4.39Å; Y1453-A1457 WeakPolarHBondContact O-CB 3.44Å; Y1453-A1457 PolarHBondContact O-N 2.82Å; F1454-A1457 PolarHBondContact O-N 2.9Å; A1457-Q1460 PolarHBondContact O-N 3.22Å; A1457-I1461 WeakPolarHBondContact O-CG1 3.41Å; A1457-I1461 PolarHBondContact O-N 3.12Å
1458	K	95.1	Very high	92.1	Very high	30 Å²	30	29.1 Å²	29.1	13%	0.13	16%	0.157	C	C	.	.	H	α-helix	trans	-63.5	-45.7	179.1	-165.6	-173.9	174	71.5	0	112.1	V1392 E1396 F1454 L1455 R1456 A1462 T1474	V1392-K1458 HydrophobicContact CG1-CB 3.96Å; V1392-K1458 HydrophobicContact CG1-CG 4.07Å; E1396-K1458 VanDerWaalsContact OE2-CE 3.32Å; E1396-K1458 WeakPolarHBondContact OE2-CE 3.17Å; E1396-K1458 IonicContact OE2-NZ 3.66Å; E1396-K1458 PolarHBondContact OE2-NZ 3.07Å; F1454-K1458 HydrophobicContact CZ-CD 4.06Å; F1454-K1458 WeakPolarHBondContact O-CB 3.2Å; F1454-K1458 PolarHBondContact O-N 3.2Å; L1455-K1458 PolarHBondContact O-N 3.44Å; R1456-K1458 VanDerWaalsContact C-N 3.32Å; R1456-K1458 PolarHBondContact O-N 3.43Å; K1458-A1462 WeakPolarHBondContact O-CB 3.44Å; K1458-A1462 PolarHBondContact O-N 2.76Å; K1458-T1474 HydrophobicContact CD-CG2 4.16Å; K1458-T1474 HydrophobicContact CG-CG2 3.88Å
1459	M	93.6	Very high	91.7	Very high	5 Å²	5	36.3 Å²	36.3	3%	0.025	19%	0.19	C	C	.	.	H	α-helix	trans	-61.8	-46.8	174.9	-70.9	-175.2	-63.3	0	0	111.7	L1455 R1456 I1461 A1462 M1463 T1474 V1478 D1528 L1529	L1455-M1459 WeakPolarHBondContact O-CG 3.22Å; L1455-M1459 PolarHBondContact O-N 3.05Å; R1456-M1459 HydrophobicContact CG-CE 4.37Å; R1456-M1459 PolarHBondContact O-N 3.16Å; M1459-I1461 PolarHBondContact O-N 2.71Å; M1459-A1462 WeakPolarHBondContact O-CB 3.42Å; M1459-A1462 PolarHBondContact O-N 3.23Å; M1459-M1463 WeakPolarHBondContact O-CG 3.25Å; M1459-M1463 PolarHBondContact O-N 2.81Å; M1459-T1474 HydrophobicContact CG-CG2 4.3Å; M1459-V1478 HydrophobicContact CG-CG2 3.84Å; M1459-V1478 HydrophobicContact SD-CG1 4.18Å; M1459-V1478 HydrophobicContact SD-CG2 4.29Å; M1459-D1528 HydrophobicContact CE-CB 4.19Å; M1459-L1529 HydrophobicContact CE-CB 4.26Å; M1459-L1529 HydrophobicContact SD-CB 3.8Å; M1459-L1529 HydrophobicContact SD-CD1 3.81Å; M1459-L1529 HydrophobicContact SD-CG 4.39Å
1460	Q	92.4	Very high	91.3	Very high	69 Å²	69	39.5 Å²	39.5	32%	0.322	21%	0.207	S	C	.	.	H	α-helix	trans	-62.9	-42.3	-176.7	-175.1	169.9	24.2	0	0	113	M1376 P1380 R1456 A1457 A1464	M1376-Q1460 PolarHBondContact O-OE1 3.22Å; P1380-Q1460 VanDerWaalsContact CG-NE2 3.27Å; R1456-Q1460 VanDerWaalsContact O-CB 3.23Å; R1456-Q1460 WeakPolarHBondContact O-CB 3.21Å; R1456-Q1460 PolarHBondContact O-N 3.35Å; A1457-Q1460 PolarHBondContact O-N 3.22Å; Q1460-A1464 PolarHBondContact O-N 2.78Å; Q1460-A1464 VanDerWaalsContact O-N 3.13Å
1461	I	91.3	Very high	91	Very high	23 Å²	23	40 Å²	40	12%	0.118	21%	0.209	C	C	.	.	H	α-helix	trans	-67.8	-42.8	174.4	-67.6	167	0	0	0	110.6	M1376 A1388 T1389 V1392 A1457 M1459 M1463 A1464 T1465	M1376-I1461 HydrophobicContact SD-CD1 4.05Å; A1388-I1461 HydrophobicContact CB-CD1 3.76Å; A1388-I1461 HydrophobicContact CB-CG1 4.23Å; T1389-I1461 VanDerWaalsContact OG1-CG2 3.24Å; T1389-I1461 WeakPolarHBondContact OG1-CG2 3.43Å; V1392-I1461 HydrophobicContact CB-CD1 4.03Å; V1392-I1461 HydrophobicContact CG2-CD1 3.35Å; A1457-I1461 WeakPolarHBondContact O-CG1 3.41Å; A1457-I1461 PolarHBondContact O-N 3.12Å; M1459-I1461 PolarHBondContact O-N 2.71Å; I1461-M1463 VanDerWaalsContact C-N 3.33Å; I1461-M1463 PolarHBondContact O-N 3.01Å; I1461-A1464 WeakPolarHBondContact O-CA 3.32Å; I1461-A1464 WeakPolarHBondContact O-CB 3.43Å; I1461-A1464 PolarHBondContact O-N 3.41Å; I1461-T1465 PolarHBondContact O-N 3.47Å
1462	A	90.2	Very high	90.5	Very high	3 Å²	3	45.4 Å²	45.4	3%	0.025	24%	0.235	C	C	.	.	H	α-helix	trans	-56	-48.7	176.6	0	0	0	0	0	111.2	K1458 M1459 A1464 T1465 I1470 H1471 T1474	K1458-A1462 WeakPolarHBondContact O-CB 3.44Å; K1458-A1462 PolarHBondContact O-N 2.76Å; M1459-A1462 WeakPolarHBondContact O-CB 3.42Å; M1459-A1462 PolarHBondContact O-N 3.23Å; A1462-A1464 VanDerWaalsContact C-N 3.26Å; A1462-A1464 PolarHBondContact O-N 3.26Å; A1462-T1465 PolarHBondContact O-N 3.1Å; A1462-T1465 PolarHBondContact O-OG1 3.12Å; A1462-I1470 HydrophobicContact CB-CG2 4.15Å; A1462-H1471 PolarHBondContact O-CD2 3.44Å; A1462-H1471 PolarHBondContact O-NE2 2.88Å; A1462-H1471 VanDerWaalsContact O-NE2 3.1Å; A1462-T1474 HydrophobicContact CB-CG2 3.82Å; A1462-T1474 WeakPolarHBondContact CB-OG1 3.35Å
1463	M	87.3	Confident	90.2	Very high	41 Å²	41	48.3 Å²	48.3	20%	0.202	26%	0.259	C	S	.	.	H	α-helix	trans	-59.4	-35	175.7	-63.7	-55.4	123.4	0	0	112.9	M1459 I1461 T1465 N1466 H1471 V1532	M1459-M1463 WeakPolarHBondContact O-CG 3.25Å; M1459-M1463 PolarHBondContact O-N 2.81Å; I1461-M1463 VanDerWaalsContact C-N 3.33Å; I1461-M1463 PolarHBondContact O-N 3.01Å; M1463-T1465 PolarHBondContact O-N 3.5Å; M1463-N1466 PolarHBondContact O-N 3.48Å; M1463-N1466 PolarHBondContact O-OD1 3.05Å; M1463-H1471 HydrophobicContact CE-CB 3.76Å; M1463-V1532 HydrophobicContact CE-CG1 3.6Å; M1463-V1532 HydrophobicContact CE-CG2 4.47Å; M1463-V1532 HydrophobicContact CG-CG2 4.23Å; M1463-V1532 HydrophobicContact SD-CG1 3.68Å; M1463-V1532 HydrophobicContact SD-CG2 4.39Å
1464	A	87.3	Confident	90	Very high	46 Å²	46	48.5 Å²	48.5	38%	0.38	26%	0.26	S	S	.	.	H	α-helix	trans	-69.7	-14.2	176.2	0	0	0	0	0	114	I1385 Q1460 I1461 A1462	I1385-A1464 HydrophobicContact CD1-CB 4.16Å; I1385-A1464 HydrophobicContact CG1-CB 4.48Å; I1385-A1464 HydrophobicContact CG2-CB 4.34Å; Q1460-A1464 PolarHBondContact O-N 2.78Å; Q1460-A1464 VanDerWaalsContact O-N 3.13Å; I1461-A1464 WeakPolarHBondContact O-CA 3.32Å; I1461-A1464 WeakPolarHBondContact O-CB 3.43Å; I1461-A1464 PolarHBondContact O-N 3.41Å; A1462-A1464 VanDerWaalsContact C-N 3.26Å; A1462-A1464 PolarHBondContact O-N 3.26Å
1465	T	84.3	Confident	89.6	Confident	49 Å²	49	49.1 Å²	49.1	30%	0.301	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-11.6	176.1	67	0	0	0	0	114.4	I1461 A1462 M1463 N1467	I1461-T1465 PolarHBondContact O-N 3.47Å; A1462-T1465 PolarHBondContact O-N 3.1Å; A1462-T1465 PolarHBondContact O-OG1 3.12Å; M1463-T1465 PolarHBondContact O-N 3.5Å; T1465-N1467 PolarHBondContact O-N 2.99Å; T1465-N1467 VanDerWaalsContact O-N 3.16Å
1466	N	79.3	Confident	89.3	Confident	145 Å²	145	51.1 Å²	51.1	78%	0.775	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.3	31.5	-176.8	-68.1	-32.3	0	0	0	114.4	M1463	M1463-N1466 PolarHBondContact O-N 3.48Å; M1463-N1466 PolarHBondContact O-OD1 3.05Å
1467	N	84.6	Confident	89.2	Confident	64 Å²	64	54.3 Å²	54.3	34%	0.342	29%	0.289	S	S	.	.			trans	-117	108.6	-179.4	-179.2	-22.1	0	0	0	110.8	T1465 E1469 I1470 H1471	T1465-N1467 PolarHBondContact O-N 2.99Å; T1465-N1467 VanDerWaalsContact O-N 3.16Å; N1467-E1469 VanDerWaalsContact C-N 3.26Å; N1467-E1469 PolarHBondContact O-N 2.73Å; N1467-E1469 PolarHBondContact OD1-N 2.73Å; N1467-I1470 HydrophobicContact CB-CB 4.13Å; N1467-I1470 HydrophobicContact CB-CD1 3.92Å; N1467-I1470 HydrophobicContact CB-CG1 4.03Å; N1467-I1470 WeakPolarHBondContact O-CA 3.39Å; N1467-I1470 WeakPolarHBondContact O-CB 3.43Å; N1467-I1470 PolarHBondContact O-N 3.11Å; N1467-I1470 PolarHBondContact OD1-N 2.89Å; N1467-H1471 PolarHBondContact N-NE2 3.44Å; N1467-H1471 PolarHBondContact O-CD2 2.79Å; N1467-H1471 PolarHBondContact O-N 2.84Å
