A0A087YEY5_POEFO Loading...

NPC1 like intracellular cholesterol transporter 1

AlphaFold DB , UniProt , Accession A0A087YEY5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,279 aa.

						>A0A087YEY5_POEFO|A0A087YEY5
VVLFFRGYLMSQILLYQASSEVEHRPGYCAFYDECGRNPTVGESLIPPIVPCLNYSRARQVTGDHYRRLKQVCPMLDFGESNTYACCSLQQIASLETSLTLSKAVLIRCPSCADNFAHLYCATTCSPNQTLTVNVTKVMNVTHLGRPRDAVVAYQAYISSTFAEGAFQSCKNVRIPATGGFAIATMCGRYGSKLCTAQRWYDFQGDTSNGLAPLDIDFRLLKENDTTGVPEGMIPYNGRALGCNENTTTGGMACSCQDCLDSCPRVPPPPPLPEPFRIQGMNGFLVISIILLCLLICAFVVYLIVSHYVKSKNGKNLSKTGRKEVTCADKTSMAAQAFMSRQFQRWGTLMASYPFTVLLVAAIIVVVFSVGLKSIKLTTDPVELWSAPNSRARQEKDFHDKHFTPFFRTNQLILTAPGRKGHLYDSLLFGKQNFSGLISKSLILELLDLQRRIQDIEFWSEDLNRTATLKDVCYAPLNPSNPSLTDCAVNSLPQYFQNSLDNINAKVNMTELGVTQEVDWRDHLIYCLNSPLSFKDITDLGMSCMADYGAPVFPFLAVGGYKSDEYTNAEAFILTFSLNNYLRDNPKFKVALQWETEFLKIVQDYQRNPKANFTFAYMAERSLEDEINRTTAEDIPIFMISYAVIFVYIAVALGEYSSCKRLLVDSKFLVGLGGILVVGCSVLASMGFYSWIGIPSSLVILQVVPFLVLAVGADNIFIFVLEYQRDARRLGETREEQIGRVLGQVAPSMLLCSLSESVCFFLAGALSTMPAVKSFALYAALAVLMDFVLQMTAFVALLSLDARRQDNNRCELLCCVTVSTRRPNKPNEGFLLPFMRKYYAPVLLHRFTRIIVMLVFIFMLCASIFLMLNVKVGLDQELAMPKGSYMLDYFQYLNKYFEVGVPVYFVTKKGYNFNTVEGMDGVCSSVGCDQFSMTQKIRYATDYPERSYMAIPANSWVDDFIDWLNPGSKCCRLYTSGPNAGNFCPANITGLSCLKKCLASPSDGVVRPTMEEFSRFLPDFLGNRPDLQCSKGGLGAYDTAVVRDQNGEIIATRFMAYHTPLTNSQEFTAALLKARELAKKITSDMRKIPGTSPDFEVFPYTITYVFYEQYLTIVKEGLFNISLCLLPTFVVCCLLLGLDLRSGLLNLITIIMIVVDTVGVMTLWSIDYNAVALINLVTAVGISVEFVSHMTRSFALSTKMTRVERAKEATATMGSAVFAGVAMTNLPGILVLAFAKAQLIQIFFFRLNLVITLLGMAHGLVFLPVLLSYFGPGVNKAVL
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	V	50.4	Low	45	Very low	165 Å²	165	138.5 Å²	138.5	100%	1	70%	0.702	S	S	*	*				0	-33.6	0	-173.1	0	0	0	0	113.2
2	V	44.8	Very low	44.8	Very low	130 Å²	130	136.6 Å²	136.6	79%	0.788	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80	-17.4	176.6	179.5	0	0	0	0	114.6
3	L	41.9	Very low	44.8	Very low	159 Å²	159	132.2 Å²	132.2	83%	0.832	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.8	-20.8	177.6	-87.8	150.6	0	0	0	114.6
4	F	44	Very low	44.1	Very low	187 Å²	187	131.5 Å²	131.5	82%	0.82	67%	0.665	S	S	*	*	H	α-helix	trans	-81.4	-28.2	-179.9	-123.6	-93.4	0	0	0	112.6
5	F	44.7	Very low	43.6	Very low	164 Å²	164	131.8 Å²	131.8	72%	0.719	67%	0.668	S	S	*	*	H	α-helix	trans	-78.6	-21.3	178.3	-103.3	-87	0	0	0	114
6	R	40.5	Very low	43.2	Very low	205 Å²	205	137.3 Å²	137.3	77%	0.774	68%	0.68	S	S	*	*	H	α-helix	trans	-78.9	-26.8	178.9	-116.4	178.6	176.5	178.4	-1.4	113.4	M10	R6-M10 WeakPolarHBondContact O-CB 3.39Å; R6-M10 PolarHBondContact O-N 2.99Å
7	G	44.4	Very low	42.5	Very low	48 Å²	48	138.1 Å²	138.1	50%	0.495	68%	0.682	S	S	.	*	H	α-helix	trans	-78.2	-36.3	176.4	0	0	0	0	0	113.9	S11	G7-S11 PolarHBondContact O-N 2.64Å; G7-S11 VanDerWaalsContact O-N 3.14Å
8	Y	48.4	Very low	41.8	Very low	170 Å²	170	135.1 Å²	135.1	67%	0.667	68%	0.682	S	S	*	*	H	α-helix	trans	-74.6	-34.7	-178.9	-153.2	-95.6	0	0	0	112.5	Q12	Y8-Q12 PolarHBondContact O-N 3.12Å
9	L	46.3	Very low	41.3	Very low	105 Å²	105	133.3 Å²	133.3	55%	0.55	68%	0.684	S	S	.	*	H	α-helix	trans	-74.8	-34.3	176.6	-150.3	79.4	0	0	0	112.3	Q12 I13	L9-Q12 PolarHBondContact O-N 3.32Å; L9-I13 HydrophobicContact CD2-CD1 4.29Å; L9-I13 HydrophobicContact CG-CD1 4.09Å; L9-I13 WeakPolarHBondContact O-CB 3.48Å; L9-I13 WeakPolarHBondContact O-CD1 3.37Å; L9-I13 WeakPolarHBondContact O-CG1 3.4Å; L9-I13 PolarHBondContact O-N 3.23Å
10	M	43.7	Very low	41.2	Very low	123 Å²	123	131.3 Å²	131.3	61%	0.606	68%	0.682	S	S	*	*	H	α-helix	trans	-69.1	-35.3	173.4	-102.2	-85.1	174	0	0	112.3	R6 I13 L14	R6-M10 WeakPolarHBondContact O-CB 3.39Å; R6-M10 PolarHBondContact O-N 2.99Å; M10-I13 PolarHBondContact O-N 3.12Å; M10-L14 WeakPolarHBondContact O-CB 3.15Å; M10-L14 PolarHBondContact O-N 2.88Å; M10-L14 HydrophobicContact SD-CD1 4.21Å
11	S	45.4	Very low	41.3	Very low	68 Å²	68	133.1 Å²	133.1	48%	0.476	69%	0.687	S	S	.	*	H	α-helix	trans	-69.3	-34.8	174.6	177.8	0	0	0	0	112.8	G7 L15	G7-S11 PolarHBondContact O-N 2.64Å; G7-S11 VanDerWaalsContact O-N 3.14Å; S11-L15 PolarHBondContact O-N 3.37Å
12	Q	43.4	Very low	41.6	Very low	115 Å²	115	128.1 Å²	128.1	54%	0.537	66%	0.657	S	S	.	*	H	α-helix	trans	-76.2	-32.7	173.8	-83.2	-163.9	-25.5	0	0	113.3	Y8 L9 L15 Y16	Y8-Q12 PolarHBondContact O-N 3.12Å; L9-Q12 PolarHBondContact O-N 3.32Å; Q12-L15 PolarHBondContact O-N 3.38Å; Q12-Y16 WeakPolarHBondContact O-CB 3.41Å; Q12-Y16 PolarHBondContact O-N 2.8Å
13	I	43.9	Very low	42.4	Very low	79 Å²	79	126.4 Å²	126.4	41%	0.405	64%	0.641	S	S	.	*	H	α-helix	trans	-73.3	-35.2	176.2	-67.5	166.2	0	0	0	111.1	L9 M10 L15 Y16 Q17	L9-I13 HydrophobicContact CD2-CD1 4.29Å; L9-I13 HydrophobicContact CG-CD1 4.09Å; L9-I13 WeakPolarHBondContact O-CB 3.48Å; L9-I13 WeakPolarHBondContact O-CD1 3.37Å; L9-I13 WeakPolarHBondContact O-CG1 3.4Å; L9-I13 PolarHBondContact O-N 3.23Å; M10-I13 PolarHBondContact O-N 3.12Å; I13-L15 VanDerWaalsContact C-N 3.32Å; I13-L15 PolarHBondContact O-N 3.16Å; I13-Y16 PolarHBondContact O-N 3.14Å; I13-Q17 WeakPolarHBondContact O-CB 3.48Å; I13-Q17 PolarHBondContact O-N 3.23Å
14	L	35.9	Very low	44.1	Very low	123 Å²	123	120.5 Å²	120.5	64%	0.644	61%	0.609	S	S	*	*	H	α-helix	trans	-70.3	-24.1	171.7	-86.3	153.6	0	0	0	113.7	M10	M10-L14 WeakPolarHBondContact O-CB 3.15Å; M10-L14 PolarHBondContact O-N 2.88Å; M10-L14 HydrophobicContact SD-CD1 4.21Å
15	L	36.8	Very low	45.8	Very low	136 Å²	136	117.4 Å²	117.4	71%	0.712	59%	0.592	S	S	*	*	H	α-helix	trans	-83.5	-20.4	171.4	-91.5	154.9	0	0	0	113.4	S11 Q12 I13	S11-L15 PolarHBondContact O-N 3.37Å; Q12-L15 PolarHBondContact O-N 3.38Å; I13-L15 VanDerWaalsContact C-N 3.32Å; I13-L15 PolarHBondContact O-N 3.16Å
16	Y	35.9	Very low	47.6	Very low	220 Å²	220	114 Å²	114	86%	0.863	59%	0.586	S	S	*	*	H	α-helix	trans	-98.7	-7.8	177.1	-123.1	-92	0	0	0	113.9	Q12 I13	Q12-Y16 WeakPolarHBondContact O-CB 3.41Å; Q12-Y16 PolarHBondContact O-N 2.8Å; I13-Y16 PolarHBondContact O-N 3.14Å
17	Q	31.3	Very low	49.7	Very low	150 Å²	150	105.5 Å²	105.5	70%	0.701	56%	0.563	S	S	*	*			trans	-111.2	27.5	173.9	-77.3	-173.5	-46.2	0	0	113.3	I13 S19	I13-Q17 WeakPolarHBondContact O-CB 3.48Å; I13-Q17 PolarHBondContact O-N 3.23Å; Q17-S19 PolarHBondContact O-N 3Å
18	A	31.1	Very low	51.8	Low	84 Å²	84	106.6 Å²	106.6	69%	0.694	55%	0.552	S	S	*	*			trans	-74.8	73.9	154.4	0	0	0	0	0	108.1	S20	A18-S20 PolarHBondContact O-N 3.04Å
19	S	32.5	Very low	53.9	Low	101 Å²	101	98.5 Å²	98.5	71%	0.706	52%	0.52	S	S	*	.			trans	-46.6	121	155	164.1	0	0	0	0	107	Q17 E21	Q17-S19 PolarHBondContact O-N 3Å; S19-E21 VanDerWaalsContact C-N 3.32Å; S19-E21 PolarHBondContact O-N 3.36Å
20	S	39.4	Very low	55.9	Low	94 Å²	94	93.5 Å²	93.5	66%	0.657	50%	0.495	S	S	*	.			trans	-53.9	85.5	178.8	53.8	0	0	0	0	111.9	A18 V22	A18-S20 PolarHBondContact O-N 3.04Å; S20-V22 PolarHBondContact O-N 2.96Å
21	E	43.4	Very low	58.2	Low	169 Å²	169	87.8 Å²	87.8	79%	0.79	47%	0.466	S	S	*	.			trans	-71.1	120	155.9	-82.2	-177.5	160.6	0	0	107.2	S19 E23	S19-E21 VanDerWaalsContact C-N 3.32Å; S19-E21 PolarHBondContact O-N 3.36Å; E21-E23 PolarHBondContact O-N 3.27Å
22	V	56.3	Low	60.2	Low	61 Å²	61	85.8 Å²	85.8	37%	0.37	45%	0.448	S	S	.	.			trans	-68.2	97.5	176.9	-178.5	0	0	0	0	107.6	S20 H24 Y55	S20-V22 PolarHBondContact O-N 2.96Å; V22-H24 WeakPolarHBondContact CG1-CE1 3.27Å; V22-Y55 HydrophobicContact CG1-CE1 3.87Å; V22-Y55 HydrophobicContact CG2-CE1 4.41Å; V22-Y55 HydrophobicContact CG2-CE2 4.2Å
23	E	61.7	Low	62.3	Low	93 Å²	93	82.1 Å²	82.1	44%	0.435	43%	0.433	S	S	.	.			trans	-90	109.8	173.3	-75.5	-175.7	146.1	0	0	110.3	E21 R25	E21-E23 PolarHBondContact O-N 3.27Å; E23-R25 VanDerWaalsContact C-N 3.28Å; E23-R25 HydrophobicContact CB-CG 4.13Å; E23-R25 VanDerWaalsContact CD-NH2 3.27Å; E23-R25 PolarHBondContact O-N 3.33Å; E23-R25 IonicContact OE1-CZ 3.05Å; E23-R25 IonicContact OE1-NE 3.65Å; E23-R25 IonicContact OE1-NH1 3.42Å; E23-R25 PolarHBondContact OE1-NH1 3.44Å; E23-R25 IonicContact OE1-NH2 2.64Å; E23-R25 PolarHBondContact OE1-NH2 3.43Å; E23-R25 WeakPolarHBondContact OE2-CD 3.13Å; E23-R25 IonicContact OE2-CZ 2.83Å; E23-R25 IonicContact OE2-NE 3.18Å; E23-R25 PolarHBondContact OE2-NE 3.48Å; E23-R25 IonicContact OE2-NH1 2.65Å; E23-R25 PolarHBondContact OE2-NH1 3.4Å; E23-R25 IonicContact OE2-NH2 3.35Å; E23-R25 PolarHBondContact OE2-NH2 2.89Å
24	H	76.9	Confident	64.4	Low	35 Å²	35	79.6 Å²	79.6	16%	0.162	42%	0.419	C	S	.	.			trans	-72.1	81.3	172	-58.6	-66.9	0	0	0	110.2	V22 T130 M233	V22-H24 WeakPolarHBondContact CG1-CE1 3.27Å; H24-T130 PolarHBondContact ND1-O 2.93Å; H24-M233 HydrophobicContact CB-CG 4.22Å; H24-M233 WeakPolarHBondContact CE1-CE 3.31Å; H24-M233 VanDerWaalsContact ND1-CE 3.33Å; H24-M233 WeakPolarHBondContact ND1-CE 3.33Å; H24-M233 WeakPolarHBondContact NE2-CE 3.18Å
25	R	79.4	Confident	66.7	Low	122 Å²	122	73.8 Å²	73.8	46%	0.46	39%	0.389	S	S	.	.			trans	-115.9	147.9	-179	-73.3	177.4	173.7	174.4	0.2	112.1	E23 Y28 T130	E23-R25 VanDerWaalsContact C-N 3.28Å; E23-R25 HydrophobicContact CB-CG 4.13Å; E23-R25 VanDerWaalsContact CD-NH2 3.27Å; E23-R25 PolarHBondContact O-N 3.33Å; E23-R25 IonicContact OE1-CZ 3.05Å; E23-R25 IonicContact OE1-NE 3.65Å; E23-R25 IonicContact OE1-NH1 3.42Å; E23-R25 PolarHBondContact OE1-NH1 3.44Å; E23-R25 IonicContact OE1-NH2 2.64Å; E23-R25 PolarHBondContact OE1-NH2 3.43Å; E23-R25 WeakPolarHBondContact OE2-CD 3.13Å; E23-R25 IonicContact OE2-CZ 2.83Å; E23-R25 IonicContact OE2-NE 3.18Å; E23-R25 PolarHBondContact OE2-NE 3.48Å; E23-R25 IonicContact OE2-NH1 2.65Å; E23-R25 PolarHBondContact OE2-NH1 3.4Å; E23-R25 IonicContact OE2-NH2 3.35Å; E23-R25 PolarHBondContact OE2-NH2 2.89Å; R25-Y28 HydrophobicContact CB-CD2 3.98Å; R25-Y28 HydrophobicContact CB-CE2 4.33Å; R25-T130 PolarHBondContact O-OG1 3.21Å
26	P	82.9	Confident	68.9	Low	92 Å²	92	68.4 Å²	68.4	60%	0.597	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	144.2	173.8	25.9	-33.6	0	0	0	111.3	L131	P26-L131 HydrophobicContact CB-CD1 4.19Å
27	G	84.9	Confident	71.1	Confident	28 Å²	28	66.7 Å²	66.7	29%	0.289	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.5	10.4	179	0	0	0	0	0	115.9	R57 A58 P127 N128	G27-R57 WeakPolarHBondContact O-CA 3.28Å; G27-A58 PolarHBondContact O-N 3.28Å; G27-P127 CarbonylContact C-O 3.57Å; G27-P127 VanDerWaalsContact C-O 3.32Å; G27-P127 VanDerWaalsContact CA-O 3.26Å; G27-P127 WeakPolarHBondContact CA-O 3.37Å; G27-N128 PolarHBondContact N-OD1 2.9Å
28	Y	89	Confident	73.6	Confident	70 Å²	70	59.8 Å²	59.8	28%	0.275	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	150.3	177.4	-76.2	-98.1	0	0	0	112.6	R25 S56 R57 P127 Q129 T130	R25-Y28 HydrophobicContact CB-CD2 3.98Å; R25-Y28 HydrophobicContact CB-CE2 4.33Å; Y28-S56 WeakPolarHBondContact CA-O 3.21Å; Y28-R57 HydrophobicContact CD1-CG 4.1Å; Y28-R57 HydrophobicContact CE1-CG 3.61Å; Y28-R57 HydrophobicContact CE2-CG 4.21Å; Y28-R57 PolarHBondContact OH-NE 3.01Å; Y28-P127 PolarHBondContact N-O 2.87Å; Y28-Q129 PolarHBondContact O-N 3.46Å; Y28-T130 PolarHBondContact O-N 3.47Å; Y28-T130 PolarHBondContact O-OG1 3.23Å
29	C	90.7	Very high	75.9	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	143.2	177.1	-47.4	0	0	0	0	110	Y55 S56 A58 C86 T130	C29-Y55 WeakPolarHBondContact O-CA 3.47Å; C29-S56 PolarHBondContact N-O 3.44Å; C29-S56 PolarHBondContact O-N 3.45Å; C29-A58 VanDerWaalsContact SG-CA 3.55Å; C29-C86 WeakPolarHBondContact CA-SG 3.38Å; C29-C86 HydrophobicContact CB-CB 3.55Å; C29-C86 WeakPolarHBondContact CB-SG 3.31Å; C29-C86 WeakPolarHBondContact SG-CA 3.46Å; C29-C86 WeakPolarHBondContact SG-CB 3.4Å; C29-C86 CovalentContact SG-SG 2.02Å; C29-C86 PolarHBondContact SG-SG 3.06Å; C29-T130 VanDerWaalsContact C-CG2 3.49Å
30	A	89.1	Confident	78	Confident	1 Å²	1	58.2 Å²	58.2	1%	0.008	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	-36.1	174.3	0	0	0	0	0	111.5	N54 Y55 Q129 T130 V135	A30-N54 CarbonylContact O-C 3.51Å; A30-N54 PolarHBondContact O-N 3.28Å; A30-N54 VanDerWaalsContact O-N 3.13Å; A30-Y55 HydrophobicContact CB-CE1 4.15Å; A30-Q129 HydrophobicContact CB-CG 4.36Å; A30-T130 HydrophobicContact CB-CG2 4.18Å; A30-V135 HydrophobicContact CB-CG2 4.14Å
31	F	91.6	Very high	79.8	Confident	3 Å²	3	54.7 Å²	54.7	1%	0.013	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	154.9	177.8	48	-104.9	0	0	0	111.1	P51 C52 Q129 V133 V135 V151 Y154	F31-P51 HydrophobicContact CB-CB 4.16Å; F31-P51 HydrophobicContact CB-CG 4.46Å; F31-P51 HydrophobicContact CD1-CG 4.4Å; F31-P51 HydrophobicContact CD2-CB 3.64Å; F31-P51 HydrophobicContact CD2-CG 3.82Å; F31-P51 HydrophobicContact CE2-CB 4.2Å; F31-P51 HydrophobicContact CE2-CG 4.04Å; F31-P51 HydrophobicContact CG-CB 4.02Å; F31-P51 HydrophobicContact CG-CG 4Å; F31-P51 HydrophobicContact CZ-CG 4.43Å; F31-C52 VanDerWaalsContact CA-O 3.27Å; F31-C52 WeakPolarHBondContact CA-O 3.46Å; F31-C52 WeakPolarHBondContact CB-O 3.39Å; F31-Q129 PolarHBondContact O-OE1 3.39Å; F31-V133 HydrophobicContact CE1-CG1 4.04Å; F31-V135 HydrophobicContact CD1-CG2 4.27Å; F31-V151 HydrophobicContact CB-CG2 4.2Å; F31-V151 HydrophobicContact CD1-CG2 4.37Å; F31-Y154 HydrophobicContact CE1-CD1 4.13Å; F31-Y154 HydrophobicContact CE1-CE1 4.13Å; F31-Y154 HydrophobicContact CZ-CE1 4.19Å
32	Y	88.6	Confident	80.9	Confident	25 Å²	25	50.2 Å²	50.2	10%	0.098	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	135.8	180	-171.1	-85.1	0	0	0	109.5	C52 R59 C86 C87	Y32-C52 PolarHBondContact N-O 2.91Å; Y32-R59 HydrophobicContact CE2-CG 4.26Å; Y32-R59 VanDerWaalsContact CZ-CZ 3.41Å; Y32-R59 VanDerWaalsContact CZ-NH1 3.29Å; Y32-R59 WeakPolarHBondContact OH-CD 3.28Å; Y32-R59 PolarHBondContact OH-NH1 2.96Å; Y32-C86 WeakPolarHBondContact CD2-O 3.49Å; Y32-C87 WeakPolarHBondContact CE2-O 3.4Å
33	D	87.8	Confident	81.2	Confident	39 Å²	39	55.8 Å²	55.8	21%	0.209	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	75.7	163.9	-176.7	-153.1	19.5	0	0	0	114.6	P51 C52 Q91 R148	D33-P51 WeakPolarHBondContact O-CA 3.3Å; D33-C52 PolarHBondContact O-N 2.96Å; D33-Q91 VanDerWaalsContact N-OE1 3.09Å; D33-Q91 PolarHBondContact O-NE2 2.86Å; D33-Q91 VanDerWaalsContact O-NE2 3.09Å; D33-R148 IonicContact OD2-CZ 3.57Å; D33-R148 IonicContact OD2-NH1 2.97Å; D33-R148 PolarHBondContact OD2-NH1 3.44Å; D33-R148 IonicContact OD2-NH2 3.58Å
34	E	87.3	Confident	81.6	Confident	25 Å²	25	53 Å²	53	12%	0.117	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	142.8	179.7	-62	-175	168.3	0	0	112.2	I49 C52 Q90 Q91 S94 H143	E34-I49 HydrophobicContact CB-CG2 4.15Å; E34-I49 HydrophobicContact CG-CG2 4.09Å; E34-C52 PolarHBondContact O-SG 3.17Å; E34-C52 VanDerWaalsContact O-SG 3.32Å; E34-Q90 HydrophobicContact CG-CB 4.4Å; E34-Q90 VanDerWaalsContact OE1-C 3.24Å; E34-Q91 HydrophobicContact CG-CG 3.54Å; E34-Q91 VanDerWaalsContact OE1-CA 3.3Å; E34-Q91 WeakPolarHBondContact OE1-CA 3.23Å; E34-Q91 PolarHBondContact OE1-N 2.93Å; E34-S94 WeakPolarHBondContact OE1-CB 3.39Å; E34-S94 PolarHBondContact OE1-OG 2.97Å; E34-H143 PolarHBondContact O-CE1 2.86Å; E34-H143 VanDerWaalsContact O-CE1 3.3Å
35	C	84.1	Confident	81.2	Confident	1 Å²	1	54 Å²	54	1%	0.007	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	2.1	-177.3	-101.5	0	0	0	0	114.2	V50 C52 R148 A150	C35-V50 PolarHBondContact N-O 3.05Å; C35-C52 WeakPolarHBondContact CA-SG 3.3Å; C35-C52 HydrophobicContact CB-CB 4.12Å; C35-C52 WeakPolarHBondContact CB-SG 3.33Å; C35-C52 PolarHBondContact N-SG 2.88Å; C35-C52 VanDerWaalsContact N-SG 3.4Å; C35-C52 WeakPolarHBondContact SG-CA 3.5Å; C35-C52 WeakPolarHBondContact SG-CB 2.91Å; C35-C52 CovalentContact SG-SG 2.02Å; C35-C52 PolarHBondContact SG-SG 2.85Å; C35-R148 WeakPolarHBondContact SG-CB 3.41Å; C35-A150 HydrophobicContact CB-CB 3.79Å
36	G	82.1	Confident	80.9	Confident	24 Å²	24	50 Å²	50	25%	0.247	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	100.3	-156.5	-176.8	0	0	0	0	0	113	I49 V50	G36-I49 WeakPolarHBondContact O-CA 3.43Å; G36-V50 WeakPolarHBondContact O-CG2 3.41Å; G36-V50 PolarHBondContact O-N 3.44Å
37	R	82.8	Confident	80.7	Confident	183 Å²	183	49.3 Å²	49.3	69%	0.691	28%	0.281	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.3	145.2	-177.3	-70	-173.9	-179.7	-171.2	-0.6	111.9	P39 P48	R37-P39 WeakPolarHBondContact O-CD 3.36Å; R37-P48 CarbonylContact C-O 3.58Å; R37-P48 WeakPolarHBondContact CA-O 3.35Å
38	N	83.4	Confident	80.5	Confident	5 Å²	5	48.4 Å²	48.4	3%	0.027	27%	0.27	C	S	.	.			trans	-65.8	119.9	173.1	-165.5	-15.6	0	0	0	110.6	T40 V41 P48 V50 P213	N38-T40 VanDerWaalsContact C-N 3.33Å; N38-T40 PolarHBondContact ND2-OG1 3.08Å; N38-T40 PolarHBondContact OD1-N 3.15Å; N38-T40 VanDerWaalsContact OD1-N 3.12Å; N38-T40 PolarHBondContact OD1-OG1 3.22Å; N38-V41 HydrophobicContact CB-CB 4.33Å; N38-V41 HydrophobicContact CB-CG2 4.23Å; N38-P48 HydrophobicContact CB-CB 4.01Å; N38-P48 HydrophobicContact CB-CG 4.23Å; N38-P48 PolarHBondContact N-O 2.96Å; N38-V50 HydrophobicContact CB-CG1 3.67Å; N38-V50 HydrophobicContact CB-CG2 4.48Å; N38-P213 PolarHBondContact ND2-O 3.22Å
39	P	79.3	Confident	80.3	Confident	81 Å²	81	47.9 Å²	47.9	53%	0.526	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-11.6	179.8	24.7	-22.6	0	0	0	114.1	R37 M139 V141	R37-P39 WeakPolarHBondContact O-CD 3.36Å; P39-M139 HydrophobicContact CB-CE 4.46Å; P39-M139 HydrophobicContact CG-CE 3.5Å; P39-M139 HydrophobicContact CG-SD 4.32Å; P39-V141 HydrophobicContact CG-CG2 4.13Å
40	T	77.4	Confident	80.2	Confident	71 Å²	71	48 Å²	48	44%	0.436	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-14.8	174	48.1	0	0	0	0	113.7	N38 M139	N38-T40 VanDerWaalsContact C-N 3.33Å; N38-T40 PolarHBondContact ND2-OG1 3.08Å; N38-T40 PolarHBondContact OD1-N 3.15Å; N38-T40 VanDerWaalsContact OD1-N 3.12Å; N38-T40 PolarHBondContact OD1-OG1 3.22Å; T40-M139 HydrophobicContact CG2-CE 3.26Å; T40-M139 HydrophobicContact CG2-SD 3.9Å
41	V	76.4	Confident	80.3	Confident	21 Å²	21	48.6 Å²	48.6	13%	0.127	28%	0.276	C	S	.	.			trans	-106.1	108.5	-177.5	-177.5	0	0	0	0	108.4	N38 P48 T207	N38-V41 HydrophobicContact CB-CB 4.33Å; N38-V41 HydrophobicContact CB-CG2 4.23Å; V41-P48 HydrophobicContact CB-CB 4.24Å; V41-P48 HydrophobicContact CB-CG 4.11Å; V41-P48 HydrophobicContact CG1-CB 4.22Å; V41-P48 HydrophobicContact CG1-CG 4.11Å; V41-T207 HydrophobicContact CG2-CG2 4.18Å
42	G	66.9	Low	80.2	Confident	75 Å²	75	48.7 Å²	48.7	77%	0.773	28%	0.277	S	S	*	.			trans	-75.6	-76.5	-178.6	0	0	0	0	0	113
43	E	63.8	Low	80.3	Confident	178 Å²	178	49.8 Å²	49.8	83%	0.832	28%	0.284	S	S	*	.	S	Bend	trans	-106.3	101.8	179.2	-69.9	-169.7	166.3	0	0	111.4	K535	E43-K535 PolarHBondContact O-NZ 3.27Å; E43-K535 VanDerWaalsContact O-NZ 3.08Å
44	S	69.9	Low	80.2	Confident	33 Å²	33	50.9 Å²	50.9	23%	0.231	29%	0.29	C	S	.	.			trans	-112.2	149.1	172.2	61	0	0	0	0	111.4	I46 P48 G210	S44-I46 VanDerWaalsContact CB-O 3.32Å; S44-I46 WeakPolarHBondContact CB-O 3.43Å; S44-I46 PolarHBondContact O-N 3.38Å; S44-I46 PolarHBondContact OG-O 3.07Å; S44-P48 VanDerWaalsContact OG-CD 3.27Å; S44-P48 WeakPolarHBondContact OG-CD 3.41Å; S44-G210 WeakPolarHBondContact CB-O 3.39Å
45	L	68.2	Low	80.3	Confident	57 Å²	57	53.6 Å²	53.6	30%	0.298	30%	0.3	S	S	.	.	S	Bend	trans	-68.1	-24.4	178.1	-68.1	177.5	0	0	0	112.3	G210 L211 K535 L1027	L45-G210 WeakPolarHBondContact CB-O 3.31Å; L45-G210 PolarHBondContact N-O 3.31Å; L45-L211 HydrophobicContact CB-CD2 4.12Å; L45-L211 HydrophobicContact CD1-CD2 3.95Å; L45-L211 HydrophobicContact CD1-CG 4.36Å; L45-K535 HydrophobicContact CD1-CB 4.29Å; L45-L1027 HydrophobicContact CB-CD2 3.98Å; L45-L1027 HydrophobicContact CD1-CD1 4.44Å; L45-L1027 HydrophobicContact CD1-CD2 4.36Å; L45-L1027 HydrophobicContact CD2-CD2 3.82Å; L45-L1027 HydrophobicContact CG-CD2 4.26Å
46	I	73.7	Confident	80.4	Confident	38 Å²	38	54.7 Å²	54.7	20%	0.195	31%	0.307	C	S	.	.	S	Bend	trans	-128.9	142.9	177.7	-57	176.5	0	0	0	108.4	S44 L101 L211	S44-I46 VanDerWaalsContact CB-O 3.32Å; S44-I46 WeakPolarHBondContact CB-O 3.43Å; S44-I46 PolarHBondContact O-N 3.38Å; S44-I46 PolarHBondContact OG-O 3.07Å; I46-L101 HydrophobicContact CD1-CD2 3.99Å; I46-L211 HydrophobicContact CD1-CD2 4.1Å; I46-L211 HydrophobicContact CG1-CD2 4.44Å
47	P	76.9	Confident	80.7	Confident	78 Å²	78	61.9 Å²	61.9	51%	0.506	33%	0.327	S	S	.	.			trans	-53.7	120.4	177	-26.2	34.7	0	0	0	112.1	I49	P47-I49 HydrophobicContact CB-CG1 4.45Å; P47-I49 PolarHBondContact O-N 3.23Å
48	P	81.4	Confident	81	Confident	9 Å²	9	54 Å²	54	6%	0.058	30%	0.301	C	S	.	.			trans	-86.5	81.6	-172.9	33	-28.2	0	0	0	108.9	R37 N38 V41 S44 P213	R37-P48 CarbonylContact C-O 3.58Å; R37-P48 WeakPolarHBondContact CA-O 3.35Å; N38-P48 HydrophobicContact CB-CB 4.01Å; N38-P48 HydrophobicContact CB-CG 4.23Å; N38-P48 PolarHBondContact N-O 2.96Å; V41-P48 HydrophobicContact CB-CB 4.24Å; V41-P48 HydrophobicContact CB-CG 4.11Å; V41-P48 HydrophobicContact CG1-CB 4.22Å; V41-P48 HydrophobicContact CG1-CG 4.11Å; S44-P48 VanDerWaalsContact OG-CD 3.27Å; S44-P48 WeakPolarHBondContact OG-CD 3.41Å; P48-P213 HydrophobicContact CB-CB 4.28Å
49	I	85.5	Confident	81.4	Confident	59 Å²	59	59 Å²	59	30%	0.303	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	131.4	-179.1	-58.6	175	0	0	0	109.5	E34 G36 P47	E34-I49 HydrophobicContact CB-CG2 4.15Å; E34-I49 HydrophobicContact CG-CG2 4.09Å; G36-I49 WeakPolarHBondContact O-CA 3.43Å; P47-I49 HydrophobicContact CB-CG1 4.45Å; P47-I49 PolarHBondContact O-N 3.23Å
50	V	88.3	Confident	81.9	Confident	2 Å²	2	60 Å²	60	1%	0.012	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	145.7	-176.3	-73.3	0	0	0	0	113	C35 G36 N38 A150 V151 L214	C35-V50 PolarHBondContact N-O 3.05Å; G36-V50 WeakPolarHBondContact O-CG2 3.41Å; G36-V50 PolarHBondContact O-N 3.44Å; N38-V50 HydrophobicContact CB-CG1 3.67Å; N38-V50 HydrophobicContact CB-CG2 4.48Å; V50-A150 HydrophobicContact CG2-CB 3.89Å; V50-V151 WeakPolarHBondContact CB-O 3.24Å; V50-L214 HydrophobicContact CG1-CB 4.01Å; V50-L214 HydrophobicContact CG1-CD2 4.25Å
51	P	90.9	Very high	82.4	Confident	13 Å²	13	56.6 Å²	56.6	8%	0.084	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	156.1	178.9	32.8	-33.2	0	0	0	112.3	F31 D33 V151	F31-P51 HydrophobicContact CB-CB 4.16Å; F31-P51 HydrophobicContact CB-CG 4.46Å; F31-P51 HydrophobicContact CD1-CG 4.4Å; F31-P51 HydrophobicContact CD2-CB 3.64Å; F31-P51 HydrophobicContact CD2-CG 3.82Å; F31-P51 HydrophobicContact CE2-CB 4.2Å; F31-P51 HydrophobicContact CE2-CG 4.04Å; F31-P51 HydrophobicContact CG-CB 4.02Å; F31-P51 HydrophobicContact CG-CG 4Å; F31-P51 HydrophobicContact CZ-CG 4.43Å; D33-P51 WeakPolarHBondContact O-CA 3.3Å; P51-V151 HydrophobicContact CG-CB 4.18Å; P51-V151 PolarHBondContact O-N 3.13Å
52	C	89.4	Confident	82.9	Confident	5 Å²	5	59.7 Å²	59.7	3%	0.034	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	134.5	173.8	-62.8	0	0	0	0	111.9	F31 Y32 D33 E34 C35 N54 R148	F31-C52 VanDerWaalsContact CA-O 3.27Å; F31-C52 WeakPolarHBondContact CA-O 3.46Å; F31-C52 WeakPolarHBondContact CB-O 3.39Å; Y32-C52 PolarHBondContact N-O 2.91Å; D33-C52 PolarHBondContact O-N 2.96Å; E34-C52 PolarHBondContact O-SG 3.17Å; E34-C52 VanDerWaalsContact O-SG 3.32Å; C35-C52 WeakPolarHBondContact CA-SG 3.3Å; C35-C52 HydrophobicContact CB-CB 4.12Å; C35-C52 WeakPolarHBondContact CB-SG 3.33Å; C35-C52 PolarHBondContact N-SG 2.88Å; C35-C52 VanDerWaalsContact N-SG 3.4Å; C35-C52 WeakPolarHBondContact SG-CA 3.5Å; C35-C52 WeakPolarHBondContact SG-CB 2.91Å; C35-C52 CovalentContact SG-SG 2.02Å; C35-C52 PolarHBondContact SG-SG 2.85Å; C52-N54 PolarHBondContact O-N 2.96Å; C52-R148 VanDerWaalsContact SG-CD 3.53Å
53	L	89.8	Confident	83.9	Confident	49 Å²	49	57.4 Å²	57.4	26%	0.257	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.6	123.5	171.1	-171.1	75	0	0	0	109.6	Y55 V135 V138 D149 V151	L53-Y55 HydrophobicContact CD1-CD2 4.44Å; L53-Y55 HydrophobicContact CD1-CE2 3.71Å; L53-Y55 HydrophobicContact CD2-CE2 4.09Å; L53-Y55 HydrophobicContact CG-CD2 4.39Å; L53-Y55 HydrophobicContact CG-CE2 3.99Å; L53-V135 HydrophobicContact CD1-CB 4.23Å; L53-V135 HydrophobicContact CD1-CG1 4.03Å; L53-V135 HydrophobicContact CD1-CG2 4.06Å; L53-V138 HydrophobicContact CB-CG1 4.48Å; L53-V138 HydrophobicContact CD1-CG1 4.33Å; L53-V138 HydrophobicContact CD2-CG1 4.22Å; L53-D149 HydrophobicContact CB-CB 4.07Å; L53-D149 HydrophobicContact CD2-CB 4.43Å; L53-D149 PolarHBondContact N-O 3.27Å; L53-V151 HydrophobicContact CB-CG2 4.01Å; L53-V151 HydrophobicContact CD1-CG2 4.02Å
54	N	87.6	Confident	85	Confident	61 Å²	61	54 Å²	54	33%	0.326	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.7	90.6	-178.6	-170.1	-11.9	0	0	0	110.8	A30 C52 S56	A30-N54 CarbonylContact O-C 3.51Å; A30-N54 PolarHBondContact O-N 3.28Å; A30-N54 VanDerWaalsContact O-N 3.13Å; C52-N54 PolarHBondContact O-N 2.96Å; N54-S56 PolarHBondContact O-N 3.24Å; N54-S56 PolarHBondContact O-OG 3.19Å
55	Y	87.8	Confident	85.8	Confident	83 Å²	83	54.2 Å²	54.2	33%	0.325	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	100.2	174.4	-67	-74.2	0	0	0	110.6	V22 C29 A30 L53 T130	V22-Y55 HydrophobicContact CG1-CE1 3.87Å; V22-Y55 HydrophobicContact CG2-CE1 4.41Å; V22-Y55 HydrophobicContact CG2-CE2 4.2Å; C29-Y55 WeakPolarHBondContact O-CA 3.47Å; A30-Y55 HydrophobicContact CB-CE1 4.15Å; L53-Y55 HydrophobicContact CD1-CD2 4.44Å; L53-Y55 HydrophobicContact CD1-CE2 3.71Å; L53-Y55 HydrophobicContact CD2-CE2 4.09Å; L53-Y55 HydrophobicContact CG-CD2 4.39Å; L53-Y55 HydrophobicContact CG-CE2 3.99Å; Y55-T130 HydrophobicContact CD1-CG2 4.48Å
56	S	87.5	Confident	86.8	Confident	24 Å²	24	52.4 Å²	52.4	17%	0.168	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	163.1	-176.1	60.6	0	0	0	0	111.8	Y28 C29 N54	Y28-S56 WeakPolarHBondContact CA-O 3.21Å; C29-S56 PolarHBondContact N-O 3.44Å; C29-S56 PolarHBondContact O-N 3.45Å; N54-S56 PolarHBondContact O-N 3.24Å; N54-S56 PolarHBondContact O-OG 3.19Å
57	R	88.7	Confident	87.4	Confident	174 Å²	174	57.6 Å²	57.6	66%	0.657	28%	0.283	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.2	146.8	173.4	-72.4	-174.1	-177.3	-174.9	1	110.9	G27 Y28	G27-R57 WeakPolarHBondContact O-CA 3.28Å; Y28-R57 HydrophobicContact CD1-CG 4.1Å; Y28-R57 HydrophobicContact CE1-CG 3.61Å; Y28-R57 HydrophobicContact CE2-CG 4.21Å; Y28-R57 PolarHBondContact OH-NE 3.01Å
58	A	89.1	Confident	87.8	Confident	17 Å²	17	57.8 Å²	57.8	14%	0.14	27%	0.274	C	S	.	.	P	Polyproline II helix	trans	-54.7	139.1	174	0	0	0	0	0	111.2	G27 C29 P127	G27-A58 PolarHBondContact O-N 3.28Å; C29-A58 VanDerWaalsContact SG-CA 3.55Å; A58-P127 HydrophobicContact CB-CB 3.88Å
59	R	90.5	Very high	88.2	Confident	111 Å²	111	57.5 Å²	57.5	42%	0.419	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	141.9	-175.6	-60	-173.3	-170.5	-173.7	-0.3	110.1	Y32 V61 Y84 A85	Y32-R59 HydrophobicContact CE2-CG 4.26Å; Y32-R59 VanDerWaalsContact CZ-CZ 3.41Å; Y32-R59 VanDerWaalsContact CZ-NH1 3.29Å; Y32-R59 WeakPolarHBondContact OH-CD 3.28Å; Y32-R59 PolarHBondContact OH-NH1 2.96Å; R59-V61 PolarHBondContact O-N 3.49Å; R59-Y84 CarbonylContact O-C 3.51Å; R59-Y84 VanDerWaalsContact O-CA 3.3Å; R59-Y84 WeakPolarHBondContact O-CA 3.43Å; R59-A85 PolarHBondContact N-O 2.81Å; R59-A85 VanDerWaalsContact N-O 3.08Å; R59-A85 PolarHBondContact O-N 3.03Å
60	Q	89.8	Confident	88.2	Confident	101 Å²	101	59.4 Å²	59.4	47%	0.472	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	131.6	172.2	-166.2	-179.1	18.7	0	0	109.3	T62 S81 Y84	Q60-T62 HydrophobicContact CG-CG2 4.41Å; Q60-S81 PolarHBondContact NE2-O 3.19Å; Q60-Y84 HydrophobicContact CB-CD1 4.11Å; Q60-Y84 HydrophobicContact CB-CE1 3.8Å; Q60-Y84 HydrophobicContact CG-CE1 4.34Å
61	V	87.8	Confident	88	Confident	1 Å²	1	65.3 Å²	65.3	1%	0.006	31%	0.305	C	S	.	.			trans	-105.4	120.2	-175.6	-179.1	0	0	0	0	109.2	R59 H65 Y66 L69 T83 A85	R59-V61 PolarHBondContact O-N 3.49Å; V61-H65 HydrophobicContact CG1-CB 3.75Å; V61-H65 VanDerWaalsContact CG1-CG 3.47Å; V61-Y66 VanDerWaalsContact CG1-N 3.31Å; V61-L69 HydrophobicContact CB-CD2 4.41Å; V61-L69 HydrophobicContact CG1-CD2 4.22Å; V61-L69 HydrophobicContact CG2-CD2 4.27Å; V61-T83 PolarHBondContact N-O 3.33Å; V61-A85 HydrophobicContact CG2-CB 3.58Å
62	T	87.9	Confident	87.7	Confident	85 Å²	85	65.1 Å²	65.1	52%	0.521	30%	0.304	S	S	.	.			trans	-132.8	159.8	-178.4	56.3	0	0	0	0	112.1	Q60 H65	Q60-T62 HydrophobicContact CG-CG2 4.41Å; T62-H65 PolarHBondContact O-N 3.48Å
63	G	88.4	Confident	87.6	Confident	27 Å²	27	64.9 Å²	64.9	28%	0.278	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.8	-133.3	174.2	0	0	0	0	0	114.1	H65 Y66 R67	G63-H65 PolarHBondContact O-N 2.95Å; G63-Y66 PolarHBondContact O-N 3.23Å; G63-Y66 VanDerWaalsContact O-N 3.11Å; G63-R67 PolarHBondContact O-N 2.99Å; G63-R67 VanDerWaalsContact O-N 3.1Å
64	D	85.2	Confident	87.4	Confident	108 Å²	108	64.3 Å²	64.3	58%	0.578	30%	0.301	S	S	*	.	H	α-helix	trans	-62.4	-31.4	-178.1	-66.9	-29.4	0	0	0	112.8	Y66 R67 R68	D64-Y66 VanDerWaalsContact C-N 3.35Å; D64-R67 PolarHBondContact O-N 3.01Å; D64-R67 IonicContact OD1-CZ 2.84Å; D64-R67 IonicContact OD1-NH1 3.94Å; D64-R67 PolarHBondContact OD1-NH1 2.89Å; D64-R67 IonicContact OD1-NH2 3.74Å; D64-R68 PolarHBondContact O-N 3.47Å
65	H	87.8	Confident	87.3	Confident	36 Å²	36	63.9 Å²	63.9	17%	0.167	30%	0.298	C	S	.	.	H	α-helix	trans	-65.5	-40	175.8	-168.3	-170.5	0	0	0	111.1	V61 T62 G63 R68 L69 C87 L89 I92	V61-H65 HydrophobicContact CG1-CB 3.75Å; V61-H65 VanDerWaalsContact CG1-CG 3.47Å; T62-H65 PolarHBondContact O-N 3.48Å; G63-H65 PolarHBondContact O-N 2.95Å; H65-R68 PolarHBondContact O-N 2.83Å; H65-L69 WeakPolarHBondContact O-CB 3.32Å; H65-L69 PolarHBondContact O-N 3.4Å; H65-C87 PolarHBondContact CE1-O 3.38Å; H65-C87 PolarHBondContact NE2-O 3Å; H65-L89 HydrophobicContact CB-CD1 4.08Å; H65-I92 WeakPolarHBondContact NE2-CD1 3.45Å
66	Y	88.4	Confident	87.2	Confident	19 Å²	19	60.5 Å²	60.5	8%	0.075	29%	0.286	C	S	.	.	H	α-helix	trans	-67	-45.1	176	172.5	-107.6	0	0	0	111.5	V61 G63 D64 R68 L69 K70 D77 E80 T83	V61-Y66 VanDerWaalsContact CG1-N 3.31Å; G63-Y66 PolarHBondContact O-N 3.23Å; G63-Y66 VanDerWaalsContact O-N 3.11Å; D64-Y66 VanDerWaalsContact C-N 3.35Å; Y66-R68 VanDerWaalsContact C-N 3.29Å; Y66-R68 PolarHBondContact O-N 3.45Å; Y66-L69 PolarHBondContact O-N 2.86Å; Y66-K70 HydrophobicContact CE1-CD 4.37Å; Y66-K70 WeakPolarHBondContact O-CB 3.28Å; Y66-K70 PolarHBondContact O-N 3.35Å; Y66-D77 VanDerWaalsContact CE2-OD1 3.25Å; Y66-D77 WeakPolarHBondContact CE2-OD1 3.3Å; Y66-D77 VanDerWaalsContact OH-CG 3.23Å; Y66-D77 PolarHBondContact OH-OD1 3.31Å; Y66-D77 PolarHBondContact OH-OD2 3.39Å; Y66-E80 HydrophobicContact CD1-CB 3.9Å; Y66-E80 HydrophobicContact CD1-CG 3.66Å; Y66-E80 HydrophobicContact CE1-CB 3.62Å; Y66-E80 HydrophobicContact CE1-CG 3.92Å; Y66-E80 HydrophobicContact CE2-CB 4.45Å; Y66-E80 HydrophobicContact CG-CB 4.43Å; Y66-E80 HydrophobicContact CG-CG 4.13Å; Y66-T83 HydrophobicContact CD2-CG2 4.47Å
67	R	86.4	Confident	87.1	Confident	147 Å²	147	61.5 Å²	61.5	56%	0.555	29%	0.289	S	S	*	.	H	α-helix	trans	-59.1	-41.9	177.3	-64.6	-170.2	-147.4	128.1	10.7	111.7	G63 D64 Q71	G63-R67 PolarHBondContact O-N 2.99Å; G63-R67 VanDerWaalsContact O-N 3.1Å; D64-R67 PolarHBondContact O-N 3.01Å; D64-R67 IonicContact OD1-CZ 2.84Å; D64-R67 IonicContact OD1-NH1 3.94Å; D64-R67 PolarHBondContact OD1-NH1 2.89Å; D64-R67 IonicContact OD1-NH2 3.74Å; R67-Q71 VanDerWaalsContact O-CG 3.28Å; R67-Q71 WeakPolarHBondContact O-CG 3.45Å; R67-Q71 PolarHBondContact O-N 3.38Å; R67-Q71 VanDerWaalsContact O-N 3.11Å
68	R	86.4	Confident	86.9	Confident	82 Å²	82	59.5 Å²	59.5	31%	0.309	29%	0.285	S	S	.	.	H	α-helix	trans	-71.7	-40.6	179.8	-161.1	57.1	164.7	-178.4	-6.5	112.3	D64 H65 Y66 K70 Q71 V72 L89 I92 E96	D64-R68 PolarHBondContact O-N 3.47Å; H65-R68 PolarHBondContact O-N 2.83Å; Y66-R68 VanDerWaalsContact C-N 3.29Å; Y66-R68 PolarHBondContact O-N 3.45Å; R68-K70 VanDerWaalsContact C-N 3.34Å; R68-K70 PolarHBondContact O-N 3.42Å; R68-Q71 PolarHBondContact O-N 3.46Å; R68-V72 WeakPolarHBondContact O-CG2 3.47Å; R68-V72 PolarHBondContact O-N 3.2Å; R68-L89 HydrophobicContact CB-CD1 4.32Å; R68-I92 HydrophobicContact CB-CG2 4.48Å; R68-I92 HydrophobicContact CG-CG2 3.76Å; R68-E96 VanDerWaalsContact CZ-CD 3.47Å; R68-E96 IonicContact CZ-OE1 2.67Å; R68-E96 VanDerWaalsContact CZ-OE1 3.27Å; R68-E96 IonicContact CZ-OE2 3Å; R68-E96 IonicContact NE-OE2 2.74Å; R68-E96 PolarHBondContact NE-OE2 2.84Å; R68-E96 IonicContact NH1-OE1 2.64Å; R68-E96 IonicContact NH1-OE2 3.94Å; R68-E96 IonicContact NH2-OE1 2.95Å; R68-E96 PolarHBondContact NH2-OE1 3.44Å; R68-E96 IonicContact NH2-OE2 3.96Å; R68-E96 PolarHBondContact NH2-OE2 3.06Å
69	L	88.3	Confident	86.6	Confident	3 Å²	3	60.1 Å²	60.1	2%	0.016	29%	0.293	C	S	.	.	H	α-helix	trans	-59.6	-45.2	174.3	-177.1	68.1	0	0	0	111.3	V61 H65 Y66 Q71 V72 C73 T83 A85 I92 C125	V61-L69 HydrophobicContact CB-CD2 4.41Å; V61-L69 HydrophobicContact CG1-CD2 4.22Å; V61-L69 HydrophobicContact CG2-CD2 4.27Å; H65-L69 WeakPolarHBondContact O-CB 3.32Å; H65-L69 PolarHBondContact O-N 3.4Å; Y66-L69 PolarHBondContact O-N 2.86Å; L69-Q71 VanDerWaalsContact C-N 3.31Å; L69-Q71 PolarHBondContact O-N 2.78Å; L69-V72 PolarHBondContact O-N 3.08Å; L69-C73 HydrophobicContact CD1-CB 4.07Å; L69-C73 CarbonylContact O-C 3.6Å; L69-C73 WeakPolarHBondContact O-CA 3.39Å; L69-C73 PolarHBondContact O-N 3.43Å; L69-T83 HydrophobicContact CD2-CG2 3.66Å; L69-A85 HydrophobicContact CD2-CB 3.9Å; L69-I92 HydrophobicContact CB-CD1 4.09Å; L69-I92 HydrophobicContact CD1-CD1 3.95Å; L69-C125 HydrophobicContact CD1-CB 4.24Å
70	K	86.8	Confident	86	Confident	99 Å²	99	59.9 Å²	59.9	43%	0.43	30%	0.297	S	S	.	.	H	α-helix	trans	-62	-36.4	176.7	-176.3	172.9	-176.1	133.7	0	113	Y66 R68 P74 D77	Y66-K70 HydrophobicContact CE1-CD 4.37Å; Y66-K70 WeakPolarHBondContact O-CB 3.28Å; Y66-K70 PolarHBondContact O-N 3.35Å; R68-K70 VanDerWaalsContact C-N 3.34Å; R68-K70 PolarHBondContact O-N 3.42Å; K70-P74 WeakPolarHBondContact O-CA 3.25Å; K70-P74 WeakPolarHBondContact O-CB 3.26Å; K70-D77 WeakPolarHBondContact CD-OD2 3.48Å; K70-D77 VanDerWaalsContact CE-OD2 3.28Å; K70-D77 WeakPolarHBondContact CE-OD2 3.3Å; K70-D77 IonicContact NZ-OD2 2.79Å; K70-D77 PolarHBondContact NZ-OD2 3.44Å
71	Q	83	Confident	85.5	Confident	127 Å²	127	58.8 Å²	58.8	59%	0.593	30%	0.3	S	S	*	.	H	α-helix	trans	-70.8	-39.7	178	-76.7	173.8	-6.3	0	0	113.1	R67 R68 L69	R67-Q71 VanDerWaalsContact O-CG 3.28Å; R67-Q71 WeakPolarHBondContact O-CG 3.45Å; R67-Q71 PolarHBondContact O-N 3.38Å; R67-Q71 VanDerWaalsContact O-N 3.11Å; R68-Q71 PolarHBondContact O-N 3.46Å; L69-Q71 VanDerWaalsContact C-N 3.31Å; L69-Q71 PolarHBondContact O-N 2.78Å
72	V	84.6	Confident	85.3	Confident	8 Å²	8	63.7 Å²	63.7	5%	0.048	33%	0.326	C	S	.	.	H	α-helix	trans	-91.3	-39	-173.8	-178.5	0	0	0	0	111.8	R68 L69 I92 L95 E96	R68-V72 WeakPolarHBondContact O-CG2 3.47Å; R68-V72 PolarHBondContact O-N 3.2Å; L69-V72 PolarHBondContact O-N 3.08Å; V72-I92 HydrophobicContact CB-CG2 3.96Å; V72-I92 HydrophobicContact CG1-CG2 4.33Å; V72-I92 HydrophobicContact CG2-CG2 3.74Å; V72-L95 HydrophobicContact CG1-CD2 4.48Å; V72-E96 HydrophobicContact CG1-CB 4.29Å; V72-E96 HydrophobicContact CG2-CB 3.97Å; V72-E96 HydrophobicContact CG2-CG 4.13Å
73	C	88.8	Confident	85.4	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	30%	0.302	C	S	.	.			trans	-131.3	63.3	-172.1	-58.1	0	0	0	0	111.3	L69 M75 L76 C121	L69-C73 HydrophobicContact CD1-CB 4.07Å; L69-C73 CarbonylContact O-C 3.6Å; L69-C73 WeakPolarHBondContact O-CA 3.39Å; L69-C73 PolarHBondContact O-N 3.43Å; C73-M75 VanDerWaalsContact C-N 3.26Å; C73-M75 VanDerWaalsContact C-SD 3.59Å; C73-M75 HydrophobicContact CB-CE 3.68Å; C73-M75 HydrophobicContact CB-SD 4.4Å; C73-M75 PolarHBondContact O-N 2.85Å; C73-L76 HydrophobicContact CB-CD1 4.22Å; C73-L76 PolarHBondContact O-N 2.96Å; C73-L76 VanDerWaalsContact O-N 3.12Å; C73-C121 VanDerWaalsContact CA-SG 3.59Å; C73-C121 HydrophobicContact CB-CB 3.65Å; C73-C121 WeakPolarHBondContact CB-SG 3.35Å; C73-C121 WeakPolarHBondContact SG-CB 3.35Å; C73-C121 CovalentContact SG-SG 2.03Å; C73-C121 PolarHBondContact SG-SG 3Å
74	P	85.6	Confident	85.5	Confident	37 Å²	37	63.6 Å²	63.6	24%	0.24	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-61.4	-27.7	-172.2	24.1	-35	0	0	0	114.5	K70 L76 D77 T249	K70-P74 WeakPolarHBondContact O-CA 3.25Å; K70-P74 WeakPolarHBondContact O-CB 3.26Å; P74-L76 PolarHBondContact O-N 2.89Å; P74-D77 VanDerWaalsContact O-CB 3.22Å; P74-D77 WeakPolarHBondContact O-CB 3.38Å; P74-D77 PolarHBondContact O-N 3.28Å; P74-D77 VanDerWaalsContact O-N 3.13Å; P74-T249 HydrophobicContact CB-CG2 3.83Å; P74-T249 HydrophobicContact CG-CG2 3.65Å
75	M	84.3	Confident	85.8	Confident	52 Å²	52	58.5 Å²	58.5	26%	0.256	28%	0.282	S	S	.	.	G	3₁₀ helix	trans	-69.2	-11.6	177.6	62.7	-75.6	171.9	0	0	114.7	C73 C121	C73-M75 VanDerWaalsContact C-N 3.26Å; C73-M75 VanDerWaalsContact C-SD 3.59Å; C73-M75 HydrophobicContact CB-CE 3.68Å; C73-M75 HydrophobicContact CB-SD 4.4Å; C73-M75 PolarHBondContact O-N 2.85Å; M75-C121 HydrophobicContact CE-CB 2.91Å; M75-C121 WeakPolarHBondContact CE-SG 3.49Å
76	L	86.5	Confident	86	Confident	13 Å²	13	56.8 Å²	56.8	7%	0.068	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-95.5	4.9	173.5	-61.7	178.8	0	0	0	112.3	C73 P74 F78 T83 C121 C125	C73-L76 HydrophobicContact CB-CD1 4.22Å; C73-L76 PolarHBondContact O-N 2.96Å; C73-L76 VanDerWaalsContact O-N 3.12Å; P74-L76 PolarHBondContact O-N 2.89Å; L76-F78 VanDerWaalsContact O-CD2 3.32Å; L76-F78 WeakPolarHBondContact O-CD2 3.3Å; L76-F78 PolarHBondContact O-N 2.75Å; L76-T83 WeakPolarHBondContact O-CG2 3.33Å; L76-C121 HydrophobicContact CD1-CB 4.41Å; L76-C125 HydrophobicContact CD1-CB 3.76Å
77	D	85.4	Confident	86.2	Confident	45 Å²	45	55.9 Å²	55.9	24%	0.241	27%	0.27	C	S	.	.			trans	-79.1	115.1	178.4	-174.9	13.2	0	0	0	111.3	Y66 K70 P74 G79	Y66-D77 VanDerWaalsContact CE2-OD1 3.25Å; Y66-D77 WeakPolarHBondContact CE2-OD1 3.3Å; Y66-D77 VanDerWaalsContact OH-CG 3.23Å; Y66-D77 PolarHBondContact OH-OD1 3.31Å; Y66-D77 PolarHBondContact OH-OD2 3.39Å; K70-D77 WeakPolarHBondContact CD-OD2 3.48Å; K70-D77 VanDerWaalsContact CE-OD2 3.28Å; K70-D77 WeakPolarHBondContact CE-OD2 3.3Å; K70-D77 IonicContact NZ-OD2 2.79Å; K70-D77 PolarHBondContact NZ-OD2 3.44Å; P74-D77 VanDerWaalsContact O-CB 3.22Å; P74-D77 WeakPolarHBondContact O-CB 3.38Å; P74-D77 PolarHBondContact O-N 3.28Å; P74-D77 VanDerWaalsContact O-N 3.13Å; D77-G79 PolarHBondContact OD1-N 3.43Å
78	F	84.3	Confident	86.4	Confident	132 Å²	132	49.4 Å²	49.4	58%	0.579	25%	0.247	S	C	*	.	S	Bend	trans	-114.4	16.1	172.4	-59.1	-77.5	0	0	0	112.3	L76 T83	L76-F78 VanDerWaalsContact O-CD2 3.32Å; L76-F78 WeakPolarHBondContact O-CD2 3.3Å; L76-F78 PolarHBondContact O-N 2.75Å; F78-T83 PolarHBondContact N-OG1 3.46Å; F78-T83 VanDerWaalsContact N-OG1 3.12Å
79	G	81.8	Confident	86.5	Confident	29 Å²	29	49.7 Å²	49.7	30%	0.299	26%	0.255	S	S	.	.			trans	97.6	150.7	-174	0	0	0	0	0	113.1	D77 S81 N82 T83	D77-G79 PolarHBondContact OD1-N 3.43Å; G79-S81 VanDerWaalsContact C-N 3.25Å; G79-S81 PolarHBondContact O-N 2.92Å; G79-S81 VanDerWaalsContact O-N 3.14Å; G79-N82 PolarHBondContact O-N 2.96Å; G79-T83 PolarHBondContact N-OG1 2.74Å; G79-T83 WeakPolarHBondContact O-CB 3.34Å; G79-T83 PolarHBondContact O-N 2.77Å; G79-T83 VanDerWaalsContact O-N 3.07Å; G79-T83 PolarHBondContact O-OG1 3.21Å
80	E	78.7	Confident	86.5	Confident	107 Å²	107	54.9 Å²	54.9	50%	0.5	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58	-31.5	-169.3	-172.7	167.3	-162.9	0	0	114.1	Y66	Y66-E80 HydrophobicContact CD1-CB 3.9Å; Y66-E80 HydrophobicContact CD1-CG 3.66Å; Y66-E80 HydrophobicContact CE1-CB 3.62Å; Y66-E80 HydrophobicContact CE1-CG 3.92Å; Y66-E80 HydrophobicContact CE2-CB 4.45Å; Y66-E80 HydrophobicContact CG-CB 4.43Å; Y66-E80 HydrophobicContact CG-CG 4.13Å
81	S	79	Confident	86.6	Confident	78 Å²	78	50.7 Å²	50.7	55%	0.545	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	-17.9	178	63.1	0	0	0	0	114.2	Q60 G79	Q60-S81 PolarHBondContact NE2-O 3.19Å; G79-S81 VanDerWaalsContact C-N 3.25Å; G79-S81 PolarHBondContact O-N 2.92Å; G79-S81 VanDerWaalsContact O-N 3.14Å
82	N	84.8	Confident	86.9	Confident	104 Å²	104	44.6 Å²	44.6	56%	0.556	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-115.2	-0.5	-168.8	-69.1	-6.6	0	0	0	113.5	G79 Y84	G79-N82 PolarHBondContact O-N 2.96Å; N82-Y84 WeakPolarHBondContact O-CD2 3.44Å
83	T	88.6	Confident	87	Confident	1 Å²	1	46.2 Å²	46.2	1%	0.006	25%	0.247	C	C	.	.			trans	-85.7	119	-177	-57.1	0	0	0	0	111	V61 Y66 L69 L76 F78 G79	V61-T83 PolarHBondContact N-O 3.33Å; Y66-T83 HydrophobicContact CD2-CG2 4.47Å; L69-T83 HydrophobicContact CD2-CG2 3.66Å; L76-T83 WeakPolarHBondContact O-CG2 3.33Å; F78-T83 PolarHBondContact N-OG1 3.46Å; F78-T83 VanDerWaalsContact N-OG1 3.12Å; G79-T83 PolarHBondContact N-OG1 2.74Å; G79-T83 WeakPolarHBondContact O-CB 3.34Å; G79-T83 PolarHBondContact O-N 2.77Å; G79-T83 VanDerWaalsContact O-N 3.07Å; G79-T83 PolarHBondContact O-OG1 3.21Å
84	Y	90.8	Very high	86.8	Confident	109 Å²	109	47.9 Å²	47.9	43%	0.427	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	140.3	172.2	-68.1	-98.5	0	0	0	109.3	R59 Q60 N82 P127	R59-Y84 CarbonylContact O-C 3.51Å; R59-Y84 VanDerWaalsContact O-CA 3.3Å; R59-Y84 WeakPolarHBondContact O-CA 3.43Å; Q60-Y84 HydrophobicContact CB-CD1 4.11Å; Q60-Y84 HydrophobicContact CB-CE1 3.8Å; Q60-Y84 HydrophobicContact CG-CE1 4.34Å; N82-Y84 WeakPolarHBondContact O-CD2 3.44Å; Y84-P127 WeakPolarHBondContact O-CB 3.5Å
85	A	91.2	Very high	86.9	Confident	1 Å²	1	46.8 Å²	46.8	1%	0.008	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	157.9	177.8	0	0	0	0	0	112.3	R59 V61 L69 C125	R59-A85 PolarHBondContact N-O 2.81Å; R59-A85 VanDerWaalsContact N-O 3.08Å; R59-A85 PolarHBondContact O-N 3.03Å; V61-A85 HydrophobicContact CG2-CB 3.58Å; L69-A85 HydrophobicContact CD2-CB 3.9Å; A85-C125 WeakPolarHBondContact CA-O 3.49Å; A85-C125 WeakPolarHBondContact CB-O 3.42Å
86	C	92.6	Very high	86.9	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	25%	0.249	C	C	.	.	S	Bend	trans	-100.2	14.2	179.6	-74.6	0	0	0	0	114.3	C29 Y32 C125 S126 Q129	C29-C86 WeakPolarHBondContact CA-SG 3.38Å; C29-C86 HydrophobicContact CB-CB 3.55Å; C29-C86 WeakPolarHBondContact CB-SG 3.31Å; C29-C86 WeakPolarHBondContact SG-CA 3.46Å; C29-C86 WeakPolarHBondContact SG-CB 3.4Å; C29-C86 CovalentContact SG-SG 2.02Å; C29-C86 PolarHBondContact SG-SG 3.06Å; Y32-C86 WeakPolarHBondContact CD2-O 3.49Å; C86-C125 PolarHBondContact N-O 3.18Å; C86-S126 WeakPolarHBondContact CB-O 3.49Å; C86-S126 PolarHBondContact SG-O 3.27Å; C86-Q129 HydrophobicContact CB-CB 4.35Å
87	C	91.6	Very high	86.7	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	27%	0.266	C	S	.	.			trans	-121.7	158.2	-178.7	59.5	0	0	0	0	113.2	Y32 H65 Q91 I92 T124 C125	Y32-C87 WeakPolarHBondContact CE2-O 3.4Å; H65-C87 PolarHBondContact CE1-O 3.38Å; H65-C87 PolarHBondContact NE2-O 3Å; C87-Q91 VanDerWaalsContact CA-OE1 3.31Å; C87-Q91 HydrophobicContact CB-CB 4.24Å; C87-I92 HydrophobicContact CB-CG1 4.37Å; C87-I92 WeakPolarHBondContact SG-CG1 3.23Å; C87-T124 HydrophobicContact CB-CG2 4.5Å; C87-C125 HydrophobicContact CB-CB 3.97Å; C87-C125 WeakPolarHBondContact CB-SG 3.29Å; C87-C125 WeakPolarHBondContact SG-CB 3.39Å; C87-C125 CovalentContact SG-SG 2.04Å; C87-C125 PolarHBondContact SG-SG 3.5Å
88	S	91.4	Very high	86.5	Confident	10 Å²	10	49.4 Å²	49.4	7%	0.07	27%	0.27	C	S	.	.			trans	-94.2	165.3	173.6	81	0	0	0	0	111.7	Q90 Q91 I92	S88-Q90 PolarHBondContact O-N 3.28Å; S88-Q90 PolarHBondContact OG-N 3.3Å; S88-Q91 PolarHBondContact O-N 3.03Å; S88-Q91 PolarHBondContact OG-N 3.31Å; S88-I92 WeakPolarHBondContact O-CG1 3.03Å; S88-I92 PolarHBondContact O-N 2.89Å
89	L	89.2	Confident	86.5	Confident	89 Å²	89	43.4 Å²	43.4	47%	0.466	24%	0.244	S	C	.	.	H	α-helix	trans	-58.5	-36.4	176.3	-165.5	86.6	0	0	0	112.2	H65 R68 A93	H65-L89 HydrophobicContact CB-CD1 4.08Å; R68-L89 HydrophobicContact CB-CD1 4.32Å; L89-A93 PolarHBondContact O-N 3.14Å; L89-A93 VanDerWaalsContact O-N 3.13Å
90	Q	87.7	Confident	86.4	Confident	112 Å²	112	43.3 Å²	43.3	52%	0.523	24%	0.237	S	C	.	.	H	α-helix	trans	-66.8	-47	177	-70.5	178.8	-12.4	0	0	110.9	E34 S88 I92 A93 S94	E34-Q90 HydrophobicContact CG-CB 4.4Å; E34-Q90 VanDerWaalsContact OE1-C 3.24Å; S88-Q90 PolarHBondContact O-N 3.28Å; S88-Q90 PolarHBondContact OG-N 3.3Å; Q90-I92 VanDerWaalsContact C-N 3.28Å; Q90-I92 PolarHBondContact O-N 3.26Å; Q90-A93 WeakPolarHBondContact O-CB 3.42Å; Q90-A93 PolarHBondContact O-N 3.46Å; Q90-S94 PolarHBondContact O-N 3.4Å; Q90-S94 PolarHBondContact O-OG 3.43Å
91	Q	88.7	Confident	86.4	Confident	10 Å²	10	39.9 Å²	39.9	5%	0.047	22%	0.222	C	C	.	.	H	α-helix	trans	-58.6	-39.8	177	-70.1	177	-56.7	0	0	112.3	D33 E34 C87 S88 S94 L95	D33-Q91 VanDerWaalsContact N-OE1 3.09Å; D33-Q91 PolarHBondContact O-NE2 2.86Å; D33-Q91 VanDerWaalsContact O-NE2 3.09Å; E34-Q91 HydrophobicContact CG-CG 3.54Å; E34-Q91 VanDerWaalsContact OE1-CA 3.3Å; E34-Q91 WeakPolarHBondContact OE1-CA 3.23Å; E34-Q91 PolarHBondContact OE1-N 2.93Å; C87-Q91 VanDerWaalsContact CA-OE1 3.31Å; C87-Q91 HydrophobicContact CB-CB 4.24Å; S88-Q91 PolarHBondContact O-N 3.03Å; S88-Q91 PolarHBondContact OG-N 3.31Å; Q91-S94 PolarHBondContact O-N 3.34Å; Q91-L95 WeakPolarHBondContact O-CB 3.49Å; Q91-L95 PolarHBondContact O-N 3.34Å
92	I	89.3	Confident	86.5	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-66	-41.1	176.3	-63.8	169.7	0	0	0	111.1	H65 R68 L69 V72 C87 S88 Q90 L95 E96	H65-I92 WeakPolarHBondContact NE2-CD1 3.45Å; R68-I92 HydrophobicContact CB-CG2 4.48Å; R68-I92 HydrophobicContact CG-CG2 3.76Å; L69-I92 HydrophobicContact CB-CD1 4.09Å; L69-I92 HydrophobicContact CD1-CD1 3.95Å; V72-I92 HydrophobicContact CB-CG2 3.96Å; V72-I92 HydrophobicContact CG1-CG2 4.33Å; V72-I92 HydrophobicContact CG2-CG2 3.74Å; C87-I92 HydrophobicContact CB-CG1 4.37Å; C87-I92 WeakPolarHBondContact SG-CG1 3.23Å; S88-I92 WeakPolarHBondContact O-CG1 3.03Å; S88-I92 PolarHBondContact O-N 2.89Å; Q90-I92 VanDerWaalsContact C-N 3.28Å; Q90-I92 PolarHBondContact O-N 3.26Å; I92-L95 PolarHBondContact O-N 3.09Å; I92-E96 WeakPolarHBondContact O-CB 3.23Å; I92-E96 PolarHBondContact O-N 3.03Å
93	A	86.2	Confident	86.2	Confident	42 Å²	42	35 Å²	35	35%	0.347	19%	0.191	S	C	.	.	H	α-helix	trans	-66.7	-38.7	177.9	0	0	0	0	0	112.4	L89 Q90 T97	L89-A93 PolarHBondContact O-N 3.14Å; L89-A93 VanDerWaalsContact O-N 3.13Å; Q90-A93 WeakPolarHBondContact O-CB 3.42Å; Q90-A93 PolarHBondContact O-N 3.46Å; A93-T97 WeakPolarHBondContact O-CB 3.41Å; A93-T97 PolarHBondContact O-N 3.01Å; A93-T97 PolarHBondContact O-OG1 3Å
94	S	85.5	Confident	85.7	Confident	35 Å²	35	35.4 Å²	35.4	25%	0.245	19%	0.194	C	C	.	.	H	α-helix	trans	-66.8	-42.7	173.6	-64.9	0	0	0	0	111.6	E34 Q90 Q91 T97 S98	E34-S94 WeakPolarHBondContact OE1-CB 3.39Å; E34-S94 PolarHBondContact OE1-OG 2.97Å; Q90-S94 PolarHBondContact O-N 3.4Å; Q90-S94 PolarHBondContact O-OG 3.43Å; Q91-S94 PolarHBondContact O-N 3.34Å; S94-T97 WeakPolarHBondContact O-CB 3.4Å; S94-T97 PolarHBondContact O-N 2.65Å; S94-S98 PolarHBondContact O-N 3.05Å; S94-S98 PolarHBondContact O-OG 3.45Å
95	L	87.3	Confident	85.1	Confident	14 Å²	14	31.4 Å²	31.4	7%	0.073	18%	0.181	C	C	.	.	H	α-helix	trans	-62.1	-44.2	176.1	177.1	61.2	0	0	0	111.9	V72 Q91 I92 T97 S98 L99	V72-L95 HydrophobicContact CG1-CD2 4.48Å; Q91-L95 WeakPolarHBondContact O-CB 3.49Å; Q91-L95 PolarHBondContact O-N 3.34Å; I92-L95 PolarHBondContact O-N 3.09Å; L95-T97 VanDerWaalsContact C-N 3.28Å; L95-T97 PolarHBondContact O-N 3.19Å; L95-S98 PolarHBondContact O-N 2.73Å; L95-S98 PolarHBondContact O-OG 3.31Å; L95-L99 HydrophobicContact CD1-CD1 3.95Å; L95-L99 HydrophobicContact CD1-CG 4.03Å; L95-L99 HydrophobicContact CG-CD1 3.93Å; L95-L99 HydrophobicContact CG-CG 4.4Å; L95-L99 WeakPolarHBondContact O-CB 3.37Å; L95-L99 WeakPolarHBondContact O-CG 3.19Å; L95-L99 PolarHBondContact O-N 3.18Å
96	E	85.4	Confident	84.9	Confident	49 Å²	49	31.4 Å²	31.4	23%	0.229	18%	0.181	C	C	.	.	H	α-helix	trans	-61.4	-41.6	174.7	-177.9	-173.4	-179.2	0	0	111.5	R68 V72 I92 S98 L99 T100	R68-E96 VanDerWaalsContact CZ-CD 3.47Å; R68-E96 IonicContact CZ-OE1 2.67Å; R68-E96 VanDerWaalsContact CZ-OE1 3.27Å; R68-E96 IonicContact CZ-OE2 3Å; R68-E96 IonicContact NE-OE2 2.74Å; R68-E96 PolarHBondContact NE-OE2 2.84Å; R68-E96 IonicContact NH1-OE1 2.64Å; R68-E96 IonicContact NH1-OE2 3.94Å; R68-E96 IonicContact NH2-OE1 2.95Å; R68-E96 PolarHBondContact NH2-OE1 3.44Å; R68-E96 IonicContact NH2-OE2 3.96Å; R68-E96 PolarHBondContact NH2-OE2 3.06Å; V72-E96 HydrophobicContact CG1-CB 4.29Å; V72-E96 HydrophobicContact CG2-CB 3.97Å; V72-E96 HydrophobicContact CG2-CG 4.13Å; I92-E96 WeakPolarHBondContact O-CB 3.23Å; I92-E96 PolarHBondContact O-N 3.03Å; E96-S98 PolarHBondContact O-N 3.47Å; E96-L99 PolarHBondContact O-N 2.78Å; E96-T100 WeakPolarHBondContact O-CG2 3.39Å; E96-T100 PolarHBondContact O-N 3.41Å
97	T	80.5	Confident	84.3	Confident	68 Å²	68	32.9 Å²	32.9	42%	0.417	19%	0.188	S	C	.	.	H	α-helix	trans	-61.6	-43.4	178.2	-61.9	0	0	0	0	111.6	A93 S94 L95 T100	A93-T97 WeakPolarHBondContact O-CB 3.41Å; A93-T97 PolarHBondContact O-N 3.01Å; A93-T97 PolarHBondContact O-OG1 3Å; S94-T97 WeakPolarHBondContact O-CB 3.4Å; S94-T97 PolarHBondContact O-N 2.65Å; L95-T97 VanDerWaalsContact C-N 3.28Å; L95-T97 PolarHBondContact O-N 3.19Å; T97-T100 PolarHBondContact O-N 3.27Å; T97-T100 PolarHBondContact O-OG1 3.46Å
98	S	82.7	Confident	84	Confident	47 Å²	47	32.9 Å²	32.9	33%	0.329	19%	0.188	S	C	.	.	H	α-helix	trans	-69	-40.3	177	62.6	0	0	0	0	112.2	S94 L95 E96 T100	S94-S98 PolarHBondContact O-N 3.05Å; S94-S98 PolarHBondContact O-OG 3.45Å; L95-S98 PolarHBondContact O-N 2.73Å; L95-S98 PolarHBondContact O-OG 3.31Å; E96-S98 PolarHBondContact O-N 3.47Å; S98-T100 VanDerWaalsContact C-N 3.28Å; S98-T100 PolarHBondContact O-N 3.36Å
99	L	84.1	Confident	83.8	Confident	6 Å²	6	32.4 Å²	32.4	3%	0.031	19%	0.185	C	C	.	.	H	α-helix	trans	-67.2	-25.4	178.4	-70	175.8	0	0	0	113.1	L95 E96 L101 S102 K103 F116 A117 Y120	L95-L99 HydrophobicContact CD1-CD1 3.95Å; L95-L99 HydrophobicContact CD1-CG 4.03Å; L95-L99 HydrophobicContact CG-CD1 3.93Å; L95-L99 HydrophobicContact CG-CG 4.4Å; L95-L99 WeakPolarHBondContact O-CB 3.37Å; L95-L99 WeakPolarHBondContact O-CG 3.19Å; L95-L99 PolarHBondContact O-N 3.18Å; E96-L99 PolarHBondContact O-N 2.78Å; L99-L101 VanDerWaalsContact C-N 3.29Å; L99-L101 PolarHBondContact O-N 3.45Å; L99-S102 PolarHBondContact O-N 3.01Å; L99-K103 VanDerWaalsContact O-CB 3.27Å; L99-K103 WeakPolarHBondContact O-CB 3.21Å; L99-K103 VanDerWaalsContact O-CG 3.3Å; L99-K103 WeakPolarHBondContact O-CG 3.34Å; L99-K103 PolarHBondContact O-N 3.4Å; L99-F116 HydrophobicContact CD2-CD1 3.95Å; L99-F116 HydrophobicContact CD2-CE1 3.73Å; L99-A117 HydrophobicContact CD1-CB 4.05Å; L99-Y120 HydrophobicContact CD2-CD2 4.04Å
100	T	80.2	Confident	83.7	Confident	27 Å²	27	29.1 Å²	29.1	17%	0.166	17%	0.169	C	C	.	.	H	α-helix	trans	-58.5	-36.7	-177.1	58.5	0	0	0	0	113.8	E96 T97 S98 A104 K969	E96-T100 WeakPolarHBondContact O-CG2 3.39Å; E96-T100 PolarHBondContact O-N 3.41Å; T97-T100 PolarHBondContact O-N 3.27Å; T97-T100 PolarHBondContact O-OG1 3.46Å; S98-T100 VanDerWaalsContact C-N 3.28Å; S98-T100 PolarHBondContact O-N 3.36Å; T100-A104 WeakPolarHBondContact O-CB 3.43Å; T100-A104 PolarHBondContact O-N 2.86Å; T100-K969 WeakPolarHBondContact OG1-CE 3.41Å
101	L	77.1	Confident	83.8	Confident	35 Å²	35	23.8 Å²	23.8	18%	0.183	14%	0.144	C	C	.	.	H	α-helix	trans	-67.8	-52.6	179.2	-178.8	64.9	0	0	0	111.3	I46 L99 K103 A104 L211 L1027	I46-L101 HydrophobicContact CD1-CD2 3.99Å; L99-L101 VanDerWaalsContact C-N 3.29Å; L99-L101 PolarHBondContact O-N 3.45Å; L101-K103 VanDerWaalsContact C-N 3.3Å; L101-K103 PolarHBondContact O-N 3.47Å; L101-A104 WeakPolarHBondContact O-CB 3.41Å; L101-A104 PolarHBondContact O-N 3.23Å; L101-A104 VanDerWaalsContact O-N 3.14Å; L101-L211 HydrophobicContact CD2-CD2 3.92Å; L101-L1027 VanDerWaalsContact CD1-O 3.23Å; L101-L1027 WeakPolarHBondContact CD1-O 3.26Å
102	S	82.4	Confident	83.9	Confident	32 Å²	32	23.3 Å²	23.3	22%	0.224	14%	0.142	C	C	.	.	H	α-helix	trans	-64	-38.1	179.2	-52.5	0	0	0	0	111.6	L99 A104 V105 L106 F116	L99-S102 PolarHBondContact O-N 3.01Å; S102-A104 PolarHBondContact O-N 3.31Å; S102-V105 PolarHBondContact O-N 2.82Å; S102-L106 WeakPolarHBondContact O-CG 3.36Å; S102-L106 PolarHBondContact O-N 3.3Å; S102-F116 VanDerWaalsContact CB-CE1 3.44Å
103	K	78.7	Confident	83.8	Confident	48 Å²	48	23.6 Å²	23.6	21%	0.209	14%	0.144	C	C	.	.	H	α-helix	trans	-60.9	-43.9	173.1	-76.3	-173.3	175.3	-169.8	0	110.9	L99 L101 V105 L106 I107	L99-K103 VanDerWaalsContact O-CB 3.27Å; L99-K103 WeakPolarHBondContact O-CB 3.21Å; L99-K103 VanDerWaalsContact O-CG 3.3Å; L99-K103 WeakPolarHBondContact O-CG 3.34Å; L99-K103 PolarHBondContact O-N 3.4Å; L101-K103 VanDerWaalsContact C-N 3.3Å; L101-K103 PolarHBondContact O-N 3.47Å; K103-V105 PolarHBondContact O-N 2.88Å; K103-V105 VanDerWaalsContact O-N 3.09Å; K103-L106 CarbonylContact O-C 3.54Å; K103-L106 PolarHBondContact O-N 3.43Å; K103-L106 VanDerWaalsContact O-N 3.07Å; K103-I107 WeakPolarHBondContact O-CA 3.29Å; K103-I107 WeakPolarHBondContact O-CB 3.29Å; K103-I107 PolarHBondContact O-N 2.97Å
104	A	76.6	Confident	84	Confident	10 Å²	10	23.3 Å²	23.3	8%	0.083	14%	0.137	C	C	.	.	H	α-helix	trans	-56.5	-30.8	-179.7	0	0	0	0	0	113.9	T100 L101 S102 K1031	T100-A104 WeakPolarHBondContact O-CB 3.43Å; T100-A104 PolarHBondContact O-N 2.86Å; L101-A104 WeakPolarHBondContact O-CB 3.41Å; L101-A104 PolarHBondContact O-N 3.23Å; L101-A104 VanDerWaalsContact O-N 3.14Å; S102-A104 PolarHBondContact O-N 3.31Å; A104-K1031 WeakPolarHBondContact O-CE 3.45Å; A104-K1031 PolarHBondContact O-NZ 3.42Å
105	V	79.7	Confident	84.2	Confident	25 Å²	25	21.7 Å²	21.7	15%	0.152	13%	0.125	C	C	.	.	H	α-helix	trans	-82.7	-41.8	175.6	-174.8	0	0	0	0	111.7	S102 K103 I175 A182	S102-V105 PolarHBondContact O-N 2.82Å; K103-V105 PolarHBondContact O-N 2.88Å; K103-V105 VanDerWaalsContact O-N 3.09Å; V105-I175 HydrophobicContact CG1-CD1 4.22Å; V105-I175 HydrophobicContact CG1-CG1 4.36Å; V105-A182 HydrophobicContact CG1-CB 3.7Å
106	L	86.7	Confident	84.4	Confident	1 Å²	1	21.3 Å²	21.3	1%	0.005	12%	0.123	C	C	.	.	H	α-helix	trans	-86.8	-8.2	-175.1	-62.3	178.4	0	0	0	114.7	S102 K103 R108 C109 A113 F116 A182 M186	S102-L106 WeakPolarHBondContact O-CG 3.36Å; S102-L106 PolarHBondContact O-N 3.3Å; K103-L106 CarbonylContact O-C 3.54Å; K103-L106 PolarHBondContact O-N 3.43Å; K103-L106 VanDerWaalsContact O-N 3.07Å; L106-R108 PolarHBondContact O-N 3.34Å; L106-C109 CarbonylContact O-C 3.52Å; L106-C109 PolarHBondContact O-N 3.19Å; L106-A113 HydrophobicContact CB-CB 4.2Å; L106-F116 HydrophobicContact CD1-CB 4.14Å; L106-F116 HydrophobicContact CD1-CD2 4.13Å; L106-F116 HydrophobicContact CD1-CG 4.03Å; L106-A182 HydrophobicContact CD2-CB 4.07Å; L106-M186 HydrophobicContact CD1-CE 4.08Å; L106-M186 HydrophobicContact CD1-SD 3.99Å; L106-M186 HydrophobicContact CD2-SD 3.92Å; L106-M186 HydrophobicContact CG-SD 4.1Å
107	I	80.5	Confident	84.5	Confident	30 Å²	30	19.2 Å²	19.2	15%	0.154	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-16.5	-169.4	-155.1	147.8	0	0	0	114.5	K103 C109 N965	K103-I107 WeakPolarHBondContact O-CA 3.29Å; K103-I107 WeakPolarHBondContact O-CB 3.29Å; K103-I107 PolarHBondContact O-N 2.97Å; I107-C109 PolarHBondContact O-N 3.19Å; I107-N965 HydrophobicContact CD1-CB 4.4Å; I107-N965 WeakPolarHBondContact CD1-ND2 3.46Å; I107-N965 VanDerWaalsContact CD1-OD1 3.25Å; I107-N965 WeakPolarHBondContact CD1-OD1 3.46Å; I107-N965 VanDerWaalsContact CG1-ND2 3.34Å; I107-N965 WeakPolarHBondContact CG1-ND2 3.32Å
108	R	83.8	Confident	85	Confident	1 Å²	1	17 Å²	17	0%	0.004	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-21.8	170.8	-63.8	-170.1	66.7	80.5	-2.6	113.2	L106 V173 R174 D258 S924 S925 V926 D958 D962	L106-R108 PolarHBondContact O-N 3.34Å; R108-V173 HydrophobicContact CB-CG1 4.26Å; R108-R174 VanDerWaalsContact CD-O 3.31Å; R108-R174 WeakPolarHBondContact CD-O 3.34Å; R108-D258 IonicContact CZ-OD2 3.97Å; R108-D258 IonicContact NE-OD1 3.29Å; R108-D258 IonicContact NE-OD2 2.76Å; R108-D258 PolarHBondContact NE-OD2 2.88Å; R108-D258 VanDerWaalsContact NE-OD2 3.09Å; R108-D258 IonicContact NH2-OD2 3.43Å; R108-S924 VanDerWaalsContact NH2-C 3.31Å; R108-S924 PolarHBondContact NH2-O 3.18Å; R108-S924 PolarHBondContact NH2-OG 3.09Å; R108-S925 VanDerWaalsContact NH2-N 3.19Å; R108-V926 WeakPolarHBondContact O-CG2 3.36Å; R108-D958 IonicContact CZ-OD1 2.99Å; R108-D958 IonicContact NH1-OD1 3.57Å; R108-D958 PolarHBondContact NH1-OD1 3.15Å; R108-D958 IonicContact NH2-OD1 2.53Å; R108-D958 PolarHBondContact NH2-OD1 2.92Å; R108-D962 WeakPolarHBondContact CD-OD2 3.47Å; R108-D962 WeakPolarHBondContact CG-OD2 3.45Å; R108-D962 IonicContact CZ-OD2 2.63Å; R108-D962 IonicContact NH1-OD1 2.94Å; R108-D962 IonicContact NH1-OD2 3.84Å; R108-D962 PolarHBondContact NH1-OD2 3.28Å