1468	L	85.1	Confident	89	Confident	102 Å²	102	54.3 Å²	54.3	53%	0.534	29%	0.289	S	S	.	.	H	α-helix	trans	-56.3	-34.5	-176.4	-172.1	66.4	0	0	0	113.9	H1471 Q1472	L1468-H1471 PolarHBondContact O-N 3.41Å; L1468-Q1472 WeakPolarHBondContact O-CB 3.28Å; L1468-Q1472 VanDerWaalsContact O-CG 3.31Å; L1468-Q1472 WeakPolarHBondContact O-CG 3.32Å; L1468-Q1472 PolarHBondContact O-N 2.91Å
1469	E	86.4	Confident	88.9	Confident	152 Å²	152	53.5 Å²	53.5	71%	0.71	29%	0.286	S	S	*	.	H	α-helix	trans	-68.6	-41.4	177.2	-62.4	-173.7	163.1	0	0	111	N1467 Q1472 A1473	N1467-E1469 VanDerWaalsContact C-N 3.26Å; N1467-E1469 PolarHBondContact O-N 2.73Å; N1467-E1469 PolarHBondContact OD1-N 2.73Å; E1469-Q1472 PolarHBondContact O-N 2.85Å; E1469-A1473 VanDerWaalsContact O-CB 3.25Å; E1469-A1473 WeakPolarHBondContact O-CB 3.44Å; E1469-A1473 PolarHBondContact O-N 2.57Å
1470	I	88.1	Confident	88.8	Confident	72 Å²	72	56.6 Å²	56.6	37%	0.369	30%	0.3	S	S	.	.	H	α-helix	trans	-66.6	-38.6	175	-61.7	-179.8	0	0	0	110.5	A1462 N1467 T1474	A1462-I1470 HydrophobicContact CB-CG2 4.15Å; N1467-I1470 HydrophobicContact CB-CB 4.13Å; N1467-I1470 HydrophobicContact CB-CD1 3.92Å; N1467-I1470 HydrophobicContact CB-CG1 4.03Å; N1467-I1470 WeakPolarHBondContact O-CA 3.39Å; N1467-I1470 WeakPolarHBondContact O-CB 3.43Å; N1467-I1470 PolarHBondContact O-N 3.11Å; N1467-I1470 PolarHBondContact OD1-N 2.89Å; I1470-T1474 WeakPolarHBondContact O-CB 3.28Å; I1470-T1474 PolarHBondContact O-N 3.32Å; I1470-T1474 PolarHBondContact O-OG1 2.84Å
1471	H	88.4	Confident	88.9	Confident	13 Å²	13	53.5 Å²	53.5	6%	0.06	29%	0.286	C	S	.	.	H	α-helix	trans	-60.1	-52.8	174.5	-65.2	-164.5	0	0	0	110.2	A1462 M1463 N1467 L1468 T1474 I1475 D1536	A1462-H1471 PolarHBondContact O-CD2 3.44Å; A1462-H1471 PolarHBondContact O-NE2 2.88Å; A1462-H1471 VanDerWaalsContact O-NE2 3.1Å; M1463-H1471 HydrophobicContact CE-CB 3.76Å; N1467-H1471 PolarHBondContact N-NE2 3.44Å; N1467-H1471 PolarHBondContact O-CD2 2.79Å; N1467-H1471 PolarHBondContact O-N 2.84Å; L1468-H1471 PolarHBondContact O-N 3.41Å; H1471-T1474 PolarHBondContact O-N 3.21Å; H1471-I1475 WeakPolarHBondContact O-CB 3.43Å; H1471-I1475 VanDerWaalsContact O-CG1 3.29Å; H1471-I1475 WeakPolarHBondContact O-CG1 3.43Å; H1471-I1475 PolarHBondContact O-N 3.41Å; H1471-D1536 IonicContact ND1-OD1 3.62Å
1472	Q	86.4	Confident	89	Confident	114 Å²	114	52.4 Å²	52.4	53%	0.533	28%	0.28	S	S	.	.	H	α-helix	trans	-64.6	-41.9	-179.2	-71.8	179.3	16	0	0	112.9	L1468 E1469 T1474 S1476	L1468-Q1472 WeakPolarHBondContact O-CB 3.28Å; L1468-Q1472 VanDerWaalsContact O-CG 3.31Å; L1468-Q1472 WeakPolarHBondContact O-CG 3.32Å; L1468-Q1472 PolarHBondContact O-N 2.91Å; E1469-Q1472 PolarHBondContact O-N 2.85Å; Q1472-T1474 VanDerWaalsContact C-N 3.34Å; Q1472-S1476 WeakPolarHBondContact O-CB 3.39Å; Q1472-S1476 PolarHBondContact O-N 3.23Å; Q1472-S1476 PolarHBondContact O-OG 3.17Å
1473	A	90	Very high	89.1	Confident	61 Å²	61	52.4 Å²	52.4	50%	0.504	28%	0.281	S	S	.	.	H	α-helix	trans	-63.1	-41.3	175	0	0	0	0	0	111.5	E1469 R1477	E1469-A1473 VanDerWaalsContact O-CB 3.25Å; E1469-A1473 WeakPolarHBondContact O-CB 3.44Å; E1469-A1473 PolarHBondContact O-N 2.57Å; A1473-R1477 VanDerWaalsContact O-CB 3.31Å; A1473-R1477 WeakPolarHBondContact O-CB 3.39Å; A1473-R1477 PolarHBondContact O-N 2.83Å
1474	T	92.3	Very high	89.4	Confident	10 Å²	10	52.5 Å²	52.5	6%	0.061	28%	0.282	C	S	.	.	H	α-helix	trans	-66.5	-46.3	177.6	-64.6	0	0	0	0	112	K1458 M1459 A1462 I1470 H1471 Q1472 S1476 R1477 V1478	K1458-T1474 HydrophobicContact CD-CG2 4.16Å; K1458-T1474 HydrophobicContact CG-CG2 3.88Å; M1459-T1474 HydrophobicContact CG-CG2 4.3Å; A1462-T1474 HydrophobicContact CB-CG2 3.82Å; A1462-T1474 WeakPolarHBondContact CB-OG1 3.35Å; I1470-T1474 WeakPolarHBondContact O-CB 3.28Å; I1470-T1474 PolarHBondContact O-N 3.32Å; I1470-T1474 PolarHBondContact O-OG1 2.84Å; H1471-T1474 PolarHBondContact O-N 3.21Å; Q1472-T1474 VanDerWaalsContact C-N 3.34Å; T1474-S1476 PolarHBondContact O-N 3.19Å; T1474-R1477 PolarHBondContact O-N 2.96Å; T1474-V1478 HydrophobicContact CG2-CG2 4.34Å; T1474-V1478 WeakPolarHBondContact O-CB 3.27Å; T1474-V1478 VanDerWaalsContact O-CG2 3.29Å; T1474-V1478 WeakPolarHBondContact O-CG2 3.26Å; T1474-V1478 PolarHBondContact O-N 2.93Å
1475	I	90.6	Very high	89.7	Confident	14 Å²	14	50.3 Å²	50.3	7%	0.072	26%	0.264	C	S	.	.	H	α-helix	trans	-58.7	-48.6	176.1	-72.1	168	0	0	0	110.3	H1471 R1477 V1478 K1479 L1529 V1532	H1471-I1475 WeakPolarHBondContact O-CB 3.43Å; H1471-I1475 VanDerWaalsContact O-CG1 3.29Å; H1471-I1475 WeakPolarHBondContact O-CG1 3.43Å; H1471-I1475 PolarHBondContact O-N 3.41Å; I1475-R1477 VanDerWaalsContact C-N 3.31Å; I1475-R1477 PolarHBondContact O-N 3.09Å; I1475-V1478 PolarHBondContact O-N 3.36Å; I1475-K1479 WeakPolarHBondContact O-CG 3.34Å; I1475-K1479 PolarHBondContact O-N 3.33Å; I1475-L1529 HydrophobicContact CG1-CD1 4.29Å; I1475-L1529 HydrophobicContact CG2-CD1 4.24Å; I1475-V1532 HydrophobicContact CD1-CG1 4.24Å
1476	S	90.6	Very high	90	Very high	42 Å²	42	50.1 Å²	50.1	29%	0.294	26%	0.258	S	S	.	.	H	α-helix	trans	-56.3	-45.2	175.7	-63.8	0	0	0	0	111.8	G41 Q1472 T1474 K1479 Q1480	G41-S1476 VanDerWaalsContact O-CB 3.29Å; G41-S1476 WeakPolarHBondContact O-CB 3.29Å; G41-S1476 PolarHBondContact O-OG 2.81Å; Q1472-S1476 WeakPolarHBondContact O-CB 3.39Å; Q1472-S1476 PolarHBondContact O-N 3.23Å; Q1472-S1476 PolarHBondContact O-OG 3.17Å; T1474-S1476 PolarHBondContact O-N 3.19Å; S1476-K1479 PolarHBondContact O-N 3.35Å; S1476-Q1480 WeakPolarHBondContact O-CG 3.43Å; S1476-Q1480 PolarHBondContact O-N 3.43Å; S1476-Q1480 VanDerWaalsContact O-N 3.13Å
1477	R	93.2	Very high	90.5	Very high	85 Å²	85	46.8 Å²	46.8	32%	0.321	24%	0.237	S	C	.	.	H	α-helix	trans	-66.1	-40	178.7	-175	56.1	176.6	155.2	5.9	113.2	E1396 L1400 A1473 T1474 I1475 K1479 Q1480 I1481	E1396-R1477 IonicContact OE1-CZ 3.1Å; E1396-R1477 IonicContact OE1-NE 2.68Å; E1396-R1477 PolarHBondContact OE1-NE 3.17Å; E1396-R1477 IonicContact OE1-NH2 2.84Å; E1396-R1477 PolarHBondContact OE1-NH2 3.22Å; L1400-R1477 VanDerWaalsContact CD2-NH2 3.34Å; A1473-R1477 VanDerWaalsContact O-CB 3.31Å; A1473-R1477 WeakPolarHBondContact O-CB 3.39Å; A1473-R1477 PolarHBondContact O-N 2.83Å; T1474-R1477 PolarHBondContact O-N 2.96Å; I1475-R1477 VanDerWaalsContact C-N 3.31Å; I1475-R1477 PolarHBondContact O-N 3.09Å; R1477-K1479 VanDerWaalsContact C-N 3.35Å; R1477-Q1480 PolarHBondContact O-N 2.88Å; R1477-I1481 HydrophobicContact CG-CD1 4.33Å; R1477-I1481 WeakPolarHBondContact O-CG1 3.43Å; R1477-I1481 PolarHBondContact O-N 3.4Å
1478	V	93.7	Very high	90.8	Very high	0 Å²	0	46 Å²	46	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-61.3	-43.6	175.5	165	0	0	0	0	110.8	L1455 M1459 T1474 I1475 I1481 L1482 L1529	L1455-V1478 HydrophobicContact CD2-CB 4.29Å; L1455-V1478 HydrophobicContact CD2-CG1 4.21Å; L1455-V1478 HydrophobicContact CD2-CG2 3.97Å; M1459-V1478 HydrophobicContact CG-CG2 3.84Å; M1459-V1478 HydrophobicContact SD-CG1 4.18Å; M1459-V1478 HydrophobicContact SD-CG2 4.29Å; T1474-V1478 HydrophobicContact CG2-CG2 4.34Å; T1474-V1478 WeakPolarHBondContact O-CB 3.27Å; T1474-V1478 VanDerWaalsContact O-CG2 3.29Å; T1474-V1478 WeakPolarHBondContact O-CG2 3.26Å; T1474-V1478 PolarHBondContact O-N 2.93Å; I1475-V1478 PolarHBondContact O-N 3.36Å; V1478-I1481 PolarHBondContact O-N 3.05Å; V1478-L1482 HydrophobicContact CG1-CD1 3.72Å; V1478-L1482 HydrophobicContact CG1-CG 4.43Å; V1478-L1482 WeakPolarHBondContact O-CG 3.41Å; V1478-L1482 PolarHBondContact O-N 3.3Å; V1478-L1529 HydrophobicContact CG1-CD2 4.26Å