109	C	88.5	Confident	85.4	Confident	0 Å²	0	14.9 Å²	14.9	0%	0	8%	0.084	C	C	.	.	S	Bend	trans	-128	94.3	171.8	-178.4	0	0	0	0	109.7	L106 I107 S111 C112 A113 V173 C254 D258	L106-C109 CarbonylContact O-C 3.52Å; L106-C109 PolarHBondContact O-N 3.19Å; I107-C109 PolarHBondContact O-N 3.19Å; C109-S111 VanDerWaalsContact C-N 3.3Å; C109-S111 PolarHBondContact O-N 3.02Å; C109-C112 HydrophobicContact CB-CB 3.91Å; C109-C112 WeakPolarHBondContact O-CB 3.5Å; C109-C112 PolarHBondContact O-N 3.08Å; C109-C112 VanDerWaalsContact O-N 3.07Å; C109-A113 PolarHBondContact O-N 2.8Å; C109-V173 HydrophobicContact CB-CG2 3.61Å; C109-C254 WeakPolarHBondContact CA-SG 3.39Å; C109-C254 HydrophobicContact CB-CB 3.76Å; C109-C254 WeakPolarHBondContact CB-SG 3.22Å; C109-C254 WeakPolarHBondContact SG-CB 3.04Å; C109-C254 CovalentContact SG-SG 2.03Å; C109-C254 PolarHBondContact SG-SG 2.88Å; C109-D258 HydrophobicContact CB-CB 4.47Å
110	P	86.7	Confident	85.7	Confident	20 Å²	20	16.2 Å²	16.2	13%	0.13	9%	0.089	C	C	.	.	H	α-helix	trans	-54.7	-42.1	-178.9	-28.9	35.8	0	0	0	113.1	C112 A113 D114 T247 V926	P110-C112 VanDerWaalsContact C-N 3.28Å; P110-C112 PolarHBondContact O-N 3.22Å; P110-A113 PolarHBondContact O-N 2.78Å; P110-A113 VanDerWaalsContact O-N 3.14Å; P110-D114 WeakPolarHBondContact O-CB 3.27Å; P110-D114 PolarHBondContact O-N 2.92Å; P110-T247 HydrophobicContact CB-CG2 3.79Å; P110-V926 HydrophobicContact CG-CG2 4.04Å
111	S	89.1	Confident	86.2	Confident	0 Å²	0	15 Å²	15	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-59.8	-38.9	178.1	-43.5	0	0	0	0	112	C109 N115 E245	C109-S111 VanDerWaalsContact C-N 3.3Å; C109-S111 PolarHBondContact O-N 3.02Å; S111-N115 WeakPolarHBondContact O-CB 3.31Å; S111-N115 PolarHBondContact O-N 3.43Å; S111-N115 PolarHBondContact O-ND2 2.97Å; S111-E245 PolarHBondContact OG-O 2.93Å
112	C	91	Very high	86.8	Confident	0 Å²	0	13.3 Å²	13.3	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-67	-47.6	173.1	162.3	0	0	0	0	112	C109 P110 D114 N115 F116 C170 V173	C109-C112 HydrophobicContact CB-CB 3.91Å; C109-C112 WeakPolarHBondContact O-CB 3.5Å; C109-C112 PolarHBondContact O-N 3.08Å; C109-C112 VanDerWaalsContact O-N 3.07Å; P110-C112 VanDerWaalsContact C-N 3.28Å; P110-C112 PolarHBondContact O-N 3.22Å; C112-D114 VanDerWaalsContact C-N 3.28Å; C112-D114 PolarHBondContact O-N 2.96Å; C112-N115 PolarHBondContact O-N 2.99Å; C112-F116 WeakPolarHBondContact O-CB 3.41Å; C112-F116 PolarHBondContact O-N 2.81Å; C112-C170 VanDerWaalsContact CA-SG 3.53Å; C112-C170 HydrophobicContact CB-CB 4.02Å; C112-C170 WeakPolarHBondContact CB-SG 3.4Å; C112-C170 WeakPolarHBondContact SG-CA 3.23Å; C112-C170 WeakPolarHBondContact SG-CB 3.36Å; C112-C170 CovalentContact SG-SG 2.02Å; C112-C170 PolarHBondContact SG-SG 2.92Å; C112-V173 HydrophobicContact CB-CG2 4.42Å
113	A	88.2	Confident	87.1	Confident	5 Å²	5	12 Å²	12	4%	0.041	6%	0.063	C	C	.	.	H	α-helix	trans	-62.6	-35.3	179.9	0	0	0	0	0	112.5	L106 C109 P110 A117	L106-A113 HydrophobicContact CB-CB 4.2Å; C109-A113 PolarHBondContact O-N 2.8Å; P110-A113 PolarHBondContact O-N 2.78Å; P110-A113 VanDerWaalsContact O-N 3.14Å; A113-A117 PolarHBondContact O-N 3.3Å
114	D	88.4	Confident	87.7	Confident	37 Å²	37	10.8 Å²	10.8	20%	0.198	6%	0.06	C	C	.	.	H	α-helix	trans	-72.2	-44.6	175.3	-79.9	-3.8	0	0	0	111.4	P110 C112 F116 A117 H118 T247	P110-D114 WeakPolarHBondContact O-CB 3.27Å; P110-D114 PolarHBondContact O-N 2.92Å; C112-D114 VanDerWaalsContact C-N 3.28Å; C112-D114 PolarHBondContact O-N 2.96Å; D114-F116 VanDerWaalsContact C-N 3.26Å; D114-F116 PolarHBondContact O-N 3.46Å; D114-A117 PolarHBondContact O-N 3.39Å; D114-H118 VanDerWaalsContact O-CB 3.27Å; D114-H118 WeakPolarHBondContact O-CB 3.29Å; D114-H118 PolarHBondContact O-N 3.11Å; D114-T247 WeakPolarHBondContact OD2-CB 3.47Å; D114-T247 WeakPolarHBondContact OD2-CG2 3.24Å
115	N	90.8	Very high	88.5	Confident	1 Å²	1	10.3 Å²	10.3	1%	0.005	6%	0.056	C	C	.	.	H	α-helix	trans	-57.5	-40.5	173.1	-75.9	-24.4	0	0	0	111.8	S111 C112 H118 A166 S169 L241	S111-N115 WeakPolarHBondContact O-CB 3.31Å; S111-N115 PolarHBondContact O-N 3.43Å; S111-N115 PolarHBondContact O-ND2 2.97Å; C112-N115 PolarHBondContact O-N 2.99Å; N115-H118 WeakPolarHBondContact O-CB 3.32Å; N115-H118 PolarHBondContact O-N 3.32Å; N115-A166 HydrophobicContact CB-CB 4.01Å; N115-S169 PolarHBondContact ND2-OG 3.49Å; N115-L241 PolarHBondContact ND2-N 3.45Å; N115-L241 PolarHBondContact ND2-O 3.43Å; N115-L241 PolarHBondContact OD1-N 2.9Å
116	F	90.5	Very high	89.1	Confident	6 Å²	6	9.7 Å²	9.7	3%	0.026	5%	0.053	C	C	.	.	H	α-helix	trans	-62.3	-49.4	175.2	-176.2	-93.4	0	0	0	111.6	L99 S102 L106 C112 D114 H118 Y120 M186 W200 Q204	L99-F116 HydrophobicContact CD2-CD1 3.95Å; L99-F116 HydrophobicContact CD2-CE1 3.73Å; S102-F116 VanDerWaalsContact CB-CE1 3.44Å; L106-F116 HydrophobicContact CD1-CB 4.14Å; L106-F116 HydrophobicContact CD1-CD2 4.13Å; L106-F116 HydrophobicContact CD1-CG 4.03Å; C112-F116 WeakPolarHBondContact O-CB 3.41Å; C112-F116 PolarHBondContact O-N 2.81Å; D114-F116 VanDerWaalsContact C-N 3.26Å; D114-F116 PolarHBondContact O-N 3.46Å; F116-H118 VanDerWaalsContact C-N 3.3Å; F116-H118 PolarHBondContact O-N 2.56Å; F116-Y120 HydrophobicContact CD1-CD2 4.49Å; F116-Y120 HydrophobicContact CD1-CE2 4.38Å; F116-Y120 HydrophobicContact CE1-CD2 4.18Å; F116-Y120 AromaticContact CE1-CE2 3.78Å; F116-Y120 HydrophobicContact CE1-CE2 3.78Å; F116-Y120 HydrophobicContact CE2-CE2 4.07Å; F116-Y120 HydrophobicContact CZ-CD2 4.45Å; F116-Y120 AromaticContact CZ-CE2 3.61Å; F116-Y120 HydrophobicContact CZ-CE2 3.61Å; F116-Y120 WeakPolarHBondContact O-CD2 3.35Å; F116-M186 HydrophobicContact CD2-CE 4.06Å; F116-M186 HydrophobicContact CE2-CE 3.37Å; F116-M186 HydrophobicContact CZ-CE 3.83Å; F116-W200 AromaticContact CD2-CH2 3.91Å; F116-W200 HydrophobicContact CD2-CH2 3.91Å; F116-W200 AromaticContact CD2-CZ2 3.56Å; F116-W200 HydrophobicContact CD2-CZ2 3.56Å; F116-W200 HydrophobicContact CE2-CZ2 4.07Å; F116-Q204 VanDerWaalsContact CE2-CD 3.44Å; F116-Q204 HydrophobicContact CE2-CG 4.09Å
117	A	88.9	Confident	89.2	Confident	4 Å²	4	10.7 Å²	10.7	3%	0.033	6%	0.059	C	C	.	.	H	α-helix	trans	-65.9	-32.3	177.6	0	0	0	0	0	112.9	L99 A113 D114 L119 Y120 C121	L99-A117 HydrophobicContact CD1-CB 4.05Å; A113-A117 PolarHBondContact O-N 3.3Å; D114-A117 PolarHBondContact O-N 3.39Å; A117-L119 VanDerWaalsContact C-N 3.32Å; A117-L119 PolarHBondContact O-N 3.4Å; A117-Y120 PolarHBondContact O-N 3.41Å; A117-C121 WeakPolarHBondContact O-CB 3.38Å; A117-C121 PolarHBondContact O-N 3.18Å; A117-C121 PolarHBondContact O-SG 3.49Å
118	H	90.3	Very high	89.7	Confident	23 Å²	23	12.4 Å²	12.4	11%	0.106	7%	0.068	C	C	.	.	H	α-helix	trans	-55.5	-47.6	-178.6	-168.7	167.7	0	0	0	111.1	D114 N115 F116 C121 A122 F162 Y236	D114-H118 VanDerWaalsContact O-CB 3.27Å; D114-H118 WeakPolarHBondContact O-CB 3.29Å; D114-H118 PolarHBondContact O-N 3.11Å; N115-H118 WeakPolarHBondContact O-CB 3.32Å; N115-H118 PolarHBondContact O-N 3.32Å; F116-H118 VanDerWaalsContact C-N 3.3Å; F116-H118 PolarHBondContact O-N 2.56Å; H118-C121 PolarHBondContact O-N 3.47Å; H118-A122 WeakPolarHBondContact O-CB 3.35Å; H118-A122 PolarHBondContact O-N 3.34Å; H118-F162 HydrophobicContact CB-CZ 4.32Å; H118-F162 AromaticContact ND1-CE2 3.78Å; H118-Y236 PolarHBondContact CD2-OH 2.89Å; H118-Y236 AromaticContact NE2-CZ 3.91Å; H118-Y236 PolarHBondContact NE2-OH 2.67Å
119	L	90.4	Very high	90	Very high	1 Å²	1	12.3 Å²	12.3	1%	0.005	7%	0.068	C	C	.	.	H	α-helix	trans	-60.8	-50.1	-179.2	176.7	60.8	0	0	0	112.3	A117 C121 A122 T123 I158 F162 Y201 F218	A117-L119 VanDerWaalsContact C-N 3.32Å; A117-L119 PolarHBondContact O-N 3.4Å; L119-C121 VanDerWaalsContact C-N 3.34Å; L119-C121 PolarHBondContact O-N 3.33Å; L119-A122 WeakPolarHBondContact O-CB 3.5Å; L119-A122 PolarHBondContact O-N 3.12Å; L119-A122 VanDerWaalsContact O-N 3.13Å; L119-T123 HydrophobicContact CD1-CG2 4.08Å; L119-T123 PolarHBondContact O-N 3.26Å; L119-T123 PolarHBondContact O-OG1 3.42Å; L119-I158 HydrophobicContact CD1-CD1 3.42Å; L119-I158 VanDerWaalsContact CD1-CD1 3.42Å; L119-I158 HydrophobicContact CD1-CG1 3.96Å; L119-I158 HydrophobicContact CD2-CD1 3.85Å; L119-I158 HydrophobicContact CG-CD1 4.29Å; L119-F162 HydrophobicContact CB-CE1 4.37Å; L119-F162 HydrophobicContact CD1-CE1 4.44Å; L119-Y201 HydrophobicContact CD2-CD1 3.55Å; L119-Y201 HydrophobicContact CD2-CE1 3.15Å; L119-F218 HydrophobicContact CD2-CD1 4.37Å; L119-F218 HydrophobicContact CD2-CE1 3.76Å; L119-F218 HydrophobicContact CD2-CZ 4.15Å; L119-F218 HydrophobicContact CG-CE1 4.32Å
120	Y	90.6	Very high	90	Very high	35 Å²	35	12.5 Å²	12.5	14%	0.137	7%	0.069	C	C	.	.	H	α-helix	trans	-67.4	-36.5	-176.5	-72.8	-76	0	0	0	112.9	L99 F116 A117 A122 T123 T124 Q204	L99-Y120 HydrophobicContact CD2-CD2 4.04Å; F116-Y120 HydrophobicContact CD1-CD2 4.49Å; F116-Y120 HydrophobicContact CD1-CE2 4.38Å; F116-Y120 HydrophobicContact CE1-CD2 4.18Å; F116-Y120 AromaticContact CE1-CE2 3.78Å; F116-Y120 HydrophobicContact CE1-CE2 3.78Å; F116-Y120 HydrophobicContact CE2-CE2 4.07Å; F116-Y120 HydrophobicContact CZ-CD2 4.45Å; F116-Y120 AromaticContact CZ-CE2 3.61Å; F116-Y120 HydrophobicContact CZ-CE2 3.61Å; F116-Y120 WeakPolarHBondContact O-CD2 3.35Å; A117-Y120 PolarHBondContact O-N 3.41Å; Y120-A122 VanDerWaalsContact C-N 3.34Å; Y120-T123 WeakPolarHBondContact CA-OG1 3.39Å; Y120-T123 PolarHBondContact O-N 3.34Å; Y120-T123 PolarHBondContact O-OG1 3.42Å; Y120-T124 WeakPolarHBondContact O-CB 3.39Å; Y120-T124 PolarHBondContact O-N 3.1Å; Y120-T124 PolarHBondContact O-OG1 2.93Å; Y120-Q204 VanDerWaalsContact OH-CB 3.3Å; Y120-Q204 WeakPolarHBondContact OH-CB 3.44Å; Y120-Q204 WeakPolarHBondContact OH-CG 3.41Å; Y120-Q204 PolarHBondContact OH-OE1 2.86Å
121	C	90.9	Very high	90	Very high	0 Å²	0	12.6 Å²	12.6	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-67	-36.6	171.9	-74.4	0	0	0	0	112.2	C73 M75 L76 A117 H118 L119 C125 S126	C73-C121 VanDerWaalsContact CA-SG 3.59Å; C73-C121 HydrophobicContact CB-CB 3.65Å; C73-C121 WeakPolarHBondContact CB-SG 3.35Å; C73-C121 WeakPolarHBondContact SG-CB 3.35Å; C73-C121 CovalentContact SG-SG 2.03Å; C73-C121 PolarHBondContact SG-SG 3Å; M75-C121 HydrophobicContact CE-CB 2.91Å; M75-C121 WeakPolarHBondContact CE-SG 3.49Å; L76-C121 HydrophobicContact CD1-CB 4.41Å; A117-C121 WeakPolarHBondContact O-CB 3.38Å; A117-C121 PolarHBondContact O-N 3.18Å; A117-C121 PolarHBondContact O-SG 3.49Å; H118-C121 PolarHBondContact O-N 3.47Å; L119-C121 VanDerWaalsContact C-N 3.34Å; L119-C121 PolarHBondContact O-N 3.33Å; C121-C125 WeakPolarHBondContact O-CA 3.46Å; C121-C125 WeakPolarHBondContact O-CB 3.37Å; C121-C125 PolarHBondContact O-N 3.04Å; C121-S126 PolarHBondContact O-N 3.48Å
122	A	89.5	Confident	90	Very high	1 Å²	1	13.1 Å²	13.1	1%	0.008	7%	0.072	C	C	.	.	H	α-helix	trans	-65.3	-42.3	175.3	0	0	0	0	0	111.6	H118 L119 Y120 S126 Y236	H118-A122 WeakPolarHBondContact O-CB 3.35Å; H118-A122 PolarHBondContact O-N 3.34Å; L119-A122 WeakPolarHBondContact O-CB 3.5Å; L119-A122 PolarHBondContact O-N 3.12Å; L119-A122 VanDerWaalsContact O-N 3.13Å; Y120-A122 VanDerWaalsContact C-N 3.34Å; A122-S126 WeakPolarHBondContact O-CB 3.23Å; A122-Y236 HydrophobicContact CB-CD1 4.34Å; A122-Y236 HydrophobicContact CB-CD2 4.21Å; A122-Y236 HydrophobicContact CB-CE1 3.93Å; A122-Y236 HydrophobicContact CB-CE2 3.78Å; A122-Y236 HydrophobicContact CB-CG 4.47Å
123	T	89.9	Confident	89.9	Confident	5 Å²	5	13.2 Å²	13.2	3%	0.031	7%	0.072	C	C	.	.	H	α-helix	trans	-75.8	-28.5	178.7	56.4	0	0	0	0	113.1	L119 Y120 Q129 V133 A156	L119-T123 HydrophobicContact CD1-CG2 4.08Å; L119-T123 PolarHBondContact O-N 3.26Å; L119-T123 PolarHBondContact O-OG1 3.42Å; Y120-T123 WeakPolarHBondContact CA-OG1 3.39Å; Y120-T123 PolarHBondContact O-N 3.34Å; Y120-T123 PolarHBondContact O-OG1 3.42Å; T123-Q129 PolarHBondContact O-NE2 2.87Å; T123-V133 HydrophobicContact CG2-CG2 4.29Å; T123-A156 HydrophobicContact CG2-CB 4.13Å
124	T	90.9	Very high	90	Very high	22 Å²	22	14.6 Å²	14.6	14%	0.135	8%	0.079	C	C	.	.	H	α-helix	trans	-94.5	-42.7	-175.7	-52.7	0	0	0	0	113.7	C87 Y120 Q129	C87-T124 HydrophobicContact CB-CG2 4.5Å; Y120-T124 WeakPolarHBondContact O-CB 3.39Å; Y120-T124 PolarHBondContact O-N 3.1Å; Y120-T124 PolarHBondContact O-OG1 2.93Å; T124-Q129 PolarHBondContact O-NE2 3.34Å; T124-Q129 VanDerWaalsContact O-NE2 3.13Å
125	C	92.4	Very high	90.1	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-116.9	-9.8	-166.8	-74	0	0	0	0	114.4	L69 L76 A85 C86 C87 C121	L69-C125 HydrophobicContact CD1-CB 4.24Å; L76-C125 HydrophobicContact CD1-CB 3.76Å; A85-C125 WeakPolarHBondContact CA-O 3.49Å; A85-C125 WeakPolarHBondContact CB-O 3.42Å; C86-C125 PolarHBondContact N-O 3.18Å; C87-C125 HydrophobicContact CB-CB 3.97Å; C87-C125 WeakPolarHBondContact CB-SG 3.29Å; C87-C125 WeakPolarHBondContact SG-CB 3.39Å; C87-C125 CovalentContact SG-SG 2.04Å; C87-C125 PolarHBondContact SG-SG 3.5Å; C121-C125 WeakPolarHBondContact O-CA 3.46Å; C121-C125 WeakPolarHBondContact O-CB 3.37Å; C121-C125 PolarHBondContact O-N 3.04Å
126	S	92.2	Very high	89.9	Confident	12 Å²	12	17.3 Å²	17.3	8%	0.084	10%	0.097	C	C	.	.			trans	-56.2	135.9	-176.7	175.6	0	0	0	0	112	C86 C121 A122 N128 Q129	C86-S126 WeakPolarHBondContact CB-O 3.49Å; C86-S126 PolarHBondContact SG-O 3.27Å; C121-S126 PolarHBondContact O-N 3.48Å; A122-S126 WeakPolarHBondContact O-CB 3.23Å; S126-N128 PolarHBondContact O-N 2.95Å; S126-N128 VanDerWaalsContact O-N 3.15Å; S126-N128 PolarHBondContact OG-N 3.45Å; S126-Q129 WeakPolarHBondContact O-CB 3.28Å; S126-Q129 PolarHBondContact O-N 2.7Å
127	P	90.4	Very high	89.9	Confident	22 Å²	22	22.2 Å²	22.2	14%	0.143	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-15.4	175	26.1	-33.9	0	0	0	113.6	G27 Y28 A58 Y84	G27-P127 CarbonylContact C-O 3.57Å; G27-P127 VanDerWaalsContact C-O 3.32Å; G27-P127 VanDerWaalsContact CA-O 3.26Å; G27-P127 WeakPolarHBondContact CA-O 3.37Å; Y28-P127 PolarHBondContact N-O 2.87Å; A58-P127 HydrophobicContact CB-CB 3.88Å; Y84-P127 WeakPolarHBondContact O-CB 3.5Å
128	N	90.3	Very high	89.9	Confident	65 Å²	65	24.9 Å²	24.9	35%	0.348	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.5	35.8	178	-67.1	-32.8	0	0	0	111.7	G27 S126 T130 L131	G27-N128 PolarHBondContact N-OD1 2.9Å; S126-N128 PolarHBondContact O-N 2.95Å; S126-N128 VanDerWaalsContact O-N 3.15Å; S126-N128 PolarHBondContact OG-N 3.45Å; N128-T130 VanDerWaalsContact C-N 3.32Å; N128-T130 PolarHBondContact O-N 3.39Å; N128-L131 HydrophobicContact CB-CD1 4.01Å; N128-L131 HydrophobicContact CB-CG 4.39Å; N128-L131 PolarHBondContact O-N 3.01Å
129	Q	89.9	Confident	89.6	Confident	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.14	C	C	.	.	G	3₁₀ helix	trans	-55.7	-42.6	-173.3	-179.1	-179.5	60.8	0	0	113	Y28 A30 F31 C86 T123 T124 S126 L131 T132 V133	Y28-Q129 PolarHBondContact O-N 3.46Å; A30-Q129 HydrophobicContact CB-CG 4.36Å; F31-Q129 PolarHBondContact O-OE1 3.39Å; C86-Q129 HydrophobicContact CB-CB 4.35Å; T123-Q129 PolarHBondContact O-NE2 2.87Å; T124-Q129 PolarHBondContact O-NE2 3.34Å; T124-Q129 VanDerWaalsContact O-NE2 3.13Å; S126-Q129 WeakPolarHBondContact O-CB 3.28Å; S126-Q129 PolarHBondContact O-N 2.7Å; Q129-L131 PolarHBondContact O-N 3.48Å; Q129-L131 VanDerWaalsContact O-N 3.14Å; Q129-T132 PolarHBondContact O-N 2.95Å; Q129-T132 PolarHBondContact O-OG1 3.41Å; Q129-T132 VanDerWaalsContact O-OG1 3.12Å; Q129-V133 HydrophobicContact CG-CB 4.19Å; Q129-V133 HydrophobicContact CG-CG2 4.18Å; Q129-V133 PolarHBondContact O-N 3.25Å
130	T	89.2	Confident	89.4	Confident	3 Å²	3	31.9 Å²	31.9	2%	0.018	17%	0.171	C	C	.	.	G	3₁₀ helix	trans	-63.4	-18.8	-178.2	50.3	0	0	0	0	114.7	H24 R25 Y28 C29 A30 Y55 N128 T132	H24-T130 PolarHBondContact ND1-O 2.93Å; R25-T130 PolarHBondContact O-OG1 3.21Å; Y28-T130 PolarHBondContact O-N 3.47Å; Y28-T130 PolarHBondContact O-OG1 3.23Å; C29-T130 VanDerWaalsContact C-CG2 3.49Å; A30-T130 HydrophobicContact CB-CG2 4.18Å; Y55-T130 HydrophobicContact CD1-CG2 4.48Å; N128-T130 VanDerWaalsContact C-N 3.32Å; N128-T130 PolarHBondContact O-N 3.39Å; T130-T132 VanDerWaalsContact C-N 3.33Å
131	L	87.1	Confident	89	Confident	23 Å²	23	31.5 Å²	31.5	12%	0.12	17%	0.172	C	C	.	.	G	3₁₀ helix	trans	-76.6	-22.4	176.1	-62.1	-176.1	0	0	0	112.8	P26 N128 Q129 G232 M233 I234	P26-L131 HydrophobicContact CB-CD1 4.19Å; N128-L131 HydrophobicContact CB-CD1 4.01Å; N128-L131 HydrophobicContact CB-CG 4.39Å; N128-L131 PolarHBondContact O-N 3.01Å; Q129-L131 PolarHBondContact O-N 3.48Å; Q129-L131 VanDerWaalsContact O-N 3.14Å; L131-G232 WeakPolarHBondContact CD2-O 3.5Å; L131-M233 CarbonylContact O-C 3.59Å; L131-M233 VanDerWaalsContact O-CA 3.29Å; L131-M233 WeakPolarHBondContact O-CA 3.18Å; L131-M233 WeakPolarHBondContact O-CB 3.03Å; L131-I234 PolarHBondContact O-N 3.42Å
132	T	87.3	Confident	88.4	Confident	11 Å²	11	37.1 Å²	37.1	7%	0.067	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-118	-24.4	-170.5	56.4	0	0	0	0	113	Q129 T130 A156 Y157 Y236	Q129-T132 PolarHBondContact O-N 2.95Å; Q129-T132 PolarHBondContact O-OG1 3.41Å; Q129-T132 VanDerWaalsContact O-OG1 3.12Å; T130-T132 VanDerWaalsContact C-N 3.33Å; T132-A156 WeakPolarHBondContact O-CA 3.36Å; T132-Y157 PolarHBondContact O-N 3.01Å; T132-Y236 HydrophobicContact CG2-CD2 4.21Å
133	V	90.1	Very high	87.4	Confident	2 Å²	2	39.1 Å²	39.1	1%	0.012	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	128.7	-176.4	177.6	0	0	0	0	110.6	F31 T123 Q129 Y154 Q155	F31-V133 HydrophobicContact CE1-CG1 4.04Å; T123-V133 HydrophobicContact CG2-CG2 4.29Å; Q129-V133 HydrophobicContact CG-CB 4.19Å; Q129-V133 HydrophobicContact CG-CG2 4.18Å; Q129-V133 PolarHBondContact O-N 3.25Å; V133-Y154 HydrophobicContact CG1-CD1 4.48Å; V133-Y154 HydrophobicContact CG1-CD2 3.56Å; V133-Y154 HydrophobicContact CG1-CE2 4.08Å; V133-Y154 HydrophobicContact CG1-CG 3.8Å; V133-Y154 HydrophobicContact CG2-CE2 4.45Å; V133-Q155 CarbonylContact C-O 2.94Å; V133-Q155 WeakPolarHBondContact CA-O 3.36Å
134	N	90.4	Very high	86.4	Confident	33 Å²	33	46 Å²	46	18%	0.176	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	115.5	174.4	-170	21.2	0	0	0	110.6	T136 Y154 Q155 Y157 M233	N134-T136 PolarHBondContact O-N 2.85Å; N134-Y154 CarbonylContact O-C 3.59Å; N134-Y154 VanDerWaalsContact O-CA 3.3Å; N134-Y154 WeakPolarHBondContact O-CA 3.31Å; N134-Y154 VanDerWaalsContact O-CB 3.31Å; N134-Y154 WeakPolarHBondContact O-CB 3.2Å; N134-Q155 HydrophobicContact CB-CB 4.22Å; N134-Q155 PolarHBondContact N-O 3.46Å; N134-Q155 PolarHBondContact O-N 2.95Å; N134-Y157 HydrophobicContact CB-CE2 4.14Å; N134-M233 HydrophobicContact CB-CE 3.41Å; N134-M233 VanDerWaalsContact CB-CE 3.41Å; N134-M233 HydrophobicContact CB-SD 4.12Å
135	V	89.5	Confident	85.3	Confident	20 Å²	20	48.8 Å²	48.8	12%	0.121	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	122	179.2	178	0	0	0	0	109.8	A30 F31 L53 V138 V151	A30-V135 HydrophobicContact CB-CG2 4.14Å; F31-V135 HydrophobicContact CD1-CG2 4.27Å; L53-V135 HydrophobicContact CD1-CB 4.23Å; L53-V135 HydrophobicContact CD1-CG1 4.03Å; L53-V135 HydrophobicContact CD1-CG2 4.06Å; V135-V138 HydrophobicContact CG1-CG1 3.67Å; V135-V151 HydrophobicContact CG1-CG1 3.81Å; V135-V151 HydrophobicContact CG1-CG2 4.14Å; V135-V151 HydrophobicContact CG2-CG1 4.22Å; V135-V151 HydrophobicContact CG2-CG2 4.38Å
136	T	88.1	Confident	84.5	Confident	76 Å²	76	57.5 Å²	57.5	47%	0.466	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	-33.9	-175.2	55.4	0	0	0	0	112.8	N134 A153 Q155	N134-T136 PolarHBondContact O-N 2.85Å; T136-A153 PolarHBondContact N-O 3.37Å; T136-A153 VanDerWaalsContact N-O 3.09Å; T136-A153 PolarHBondContact OG1-O 2.85Å; T136-A153 VanDerWaalsContact OG1-O 3.13Å; T136-Q155 HydrophobicContact CG2-CB 4.28Å; T136-Q155 HydrophobicContact CG2-CG 3.85Å
137	K	88.6	Confident	83.9	Confident	109 Å²	109	61.7 Å²	61.7	47%	0.474	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	131.9	-176.6	-164.5	-179.8	175.9	-176.1	0	111.6	V152 A153	K137-V152 HydrophobicContact CB-CG2 3.87Å; K137-V152 HydrophobicContact CD-CG2 3.82Å; K137-V152 HydrophobicContact CG-CG2 3.59Å; K137-V152 WeakPolarHBondContact O-CG2 3.43Å; K137-V152 PolarHBondContact O-N 3.27Å; K137-A153 HydrophobicContact CB-CB 3.79Å; K137-A153 PolarHBondContact N-O 3.32Å; K137-A153 VanDerWaalsContact N-O 3.1Å; K137-A153 PolarHBondContact O-N 3.49Å
138	V	89.3	Confident	83.5	Confident	60 Å²	60	64.7 Å²	64.7	36%	0.364	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	154.7	175.5	-61.7	0	0	0	0	110.9	L53 V135 D149 A150 V151	L53-V138 HydrophobicContact CB-CG1 4.48Å; L53-V138 HydrophobicContact CD1-CG1 4.33Å; L53-V138 HydrophobicContact CD2-CG1 4.22Å; V135-V138 HydrophobicContact CG1-CG1 3.67Å; V138-D149 HydrophobicContact CB-CB 4.38Å; V138-A150 CarbonylContact C-O 3.59Å; V138-A150 WeakPolarHBondContact CA-O 3.39Å; V138-V151 HydrophobicContact CG1-CG2 4.33Å
139	M	85.4	Confident	83.4	Confident	48 Å²	48	64.6 Å²	64.6	24%	0.236	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	143.5	174.4	-71.6	-165.3	-71.2	0	0	111.2	P39 T40 V141 A150 V152	P39-M139 HydrophobicContact CB-CE 4.46Å; P39-M139 HydrophobicContact CG-CE 3.5Å; P39-M139 HydrophobicContact CG-SD 4.32Å; T40-M139 HydrophobicContact CG2-CE 3.26Å; T40-M139 HydrophobicContact CG2-SD 3.9Å; M139-V141 PolarHBondContact O-N 3.07Å; M139-A150 PolarHBondContact N-O 3Å; M139-A150 PolarHBondContact O-N 3.31Å; M139-V152 HydrophobicContact CB-CG1 4.29Å; M139-V152 HydrophobicContact CE-CB 3.93Å; M139-V152 HydrophobicContact CE-CG1 3.28Å; M139-V152 HydrophobicContact CE-CG2 3.96Å; M139-V152 HydrophobicContact CG-CG1 4.31Å; M139-V152 HydrophobicContact CG-CG2 4.08Å
140	N	85.9	Confident	83.3	Confident	122 Å²	122	64.6 Å²	64.6	65%	0.652	35%	0.353	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.7	119.6	177.3	-102.5	-57.6	0	0	0	110.9	D149	N140-D149 VanDerWaalsContact CG-OD1 3.31Å; N140-D149 PolarHBondContact ND2-OD1 2.98Å; N140-D149 PolarHBondContact OD1-OD1 3.04Å; N140-D149 VanDerWaalsContact OD1-OD1 3.13Å
141	V	82.1	Confident	83.3	Confident	27 Å²	27	64.5 Å²	64.5	16%	0.164	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	142.5	177.4	-177.4	0	0	0	0	109.5	P39 M139 H143 R148 A150	P39-V141 HydrophobicContact CG-CG2 4.13Å; M139-V141 PolarHBondContact O-N 3.07Å; V141-H143 PolarHBondContact O-N 3.41Å; V141-R148 PolarHBondContact N-O 2.91Å; V141-R148 PolarHBondContact O-N 3.44Å; V141-R148 VanDerWaalsContact O-O 3.1Å; V141-A150 HydrophobicContact CB-CB 4.25Å; V141-A150 HydrophobicContact CG2-CB 3.64Å
142	T	78	Confident	83.4	Confident	119 Å²	119	63.5 Å²	63.5	73%	0.73	35%	0.347	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88	104.7	173.9	38.3	0	0	0	0	109.9
143	H	69	Low	83.5	Confident	43 Å²	43	63.5 Å²	63.5	20%	0.199	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	123.4	178.7	-170.6	-110.7	0	0	0	109.8	E34 V141 G145 R146	E34-H143 PolarHBondContact O-CE1 2.86Å; E34-H143 VanDerWaalsContact O-CE1 3.3Å; V141-H143 PolarHBondContact O-N 3.41Å; H143-G145 PolarHBondContact O-N 3.24Å; H143-R146 PolarHBondContact N-O 3.31Å; H143-R146 PolarHBondContact O-N 2.84Å; H143-R146 VanDerWaalsContact O-N 3.15Å; H143-R146 VanDerWaalsContact O-O 3.13Å
144	L	69.1	Low	83.6	Confident	150 Å²	150	63.8 Å²	63.8	79%	0.785	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.9	38.9	-177.3	-61.4	166.4	0	0	0	113.6	R146	L144-R146 VanDerWaalsContact C-N 3.3Å; L144-R146 PolarHBondContact O-N 3.34Å
145	G	65.9	Low	83.7	Confident	80 Å²	80	64.3 Å²	64.3	83%	0.825	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	75	9.9	178	0	0	0	0	0	115.4	H143	H143-G145 PolarHBondContact O-N 3.24Å
146	R	76.2	Confident	83.8	Confident	183 Å²	183	63.4 Å²	63.4	69%	0.691	35%	0.345	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.6	142.7	173.4	-64.2	-176.9	-177.9	179.4	1.2	110.9	H143 L144 R148	H143-R146 PolarHBondContact N-O 3.31Å; H143-R146 PolarHBondContact O-N 2.84Å; H143-R146 VanDerWaalsContact O-N 3.15Å; H143-R146 VanDerWaalsContact O-O 3.13Å; L144-R146 VanDerWaalsContact C-N 3.3Å; L144-R146 PolarHBondContact O-N 3.34Å; R146-R148 PolarHBondContact O-N 3.14Å
147	P	79.3	Confident	83.8	Confident	100 Å²	100	60.3 Å²	60.3	65%	0.649	33%	0.325	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.9	130.1	169.9	29.1	-32.4	0	0	0	109.3
148	R	82.9	Confident	83.9	Confident	85 Å²	85	55.1 Å²	55.1	32%	0.321	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	145	171	-69	-165.9	174.9	-174.1	-0.7	108.9	D33 C35 C52 V141 R146 A150	D33-R148 IonicContact OD2-CZ 3.57Å; D33-R148 IonicContact OD2-NH1 2.97Å; D33-R148 PolarHBondContact OD2-NH1 3.44Å; D33-R148 IonicContact OD2-NH2 3.58Å; C35-R148 WeakPolarHBondContact SG-CB 3.41Å; C52-R148 VanDerWaalsContact SG-CD 3.53Å; V141-R148 PolarHBondContact N-O 2.91Å; V141-R148 PolarHBondContact O-N 3.44Å; V141-R148 VanDerWaalsContact O-O 3.1Å; R146-R148 PolarHBondContact O-N 3.14Å; R148-A150 PolarHBondContact O-N 3.42Å
149	D	87.4	Confident	84	Confident	63 Å²	63	52.3 Å²	52.3	34%	0.337	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	112.5	172.6	-67.7	-42.3	0	0	0	109.5	L53 V138 N140	L53-D149 HydrophobicContact CB-CB 4.07Å; L53-D149 HydrophobicContact CD2-CB 4.43Å; L53-D149 PolarHBondContact N-O 3.27Å; V138-D149 HydrophobicContact CB-CB 4.38Å; N140-D149 VanDerWaalsContact CG-OD1 3.31Å; N140-D149 PolarHBondContact ND2-OD1 2.98Å; N140-D149 PolarHBondContact OD1-OD1 3.04Å; N140-D149 VanDerWaalsContact OD1-OD1 3.13Å
150	A	88.1	Confident	84.2	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	133.4	174.3	0	0	0	0	0	110	C35 V50 V138 M139 V141 R148 V152	C35-A150 HydrophobicContact CB-CB 3.79Å; V50-A150 HydrophobicContact CG2-CB 3.89Å; V138-A150 CarbonylContact C-O 3.59Å; V138-A150 WeakPolarHBondContact CA-O 3.39Å; M139-A150 PolarHBondContact N-O 3Å; M139-A150 PolarHBondContact O-N 3.31Å; V141-A150 HydrophobicContact CB-CB 4.25Å; V141-A150 HydrophobicContact CG2-CB 3.64Å; R148-A150 PolarHBondContact O-N 3.42Å; A150-V152 PolarHBondContact O-N 2.93Å
151	V	90.1	Very high	84.4	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	119.6	176.6	179.5	0	0	0	0	109.2	F31 V50 P51 L53 V135 V138 Y154	F31-V151 HydrophobicContact CB-CG2 4.2Å; F31-V151 HydrophobicContact CD1-CG2 4.37Å; V50-V151 WeakPolarHBondContact CB-O 3.24Å; P51-V151 HydrophobicContact CG-CB 4.18Å; P51-V151 PolarHBondContact O-N 3.13Å; L53-V151 HydrophobicContact CB-CG2 4.01Å; L53-V151 HydrophobicContact CD1-CG2 4.02Å; V135-V151 HydrophobicContact CG1-CG1 3.81Å; V135-V151 HydrophobicContact CG1-CG2 4.14Å; V135-V151 HydrophobicContact CG2-CG1 4.22Å; V135-V151 HydrophobicContact CG2-CG2 4.38Å; V138-V151 HydrophobicContact CG1-CG2 4.33Å; V151-Y154 HydrophobicContact CG1-CD1 4.17Å
152	V	88.5	Confident	84.8	Confident	2 Å²	2	48.2 Å²	48.2	1%	0.012	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	-18.4	-177.2	-61.5	0	0	0	0	113.6	K137 M139 A150 D215	K137-V152 HydrophobicContact CB-CG2 3.87Å; K137-V152 HydrophobicContact CD-CG2 3.82Å; K137-V152 HydrophobicContact CG-CG2 3.59Å; K137-V152 WeakPolarHBondContact O-CG2 3.43Å; K137-V152 PolarHBondContact O-N 3.27Å; M139-V152 HydrophobicContact CB-CG1 4.29Å; M139-V152 HydrophobicContact CE-CB 3.93Å; M139-V152 HydrophobicContact CE-CG1 3.28Å; M139-V152 HydrophobicContact CE-CG2 3.96Å; M139-V152 HydrophobicContact CG-CG1 4.31Å; M139-V152 HydrophobicContact CG-CG2 4.08Å; A150-V152 PolarHBondContact O-N 2.93Å; V152-D215 PolarHBondContact O-N 2.95Å
153	A	90.4	Very high	85.5	Confident	12 Å²	12	42.5 Å²	42.5	10%	0.099	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	144.6	166.7	0	0	0	0	0	112	T136 K137 D215	T136-A153 PolarHBondContact N-O 3.37Å; T136-A153 VanDerWaalsContact N-O 3.09Å; T136-A153 PolarHBondContact OG1-O 2.85Å; T136-A153 VanDerWaalsContact OG1-O 3.13Å; K137-A153 HydrophobicContact CB-CB 3.79Å; K137-A153 PolarHBondContact N-O 3.32Å; K137-A153 VanDerWaalsContact N-O 3.1Å; K137-A153 PolarHBondContact O-N 3.49Å; A153-D215 WeakPolarHBondContact CA-O 3.47Å; A153-D215 HydrophobicContact CB-CB 3.96Å