1479	K	91.7	Very high	91.1	Very high	14 Å²	14	41.2 Å²	41.2	6%	0.061	21%	0.205	C	C	.	.	H	α-helix	trans	-63.5	-41.7	176.8	-65.2	-174.1	-155.9	-179.3	0	112.9	N79 D81 I1475 S1476 R1477 I1481 L1482 A1483	N79-K1479 WeakPolarHBondContact O-CE 3.44Å; N79-K1479 PolarHBondContact O-NZ 3.09Å; D81-K1479 HydrophobicContact CB-CD 4.32Å; D81-K1479 VanDerWaalsContact CG-CD 3.48Å; D81-K1479 IonicContact OD1-NZ 3.36Å; D81-K1479 PolarHBondContact OD1-NZ 3.15Å; D81-K1479 WeakPolarHBondContact OD2-CD 3.18Å; D81-K1479 IonicContact OD2-NZ 3.85Å; D81-K1479 PolarHBondContact OD2-NZ 2.97Å; D81-K1479 VanDerWaalsContact OD2-NZ 3.17Å; I1475-K1479 WeakPolarHBondContact O-CG 3.34Å; I1475-K1479 PolarHBondContact O-N 3.33Å; S1476-K1479 PolarHBondContact O-N 3.35Å; R1477-K1479 VanDerWaalsContact C-N 3.35Å; K1479-I1481 VanDerWaalsContact C-N 3.27Å; K1479-I1481 PolarHBondContact O-N 3.3Å; K1479-L1482 PolarHBondContact O-N 2.98Å; K1479-A1483 PolarHBondContact O-N 2.92Å
1480	Q	92.3	Very high	91	Very high	69 Å²	69	36.8 Å²	36.8	32%	0.322	19%	0.186	S	C	.	.	H	α-helix	trans	-57.8	-38.4	174.7	-70.7	170.5	3	0	0	112.5	F40 S1476 R1477 A1483	F40-Q1480 VanDerWaalsContact O-CG 3.31Å; F40-Q1480 WeakPolarHBondContact O-CG 3.21Å; S1476-Q1480 WeakPolarHBondContact O-CG 3.43Å; S1476-Q1480 PolarHBondContact O-N 3.43Å; S1476-Q1480 VanDerWaalsContact O-N 3.13Å; R1477-Q1480 PolarHBondContact O-N 2.88Å; Q1480-A1483 VanDerWaalsContact O-CB 3.29Å; Q1480-A1483 WeakPolarHBondContact O-CB 3.29Å
1481	I	93.8	Very high	90.9	Very high	4 Å²	4	37.6 Å²	37.6	2%	0.021	19%	0.191	C	C	.	.	H	α-helix	trans	-75.3	-40.7	179.4	-64.7	168.1	0	0	0	110.9	L1400 M1451 F1454 L1455 R1477 V1478 K1479 A1483 N1484 H1485	L1400-I1481 HydrophobicContact CD1-CD1 4.21Å; L1400-I1481 HydrophobicContact CD2-CD1 3.87Å; L1400-I1481 HydrophobicContact CD2-CG1 4.42Å; M1451-I1481 HydrophobicContact CE-CG2 3.82Å; M1451-I1481 HydrophobicContact CG-CG2 4.12Å; M1451-I1481 HydrophobicContact SD-CG2 3.54Å; M1451-I1481 VanDerWaalsContact SD-CG2 3.54Å; F1454-I1481 HydrophobicContact CE1-CD1 3.89Å; L1455-I1481 HydrophobicContact CD2-CB 4.07Å; L1455-I1481 HydrophobicContact CD2-CD1 3.97Å; L1455-I1481 HydrophobicContact CD2-CG2 4Å; R1477-I1481 HydrophobicContact CG-CD1 4.33Å; R1477-I1481 WeakPolarHBondContact O-CG1 3.43Å; R1477-I1481 PolarHBondContact O-N 3.4Å; V1478-I1481 PolarHBondContact O-N 3.05Å; K1479-I1481 VanDerWaalsContact C-N 3.27Å; K1479-I1481 PolarHBondContact O-N 3.3Å; I1481-A1483 PolarHBondContact O-N 2.92Å; I1481-N1484 PolarHBondContact O-N 3.02Å; I1481-H1485 PolarHBondContact O-ND1 3.21Å
1482	L	94.2	Very high	90.8	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-65	-23.8	174.1	-70.3	168	0	0	0	112.8	F82 L990 L1455 V1478 K1479 N1484 H1485 W1486 I1522 L1526 L1529	F82-L1482 HydrophobicContact CE2-CB 4.49Å; F82-L1482 HydrophobicContact CZ-CB 3.69Å; L990-L1482 HydrophobicContact CD2-CB 4.43Å; L1455-L1482 HydrophobicContact CD1-CD2 3.72Å; L1455-L1482 HydrophobicContact CD1-CG 3.94Å; V1478-L1482 HydrophobicContact CG1-CD1 3.72Å; V1478-L1482 HydrophobicContact CG1-CG 4.43Å; V1478-L1482 WeakPolarHBondContact O-CG 3.41Å; V1478-L1482 PolarHBondContact O-N 3.3Å; K1479-L1482 PolarHBondContact O-N 2.98Å; L1482-N1484 VanDerWaalsContact C-N 3.33Å; L1482-N1484 PolarHBondContact O-N 3.46Å; L1482-H1485 WeakPolarHBondContact O-CB 3.5Å; L1482-H1485 PolarHBondContact O-N 3.49Å; L1482-H1485 VanDerWaalsContact O-N 3.17Å; L1482-W1486 PolarHBondContact O-N 2.97Å; L1482-I1522 HydrophobicContact CD2-CD1 4.46Å; L1482-I1522 HydrophobicContact CD2-CG2 3.81Å; L1482-L1526 HydrophobicContact CD1-CD2 3.8Å; L1482-L1526 HydrophobicContact CD1-CG 4.5Å; L1482-L1529 HydrophobicContact CD1-CD2 4.23Å
1483	A	92.4	Very high	90.7	Very high	4 Å²	4	34 Å²	34	3%	0.033	18%	0.178	C	C	.	.	H	α-helix	trans	-58.7	-41.4	174.4	0	0	0	0	0	112.6	S37 F40 K1479 Q1480 I1481 H1485 W1486 E1487	S37-A1483 WeakPolarHBondContact O-CB 3.3Å; F40-A1483 HydrophobicContact CB-CB 4.23Å; F40-A1483 HydrophobicContact CD2-CB 3.8Å; F40-A1483 HydrophobicContact CG-CB 4.44Å; K1479-A1483 PolarHBondContact O-N 2.92Å; Q1480-A1483 VanDerWaalsContact O-CB 3.29Å; Q1480-A1483 WeakPolarHBondContact O-CB 3.29Å; I1481-A1483 PolarHBondContact O-N 2.92Å; A1483-H1485 VanDerWaalsContact C-N 3.29Å; A1483-H1485 PolarHBondContact O-N 3.26Å; A1483-W1486 PolarHBondContact O-N 3.13Å; A1483-E1487 WeakPolarHBondContact O-CB 3.25Å; A1483-E1487 PolarHBondContact O-N 3.08Å
1484	N	92.5	Very high	90.4	Very high	42 Å²	42	33.9 Å²	33.9	23%	0.225	16%	0.164	C	C	.	.	H	α-helix	trans	-61.1	-39.1	176	-57.7	-18.4	0	0	0	111.5	H1402 L1403 I1481 L1482 E1487 Y1488	H1402-N1484 PolarHBondContact CE1-OD1 3.18Å; H1402-N1484 PolarHBondContact ND1-ND2 2.95Å; H1402-N1484 WeakPolarHBondContact O-CB 3.34Å; H1402-N1484 PolarHBondContact O-ND2 2.85Å; L1403-N1484 HydrophobicContact CD2-CB 3.96Å; L1403-N1484 WeakPolarHBondContact CD2-O 3.32Å; I1481-N1484 PolarHBondContact O-N 3.02Å; L1482-N1484 VanDerWaalsContact C-N 3.33Å; L1482-N1484 PolarHBondContact O-N 3.46Å; N1484-E1487 PolarHBondContact O-N 3.43Å; N1484-Y1488 WeakPolarHBondContact O-CB 3.43Å; N1484-Y1488 PolarHBondContact O-N 2.96Å
1485	H	93.8	Very high	90.1	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-69	-43	-179.9	-61.7	68.6	0	0	0	111	L1403 I1481 L1482 A1483 E1487 Y1488 I1489 L1497	L1403-H1485 PolarHBondContact O-NE2 3.09Å; I1481-H1485 PolarHBondContact O-ND1 3.21Å; L1482-H1485 WeakPolarHBondContact O-CB 3.5Å; L1482-H1485 PolarHBondContact O-N 3.49Å; L1482-H1485 VanDerWaalsContact O-N 3.17Å; A1483-H1485 VanDerWaalsContact C-N 3.29Å; A1483-H1485 PolarHBondContact O-N 3.26Å; H1485-E1487 VanDerWaalsContact C-N 3.34Å; H1485-Y1488 PolarHBondContact O-N 3.29Å; H1485-I1489 WeakPolarHBondContact O-CB 3.48Å; H1485-I1489 VanDerWaalsContact O-CD1 3.3Å; H1485-I1489 WeakPolarHBondContact O-CD1 3.32Å; H1485-I1489 WeakPolarHBondContact O-CG1 3.42Å; H1485-I1489 PolarHBondContact O-N 3.41Å; H1485-L1497 HydrophobicContact CB-CD2 4.17Å
1486	W	91.5	Very high	90.2	Very high	45 Å²	45	33.6 Å²	33.6	17%	0.17	16%	0.162	C	C	.	.	H	α-helix	trans	-60.4	-42.4	173	173	-111.4	0	0	0	112.2	F40 F82 P989 L990 T993 L1482 A1483 N1490	F40-W1486 AromaticContact CE2-CD1 3.65Å; F40-W1486 HydrophobicContact CE2-CG 4.36Å; F82-W1486 HydrophobicContact CD1-CB 3.85Å; F82-W1486 HydrophobicContact CD1-CD2 4.1Å; F82-W1486 AromaticContact CD1-CG 3.7Å; F82-W1486 HydrophobicContact CD1-CG 3.7Å; F82-W1486 HydrophobicContact CE1-CB 3.69Å; F82-W1486 HydrophobicContact CE1-CG 4.05Å; P989-W1486 HydrophobicContact CB-CH2 3.5Å; P989-W1486 HydrophobicContact CB-CZ2 4.06Å; P989-W1486 HydrophobicContact CB-CZ3 4.08Å; L990-W1486 HydrophobicContact CB-CD2 4.44Å; L990-W1486 HydrophobicContact CB-CE3 3.79Å; L990-W1486 HydrophobicContact CB-CZ3 4.28Å; L990-W1486 HydrophobicContact CD1-CB 4.21Å; L990-W1486 HydrophobicContact CD1-CE3 3.85Å; L990-W1486 HydrophobicContact CG-CE3 4.4Å; T993-W1486 HydrophobicContact CG2-CZ3 4.39Å; L1482-W1486 PolarHBondContact O-N 2.97Å; A1483-W1486 PolarHBondContact O-N 3.13Å; W1486-N1490 VanDerWaalsContact CE3-ND2 3.26Å; W1486-N1490 WeakPolarHBondContact CH2-ND2 3.5Å; W1486-N1490 WeakPolarHBondContact CZ2-ND2 3.29Å; W1486-N1490 WeakPolarHBondContact CZ3-ND2 3.45Å; W1486-N1490 PolarHBondContact O-N 2.88Å; W1486-N1490 PolarHBondContact O-ND2 3.46Å
1487	E	89.8	Confident	90.3	Very high	76 Å²	76	31.6 Å²	31.6	36%	0.355	15%	0.148	S	C	.	.	H	α-helix	trans	-67.2	-42.3	178	-171.1	168.2	155.8	0	0	112.2	H36 S37 A1483 N1484 H1485 N1491	H36-E1487 IonicContact CE1-OE2 2.62Å; S37-E1487 PolarHBondContact OG-OE2 2.61Å; A1483-E1487 WeakPolarHBondContact O-CB 3.25Å; A1483-E1487 PolarHBondContact O-N 3.08Å; N1484-E1487 PolarHBondContact O-N 3.43Å; H1485-E1487 VanDerWaalsContact C-N 3.34Å; E1487-N1491 PolarHBondContact O-N 3.03Å; E1487-N1491 PolarHBondContact O-ND2 2.83Å
1488	Y	91.3	Very high	90.4	Very high	47 Å²	47	27.7 Å²	27.7	18%	0.184	13%	0.134	C	C	.	.	H	α-helix	trans	-60.5	-52.2	174.8	-171.7	-81.7	0	0	0	111.4	L1403 N1484 H1485 N1490 N1491 D1492 S1496 L1497 P1498	L1403-Y1488 HydrophobicContact CD1-CD2 3.36Å; L1403-Y1488 HydrophobicContact CD1-CE2 3.94Å; L1403-Y1488 HydrophobicContact CD1-CG 3.89Å; N1484-Y1488 WeakPolarHBondContact O-CB 3.43Å; N1484-Y1488 PolarHBondContact O-N 2.96Å; H1485-Y1488 PolarHBondContact O-N 3.29Å; Y1488-N1490 VanDerWaalsContact C-N 3.28Å; Y1488-N1490 PolarHBondContact O-N 3.46Å; Y1488-N1491 PolarHBondContact O-N 3.42Å; Y1488-D1492 HydrophobicContact CD1-CB 4.01Å; Y1488-D1492 HydrophobicContact CE1-CB 3.6Å; Y1488-D1492 WeakPolarHBondContact CE1-OD1 3.46Å; Y1488-D1492 WeakPolarHBondContact O-CB 3.13Å; Y1488-D1492 PolarHBondContact O-N 3.43Å; Y1488-D1492 PolarHBondContact OH-OD1 3.4Å; Y1488-S1496 WeakPolarHBondContact CD1-O 3.28Å; Y1488-L1497 HydrophobicContact CD1-CD2 4.29Å; Y1488-P1498 HydrophobicContact CE1-CG 4.25Å
1489	I	89.9	Confident	90.3	Very high	1 Å²	1	27.9 Å²	27.9	1%	0.005	14%	0.135	C	C	.	.	H	α-helix	trans	-60.1	-35.3	-175.8	-67.7	161.2	0	0	0	112.6	L990 T993 L994 H1485 N1491 F1495 L1497	L990-I1489 HydrophobicContact CD1-CD1 4.08Å; T993-I1489 HydrophobicContact CG2-CB 4.47Å; T993-I1489 HydrophobicContact CG2-CG2 3.28Å; L994-I1489 HydrophobicContact CD2-CD1 3.63Å; L994-I1489 HydrophobicContact CG-CD1 4.32Å; H1485-I1489 WeakPolarHBondContact O-CB 3.48Å; H1485-I1489 VanDerWaalsContact O-CD1 3.3Å; H1485-I1489 WeakPolarHBondContact O-CD1 3.32Å; H1485-I1489 WeakPolarHBondContact O-CG1 3.42Å; H1485-I1489 PolarHBondContact O-N 3.41Å; I1489-N1491 VanDerWaalsContact C-N 3.35Å; I1489-F1495 HydrophobicContact CG2-CB 4.42Å; I1489-F1495 WeakPolarHBondContact CG2-O 3.21Å; I1489-F1495 WeakPolarHBondContact O-CA 3.5Å; I1489-L1497 HydrophobicContact CD1-CD1 4.22Å; I1489-L1497 HydrophobicContact CD1-CD2 3.93Å; I1489-L1497 HydrophobicContact CD1-CG 3.84Å; I1489-L1497 HydrophobicContact CG1-CD2 3.69Å; I1489-L1497 HydrophobicContact CG1-CG 3.85Å
1490	N	84.2	Confident	90.2	Very high	60 Å²	60	28 Å²	28	32%	0.321	14%	0.136	S	C	.	.	H	α-helix	trans	-78.7	-18.8	179.1	-73.9	-61.5	0	0	0	113.8	W1486 Y1488	W1486-N1490 VanDerWaalsContact CE3-ND2 3.26Å; W1486-N1490 WeakPolarHBondContact CH2-ND2 3.5Å; W1486-N1490 WeakPolarHBondContact CZ2-ND2 3.29Å; W1486-N1490 WeakPolarHBondContact CZ3-ND2 3.45Å; W1486-N1490 PolarHBondContact O-N 2.88Å; W1486-N1490 PolarHBondContact O-ND2 3.46Å; Y1488-N1490 VanDerWaalsContact C-N 3.28Å; Y1488-N1490 PolarHBondContact O-N 3.46Å
1491	N	86.1	Confident	90.2	Very high	88 Å²	88	24.8 Å²	24.8	47%	0.471	12%	0.121	S	C	.	.	H	α-helix	trans	-102.7	-13.4	-179.5	-70.6	-55.7	0	0	0	113.3	Y896 E1487 Y1488 I1489	Y896-N1491 VanDerWaalsContact CE2-O 3.24Å; Y896-N1491 WeakPolarHBondContact CE2-O 3.38Å; Y896-N1491 VanDerWaalsContact CZ-O 3.31Å; Y896-N1491 PolarHBondContact OH-O 3.15Å; E1487-N1491 PolarHBondContact O-N 3.03Å; E1487-N1491 PolarHBondContact O-ND2 2.83Å; Y1488-N1491 PolarHBondContact O-N 3.42Å; I1489-N1491 VanDerWaalsContact C-N 3.35Å
1492	D	86.3	Confident	89.9	Confident	16 Å²	16	25.2 Å²	25.2	9%	0.086	12%	0.123	C	C	.	.	S	Bend	trans	-91.1	133.9	177.7	-174.2	98.6	0	0	0	112.5	Y1488 W1494 F1495	Y1488-D1492 HydrophobicContact CD1-CB 4.01Å; Y1488-D1492 HydrophobicContact CE1-CB 3.6Å; Y1488-D1492 WeakPolarHBondContact CE1-OD1 3.46Å; Y1488-D1492 WeakPolarHBondContact O-CB 3.13Å; Y1488-D1492 PolarHBondContact O-N 3.43Å; Y1488-D1492 PolarHBondContact OH-OD1 3.4Å; D1492-W1494 VanDerWaalsContact C-N 3.26Å; D1492-W1494 PolarHBondContact O-N 3.32Å; D1492-W1494 WeakPolarHBondContact OD2-CA 3.41Å; D1492-W1494 VanDerWaalsContact OD2-CB 3.25Å; D1492-W1494 WeakPolarHBondContact OD2-CB 3.48Å; D1492-W1494 PolarHBondContact OD2-N 3.19Å; D1492-F1495 PolarHBondContact O-N 2.83Å
1493	P	83.9	Confident	89.4	Confident	35 Å²	35	28.4 Å²	28.4	23%	0.227	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-26.8	-178.6	-24.8	34.3	0	0	0	115.7	D893 Y896 F1495	D893-P1493 WeakPolarHBondContact OD1-CB 3.17Å; Y896-P1493 HydrophobicContact CD1-CB 4.16Å; Y896-P1493 HydrophobicContact CD1-CG 4.1Å; Y896-P1493 HydrophobicContact CE1-CG 3.97Å; Y896-P1493 HydrophobicContact CG-CB 4.19Å; Y896-P1493 HydrophobicContact CG-CG 4.46Å; P1493-F1495 WeakPolarHBondContact O-CD2 3.43Å; P1493-F1495 PolarHBondContact O-N 2.74Å
1494	W	85	Confident	88.8	Confident	59 Å²	59	32.8 Å²	32.8	22%	0.223	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78	-9.1	177.8	-60.6	81.9	0	0	0	112.7	I1041 D1492 S1496 P1513 A1514	I1041-W1494 HydrophobicContact CB-CZ3 4.34Å; I1041-W1494 HydrophobicContact CG2-CE3 4.12Å; I1041-W1494 HydrophobicContact CG2-CH2 3.92Å; I1041-W1494 HydrophobicContact CG2-CZ3 3.38Å; D1492-W1494 VanDerWaalsContact C-N 3.26Å; D1492-W1494 PolarHBondContact O-N 3.32Å; D1492-W1494 WeakPolarHBondContact OD2-CA 3.41Å; D1492-W1494 VanDerWaalsContact OD2-CB 3.25Å; D1492-W1494 WeakPolarHBondContact OD2-CB 3.48Å; D1492-W1494 PolarHBondContact OD2-N 3.19Å; W1494-S1496 PolarHBondContact O-N 3.1Å; W1494-P1513 HydrophobicContact CD2-CG 4.01Å; W1494-P1513 HydrophobicContact CG-CB 4.07Å; W1494-P1513 HydrophobicContact CG-CG 3.97Å; W1494-P1513 HydrophobicContact CZ2-CG 4.24Å; W1494-P1513 VanDerWaalsContact NE1-CG 3.27Å; W1494-A1514 HydrophobicContact CB-CB 4.31Å
1495	F	86.3	Confident	88.4	Confident	18 Å²	18	31.3 Å²	31.3	8%	0.079	16%	0.155	C	C	.	.	S	Bend	trans	47.8	39.6	-169.1	-59.9	-88.7	0	0	0	112.5	R890 Y896 S997 I1489 D1492 P1493	R890-F1495 HydrophobicContact CG-CD2 3.62Å; R890-F1495 HydrophobicContact CG-CE2 3.95Å; R890-F1495 HydrophobicContact CG-CG 4.26Å; R890-F1495 VanDerWaalsContact NE-CG 3.3Å; Y896-F1495 HydrophobicContact CD2-CE1 4.48Å; Y896-F1495 HydrophobicContact CD2-CZ 4.18Å; S997-F1495 WeakPolarHBondContact CB-O 3.24Å; S997-F1495 PolarHBondContact OG-O 3.08Å; I1489-F1495 HydrophobicContact CG2-CB 4.42Å; I1489-F1495 WeakPolarHBondContact CG2-O 3.21Å; I1489-F1495 WeakPolarHBondContact O-CA 3.5Å; D1492-F1495 PolarHBondContact O-N 2.83Å; P1493-F1495 WeakPolarHBondContact O-CD2 3.43Å; P1493-F1495 PolarHBondContact O-N 2.74Å
1496	S	91.6	Very high	88.1	Confident	0 Å²	0	33 Å²	33	0%	0	17%	0.169	C	C	.	.	S	Bend	trans	-135	-175.3	-170.9	-155.6	0	0	0	0	111.9	Y1488 W1494 A1514	Y1488-S1496 WeakPolarHBondContact CD1-O 3.28Å; W1494-S1496 PolarHBondContact O-N 3.1Å; S1496-A1514 WeakPolarHBondContact OG-CB 3.37Å