154	Y	92.1	Very high	86.6	Confident	8 Å²	8	44.3 Å²	44.3	3%	0.031	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	159.7	170.7	67.4	-107.7	0	0	0	112.1	F31 V133 N134 V151 A156 L214 D215 I216 D217	F31-Y154 HydrophobicContact CE1-CD1 4.13Å; F31-Y154 HydrophobicContact CE1-CE1 4.13Å; F31-Y154 HydrophobicContact CZ-CE1 4.19Å; V133-Y154 HydrophobicContact CG1-CD1 4.48Å; V133-Y154 HydrophobicContact CG1-CD2 3.56Å; V133-Y154 HydrophobicContact CG1-CE2 4.08Å; V133-Y154 HydrophobicContact CG1-CG 3.8Å; V133-Y154 HydrophobicContact CG2-CE2 4.45Å; N134-Y154 CarbonylContact O-C 3.59Å; N134-Y154 VanDerWaalsContact O-CA 3.3Å; N134-Y154 WeakPolarHBondContact O-CA 3.31Å; N134-Y154 VanDerWaalsContact O-CB 3.31Å; N134-Y154 WeakPolarHBondContact O-CB 3.2Å; V151-Y154 HydrophobicContact CG1-CD1 4.17Å; Y154-A156 HydrophobicContact CD2-CB 4.41Å; Y154-A156 HydrophobicContact CE2-CB 4.13Å; Y154-L214 HydrophobicContact CD1-CD1 3.5Å; Y154-L214 VanDerWaalsContact CD1-CD1 3.5Å; Y154-L214 HydrophobicContact CE1-CD1 3.48Å; Y154-L214 VanDerWaalsContact CE1-CD1 3.48Å; Y154-D215 PolarHBondContact N-O 3.01Å; Y154-D215 VanDerWaalsContact N-O 3.09Å; Y154-I216 HydrophobicContact CD2-CG1 4.46Å; Y154-I216 HydrophobicContact CD2-CG2 3.92Å; Y154-I216 HydrophobicContact CE1-CD1 4.24Å; Y154-I216 HydrophobicContact CE1-CG1 3.96Å; Y154-I216 HydrophobicContact CE2-CB 4.22Å; Y154-I216 HydrophobicContact CE2-CD1 4.23Å; Y154-I216 HydrophobicContact CE2-CG1 3.88Å; Y154-I216 HydrophobicContact CE2-CG2 3.41Å; Y154-I216 VanDerWaalsContact CE2-CG2 3.41Å; Y154-I216 WeakPolarHBondContact O-CA 3.3Å; Y154-I216 WeakPolarHBondContact OH-CD1 3.41Å; Y154-D217 PolarHBondContact O-N 3.13Å
155	Q	91.6	Very high	87.6	Confident	43 Å²	43	38.5 Å²	38.5	20%	0.201	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	136.7	171.3	-82.1	170.4	-17.9	0	0	110.1	V133 N134 T136 Y157 D217	V133-Q155 CarbonylContact C-O 2.94Å; V133-Q155 WeakPolarHBondContact CA-O 3.36Å; N134-Q155 HydrophobicContact CB-CB 4.22Å; N134-Q155 PolarHBondContact N-O 3.46Å; N134-Q155 PolarHBondContact O-N 2.95Å; T136-Q155 HydrophobicContact CG2-CB 4.28Å; T136-Q155 HydrophobicContact CG2-CG 3.85Å; Q155-Y157 HydrophobicContact CB-CE2 4.36Å; Q155-D217 WeakPolarHBondContact CA-O 3.2Å; Q155-D217 HydrophobicContact CG-CB 3.72Å; Q155-D217 WeakPolarHBondContact CG-OD2 3.18Å; Q155-D217 PolarHBondContact NE2-OD2 3.35Å
156	A	91.2	Very high	88.8	Confident	1 Å²	1	34.7 Å²	34.7	1%	0.008	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	124.9	175.6	0	0	0	0	0	110.3	T123 T132 Y154 I216 D217 F218 R219	T123-A156 HydrophobicContact CG2-CB 4.13Å; T132-A156 WeakPolarHBondContact O-CA 3.36Å; Y154-A156 HydrophobicContact CD2-CB 4.41Å; Y154-A156 HydrophobicContact CE2-CB 4.13Å; A156-I216 HydrophobicContact CB-CG2 4.21Å; A156-D217 PolarHBondContact N-O 3.29Å; A156-F218 HydrophobicContact CB-CD1 3.82Å; A156-F218 HydrophobicContact CB-CE1 4.04Å; A156-R219 PolarHBondContact O-N 3.16Å
157	Y	89.7	Confident	89.6	Confident	11 Å²	11	26.3 Å²	26.3	4%	0.043	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	122.4	-179.4	-62	-85.1	0	0	0	110.5	T132 N134 Q155 R219 L221 V229 P230 M233 Y236	T132-Y157 PolarHBondContact O-N 3.01Å; N134-Y157 HydrophobicContact CB-CE2 4.14Å; Q155-Y157 HydrophobicContact CB-CE2 4.36Å; Y157-R219 HydrophobicContact CD1-CB 3.75Å; Y157-R219 HydrophobicContact CD1-CG 4.34Å; Y157-R219 HydrophobicContact CE1-CB 4.03Å; Y157-R219 HydrophobicContact CE1-CG 4.14Å; Y157-L221 HydrophobicContact CD1-CD1 3.77Å; Y157-V229 HydrophobicContact CD1-CG2 4.29Å; Y157-V229 HydrophobicContact CE1-CG2 4.26Å; Y157-P230 VanDerWaalsContact OH-CD 3.28Å; Y157-P230 WeakPolarHBondContact OH-CD 3.46Å; Y157-M233 HydrophobicContact CD2-SD 3.57Å; Y157-M233 VanDerWaalsContact CD2-SD 3.57Å; Y157-M233 HydrophobicContact CE2-CE 4.43Å; Y157-M233 HydrophobicContact CE2-SD 3.33Å; Y157-M233 WeakPolarHBondContact CE2-SD 3.43Å; Y157-Y236 PolarHBondContact O-N 3.37Å
158	I	90.5	Very high	90.2	Very high	1 Å²	1	25 Å²	25	1%	0.005	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	143.9	-173.5	-52.7	166.1	0	0	0	109.5	L119 F162 A163 F218 R219 L220 L221	L119-I158 HydrophobicContact CD1-CD1 3.42Å; L119-I158 VanDerWaalsContact CD1-CD1 3.42Å; L119-I158 HydrophobicContact CD1-CG1 3.96Å; L119-I158 HydrophobicContact CD2-CD1 3.85Å; L119-I158 HydrophobicContact CG-CD1 4.29Å; I158-F162 HydrophobicContact CG2-CD1 3.68Å; I158-F162 HydrophobicContact CG2-CE1 4.44Å; I158-A163 HydrophobicContact CG2-CB 4.31Å; I158-F218 HydrophobicContact CD1-CB 4.47Å; I158-F218 HydrophobicContact CD1-CD1 3.44Å; I158-F218 VanDerWaalsContact CD1-CD1 3.44Å; I158-F218 HydrophobicContact CD1-CE1 4.01Å; I158-F218 HydrophobicContact CD1-CG 4.32Å; I158-R219 PolarHBondContact N-O 2.87Å; I158-L220 HydrophobicContact CB-CD2 3.89Å; I158-L220 HydrophobicContact CD1-CD2 4.3Å; I158-L220 HydrophobicContact CG2-CD2 4.29Å; I158-L220 WeakPolarHBondContact O-CA 3.34Å; I158-L221 PolarHBondContact O-N 3.47Å
159	S	90.6	Very high	90.7	Very high	1 Å²	1	21 Å²	21	1%	0.007	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	134.9	171.2	-175.5	0	0	0	0	111.4	T161 F162 A163 L221 Y236	S159-T161 PolarHBondContact O-N 3.38Å; S159-T161 PolarHBondContact OG-N 3.22Å; S159-T161 PolarHBondContact OG-OG1 3.13Å; S159-F162 PolarHBondContact O-N 3.42Å; S159-A163 WeakPolarHBondContact O-CB 3.39Å; S159-A163 PolarHBondContact O-N 3.47Å; S159-L221 CarbonylContact C-O 3.6Å; S159-Y236 WeakPolarHBondContact CB-O 3.41Å; S159-Y236 PolarHBondContact N-O 3.15Å
160	S	89.4	Confident	90.8	Very high	36 Å²	36	18.1 Å²	18.1	25%	0.252	10%	0.103	S	C	.	.	H	α-helix	trans	-62.1	-28.5	175.8	55.4	0	0	0	0	112.5	E164 L221	S160-E164 VanDerWaalsContact O-CB 3.23Å; S160-E164 WeakPolarHBondContact O-CB 3.32Å; S160-E164 PolarHBondContact O-N 3.07Å; S160-L221 WeakPolarHBondContact CB-O 3.32Å; S160-L221 PolarHBondContact N-O 3.11Å; S160-L221 PolarHBondContact OG-O 3.37Å; S160-L221 VanDerWaalsContact OG-O 3.08Å
161	T	90.6	Very high	90.9	Very high	71 Å²	71	22.1 Å²	22.1	44%	0.436	12%	0.121	S	C	.	.	H	α-helix	trans	-65.4	-47.7	175.9	52.4	0	0	0	0	111.8	S159 G165 E223 N237	S159-T161 PolarHBondContact O-N 3.38Å; S159-T161 PolarHBondContact OG-N 3.22Å; S159-T161 PolarHBondContact OG-OG1 3.13Å; T161-G165 PolarHBondContact O-N 2.96Å; T161-E223 PolarHBondContact OG1-OE1 3.37Å; T161-N237 PolarHBondContact OG1-OD1 3.46Å
162	F	90.9	Very high	90.9	Very high	3 Å²	3	23.5 Å²	23.5	1%	0.013	13%	0.128	C	C	.	.	H	α-helix	trans	-64.1	-47.4	175	174.3	-99.8	0	0	0	111.6	H118 L119 I158 S159 E164 G165 A166 Y236 G238 A240	H118-F162 HydrophobicContact CB-CZ 4.32Å; H118-F162 AromaticContact ND1-CE2 3.78Å; L119-F162 HydrophobicContact CB-CE1 4.37Å; L119-F162 HydrophobicContact CD1-CE1 4.44Å; I158-F162 HydrophobicContact CG2-CD1 3.68Å; I158-F162 HydrophobicContact CG2-CE1 4.44Å; S159-F162 PolarHBondContact O-N 3.42Å; F162-E164 PolarHBondContact O-N 3.04Å; F162-G165 PolarHBondContact O-N 3.29Å; F162-A166 WeakPolarHBondContact O-CB 3.32Å; F162-A166 PolarHBondContact O-N 3.46Å; F162-Y236 HydrophobicContact CD1-CD1 4.42Å; F162-Y236 HydrophobicContact CE1-CD1 4.39Å; F162-Y236 HydrophobicContact CE1-CE1 4.39Å; F162-Y236 HydrophobicContact CE2-CE1 4.46Å; F162-Y236 HydrophobicContact CZ-CE1 4.27Å; F162-G238 WeakPolarHBondContact CD2-O 3.18Å; F162-A240 HydrophobicContact CD2-CB 3.8Å; F162-A240 HydrophobicContact CE2-CB 4.13Å
163	A	91.4	Very high	90.9	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-61.5	-45.6	-177.4	0	0	0	0	0	112.7	I158 S159 F167 Y201 L220	I158-A163 HydrophobicContact CG2-CB 4.31Å; S159-A163 WeakPolarHBondContact O-CB 3.39Å; S159-A163 PolarHBondContact O-N 3.47Å; A163-F167 WeakPolarHBondContact O-CB 3.27Å; A163-F167 PolarHBondContact O-N 3.38Å; A163-Y201 HydrophobicContact CB-CD2 4.31Å; A163-Y201 HydrophobicContact CB-CE2 3.65Å; A163-L220 HydrophobicContact CB-CD1 3.82Å; A163-L220 HydrophobicContact CB-CD2 3.39Å; A163-L220 HydrophobicContact CB-CG 4.19Å
164	E	92.1	Very high	90.5	Very high	80 Å²	80	24 Å²	24	37%	0.374	13%	0.127	S	C	.	.	H	α-helix	trans	-69.6	-40.5	177.4	-169.3	61.1	-149.4	0	0	111.4	S160 F162 A166 F167 Q168 A197	S160-E164 VanDerWaalsContact O-CB 3.23Å; S160-E164 WeakPolarHBondContact O-CB 3.32Å; S160-E164 PolarHBondContact O-N 3.07Å; F162-E164 PolarHBondContact O-N 3.04Å; E164-A166 VanDerWaalsContact C-N 3.35Å; E164-A166 PolarHBondContact O-N 3.32Å; E164-F167 PolarHBondContact O-N 2.95Å; E164-Q168 HydrophobicContact CG-CG 4.35Å; E164-Q168 WeakPolarHBondContact O-CB 3.5Å; E164-Q168 VanDerWaalsContact O-CG 3.31Å; E164-Q168 WeakPolarHBondContact O-CG 2.81Å; E164-Q168 PolarHBondContact O-N 2.94Å; E164-Q168 PolarHBondContact OE1-NE2 2.93Å; E164-A197 VanDerWaalsContact OE2-CB 3.3Å; E164-A197 WeakPolarHBondContact OE2-CB 3.48Å
165	G	91.1	Very high	90	Very high	29 Å²	29	25 Å²	25	30%	0.299	13%	0.133	S	C	.	.	H	α-helix	trans	-58.6	-44.8	174.6	0	0	0	0	0	112.6	T161 F162 S169	T161-G165 PolarHBondContact O-N 2.96Å; F162-G165 PolarHBondContact O-N 3.29Å; G165-S169 PolarHBondContact O-N 3.25Å; G165-S169 VanDerWaalsContact O-N 3.15Å
166	A	91.8	Very high	89.2	Confident	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-63	-46.1	175	0	0	0	0	0	111.8	N115 F162 E164 S169 C170 W200 Y201	N115-A166 HydrophobicContact CB-CB 4.01Å; F162-A166 WeakPolarHBondContact O-CB 3.32Å; F162-A166 PolarHBondContact O-N 3.46Å; E164-A166 VanDerWaalsContact C-N 3.35Å; E164-A166 PolarHBondContact O-N 3.32Å; A166-S169 PolarHBondContact O-N 3.48Å; A166-S169 PolarHBondContact O-OG 2.94Å; A166-C170 PolarHBondContact O-N 3.44Å; A166-W200 HydrophobicContact CB-CZ3 4.38Å; A166-Y201 WeakPolarHBondContact CB-OH 3.48Å
167	F	92.8	Very high	88.2	Confident	6 Å²	6	25.3 Å²	25.3	3%	0.026	14%	0.143	C	C	.	.	H	α-helix	trans	-61.1	-47	178	174.8	-107	0	0	0	112.5	A163 E164 S169 C170 K171 I183 C195 A197 W200	A163-F167 WeakPolarHBondContact O-CB 3.27Å; A163-F167 PolarHBondContact O-N 3.38Å; E164-F167 PolarHBondContact O-N 2.95Å; F167-S169 VanDerWaalsContact C-N 3.26Å; F167-S169 PolarHBondContact O-N 3.17Å; F167-C170 PolarHBondContact O-N 3.33Å; F167-K171 HydrophobicContact CE1-CD 4.17Å; F167-K171 HydrophobicContact CZ-CD 4.49Å; F167-K171 HydrophobicContact CZ-CG 4.42Å; F167-K171 PolarHBondContact O-N 3.02Å; F167-I183 HydrophobicContact CD2-CD1 4.38Å; F167-I183 HydrophobicContact CE2-CD1 4.12Å; F167-I183 HydrophobicContact CE2-CG1 3.97Å; F167-C195 HydrophobicContact CE2-CB 4.36Å; F167-C195 HydrophobicContact CZ-CB 4.39Å; F167-C195 WeakPolarHBondContact CZ-O 3.17Å; F167-A197 HydrophobicContact CB-CB 3.73Å; F167-A197 HydrophobicContact CD1-CB 4.3Å; F167-A197 HydrophobicContact CG-CB 3.99Å; F167-W200 HydrophobicContact CB-CE3 4.24Å; F167-W200 HydrophobicContact CB-CZ3 4.49Å; F167-W200 HydrophobicContact CD2-CB 4.08Å; F167-W200 HydrophobicContact CD2-CD2 4.22Å; F167-W200 HydrophobicContact CD2-CE3 4.18Å; F167-W200 HydrophobicContact CD2-CG 4.22Å; F167-W200 HydrophobicContact CE2-CB 4.31Å
168	Q	91.8	Very high	87.2	Confident	73 Å²	73	26.1 Å²	26.1	34%	0.341	15%	0.149	S	C	.	.	H	α-helix	trans	-61.6	-35.7	178.8	-69.7	-61	-27.7	0	0	112.1	E164 C170	E164-Q168 HydrophobicContact CG-CG 4.35Å; E164-Q168 WeakPolarHBondContact O-CB 3.5Å; E164-Q168 VanDerWaalsContact O-CG 3.31Å; E164-Q168 WeakPolarHBondContact O-CG 2.81Å; E164-Q168 PolarHBondContact O-N 2.94Å; E164-Q168 PolarHBondContact OE1-NE2 2.93Å; Q168-C170 PolarHBondContact O-N 3.4Å
169	S	92	Very high	86	Confident	2 Å²	2	26.8 Å²	26.8	1%	0.014	16%	0.155	C	C	.	.	H	α-helix	trans	-62.7	-26.5	175.6	78.8	0	0	0	0	113.5	N115 G165 A166 F167	N115-S169 PolarHBondContact ND2-OG 3.49Å; G165-S169 PolarHBondContact O-N 3.25Å; G165-S169 VanDerWaalsContact O-N 3.15Å; A166-S169 PolarHBondContact O-N 3.48Å; A166-S169 PolarHBondContact O-OG 2.94Å; F167-S169 VanDerWaalsContact C-N 3.26Å; F167-S169 PolarHBondContact O-N 3.17Å
170	C	91.3	Very high	85.4	Confident	1 Å²	1	27.9 Å²	27.9	1%	0.007	17%	0.167	C	C	.	.	H	α-helix	trans	-103.7	-17.7	-175.5	-65.6	0	0	0	0	114.6	C112 A166 F167 Q168 N172 V173	C112-C170 VanDerWaalsContact CA-SG 3.53Å; C112-C170 HydrophobicContact CB-CB 4.02Å; C112-C170 WeakPolarHBondContact CB-SG 3.4Å; C112-C170 WeakPolarHBondContact SG-CA 3.23Å; C112-C170 WeakPolarHBondContact SG-CB 3.36Å; C112-C170 CovalentContact SG-SG 2.02Å; C112-C170 PolarHBondContact SG-SG 2.92Å; A166-C170 PolarHBondContact O-N 3.44Å; F167-C170 PolarHBondContact O-N 3.33Å; Q168-C170 PolarHBondContact O-N 3.4Å; C170-N172 VanDerWaalsContact C-N 3.27Å; C170-N172 PolarHBondContact O-N 3.34Å; C170-N172 VanDerWaalsContact O-N 3.15Å; C170-V173 WeakPolarHBondContact O-CG2 3.32Å; C170-V173 PolarHBondContact O-N 3.3Å
171	K	90.1	Very high	85.1	Confident	84 Å²	84	29 Å²	29	37%	0.365	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-36.7	-169.4	-179	178.6	176.4	-179.1	0	114.3	F167	F167-K171 HydrophobicContact CE1-CD 4.17Å; F167-K171 HydrophobicContact CZ-CD 4.49Å; F167-K171 HydrophobicContact CZ-CG 4.42Å; F167-K171 PolarHBondContact O-N 3.02Å
172	N	88.3	Confident	84.9	Confident	30 Å²	30	25.6 Å²	25.6	16%	0.16	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.4	1.2	-172.8	-64.2	-51.1	0	0	0	114	C170 R174 D258	C170-N172 VanDerWaalsContact C-N 3.27Å; C170-N172 PolarHBondContact O-N 3.34Å; C170-N172 VanDerWaalsContact O-N 3.15Å; N172-R174 PolarHBondContact O-N 2.97Å; N172-D258 CarbonylContact C-O 3.55Å; N172-D258 VanDerWaalsContact C-O 3.23Å; N172-D258 WeakPolarHBondContact CB-O 3.38Å
173	V	88.7	Confident	84.8	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	15%	0.146	C	C	.	.			trans	-63.7	129.9	179.8	-179.4	0	0	0	0	109.6	R108 C109 C112 C170 F181 A182 D258	R108-V173 HydrophobicContact CB-CG1 4.26Å; C109-V173 HydrophobicContact CB-CG2 3.61Å; C112-V173 HydrophobicContact CB-CG2 4.42Å; C170-V173 WeakPolarHBondContact O-CG2 3.32Å; C170-V173 PolarHBondContact O-N 3.3Å; V173-F181 CarbonylContact O-C 3.58Å; V173-F181 WeakPolarHBondContact O-CA 3.43Å; V173-A182 HydrophobicContact CB-CB 4.17Å; V173-A182 HydrophobicContact CG1-CB 4.01Å; V173-A182 PolarHBondContact O-N 3.1Å; V173-D258 HydrophobicContact CG2-CB 4.4Å; V173-D258 PolarHBondContact N-O 3.03Å
174	R	83.7	Confident	84.3	Confident	25 Å²	25	26.4 Å²	26.4	9%	0.094	15%	0.154	C	C	.	.	B	Isolated β-bridge	trans	-105.5	160.9	-174.1	-69.4	-168.4	175.2	-120.3	7.9	113.5	R108 N172 G179 G180 F181 D258	R108-R174 VanDerWaalsContact CD-O 3.31Å; R108-R174 WeakPolarHBondContact CD-O 3.34Å; N172-R174 PolarHBondContact O-N 2.97Å; R174-G179 PolarHBondContact NH1-O 3.29Å; R174-G180 CarbonylContact C-O 3.6Å; R174-G180 VanDerWaalsContact CA-O 3.31Å; R174-G180 WeakPolarHBondContact CA-O 3.18Å; R174-F181 HydrophobicContact CG-CD1 4.18Å; R174-F181 HydrophobicContact CG-CE1 4.35Å; R174-D258 PolarHBondContact N-OD1 3.3Å
175	I	81.6	Confident	83.8	Confident	29 Å²	29	24.8 Å²	24.8	15%	0.149	15%	0.149	C	C	.	.			trans	-111.4	101	168.7	-59.2	174	0	0	0	107.8	V105 A177 T178 G179 G180 A182 T185 L532	V105-I175 HydrophobicContact CG1-CD1 4.22Å; V105-I175 HydrophobicContact CG1-CG1 4.36Å; I175-A177 VanDerWaalsContact C-N 3.34Å; I175-A177 HydrophobicContact CG2-CB 4.39Å; I175-A177 PolarHBondContact O-N 3.06Å; I175-T178 HydrophobicContact CG2-CG2 4.21Å; I175-T178 PolarHBondContact O-N 3.05Å; I175-T178 VanDerWaalsContact O-N 3.09Å; I175-T178 PolarHBondContact O-OG1 3.06Å; I175-G179 PolarHBondContact O-N 3.45Å; I175-G180 PolarHBondContact N-O 3.42Å; I175-A182 HydrophobicContact CG1-CB 4.29Å; I175-T185 HydrophobicContact CD1-CG2 4.07Å; I175-L532 HydrophobicContact CD1-CD1 4.21Å
176	P	74.4	Confident	83.5	Confident	3 Å²	3	24.1 Å²	24.1	2%	0.019	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55	-41	-174.7	-26.9	34.6	0	0	0	114.8	T178 G179 N954 D958	P176-T178 PolarHBondContact O-N 3.05Å; P176-T178 VanDerWaalsContact O-N 3.11Å; P176-G179 PolarHBondContact O-N 2.92Å; P176-N954 WeakPolarHBondContact O-CA 3.25Å; P176-D958 HydrophobicContact CB-CB 4.18Å; P176-D958 HydrophobicContact CG-CB 3.92Å
177	A	69.1	Low	83.2	Confident	47 Å²	47	24.1 Å²	24.1	39%	0.388	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.1	-35.7	175.5	0	0	0	0	0	114.4	I175 D959 Y1037	I175-A177 VanDerWaalsContact C-N 3.34Å; I175-A177 HydrophobicContact CG2-CB 4.39Å; I175-A177 PolarHBondContact O-N 3.06Å; A177-D959 WeakPolarHBondContact CA-OD2 3.29Å; A177-D959 WeakPolarHBondContact CB-OD2 3.41Å; A177-D959 PolarHBondContact N-OD2 2.71Å; A177-D959 VanDerWaalsContact N-OD2 3.13Å; A177-Y1037 WeakPolarHBondContact CA-OH 3.42Å
178	T	69.4	Low	82.6	Confident	28 Å²	28	24 Å²	24	17%	0.172	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.8	-14.2	-171.9	65.3	0	0	0	0	112.8	I175 P176 G180 L532 F553	I175-T178 HydrophobicContact CG2-CG2 4.21Å; I175-T178 PolarHBondContact O-N 3.05Å; I175-T178 VanDerWaalsContact O-N 3.09Å; I175-T178 PolarHBondContact O-OG1 3.06Å; P176-T178 PolarHBondContact O-N 3.05Å; P176-T178 VanDerWaalsContact O-N 3.11Å; T178-G180 PolarHBondContact O-N 3.45Å; T178-G180 PolarHBondContact OG1-N 3.09Å; T178-L532 HydrophobicContact CG2-CD1 3.93Å; T178-L532 HydrophobicContact CG2-CD2 3.57Å; T178-L532 HydrophobicContact CG2-CG 4.39Å; T178-F553 HydrophobicContact CG2-CZ 4.18Å
179	G	65.8	Low	81.7	Confident	14 Å²	14	22.7 Å²	22.7	14%	0.144	13%	0.131	C	C	.	.	S	Bend	trans	70.9	-5.2	-171	0	0	0	0	0	114.8	R174 I175 P176	R174-G179 PolarHBondContact NH1-O 3.29Å; I175-G179 PolarHBondContact O-N 3.45Å; P176-G179 PolarHBondContact O-N 2.92Å
180	G	76.4	Confident	81	Confident	25 Å²	25	25.1 Å²	25.1	26%	0.258	14%	0.14	S	C	.	.	S	Bend	trans	-84.9	-176.1	-177.7	0	0	0	0	0	114.7	R174 I175 T178	R174-G180 CarbonylContact C-O 3.6Å; R174-G180 VanDerWaalsContact CA-O 3.31Å; R174-G180 WeakPolarHBondContact CA-O 3.18Å; I175-G180 PolarHBondContact N-O 3.42Å; T178-G180 PolarHBondContact O-N 3.45Å; T178-G180 PolarHBondContact OG1-N 3.09Å
181	F	84.9	Confident	80.4	Confident	58 Å²	58	25.3 Å²	25.3	25%	0.254	14%	0.142	S	C	.	.	B	Isolated β-bridge	trans	-98.2	139.4	179.4	-60.7	-80.6	0	0	0	111.8	V173 R174 I183 A184	V173-F181 CarbonylContact O-C 3.58Å; V173-F181 WeakPolarHBondContact O-CA 3.43Å; R174-F181 HydrophobicContact CG-CD1 4.18Å; R174-F181 HydrophobicContact CG-CE1 4.35Å; F181-I183 VanDerWaalsContact C-N 3.25Å; F181-I183 HydrophobicContact CB-CG2 3.98Å; F181-I183 PolarHBondContact O-N 3.17Å; F181-A184 VanDerWaalsContact O-CB 3.25Å; F181-A184 WeakPolarHBondContact O-CB 3.27Å; F181-A184 PolarHBondContact O-N 3.45Å; F181-A184 VanDerWaalsContact O-N 3.14Å
182	A	86.1	Confident	79.9	Confident	0 Å²	0	22.9 Å²	22.9	0%	0	14%	0.136	C	C	.	.	G	3₁₀ helix	trans	-56.9	-41	174.6	0	0	0	0	0	111.9	V105 L106 V173 I175 A184 T185	V105-A182 HydrophobicContact CG1-CB 3.7Å; L106-A182 HydrophobicContact CD2-CB 4.07Å; V173-A182 HydrophobicContact CB-CB 4.17Å; V173-A182 HydrophobicContact CG1-CB 4.01Å; V173-A182 PolarHBondContact O-N 3.1Å; I175-A182 HydrophobicContact CG1-CB 4.29Å; A182-A184 PolarHBondContact O-N 3.01Å; A182-A184 VanDerWaalsContact O-N 3.12Å; A182-T185 PolarHBondContact O-N 3.23Å; A182-T185 PolarHBondContact O-OG1 2.9Å
183	I	87.5	Confident	79.3	Confident	2 Å²	2	28.5 Å²	28.5	1%	0.01	16%	0.159	C	C	.	.	G	3₁₀ helix	trans	-60	-25.9	-179.4	-157.6	60.1	0	0	0	112.9	F167 F181 T185 M186 C187 W200	F167-I183 HydrophobicContact CD2-CD1 4.38Å; F167-I183 HydrophobicContact CE2-CD1 4.12Å; F167-I183 HydrophobicContact CE2-CG1 3.97Å; F181-I183 VanDerWaalsContact C-N 3.25Å; F181-I183 HydrophobicContact CB-CG2 3.98Å; F181-I183 PolarHBondContact O-N 3.17Å; I183-T185 PolarHBondContact O-N 3.41Å; I183-M186 HydrophobicContact CD1-CB 4.46Å; I183-M186 CarbonylContact O-C 3.46Å; I183-M186 PolarHBondContact O-N 2.97Å; I183-C187 PolarHBondContact O-N 3.35Å; I183-C187 PolarHBondContact O-SG 3.43Å; I183-C187 VanDerWaalsContact O-SG 3.33Å; I183-W200 HydrophobicContact CD1-CD2 4.21Å; I183-W200 HydrophobicContact CD1-CG 3.86Å; I183-W200 VanDerWaalsContact CD1-NE1 3.3Å
184	A	81.6	Confident	78.9	Confident	18 Å²	18	33.9 Å²	33.9	15%	0.149	19%	0.187	C	C	.	.	G	3₁₀ helix	trans	-60.1	-33.8	175.2	0	0	0	0	0	111.9	F181 A182 M186 S530	F181-A184 VanDerWaalsContact O-CB 3.25Å; F181-A184 WeakPolarHBondContact O-CB 3.27Å; F181-A184 PolarHBondContact O-N 3.45Å; F181-A184 VanDerWaalsContact O-N 3.14Å; A182-A184 PolarHBondContact O-N 3.01Å; A182-A184 VanDerWaalsContact O-N 3.12Å; A184-M186 VanDerWaalsContact C-N 3.31Å; A184-S530 PolarHBondContact O-OG 3.48Å
185	T	81	Confident	79.1	Confident	46 Å²	46	33.1 Å²	33.1	28%	0.282	19%	0.185	S	C	.	.	G	3₁₀ helix	trans	-81.3	-11.1	178.2	69.2	0	0	0	0	113.3	I175 A182 I183 L532	I175-T185 HydrophobicContact CD1-CG2 4.07Å; A182-T185 PolarHBondContact O-N 3.23Å; A182-T185 PolarHBondContact O-OG1 2.9Å; I183-T185 PolarHBondContact O-N 3.41Å; T185-L532 HydrophobicContact CG2-CB 3.92Å; T185-L532 HydrophobicContact CG2-CD1 4.02Å
186	M	85.1	Confident	79.5	Confident	15 Å²	15	34.8 Å²	34.8	7%	0.074	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-115.7	8.5	-173.9	-58.3	-176.6	74.6	0	0	113.3	L106 F116 I183 A184 W200 F203	L106-M186 HydrophobicContact CD1-CE 4.08Å; L106-M186 HydrophobicContact CD1-SD 3.99Å; L106-M186 HydrophobicContact CD2-SD 3.92Å; L106-M186 HydrophobicContact CG-SD 4.1Å; F116-M186 HydrophobicContact CD2-CE 4.06Å; F116-M186 HydrophobicContact CE2-CE 3.37Å; F116-M186 HydrophobicContact CZ-CE 3.83Å; I183-M186 HydrophobicContact CD1-CB 4.46Å; I183-M186 CarbonylContact O-C 3.46Å; I183-M186 PolarHBondContact O-N 2.97Å; A184-M186 VanDerWaalsContact C-N 3.31Å; M186-W200 VanDerWaalsContact O-CD1 3.27Å; M186-F203 WeakPolarHBondContact O-CD1 3.46Å; M186-F203 WeakPolarHBondContact O-CG 3.42Å
187	C	86.1	Confident	80.3	Confident	1 Å²	1	34.8 Å²	34.8	1%	0.007	20%	0.197	C	C	.	.	S	Bend	trans	-122.3	15.6	179.2	-65.2	0	0	0	0	113.2	I183 R189 Y190 C195	I183-C187 PolarHBondContact O-N 3.35Å; I183-C187 PolarHBondContact O-SG 3.43Å; I183-C187 VanDerWaalsContact O-SG 3.33Å; C187-R189 PolarHBondContact O-N 2.95Å; C187-R189 VanDerWaalsContact O-N 3.12Å; C187-Y190 PolarHBondContact O-N 3.21Å; C187-C195 HydrophobicContact CB-CB 3.57Å; C187-C195 WeakPolarHBondContact CB-SG 3.4Å; C187-C195 WeakPolarHBondContact SG-CB 3.41Å; C187-C195 CovalentContact SG-SG 2.01Å; C187-C195 PolarHBondContact SG-SG 3.35Å
188	G	79.3	Confident	81.3	Confident	2 Å²	2	35.6 Å²	35.6	2%	0.021	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	49.4	-116.1	176.9	0	0	0	0	0	113	Y190 F203 Y526 S530	G188-Y190 VanDerWaalsContact C-N 3.27Å; G188-Y190 PolarHBondContact O-N 3.04Å; G188-F203 VanDerWaalsContact CA-CD2 3.43Å; G188-F203 VanDerWaalsContact N-CD2 3.34Å; G188-Y526 VanDerWaalsContact C-CE2 3.46Å; G188-S530 PolarHBondContact O-OG 2.78Å
189	R	73.8	Confident	82.3	Confident	46 Å²	46	38.1 Å²	38.1	17%	0.174	20%	0.199	C	C	.	.	G	3₁₀ helix	trans	-65.3	-20.1	-174.2	55.6	178.6	-175.2	-151.9	-0.7	115.9	C187 L428 F429 E511 Y526 I537	C187-R189 PolarHBondContact O-N 2.95Å; C187-R189 VanDerWaalsContact O-N 3.12Å; R189-L428 WeakPolarHBondContact CD-O 3.03Å; R189-L428 PolarHBondContact NE-O 3.36Å; R189-L428 VanDerWaalsContact NH1-CD2 3.3Å; R189-L428 PolarHBondContact NH1-O 3.42Å; R189-F429 HydrophobicContact CB-CD1 4.02Å; R189-F429 HydrophobicContact CB-CE1 3.28Å; R189-F429 HydrophobicContact CB-CZ 3.64Å; R189-F429 HydrophobicContact CG-CE1 4.41Å; R189-F429 WeakPolarHBondContact O-CE1 3.4Å; R189-E511 IonicContact CZ-OE1 3.67Å; R189-E511 IonicContact NH1-OE1 3.03Å; R189-E511 PolarHBondContact NH1-OE1 2.78Å; R189-E511 IonicContact NH1-OE2 3.58Å; R189-E511 PolarHBondContact NH1-OE2 2.83Å; R189-E511 IonicContact NH2-OE1 3.59Å; R189-E511 PolarHBondContact NH2-OE1 2.78Å; R189-Y526 HydrophobicContact CB-CD2 4.36Å; R189-I537 HydrophobicContact CB-CD1 3.67Å; R189-I537 HydrophobicContact CG-CD1 3.88Å
190	Y	76.8	Confident	83.5	Confident	54 Å²	54	37.5 Å²	37.5	21%	0.212	19%	0.192	C	C	.	.	G	3₁₀ helix	trans	-93.2	-8.8	-169.3	-60	-69.8	0	0	0	114.3	C187 G188 L194 R199	C187-Y190 PolarHBondContact O-N 3.21Å; G188-Y190 VanDerWaalsContact C-N 3.27Å; G188-Y190 PolarHBondContact O-N 3.04Å; Y190-L194 HydrophobicContact CD1-CB 4.47Å; Y190-L194 WeakPolarHBondContact O-CB 3.27Å; Y190-L194 PolarHBondContact O-N 3.03Å; Y190-R199 HydrophobicContact CD2-CB 3.87Å; Y190-R199 HydrophobicContact CD2-CG 3.87Å; Y190-R199 VanDerWaalsContact CE1-CZ 3.46Å; Y190-R199 HydrophobicContact CE2-CB 4.03Å; Y190-R199 HydrophobicContact CE2-CG 3.64Å
191	G	77.9	Confident	84.2	Confident	5 Å²	5	36.3 Å²	36.3	5%	0.052	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.2	-159.6	-172.3	0	0	0	0	0	112.1	C195	G191-C195 WeakPolarHBondContact O-CB 3.46Å
192	S	80.5	Confident	84.4	Confident	33 Å²	33	36.7 Å²	36.7	23%	0.231	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-36	-179.2	57.4	0	0	0	0	114.6
193	K	75.7	Confident	84.5	Confident	148 Å²	148	37.8 Å²	37.8	64%	0.643	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.2	-37.9	-171.7	-74.3	178.8	-179.8	173.5	0	113.8	C195 D564	K193-C195 VanDerWaalsContact C-N 3.33Å; K193-D564 WeakPolarHBondContact CD-OD2 3.33Å; K193-D564 WeakPolarHBondContact CE-OD2 3.35Å; K193-D564 IonicContact NZ-OD1 3.09Å; K193-D564 PolarHBondContact NZ-OD1 3.3Å; K193-D564 IonicContact NZ-OD2 2.84Å; K193-D564 PolarHBondContact NZ-OD2 3.18Å
194	L	80.6	Confident	84.6	Confident	112 Å²	112	38.3 Å²	38.3	59%	0.586	19%	0.192	S	C	*	.	S	Bend	trans	-92.9	5.9	179.2	-59.4	172.3	0	0	0	112.3	Y190 R199	Y190-L194 HydrophobicContact CD1-CB 4.47Å; Y190-L194 WeakPolarHBondContact O-CB 3.27Å; Y190-L194 PolarHBondContact O-N 3.03Å; L194-R199 WeakPolarHBondContact O-CD 3.31Å; L194-R199 PolarHBondContact O-NH1 3.38Å
195	C	87.6	Confident	84.9	Confident	10 Å²	10	37.6 Å²	37.6	7%	0.068	19%	0.187	C	C	.	.			trans	-75.7	135.4	177.5	-164.1	0	0	0	0	111.6	F167 C187 G191 K193	F167-C195 HydrophobicContact CE2-CB 4.36Å; F167-C195 HydrophobicContact CZ-CB 4.39Å; F167-C195 WeakPolarHBondContact CZ-O 3.17Å; C187-C195 HydrophobicContact CB-CB 3.57Å; C187-C195 WeakPolarHBondContact CB-SG 3.4Å; C187-C195 WeakPolarHBondContact SG-CB 3.41Å; C187-C195 CovalentContact SG-SG 2.01Å; C187-C195 PolarHBondContact SG-SG 3.35Å; G191-C195 WeakPolarHBondContact O-CB 3.46Å; K193-C195 VanDerWaalsContact C-N 3.33Å
196	T	91	Very high	85.2	Confident	64 Å²	64	38.2 Å²	38.2	39%	0.393	19%	0.188	S	C	.	.			trans	-123.1	164	172.3	64.1	0	0	0	0	108.9	Q198 R199 W200	T196-Q198 VanDerWaalsContact C-N 3.26Å; T196-Q198 PolarHBondContact O-N 3.48Å; T196-R199 PolarHBondContact O-N 3.42Å; T196-R199 VanDerWaalsContact O-N 3.12Å; T196-R199 WeakPolarHBondContact OG1-CG 3.37Å; T196-R199 PolarHBondContact OG1-N 2.91Å; T196-W200 WeakPolarHBondContact O-CB 3.39Å; T196-W200 PolarHBondContact O-N 3.31Å
197	A	90.7	Very high	85.2	Confident	3 Å²	3	38.9 Å²	38.9	3%	0.025	19%	0.193	C	C	.	.	H	α-helix	trans	-53.3	-43.5	177.8	0	0	0	0	0	112.5	E164 F167 W200 Y201 L220	E164-A197 VanDerWaalsContact OE2-CB 3.3Å; E164-A197 WeakPolarHBondContact OE2-CB 3.48Å; F167-A197 HydrophobicContact CB-CB 3.73Å; F167-A197 HydrophobicContact CD1-CB 4.3Å; F167-A197 HydrophobicContact CG-CB 3.99Å; A197-W200 PolarHBondContact O-N 2.98Å; A197-Y201 WeakPolarHBondContact O-CD2 3.3Å; A197-Y201 PolarHBondContact O-N 3.35Å; A197-Y201 VanDerWaalsContact O-N 3.09Å; A197-L220 HydrophobicContact CB-CD1 4.25Å
198	Q	90.3	Very high	84.8	Confident	63 Å²	63	40 Å²	40	29%	0.294	20%	0.201	S	C	.	.	H	α-helix	trans	-58.2	-53.4	175.8	-175.1	66.8	46	0	0	111.4	T196 W200 Y201 D202 F218 L220	T196-Q198 VanDerWaalsContact C-N 3.26Å; T196-Q198 PolarHBondContact O-N 3.48Å; Q198-W200 VanDerWaalsContact C-N 3.26Å; Q198-W200 PolarHBondContact O-N 2.96Å; Q198-Y201 PolarHBondContact O-N 3.48Å; Q198-Y201 VanDerWaalsContact O-N 3.1Å; Q198-D202 PolarHBondContact NE2-OD1 3.43Å; Q198-D202 PolarHBondContact O-N 2.55Å; Q198-F218 PolarHBondContact NE2-O 3.11Å; Q198-L220 HydrophobicContact CB-CD1 4.06Å
199	R	89.6	Confident	84.7	Confident	82 Å²	82	40.2 Å²	40.2	31%	0.309	20%	0.202	S	C	.	.	H	α-helix	trans	-62.5	-33.9	-177.9	-69.2	170.6	173.9	-176.2	-2.1	112.8	Y190 L194 T196 F203	Y190-R199 HydrophobicContact CD2-CB 3.87Å; Y190-R199 HydrophobicContact CD2-CG 3.87Å; Y190-R199 VanDerWaalsContact CE1-CZ 3.46Å; Y190-R199 HydrophobicContact CE2-CB 4.03Å; Y190-R199 HydrophobicContact CE2-CG 3.64Å; L194-R199 WeakPolarHBondContact O-CD 3.31Å; L194-R199 PolarHBondContact O-NH1 3.38Å; T196-R199 PolarHBondContact O-N 3.42Å; T196-R199 VanDerWaalsContact O-N 3.12Å; T196-R199 WeakPolarHBondContact OG1-CG 3.37Å; T196-R199 PolarHBondContact OG1-N 2.91Å; R199-F203 WeakPolarHBondContact O-CB 3.45Å; R199-F203 PolarHBondContact O-N 3.43Å