1497	L	94	Very high	87.9	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	19%	0.191	C	C	.	.			trans	-114.6	137.5	175.8	-71.2	174.2	0	0	0	110	L994 V1448 H1485 Y1488 I1489 P1513 A1514 Q1515 I1519 I1522	L994-L1497 HydrophobicContact CD2-CD1 4.19Å; V1448-L1497 HydrophobicContact CG1-CB 4.23Å; V1448-L1497 HydrophobicContact CG1-CD1 4.19Å; H1485-L1497 HydrophobicContact CB-CD2 4.17Å; Y1488-L1497 HydrophobicContact CD1-CD2 4.29Å; I1489-L1497 HydrophobicContact CD1-CD1 4.22Å; I1489-L1497 HydrophobicContact CD1-CD2 3.93Å; I1489-L1497 HydrophobicContact CD1-CG 3.84Å; I1489-L1497 HydrophobicContact CG1-CD2 3.69Å; I1489-L1497 HydrophobicContact CG1-CG 3.85Å; L1497-P1513 CarbonylContact C-O 3.53Å; L1497-A1514 CarbonylContact O-C 3.58Å; L1497-A1514 WeakPolarHBondContact O-CA 3.47Å; L1497-Q1515 PolarHBondContact O-N 2.77Å; L1497-I1519 HydrophobicContact CB-CD1 3.98Å; L1497-I1519 HydrophobicContact CB-CG1 4.48Å; L1497-I1519 HydrophobicContact CD1-CD1 4.15Å; L1497-I1519 HydrophobicContact CG-CD1 3.97Å; L1497-I1522 HydrophobicContact CD1-CB 4.28Å; L1497-I1522 HydrophobicContact CD1-CG1 3.85Å
1498	P	93.9	Very high	87.9	Confident	4 Å²	4	35.1 Å²	35.1	3%	0.026	18%	0.176	C	C	.	.			trans	-72.3	162.9	-177.5	30.2	-34.4	0	0	0	111.4	V1448 Y1488 F1500 T1501 C1512 P1513 S1518	V1448-P1498 WeakPolarHBondContact CB-O 3.43Å; V1448-P1498 HydrophobicContact CG2-CG 4.17Å; V1448-P1498 WeakPolarHBondContact CG2-O 3.42Å; Y1488-P1498 HydrophobicContact CE1-CG 4.25Å; P1498-F1500 VanDerWaalsContact C-N 3.35Å; P1498-T1501 HydrophobicContact CG-CG2 3.83Å; P1498-C1512 CarbonylContact C-O 3.56Å; P1498-C1512 WeakPolarHBondContact CA-O 3.23Å; P1498-P1513 VanDerWaalsContact CA-O 3.32Å; P1498-P1513 WeakPolarHBondContact CA-O 3.5Å; P1498-S1518 WeakPolarHBondContact O-CB 3.13Å; P1498-S1518 PolarHBondContact O-OG 3.2Å
1499	A	91.4	Very high	87.7	Confident	4 Å²	4	42.7 Å²	42.7	3%	0.033	20%	0.204	C	C	.	.	S	Bend	trans	-62.4	-46.2	173.5	0	0	0	0	0	111.6	V1448 C1512 Q1515	V1448-A1499 PolarHBondContact N-O 3.25Å; A1499-C1512 PolarHBondContact N-O 3.03Å; A1499-Q1515 VanDerWaalsContact CA-CB 3.5Å; A1499-Q1515 HydrophobicContact CB-CB 3.83Å; A1499-Q1515 HydrophobicContact CB-CG 3.79Å
1500	F	91.1	Very high	87.6	Confident	15 Å²	15	45 Å²	45	7%	0.066	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.9	156.3	177.9	51.4	-100.6	0	0	0	109.9	Y1419 L1436 K1445 E1446 W1447 P1498 A1511	Y1419-F1500 AromaticContact CD1-CE2 3.67Å; Y1419-F1500 HydrophobicContact CD1-CE2 3.67Å; Y1419-F1500 AromaticContact CD1-CZ 3.99Å; Y1419-F1500 HydrophobicContact CD1-CZ 3.99Å; Y1419-F1500 HydrophobicContact CE1-CE2 4.16Å; Y1419-F1500 AromaticContact CE1-CZ 3.99Å; Y1419-F1500 HydrophobicContact CE1-CZ 3.99Å; Y1419-F1500 HydrophobicContact CG-CE2 4.19Å; L1436-F1500 HydrophobicContact CD1-CE1 4.02Å; L1436-F1500 HydrophobicContact CD1-CZ 3.95Å; K1445-F1500 VanDerWaalsContact CE-CG 3.41Å; E1446-F1500 CarbonylContact O-C 3.42Å; E1446-F1500 WeakPolarHBondContact O-CA 3.12Å; E1446-F1500 WeakPolarHBondContact O-CB 3.37Å; W1447-F1500 HydrophobicContact CD2-CB 4.14Å; W1447-F1500 HydrophobicContact CD2-CD1 4.23Å; W1447-F1500 AromaticContact CE2-CD1 3.99Å; W1447-F1500 HydrophobicContact CE3-CD1 4.27Å; W1447-F1500 HydrophobicContact CG-CB 4.16Å; W1447-F1500 AromaticContact CH2-CD1 3.99Å; W1447-F1500 HydrophobicContact CH2-CD1 3.99Å; W1447-F1500 HydrophobicContact CH2-CE1 4.33Å; W1447-F1500 AromaticContact CZ2-CD1 3.89Å; W1447-F1500 HydrophobicContact CZ2-CD1 3.89Å; W1447-F1500 HydrophobicContact CZ2-CE1 4.29Å; W1447-F1500 HydrophobicContact CZ3-CD1 4.17Å; P1498-F1500 VanDerWaalsContact C-N 3.35Å; F1500-A1511 HydrophobicContact CD2-CB 3.8Å; F1500-A1511 HydrophobicContact CE2-CB 3.59Å; F1500-A1511 HydrophobicContact CG-CB 4.37Å; F1500-A1511 HydrophobicContact CZ-CB 3.97Å; F1500-A1511 VanDerWaalsContact O-CB 3.3Å; F1500-A1511 WeakPolarHBondContact O-CB 3.41Å
1501	T	90.9	Very high	87.8	Confident	3 Å²	3	42.5 Å²	42.5	2%	0.018	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	163.2	173.2	50.3	0	0	0	0	110.9	L1403 K1445 E1446 P1498 A1506	L1403-T1501 HydrophobicContact CD1-CG2 4.08Å; K1445-T1501 WeakPolarHBondContact CG-O 3.49Å; E1446-T1501 WeakPolarHBondContact CB-OG1 3.47Å; E1446-T1501 PolarHBondContact N-O 3.18Å; E1446-T1501 VanDerWaalsContact N-O 3.13Å; E1446-T1501 PolarHBondContact O-N 3.26Å; E1446-T1501 PolarHBondContact OE2-OG1 3.02Å; P1498-T1501 HydrophobicContact CG-CG2 3.83Å; T1501-A1506 WeakPolarHBondContact CB-O 3.48Å
1502	N	88	Confident	88.1	Confident	12 Å²	12	38.5 Å²	38.5	6%	0.064	18%	0.183	C	C	.	.	S	Bend	trans	-79.5	-159.4	163.3	-71.4	-27.5	0	0	0	109.5	Y1418 Y1419 L1444 D1504 G1505 A1506 Y1507 C1508	Y1418-N1502 HydrophobicContact CD1-CB 3.64Å; Y1418-N1502 HydrophobicContact CE1-CB 4.43Å; Y1418-N1502 HydrophobicContact CG-CB 4.14Å; Y1419-N1502 PolarHBondContact N-OD1 2.98Å; L1444-N1502 CarbonylContact O-C 3.54Å; L1444-N1502 VanDerWaalsContact O-C 3.29Å; N1502-D1504 PolarHBondContact O-N 2.99Å; N1502-G1505 PolarHBondContact O-N 3.49Å; N1502-A1506 HydrophobicContact CB-CB 4.07Å; N1502-A1506 WeakPolarHBondContact CB-O 3.34Å; N1502-A1506 PolarHBondContact N-O 3.43Å; N1502-Y1507 PolarHBondContact ND2-O 2.95Å; N1502-C1508 HydrophobicContact CB-CB 4.47Å; N1502-C1508 WeakPolarHBondContact ND2-CA 3.33Å; N1502-C1508 WeakPolarHBondContact ND2-CB 3.45Å; N1502-C1508 PolarHBondContact OD1-SG 3.33Å; N1502-C1508 VanDerWaalsContact OD1-SG 3.32Å
1503	K	83	Confident	88.3	Confident	67 Å²	67	38.7 Å²	38.7	29%	0.291	19%	0.185	S	C	.	.	G	3₁₀ helix	trans	-56.4	132.4	-169.5	-159.4	-175	-178	-156.5	0	114.9	Y1418 G1443 L1444 G1505 A1506	Y1418-K1503 HydrophobicContact CD1-CB 4.44Å; Y1418-K1503 HydrophobicContact CE1-CB 3.84Å; Y1418-K1503 HydrophobicContact CE2-CB 4.01Å; Y1418-K1503 HydrophobicContact CE2-CD 4.45Å; G1443-K1503 VanDerWaalsContact C-CG 3.47Å; G1443-K1503 WeakPolarHBondContact O-CB 3.41Å; G1443-K1503 WeakPolarHBondContact O-CD 3.38Å; G1443-K1503 WeakPolarHBondContact O-CG 3.46Å; L1444-K1503 HydrophobicContact CB-CB 4.41Å; L1444-K1503 HydrophobicContact CB-CG 3.68Å; L1444-K1503 HydrophobicContact CD1-CG 4.29Å; L1444-K1503 HydrophobicContact CG-CD 4.38Å; L1444-K1503 HydrophobicContact CG-CG 3.69Å; L1444-K1503 WeakPolarHBondContact O-CA 3.35Å; L1444-K1503 PolarHBondContact O-N 3.26Å; K1503-G1505 PolarHBondContact O-N 3.02Å; K1503-G1505 VanDerWaalsContact O-N 3.16Å; K1503-A1506 WeakPolarHBondContact O-CA 3.35Å; K1503-A1506 WeakPolarHBondContact O-CB 3.26Å; K1503-A1506 PolarHBondContact O-N 3.45Å
1504	D	79.7	Confident	88.7	Confident	96 Å²	96	37 Å²	37	51%	0.513	17%	0.174	S	C	.	.	G	3₁₀ helix	trans	54.7	35.6	172.1	-63	-60.3	0	0	0	111.6	L1444 E1446 N1502	L1444-D1504 WeakPolarHBondContact CD1-OD1 3.39Å; E1446-D1504 WeakPolarHBondContact OE1-CA 3.49Å; N1502-D1504 PolarHBondContact O-N 2.99Å
1505	G	84.1	Confident	89.1	Confident	12 Å²	12	34.5 Å²	34.5	12%	0.124	17%	0.165	C	C	.	.	G	3₁₀ helix	trans	82.4	3.8	-174.2	0	0	0	0	0	116.1	E1446 N1502 K1503	E1446-G1505 PolarHBondContact OE1-N 3.21Å; N1502-G1505 PolarHBondContact O-N 3.49Å; K1503-G1505 PolarHBondContact O-N 3.02Å; K1503-G1505 VanDerWaalsContact O-N 3.16Å
1506	A	87.5	Confident	89.5	Confident	36 Å²	36	33.6 Å²	33.6	30%	0.298	16%	0.161	S	C	.	.			trans	-58.4	146.8	-176.4	0	0	0	0	0	113.6	Y1418 T1501 N1502 K1503	Y1418-A1506 HydrophobicContact CE1-CB 4.45Å; T1501-A1506 WeakPolarHBondContact CB-O 3.48Å; N1502-A1506 HydrophobicContact CB-CB 4.07Å; N1502-A1506 WeakPolarHBondContact CB-O 3.34Å; N1502-A1506 PolarHBondContact N-O 3.43Å; K1503-A1506 WeakPolarHBondContact O-CA 3.35Å; K1503-A1506 WeakPolarHBondContact O-CB 3.26Å; K1503-A1506 PolarHBondContact O-N 3.45Å