200	W	90.9	Very high	84.8	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-66.5	-40.4	175.9	-179.6	53.4	0	0	0	112.1	F116 A166 F167 I183 M186 T196 A197 Q198 Q204	F116-W200 AromaticContact CD2-CH2 3.91Å; F116-W200 HydrophobicContact CD2-CH2 3.91Å; F116-W200 AromaticContact CD2-CZ2 3.56Å; F116-W200 HydrophobicContact CD2-CZ2 3.56Å; F116-W200 HydrophobicContact CE2-CZ2 4.07Å; A166-W200 HydrophobicContact CB-CZ3 4.38Å; F167-W200 HydrophobicContact CB-CE3 4.24Å; F167-W200 HydrophobicContact CB-CZ3 4.49Å; F167-W200 HydrophobicContact CD2-CB 4.08Å; F167-W200 HydrophobicContact CD2-CD2 4.22Å; F167-W200 HydrophobicContact CD2-CE3 4.18Å; F167-W200 HydrophobicContact CD2-CG 4.22Å; F167-W200 HydrophobicContact CE2-CB 4.31Å; I183-W200 HydrophobicContact CD1-CD2 4.21Å; I183-W200 HydrophobicContact CD1-CG 3.86Å; I183-W200 VanDerWaalsContact CD1-NE1 3.3Å; M186-W200 VanDerWaalsContact O-CD1 3.27Å; T196-W200 WeakPolarHBondContact O-CB 3.39Å; T196-W200 PolarHBondContact O-N 3.31Å; A197-W200 PolarHBondContact O-N 2.98Å; Q198-W200 VanDerWaalsContact C-N 3.26Å; Q198-W200 PolarHBondContact O-N 2.96Å; W200-Q204 WeakPolarHBondContact O-CG 3.46Å; W200-Q204 PolarHBondContact O-N 3.07Å; W200-Q204 PolarHBondContact O-NE2 3.35Å
201	Y	91.3	Very high	85	Confident	1 Å²	1	38.7 Å²	38.7	0%	0.004	20%	0.2	C	C	.	.	H	α-helix	trans	-75.7	-37.4	174.8	-73.2	-59.7	0	0	0	112.4	L119 A163 A166 A197 Q198 F203 Q204 G205 F218 L220	L119-Y201 HydrophobicContact CD2-CD1 3.55Å; L119-Y201 HydrophobicContact CD2-CE1 3.15Å; A163-Y201 HydrophobicContact CB-CD2 4.31Å; A163-Y201 HydrophobicContact CB-CE2 3.65Å; A166-Y201 WeakPolarHBondContact CB-OH 3.48Å; A197-Y201 WeakPolarHBondContact O-CD2 3.3Å; A197-Y201 PolarHBondContact O-N 3.35Å; A197-Y201 VanDerWaalsContact O-N 3.09Å; Q198-Y201 PolarHBondContact O-N 3.48Å; Q198-Y201 VanDerWaalsContact O-N 3.1Å; Y201-F203 VanDerWaalsContact C-N 3.3Å; Y201-F203 PolarHBondContact O-N 2.98Å; Y201-Q204 WeakPolarHBondContact O-CB 3.2Å; Y201-Q204 PolarHBondContact O-N 2.96Å; Y201-G205 PolarHBondContact O-N 3.24Å; Y201-F218 WeakPolarHBondContact O-CD2 3.27Å; Y201-L220 HydrophobicContact CD2-CD1 4.31Å; Y201-L220 HydrophobicContact CD2-CD2 4.21Å
202	D	89.3	Confident	85.5	Confident	65 Å²	65	38.8 Å²	38.8	35%	0.348	20%	0.201	S	C	.	.	H	α-helix	trans	-56.2	-47.3	173.6	-63.1	-21.7	0	0	0	110.1	Q198 Q204 G205 D206	Q198-D202 PolarHBondContact NE2-OD1 3.43Å; Q198-D202 PolarHBondContact O-N 2.55Å; D202-Q204 VanDerWaalsContact C-N 3.28Å; D202-Q204 PolarHBondContact O-N 3.08Å; D202-G205 PolarHBondContact O-N 3.29Å; D202-D206 WeakPolarHBondContact O-CB 3.2Å; D202-D206 PolarHBondContact O-N 2.68Å
203	F	88.3	Confident	85.7	Confident	24 Å²	24	39.4 Å²	39.4	11%	0.105	20%	0.204	C	C	.	.	H	α-helix	trans	-60.7	-37.1	176.4	-180	-98.3	0	0	0	112.8	M186 G188 R199 Y201 G205 N209 I537	M186-F203 WeakPolarHBondContact O-CD1 3.46Å; M186-F203 WeakPolarHBondContact O-CG 3.42Å; G188-F203 VanDerWaalsContact CA-CD2 3.43Å; G188-F203 VanDerWaalsContact N-CD2 3.34Å; R199-F203 WeakPolarHBondContact O-CB 3.45Å; R199-F203 PolarHBondContact O-N 3.43Å; Y201-F203 VanDerWaalsContact C-N 3.3Å; Y201-F203 PolarHBondContact O-N 2.98Å; F203-G205 VanDerWaalsContact C-N 3.33Å; F203-N209 HydrophobicContact CD2-CB 4.48Å; F203-N209 HydrophobicContact CE2-CB 3.74Å; F203-N209 HydrophobicContact CZ-CB 3.87Å; F203-N209 PolarHBondContact O-ND2 2.84Å; F203-I537 HydrophobicContact CD2-CG2 4.36Å; F203-I537 HydrophobicContact CE2-CG2 3.9Å
204	Q	89	Confident	86.4	Confident	12 Å²	12	32.9 Å²	32.9	6%	0.056	18%	0.176	C	C	.	.	H	α-helix	trans	-69.7	-29	178	-86	171.5	72.9	0	0	113.8	F116 Y120 W200 Y201 D202 F218	F116-Q204 VanDerWaalsContact CE2-CD 3.44Å; F116-Q204 HydrophobicContact CE2-CG 4.09Å; Y120-Q204 VanDerWaalsContact OH-CB 3.3Å; Y120-Q204 WeakPolarHBondContact OH-CB 3.44Å; Y120-Q204 WeakPolarHBondContact OH-CG 3.41Å; Y120-Q204 PolarHBondContact OH-OE1 2.86Å; W200-Q204 WeakPolarHBondContact O-CG 3.46Å; W200-Q204 PolarHBondContact O-N 3.07Å; W200-Q204 PolarHBondContact O-NE2 3.35Å; Y201-Q204 WeakPolarHBondContact O-CB 3.2Å; Y201-Q204 PolarHBondContact O-N 2.96Å; D202-Q204 VanDerWaalsContact C-N 3.28Å; D202-Q204 PolarHBondContact O-N 3.08Å; Q204-F218 HydrophobicContact CB-CE2 4.38Å
205	G	88.6	Confident	86.8	Confident	4 Å²	4	30.3 Å²	30.3	4%	0.041	16%	0.163	C	C	.	.	H	α-helix	trans	-93.7	-6.7	179.8	0	0	0	0	0	114.3	Y201 D202 F203 D215 I216	Y201-G205 PolarHBondContact O-N 3.24Å; D202-G205 PolarHBondContact O-N 3.29Å; F203-G205 VanDerWaalsContact C-N 3.33Å; G205-D215 CarbonylContact O-C 3.56Å; G205-D215 WeakPolarHBondContact O-CA 3.33Å; G205-I216 WeakPolarHBondContact CA-O 3.24Å; G205-I216 PolarHBondContact O-N 2.85Å
206	D	86.2	Confident	87	Confident	59 Å²	59	30.5 Å²	30.5	32%	0.316	16%	0.163	S	C	.	.			trans	-90.6	120.5	-177.5	-176.9	2.3	0	0	0	111.5	D202 S208 N209 A212	D202-D206 WeakPolarHBondContact O-CB 3.2Å; D202-D206 PolarHBondContact O-N 2.68Å; D206-S208 VanDerWaalsContact C-N 3.27Å; D206-S208 PolarHBondContact O-N 3.45Å; D206-S208 VanDerWaalsContact OD1-CB 3.24Å; D206-S208 WeakPolarHBondContact OD1-CB 3.33Å; D206-S208 PolarHBondContact OD1-N 3.27Å; D206-S208 PolarHBondContact OD1-OG 2.81Å; D206-S208 PolarHBondContact OD2-OG 3.41Å; D206-N209 PolarHBondContact O-ND2 3.31Å; D206-N209 PolarHBondContact O-OD1 2.89Å; D206-A212 WeakPolarHBondContact O-CB 3.44Å
207	T	85.3	Confident	87	Confident	28 Å²	28	29.9 Å²	29.9	17%	0.172	16%	0.157	C	C	.	.	G	3₁₀ helix	trans	-71.7	-17	178.3	54.7	0	0	0	0	114.2	V41 N209 G210 A212 L214 D215	V41-T207 HydrophobicContact CG2-CG2 4.18Å; T207-N209 PolarHBondContact O-N 2.86Å; T207-G210 PolarHBondContact O-N 3.49Å; T207-G210 VanDerWaalsContact O-N 3.09Å; T207-A212 HydrophobicContact CG2-CB 4.39Å; T207-L214 VanDerWaalsContact CG2-CA 3.5Å; T207-D215 VanDerWaalsContact CB-OD1 3.32Å; T207-D215 WeakPolarHBondContact CB-OD1 3.28Å; T207-D215 WeakPolarHBondContact CG2-OD1 3.41Å; T207-D215 PolarHBondContact N-OD1 3Å; T207-D215 PolarHBondContact OG1-OD1 3.07Å
208	S	77.4	Confident	87	Confident	24 Å²	24	29.7 Å²	29.7	17%	0.168	16%	0.156	C	C	.	.	G	3₁₀ helix	trans	-59.6	-32.9	-179.2	74.2	0	0	0	0	112.8	D206 G210 I537	D206-S208 VanDerWaalsContact C-N 3.27Å; D206-S208 PolarHBondContact O-N 3.45Å; D206-S208 VanDerWaalsContact OD1-CB 3.24Å; D206-S208 WeakPolarHBondContact OD1-CB 3.33Å; D206-S208 PolarHBondContact OD1-N 3.27Å; D206-S208 PolarHBondContact OD1-OG 2.81Å; D206-S208 PolarHBondContact OD2-OG 3.41Å; S208-G210 PolarHBondContact O-N 3.44Å; S208-I537 PolarHBondContact OG-O 3.44Å
209	N	77.6	Confident	86.9	Confident	8 Å²	8	32.4 Å²	32.4	4%	0.043	16%	0.164	C	C	.	.	G	3₁₀ helix	trans	-65	-10.1	179.1	67.9	17.1	0	0	0	113.8	F203 D206 T207 L211 A212 I537	F203-N209 HydrophobicContact CD2-CB 4.48Å; F203-N209 HydrophobicContact CE2-CB 3.74Å; F203-N209 HydrophobicContact CZ-CB 3.87Å; F203-N209 PolarHBondContact O-ND2 2.84Å; D206-N209 PolarHBondContact O-ND2 3.31Å; D206-N209 PolarHBondContact O-OD1 2.89Å; T207-N209 PolarHBondContact O-N 2.86Å; N209-L211 PolarHBondContact O-N 3.14Å; N209-L211 WeakPolarHBondContact OD1-CA 3.38Å; N209-L211 PolarHBondContact OD1-N 3.27Å; N209-A212 PolarHBondContact OD1-N 2.89Å; N209-I537 HydrophobicContact CB-CG2 4.49Å
210	G	76.3	Confident	86.9	Confident	1 Å²	1	30.3 Å²	30.3	1%	0.01	16%	0.158	C	C	.	.	S	Bend	trans	73.1	5.8	-179	0	0	0	0	0	115.2	S44 L45 T207 S208	S44-G210 WeakPolarHBondContact CB-O 3.39Å; L45-G210 WeakPolarHBondContact CB-O 3.31Å; L45-G210 PolarHBondContact N-O 3.31Å; T207-G210 PolarHBondContact O-N 3.49Å; T207-G210 VanDerWaalsContact O-N 3.09Å; S208-G210 PolarHBondContact O-N 3.44Å
211	L	81.8	Confident	86.7	Confident	66 Å²	66	31.2 Å²	31.2	35%	0.346	16%	0.163	S	C	.	.			trans	-108.2	-40.6	178.8	-65.8	172.5	0	0	0	112.3	L45 I46 L101 N209	L45-L211 HydrophobicContact CB-CD2 4.12Å; L45-L211 HydrophobicContact CD1-CD2 3.95Å; L45-L211 HydrophobicContact CD1-CG 4.36Å; I46-L211 HydrophobicContact CD1-CD2 4.1Å; I46-L211 HydrophobicContact CG1-CD2 4.44Å; L101-L211 HydrophobicContact CD2-CD2 3.92Å; N209-L211 PolarHBondContact O-N 3.14Å; N209-L211 WeakPolarHBondContact OD1-CA 3.38Å; N209-L211 PolarHBondContact OD1-N 3.27Å
212	A	86.6	Confident	86.1	Confident	7 Å²	7	38.3 Å²	38.3	6%	0.058	19%	0.194	C	C	.	.			trans	-72.1	131.4	179.9	0	0	0	0	0	110.6	D206 T207 N209	D206-A212 WeakPolarHBondContact O-CB 3.44Å; T207-A212 HydrophobicContact CG2-CB 4.39Å; N209-A212 PolarHBondContact OD1-N 2.89Å
213	P	86.3	Confident	85	Confident	46 Å²	46	40.6 Å²	40.6	30%	0.299	20%	0.203	S	C	.	.	S	Bend	trans	-76.4	-23.9	-176.4	28.8	-34.4	0	0	0	113.7	N38 P48	N38-P213 PolarHBondContact ND2-O 3.22Å; P48-P213 HydrophobicContact CB-CB 4.28Å
214	L	89.4	Confident	84	Confident	11 Å²	11	47 Å²	47	6%	0.058	24%	0.238	C	C	.	.	S	Bend	trans	-156.8	161.6	-177.7	69.6	114	0	0	0	110	V50 Y154 T207 I216	V50-L214 HydrophobicContact CG1-CB 4.01Å; V50-L214 HydrophobicContact CG1-CD2 4.25Å; Y154-L214 HydrophobicContact CD1-CD1 3.5Å; Y154-L214 VanDerWaalsContact CD1-CD1 3.5Å; Y154-L214 HydrophobicContact CE1-CD1 3.48Å; Y154-L214 VanDerWaalsContact CE1-CD1 3.48Å; T207-L214 VanDerWaalsContact CG2-CA 3.5Å; L214-I216 HydrophobicContact CD1-CG1 3.94Å; L214-I216 HydrophobicContact CG-CG1 4.36Å
215	D	89.2	Confident	83	Confident	59 Å²	59	49.5 Å²	49.5	32%	0.316	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	124.2	-175.9	-68.2	-39.4	0	0	0	111.3	V152 A153 Y154 G205 T207	V152-D215 PolarHBondContact O-N 2.95Å; A153-D215 WeakPolarHBondContact CA-O 3.47Å; A153-D215 HydrophobicContact CB-CB 3.96Å; Y154-D215 PolarHBondContact N-O 3.01Å; Y154-D215 VanDerWaalsContact N-O 3.09Å; G205-D215 CarbonylContact O-C 3.56Å; G205-D215 WeakPolarHBondContact O-CA 3.33Å; T207-D215 VanDerWaalsContact CB-OD1 3.32Å; T207-D215 WeakPolarHBondContact CB-OD1 3.28Å; T207-D215 WeakPolarHBondContact CG2-OD1 3.41Å; T207-D215 PolarHBondContact N-OD1 3Å; T207-D215 PolarHBondContact OG1-OD1 3.07Å
216	I	91.6	Very high	81.9	Confident	14 Å²	14	55 Å²	55	7%	0.072	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	112	178.4	-53.9	166.9	0	0	0	109.4	Y154 A156 G205 L214 F218	Y154-I216 HydrophobicContact CD2-CG1 4.46Å; Y154-I216 HydrophobicContact CD2-CG2 3.92Å; Y154-I216 HydrophobicContact CE1-CD1 4.24Å; Y154-I216 HydrophobicContact CE1-CG1 3.96Å; Y154-I216 HydrophobicContact CE2-CB 4.22Å; Y154-I216 HydrophobicContact CE2-CD1 4.23Å; Y154-I216 HydrophobicContact CE2-CG1 3.88Å; Y154-I216 HydrophobicContact CE2-CG2 3.41Å; Y154-I216 VanDerWaalsContact CE2-CG2 3.41Å; Y154-I216 WeakPolarHBondContact O-CA 3.3Å; Y154-I216 WeakPolarHBondContact OH-CD1 3.41Å; A156-I216 HydrophobicContact CB-CG2 4.21Å; G205-I216 WeakPolarHBondContact CA-O 3.24Å; G205-I216 PolarHBondContact O-N 2.85Å; L214-I216 HydrophobicContact CD1-CG1 3.94Å; L214-I216 HydrophobicContact CG-CG1 4.36Å; I216-F218 HydrophobicContact CB-CD2 4.34Å; I216-F218 HydrophobicContact CB-CE2 3.86Å; I216-F218 HydrophobicContact CB-CZ 4.07Å; I216-F218 HydrophobicContact CD1-CZ 4.26Å; I216-F218 HydrophobicContact CG2-CD1 3.93Å; I216-F218 HydrophobicContact CG2-CD2 3.92Å; I216-F218 HydrophobicContact CG2-CE1 3.61Å; I216-F218 HydrophobicContact CG2-CE2 3.6Å; I216-F218 HydrophobicContact CG2-CG 4.12Å; I216-F218 HydrophobicContact CG2-CZ 3.45Å; I216-F218 VanDerWaalsContact CG2-CZ 3.45Å; I216-F218 PolarHBondContact O-N 3.06Å
217	D	90.8	Very high	80.8	Confident	50 Å²	50	57.1 Å²	57.1	27%	0.267	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	101.1	174.6	174.8	18.4	0	0	0	109.5	Y154 Q155 A156 R219	Y154-D217 PolarHBondContact O-N 3.13Å; Q155-D217 WeakPolarHBondContact CA-O 3.2Å; Q155-D217 HydrophobicContact CG-CB 3.72Å; Q155-D217 WeakPolarHBondContact CG-OD2 3.18Å; Q155-D217 PolarHBondContact NE2-OD2 3.35Å; A156-D217 PolarHBondContact N-O 3.29Å; D217-R219 VanDerWaalsContact CG-NE 3.35Å; D217-R219 IonicContact OD1-CZ 3.3Å; D217-R219 IonicContact OD1-NE 2.93Å; D217-R219 PolarHBondContact OD1-NE 3.33Å; D217-R219 IonicContact OD1-NH2 2.8Å; D217-R219 IonicContact OD2-CZ 3.22Å; D217-R219 VanDerWaalsContact OD2-CZ 3.3Å; D217-R219 IonicContact OD2-NE 3.61Å; D217-R219 PolarHBondContact OD2-NE 3.04Å; D217-R219 IonicContact OD2-NH2 2.76Å; D217-R219 PolarHBondContact OD2-NH2 3.14Å
218	F	91.3	Very high	79.7	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	111.2	-179.8	-69.4	-71.9	0	0	0	111.3	L119 A156 I158 Q198 Y201 Q204 I216	L119-F218 HydrophobicContact CD2-CD1 4.37Å; L119-F218 HydrophobicContact CD2-CE1 3.76Å; L119-F218 HydrophobicContact CD2-CZ 4.15Å; L119-F218 HydrophobicContact CG-CE1 4.32Å; A156-F218 HydrophobicContact CB-CD1 3.82Å; A156-F218 HydrophobicContact CB-CE1 4.04Å; I158-F218 HydrophobicContact CD1-CB 4.47Å; I158-F218 HydrophobicContact CD1-CD1 3.44Å; I158-F218 VanDerWaalsContact CD1-CD1 3.44Å; I158-F218 HydrophobicContact CD1-CE1 4.01Å; I158-F218 HydrophobicContact CD1-CG 4.32Å; Q198-F218 PolarHBondContact NE2-O 3.11Å; Y201-F218 WeakPolarHBondContact O-CD2 3.27Å; Q204-F218 HydrophobicContact CB-CE2 4.38Å; I216-F218 HydrophobicContact CB-CD2 4.34Å; I216-F218 HydrophobicContact CB-CE2 3.86Å; I216-F218 HydrophobicContact CB-CZ 4.07Å; I216-F218 HydrophobicContact CD1-CZ 4.26Å; I216-F218 HydrophobicContact CG2-CD1 3.93Å; I216-F218 HydrophobicContact CG2-CD2 3.92Å; I216-F218 HydrophobicContact CG2-CE1 3.61Å; I216-F218 HydrophobicContact CG2-CE2 3.6Å; I216-F218 HydrophobicContact CG2-CG 4.12Å; I216-F218 HydrophobicContact CG2-CZ 3.45Å; I216-F218 VanDerWaalsContact CG2-CZ 3.45Å; I216-F218 PolarHBondContact O-N 3.06Å
219	R	89.1	Confident	79.4	Confident	119 Å²	119	59.6 Å²	59.6	45%	0.449	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	106.2	178.7	-63.5	-66	177.2	162.4	-3.5	110.5	A156 Y157 I158 D217	A156-R219 PolarHBondContact O-N 3.16Å; Y157-R219 HydrophobicContact CD1-CB 3.75Å; Y157-R219 HydrophobicContact CD1-CG 4.34Å; Y157-R219 HydrophobicContact CE1-CB 4.03Å; Y157-R219 HydrophobicContact CE1-CG 4.14Å; I158-R219 PolarHBondContact N-O 2.87Å; D217-R219 VanDerWaalsContact CG-NE 3.35Å; D217-R219 IonicContact OD1-CZ 3.3Å; D217-R219 IonicContact OD1-NE 2.93Å; D217-R219 PolarHBondContact OD1-NE 3.33Å; D217-R219 IonicContact OD1-NH2 2.8Å; D217-R219 IonicContact OD2-CZ 3.22Å; D217-R219 VanDerWaalsContact OD2-CZ 3.3Å; D217-R219 IonicContact OD2-NE 3.61Å; D217-R219 PolarHBondContact OD2-NE 3.04Å; D217-R219 IonicContact OD2-NH2 2.76Å; D217-R219 PolarHBondContact OD2-NH2 3.14Å
220	L	88.5	Confident	79.1	Confident	38 Å²	38	61.2 Å²	61.2	20%	0.199	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	112.5	176	-56.6	-172.9	0	0	0	110.6	I158 A163 A197 Q198 Y201	I158-L220 HydrophobicContact CB-CD2 3.89Å; I158-L220 HydrophobicContact CD1-CD2 4.3Å; I158-L220 HydrophobicContact CG2-CD2 4.29Å; I158-L220 WeakPolarHBondContact O-CA 3.34Å; A163-L220 HydrophobicContact CB-CD1 3.82Å; A163-L220 HydrophobicContact CB-CD2 3.39Å; A163-L220 HydrophobicContact CB-CG 4.19Å; A197-L220 HydrophobicContact CB-CD1 4.25Å; Q198-L220 HydrophobicContact CB-CD1 4.06Å; Y201-L220 HydrophobicContact CD2-CD1 4.31Å; Y201-L220 HydrophobicContact CD2-CD2 4.21Å
221	L	86.1	Confident	78.8	Confident	20 Å²	20	70.3 Å²	70.3	11%	0.105	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	145.8	-176.6	-62.9	172.6	0	0	0	111.4	Y157 I158 S159 S160 V229 P235	Y157-L221 HydrophobicContact CD1-CD1 3.77Å; I158-L221 PolarHBondContact O-N 3.47Å; S159-L221 CarbonylContact C-O 3.6Å; S160-L221 WeakPolarHBondContact CB-O 3.32Å; S160-L221 PolarHBondContact N-O 3.11Å; S160-L221 PolarHBondContact OG-O 3.37Å; S160-L221 VanDerWaalsContact OG-O 3.08Å; L221-V229 HydrophobicContact CD1-CG2 3.29Å; L221-P235 HydrophobicContact CD1-CB 4.49Å
222	K	80	Confident	78.4	Confident	149 Å²	149	69.3 Å²	69.3	65%	0.648	39%	0.388	S	S	*	.			trans	-76.1	149.3	166.7	-66.5	178.3	-178.6	175.5	0	108.6	N224 D225	K222-N224 PolarHBondContact O-N 3.05Å; K222-D225 HydrophobicContact CB-CB 4.25Å; K222-D225 PolarHBondContact O-N 3.24Å
223	E	66.3	Low	78	Confident	113 Å²	113	69.7 Å²	69.7	53%	0.528	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-19.1	-171.1	-65.5	-179.8	165	0	0	114.8	T161 N237	T161-E223 PolarHBondContact OG1-OE1 3.37Å; E223-N237 PolarHBondContact OE1-ND2 3.31Å
224	N	66.5	Low	77.8	Confident	159 Å²	159	72.6 Å²	72.6	85%	0.85	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.6	5	177.9	-70	-10.8	0	0	0	114.5	K222	K222-N224 PolarHBondContact O-N 3.05Å
225	D	68.8	Low	77.5	Confident	65 Å²	65	73.5 Å²	73.5	35%	0.348	41%	0.406	S	S	.	.			trans	-98	103.6	-177.3	-164.5	-5.6	0	0	0	110.5	K222 T227	K222-D225 HydrophobicContact CB-CB 4.25Å; K222-D225 PolarHBondContact O-N 3.24Å; D225-T227 WeakPolarHBondContact OD1-CB 3.36Å; D225-T227 WeakPolarHBondContact OD1-CG2 3.31Å; D225-T227 PolarHBondContact OD1-N 3.39Å; D225-T227 VanDerWaalsContact OD1-N 3.15Å; D225-T227 PolarHBondContact OD1-OG1 3.14Å
226	T	65.3	Low	77.4	Confident	118 Å²	118	72.8 Å²	72.8	72%	0.724	40%	0.4	S	S	*	.			trans	-98.1	10	177.6	58.7	0	0	0	0	112.5	G228	T226-G228 PolarHBondContact O-N 3.16Å
227	T	62.6	Low	77	Confident	104 Å²	104	76.5 Å²	76.5	64%	0.638	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	119	-177.9	60	0	0	0	0	110.8	D225	D225-T227 WeakPolarHBondContact OD1-CB 3.36Å; D225-T227 WeakPolarHBondContact OD1-CG2 3.31Å; D225-T227 PolarHBondContact OD1-N 3.39Å; D225-T227 VanDerWaalsContact OD1-N 3.15Å; D225-T227 PolarHBondContact OD1-OG1 3.14Å
228	G	61.7	Low	76.6	Confident	72 Å²	72	74.8 Å²	74.8	74%	0.742	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.9	13.4	178.2	0	0	0	0	0	116.2	T226	T226-G228 PolarHBondContact O-N 3.16Å
229	V	71.4	Confident	76.4	Confident	32 Å²	32	83 Å²	83	19%	0.194	45%	0.445	C	S	.	.	P	Polyproline II helix	trans	-97.1	129.3	175.3	-174.2	0	0	0	0	110.5	Y157 L221 M233	Y157-V229 HydrophobicContact CD1-CG2 4.29Å; Y157-V229 HydrophobicContact CE1-CG2 4.26Å; L221-V229 HydrophobicContact CD1-CG2 3.29Å; V229-M233 HydrophobicContact CG1-CB 3.74Å
230	P	72.4	Confident	76.4	Confident	42 Å²	42	78.4 Å²	78.4	27%	0.273	43%	0.432	S	S	.	.	P	Polyproline II helix	trans	-58.9	146.4	173.9	-25.8	35.8	0	0	0	113.1	Y157 G232 M233	Y157-P230 VanDerWaalsContact OH-CD 3.28Å; Y157-P230 WeakPolarHBondContact OH-CD 3.46Å; P230-G232 PolarHBondContact O-N 2.98Å; P230-M233 HydrophobicContact CB-CE 3.81Å; P230-M233 HydrophobicContact CB-CG 4.47Å; P230-M233 HydrophobicContact CB-SD 4.16Å; P230-M233 HydrophobicContact CG-CE 3.73Å; P230-M233 HydrophobicContact CG-SD 3.95Å; P230-M233 PolarHBondContact O-N 3.41Å
231	E	70.1	Confident	76.4	Confident	192 Å²	192	77.5 Å²	77.5	90%	0.897	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	126.9	179.7	-71.7	-172.2	169	0	0	111.5
232	G	72.1	Confident	76.6	Confident	46 Å²	46	77.7 Å²	77.7	47%	0.474	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	94.5	-8.2	179.7	0	0	0	0	0	115.8	L131 P230	L131-G232 WeakPolarHBondContact CD2-O 3.5Å; P230-G232 PolarHBondContact O-N 2.98Å
233	M	78.2	Confident	77	Confident	15 Å²	15	70.8 Å²	70.8	7%	0.074	41%	0.405	C	S	.	.			trans	-84.8	146.7	173.2	-72.6	-173	-158.4	0	0	112.8	H24 L131 N134 Y157 V229 P230	H24-M233 HydrophobicContact CB-CG 4.22Å; H24-M233 WeakPolarHBondContact CE1-CE 3.31Å; H24-M233 VanDerWaalsContact ND1-CE 3.33Å; H24-M233 WeakPolarHBondContact ND1-CE 3.33Å; H24-M233 WeakPolarHBondContact NE2-CE 3.18Å; L131-M233 CarbonylContact O-C 3.59Å; L131-M233 VanDerWaalsContact O-CA 3.29Å; L131-M233 WeakPolarHBondContact O-CA 3.18Å; L131-M233 WeakPolarHBondContact O-CB 3.03Å; N134-M233 HydrophobicContact CB-CE 3.41Å; N134-M233 VanDerWaalsContact CB-CE 3.41Å; N134-M233 HydrophobicContact CB-SD 4.12Å; Y157-M233 HydrophobicContact CD2-SD 3.57Å; Y157-M233 VanDerWaalsContact CD2-SD 3.57Å; Y157-M233 HydrophobicContact CE2-CE 4.43Å; Y157-M233 HydrophobicContact CE2-SD 3.33Å; Y157-M233 WeakPolarHBondContact CE2-SD 3.43Å; V229-M233 HydrophobicContact CG1-CB 3.74Å; P230-M233 HydrophobicContact CB-CE 3.81Å; P230-M233 HydrophobicContact CB-CG 4.47Å; P230-M233 HydrophobicContact CB-SD 4.16Å; P230-M233 HydrophobicContact CG-CE 3.73Å; P230-M233 HydrophobicContact CG-SD 3.95Å; P230-M233 PolarHBondContact O-N 3.41Å
234	I	82.2	Confident	78.2	Confident	107 Å²	107	69.7 Å²	69.7	55%	0.549	40%	0.402	S	S	.	.			trans	-130.1	129.3	178.6	-56.2	174.7	0	0	0	107.3	L131 Y236	L131-I234 PolarHBondContact O-N 3.42Å; I234-Y236 PolarHBondContact O-N 2.99Å
235	P	84.1	Confident	79.2	Confident	29 Å²	29	65.3 Å²	65.3	19%	0.188	38%	0.377	C	S	.	.			trans	-59.9	137.1	176.6	24.9	-33	0	0	0	110.1	L221 N237	L221-P235 HydrophobicContact CD1-CB 4.49Å; P235-N237 PolarHBondContact O-N 2.95Å; P235-N237 VanDerWaalsContact O-N 3.09Å
236	Y	86.3	Confident	80	Confident	45 Å²	45	67.2 Å²	67.2	18%	0.176	39%	0.387	C	S	.	.	B	Isolated β-bridge	trans	-62.6	115.8	177.5	-175.5	-102.9	0	0	0	110.3	H118 A122 T132 Y157 S159 F162 I234	H118-Y236 PolarHBondContact CD2-OH 2.89Å; H118-Y236 AromaticContact NE2-CZ 3.91Å; H118-Y236 PolarHBondContact NE2-OH 2.67Å; A122-Y236 HydrophobicContact CB-CD1 4.34Å; A122-Y236 HydrophobicContact CB-CD2 4.21Å; A122-Y236 HydrophobicContact CB-CE1 3.93Å; A122-Y236 HydrophobicContact CB-CE2 3.78Å; A122-Y236 HydrophobicContact CB-CG 4.47Å; T132-Y236 HydrophobicContact CG2-CD2 4.21Å; Y157-Y236 PolarHBondContact O-N 3.37Å; S159-Y236 WeakPolarHBondContact CB-O 3.41Å; S159-Y236 PolarHBondContact N-O 3.15Å; F162-Y236 HydrophobicContact CD1-CD1 4.42Å; F162-Y236 HydrophobicContact CE1-CD1 4.39Å; F162-Y236 HydrophobicContact CE1-CE1 4.39Å; F162-Y236 HydrophobicContact CE2-CE1 4.46Å; F162-Y236 HydrophobicContact CZ-CE1 4.27Å; I234-Y236 PolarHBondContact O-N 2.99Å
237	N	83.7	Confident	80.9	Confident	91 Å²	91	62.1 Å²	62.1	49%	0.487	36%	0.356	S	S	.	.			trans	-117.8	69.6	178.8	-162.1	6.9	0	0	0	110.3	T161 E223 P235	T161-N237 PolarHBondContact OG1-OD1 3.46Å; E223-N237 PolarHBondContact OE1-ND2 3.31Å; P235-N237 PolarHBondContact O-N 2.95Å; P235-N237 VanDerWaalsContact O-N 3.09Å
238	G	83.1	Confident	81.4	Confident	14 Å²	14	62.4 Å²	62.4	14%	0.144	36%	0.357	C	S	.	.	P	Polyproline II helix	trans	-76.7	165.1	170.8	0	0	0	0	0	111.8	F162 A240	F162-G238 WeakPolarHBondContact CD2-O 3.18Å; G238-A240 PolarHBondContact O-N 2.93Å
239	R	86.4	Confident	81.8	Confident	172 Å²	172	62.7 Å²	62.7	65%	0.649	35%	0.345	S	S	*	.	P	Polyproline II helix	trans	-79.9	118.5	168.3	-178.9	177.8	172.4	177.8	-2.5	109.2	E245	R239-E245 IonicContact CZ-OE2 3.23Å; R239-E245 IonicContact NE-OE2 2.89Å; R239-E245 IonicContact NH2-OE1 3.83Å; R239-E245 PolarHBondContact NH2-OE1 2.95Å; R239-E245 IonicContact NH2-OE2 3.97Å; R239-E245 PolarHBondContact NH2-OE2 2.89Å
240	A	88.9	Confident	81.9	Confident	23 Å²	23	63 Å²	63	19%	0.19	36%	0.355	C	S	.	.	P	Polyproline II helix	trans	-81.5	133.3	166	0	0	0	0	0	109.4	F162 G238	F162-A240 HydrophobicContact CD2-CB 3.8Å; F162-A240 HydrophobicContact CE2-CB 4.13Å; G238-A240 PolarHBondContact O-N 2.93Å
241	L	89.6	Confident	82.1	Confident	20 Å²	20	61.2 Å²	61.2	11%	0.105	34%	0.344	C	S	.	.	P	Polyproline II helix	trans	-77.7	133.9	176.4	-64	172.3	0	0	0	110.2	N115 T247	N115-L241 PolarHBondContact ND2-N 3.45Å; N115-L241 PolarHBondContact ND2-O 3.43Å; N115-L241 PolarHBondContact OD1-N 2.9Å; L241-T247 HydrophobicContact CD1-CG2 4.49Å
242	G	89.6	Confident	82.7	Confident	24 Å²	24	56.3 Å²	56.3	25%	0.247	32%	0.322	C	S	.	.	P	Polyproline II helix	trans	-66.5	151	169	0	0	0	0	0	111.1	N244 E245	G242-N244 PolarHBondContact O-N 3.48Å; G242-E245 PolarHBondContact O-N 3.31Å
243	C	88.8	Confident	83.4	Confident	3 Å²	3	55.4 Å²	55.4	2%	0.02	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-15.7	178.1	60.7	0	0	0	0	113.6	C254 C259 S262	C243-C254 HydrophobicContact CB-CB 4.3Å; C243-C254 VanDerWaalsContact O-CB 3.28Å; C243-C254 WeakPolarHBondContact O-CB 3.3Å; C243-C254 PolarHBondContact O-N 3.31Å; C243-C259 VanDerWaalsContact C-SG 3.55Å; C243-C259 HydrophobicContact CB-CB 3.54Å; C243-C259 WeakPolarHBondContact CB-SG 3.12Å; C243-C259 WeakPolarHBondContact SG-CB 3.47Å; C243-C259 CovalentContact SG-SG 2.02Å; C243-C259 PolarHBondContact SG-SG 2.85Å; C243-S262 PolarHBondContact O-OG 2.89Å
244	N	89.7	Confident	83.8	Confident	90 Å²	90	54.9 Å²	54.9	48%	0.481	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-4.2	171.4	63.7	-21.3	0	0	0	113.8	G242 A253 S262	G242-N244 PolarHBondContact O-N 3.48Å; N244-A253 WeakPolarHBondContact O-CB 3.41Å; N244-S262 WeakPolarHBondContact CA-OG 3.24Å
245	E	88.5	Confident	84	Confident	68 Å²	68	50.7 Å²	50.7	32%	0.318	29%	0.289	S	S	.	.	S	Bend	trans	-95.5	147.6	177.2	-59.7	-170.4	157.9	0	0	111	S111 R239 G242	S111-E245 PolarHBondContact OG-O 2.93Å; R239-E245 IonicContact CZ-OE2 3.23Å; R239-E245 IonicContact NE-OE2 2.89Å; R239-E245 IonicContact NH2-OE1 3.83Å; R239-E245 PolarHBondContact NH2-OE1 2.95Å; R239-E245 IonicContact NH2-OE2 3.97Å; R239-E245 PolarHBondContact NH2-OE2 2.89Å; G242-E245 PolarHBondContact O-N 3.31Å
246	N	85.9	Confident	84	Confident	105 Å²	105	50.3 Å²	50.3	56%	0.561	29%	0.286	S	S	*	.	P	Polyproline II helix	trans	-73.1	149.1	171	-69.7	-1.8	0	0	0	110.8	G251 A253	N246-G251 CarbonylContact C-O 3.56Å; N246-G251 WeakPolarHBondContact CA-O 3.43Å; N246-G251 WeakPolarHBondContact CB-O 3.41Å; N246-A253 PolarHBondContact OD1-N 3.39Å
247	T	83	Confident	83.8	Confident	10 Å²	10	48.8 Å²	48.8	6%	0.061	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-73.5	155.2	177.7	64.3	0	0	0	0	112.1	P110 D114 L241 T249 G250 G251	P110-T247 HydrophobicContact CB-CG2 3.79Å; D114-T247 WeakPolarHBondContact OD2-CB 3.47Å; D114-T247 WeakPolarHBondContact OD2-CG2 3.24Å; L241-T247 HydrophobicContact CD1-CG2 4.49Å; T247-T249 PolarHBondContact O-N 2.94Å; T247-T249 PolarHBondContact OG1-OG1 3.46Å; T247-G250 PolarHBondContact O-N 3.44Å; T247-G251 PolarHBondContact N-O 3.04Å; T247-G251 WeakPolarHBondContact OG1-CA 3.44Å; T247-G251 PolarHBondContact OG1-N 3.23Å; T247-G251 PolarHBondContact OG1-O 3.09Å
248	T	73.5	Confident	83.9	Confident	110 Å²	110	44.4 Å²	44.4	68%	0.675	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-17.1	179.3	54.8	0	0	0	0	113.5
249	T	70.4	Confident	84.1	Confident	78 Å²	78	43.8 Å²	43.8	48%	0.479	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.4	-1.2	178	53.8	0	0	0	0	113.5	P74 T247	P74-T249 HydrophobicContact CB-CG2 3.83Å; P74-T249 HydrophobicContact CG-CG2 3.65Å; T247-T249 PolarHBondContact O-N 2.94Å; T247-T249 PolarHBondContact OG1-OG1 3.46Å
250	G	72.7	Confident	84	Confident	40 Å²	40	39.7 Å²	39.7	41%	0.412	24%	0.241	S	C	.	.	S	Bend	trans	103.5	-3.8	177.6	0	0	0	0	0	115.4	T247	T247-G250 PolarHBondContact O-N 3.44Å
251	G	77.5	Confident	83.8	Confident	4 Å²	4	44.1 Å²	44.1	4%	0.041	26%	0.262	C	S	.	.	P	Polyproline II helix	trans	-66.6	137.1	175.5	0	0	0	0	0	113.8	N246 T247 D1003	N246-G251 CarbonylContact C-O 3.56Å; N246-G251 WeakPolarHBondContact CA-O 3.43Å; N246-G251 WeakPolarHBondContact CB-O 3.41Å; T247-G251 PolarHBondContact N-O 3.04Å; T247-G251 WeakPolarHBondContact OG1-CA 3.44Å; T247-G251 PolarHBondContact OG1-N 3.23Å; T247-G251 PolarHBondContact OG1-O 3.09Å; G251-D1003 WeakPolarHBondContact CA-O 3.39Å
252	M	83.4	Confident	83.6	Confident	88 Å²	88	44.4 Å²	44.4	43%	0.433	27%	0.265	S	S	.	.	P	Polyproline II helix	trans	-67.4	157	178	-69	-170.6	169.1	0	0	113.8	V926 D1003 V1005	M252-V926 HydrophobicContact CB-CG1 3.76Å; M252-D1003 PolarHBondContact N-O 3.22Å; M252-V1005 HydrophobicContact CB-CG2 4.49Å; M252-V1005 HydrophobicContact CG-CG2 4.24Å; M252-V1005 HydrophobicContact SD-CG2 3.86Å
253	A	85	Confident	83.3	Confident	28 Å²	28	44.9 Å²	44.9	23%	0.231	27%	0.265	C	S	.	.	P	Polyproline II helix	trans	-56.8	152.6	173.4	0	0	0	0	0	113.1	N244 N246	N244-A253 WeakPolarHBondContact O-CB 3.41Å; N246-A253 PolarHBondContact OD1-N 3.39Å
254	C	88.1	Confident	82.7	Confident	4 Å²	4	47 Å²	47	3%	0.027	28%	0.278	C	S	.	.	P	Polyproline II helix	trans	-67.5	148.1	-176.4	-53.6	0	0	0	0	111.7	C109 C243 C259 S262	C109-C254 WeakPolarHBondContact CA-SG 3.39Å; C109-C254 HydrophobicContact CB-CB 3.76Å; C109-C254 WeakPolarHBondContact CB-SG 3.22Å; C109-C254 WeakPolarHBondContact SG-CB 3.04Å; C109-C254 CovalentContact SG-SG 2.03Å; C109-C254 PolarHBondContact SG-SG 2.88Å; C243-C254 HydrophobicContact CB-CB 4.3Å; C243-C254 VanDerWaalsContact O-CB 3.28Å; C243-C254 WeakPolarHBondContact O-CB 3.3Å; C243-C254 PolarHBondContact O-N 3.31Å; C254-C259 HydrophobicContact CB-CB 3.83Å; C254-S262 WeakPolarHBondContact O-CB 3.48Å; C254-S262 PolarHBondContact O-OG 2.61Å
255	S	85.9	Confident	81.9	Confident	19 Å²	19	54.9 Å²	54.9	13%	0.133	30%	0.301	C	S	.	.	P	Polyproline II helix	trans	-65.2	158.4	179.1	82.3	0	0	0	0	111.3	Q257 D258 C259 S924	S255-Q257 PolarHBondContact O-N 2.98Å; S255-Q257 VanDerWaalsContact O-N 3.15Å; S255-Q257 PolarHBondContact OG-N 3.36Å; S255-D258 PolarHBondContact O-N 3.43Å; S255-D258 VanDerWaalsContact O-N 3.13Å; S255-D258 PolarHBondContact OG-OD2 3.45Å; S255-C259 PolarHBondContact O-N 3.46Å; S255-S924 WeakPolarHBondContact CB-O 3.42Å; S255-S924 PolarHBondContact OG-O 3.23Å