1507	Y	89	Confident	89.7	Confident	160 Å²	160	33.8 Å²	33.8	63%	0.627	16%	0.162	S	C	*	.			trans	-56	138.7	179.3	178.1	-104.4	0	0	0	112.4	N1502 R1509	N1502-Y1507 PolarHBondContact ND2-O 2.95Å; Y1507-R1509 HydrophobicContact CE1-CB 4.1Å
1508	C	88.1	Confident	89.8	Confident	5 Å²	5	33.8 Å²	33.8	3%	0.034	16%	0.162	C	C	.	.			trans	-125.2	110.6	176.6	-170.6	0	0	0	0	110	N1502 D1510 A1511	N1502-C1508 HydrophobicContact CB-CB 4.47Å; N1502-C1508 WeakPolarHBondContact ND2-CA 3.33Å; N1502-C1508 WeakPolarHBondContact ND2-CB 3.45Å; N1502-C1508 PolarHBondContact OD1-SG 3.33Å; N1502-C1508 VanDerWaalsContact OD1-SG 3.32Å; C1508-D1510 VanDerWaalsContact C-N 3.25Å; C1508-D1510 PolarHBondContact O-N 2.92Å; C1508-A1511 HydrophobicContact CB-CB 3.92Å; C1508-A1511 WeakPolarHBondContact O-CB 3.25Å; C1508-A1511 PolarHBondContact O-N 2.72Å; C1508-A1511 VanDerWaalsContact O-N 3.16Å
1509	R	87.7	Confident	89.9	Confident	205 Å²	205	33.6 Å²	33.6	77%	0.774	16%	0.161	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-35.4	-178	-179.6	-177.1	174.4	-164.6	-2.2	113.6	Y1507 A1511	Y1507-R1509 HydrophobicContact CE1-CB 4.1Å; R1509-A1511 VanDerWaalsContact C-N 3.33Å
1510	D	87.8	Confident	90.1	Very high	49 Å²	49	33.4 Å²	33.4	26%	0.262	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-0.6	-175.7	-60.9	-39.8	0	0	0	112.8	Y1419 S1420 A1421 C1508	Y1419-D1510 HydrophobicContact CD1-CB 3.86Å; Y1419-D1510 HydrophobicContact CE1-CB 3.58Å; S1420-D1510 WeakPolarHBondContact CA-OD2 2.98Å; S1420-D1510 PolarHBondContact OG-OD2 3.32Å; A1421-D1510 HydrophobicContact CB-CB 4.46Å; A1421-D1510 PolarHBondContact N-OD2 3.41Å; C1508-D1510 VanDerWaalsContact C-N 3.25Å; C1508-D1510 PolarHBondContact O-N 2.92Å
1511	A	89.3	Confident	90.4	Very high	9 Å²	9	32.7 Å²	32.7	7%	0.074	16%	0.156	C	C	.	.	S	Bend	trans	-84.4	150.6	172	0	0	0	0	0	111.1	F1500 C1508 R1509 P1513	F1500-A1511 HydrophobicContact CD2-CB 3.8Å; F1500-A1511 HydrophobicContact CE2-CB 3.59Å; F1500-A1511 HydrophobicContact CG-CB 4.37Å; F1500-A1511 HydrophobicContact CZ-CB 3.97Å; F1500-A1511 VanDerWaalsContact O-CB 3.3Å; F1500-A1511 WeakPolarHBondContact O-CB 3.41Å; C1508-A1511 HydrophobicContact CB-CB 3.92Å; C1508-A1511 WeakPolarHBondContact O-CB 3.25Å; C1508-A1511 PolarHBondContact O-N 2.72Å; C1508-A1511 VanDerWaalsContact O-N 3.16Å; R1509-A1511 VanDerWaalsContact C-N 3.33Å; A1511-P1513 WeakPolarHBondContact O-CD 3.33Å
1512	C	91.4	Very high	90.7	Very high	4 Å²	4	32.6 Å²	32.6	3%	0.027	16%	0.155	C	C	.	.			trans	-70.7	124.5	162.1	-67.6	0	0	0	0	108.7	I1041 Y1044 P1498 A1499 A1514	I1041-C1512 WeakPolarHBondContact O-CB 3.38Å; Y1044-C1512 VanDerWaalsContact CE2-SG 3.56Å; P1498-C1512 CarbonylContact C-O 3.56Å; P1498-C1512 WeakPolarHBondContact CA-O 3.23Å; A1499-C1512 PolarHBondContact N-O 3.03Å; C1512-A1514 WeakPolarHBondContact CB-O 3.24Å; C1512-A1514 PolarHBondContact O-N 2.76Å
1513	P	90.5	Very high	91	Very high	19 Å²	19	32 Å²	32	12%	0.123	15%	0.153	C	C	.	.	S	Bend	trans	-66.2	-21.5	174.2	26.5	-36.2	0	0	0	113.1	I1041 W1494 L1497 P1498 A1511	I1041-P1513 VanDerWaalsContact O-CD 3.31Å; I1041-P1513 WeakPolarHBondContact O-CD 2.93Å; W1494-P1513 HydrophobicContact CD2-CG 4.01Å; W1494-P1513 HydrophobicContact CG-CB 4.07Å; W1494-P1513 HydrophobicContact CG-CG 3.97Å; W1494-P1513 HydrophobicContact CZ2-CG 4.24Å; W1494-P1513 VanDerWaalsContact NE1-CG 3.27Å; L1497-P1513 CarbonylContact C-O 3.53Å; P1498-P1513 VanDerWaalsContact CA-O 3.32Å; P1498-P1513 WeakPolarHBondContact CA-O 3.5Å; A1511-P1513 WeakPolarHBondContact O-CD 3.33Å
1514	A	92.2	Very high	91.7	Very high	0 Å²	0	29 Å²	29	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	122	171.7	0	0	0	0	0	110.4	I1000 F1001 G1040 I1041 W1494 S1496 L1497 C1512	I1000-A1514 HydrophobicContact CD1-CB 3.87Å; F1001-A1514 HydrophobicContact CE1-CB 4.02Å; F1001-A1514 HydrophobicContact CZ-CB 3.95Å; G1040-A1514 CarbonylContact C-O 3.56Å; G1040-A1514 WeakPolarHBondContact CA-O 3.34Å; I1041-A1514 HydrophobicContact CB-CB 4.34Å; I1041-A1514 PolarHBondContact N-O 3.41Å; W1494-A1514 HydrophobicContact CB-CB 4.31Å; S1496-A1514 WeakPolarHBondContact OG-CB 3.37Å; L1497-A1514 CarbonylContact O-C 3.58Å; L1497-A1514 WeakPolarHBondContact O-CA 3.47Å; C1512-A1514 WeakPolarHBondContact CB-O 3.24Å; C1512-A1514 PolarHBondContact O-N 2.76Å
1515	Q	94.4	Very high	92.4	Very high	6 Å²	6	24.4 Å²	24.4	3%	0.028	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	131.7	177.9	-175	80.5	10	0	0	112	A1039 D1055 L1497 A1499 T1517 S1518 I1519	A1039-Q1515 PolarHBondContact O-NE2 2.74Å; A1039-Q1515 VanDerWaalsContact O-NE2 3.12Å; A1039-Q1515 PolarHBondContact O-OE1 3.01Å; D1055-Q1515 PolarHBondContact OD1-NE2 3.27Å; L1497-Q1515 PolarHBondContact O-N 2.77Å; A1499-Q1515 VanDerWaalsContact CA-CB 3.5Å; A1499-Q1515 HydrophobicContact CB-CB 3.83Å; A1499-Q1515 HydrophobicContact CB-CG 3.79Å; Q1515-T1517 WeakPolarHBondContact CG-OG1 3.49Å; Q1515-T1517 PolarHBondContact O-N 3.25Å; Q1515-S1518 PolarHBondContact O-N 2.89Å; Q1515-I1519 PolarHBondContact O-N 2.76Å
1516	A	94.5	Very high	92.8	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-59.1	-46.4	-178.2	0	0	0	0	0	112.7	F1001 I1037 A1038 A1039 A1059 L1063 S1518 A1520	F1001-A1516 HydrophobicContact CB-CB 4.17Å; F1001-A1516 HydrophobicContact CD1-CB 3.9Å; F1001-A1516 HydrophobicContact CD2-CB 4.2Å; F1001-A1516 HydrophobicContact CE1-CB 4.36Å; F1001-A1516 HydrophobicContact CG-CB 3.81Å; I1037-A1516 HydrophobicContact CG2-CB 4.1Å; A1038-A1516 VanDerWaalsContact O-CB 3.29Å; A1038-A1516 WeakPolarHBondContact O-CB 3.42Å; A1039-A1516 WeakPolarHBondContact O-CB 3.39Å; A1039-A1516 PolarHBondContact O-N 3.19Å; A1059-A1516 HydrophobicContact CB-CB 3.84Å; L1063-A1516 HydrophobicContact CD1-CB 3.89Å; A1516-S1518 PolarHBondContact O-N 3.18Å; A1516-A1520 VanDerWaalsContact O-CB 3.24Å; A1516-A1520 WeakPolarHBondContact O-CB 3.38Å; A1516-A1520 PolarHBondContact O-N 2.88Å
1517	T	95.8	Very high	93.1	Very high	3 Å²	3	25.4 Å²	25.4	2%	0.018	11%	0.108	C	C	.	.	H	α-helix	trans	-66.2	-37.1	-179.8	54.1	0	0	0	0	112.3	D1055 I1058 A1059 W1449 Q1515 A1520 C1521	D1055-T1517 HydrophobicContact CB-CG2 4.22Å; I1058-T1517 HydrophobicContact CB-CG2 3.9Å; I1058-T1517 HydrophobicContact CG2-CG2 3.7Å; A1059-T1517 HydrophobicContact CB-CG2 4.16Å; W1449-T1517 WeakPolarHBondContact CB-O 3.26Å; Q1515-T1517 WeakPolarHBondContact CG-OG1 3.49Å; Q1515-T1517 PolarHBondContact O-N 3.25Å; T1517-A1520 PolarHBondContact O-N 3.41Å; T1517-C1521 WeakPolarHBondContact O-CB 3.49Å; T1517-C1521 PolarHBondContact O-N 3.09Å; T1517-C1521 PolarHBondContact O-SG 2.94Å
1518	S	95.9	Very high	93.2	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-63	-49.2	177.2	-58.9	0	0	0	0	111.8	P1498 Q1515 A1516 I1522	P1498-S1518 WeakPolarHBondContact O-CB 3.13Å; P1498-S1518 PolarHBondContact O-OG 3.2Å; Q1515-S1518 PolarHBondContact O-N 2.89Å; A1516-S1518 PolarHBondContact O-N 3.18Å; S1518-I1522 WeakPolarHBondContact O-CG1 3.5Å; S1518-I1522 PolarHBondContact O-N 2.83Å
1519	I	95.2	Very high	93.3	Very high	1 Å²	1	19.6 Å²	19.6	1%	0.005	9%	0.088	C	C	.	.	H	α-helix	trans	-63.2	-44.7	176.4	-65.7	-68.4	0	0	0	111	L994 F1001 L1063 L1497 Q1515 M1523	L994-I1519 HydrophobicContact CD2-CD1 3.49Å; L994-I1519 VanDerWaalsContact CD2-CD1 3.49Å; L994-I1519 HydrophobicContact CD2-CG2 4.29Å; F1001-I1519 HydrophobicContact CE2-CB 4.28Å; F1001-I1519 HydrophobicContact CE2-CG1 3.94Å; F1001-I1519 HydrophobicContact CZ-CG1 4.28Å; L1063-I1519 HydrophobicContact CD2-CB 4.26Å; L1063-I1519 HydrophobicContact CD2-CG2 3.87Å; L1497-I1519 HydrophobicContact CB-CD1 3.98Å; L1497-I1519 HydrophobicContact CB-CG1 4.48Å; L1497-I1519 HydrophobicContact CD1-CD1 4.15Å; L1497-I1519 HydrophobicContact CG-CD1 3.97Å; Q1515-I1519 PolarHBondContact O-N 2.76Å; I1519-M1523 WeakPolarHBondContact O-CB 3.49Å; I1519-M1523 PolarHBondContact O-N 2.89Å
1520	A	96.2	Very high	93.2	Very high	0 Å²	0	11.1 Å²	11.1	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-61.4	-53.2	-179	0	0	0	0	0	113.2	A1059 L1063 A1516 T1517 I1522 M1523 E1524	A1059-A1520 VanDerWaalsContact CA-CB 3.47Å; A1059-A1520 HydrophobicContact CB-CB 3.95Å; A1059-A1520 WeakPolarHBondContact O-CB 3.35Å; L1063-A1520 HydrophobicContact CD2-CB 4.13Å; L1063-A1520 HydrophobicContact CG-CB 4.11Å; A1516-A1520 VanDerWaalsContact O-CB 3.24Å; A1516-A1520 WeakPolarHBondContact O-CB 3.38Å; A1516-A1520 PolarHBondContact O-N 2.88Å; T1517-A1520 PolarHBondContact O-N 3.41Å; A1520-I1522 VanDerWaalsContact C-N 3.29Å; A1520-I1522 PolarHBondContact O-N 3.46Å; A1520-M1523 WeakPolarHBondContact O-CB 3.1Å; A1520-M1523 PolarHBondContact O-N 3.34Å; A1520-M1523 VanDerWaalsContact O-N 3.12Å; A1520-E1524 WeakPolarHBondContact O-CG 3.16Å; A1520-E1524 PolarHBondContact O-N 3.35Å
1521	C	97.2	Very high	93	Very high	0 Å²	0	10.7 Å²	10.7	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-69.8	-27.7	-173.5	-60.7	0	0	0	0	112.5	W1449 G1452 T1517 A1525	W1449-C1521 HydrophobicContact CB-CB 4.25Å; W1449-C1521 WeakPolarHBondContact O-CB 3.24Å; G1452-C1521 VanDerWaalsContact CA-O 3.26Å; G1452-C1521 WeakPolarHBondContact CA-O 3.34Å; T1517-C1521 WeakPolarHBondContact O-CB 3.49Å; T1517-C1521 PolarHBondContact O-N 3.09Å; T1517-C1521 PolarHBondContact O-SG 2.94Å; C1521-A1525 PolarHBondContact O-N 2.99Å; C1521-A1525 VanDerWaalsContact O-N 3.13Å
1522	I	96.8	Very high	92.3	Very high	0 Å²	0	11.1 Å²	11.1	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-72.8	-39.5	170.4	-62.9	-63.1	0	0	0	111.4	L994 M1451 L1455 L1482 L1497 S1518 A1520 E1524 A1525 L1526	L994-I1522 HydrophobicContact CD1-CG2 3.8Å; M1451-I1522 HydrophobicContact CB-CD1 4.04Å; M1451-I1522 HydrophobicContact CG-CD1 4.07Å; L1455-I1522 HydrophobicContact CD1-CD1 4.43Å; L1482-I1522 HydrophobicContact CD2-CD1 4.46Å; L1482-I1522 HydrophobicContact CD2-CG2 3.81Å; L1497-I1522 HydrophobicContact CD1-CB 4.28Å; L1497-I1522 HydrophobicContact CD1-CG1 3.85Å; S1518-I1522 WeakPolarHBondContact O-CG1 3.5Å; S1518-I1522 PolarHBondContact O-N 2.83Å; A1520-I1522 VanDerWaalsContact C-N 3.29Å; A1520-I1522 PolarHBondContact O-N 3.46Å; I1522-E1524 VanDerWaalsContact C-N 3.27Å; I1522-E1524 PolarHBondContact O-N 3.29Å; I1522-A1525 PolarHBondContact O-N 2.95Å; I1522-A1525 VanDerWaalsContact O-N 3.16Å; I1522-L1526 HydrophobicContact CG2-CD1 4.39Å; I1522-L1526 PolarHBondContact O-N 3.33Å
1523	M	95.4	Very high	90.6	Very high	1 Å²	1	12.4 Å²	12.4	1%	0.005	7%	0.065	C	C	.	.	H	α-helix	trans	-58.6	-40.1	171.2	-175.1	66.6	85	0	0	111.6	F983 V991 L994 A995 I1066 I1519 A1520 L1526 Y1527	F983-M1523 HydrophobicContact CE1-SD 3.74Å; F983-M1523 HydrophobicContact CZ-SD 4.39Å; V991-M1523 HydrophobicContact CG1-SD 4.22Å; L994-M1523 HydrophobicContact CB-CE 3.56Å; A995-M1523 HydrophobicContact CB-CE 3.71Å; A995-M1523 VanDerWaalsContact N-CE 3.29Å; I1066-M1523 HydrophobicContact CB-CG 4.49Å; I1066-M1523 HydrophobicContact CG2-CG 3.89Å; I1066-M1523 HydrophobicContact CG2-SD 4.44Å; I1519-M1523 WeakPolarHBondContact O-CB 3.49Å; I1519-M1523 PolarHBondContact O-N 2.89Å; A1520-M1523 WeakPolarHBondContact O-CB 3.1Å; A1520-M1523 PolarHBondContact O-N 3.34Å; A1520-M1523 VanDerWaalsContact O-N 3.12Å; M1523-L1526 PolarHBondContact O-N 2.93Å; M1523-Y1527 WeakPolarHBondContact O-CB 3.48Å; M1523-Y1527 PolarHBondContact O-N 3.31Å
1524	E	96.1	Very high	89	Confident	3 Å²	3	18.1 Å²	18.1	1%	0.014	9%	0.088	C	C	.	.	H	α-helix	trans	-63.7	-39.2	174.6	-70.8	-176.4	-136.5	0	0	112.9	R1061 G1062 I1066 R1456 A1520 I1522 Y1527 D1528	R1061-E1524 WeakPolarHBondContact CB-OE1 3.34Å; R1061-E1524 WeakPolarHBondContact CD-OE2 3.36Å; R1061-E1524 HydrophobicContact CG-CG 4.2Å; R1061-E1524 IonicContact CZ-OE2 3.37Å; R1061-E1524 IonicContact NE-OE2 2.68Å; R1061-E1524 VanDerWaalsContact NH1-CG 3.3Å; R1061-E1524 IonicContact NH1-OE2 3.72Å; R1061-E1524 PolarHBondContact NH1-OE2 3.14Å; G1062-E1524 PolarHBondContact N-OE1 2.96Å; I1066-E1524 HydrophobicContact CD1-CB 4.19Å; I1066-E1524 HydrophobicContact CD1-CG 3.56Å; R1456-E1524 IonicContact CZ-OE2 2.69Å; R1456-E1524 IonicContact NH1-OE2 3.89Å; R1456-E1524 PolarHBondContact NH1-OE2 3.31Å; R1456-E1524 IonicContact NH2-OE2 3.46Å; A1520-E1524 WeakPolarHBondContact O-CG 3.16Å; A1520-E1524 PolarHBondContact O-N 3.35Å; I1522-E1524 VanDerWaalsContact C-N 3.27Å; I1522-E1524 PolarHBondContact O-N 3.29Å; E1524-Y1527 PolarHBondContact O-N 3.18Å; E1524-D1528 VanDerWaalsContact O-CG 3.31Å; E1524-D1528 PolarHBondContact O-N 3.49Å
1525	A	95	Very high	87	Confident	0 Å²	0	24 Å²	24	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-65.7	-38.7	174.7	0	0	0	0	0	112.4	L1455 R1456 C1521 I1522 L1529	L1455-A1525 HydrophobicContact CB-CB 4.08Å; L1455-A1525 HydrophobicContact CD1-CB 4.23Å; R1456-A1525 HydrophobicContact CG-CB 3.94Å; C1521-A1525 PolarHBondContact O-N 2.99Å; C1521-A1525 VanDerWaalsContact O-N 3.13Å; I1522-A1525 PolarHBondContact O-N 2.95Å; I1522-A1525 VanDerWaalsContact O-N 3.16Å; A1525-L1529 VanDerWaalsContact O-CB 3.28Å; A1525-L1529 WeakPolarHBondContact O-CB 3.46Å; A1525-L1529 PolarHBondContact O-N 3.3Å
1526	L	93.4	Very high	84.7	Confident	10 Å²	10	27.3 Å²	27.3	5%	0.052	14%	0.138	C	C	.	.	H	α-helix	trans	-68.2	-35.9	175.6	-72.3	165.4	0	0	0	112.9	F983 L990 V991 L994 L1482 I1522 M1523 S1530	F983-L1526 HydrophobicContact CZ-CB 4.19Å; L990-L1526 HydrophobicContact CD2-CD1 3.88Å; L990-L1526 HydrophobicContact CD2-CD2 4.04Å; L990-L1526 HydrophobicContact CG-CD1 3.87Å; V991-L1526 HydrophobicContact CG2-CB 4.39Å; V991-L1526 HydrophobicContact CG2-CD1 4.17Å; L994-L1526 HydrophobicContact CD1-CD1 3.33Å; L1482-L1526 HydrophobicContact CD1-CD2 3.8Å; L1482-L1526 HydrophobicContact CD1-CG 4.5Å; I1522-L1526 HydrophobicContact CG2-CD1 4.39Å; I1522-L1526 PolarHBondContact O-N 3.33Å; M1523-L1526 PolarHBondContact O-N 2.93Å; L1526-S1530 WeakPolarHBondContact O-CB 3.35Å; L1526-S1530 PolarHBondContact O-N 2.86Å