256	C	83.8	Confident	81	Confident	21 Å²	21	54.2 Å²	54.2	14%	0.142	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-27.3	174.6	168.5	0	0	0	0	112.3	C259 C263 Q935 R938	C256-C259 CarbonylContact C-O 3.58Å; C256-C259 WeakPolarHBondContact CA-O 3.41Å; C256-C263 WeakPolarHBondContact CA-SG 3.19Å; C256-C263 HydrophobicContact CB-CB 3.98Å; C256-C263 WeakPolarHBondContact CB-SG 3.1Å; C256-C263 PolarHBondContact O-SG 3.22Å; C256-C263 VanDerWaalsContact SG-CA 3.55Å; C256-C263 WeakPolarHBondContact SG-CB 3.36Å; C256-C263 CovalentContact SG-SG 2.02Å; C256-C263 PolarHBondContact SG-SG 2.82Å; C256-Q935 PolarHBondContact SG-NE2 2.92Å; C256-R938 VanDerWaalsContact C-NH1 3.33Å; C256-R938 PolarHBondContact O-NH1 2.97Å
257	Q	81.8	Confident	80.3	Confident	12 Å²	12	54 Å²	54	6%	0.056	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-46.3	175.9	-170.2	154.8	-36.6	0	0	112.3	S255 S924 R938	S255-Q257 PolarHBondContact O-N 2.98Å; S255-Q257 VanDerWaalsContact O-N 3.15Å; S255-Q257 PolarHBondContact OG-N 3.36Å; Q257-S924 PolarHBondContact OE1-OG 3.31Å; Q257-R938 PolarHBondContact O-NH2 3.05Å
258	D	86.6	Confident	79.9	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.2	-12.7	-170.8	-63.5	-56.6	0	0	0	112.4	R108 C109 N172 V173 R174 S255	R108-D258 IonicContact CZ-OD2 3.97Å; R108-D258 IonicContact NE-OD1 3.29Å; R108-D258 IonicContact NE-OD2 2.76Å; R108-D258 PolarHBondContact NE-OD2 2.88Å; R108-D258 VanDerWaalsContact NE-OD2 3.09Å; R108-D258 IonicContact NH2-OD2 3.43Å; C109-D258 HydrophobicContact CB-CB 4.47Å; N172-D258 CarbonylContact C-O 3.55Å; N172-D258 VanDerWaalsContact C-O 3.23Å; N172-D258 WeakPolarHBondContact CB-O 3.38Å; V173-D258 HydrophobicContact CG2-CB 4.4Å; V173-D258 PolarHBondContact N-O 3.03Å; R174-D258 PolarHBondContact N-OD1 3.3Å; S255-D258 PolarHBondContact O-N 3.43Å; S255-D258 VanDerWaalsContact O-N 3.13Å; S255-D258 PolarHBondContact OG-OD2 3.45Å
259	C	87.8	Confident	79.9	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	31%	0.311	C	S	.	.			trans	-143.8	115.2	177.2	171.9	0	0	0	0	111.2	C243 C254 S255 C256 D261 S262	C243-C259 VanDerWaalsContact C-SG 3.55Å; C243-C259 HydrophobicContact CB-CB 3.54Å; C243-C259 WeakPolarHBondContact CB-SG 3.12Å; C243-C259 WeakPolarHBondContact SG-CB 3.47Å; C243-C259 CovalentContact SG-SG 2.02Å; C243-C259 PolarHBondContact SG-SG 2.85Å; C254-C259 HydrophobicContact CB-CB 3.83Å; S255-C259 PolarHBondContact O-N 3.46Å; C256-C259 CarbonylContact C-O 3.58Å; C256-C259 WeakPolarHBondContact CA-O 3.41Å; C259-D261 VanDerWaalsContact C-N 3.3Å; C259-D261 PolarHBondContact O-N 3.28Å; C259-S262 PolarHBondContact O-N 2.79Å; C259-S262 PolarHBondContact SG-N 3.49Å; C259-S262 PolarHBondContact SG-OG 3.4Å
260	L	83.3	Confident	80.1	Confident	87 Å²	87	56 Å²	56	46%	0.455	32%	0.323	S	S	.	.	G	3₁₀ helix	trans	-68.1	-29	178.4	-70.4	173.9	0	0	0	113.1	S262 C263	L260-S262 PolarHBondContact O-N 3.21Å; L260-C263 VanDerWaalsContact O-CB 3.24Å; L260-C263 WeakPolarHBondContact O-CB 3.33Å; L260-C263 PolarHBondContact O-N 2.81Å; L260-C263 VanDerWaalsContact O-N 3.07Å
261	D	85.8	Confident	80.1	Confident	116 Å²	116	59 Å²	59	62%	0.62	33%	0.334	S	S	*	.	G	3₁₀ helix	trans	-70.4	-19.4	-179.9	-60.7	-32	0	0	0	112.6	C259 C263	C259-D261 VanDerWaalsContact C-N 3.3Å; C259-D261 PolarHBondContact O-N 3.28Å; D261-C263 VanDerWaalsContact C-N 3.31Å
262	S	85.5	Confident	79.6	Confident	25 Å²	25	65.1 Å²	65.1	18%	0.175	37%	0.365	C	S	.	.	G	3₁₀ helix	trans	-82.7	-6.5	172.9	-62.5	0	0	0	0	113.1	C243 N244 C254 C259 L260	C243-S262 PolarHBondContact O-OG 2.89Å; N244-S262 WeakPolarHBondContact CA-OG 3.24Å; C254-S262 WeakPolarHBondContact O-CB 3.48Å; C254-S262 PolarHBondContact O-OG 2.61Å; C259-S262 PolarHBondContact O-N 2.79Å; C259-S262 PolarHBondContact SG-N 3.49Å; C259-S262 PolarHBondContact SG-OG 3.4Å; L260-S262 PolarHBondContact O-N 3.21Å
263	C	81.8	Confident	79.1	Confident	35 Å²	35	66.7 Å²	66.7	24%	0.236	38%	0.382	C	S	.	.	S	Bend	trans	-79.4	139.3	-175.1	-65	0	0	0	0	112.7	C256 L260 D261	C256-C263 WeakPolarHBondContact CA-SG 3.19Å; C256-C263 HydrophobicContact CB-CB 3.98Å; C256-C263 WeakPolarHBondContact CB-SG 3.1Å; C256-C263 PolarHBondContact O-SG 3.22Å; C256-C263 VanDerWaalsContact SG-CA 3.55Å; C256-C263 WeakPolarHBondContact SG-CB 3.36Å; C256-C263 CovalentContact SG-SG 2.02Å; C256-C263 PolarHBondContact SG-SG 2.82Å; L260-C263 VanDerWaalsContact O-CB 3.24Å; L260-C263 WeakPolarHBondContact O-CB 3.33Å; L260-C263 PolarHBondContact O-N 2.81Å; L260-C263 VanDerWaalsContact O-N 3.07Å; D261-C263 VanDerWaalsContact C-N 3.31Å
264	P	77.3	Confident	78.3	Confident	47 Å²	47	73.6 Å²	73.6	31%	0.305	41%	0.41	S	S	.	.			trans	-64.4	143	164	29.7	-34.1	0	0	0	109.6	V266 F931	P264-V266 HydrophobicContact CG-CG2 4.45Å; P264-V266 PolarHBondContact O-N 3.48Å; P264-F931 HydrophobicContact CG-CE2 4.48Å; P264-F931 HydrophobicContact CG-CZ 4.14Å
265	R	72.6	Confident	77.7	Confident	256 Å²	256	77.6 Å²	77.6	97%	0.966	44%	0.436	S	S	*	.			trans	-69.3	98.5	173.8	-68.2	-176.4	-178.8	-179.8	0.5	109.5
266	V	69.6	Low	77.5	Confident	53 Å²	53	81.5 Å²	81.5	32%	0.321	45%	0.451	S	S	.	.	P	Polyproline II helix	trans	-86.3	127.1	175.3	-171.6	0	0	0	0	109	P264 F931 Y939	P264-V266 HydrophobicContact CG-CG2 4.45Å; P264-V266 PolarHBondContact O-N 3.48Å; V266-F931 HydrophobicContact CG2-CE1 3.97Å; V266-F931 HydrophobicContact CG2-CZ 4.04Å; V266-Y939 HydrophobicContact CB-CE2 3.86Å; V266-Y939 HydrophobicContact CG1-CE1 4.28Å; V266-Y939 HydrophobicContact CG1-CE2 3.91Å; V266-Y939 WeakPolarHBondContact CG1-OH 3.46Å; V266-Y939 HydrophobicContact CG2-CE2 4.42Å
267	P	71.9	Confident	77.5	Confident	102 Å²	102	88.5 Å²	88.5	66%	0.662	47%	0.474	S	S	*	.	P	Polyproline II helix	trans	-61.9	139.5	174.8	26.1	-32.8	0	0	0	109.6	Y939	P267-Y939 PolarHBondContact O-OH 3.39Å
268	P	73.8	Confident	77.6	Confident	84 Å²	84	90.9 Å²	90.9	55%	0.545	49%	0.486	S	S	.	.	P	Polyproline II helix	trans	-57.4	151.2	176.1	26	-34.1	0	0	0	109.8	Y943	P268-Y943 HydrophobicContact CB-CE1 4.21Å
269	P	73.5	Confident	77.3	Confident	43 Å²	43	100.3 Å²	100.3	28%	0.279	53%	0.53	S	S	.	.	P	Polyproline II helix	trans	-53.5	151.6	176.3	16.8	-26.7	0	0	0	110.8	Y943 R946	P269-Y943 HydrophobicContact CG-CD2 4.18Å; P269-Y943 HydrophobicContact CG-CG 4.19Å; P269-R946 PolarHBondContact O-NH1 3.02Å
270	P	75.4	Confident	76.9	Confident	113 Å²	113	103.3 Å²	103.3	73%	0.734	56%	0.561	S	S	*	*	P	Polyproline II helix	trans	-59.4	147.9	176.1	24.8	-33	0	0	0	110.5	R946	P270-R946 PolarHBondContact O-NH1 3.2Å
271	P	72.6	Confident	76.7	Confident	101 Å²	101	104 Å²	104	66%	0.656	56%	0.563	S	S	*	*	P	Polyproline II helix	trans	-62.6	157.8	176	27.9	-34.1	0	0	0	110.9
272	L	67.2	Low	76.6	Confident	133 Å²	133	101.4 Å²	101.4	70%	0.696	55%	0.55	S	S	*	.	P	Polyproline II helix	trans	-56.4	140.3	173.6	-73	165.7	0	0	0	109.6	E274	L272-E274 PolarHBondContact O-N 2.93Å
273	P	71.3	Confident	76.5	Confident	121 Å²	121	100.2 Å²	100.2	79%	0.786	54%	0.541	S	S	*	.	P	Polyproline II helix	trans	-58.4	128.2	178	23.5	-31.6	0	0	0	109.6
274	E	68.8	Low	76.7	Confident	174 Å²	174	102.5 Å²	102.5	81%	0.813	55%	0.547	S	S	*	.	P	Polyproline II helix	trans	-60.3	146.9	177.8	-70.5	-172.5	-180	0	0	110.8	L272 F276	L272-E274 PolarHBondContact O-N 2.93Å; E274-F276 PolarHBondContact O-N 3.43Å
275	P	75.4	Confident	77.1	Confident	87 Å²	87	102.9 Å²	102.9	57%	0.565	55%	0.546	S	S	*	.	P	Polyproline II helix	trans	-57.2	138.1	175.6	23.7	-32.8	0	0	0	110.1	R277	P275-R277 WeakPolarHBondContact O-CG 3.41Å; P275-R277 PolarHBondContact O-N 2.82Å
276	F	81.3	Confident	77.8	Confident	102 Å²	102	92.2 Å²	92.2	45%	0.447	51%	0.51	S	S	.	.			trans	-56.7	107.1	-178.7	178.8	-119.8	0	0	0	111.1	E274 I278 G283 F284 I287	E274-F276 PolarHBondContact O-N 3.43Å; F276-I278 HydrophobicContact CE1-CD1 4.23Å; F276-I278 HydrophobicContact CE2-CG1 4.49Å; F276-I278 HydrophobicContact CZ-CD1 3.86Å; F276-I278 HydrophobicContact CZ-CG1 4.14Å; F276-G283 VanDerWaalsContact CE1-C 3.5Å; F276-G283 PolarHBondContact O-N 3.03Å; F276-F284 HydrophobicContact CB-CE2 4.17Å; F276-F284 HydrophobicContact CD1-CD1 4.29Å; F276-F284 HydrophobicContact CD1-CD2 4.04Å; F276-F284 HydrophobicContact CD1-CE1 4.23Å; F276-F284 AromaticContact CD1-CE2 3.97Å; F276-F284 HydrophobicContact CD1-CE2 3.97Å; F276-F284 HydrophobicContact CD1-CG 4.21Å; F276-F284 HydrophobicContact CD1-CZ 4.08Å; F276-F284 HydrophobicContact CE1-CD1 4.48Å; F276-I287 HydrophobicContact CE1-CD1 3.84Å; F276-I287 HydrophobicContact CZ-CD1 4.26Å
277	R	83.4	Confident	78.7	Confident	167 Å²	167	93.8 Å²	93.8	63%	0.63	52%	0.515	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.6	138.2	-178.4	-74	178	-179.2	-166.9	1.4	111.1	P275 M281	P275-R277 WeakPolarHBondContact O-CG 3.41Å; P275-R277 PolarHBondContact O-N 2.82Å; R277-M281 CarbonylContact C-O 3.54Å; R277-M281 VanDerWaalsContact CA-O 3.24Å; R277-M281 WeakPolarHBondContact CA-O 3.3Å
278	I	84.4	Confident	79.4	Confident	62 Å²	62	89.4 Å²	89.4	32%	0.318	49%	0.487	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	120.2	172.4	-59.8	173.4	0	0	0	106.8	F276 G280 M281 V286	F276-I278 HydrophobicContact CE1-CD1 4.23Å; F276-I278 HydrophobicContact CE2-CG1 4.49Å; F276-I278 HydrophobicContact CZ-CD1 3.86Å; F276-I278 HydrophobicContact CZ-CG1 4.14Å; I278-G280 PolarHBondContact O-N 2.76Å; I278-G280 VanDerWaalsContact O-N 3.15Å; I278-M281 PolarHBondContact N-O 2.89Å; I278-M281 PolarHBondContact O-N 3.08Å; I278-V286 HydrophobicContact CB-CG2 4.43Å; I278-V286 HydrophobicContact CD1-CB 4.49Å
279	Q	81.3	Confident	80.1	Confident	198 Å²	198	89.4 Å²	89.4	93%	0.925	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.8	35.9	-178.1	-64.5	-179.2	-20.3	0	0	114.4	M281	Q279-M281 VanDerWaalsContact C-N 3.27Å; Q279-M281 PolarHBondContact O-N 3.48Å
280	G	79.2	Confident	80.9	Confident	63 Å²	63	91.8 Å²	91.8	65%	0.649	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	82	-7.9	179.6	0	0	0	0	0	115.6	I278	I278-G280 PolarHBondContact O-N 2.76Å; I278-G280 VanDerWaalsContact O-N 3.15Å
281	M	79.7	Confident	81.6	Confident	102 Å²	102	89.5 Å²	89.5	50%	0.502	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	157.4	172	-65.7	177.2	63.6	0	0	110.9	R277 I278 Q279 G283 L285 V286	R277-M281 CarbonylContact C-O 3.54Å; R277-M281 VanDerWaalsContact CA-O 3.24Å; R277-M281 WeakPolarHBondContact CA-O 3.3Å; I278-M281 PolarHBondContact N-O 2.89Å; I278-M281 PolarHBondContact O-N 3.08Å; Q279-M281 VanDerWaalsContact C-N 3.27Å; Q279-M281 PolarHBondContact O-N 3.48Å; M281-G283 PolarHBondContact O-N 2.89Å; M281-L285 HydrophobicContact CE-CD2 3.47Å; M281-L285 VanDerWaalsContact CE-CD2 3.47Å; M281-V286 HydrophobicContact CB-CG2 4.11Å
282	N	83.3	Confident	82.4	Confident	62 Å²	62	86.2 Å²	86.2	33%	0.332	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.4	120.8	173.9	-174.6	-29.3	0	0	0	109.4	F284 L285 V286	N282-F284 PolarHBondContact O-N 2.88Å; N282-F284 PolarHBondContact OD1-N 3.3Å; N282-F284 VanDerWaalsContact OD1-N 3.17Å; N282-L285 HydrophobicContact CB-CB 4.2Å; N282-L285 WeakPolarHBondContact O-CB 3.15Å; N282-L285 PolarHBondContact O-N 3.01Å; N282-V286 PolarHBondContact O-N 3.2Å
283	G	83.3	Confident	83.5	Confident	0 Å²	0	83.2 Å²	83.2	0%	0	44%	0.439	C	S	.	.	H	α-helix	trans	-61.8	-32.2	-172.6	0	0	0	0	0	113.1	F276 M281 L285 V286 I287	F276-G283 VanDerWaalsContact CE1-C 3.5Å; F276-G283 PolarHBondContact O-N 3.03Å; M281-G283 PolarHBondContact O-N 2.89Å; G283-L285 VanDerWaalsContact C-N 3.34Å; G283-L285 PolarHBondContact O-N 3.27Å; G283-V286 PolarHBondContact O-N 3.38Å; G283-I287 WeakPolarHBondContact O-CG1 3.33Å; G283-I287 PolarHBondContact O-N 3.48Å; G283-I287 VanDerWaalsContact O-N 3.11Å
284	F	85	Confident	84.5	Confident	83 Å²	83	82.7 Å²	82.7	36%	0.364	43%	0.429	S	S	.	.	H	α-helix	trans	-69.1	-31.3	176	-65.5	-65.3	0	0	0	113.2	F276 N282 S288 L868	F276-F284 HydrophobicContact CB-CE2 4.17Å; F276-F284 HydrophobicContact CD1-CD1 4.29Å; F276-F284 HydrophobicContact CD1-CD2 4.04Å; F276-F284 HydrophobicContact CD1-CE1 4.23Å; F276-F284 AromaticContact CD1-CE2 3.97Å; F276-F284 HydrophobicContact CD1-CE2 3.97Å; F276-F284 HydrophobicContact CD1-CG 4.21Å; F276-F284 HydrophobicContact CD1-CZ 4.08Å; F276-F284 HydrophobicContact CE1-CD1 4.48Å; N282-F284 PolarHBondContact O-N 2.88Å; N282-F284 PolarHBondContact OD1-N 3.3Å; N282-F284 VanDerWaalsContact OD1-N 3.17Å; F284-S288 WeakPolarHBondContact O-CB 3.21Å; F284-S288 PolarHBondContact O-N 3.23Å; F284-S288 PolarHBondContact O-OG 3.36Å; F284-L868 HydrophobicContact CB-CD1 3.77Å; F284-L868 HydrophobicContact CD1-CD1 3.53Å; F284-L868 HydrophobicContact CE1-CD1 4.23Å; F284-L868 HydrophobicContact CG-CD1 3.74Å
285	L	86.7	Confident	85.5	Confident	54 Å²	54	77.5 Å²	77.5	28%	0.283	41%	0.406	S	S	.	.	H	α-helix	trans	-67.4	-42.9	175	-176.6	135	0	0	0	110.7	M281 N282 G283 S288 I289 F865	M281-L285 HydrophobicContact CE-CD2 3.47Å; M281-L285 VanDerWaalsContact CE-CD2 3.47Å; N282-L285 HydrophobicContact CB-CB 4.2Å; N282-L285 WeakPolarHBondContact O-CB 3.15Å; N282-L285 PolarHBondContact O-N 3.01Å; G283-L285 VanDerWaalsContact C-N 3.34Å; G283-L285 PolarHBondContact O-N 3.27Å; L285-S288 PolarHBondContact O-N 3.36Å; L285-I289 HydrophobicContact CD2-CD1 3.58Å; L285-I289 HydrophobicContact CG-CD1 4.23Å; L285-I289 WeakPolarHBondContact O-CG1 3.19Å; L285-I289 PolarHBondContact O-N 2.92Å; L285-F865 HydrophobicContact CB-CD2 3.97Å; L285-F865 HydrophobicContact CB-CE2 3.62Å; L285-F865 HydrophobicContact CB-CZ 4.32Å; L285-F865 HydrophobicContact CD1-CE1 4.26Å; L285-F865 HydrophobicContact CD1-CE2 3.97Å; L285-F865 HydrophobicContact CD1-CZ 3.81Å; L285-F865 HydrophobicContact CG-CE2 4.29Å
286	V	86.9	Confident	86.2	Confident	33 Å²	33	76 Å²	76	20%	0.2	39%	0.393	C	S	.	.	H	α-helix	trans	-61.6	-46.6	176.5	178.8	0	0	0	0	110.9	I278 M281 N282 G283 S288 I289 I290	I278-V286 HydrophobicContact CB-CG2 4.43Å; I278-V286 HydrophobicContact CD1-CB 4.49Å; M281-V286 HydrophobicContact CB-CG2 4.11Å; N282-V286 PolarHBondContact O-N 3.2Å; G283-V286 PolarHBondContact O-N 3.38Å; V286-S288 VanDerWaalsContact C-N 3.3Å; V286-S288 PolarHBondContact O-N 3.43Å; V286-I289 PolarHBondContact O-N 2.86Å; V286-I290 HydrophobicContact CG1-CD1 3.99Å; V286-I290 WeakPolarHBondContact O-CG1 3.22Å; V286-I290 PolarHBondContact O-N 3.06Å
287	I	87.9	Confident	86.6	Confident	85 Å²	85	74.8 Å²	74.8	44%	0.436	40%	0.396	S	S	.	.	H	α-helix	trans	-59.1	-43	176.8	-67	168.7	0	0	0	111	F276 G283 I290 L291	F276-I287 HydrophobicContact CE1-CD1 3.84Å; F276-I287 HydrophobicContact CZ-CD1 4.26Å; G283-I287 WeakPolarHBondContact O-CG1 3.33Å; G283-I287 PolarHBondContact O-N 3.48Å; G283-I287 VanDerWaalsContact O-N 3.11Å; I287-I290 PolarHBondContact O-N 2.88Å; I287-L291 WeakPolarHBondContact O-CB 3.04Å; I287-L291 PolarHBondContact O-N 2.7Å
288	S	87	Confident	86.8	Confident	10 Å²	10	69.7 Å²	69.7	7%	0.07	39%	0.39	C	S	.	.	H	α-helix	trans	-66.8	-37.2	-179.6	-56.8	0	0	0	0	112.5	F284 L285 V286 L291 L292	F284-S288 WeakPolarHBondContact O-CB 3.21Å; F284-S288 PolarHBondContact O-N 3.23Å; F284-S288 PolarHBondContact O-OG 3.36Å; L285-S288 PolarHBondContact O-N 3.36Å; V286-S288 VanDerWaalsContact C-N 3.3Å; V286-S288 PolarHBondContact O-N 3.43Å; S288-L291 PolarHBondContact O-N 3.12Å; S288-L292 WeakPolarHBondContact O-CB 3.26Å; S288-L292 PolarHBondContact O-N 3.44Å
289	I	88.5	Confident	86.9	Confident	84 Å²	84	67.4 Å²	67.4	43%	0.431	38%	0.377	S	S	.	.	H	α-helix	trans	-66.1	-43	174.4	-68.9	168.8	0	0	0	111	L285 V286 L291 L292 C293	L285-I289 HydrophobicContact CD2-CD1 3.58Å; L285-I289 HydrophobicContact CG-CD1 4.23Å; L285-I289 WeakPolarHBondContact O-CG1 3.19Å; L285-I289 PolarHBondContact O-N 2.92Å; V286-I289 PolarHBondContact O-N 2.86Å; I289-L291 VanDerWaalsContact C-N 3.33Å; I289-L291 PolarHBondContact O-N 3.45Å; I289-L292 WeakPolarHBondContact O-CB 3.34Å; I289-L292 PolarHBondContact O-N 2.84Å; I289-C293 PolarHBondContact O-N 3.16Å; I289-C293 PolarHBondContact O-SG 3.41Å; I289-C293 VanDerWaalsContact O-SG 3.41Å
290	I	89.7	Confident	87.1	Confident	94 Å²	94	61.1 Å²	61.1	48%	0.482	35%	0.353	S	S	.	.	H	α-helix	trans	-61	-45.3	176.6	-67.8	167.5	0	0	0	110.1	V286 I287 L292 C293 L294	V286-I290 HydrophobicContact CG1-CD1 3.99Å; V286-I290 WeakPolarHBondContact O-CG1 3.22Å; V286-I290 PolarHBondContact O-N 3.06Å; I287-I290 PolarHBondContact O-N 2.88Å; I290-L292 PolarHBondContact O-N 3.29Å; I290-C293 PolarHBondContact O-N 3.41Å; I290-L294 HydrophobicContact CG2-CD1 3.92Å; I290-L294 HydrophobicContact CG2-CG 4.43Å; I290-L294 WeakPolarHBondContact O-CB 3.5Å; I290-L294 WeakPolarHBondContact O-CG 3.45Å; I290-L294 PolarHBondContact O-N 2.94Å
291	L	90.2	Very high	87.5	Confident	65 Å²	65	62.2 Å²	62.2	34%	0.34	35%	0.346	S	S	.	.	H	α-helix	trans	-59.8	-44.3	176.6	-176.9	66.1	0	0	0	111.8	I287 S288 I289 L294 L295 I864	I287-L291 WeakPolarHBondContact O-CB 3.04Å; I287-L291 PolarHBondContact O-N 2.7Å; S288-L291 PolarHBondContact O-N 3.12Å; I289-L291 VanDerWaalsContact C-N 3.33Å; I289-L291 PolarHBondContact O-N 3.45Å; L291-L294 PolarHBondContact O-N 3.43Å; L291-L295 HydrophobicContact CD1-CD1 4.29Å; L291-L295 HydrophobicContact CD1-CG 4.4Å; L291-L295 HydrophobicContact CG-CD1 4.06Å; L291-L295 WeakPolarHBondContact O-CG 3.01Å; L291-L295 PolarHBondContact O-N 3.03Å; L291-I864 HydrophobicContact CD2-CD1 4.14Å
292	L	90.6	Very high	87.8	Confident	32 Å²	32	60.8 Å²	60.8	17%	0.168	34%	0.336	C	S	.	.	H	α-helix	trans	-59.2	-49.4	176.7	178	63.7	0	0	0	111.6	S288 I289 I290 L294 L295 I296 I857 F858 C861	S288-L292 WeakPolarHBondContact O-CB 3.26Å; S288-L292 PolarHBondContact O-N 3.44Å; I289-L292 WeakPolarHBondContact O-CB 3.34Å; I289-L292 PolarHBondContact O-N 2.84Å; I290-L292 PolarHBondContact O-N 3.29Å; L292-L294 VanDerWaalsContact C-N 3.34Å; L292-L294 PolarHBondContact O-N 2.97Å; L292-L295 PolarHBondContact O-N 3.45Å; L292-I296 HydrophobicContact CD1-CD1 3.73Å; L292-I296 HydrophobicContact CD1-CG1 4.22Å; L292-I296 HydrophobicContact CG-CD1 3.87Å; L292-I296 WeakPolarHBondContact O-CB 3.39Å; L292-I296 VanDerWaalsContact O-CG1 3.29Å; L292-I296 WeakPolarHBondContact O-CG1 3.28Å; L292-I296 PolarHBondContact O-N 2.86Å; L292-I857 HydrophobicContact CD1-CG2 4Å; L292-F858 HydrophobicContact CD1-CB 4.45Å; L292-F858 HydrophobicContact CD2-CD2 4.02Å; L292-C861 HydrophobicContact CB-CB 4.07Å; L292-C861 HydrophobicContact CD1-CB 4.08Å
293	C	90.6	Very high	87.8	Confident	70 Å²	70	59.5 Å²	59.5	47%	0.473	33%	0.329	S	S	.	.	H	α-helix	trans	-59.5	-44.5	177.2	-71.7	0	0	0	0	111.5	I289 I290 I296 C297	I289-C293 PolarHBondContact O-N 3.16Å; I289-C293 PolarHBondContact O-SG 3.41Å; I289-C293 VanDerWaalsContact O-SG 3.41Å; I290-C293 PolarHBondContact O-N 3.41Å; C293-I296 PolarHBondContact O-N 3.46Å; C293-C297 VanDerWaalsContact O-CB 3.29Å; C293-C297 WeakPolarHBondContact O-CB 3.4Å; C293-C297 PolarHBondContact O-N 3.37Å; C293-C297 PolarHBondContact O-SG 3.49Å
294	L	92.4	Very high	87.8	Confident	109 Å²	109	64.6 Å²	64.6	57%	0.571	36%	0.355	S	S	*	.	H	α-helix	trans	-62	-45.3	178.1	-74.9	170.8	0	0	0	112.4	I290 L291 L292 C297 A298	I290-L294 HydrophobicContact CG2-CD1 3.92Å; I290-L294 HydrophobicContact CG2-CG 4.43Å; I290-L294 WeakPolarHBondContact O-CB 3.5Å; I290-L294 WeakPolarHBondContact O-CG 3.45Å; I290-L294 PolarHBondContact O-N 2.94Å; L291-L294 PolarHBondContact O-N 3.43Å; L292-L294 VanDerWaalsContact C-N 3.34Å; L292-L294 PolarHBondContact O-N 2.97Å; L294-C297 PolarHBondContact O-N 3.47Å; L294-A298 VanDerWaalsContact O-CB 3.3Å; L294-A298 WeakPolarHBondContact O-CB 3.48Å; L294-A298 PolarHBondContact O-N 2.84Å
295	L	89.6	Confident	87.6	Confident	65 Å²	65	64.3 Å²	64.3	34%	0.34	36%	0.36	S	S	.	.	H	α-helix	trans	-66.6	-40.9	179.5	-72.5	172.8	0	0	0	112.1	L291 L292 A298 F299 I857	L291-L295 HydrophobicContact CD1-CD1 4.29Å; L291-L295 HydrophobicContact CD1-CG 4.4Å; L291-L295 HydrophobicContact CG-CD1 4.06Å; L291-L295 WeakPolarHBondContact O-CG 3.01Å; L291-L295 PolarHBondContact O-N 3.03Å; L292-L295 PolarHBondContact O-N 3.45Å; L295-A298 PolarHBondContact O-N 3.45Å; L295-F299 WeakPolarHBondContact O-CB 3.16Å; L295-F299 PolarHBondContact O-N 3.41Å; L295-I857 HydrophobicContact CB-CG2 3.85Å; L295-I857 HydrophobicContact CD1-CG2 4.27Å
296	I	89.3	Confident	87.2	Confident	56 Å²	56	64 Å²	64	29%	0.287	36%	0.362	S	S	.	.	H	α-helix	trans	-64.5	-46.9	175	-67.6	171.3	0	0	0	110.3	L292 C293 A298 F299 V300 L854 I857	L292-I296 HydrophobicContact CD1-CD1 3.73Å; L292-I296 HydrophobicContact CD1-CG1 4.22Å; L292-I296 HydrophobicContact CG-CD1 3.87Å; L292-I296 WeakPolarHBondContact O-CB 3.39Å; L292-I296 VanDerWaalsContact O-CG1 3.29Å; L292-I296 WeakPolarHBondContact O-CG1 3.28Å; L292-I296 PolarHBondContact O-N 2.86Å; C293-I296 PolarHBondContact O-N 3.46Å; I296-A298 PolarHBondContact O-N 3.45Å; I296-F299 PolarHBondContact O-N 2.86Å; I296-V300 HydrophobicContact CG2-CG2 4.35Å; I296-V300 WeakPolarHBondContact O-CG2 3.36Å; I296-V300 PolarHBondContact O-N 2.91Å; I296-L854 HydrophobicContact CG1-CD2 4.17Å; I296-L854 HydrophobicContact CG2-CD2 4.16Å; I296-I857 HydrophobicContact CG1-CG2 4.37Å
297	C	89	Confident	86.7	Confident	76 Å²	76	68.2 Å²	68.2	51%	0.514	38%	0.379	S	S	.	.	H	α-helix	trans	-59.4	-46.1	176.6	-74.4	0	0	0	0	111.6	C293 L294 F299 V300 V301	C293-C297 VanDerWaalsContact O-CB 3.29Å; C293-C297 WeakPolarHBondContact O-CB 3.4Å; C293-C297 PolarHBondContact O-N 3.37Å; C293-C297 PolarHBondContact O-SG 3.49Å; L294-C297 PolarHBondContact O-N 3.47Å; C297-F299 VanDerWaalsContact C-N 3.31Å; C297-F299 PolarHBondContact O-N 3.2Å; C297-V300 PolarHBondContact O-N 3.12Å; C297-V301 WeakPolarHBondContact O-CB 3.46Å; C297-V301 VanDerWaalsContact O-CG2 3.25Å; C297-V301 WeakPolarHBondContact O-CG2 3.44Å; C297-V301 PolarHBondContact O-N 2.85Å
298	A	88.3	Confident	86	Confident	60 Å²	60	71.6 Å²	71.6	50%	0.496	39%	0.388	S	S	.	.	H	α-helix	trans	-59.7	-41.4	176.8	0	0	0	0	0	112	L294 L295 I296 Y302	L294-A298 VanDerWaalsContact O-CB 3.3Å; L294-A298 WeakPolarHBondContact O-CB 3.48Å; L294-A298 PolarHBondContact O-N 2.84Å; L295-A298 PolarHBondContact O-N 3.45Å; I296-A298 PolarHBondContact O-N 3.45Å; A298-Y302 WeakPolarHBondContact O-CB 3.48Å; A298-Y302 PolarHBondContact O-N 3.42Å
299	F	87	Confident	85.2	Confident	14 Å²	14	74.6 Å²	74.6	6%	0.061	41%	0.405	C	S	.	.	H	α-helix	trans	-67.5	-42.2	177.2	-176.3	-111	0	0	0	112.5	L295 I296 C297 Y302 L303 I850 M853 L854 I857	L295-F299 WeakPolarHBondContact O-CB 3.16Å; L295-F299 PolarHBondContact O-N 3.41Å; I296-F299 PolarHBondContact O-N 2.86Å; C297-F299 VanDerWaalsContact C-N 3.31Å; C297-F299 PolarHBondContact O-N 3.2Å; F299-Y302 WeakPolarHBondContact O-CB 3.29Å; F299-Y302 PolarHBondContact O-N 3.15Å; F299-L303 HydrophobicContact CD1-CD1 4.12Å; F299-L303 HydrophobicContact CE1-CD1 3.68Å; F299-L303 HydrophobicContact CE1-CG 4.29Å; F299-L303 HydrophobicContact CZ-CD1 4.09Å; F299-L303 HydrophobicContact CZ-CD2 4.38Å; F299-L303 HydrophobicContact CZ-CG 4.3Å; F299-L303 WeakPolarHBondContact O-CG 3.45Å; F299-L303 PolarHBondContact O-N 3.3Å; F299-I850 HydrophobicContact CE1-CG2 4.42Å; F299-M853 HydrophobicContact CD2-CE 4.45Å; F299-M853 HydrophobicContact CE1-CB 3.88Å; F299-M853 HydrophobicContact CE2-CB 4.06Å; F299-M853 HydrophobicContact CE2-CE 4.08Å; F299-M853 HydrophobicContact CE2-CG 3.98Å; F299-M853 HydrophobicContact CZ-CB 3.55Å; F299-M853 HydrophobicContact CZ-CG 3.7Å; F299-L854 HydrophobicContact CD1-CD2 4.38Å; F299-I857 HydrophobicContact CB-CD1 4.48Å
300	V	85.4	Confident	84.2	Confident	67 Å²	67	78.3 Å²	78.3	41%	0.406	42%	0.418	S	S	.	.	H	α-helix	trans	-64.8	-44	176	173.3	0	0	0	0	110.9	I296 C297 Y302 L303 I304	I296-V300 HydrophobicContact CG2-CG2 4.35Å; I296-V300 WeakPolarHBondContact O-CG2 3.36Å; I296-V300 PolarHBondContact O-N 2.91Å; C297-V300 PolarHBondContact O-N 3.12Å; V300-Y302 VanDerWaalsContact C-N 3.33Å; V300-Y302 PolarHBondContact O-N 3.36Å; V300-L303 WeakPolarHBondContact O-CB 3.36Å; V300-L303 PolarHBondContact O-N 3.27Å; V300-L303 VanDerWaalsContact O-N 3.17Å; V300-I304 HydrophobicContact CG1-CD1 3.96Å; V300-I304 WeakPolarHBondContact O-CG1 3.27Å; V300-I304 PolarHBondContact O-N 2.06Å
301	V	86.8	Confident	82.8	Confident	85 Å²	85	77.9 Å²	77.9	52%	0.515	42%	0.424	S	S	.	.	H	α-helix	trans	-59.9	-44.2	174.4	170.8	0	0	0	0	110.6	C297 L303 I304 V305	C297-V301 WeakPolarHBondContact O-CB 3.46Å; C297-V301 VanDerWaalsContact O-CG2 3.25Å; C297-V301 WeakPolarHBondContact O-CG2 3.44Å; C297-V301 PolarHBondContact O-N 2.85Å; V301-L303 VanDerWaalsContact C-N 3.33Å; V301-L303 PolarHBondContact O-N 2.9Å; V301-I304 PolarHBondContact O-N 2.95Å; V301-V305 HydrophobicContact CG1-CG2 4.17Å; V301-V305 WeakPolarHBondContact O-CB 3.27Å; V301-V305 VanDerWaalsContact O-CG2 3.31Å; V301-V305 WeakPolarHBondContact O-CG2 3.27Å; V301-V305 PolarHBondContact O-N 3Å
302	Y	86.5	Confident	81.1	Confident	73 Å²	73	81.4 Å²	81.4	29%	0.286	44%	0.436	S	S	.	.	H	α-helix	trans	-58.2	-42.8	174.5	171	-101.2	0	0	0	112.4	A298 F299 V300 S306 Y1269 F1270	A298-Y302 WeakPolarHBondContact O-CB 3.48Å; A298-Y302 PolarHBondContact O-N 3.42Å; F299-Y302 WeakPolarHBondContact O-CB 3.29Å; F299-Y302 PolarHBondContact O-N 3.15Å; V300-Y302 VanDerWaalsContact C-N 3.33Å; V300-Y302 PolarHBondContact O-N 3.36Å; Y302-S306 WeakPolarHBondContact O-CB 3.29Å; Y302-S306 PolarHBondContact O-N 2.75Å; Y302-Y1269 HydrophobicContact CE1-CD1 4.15Å; Y302-F1270 HydrophobicContact CD1-CE1 4.42Å; Y302-F1270 HydrophobicContact CD1-CZ 4.07Å; Y302-F1270 HydrophobicContact CD2-CE1 4.33Å; Y302-F1270 AromaticContact CE1-CE1 3.84Å; Y302-F1270 HydrophobicContact CE1-CE1 3.84Å; Y302-F1270 AromaticContact CE1-CZ 3.7Å; Y302-F1270 HydrophobicContact CE1-CZ 3.7Å; Y302-F1270 AromaticContact CE2-CE1 3.75Å; Y302-F1270 HydrophobicContact CE2-CE1 3.75Å; Y302-F1270 HydrophobicContact CE2-CZ 4.34Å; Y302-F1270 AromaticContact CZ-CE1 3.46Å; Y302-F1270 VanDerWaalsContact CZ-CE1 3.46Å; Y302-F1270 AromaticContact CZ-CZ 3.85Å
303	L	83.7	Confident	79.3	Confident	34 Å²	34	84.1 Å²	84.1	18%	0.178	45%	0.451	C	S	.	.	H	α-helix	trans	-62.9	-43.5	175.9	-71.8	175.6	0	0	0	112	F299 V300 V301 S306 H307 I850 Y1269	F299-L303 HydrophobicContact CD1-CD1 4.12Å; F299-L303 HydrophobicContact CE1-CD1 3.68Å; F299-L303 HydrophobicContact CE1-CG 4.29Å; F299-L303 HydrophobicContact CZ-CD1 4.09Å; F299-L303 HydrophobicContact CZ-CD2 4.38Å; F299-L303 HydrophobicContact CZ-CG 4.3Å; F299-L303 WeakPolarHBondContact O-CG 3.45Å; F299-L303 PolarHBondContact O-N 3.3Å; V300-L303 WeakPolarHBondContact O-CB 3.36Å; V300-L303 PolarHBondContact O-N 3.27Å; V300-L303 VanDerWaalsContact O-N 3.17Å; V301-L303 VanDerWaalsContact C-N 3.33Å; V301-L303 PolarHBondContact O-N 2.9Å; L303-S306 PolarHBondContact O-N 2.75Å; L303-H307 WeakPolarHBondContact O-CB 3.28Å; L303-H307 PolarHBondContact O-N 3.32Å; L303-I850 HydrophobicContact CD1-CD1 4.36Å; L303-I850 HydrophobicContact CD1-CG1 4.32Å; L303-Y1269 HydrophobicContact CD2-CE1 3.89Å
304	I	82.4	Confident	77.3	Confident	108 Å²	108	83.7 Å²	83.7	55%	0.554	46%	0.459	S	S	*	.	H	α-helix	trans	-63.7	-49.1	178	-66.1	166.5	0	0	0	110.5	V300 V301 S306 H307 Y308	V300-I304 HydrophobicContact CG1-CD1 3.96Å; V300-I304 WeakPolarHBondContact O-CG1 3.27Å; V300-I304 PolarHBondContact O-N 2.06Å; V301-I304 PolarHBondContact O-N 2.95Å; I304-S306 PolarHBondContact O-N 3.49Å; I304-H307 PolarHBondContact O-N 3.24Å; I304-Y308 WeakPolarHBondContact O-CB 3.3Å; I304-Y308 PolarHBondContact O-N 3.31Å
305	V	82.1	Confident	75	Confident	76 Å²	76	87.6 Å²	87.6	46%	0.461	47%	0.471	S	S	.	.	H	α-helix	trans	-62.4	-44.6	178.2	172.9	0	0	0	0	110.7	V301 H307 Y308 V309	V301-V305 HydrophobicContact CG1-CG2 4.17Å; V301-V305 WeakPolarHBondContact O-CB 3.27Å; V301-V305 VanDerWaalsContact O-CG2 3.31Å; V301-V305 WeakPolarHBondContact O-CG2 3.27Å; V301-V305 PolarHBondContact O-N 3Å; V305-H307 PolarHBondContact O-N 3.25Å; V305-Y308 PolarHBondContact O-N 2.93Å; V305-V309 HydrophobicContact CG1-CG2 4.11Å; V305-V309 WeakPolarHBondContact O-CB 3.4Å; V305-V309 VanDerWaalsContact O-CG2 3.28Å; V305-V309 WeakPolarHBondContact O-CG2 3.43Å; V305-V309 PolarHBondContact O-N 3.36Å
306	S	77.2	Confident	72.7	Confident	49 Å²	49	90.6 Å²	90.6	34%	0.343	49%	0.487	S	S	.	.	H	α-helix	trans	-61.7	-42	176.9	173.8	0	0	0	0	111.8	Y302 L303 I304 K310	Y302-S306 WeakPolarHBondContact O-CB 3.29Å; Y302-S306 PolarHBondContact O-N 2.75Å; L303-S306 PolarHBondContact O-N 2.75Å; I304-S306 PolarHBondContact O-N 3.49Å; S306-K310 WeakPolarHBondContact O-CB 3.42Å; S306-K310 PolarHBondContact O-N 3.29Å