1527	Y	93	Very high	82.1	Confident	58 Å²	58	33.4 Å²	33.4	23%	0.227	17%	0.166	C	C	.	.	H	α-helix	trans	-65.1	-47.4	174.9	-177.5	-100.1	0	0	0	111.6	F983 I1066 M1523 E1524 S1530 N1531	F983-Y1527 HydrophobicContact CB-CD2 4.22Å; F983-Y1527 HydrophobicContact CB-CE2 4.25Å; F983-Y1527 AromaticContact CD1-CD2 3.87Å; F983-Y1527 HydrophobicContact CD1-CD2 3.87Å; F983-Y1527 AromaticContact CD2-CD2 3.85Å; F983-Y1527 HydrophobicContact CD2-CD2 3.85Å; F983-Y1527 HydrophobicContact CE1-CD2 4.17Å; F983-Y1527 HydrophobicContact CE2-CD2 4.18Å; F983-Y1527 AromaticContact CG-CD2 3.68Å; F983-Y1527 HydrophobicContact CG-CD2 3.68Å; F983-Y1527 HydrophobicContact CG-CE2 4.22Å; F983-Y1527 HydrophobicContact CZ-CD2 4.32Å; I1066-Y1527 HydrophobicContact CD1-CD1 4.06Å; I1066-Y1527 HydrophobicContact CD1-CD2 4.46Å; I1066-Y1527 HydrophobicContact CD1-CG 3.84Å; I1066-Y1527 HydrophobicContact CG1-CD1 4.25Å; I1066-Y1527 HydrophobicContact CG1-CD2 4.17Å; I1066-Y1527 HydrophobicContact CG1-CG 3.99Å; I1066-Y1527 HydrophobicContact CG2-CD2 3.75Å; I1066-Y1527 HydrophobicContact CG2-CE2 4.49Å; I1066-Y1527 HydrophobicContact CG2-CG 4.08Å; M1523-Y1527 WeakPolarHBondContact O-CB 3.48Å; M1523-Y1527 PolarHBondContact O-N 3.31Å; E1524-Y1527 PolarHBondContact O-N 3.18Å; Y1527-S1530 WeakPolarHBondContact O-CB 3.5Å; Y1527-S1530 PolarHBondContact O-N 3.34Å; Y1527-N1531 WeakPolarHBondContact CD1-ND2 3.46Å; Y1527-N1531 WeakPolarHBondContact CE1-ND2 3.41Å; Y1527-N1531 PolarHBondContact O-N 3Å; Y1527-N1531 VanDerWaalsContact O-N 3.13Å; Y1527-N1531 PolarHBondContact O-ND2 3.42Å
1528	D	92	Very high	79.2	Confident	40 Å²	40	39.9 Å²	39.9	21%	0.214	22%	0.22	C	C	.	.	H	α-helix	trans	-65.4	-41.8	178.3	-64.7	-0.2	0	0	0	110.4	R1061 R1456 M1459 E1524 S1530 N1531 V1532	R1061-D1528 IonicContact NH2-OD1 3.74Å; R1061-D1528 PolarHBondContact NH2-OD1 3Å; R1456-D1528 HydrophobicContact CG-CB 4.5Å; R1456-D1528 IonicContact CZ-OD2 2.73Å; R1456-D1528 IonicContact NE-OD2 2.65Å; R1456-D1528 PolarHBondContact NE-OD2 3.25Å; R1456-D1528 IonicContact NH2-OD2 3.2Å; R1456-D1528 PolarHBondContact NH2-OD2 2.91Å; R1456-D1528 VanDerWaalsContact NH2-OD2 3.13Å; M1459-D1528 HydrophobicContact CE-CB 4.19Å; E1524-D1528 VanDerWaalsContact O-CG 3.31Å; E1524-D1528 PolarHBondContact O-N 3.49Å; D1528-S1530 VanDerWaalsContact C-N 3.25Å; D1528-S1530 PolarHBondContact O-N 3.23Å; D1528-N1531 PolarHBondContact O-N 2.99Å; D1528-V1532 WeakPolarHBondContact O-CG2 3.47Å; D1528-V1532 PolarHBondContact O-N 3.46Å; D1528-V1532 VanDerWaalsContact O-N 3.09Å
1529	L	89.9	Confident	78.3	Confident	4 Å²	4	41.9 Å²	41.9	2%	0.021	23%	0.231	C	C	.	.	H	α-helix	trans	-58.5	-32.3	172.7	178.2	63.5	0	0	0	113.5	N79 M1459 I1475 V1478 L1482 A1525	N79-L1529 HydrophobicContact CB-CD1 4.35Å; N79-L1529 HydrophobicContact CB-CG 4.35Å; M1459-L1529 HydrophobicContact CE-CB 4.26Å; M1459-L1529 HydrophobicContact SD-CB 3.8Å; M1459-L1529 HydrophobicContact SD-CD1 3.81Å; M1459-L1529 HydrophobicContact SD-CG 4.39Å; I1475-L1529 HydrophobicContact CG1-CD1 4.29Å; I1475-L1529 HydrophobicContact CG2-CD1 4.24Å; V1478-L1529 HydrophobicContact CG1-CD2 4.26Å; L1482-L1529 HydrophobicContact CD1-CD2 4.23Å; A1525-L1529 VanDerWaalsContact O-CB 3.28Å; A1525-L1529 WeakPolarHBondContact O-CB 3.46Å; A1525-L1529 PolarHBondContact O-N 3.3Å
1530	S	86.2	Confident	77.4	Confident	27 Å²	27	44.1 Å²	44.1	19%	0.189	24%	0.243	C	C	.	.	H	α-helix	trans	-77.9	-24.8	175.8	-171.7	0	0	0	0	113.5	N77 L1526 Y1527 D1528	N77-S1530 WeakPolarHBondContact ND2-CB 3.24Å; N77-S1530 PolarHBondContact ND2-OG 3.11Å; L1526-S1530 WeakPolarHBondContact O-CB 3.35Å; L1526-S1530 PolarHBondContact O-N 2.86Å; Y1527-S1530 WeakPolarHBondContact O-CB 3.5Å; Y1527-S1530 PolarHBondContact O-N 3.34Å; D1528-S1530 VanDerWaalsContact C-N 3.25Å; D1528-S1530 PolarHBondContact O-N 3.23Å
1531	N	83.6	Confident	76.4	Confident	39 Å²	39	46.5 Å²	46.5	21%	0.209	26%	0.256	C	S	.	.	H	α-helix	trans	-87.7	-31	-179.2	-74.3	-44.7	0	0	0	112.8	Y1527 D1528 M1533 K1534	Y1527-N1531 WeakPolarHBondContact CD1-ND2 3.46Å; Y1527-N1531 WeakPolarHBondContact CE1-ND2 3.41Å; Y1527-N1531 PolarHBondContact O-N 3Å; Y1527-N1531 VanDerWaalsContact O-N 3.13Å; Y1527-N1531 PolarHBondContact O-ND2 3.42Å; D1528-N1531 PolarHBondContact O-N 2.99Å; N1531-M1533 PolarHBondContact O-N 3.17Å; N1531-K1534 WeakPolarHBondContact O-CB 3.48Å; N1531-K1534 PolarHBondContact O-N 2.79Å; N1531-K1534 PolarHBondContact OD1-NZ 3.05Å
1532	V	74.1	Confident	75.2	Confident	18 Å²	18	49.2 Å²	49.2	11%	0.109	27%	0.271	C	S	.	.	H	α-helix	trans	-46.2	-35.4	171	163.3	0	0	0	0	112.3	M1463 I1475 D1528 K1534 D1535 D1536	M1463-V1532 HydrophobicContact CE-CG1 3.6Å; M1463-V1532 HydrophobicContact CE-CG2 4.47Å; M1463-V1532 HydrophobicContact CG-CG2 4.23Å; M1463-V1532 HydrophobicContact SD-CG1 3.68Å; M1463-V1532 HydrophobicContact SD-CG2 4.39Å; I1475-V1532 HydrophobicContact CD1-CG1 4.24Å; D1528-V1532 WeakPolarHBondContact O-CG2 3.47Å; D1528-V1532 PolarHBondContact O-N 3.46Å; D1528-V1532 VanDerWaalsContact O-N 3.09Å; V1532-K1534 PolarHBondContact O-N 3.43Å; V1532-D1535 PolarHBondContact O-N 2.98Å; V1532-D1536 PolarHBondContact O-N 3.37Å; V1532-D1536 VanDerWaalsContact O-N 3.14Å
1533	M	55.9	Low	73.8	Confident	32 Å²	32	52.3 Å²	52.3	16%	0.158	29%	0.288	C	S	.	.	H	α-helix	trans	-74.7	-17.6	178.8	-65.8	-142.4	69.6	0	0	115.9	K78 N79 N1531 D1535 Q1537	K78-M1533 HydrophobicContact CB-CE 3.66Å; K78-M1533 HydrophobicContact CB-SD 3.5Å; K78-M1533 VanDerWaalsContact CB-SD 3.5Å; K78-M1533 HydrophobicContact CD-CE 3.93Å; K78-M1533 HydrophobicContact CG-CE 4.47Å; N79-M1533 HydrophobicContact CB-SD 3.93Å; N79-M1533 VanDerWaalsContact ND2-CG 3.32Å; N79-M1533 WeakPolarHBondContact ND2-CG 3.34Å; N79-M1533 PolarHBondContact ND2-SD 3.38Å; N79-M1533 VanDerWaalsContact ND2-SD 3.44Å; N1531-M1533 PolarHBondContact O-N 3.17Å; M1533-D1535 VanDerWaalsContact C-N 3.33Å; M1533-Q1537 WeakPolarHBondContact O-CB 3.35Å; M1533-Q1537 VanDerWaalsContact O-CG 3.27Å; M1533-Q1537 WeakPolarHBondContact O-CG 3.49Å; M1533-Q1537 PolarHBondContact O-N 3.37Å
1534	K	55.8	Low	72.4	Confident	138 Å²	138	55.7 Å²	55.7	60%	0.6	31%	0.307	S	S	*	.	H	α-helix	trans	-73	-33.8	173.1	-71.8	178.1	-179.4	160.5	0	110.9	N1531 V1532 A1538	N1531-K1534 WeakPolarHBondContact O-CB 3.48Å; N1531-K1534 PolarHBondContact O-N 2.79Å; N1531-K1534 PolarHBondContact OD1-NZ 3.05Å; V1532-K1534 PolarHBondContact O-N 3.43Å; K1534-A1538 WeakPolarHBondContact O-CB 2.91Å; K1534-A1538 PolarHBondContact O-N 3.07Å
1535	D	50.1	Low	70.7	Confident	123 Å²	123	59.5 Å²	59.5	66%	0.658	33%	0.328	S	S	*	.	H	α-helix	trans	-82.2	-42	-178.7	-57.7	-21.3	0	0	0	110.8	V1532 M1533 Q1537 A1538	V1532-D1535 PolarHBondContact O-N 2.98Å; M1533-D1535 VanDerWaalsContact C-N 3.33Å; D1535-Q1537 PolarHBondContact O-N 2.95Å; D1535-Q1537 VanDerWaalsContact O-N 3.13Å; D1535-A1538 PolarHBondContact O-N 3.44Å
1536	D	47.5	Very low	68.8	Low	77 Å²	77	64.1 Å²	64.1	41%	0.412	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-10.3	172.4	-90.9	-9.2	0	0	0	114	H1471 V1532	H1471-D1536 IonicContact ND1-OD1 3.62Å; V1532-D1536 PolarHBondContact O-N 3.37Å; V1532-D1536 VanDerWaalsContact O-N 3.14Å
1537	Q	39.2	Very low	66.8	Low	128 Å²	128	68.6 Å²	68.6	60%	0.598	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.3	-6.3	175.7	-75.9	-156.4	-108.9	0	0	114.1	K78 M1533 D1535	K78-Q1537 VanDerWaalsContact NZ-NE2 3.11Å; M1533-Q1537 WeakPolarHBondContact O-CB 3.35Å; M1533-Q1537 VanDerWaalsContact O-CG 3.27Å; M1533-Q1537 WeakPolarHBondContact O-CG 3.49Å; M1533-Q1537 PolarHBondContact O-N 3.37Å; D1535-Q1537 PolarHBondContact O-N 2.95Å; D1535-Q1537 VanDerWaalsContact O-N 3.13Å
1538	A	33.9	Very low	64.4	Low	139 Å²	139	69.5 Å²	69.5	100%	1.149	39%	0.392	S	S	*	.			trans	-99.7	0	-178.3	0	0	0	0	0	111.9	K1534 D1535	K1534-A1538 WeakPolarHBondContact O-CB 2.91Å; K1534-A1538 PolarHBondContact O-N 3.07Å; D1535-A1538 PolarHBondContact O-N 3.44Å

Retrieved 1,538 of 1,538 residues in 1064.7 ms (Link to these results)

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