307	H	76.8	Confident	70.5	Confident	120 Å²	120	94.4 Å²	94.4	56%	0.556	51%	0.508	S	S	*	.	H	α-helix	trans	-64.5	-42.4	173.3	-91.6	-167	0	0	0	112.2	L303 I304 V305 K310 S311	L303-H307 WeakPolarHBondContact O-CB 3.28Å; L303-H307 PolarHBondContact O-N 3.32Å; I304-H307 PolarHBondContact O-N 3.24Å; V305-H307 PolarHBondContact O-N 3.25Å; H307-K310 PolarHBondContact O-N 3.23Å; H307-S311 VanDerWaalsContact O-CB 3.26Å; H307-S311 WeakPolarHBondContact O-CB 3.41Å; H307-S311 PolarHBondContact O-N 2.95Å
308	Y	73.1	Confident	68.1	Low	157 Å²	157	96.4 Å²	96.4	62%	0.616	52%	0.522	S	S	*	.	H	α-helix	trans	-66.4	-45.6	179.7	-169	-96.2	0	0	0	112.1	I304 V305 K310 S311 K312	I304-Y308 WeakPolarHBondContact O-CB 3.3Å; I304-Y308 PolarHBondContact O-N 3.31Å; V305-Y308 PolarHBondContact O-N 2.93Å; Y308-K310 PolarHBondContact O-N 3.14Å; Y308-S311 PolarHBondContact O-N 2.85Å; Y308-K312 HydrophobicContact CE1-CD 4.14Å; Y308-K312 WeakPolarHBondContact O-CB 3.3Å; Y308-K312 PolarHBondContact O-N 2.84Å
309	V	70.8	Confident	65.9	Low	72 Å²	72	102.2 Å²	102.2	44%	0.436	54%	0.537	S	S	.	.	H	α-helix	trans	-63.7	-40.4	176	172.2	0	0	0	0	111.1	V305 K312 N313	V305-V309 HydrophobicContact CG1-CG2 4.11Å; V305-V309 WeakPolarHBondContact O-CB 3.4Å; V305-V309 VanDerWaalsContact O-CG2 3.28Å; V305-V309 WeakPolarHBondContact O-CG2 3.43Å; V305-V309 PolarHBondContact O-N 3.36Å; V309-K312 PolarHBondContact O-N 3.33Å; V309-N313 WeakPolarHBondContact O-CB 3.47Å; V309-N313 PolarHBondContact O-N 3.38Å
310	K	66.2	Low	63.5	Low	162 Å²	162	107.6 Å²	107.6	70%	0.704	57%	0.571	S	S	*	*	H	α-helix	trans	-69.1	-35.6	177.4	-156.5	175.4	-172	-178.3	0	112.1	S306 H307 Y308 G314	S306-K310 WeakPolarHBondContact O-CB 3.42Å; S306-K310 PolarHBondContact O-N 3.29Å; H307-K310 PolarHBondContact O-N 3.23Å; Y308-K310 PolarHBondContact O-N 3.14Å; K310-G314 PolarHBondContact O-N 3.32Å
311	S	60	Low	61.2	Low	85 Å²	85	107.6 Å²	107.6	59%	0.594	58%	0.584	S	S	*	*	H	α-helix	trans	-67.6	-42.2	172.6	-175.9	0	0	0	0	112.1	H307 Y308 G314	H307-S311 VanDerWaalsContact O-CB 3.26Å; H307-S311 WeakPolarHBondContact O-CB 3.41Å; H307-S311 PolarHBondContact O-N 2.95Å; Y308-S311 PolarHBondContact O-N 2.85Å; S311-G314 PolarHBondContact O-N 3.15Å
312	K	55.6	Low	59	Low	139 Å²	139	116 Å²	116	60%	0.604	61%	0.607	S	S	*	*	H	α-helix	trans	-71.2	-41.1	179	-160.7	173.6	-177.9	177.5	0	112.6	Y308 V309 G314 K315	Y308-K312 HydrophobicContact CE1-CD 4.14Å; Y308-K312 WeakPolarHBondContact O-CB 3.3Å; Y308-K312 PolarHBondContact O-N 2.84Å; V309-K312 PolarHBondContact O-N 3.33Å; K312-G314 VanDerWaalsContact C-N 3.29Å; K312-G314 PolarHBondContact O-N 2.96Å; K312-K315 PolarHBondContact O-N 2.88Å
313	N	53.1	Low	57.1	Low	89 Å²	89	120.6 Å²	120.6	48%	0.476	63%	0.628	S	S	.	*	H	α-helix	trans	-71.6	-22.4	172.2	-83.3	-8.4	0	0	0	113	V309 K315 N316 L317	V309-N313 WeakPolarHBondContact O-CB 3.47Å; V309-N313 PolarHBondContact O-N 3.38Å; N313-K315 PolarHBondContact O-N 3.34Å; N313-N316 PolarHBondContact O-N 3.05Å; N313-N316 VanDerWaalsContact O-N 3.12Å; N313-L317 PolarHBondContact O-N 2.85Å
314	G	48.3	Very low	55.5	Low	62 Å²	62	127.5 Å²	127.5	64%	0.639	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.1	-19.1	171.8	0	0	0	0	0	114.1	K310 S311 K312	K310-G314 PolarHBondContact O-N 3.32Å; S311-G314 PolarHBondContact O-N 3.15Å; K312-G314 VanDerWaalsContact C-N 3.29Å; K312-G314 PolarHBondContact O-N 2.96Å
315	K	44.5	Very low	54.4	Low	191 Å²	191	125.2 Å²	125.2	83%	0.83	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94	-8.9	172.9	-75	-175.7	175.2	-178.8	0	114.6	K312 N313	K312-K315 PolarHBondContact O-N 2.88Å; N313-K315 PolarHBondContact O-N 3.34Å
316	N	40.3	Very low	53.5	Low	127 Å²	127	125.4 Å²	125.4	68%	0.679	65%	0.652	S	S	*	*	S	Bend	trans	-122.2	14.7	-176.6	-91.6	-5.1	0	0	0	114.9	N313 S318	N313-N316 PolarHBondContact O-N 3.05Å; N313-N316 VanDerWaalsContact O-N 3.12Å; N316-S318 PolarHBondContact O-N 2.73Å
317	L	42.9	Very low	52.8	Low	137 Å²	137	127.9 Å²	127.9	72%	0.717	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.6	62.1	-177.8	-131.6	80.5	0	0	0	113.3	N313	N313-L317 PolarHBondContact O-N 2.85Å
318	S	38.9	Very low	52.1	Low	117 Å²	117	124.5 Å²	124.5	82%	0.818	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.1	-3.5	159.6	70.3	0	0	0	0	114.3	N316	N316-S318 PolarHBondContact O-N 2.73Å
319	K	43.3	Very low	51.8	Low	183 Å²	183	118.6 Å²	118.6	80%	0.796	64%	0.64	S	S	*	*			trans	-146.9	103.1	174.3	-77.4	-177.3	176.6	174.4	0	110.7
320	T	35.3	Very low	51.6	Low	126 Å²	126	121.5 Å²	121.5	77%	0.773	65%	0.647	S	S	*	*			trans	-159.8	112.6	148.8	11	0	0	0	0	108.4
321	G	36.6	Very low	51.8	Low	67 Å²	67	116.8 Å²	116.8	69%	0.691	63%	0.632	S	S	*	*			trans	-69.3	173.3	-172.7	0	0	0	0	0	114.9	K323	G321-K323 PolarHBondContact O-N 2.82Å
322	R	41.8	Very low	52.2	Low	261 Å²	261	113.3 Å²	113.3	99%	0.985	61%	0.607	S	S	*	*			trans	-28.9	101.6	163.5	-100.9	170.9	167.5	162.6	-3.5	111.2
323	K	46.1	Very low	53	Low	170 Å²	170	109.8 Å²	109.8	74%	0.739	59%	0.594	S	S	*	*	P	Polyproline II helix	trans	-77.3	125.4	163.6	-85.5	-174.9	176.1	-174.1	0	108.2	G321 K1276	G321-K323 PolarHBondContact O-N 2.82Å; K323-K1276 PolarHBondContact O-NZ 3.47Å
324	E	50.2	Low	54.1	Low	179 Å²	179	108.4 Å²	108.4	84%	0.836	60%	0.595	S	S	*	*	P	Polyproline II helix	trans	-49.1	153.7	-179.5	-68.8	179.2	156.7	0	0	114.2
325	V	60.2	Low	55.4	Low	61 Å²	61	107.2 Å²	107.2	37%	0.37	58%	0.579	S	S	.	*	P	Polyproline II helix	trans	-73.8	120.1	175.2	-177.3	0	0	0	0	108.7	D329 K330 A1277	V325-D329 HydrophobicContact CG1-CB 4Å; V325-K330 HydrophobicContact CG1-CD 4.46Å; V325-K330 HydrophobicContact CG1-CG 3.73Å; V325-A1277 HydrophobicContact CG1-CB 4.01Å
326	T	63.4	Low	57	Low	79 Å²	79	99.4 Å²	99.4	49%	0.485	55%	0.545	S	S	.	.	P	Polyproline II helix	trans	-67.1	149.2	178.2	18.1	0	0	0	0	111.7	A328 D329 K330	T326-A328 PolarHBondContact O-N 3.22Å; T326-D329 WeakPolarHBondContact O-CB 3.37Å; T326-D329 PolarHBondContact O-N 3.04Å; T326-D329 PolarHBondContact OG1-OD1 3.31Å; T326-D329 PolarHBondContact OG1-OD2 3.14Å; T326-K330 PolarHBondContact O-N 3.28Å
327	C	61.4	Low	59	Low	101 Å²	101	96.3 Å²	96.3	68%	0.682	54%	0.537	S	S	*	.	H	α-helix	trans	-57.3	-39.8	177.3	-168.8	0	0	0	0	111.5	D329 K330 T331	C327-D329 VanDerWaalsContact C-N 3.32Å; C327-D329 PolarHBondContact O-N 3.46Å; C327-K330 PolarHBondContact O-N 3.32Å; C327-T331 PolarHBondContact O-N 2.97Å; C327-T331 PolarHBondContact O-OG1 3.05Å
328	A	61.5	Low	61.1	Low	49 Å²	49	96 Å²	96	41%	0.405	53%	0.53	S	S	.	.	H	α-helix	trans	-57.6	-39.6	174.2	0	0	0	0	0	113.3	T326 T331 S332	T326-A328 PolarHBondContact O-N 3.22Å; A328-T331 VanDerWaalsContact CA-OG1 3.3Å; A328-T331 WeakPolarHBondContact CA-OG1 3.47Å; A328-T331 PolarHBondContact O-N 3.44Å; A328-T331 PolarHBondContact O-OG1 2.96Å; A328-S332 VanDerWaalsContact O-CB 3.23Å; A328-S332 WeakPolarHBondContact O-CB 3.14Å; A328-S332 PolarHBondContact O-N 2.92Å
329	D	66.6	Low	63.2	Low	33 Å²	33	91.7 Å²	91.7	18%	0.176	50%	0.498	C	S	.	.	H	α-helix	trans	-66.4	-40.1	179.1	-68.5	22.2	0	0	0	111	V325 T326 C327 M333 N1275 A1277	V325-D329 HydrophobicContact CG1-CB 4Å; T326-D329 WeakPolarHBondContact O-CB 3.37Å; T326-D329 PolarHBondContact O-N 3.04Å; T326-D329 PolarHBondContact OG1-OD1 3.31Å; T326-D329 PolarHBondContact OG1-OD2 3.14Å; C327-D329 VanDerWaalsContact C-N 3.32Å; C327-D329 PolarHBondContact O-N 3.46Å; D329-M333 WeakPolarHBondContact O-CB 3.34Å; D329-M333 PolarHBondContact O-N 3.47Å; D329-M333 VanDerWaalsContact O-N 3.15Å; D329-N1275 WeakPolarHBondContact CB-OD1 3.31Å; D329-A1277 HydrophobicContact CB-CB 4.4Å
330	K	68.4	Low	65.3	Low	134 Å²	134	84.7 Å²	84.7	58%	0.583	47%	0.472	S	S	*	.	H	α-helix	trans	-67.9	-44.2	175.8	-72	-176.1	179.1	177.4	0	111.9	V325 T326 C327 A334	V325-K330 HydrophobicContact CG1-CD 4.46Å; V325-K330 HydrophobicContact CG1-CG 3.73Å; T326-K330 PolarHBondContact O-N 3.28Å; C327-K330 PolarHBondContact O-N 3.32Å; K330-A334 VanDerWaalsContact O-CB 3.31Å; K330-A334 WeakPolarHBondContact O-CB 3.22Å; K330-A334 PolarHBondContact O-N 3.44Å
331	T	69.5	Low	67.9	Low	63 Å²	63	85.9 Å²	85.9	39%	0.387	46%	0.462	S	S	.	.	H	α-helix	trans	-67	-38.3	178.4	51.1	0	0	0	0	111.8	C327 A328 A334 A335	C327-T331 PolarHBondContact O-N 2.97Å; C327-T331 PolarHBondContact O-OG1 3.05Å; A328-T331 VanDerWaalsContact CA-OG1 3.3Å; A328-T331 WeakPolarHBondContact CA-OG1 3.47Å; A328-T331 PolarHBondContact O-N 3.44Å; A328-T331 PolarHBondContact O-OG1 2.96Å; T331-A334 PolarHBondContact O-N 2.95Å; T331-A335 WeakPolarHBondContact O-CB 3.36Å; T331-A335 PolarHBondContact O-N 3.45Å
332	S	68.8	Low	70.5	Confident	11 Å²	11	86.4 Å²	86.4	8%	0.077	45%	0.447	C	S	.	.	H	α-helix	trans	-60.2	-51.2	176	179.1	0	0	0	0	111.8	A328 A334 A335 Q336 L1136 G1137	A328-S332 VanDerWaalsContact O-CB 3.23Å; A328-S332 WeakPolarHBondContact O-CB 3.14Å; A328-S332 PolarHBondContact O-N 2.92Å; S332-A334 PolarHBondContact O-N 3.26Å; S332-A335 PolarHBondContact O-N 2.63Å; S332-Q336 WeakPolarHBondContact O-CG 3.23Å; S332-Q336 PolarHBondContact O-N 2.93Å; S332-L1136 PolarHBondContact OG-O 3.34Å; S332-G1137 VanDerWaalsContact CB-O 3.26Å; S332-G1137 WeakPolarHBondContact CB-O 3.4Å
333	M	72.6	Confident	73	Confident	65 Å²	65	75.5 Å²	75.5	32%	0.32	41%	0.407	S	S	.	.	H	α-helix	trans	-61	-43.5	176	-86.8	-104.2	-58.3	0	0	112.6	D329 Q336 A337 A1277 V1278	D329-M333 WeakPolarHBondContact O-CB 3.34Å; D329-M333 PolarHBondContact O-N 3.47Å; D329-M333 VanDerWaalsContact O-N 3.15Å; M333-Q336 PolarHBondContact O-N 3.49Å; M333-A337 WeakPolarHBondContact O-CB 3.37Å; M333-A337 PolarHBondContact O-N 3.37Å; M333-A1277 HydrophobicContact CB-CB 4.44Å; M333-A1277 VanDerWaalsContact CE-C 3.48Å; M333-A1277 HydrophobicContact CE-CB 4.04Å; M333-A1277 WeakPolarHBondContact CE-O 3.35Å; M333-A1277 HydrophobicContact CG-CB 3.77Å; M333-A1277 HydrophobicContact SD-CB 4.39Å; M333-V1278 HydrophobicContact CG-CG2 4Å; M333-V1278 HydrophobicContact SD-CB 4.08Å; M333-V1278 HydrophobicContact SD-CG2 3.39Å; M333-V1278 WeakPolarHBondContact SD-CG2 3.26Å
334	A	76	Confident	75.2	Confident	61 Å²	61	70.8 Å²	70.8	50%	0.504	39%	0.387	S	S	.	.	H	α-helix	trans	-62.5	-43.2	178.2	0	0	0	0	0	111.5	K330 T331 S332 F338	K330-A334 VanDerWaalsContact O-CB 3.31Å; K330-A334 WeakPolarHBondContact O-CB 3.22Å; K330-A334 PolarHBondContact O-N 3.44Å; T331-A334 PolarHBondContact O-N 2.95Å; S332-A334 PolarHBondContact O-N 3.26Å; A334-F338 WeakPolarHBondContact O-CB 3.34Å; A334-F338 PolarHBondContact O-N 2.64Å
335	A	76.1	Confident	77.3	Confident	37 Å²	37	68.7 Å²	68.7	31%	0.306	37%	0.372	S	S	.	.	H	α-helix	trans	-64.5	-45.2	177.5	0	0	0	0	0	112	T331 S332 F338 M339	T331-A335 WeakPolarHBondContact O-CB 3.36Å; T331-A335 PolarHBondContact O-N 3.45Å; S332-A335 PolarHBondContact O-N 2.63Å; A335-F338 PolarHBondContact O-N 3.11Å; A335-M339 WeakPolarHBondContact O-CG 3.33Å; A335-M339 PolarHBondContact O-N 3.39Å
336	Q	77.9	Confident	78.9	Confident	26 Å²	26	71.3 Å²	71.3	12%	0.121	38%	0.375	C	S	.	.	H	α-helix	trans	-67.5	-43.7	178.8	-72.2	179.6	-20.4	0	0	112.5	S332 M333 F338 M339 S340	S332-Q336 WeakPolarHBondContact O-CG 3.23Å; S332-Q336 PolarHBondContact O-N 2.93Å; M333-Q336 PolarHBondContact O-N 3.49Å; Q336-F338 VanDerWaalsContact C-N 3.31Å; Q336-F338 PolarHBondContact O-N 3.01Å; Q336-M339 HydrophobicContact CG-CE 4.48Å; Q336-M339 PolarHBondContact O-N 2.97Å; Q336-S340 VanDerWaalsContact O-CB 3.28Å; Q336-S340 WeakPolarHBondContact O-CB 3.45Å; Q336-S340 PolarHBondContact O-N 3.11Å
337	A	81.1	Confident	80.2	Confident	62 Å²	62	67.5 Å²	67.5	51%	0.512	35%	0.352	S	S	.	.	H	α-helix	trans	-64.6	-37.6	175.7	0	0	0	0	0	111.6	M333 R341	M333-A337 WeakPolarHBondContact O-CB 3.37Å; M333-A337 PolarHBondContact O-N 3.37Å; A337-R341 VanDerWaalsContact O-CB 3.27Å; A337-R341 WeakPolarHBondContact O-CB 3.33Å; A337-R341 PolarHBondContact O-N 2.84Å
338	F	86.7	Confident	81.7	Confident	130 Å²	130	64.4 Å²	64.4	57%	0.57	33%	0.33	S	S	*	.	H	α-helix	trans	-61.8	-53.8	174.3	176.7	-97.9	0	0	0	111.3	A334 A335 Q336 S340 R341 Q342	A334-F338 WeakPolarHBondContact O-CB 3.34Å; A334-F338 PolarHBondContact O-N 2.64Å; A335-F338 PolarHBondContact O-N 3.11Å; Q336-F338 VanDerWaalsContact C-N 3.31Å; Q336-F338 PolarHBondContact O-N 3.01Å; F338-S340 PolarHBondContact O-N 2.99Å; F338-R341 PolarHBondContact O-N 3Å; F338-Q342 HydrophobicContact CD1-CG 4.49Å; F338-Q342 HydrophobicContact CE1-CG 4.12Å; F338-Q342 HydrophobicContact CE2-CG 4.21Å; F338-Q342 HydrophobicContact CZ-CG 3.97Å; F338-Q342 WeakPolarHBondContact O-CG 3.45Å; F338-Q342 PolarHBondContact O-N 3.35Å
339	M	84.4	Confident	83.2	Confident	28 Å²	28	66.2 Å²	66.2	14%	0.138	33%	0.332	C	S	.	.	H	α-helix	trans	-58.3	-47.5	178.3	-73.1	-173.2	-74.4	0	0	111.7	A335 Q336 R341 Q342 F343 P747 L1135	A335-M339 WeakPolarHBondContact O-CG 3.33Å; A335-M339 PolarHBondContact O-N 3.39Å; Q336-M339 HydrophobicContact CG-CE 4.48Å; Q336-M339 PolarHBondContact O-N 2.97Å; M339-R341 VanDerWaalsContact C-N 3.32Å; M339-R341 PolarHBondContact O-N 3.25Å; M339-Q342 PolarHBondContact O-N 3.33Å; M339-F343 HydrophobicContact CB-CD2 4.46Å; M339-F343 WeakPolarHBondContact O-CD2 3.39Å; M339-F343 PolarHBondContact O-N 3.04Å; M339-P747 HydrophobicContact CB-CG 4.31Å; M339-L1135 HydrophobicContact CE-CD2 4.28Å; M339-L1135 HydrophobicContact SD-CD2 3.69Å
340	S	86.7	Confident	84.5	Confident	36 Å²	36	65.5 Å²	65.5	25%	0.252	33%	0.328	S	S	.	.	H	α-helix	trans	-59.1	-42.3	179.7	-170.6	0	0	0	0	112.1	Q336 F338 Q344 G743	Q336-S340 VanDerWaalsContact O-CB 3.28Å; Q336-S340 WeakPolarHBondContact O-CB 3.45Å; Q336-S340 PolarHBondContact O-N 3.11Å; F338-S340 PolarHBondContact O-N 2.99Å; S340-Q344 VanDerWaalsContact O-CB 3.28Å; S340-Q344 WeakPolarHBondContact O-CB 3.46Å; S340-Q344 PolarHBondContact O-N 2.81Å; S340-G743 WeakPolarHBondContact CA-O 3.35Å; S340-G743 VanDerWaalsContact CB-O 3.28Å; S340-G743 WeakPolarHBondContact CB-O 3.48Å; S340-G743 PolarHBondContact OG-O 2.72Å
341	R	89.9	Confident	85.6	Confident	150 Å²	150	59.2 Å²	59.2	57%	0.566	30%	0.301	S	S	*	.	H	α-helix	trans	-67.5	-38.2	178.2	-171.1	175.4	-174.8	176	2.5	112.9	A337 F338 M339 R345	A337-R341 VanDerWaalsContact O-CB 3.27Å; A337-R341 WeakPolarHBondContact O-CB 3.33Å; A337-R341 PolarHBondContact O-N 2.84Å; F338-R341 PolarHBondContact O-N 3Å; M339-R341 VanDerWaalsContact C-N 3.32Å; M339-R341 PolarHBondContact O-N 3.25Å; R341-R345 WeakPolarHBondContact O-CG 3.08Å; R341-R345 PolarHBondContact O-N 2.85Å; R341-R345 VanDerWaalsContact O-N 3.12Å
342	Q	92.3	Very high	86.7	Confident	79 Å²	79	59.1 Å²	59.1	37%	0.369	30%	0.303	S	S	.	.	H	α-helix	trans	-68.9	-46.4	177.1	-63.3	-53.4	-21.1	0	0	111.4	F338 M339 Q344 R345 W346	F338-Q342 HydrophobicContact CD1-CG 4.49Å; F338-Q342 HydrophobicContact CE1-CG 4.12Å; F338-Q342 HydrophobicContact CE2-CG 4.21Å; F338-Q342 HydrophobicContact CZ-CG 3.97Å; F338-Q342 WeakPolarHBondContact O-CG 3.45Å; F338-Q342 PolarHBondContact O-N 3.35Å; M339-Q342 PolarHBondContact O-N 3.33Å; Q342-Q344 VanDerWaalsContact C-N 3.26Å; Q342-Q344 PolarHBondContact O-N 2.94Å; Q342-R345 PolarHBondContact O-N 3.4Å; Q342-W346 WeakPolarHBondContact O-CB 3.28Å; Q342-W346 PolarHBondContact O-N 2.78Å
343	F	93.1	Very high	87.8	Confident	32 Å²	32	65.8 Å²	65.8	14%	0.14	33%	0.327	C	S	.	.	H	α-helix	trans	-63.9	-32.8	175.8	-77.5	-60.9	0	0	0	112.5	M339 W346 G347 A746 P747 L750	M339-F343 HydrophobicContact CB-CD2 4.46Å; M339-F343 WeakPolarHBondContact O-CD2 3.39Å; M339-F343 PolarHBondContact O-N 3.04Å; F343-W346 PolarHBondContact O-N 3.38Å; F343-G347 PolarHBondContact O-N 3.49Å; F343-A746 HydrophobicContact CB-CB 4.05Å; F343-A746 HydrophobicContact CD1-CB 3.7Å; F343-A746 HydrophobicContact CD2-CB 3.93Å; F343-A746 HydrophobicContact CE1-CB 4.09Å; F343-A746 HydrophobicContact CE2-CB 4.29Å; F343-A746 HydrophobicContact CG-CB 3.63Å; F343-A746 HydrophobicContact CZ-CB 4.36Å; F343-P747 HydrophobicContact CD2-CG 4.1Å; F343-P747 HydrophobicContact CE2-CG 4.42Å; F343-L750 HydrophobicContact CE2-CD2 4.25Å; F343-L750 HydrophobicContact CZ-CB 4.39Å; F343-L750 HydrophobicContact CZ-CD2 4.02Å
344	Q	93.1	Very high	88.8	Confident	70 Å²	70	63.3 Å²	63.3	33%	0.327	32%	0.316	S	S	.	.	H	α-helix	trans	-62.9	-49.1	173	-176.5	177.2	11.4	0	0	111.8	S340 Q342 W346 G347 T348 G739	S340-Q344 VanDerWaalsContact O-CB 3.28Å; S340-Q344 WeakPolarHBondContact O-CB 3.46Å; S340-Q344 PolarHBondContact O-N 2.81Å; Q342-Q344 VanDerWaalsContact C-N 3.26Å; Q342-Q344 PolarHBondContact O-N 2.94Å; Q344-W346 VanDerWaalsContact C-N 3.31Å; Q344-W346 PolarHBondContact O-N 3.15Å; Q344-G347 PolarHBondContact O-N 3.5Å; Q344-T348 WeakPolarHBondContact O-CG2 3.25Å; Q344-T348 PolarHBondContact O-N 3.03Å; Q344-T348 PolarHBondContact O-OG1 3.46Å; Q344-G739 VanDerWaalsContact CA-O 3.3Å; Q344-G739 WeakPolarHBondContact CA-O 3.28Å
345	R	93.5	Very high	89.5	Confident	136 Å²	136	67.1 Å²	67.1	51%	0.513	32%	0.322	S	S	.	.	H	α-helix	trans	-62.5	-38.6	176.2	-74.3	176.2	173	173	-5.1	112.5	R341 Q342 T348 L349	R341-R345 WeakPolarHBondContact O-CG 3.08Å; R341-R345 PolarHBondContact O-N 2.85Å; R341-R345 VanDerWaalsContact O-N 3.12Å; Q342-R345 PolarHBondContact O-N 3.4Å; R345-T348 PolarHBondContact O-OG1 3.22Å; R345-L349 WeakPolarHBondContact O-CB 3.28Å; R345-L349 PolarHBondContact O-N 3.28Å; R345-L349 VanDerWaalsContact O-N 3.12Å
346	W	93.3	Very high	90.3	Very high	115 Å²	115	69.3 Å²	69.3	44%	0.436	33%	0.331	S	S	.	.	H	α-helix	trans	-65.1	-48	177.1	-172.7	-98.1	0	0	0	111.2	Q342 F343 Q344 T348 L349 M350 M791 T792	Q342-W346 WeakPolarHBondContact O-CB 3.28Å; Q342-W346 PolarHBondContact O-N 2.78Å; F343-W346 PolarHBondContact O-N 3.38Å; Q344-W346 VanDerWaalsContact C-N 3.31Å; Q344-W346 PolarHBondContact O-N 3.15Å; W346-T348 PolarHBondContact O-N 2.71Å; W346-L349 WeakPolarHBondContact O-CB 3.34Å; W346-L349 PolarHBondContact O-N 3.29Å; W346-M350 HydrophobicContact CD2-CE 3.95Å; W346-M350 HydrophobicContact CE3-CE 4.13Å; W346-M350 HydrophobicContact CH2-CE 3.55Å; W346-M350 HydrophobicContact CZ2-CE 3.31Å; W346-M350 HydrophobicContact CZ2-SD 4.29Å; W346-M350 HydrophobicContact CZ3-CE 3.95Å; W346-M350 VanDerWaalsContact O-CG 3.31Å; W346-M350 WeakPolarHBondContact O-CG 3.27Å; W346-M350 PolarHBondContact O-N 3.33Å; W346-M791 PolarHBondContact NE1-O 2.83Å; W346-T792 HydrophobicContact CZ2-CG2 4.06Å
347	G	92.4	Very high	91	Very high	0 Å²	0	69.1 Å²	69.1	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-62.1	-41.8	178.8	0	0	0	0	0	113.1	F343 Q344 L349 M350 A351 L742	F343-G347 PolarHBondContact O-N 3.49Å; Q344-G347 PolarHBondContact O-N 3.5Å; G347-L349 VanDerWaalsContact C-N 3.35Å; G347-M350 PolarHBondContact O-N 3.42Å; G347-A351 VanDerWaalsContact O-CB 3.24Å; G347-A351 WeakPolarHBondContact O-CB 3.44Å; G347-A351 PolarHBondContact O-N 3.11Å; G347-L742 VanDerWaalsContact CA-CD2 3.47Å
348	T	92.4	Very high	91.6	Very high	36 Å²	36	68.7 Å²	68.7	22%	0.221	32%	0.321	C	S	.	.	H	α-helix	trans	-64.6	-40.2	175.4	56.8	0	0	0	0	111.7	Q344 R345 W346 A351 S352 E736	Q344-T348 WeakPolarHBondContact O-CG2 3.25Å; Q344-T348 PolarHBondContact O-N 3.03Å; Q344-T348 PolarHBondContact O-OG1 3.46Å; R345-T348 PolarHBondContact O-OG1 3.22Å; W346-T348 PolarHBondContact O-N 2.71Å; T348-A351 PolarHBondContact O-N 3.19Å; T348-S352 WeakPolarHBondContact O-CB 3.3Å; T348-S352 PolarHBondContact O-N 3.21Å; T348-S352 PolarHBondContact O-OG 3.2Å; T348-E736 HydrophobicContact CG2-CG 4.4Å
349	L	93.4	Very high	91.9	Very high	86 Å²	86	67.8 Å²	67.8	45%	0.45	32%	0.321	S	S	.	.	H	α-helix	trans	-62.6	-49.4	177	-176	70.9	0	0	0	111.6	R345 W346 G347 A351 S352 Y353	R345-L349 WeakPolarHBondContact O-CB 3.28Å; R345-L349 PolarHBondContact O-N 3.28Å; R345-L349 VanDerWaalsContact O-N 3.12Å; W346-L349 WeakPolarHBondContact O-CB 3.34Å; W346-L349 PolarHBondContact O-N 3.29Å; G347-L349 VanDerWaalsContact C-N 3.35Å; L349-A351 VanDerWaalsContact C-N 3.33Å; L349-A351 PolarHBondContact O-N 3.21Å; L349-S352 PolarHBondContact O-N 2.86Å; L349-Y353 HydrophobicContact CD1-CD2 4.41Å; L349-Y353 HydrophobicContact CD1-CE2 4.44Å; L349-Y353 PolarHBondContact O-N 2.83Å
350	M	92.8	Very high	92.3	Very high	18 Å²	18	70.2 Å²	70.2	9%	0.089	34%	0.338	C	S	.	.	H	α-helix	trans	-64.8	-37	-179.8	-63.2	-63	138.8	0	0	111.9	W346 G347 S352 V357 T792 V795	W346-M350 HydrophobicContact CD2-CE 3.95Å; W346-M350 HydrophobicContact CE3-CE 4.13Å; W346-M350 HydrophobicContact CH2-CE 3.55Å; W346-M350 HydrophobicContact CZ2-CE 3.31Å; W346-M350 HydrophobicContact CZ2-SD 4.29Å; W346-M350 HydrophobicContact CZ3-CE 3.95Å; W346-M350 VanDerWaalsContact O-CG 3.31Å; W346-M350 WeakPolarHBondContact O-CG 3.27Å; W346-M350 PolarHBondContact O-N 3.33Å; G347-M350 PolarHBondContact O-N 3.42Å; M350-S352 VanDerWaalsContact C-N 3.33Å; M350-V357 HydrophobicContact SD-CB 4.46Å; M350-V357 HydrophobicContact SD-CG1 3.87Å; M350-V357 HydrophobicContact SD-CG2 3.66Å; M350-T792 HydrophobicContact SD-CG2 4.19Å; M350-V795 HydrophobicContact CB-CG1 4.16Å
351	A	90.9	Very high	92.6	Very high	3 Å²	3	69.1 Å²	69.1	3%	0.025	33%	0.33	C	S	.	.	H	α-helix	trans	-72	-24.1	176	0	0	0	0	0	113.6	G347 T348 L349 E735 I738	G347-A351 VanDerWaalsContact O-CB 3.24Å; G347-A351 WeakPolarHBondContact O-CB 3.44Å; G347-A351 PolarHBondContact O-N 3.11Å; T348-A351 PolarHBondContact O-N 3.19Å; L349-A351 VanDerWaalsContact C-N 3.33Å; L349-A351 PolarHBondContact O-N 3.21Å; A351-E735 HydrophobicContact CB-CB 4.11Å; A351-E735 HydrophobicContact CB-CG 4.04Å; A351-I738 HydrophobicContact CB-CG2 4.42Å
352	S	92.6	Very high	92.7	Very high	61 Å²	61	64.5 Å²	64.5	43%	0.427	33%	0.325	S	S	.	.	H	α-helix	trans	-75.7	-33.8	179.8	-59.7	0	0	0	0	112.7	T348 L349 M350 P354	T348-S352 WeakPolarHBondContact O-CB 3.3Å; T348-S352 PolarHBondContact O-N 3.21Å; T348-S352 PolarHBondContact O-OG 3.2Å; L349-S352 PolarHBondContact O-N 2.86Å; M350-S352 VanDerWaalsContact C-N 3.33Å; S352-P354 WeakPolarHBondContact O-CD 3.24Å
353	Y	93.3	Very high	92.8	Very high	150 Å²	150	65.3 Å²	65.3	59%	0.588	33%	0.33	S	S	*	.	S	Bend	trans	-123.3	53.9	-174.7	-61.5	-78.1	0	0	0	114.2	L349 F355 T356 V357	L349-Y353 HydrophobicContact CD1-CD2 4.41Å; L349-Y353 HydrophobicContact CD1-CE2 4.44Å; L349-Y353 PolarHBondContact O-N 2.83Å; Y353-F355 PolarHBondContact O-N 3.11Å; Y353-T356 WeakPolarHBondContact CB-OG1 3.4Å; Y353-T356 PolarHBondContact O-N 2.9Å; Y353-T356 PolarHBondContact O-OG1 3.43Å; Y353-V357 WeakPolarHBondContact O-CG2 3.46Å; Y353-V357 PolarHBondContact O-N 3.05Å
354	P	92.4	Very high	92.8	Very high	13 Å²	13	67.7 Å²	67.7	8%	0.084	34%	0.344	C	S	.	.	H	α-helix	trans	-63.1	-38.7	-165.7	24.2	-34.6	0	0	0	114.6	S352 V357 L358 A796 L800	S352-P354 WeakPolarHBondContact O-CD 3.24Å; P354-V357 PolarHBondContact O-N 2.81Å; P354-L358 WeakPolarHBondContact O-CG 3.34Å; P354-L358 PolarHBondContact O-N 3.46Å; P354-A796 HydrophobicContact CB-CB 3.88Å; P354-L800 HydrophobicContact CB-CD1 4.21Å; P354-L800 HydrophobicContact CB-CD2 4.09Å; P354-L800 HydrophobicContact CB-CG 3.89Å; P354-L800 HydrophobicContact CG-CD2 3.73Å; P354-L800 HydrophobicContact CG-CG 4.1Å
355	F	91.5	Very high	92.9	Very high	142 Å²	142	65.1 Å²	65.1	62%	0.623	33%	0.333	S	S	*	.	H	α-helix	trans	-67.1	-39.6	-179.6	-69.1	-71.4	0	0	0	112.9	Y353 L359 L800	Y353-F355 PolarHBondContact O-N 3.11Å; F355-L359 WeakPolarHBondContact O-CB 3.33Å; F355-L359 PolarHBondContact O-N 2.93Å; F355-L359 VanDerWaalsContact O-N 3.09Å; F355-L800 HydrophobicContact CE1-CD1 4.37Å; F355-L800 HydrophobicContact CE2-CD2 4.07Å; F355-L800 HydrophobicContact CZ-CD2 4.01Å
356	T	92.3	Very high	92.8	Very high	82 Å²	82	63 Å²	63	50%	0.503	33%	0.334	S	S	.	.	H	α-helix	trans	-67.9	-40.3	178.4	62.4	0	0	0	0	111.4	Y353 L359 V360	Y353-T356 WeakPolarHBondContact CB-OG1 3.4Å; Y353-T356 PolarHBondContact O-N 2.9Å; Y353-T356 PolarHBondContact O-OG1 3.43Å; T356-L359 PolarHBondContact O-N 3.32Å; T356-V360 WeakPolarHBondContact O-CG2 3.21Å; T356-V360 PolarHBondContact O-N 3.43Å
357	V	93.6	Very high	92.8	Very high	22 Å²	22	61.9 Å²	61.9	13%	0.133	34%	0.34	C	S	.	.	H	α-helix	trans	-64.7	-45.3	178	175	0	0	0	0	110.8	M350 Y353 P354 L359 V360 A361 A796	M350-V357 HydrophobicContact SD-CB 4.46Å; M350-V357 HydrophobicContact SD-CG1 3.87Å; M350-V357 HydrophobicContact SD-CG2 3.66Å; Y353-V357 WeakPolarHBondContact O-CG2 3.46Å; Y353-V357 PolarHBondContact O-N 3.05Å; P354-V357 PolarHBondContact O-N 2.81Å; V357-L359 VanDerWaalsContact C-N 3.32Å; V357-L359 PolarHBondContact O-N 3.4Å; V357-V360 PolarHBondContact O-N 2.73Å; V357-A361 WeakPolarHBondContact O-CB 3.04Å; V357-A361 PolarHBondContact O-N 2.59Å; V357-A796 HydrophobicContact CB-CB 4.3Å; V357-A796 HydrophobicContact CG1-CB 4.22Å
358	L	92.3	Very high	92.8	Very high	53 Å²	53	64.3 Å²	64.3	28%	0.277	35%	0.351	S	S	.	.	H	α-helix	trans	-61.3	-40	176.5	-73.7	170.9	0	0	0	112.1	P354 A362 A793 A796 L800	P354-L358 WeakPolarHBondContact O-CG 3.34Å; P354-L358 PolarHBondContact O-N 3.46Å; L358-A362 VanDerWaalsContact O-CB 3.31Å; L358-A362 WeakPolarHBondContact O-CB 3.47Å; L358-A362 PolarHBondContact O-N 3.47Å; L358-A793 HydrophobicContact CD2-CB 4.04Å; L358-A796 HydrophobicContact CG-CB 4.2Å; L358-L800 HydrophobicContact CD1-CD1 3.94Å
359	L	93.6	Very high	92.8	Very high	111 Å²	111	63.8 Å²	63.8	58%	0.581	35%	0.349	S	S	*	.	H	α-helix	trans	-66.2	-44.5	177	-176.4	135	0	0	0	112	F355 T356 V357 A362 I363	F355-L359 WeakPolarHBondContact O-CB 3.33Å; F355-L359 PolarHBondContact O-N 2.93Å; F355-L359 VanDerWaalsContact O-N 3.09Å; T356-L359 PolarHBondContact O-N 3.32Å; V357-L359 VanDerWaalsContact C-N 3.32Å; V357-L359 PolarHBondContact O-N 3.4Å; L359-A362 PolarHBondContact O-N 3.33Å; L359-I363 HydrophobicContact CD2-CD1 3.63Å; L359-I363 HydrophobicContact CG-CD1 4.26Å; L359-I363 VanDerWaalsContact O-CG1 3.3Å; L359-I363 WeakPolarHBondContact O-CG1 3.38Å; L359-I363 PolarHBondContact O-N 2.85Å
360	V	93.5	Very high	92.8	Very high	80 Å²	80	64 Å²	64	49%	0.485	35%	0.353	S	S	.	.	H	α-helix	trans	-63.6	-45.2	176.4	171.6	0	0	0	0	111.2	T356 V357 A362 I363 I364	T356-V360 WeakPolarHBondContact O-CG2 3.21Å; T356-V360 PolarHBondContact O-N 3.43Å; V357-V360 PolarHBondContact O-N 2.73Å; V360-A362 VanDerWaalsContact C-N 3.34Å; V360-A362 PolarHBondContact O-N 3.3Å; V360-I363 PolarHBondContact O-N 2.97Å; V360-I364 HydrophobicContact CG1-CD1 3.93Å; V360-I364 WeakPolarHBondContact O-CG1 3.16Å; V360-I364 PolarHBondContact O-N 3.4Å
361	A	93	Very high	92.6	Very high	12 Å²	12	63.5 Å²	63.5	10%	0.099	35%	0.354	C	S	.	.	H	α-helix	trans	-60.4	-44	177.1	0	0	0	0	0	111.5	V357 I363 I364 V365 L789 A793	V357-A361 WeakPolarHBondContact O-CB 3.04Å; V357-A361 PolarHBondContact O-N 2.59Å; A361-I363 PolarHBondContact O-N 2.84Å; A361-I364 PolarHBondContact O-N 3Å; A361-V365 VanDerWaalsContact O-CG2 3.32Å; A361-V365 WeakPolarHBondContact O-CG2 3.26Å; A361-V365 PolarHBondContact O-N 3Å; A361-L789 HydrophobicContact CB-CD2 4.15Å; A361-A793 HydrophobicContact CB-CB 4.06Å
362	A	92.4	Very high	92.6	Very high	54 Å²	54	65.8 Å²	65.8	45%	0.446	37%	0.365	S	S	.	.	H	α-helix	trans	-61.3	-42.2	176.3	0	0	0	0	0	112.3	L358 L359 V360 V365 V366	L358-A362 VanDerWaalsContact O-CB 3.31Å; L358-A362 WeakPolarHBondContact O-CB 3.47Å; L358-A362 PolarHBondContact O-N 3.47Å; L359-A362 PolarHBondContact O-N 3.33Å; V360-A362 VanDerWaalsContact C-N 3.34Å; V360-A362 PolarHBondContact O-N 3.3Å; A362-V365 PolarHBondContact O-N 3.12Å; A362-V366 WeakPolarHBondContact O-CB 3.28Å; A362-V366 VanDerWaalsContact O-CG2 3.27Å; A362-V366 WeakPolarHBondContact O-CG2 3.36Å; A362-V366 PolarHBondContact O-N 3.09Å
363	I	94.3	Very high	92.4	Very high	95 Å²	95	72 Å²	72	49%	0.487	38%	0.384	S	S	.	.	H	α-helix	trans	-60.9	-46.9	176.4	-70	166.2	0	0	0	110.8	L359 V360 A361 V365 V366 V367	L359-I363 HydrophobicContact CD2-CD1 3.63Å; L359-I363 HydrophobicContact CG-CD1 4.26Å; L359-I363 VanDerWaalsContact O-CG1 3.3Å; L359-I363 WeakPolarHBondContact O-CG1 3.38Å; L359-I363 PolarHBondContact O-N 2.85Å; V360-I363 PolarHBondContact O-N 2.97Å; A361-I363 PolarHBondContact O-N 2.84Å; I363-V365 VanDerWaalsContact C-N 3.34Å; I363-V365 PolarHBondContact O-N 3.36Å; I363-V366 PolarHBondContact O-N 2.94Å; I363-V367 HydrophobicContact CG2-CG2 4.36Å; I363-V367 VanDerWaalsContact O-CG2 3.3Å; I363-V367 WeakPolarHBondContact O-CG2 3.18Å; I363-V367 PolarHBondContact O-N 3.31Å
364	I	92.7	Very high	92.2	Very high	82 Å²	82	68.6 Å²	68.6	42%	0.421	38%	0.383	S	S	.	.	H	α-helix	trans	-60.2	-45.8	179.5	-68.2	168.8	0	0	0	110.8	V360 A361 V366 V367 F368	V360-I364 HydrophobicContact CG1-CD1 3.93Å; V360-I364 WeakPolarHBondContact O-CG1 3.16Å; V360-I364 PolarHBondContact O-N 3.4Å; A361-I364 PolarHBondContact O-N 3Å; I364-V366 PolarHBondContact O-N 3.38Å; I364-V367 PolarHBondContact O-N 3.04Å; I364-F368 HydrophobicContact CG2-CD2 3.76Å; I364-F368 HydrophobicContact CG2-CE2 3.58Å; I364-F368 VanDerWaalsContact O-CD2 3.29Å; I364-F368 WeakPolarHBondContact O-CD2 3.47Å; I364-F368 PolarHBondContact O-N 3.35Å; I364-F368 VanDerWaalsContact O-N 3.1Å
365	V	94.1	Very high	92	Very high	16 Å²	16	71 Å²	71	10%	0.097	39%	0.394	C	S	.	.	H	α-helix	trans	-61.6	-44.4	178.1	171.7	0	0	0	0	111.1	A361 A362 I363 F368 S369 C680 L789	A361-V365 VanDerWaalsContact O-CG2 3.32Å; A361-V365 WeakPolarHBondContact O-CG2 3.26Å; A361-V365 PolarHBondContact O-N 3Å; A362-V365 PolarHBondContact O-N 3.12Å; I363-V365 VanDerWaalsContact C-N 3.34Å; I363-V365 PolarHBondContact O-N 3.36Å; V365-F368 PolarHBondContact O-N 3.33Å; V365-S369 VanDerWaalsContact O-CB 3.23Å; V365-S369 WeakPolarHBondContact O-CB 3.29Å; V365-S369 PolarHBondContact O-N 3.21Å; V365-S369 PolarHBondContact O-OG 2.97Å; V365-C680 HydrophobicContact CB-CB 4.49Å; V365-C680 HydrophobicContact CG1-CB 3.76Å; V365-C680 HydrophobicContact CG2-CB 3.91Å; V365-L789 HydrophobicContact CG2-CD1 4.03Å; V365-L789 HydrophobicContact CG2-CD2 4.08Å
366	V	92.9	Very high	91.8	Very high	91 Å²	91	72 Å²	72	55%	0.552	40%	0.398	S	S	*	.	H	α-helix	trans	-62.2	-45.2	178.1	169.8	0	0	0	0	110.9	A362 I363 I364 F368 S369 V370	A362-V366 WeakPolarHBondContact O-CB 3.28Å; A362-V366 VanDerWaalsContact O-CG2 3.27Å; A362-V366 WeakPolarHBondContact O-CG2 3.36Å; A362-V366 PolarHBondContact O-N 3.09Å; I363-V366 PolarHBondContact O-N 2.94Å; I364-V366 PolarHBondContact O-N 3.38Å; V366-F368 PolarHBondContact O-N 3.05Å; V366-S369 PolarHBondContact O-N 3.13Å; V366-V370 WeakPolarHBondContact O-CG2 3.47Å; V366-V370 PolarHBondContact O-N 3.24Å
367	V	93.1	Very high	91.5	Very high	92 Å²	92	72.2 Å²	72.2	56%	0.558	40%	0.396	S	S	*	.	H	α-helix	trans	-57.4	-47.5	178.6	168.6	0	0	0	0	111.3	I363 I364	I363-V367 HydrophobicContact CG2-CG2 4.36Å; I363-V367 VanDerWaalsContact O-CG2 3.3Å; I363-V367 WeakPolarHBondContact O-CG2 3.18Å; I363-V367 PolarHBondContact O-N 3.31Å; I364-V367 PolarHBondContact O-N 3.04Å
368	F	92.8	Very high	91.1	Very high	51 Å²	51	73.1 Å²	73.1	22%	0.224	40%	0.401	C	S	.	.	H	α-helix	trans	-68.6	-38	177	-72.9	-56.1	0	0	0	112.6	I364 V365 V366 V370 G371 A684 G687 F688 M785	I364-F368 HydrophobicContact CG2-CD2 3.76Å; I364-F368 HydrophobicContact CG2-CE2 3.58Å; I364-F368 VanDerWaalsContact O-CD2 3.29Å; I364-F368 WeakPolarHBondContact O-CD2 3.47Å; I364-F368 PolarHBondContact O-N 3.35Å; I364-F368 VanDerWaalsContact O-N 3.1Å; V365-F368 PolarHBondContact O-N 3.33Å; V366-F368 PolarHBondContact O-N 3.05Å; F368-V370 VanDerWaalsContact C-N 3.29Å; F368-V370 PolarHBondContact O-N 3.49Å; F368-G371 PolarHBondContact O-N 2.89Å; F368-A684 HydrophobicContact CB-CB 3.87Å; F368-A684 HydrophobicContact CD2-CB 4.42Å; F368-A684 HydrophobicContact CG-CB 4.5Å; F368-G687 CarbonylContact O-C 3.3Å; F368-G687 VanDerWaalsContact O-C 3.3Å; F368-G687 VanDerWaalsContact O-CA 3.24Å; F368-G687 WeakPolarHBondContact O-CA 3.42Å; F368-F688 HydrophobicContact CD1-CB 4.21Å; F368-F688 AromaticContact CD1-CD2 3.95Å; F368-F688 HydrophobicContact CD1-CD2 3.95Å; F368-F688 AromaticContact CE1-CD2 3.77Å; F368-F688 HydrophobicContact CE1-CD2 3.77Å; F368-F688 HydrophobicContact CE1-CE2 4.39Å; F368-M785 HydrophobicContact CD2-CE 4.16Å; F368-M785 HydrophobicContact CE2-CE 3.6Å; F368-M785 HydrophobicContact CZ-CE 3.94Å
369	S	92	Very high	90.5	Very high	26 Å²	26	73.2 Å²	73.2	18%	0.182	40%	0.404	C	S	.	.	H	α-helix	trans	-68.5	-23	-178.2	-59	0	0	0	0	113.6	V365 V366 G371 L372	V365-S369 VanDerWaalsContact O-CB 3.23Å; V365-S369 WeakPolarHBondContact O-CB 3.29Å; V365-S369 PolarHBondContact O-N 3.21Å; V365-S369 PolarHBondContact O-OG 2.97Å; V366-S369 PolarHBondContact O-N 3.13Å; S369-G371 PolarHBondContact O-N 2.94Å; S369-G371 VanDerWaalsContact O-N 3.13Å; S369-L372 VanDerWaalsContact O-CB 3.3Å; S369-L372 WeakPolarHBondContact O-CB 3.42Å; S369-L372 WeakPolarHBondContact O-CG 3.34Å; S369-L372 PolarHBondContact O-N 2.92Å
370	V	92.9	Very high	89.9	Confident	89 Å²	89	69.3 Å²	69.3	54%	0.539	38%	0.384	S	S	.	.	G	3₁₀ helix	trans	-56.5	-29.3	175.1	167.6	0	0	0	0	111.9	V366 F368 L372 K373	V366-V370 WeakPolarHBondContact O-CG2 3.47Å; V366-V370 PolarHBondContact O-N 3.24Å; F368-V370 VanDerWaalsContact C-N 3.29Å; F368-V370 PolarHBondContact O-N 3.49Å; V370-L372 PolarHBondContact O-N 3.35Å; V370-L372 VanDerWaalsContact O-N 3.14Å; V370-K373 PolarHBondContact O-N 3.44Å
371	G	89.4	Confident	89.4	Confident	9 Å²	9	66.8 Å²	66.8	9%	0.093	37%	0.369	C	S	.	.	G	3₁₀ helix	trans	-59.7	-22.5	177.4	0	0	0	0	0	114.4	F368 S369 K373 S374 G687 S690	F368-G371 PolarHBondContact O-N 2.89Å; S369-G371 PolarHBondContact O-N 2.94Å; S369-G371 VanDerWaalsContact O-N 3.13Å; G371-K373 PolarHBondContact O-N 3.43Å; G371-K373 VanDerWaalsContact O-N 3.07Å; G371-S374 PolarHBondContact O-N 3.02Å; G371-G687 WeakPolarHBondContact CA-O 3.3Å; G371-S690 WeakPolarHBondContact O-CB 3.39Å; G371-S690 PolarHBondContact O-OG 2.88Å
372	L	89.7	Confident	89	Confident	50 Å²	50	67.1 Å²	67.1	26%	0.262	37%	0.37	S	S	.	.	G	3₁₀ helix	trans	-58.8	-22.1	178	-69	169.2	0	0	0	113.5	S369 V370 S374 I375 L683 M686	S369-L372 VanDerWaalsContact O-CB 3.3Å; S369-L372 WeakPolarHBondContact O-CB 3.42Å; S369-L372 WeakPolarHBondContact O-CG 3.34Å; S369-L372 PolarHBondContact O-N 2.92Å; V370-L372 PolarHBondContact O-N 3.35Å; V370-L372 VanDerWaalsContact O-N 3.14Å; L372-S374 PolarHBondContact O-N 3.38Å; L372-I375 WeakPolarHBondContact O-CB 3.36Å; L372-I375 VanDerWaalsContact O-CG2 3.23Å; L372-I375 WeakPolarHBondContact O-CG2 3.39Å; L372-I375 PolarHBondContact O-N 3.32Å; L372-L683 HydrophobicContact CD1-CD2 3.97Å; L372-M686 HydrophobicContact CD2-CB 3.79Å
373	K	89.6	Confident	88.6	Confident	192 Å²	192	68.5 Å²	68.5	84%	0.835	37%	0.367	S	S	*	.	G	3₁₀ helix	trans	-61.8	-23.5	174.7	-72.4	-175.3	177.5	-178.5	0	113.5	V370 G371	V370-K373 PolarHBondContact O-N 3.44Å; G371-K373 PolarHBondContact O-N 3.43Å; G371-K373 VanDerWaalsContact O-N 3.07Å
374	S	88.6	Confident	88.1	Confident	79 Å²	79	65.4 Å²	65.4	55%	0.552	35%	0.351	S	S	*	.	G	3₁₀ helix	trans	-100.3	16.3	-179.2	-53.9	0	0	0	0	112.7	G371 L372 K376 S690	G371-S374 PolarHBondContact O-N 3.02Å; L372-S374 PolarHBondContact O-N 3.38Å; S374-K376 PolarHBondContact O-N 2.97Å; S374-S690 VanDerWaalsContact C-OG 3.23Å; S374-S690 PolarHBondContact O-OG 3.3Å
375	I	87.5	Confident	87.6	Confident	64 Å²	64	64.5 Å²	64.5	33%	0.328	34%	0.343	S	S	.	.			trans	-65.1	127	-175.4	-165.4	169.4	0	0	0	110.7	L372 L377 S690	L372-I375 WeakPolarHBondContact O-CB 3.36Å; L372-I375 VanDerWaalsContact O-CG2 3.23Å; L372-I375 WeakPolarHBondContact O-CG2 3.39Å; L372-I375 PolarHBondContact O-N 3.32Å; I375-L377 HydrophobicContact CD1-CD2 4.35Å; I375-L377 HydrophobicContact CG1-CD2 4.48Å; I375-S690 VanDerWaalsContact CA-OG 3.22Å; I375-S690 WeakPolarHBondContact CA-OG 3.39Å; I375-S690 PolarHBondContact N-OG 3.04Å; I375-S690 VanDerWaalsContact N-OG 3.11Å
376	K	87.9	Confident	87.3	Confident	162 Å²	162	63.9 Å²	63.9	70%	0.704	34%	0.339	S	S	*	.			trans	-111.9	124.3	171.9	-68.1	-176.6	-179.8	-179.5	0	108.6	S374 S696	S374-K376 PolarHBondContact O-N 2.97Å; K376-S696 PolarHBondContact O-N 3.47Å
377	L	85.5	Confident	87	Confident	87 Å²	87	60.5 Å²	60.5	46%	0.455	32%	0.32	S	S	.	.	B	Isolated β-bridge	trans	-98.4	123.1	176.9	-64.6	173.3	0	0	0	109.6	I375 S696 L701	I375-L377 HydrophobicContact CD1-CD2 4.35Å; I375-L377 HydrophobicContact CG1-CD2 4.48Å; L377-S696 WeakPolarHBondContact CA-O 3.14Å; L377-L701 HydrophobicContact CD2-CD1 3.94Å
378	T	84.4	Confident	86.7	Confident	41 Å²	41	59.5 Å²	59.5	25%	0.252	32%	0.316	S	S	.	.			trans	-90.1	116	171.9	48.9	0	0	0	0	109.6	L384 P695 S696	T378-L384 WeakPolarHBondContact OG1-CD2 3.44Å; T378-P695 HydrophobicContact CG2-CB 3.61Å; T378-P695 HydrophobicContact CG2-CG 4.14Å; T378-S696 PolarHBondContact N-O 3.44Å; T378-S696 PolarHBondContact OG1-O 2.83Å
379	T	81.3	Confident	86.6	Confident	54 Å²	54	63.7 Å²	63.7	33%	0.331	34%	0.341	S	S	.	.			trans	-100.6	-19.4	174.5	58.5	0	0	0	0	112.9	P381 E624	T379-P381 WeakPolarHBondContact O-CD 3.35Å; T379-E624 WeakPolarHBondContact CB-OE1 3.38Å; T379-E624 PolarHBondContact OG1-OE1 3.36Å
380	D	80.9	Confident	86.5	Confident	30 Å²	30	63.4 Å²	63.4	16%	0.16	34%	0.338	C	S	.	.			trans	-64.6	118.8	-178.7	-167.7	-35.4	0	0	0	110.4	V382 E383 L384 R583	D380-V382 PolarHBondContact O-N 3.2Å; D380-V382 WeakPolarHBondContact OD1-CB 3.3Å; D380-V382 WeakPolarHBondContact OD1-CG2 3.44Å; D380-V382 PolarHBondContact OD1-N 3.32Å; D380-E383 HydrophobicContact CB-CB 4.23Å; D380-E383 HydrophobicContact CB-CG 4.11Å; D380-E383 PolarHBondContact O-N 3.28Å; D380-L384 WeakPolarHBondContact O-CG 3.49Å; D380-L384 PolarHBondContact O-N 3.35Å; D380-R583 IonicContact OD1-NH2 2.97Å; D380-R583 IonicContact OD2-CZ 2.94Å; D380-R583 VanDerWaalsContact OD2-CZ 3.24Å; D380-R583 IonicContact OD2-NE 3.96Å; D380-R583 PolarHBondContact OD2-NE 3.39Å; D380-R583 IonicContact OD2-NH2 2.75Å; D380-R583 PolarHBondContact OD2-NH2 2.88Å
381	P	82.1	Confident	86.6	Confident	27 Å²	27	64.4 Å²	64.4	18%	0.175	33%	0.333	C	S	.	.	H	α-helix	trans	-63.6	-28.9	180	27	-35.3	0	0	0	112.1	T379 L384 W385 F1106	T379-P381 WeakPolarHBondContact O-CD 3.35Å; P381-L384 PolarHBondContact O-N 2.93Å; P381-W385 WeakPolarHBondContact O-CB 3.38Å; P381-W385 PolarHBondContact O-N 3.09Å; P381-F1106 HydrophobicContact CB-CE1 4.04Å; P381-F1106 HydrophobicContact CG-CE1 4.36Å; P381-F1106 HydrophobicContact CG-CZ 4.4Å
382	V	84.4	Confident	86.8	Confident	19 Å²	19	64.1 Å²	64.1	12%	0.115	33%	0.329	C	S	.	.	H	α-helix	trans	-69.5	-41.7	-179.8	-163.7	0	0	0	0	110.6	D380 L384 S386 V1105 F1106	D380-V382 PolarHBondContact O-N 3.2Å; D380-V382 WeakPolarHBondContact OD1-CB 3.3Å; D380-V382 WeakPolarHBondContact OD1-CG2 3.44Å; D380-V382 PolarHBondContact OD1-N 3.32Å; V382-L384 VanDerWaalsContact C-N 3.31Å; V382-L384 PolarHBondContact O-N 3.31Å; V382-S386 WeakPolarHBondContact CG1-OG 3.47Å; V382-S386 VanDerWaalsContact O-CB 3.3Å; V382-S386 WeakPolarHBondContact O-CB 3.37Å; V382-S386 PolarHBondContact O-N 3.31Å; V382-S386 PolarHBondContact O-OG 2.88Å; V382-V1105 HydrophobicContact CG1-CB 4.14Å; V382-V1105 HydrophobicContact CG1-CG2 3.86Å; V382-F1106 HydrophobicContact CB-CE1 4.45Å; V382-F1106 HydrophobicContact CG2-CE1 3.9Å; V382-F1106 HydrophobicContact CG2-CE2 4.42Å; V382-F1106 HydrophobicContact CG2-CZ 3.54Å
383	E	84.9	Confident	86.9	Confident	82 Å²	82	63 Å²	63	38%	0.383	32%	0.321	S	S	.	.	H	α-helix	trans	-68.4	-30.2	176.6	-68.5	-66.9	165.7	0	0	112.7	D380 R393	D380-E383 HydrophobicContact CB-CB 4.23Å; D380-E383 HydrophobicContact CB-CG 4.11Å; D380-E383 PolarHBondContact O-N 3.28Å; E383-R393 IonicContact OE1-CZ 2.68Å; E383-R393 IonicContact OE1-NH2 3.53Å; E383-R393 PolarHBondContact OE1-NH2 3.16Å
384	L	82.6	Confident	87.1	Confident	30 Å²	30	58.9 Å²	58.9	16%	0.157	31%	0.305	C	S	.	.	H	α-helix	trans	-75.4	-44	179	-73.7	167.2	0	0	0	112.5	T378 D380 P381 V382 A771	T378-L384 WeakPolarHBondContact OG1-CD2 3.44Å; D380-L384 WeakPolarHBondContact O-CG 3.49Å; D380-L384 PolarHBondContact O-N 3.35Å; P381-L384 PolarHBondContact O-N 2.93Å; V382-L384 VanDerWaalsContact C-N 3.31Å; V382-L384 PolarHBondContact O-N 3.31Å; L384-A771 WeakPolarHBondContact O-CB 3.46Å; L384-A771 PolarHBondContact O-N 3.4Å
385	W	83.1	Confident	87.3	Confident	64 Å²	64	55.4 Å²	55.4	24%	0.242	28%	0.28	C	S	.	.	H	α-helix	trans	-105.2	-15.9	-167.2	-61.1	113	0	0	0	114.7	P381 A771 A1170 V1171	P381-W385 WeakPolarHBondContact O-CB 3.38Å; P381-W385 PolarHBondContact O-N 3.09Å; W385-A771 HydrophobicContact CZ3-CB 4.43Å; W385-A1170 HydrophobicContact CE3-CB 4.28Å; W385-A1170 HydrophobicContact CZ3-CB 3.85Å; W385-V1171 HydrophobicContact CH2-CG2 3.62Å; W385-V1171 HydrophobicContact CZ3-CG2 4.21Å
386	S	87.2	Confident	87.6	Confident	3 Å²	3	54.1 Å²	54.1	2%	0.021	27%	0.272	C	S	.	.	S	Bend	trans	-107.7	133.7	176.1	78.8	0	0	0	0	110.8	V382 P770 V1105	V382-S386 WeakPolarHBondContact CG1-OG 3.47Å; V382-S386 VanDerWaalsContact O-CB 3.3Å; V382-S386 WeakPolarHBondContact O-CB 3.37Å; V382-S386 PolarHBondContact O-N 3.31Å; V382-S386 PolarHBondContact O-OG 2.88Å; S386-P770 WeakPolarHBondContact O-CG 3.17Å; S386-V1105 WeakPolarHBondContact CB-O 3.07Å
387	A	87.6	Confident	87.8	Confident	19 Å²	19	50.1 Å²	50.1	16%	0.157	26%	0.258	C	S	.	.			trans	-70.3	137.2	175.9	0	0	0	0	0	109.8	N389 S390 R393 T768	A387-N389 PolarHBondContact O-N 3.26Å; A387-N389 VanDerWaalsContact O-N 3.16Å; A387-S390 VanDerWaalsContact O-CB 3.27Å; A387-S390 WeakPolarHBondContact O-CB 3.37Å; A387-S390 PolarHBondContact O-N 3.05Å; A387-S390 PolarHBondContact O-OG 2.81Å; A387-R393 WeakPolarHBondContact O-CB 3.44Å; A387-T768 WeakPolarHBondContact CB-O 3.27Å
388	P	86.5	Confident	88.1	Confident	71 Å²	71	47.9 Å²	47.9	46%	0.461	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-30.2	-176.4	23.6	-34.1	0	0	0	112.6
389	N	89.9	Confident	88.5	Confident	140 Å²	140	46 Å²	46	75%	0.749	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.8	11.7	177.1	-65.4	-20.8	0	0	0	113	A387 Q394	A387-N389 PolarHBondContact O-N 3.26Å; A387-N389 VanDerWaalsContact O-N 3.16Å; N389-Q394 PolarHBondContact O-NE2 3.16Å
390	S	91.4	Very high	88.9	Confident	19 Å²	19	44.9 Å²	44.9	13%	0.133	23%	0.225	C	C	.	.	S	Bend	trans	-68.7	156	177.5	94.3	0	0	0	0	110.8	A387 A392 R393 Q394 E1108	A387-S390 VanDerWaalsContact O-CB 3.27Å; A387-S390 WeakPolarHBondContact O-CB 3.37Å; A387-S390 PolarHBondContact O-N 3.05Å; A387-S390 PolarHBondContact O-OG 2.81Å; S390-A392 PolarHBondContact OG-N 3.25Å; S390-R393 PolarHBondContact O-N 2.74Å; S390-R393 PolarHBondContact OG-N 3.47Å; S390-R393 VanDerWaalsContact OG-N 3.11Å; S390-Q394 WeakPolarHBondContact O-CG 3.23Å; S390-Q394 PolarHBondContact O-N 2.95Å; S390-E1108 VanDerWaalsContact CB-OE2 3.24Å; S390-E1108 WeakPolarHBondContact CB-OE2 3.31Å; S390-E1108 PolarHBondContact OG-OE2 3.02Å
391	R	93.3	Very high	89.4	Confident	111 Å²	111	51.6 Å²	51.6	42%	0.419	25%	0.253	S	S	.	.	H	α-helix	trans	-63.5	-44.4	178.4	174.1	-178.4	171.6	160.5	8.9	110.9	R393 Q394 E395 E1108	R391-R393 VanDerWaalsContact C-N 3.28Å; R391-R393 PolarHBondContact O-N 3.17Å; R391-Q394 PolarHBondContact O-N 3.37Å; R391-E395 HydrophobicContact CG-CG 4.28Å; R391-E395 WeakPolarHBondContact CG-OE1 3.2Å; R391-E395 IonicContact CZ-OE1 3.75Å; R391-E395 IonicContact NE-OE1 2.97Å; R391-E395 PolarHBondContact NE-OE1 3.47Å; R391-E395 IonicContact NH2-OE1 3.76Å; R391-E395 PolarHBondContact NH2-OE1 3.37Å; R391-E395 WeakPolarHBondContact O-CB 3.16Å; R391-E395 WeakPolarHBondContact O-CG 3.34Å; R391-E395 PolarHBondContact O-N 3.12Å; R391-E1108 WeakPolarHBondContact CB-OE1 3.21Å
392	A	93.3	Very high	89.8	Confident	2 Å²	2	52.6 Å²	52.6	2%	0.017	26%	0.256	C	S	.	.	H	α-helix	trans	-63.7	-33.5	177.8	0	0	0	0	0	112.4	S390 E395 K396 V1105 E1108	S390-A392 PolarHBondContact OG-N 3.25Å; A392-E395 PolarHBondContact O-N 2.93Å; A392-K396 WeakPolarHBondContact O-CB 3.3Å; A392-K396 PolarHBondContact O-N 3.49Å; A392-V1105 HydrophobicContact CB-CG1 4.11Å; A392-E1108 HydrophobicContact CB-CB 4.1Å; A392-E1108 HydrophobicContact CB-CG 4.46Å; A392-E1108 WeakPolarHBondContact CB-OE2 3.41Å; A392-E1108 PolarHBondContact N-OE1 3.11Å; A392-E1108 PolarHBondContact N-OE2 3.34Å
393	R	92.3	Very high	90	Very high	26 Å²	26	52.2 Å²	52.2	10%	0.098	25%	0.252	C	S	.	.	H	α-helix	trans	-67.6	-45.3	175.2	-167.8	65.7	170.5	172.1	-0.3	111.4	E383 A387 S390 R391 E395 K396 D397	E383-R393 IonicContact OE1-CZ 2.68Å; E383-R393 IonicContact OE1-NH2 3.53Å; E383-R393 PolarHBondContact OE1-NH2 3.16Å; A387-R393 WeakPolarHBondContact O-CB 3.44Å; S390-R393 PolarHBondContact O-N 2.74Å; S390-R393 PolarHBondContact OG-N 3.47Å; S390-R393 VanDerWaalsContact OG-N 3.11Å; R391-R393 VanDerWaalsContact C-N 3.28Å; R391-R393 PolarHBondContact O-N 3.17Å; R393-E395 VanDerWaalsContact C-N 3.33Å; R393-E395 PolarHBondContact O-N 3.5Å; R393-K396 WeakPolarHBondContact O-CB 3.48Å; R393-K396 PolarHBondContact O-N 3.39Å; R393-D397 IonicContact NE-OD1 3.94Å; R393-D397 WeakPolarHBondContact O-CB 3.47Å; R393-D397 PolarHBondContact O-N 2.87Å
394	Q	93.9	Very high	89.9	Confident	106 Å²	106	51.9 Å²	51.9	50%	0.495	26%	0.256	S	S	.	.	H	α-helix	trans	-62	-39.1	174.1	-67.8	173.3	12.2	0	0	112.6	N389 S390 R391 F398	N389-Q394 PolarHBondContact O-NE2 3.16Å; S390-Q394 WeakPolarHBondContact O-CG 3.23Å; S390-Q394 PolarHBondContact O-N 2.95Å; R391-Q394 PolarHBondContact O-N 3.37Å; Q394-F398 VanDerWaalsContact O-CB 3.26Å; Q394-F398 WeakPolarHBondContact O-CB 3.32Å; Q394-F398 PolarHBondContact O-N 3.38Å
395	E	94.1	Very high	90	Very high	7 Å²	7	51.7 Å²	51.7	3%	0.033	26%	0.256	C	S	.	.	H	α-helix	trans	-63.1	-42.7	174.8	-72.6	169.4	163.5	0	0	110.9	R391 A392 R393 H399 R1075 F1098	R391-E395 HydrophobicContact CG-CG 4.28Å; R391-E395 WeakPolarHBondContact CG-OE1 3.2Å; R391-E395 IonicContact CZ-OE1 3.75Å; R391-E395 IonicContact NE-OE1 2.97Å; R391-E395 PolarHBondContact NE-OE1 3.47Å; R391-E395 IonicContact NH2-OE1 3.76Å; R391-E395 PolarHBondContact NH2-OE1 3.37Å; R391-E395 WeakPolarHBondContact O-CB 3.16Å; R391-E395 WeakPolarHBondContact O-CG 3.34Å; R391-E395 PolarHBondContact O-N 3.12Å; A392-E395 PolarHBondContact O-N 2.93Å; R393-E395 VanDerWaalsContact C-N 3.33Å; R393-E395 PolarHBondContact O-N 3.5Å; E395-H399 WeakPolarHBondContact O-CB 3.4Å; E395-H399 PolarHBondContact O-N 2.97Å; E395-R1075 IonicContact OE2-NH2 3.65Å; E395-R1075 PolarHBondContact OE2-NH2 3.16Å; E395-R1075 VanDerWaalsContact OE2-NH2 3.12Å; E395-F1098 HydrophobicContact CB-CD2 3.62Å; E395-F1098 HydrophobicContact CB-CE2 3.62Å; E395-F1098 HydrophobicContact CB-CG 4.45Å; E395-F1098 HydrophobicContact CB-CZ 4.44Å; E395-F1098 HydrophobicContact CG-CB 4.17Å; E395-F1098 HydrophobicContact CG-CD2 3.47Å; E395-F1098 VanDerWaalsContact CG-CD2 3.47Å; E395-F1098 HydrophobicContact CG-CE2 3.91Å; E395-F1098 HydrophobicContact CG-CG 3.82Å; E395-F1098 WeakPolarHBondContact OE1-CB 3.32Å
396	K	92.5	Very high	90.3	Very high	37 Å²	37	49.6 Å²	49.6	16%	0.161	25%	0.249	C	C	.	.	H	α-helix	trans	-64.1	-50.3	174	175.6	172.8	172	51.6	0	112.3	A392 R393 F398 H399 D400 Y1100 V1105	A392-K396 WeakPolarHBondContact O-CB 3.3Å; A392-K396 PolarHBondContact O-N 3.49Å; R393-K396 WeakPolarHBondContact O-CB 3.48Å; R393-K396 PolarHBondContact O-N 3.39Å; K396-F398 VanDerWaalsContact C-N 3.25Å; K396-F398 PolarHBondContact O-N 3.49Å; K396-H399 WeakPolarHBondContact O-CB 3.48Å; K396-H399 PolarHBondContact O-N 2.86Å; K396-H399 VanDerWaalsContact O-N 3.09Å; K396-D400 IonicContact NZ-OD1 2.74Å; K396-D400 IonicContact NZ-OD2 3.73Å; K396-D400 PolarHBondContact NZ-OD2 3.22Å; K396-D400 PolarHBondContact O-N 3.04Å; K396-Y1100 HydrophobicContact CB-CE2 3.87Å; K396-Y1100 HydrophobicContact CG-CE2 4.07Å; K396-V1105 HydrophobicContact CB-CG1 4.09Å; K396-V1105 HydrophobicContact CD-CG1 3.93Å
397	D	91.7	Very high	90.4	Very high	77 Å²	77	52.1 Å²	52.1	41%	0.412	26%	0.26	S	S	.	.	H	α-helix	trans	-63.6	-35.3	-178.7	-65.4	-16.1	0	0	0	110.9	R393 K401	R393-D397 IonicContact NE-OD1 3.94Å; R393-D397 WeakPolarHBondContact O-CB 3.47Å; R393-D397 PolarHBondContact O-N 2.87Å; D397-K401 WeakPolarHBondContact O-CB 3.4Å; D397-K401 PolarHBondContact O-N 2.76Å; D397-K401 VanDerWaalsContact O-N 3.07Å
398	F	92.9	Very high	90.6	Very high	41 Å²	41	52.1 Å²	52.1	18%	0.18	26%	0.256	C	S	.	.	H	α-helix	trans	-64.5	-46.3	171.7	-176.2	-82.1	0	0	0	111.6	Q394 K396 H402 V906 K908 A1051 F1098	Q394-F398 VanDerWaalsContact O-CB 3.26Å; Q394-F398 WeakPolarHBondContact O-CB 3.32Å; Q394-F398 PolarHBondContact O-N 3.38Å; K396-F398 VanDerWaalsContact C-N 3.25Å; K396-F398 PolarHBondContact O-N 3.49Å; F398-H402 AromaticContact CD1-ND1 3.9Å; F398-H402 AromaticContact CD2-CE1 3.67Å; F398-H402 AromaticContact CD2-ND1 3.92Å; F398-H402 AromaticContact CE1-ND1 3.81Å; F398-H402 AromaticContact CE2-CE1 3.37Å; F398-H402 WeakPolarHBondContact CE2-CE1 3.32Å; F398-H402 AromaticContact CE2-ND1 3.82Å; F398-H402 AromaticContact CG-ND1 3.96Å; F398-H402 AromaticContact CZ-CE1 3.64Å; F398-H402 AromaticContact CZ-ND1 3.76Å; F398-H402 PolarHBondContact O-N 3.28Å; F398-H402 PolarHBondContact O-ND1 3.39Å; F398-V906 HydrophobicContact CD1-CG1 4.36Å; F398-V906 HydrophobicContact CE1-CG1 4.07Å; F398-K908 HydrophobicContact CD2-CD 4.46Å; F398-K908 HydrophobicContact CE1-CG 4.17Å; F398-K908 HydrophobicContact CE2-CD 4.09Å; F398-K908 HydrophobicContact CE2-CG 4.1Å; F398-K908 HydrophobicContact CZ-CB 4.29Å; F398-K908 HydrophobicContact CZ-CD 4.3Å; F398-K908 HydrophobicContact CZ-CG 3.79Å; F398-A1051 HydrophobicContact CE1-CB 4.01Å; F398-A1051 HydrophobicContact CZ-CB 4.17Å; F398-F1098 HydrophobicContact CB-CZ 4.32Å; F398-F1098 AromaticContact CD1-CE1 3.89Å; F398-F1098 HydrophobicContact CD1-CE1 3.89Å; F398-F1098 AromaticContact CD1-CZ 3.6Å; F398-F1098 HydrophobicContact CD1-CZ 3.6Å; F398-F1098 HydrophobicContact CE1-CE1 4.23Å; F398-F1098 HydrophobicContact CE1-CZ 4.28Å; F398-F1098 HydrophobicContact CG-CE1 4.42Å; F398-F1098 HydrophobicContact CG-CZ 4.2Å
399	H	92.8	Very high	91	Very high	0 Å²	0	50 Å²	50	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-60.1	-52.5	177.9	173.3	-83.3	0	0	0	110.9	E395 K396 K401 H402 F403 R1053 Y1100	E395-H399 WeakPolarHBondContact O-CB 3.4Å; E395-H399 PolarHBondContact O-N 2.97Å; K396-H399 WeakPolarHBondContact O-CB 3.48Å; K396-H399 PolarHBondContact O-N 2.86Å; K396-H399 VanDerWaalsContact O-N 3.09Å; H399-K401 VanDerWaalsContact C-N 3.26Å; H399-K401 PolarHBondContact O-N 3.19Å; H399-H402 PolarHBondContact O-N 3.41Å; H399-F403 AromaticContact CD2-CD2 3.67Å; H399-F403 WeakPolarHBondContact O-CA 3.47Å; H399-F403 WeakPolarHBondContact O-CB 3.39Å; H399-F403 WeakPolarHBondContact O-CD2 3.39Å; H399-F403 PolarHBondContact O-N 3.32Å; H399-R1053 PolarHBondContact NE2-NH1 3.37Å; H399-Y1100 HydrophobicContact CB-CD1 4.12Å; H399-Y1100 HydrophobicContact CB-CD2 4.32Å; H399-Y1100 HydrophobicContact CB-CE1 4.2Å; H399-Y1100 HydrophobicContact CB-CE2 4.42Å; H399-Y1100 HydrophobicContact CB-CG 4.17Å; H399-Y1100 AromaticContact CD2-CD1 3.42Å; H399-Y1100 VanDerWaalsContact CD2-CD1 3.42Å; H399-Y1100 WeakPolarHBondContact CD2-CD1 3.32Å; H399-Y1100 AromaticContact CD2-CE1 3.67Å; H399-Y1100 AromaticContact CE1-CE1 3.56Å; H399-Y1100 AromaticContact CG-CD1 3.55Å; H399-Y1100 AromaticContact CG-CE1 3.48Å; H399-Y1100 VanDerWaalsContact CG-CE1 3.48Å; H399-Y1100 AromaticContact CG-CZ 4Å; H399-Y1100 AromaticContact ND1-CD1 3.96Å; H399-Y1100 AromaticContact ND1-CE1 3.39Å; H399-Y1100 WeakPolarHBondContact ND1-CE1 3.38Å; H399-Y1100 AromaticContact ND1-CZ 3.81Å; H399-Y1100 AromaticContact NE2-CD1 3.79Å; H399-Y1100 AromaticContact NE2-CE1 3.72Å
400	D	90.2	Very high	91.2	Very high	31 Å²	31	43.3 Å²	43.3	17%	0.166	21%	0.206	C	C	.	.	H	α-helix	trans	-70.4	-20.7	-175.1	-66.5	-10.4	0	0	0	113.3	K396 F403 P405	K396-D400 IonicContact NZ-OD1 2.74Å; K396-D400 IonicContact NZ-OD2 3.73Å; K396-D400 PolarHBondContact NZ-OD2 3.22Å; K396-D400 PolarHBondContact O-N 3.04Å; D400-F403 CarbonylContact C-O 3.55Å; D400-P405 HydrophobicContact CB-CG 4.45Å
401	K	90.1	Very high	91.3	Very high	171 Å²	171	43.5 Å²	43.5	74%	0.743	21%	0.205	S	C	*	.	H	α-helix	trans	-76.6	-39	173.9	-179.8	177.9	177.9	-178.5	0	112.8	D397 H399	D397-K401 WeakPolarHBondContact O-CB 3.4Å; D397-K401 PolarHBondContact O-N 2.76Å; D397-K401 VanDerWaalsContact O-N 3.07Å; H399-K401 VanDerWaalsContact C-N 3.26Å; H399-K401 PolarHBondContact O-N 3.19Å
402	H	91.3	Very high	91.4	Very high	49 Å²	49	38.2 Å²	38.2	23%	0.227	19%	0.185	C	C	.	.	H	α-helix	trans	-95.7	-36.6	-175	-64.8	86.9	0	0	0	112.2	F398 H399 V1042 A1051	F398-H402 AromaticContact CD1-ND1 3.9Å; F398-H402 AromaticContact CD2-CE1 3.67Å; F398-H402 AromaticContact CD2-ND1 3.92Å; F398-H402 AromaticContact CE1-ND1 3.81Å; F398-H402 AromaticContact CE2-CE1 3.37Å; F398-H402 WeakPolarHBondContact CE2-CE1 3.32Å; F398-H402 AromaticContact CE2-ND1 3.82Å; F398-H402 AromaticContact CG-ND1 3.96Å; F398-H402 AromaticContact CZ-CE1 3.64Å; F398-H402 AromaticContact CZ-ND1 3.76Å; F398-H402 PolarHBondContact O-N 3.28Å; F398-H402 PolarHBondContact O-ND1 3.39Å; H399-H402 PolarHBondContact O-N 3.41Å; H402-V1042 HydrophobicContact CB-CG2 4.42Å; H402-V1042 WeakPolarHBondContact O-CG2 3.46Å; H402-A1051 HydrophobicContact CB-CB 4.22Å
403	F	89.4	Confident	91.4	Very high	10 Å²	10	38.1 Å²	38.1	4%	0.044	18%	0.184	C	C	.	.	S	Bend	trans	-109.6	162	178.9	-52.1	-72.9	0	0	0	109.8	H399 D400 V906 T1039 A1040 V1042 A1051 R1053	H399-F403 AromaticContact CD2-CD2 3.67Å; H399-F403 WeakPolarHBondContact O-CA 3.47Å; H399-F403 WeakPolarHBondContact O-CB 3.39Å; H399-F403 WeakPolarHBondContact O-CD2 3.39Å; H399-F403 PolarHBondContact O-N 3.32Å; D400-F403 CarbonylContact C-O 3.55Å; F403-V906 HydrophobicContact CE2-CG1 3.78Å; F403-V906 HydrophobicContact CZ-CG1 4.39Å; F403-T1039 VanDerWaalsContact CD1-O 3.24Å; F403-T1039 WeakPolarHBondContact CD1-O 3.49Å; F403-A1040 WeakPolarHBondContact CE1-O 3.37Å; F403-V1042 HydrophobicContact CD1-CG2 3.58Å; F403-V1042 HydrophobicContact CE1-CB 4.46Å; F403-V1042 HydrophobicContact CE1-CG2 3.45Å; F403-V1042 VanDerWaalsContact CE1-CG2 3.45Å; F403-V1042 HydrophobicContact CG-CG2 4.5Å; F403-V1042 HydrophobicContact CZ-CG2 4.26Å; F403-A1051 HydrophobicContact CE2-CB 4.01Å; F403-A1051 HydrophobicContact CZ-CB 3.68Å; F403-R1053 HydrophobicContact CE1-CG 4.26Å; F403-R1053 HydrophobicContact CZ-CB 4.23Å; F403-R1053 HydrophobicContact CZ-CG 4.4Å
404	T	81.9	Confident	91.4	Very high	76 Å²	76	36.9 Å²	36.9	47%	0.466	18%	0.179	S	C	.	.	P	Polyproline II helix	trans	-61	139.3	169.5	51.3	0	0	0	0	109.9
405	P	85.5	Confident	91.3	Very high	25 Å²	25	32.1 Å²	32.1	16%	0.162	16%	0.158	C	C	.	.	P	Polyproline II helix	trans	-52	147.2	174	-24.8	33.3	0	0	0	111.1	D400 F407 N580	D400-P405 HydrophobicContact CB-CG 4.45Å; P405-F407 PolarHBondContact O-N 2.82Å; P405-N580 HydrophobicContact CB-CB 4.12Å
406	F	87.7	Confident	91	Very high	21 Å²	21	32.3 Å²	32.3	9%	0.092	16%	0.16	C	C	.	.	P	Polyproline II helix	trans	-54.3	132	-179.6	-171.5	-92.3	0	0	0	110.4	N580 P902 Y904 I1102	F406-N580 WeakPolarHBondContact O-CB 3.44Å; F406-N580 PolarHBondContact O-ND2 3.49Å; F406-P902 HydrophobicContact CE2-CG 3.79Å; F406-P902 HydrophobicContact CZ-CG 3.8Å; F406-Y904 AromaticContact CD2-CE2 3.76Å; F406-Y904 HydrophobicContact CD2-CE2 3.76Å; F406-Y904 AromaticContact CE2-CE2 3.69Å; F406-Y904 HydrophobicContact CE2-CE2 3.69Å; F406-I1102 HydrophobicContact CD1-CD1 4.24Å
407	F	90.4	Very high	90.3	Very high	55 Å²	55	35.1 Å²	35.1	24%	0.241	18%	0.182	C	C	.	.	P	Polyproline II helix	trans	-60.7	152.4	-175.1	53.9	-96.1	0	0	0	111.7	P405 T409 L578	P405-F407 PolarHBondContact O-N 2.82Å; F407-T409 HydrophobicContact CD2-CG2 3.65Å; F407-T409 HydrophobicContact CE2-CG2 3.46Å; F407-T409 VanDerWaalsContact CE2-CG2 3.46Å; F407-L578 CarbonylContact C-O 3.58Å; F407-L578 WeakPolarHBondContact CA-O 3.31Å; F407-L578 VanDerWaalsContact CB-O 3.26Å; F407-L578 WeakPolarHBondContact CB-O 3.22Å
408	R	92.6	Very high	89.6	Confident	19 Å²	19	35.4 Å²	35.4	7%	0.072	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	129.6	177.6	-52.5	178.3	62.1	78.8	-1.8	108.6	L578 N580 E595 E620	R408-L578 HydrophobicContact CB-CB 4.27Å; R408-L578 PolarHBondContact N-O 2.87Å; R408-L578 PolarHBondContact O-N 2.92Å; R408-N580 HydrophobicContact CG-CB 3.8Å; R408-E595 IonicContact CZ-OE1 2.59Å; R408-E595 IonicContact CZ-OE2 3.71Å; R408-E595 IonicContact NE-OE1 3.97Å; R408-E595 PolarHBondContact NE-OE1 2.92Å; R408-E595 IonicContact NE-OE2 3.25Å; R408-E595 IonicContact NH2-OE1 4Å; R408-E595 PolarHBondContact NH2-OE1 3.34Å; R408-E595 IonicContact NH2-OE2 2.74Å; R408-E595 PolarHBondContact NH2-OE2 3.37Å; R408-E620 HydrophobicContact CB-CB 4.02Å; R408-E620 HydrophobicContact CB-CG 4.12Å; R408-E620 HydrophobicContact CG-CG 4.29Å
409	T	93.1	Very high	89.1	Confident	27 Å²	27	38 Å²	38	17%	0.166	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	124.4	-178.2	51.8	0	0	0	0	110.6	F407	F407-T409 HydrophobicContact CD2-CG2 3.65Å; F407-T409 HydrophobicContact CE2-CG2 3.46Å; F407-T409 VanDerWaalsContact CE2-CG2 3.46Å
410	N	95.4	Very high	88.6	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	119.9	170.2	-55.5	-67.9	0	0	0	108.1	T575 F576 L578 F598 M618 A619 E620	N410-T575 WeakPolarHBondContact O-CA 3.21Å; N410-F576 HydrophobicContact CB-CB 4.32Å; N410-F576 PolarHBondContact N-O 2.93Å; N410-F576 PolarHBondContact O-N 2.97Å; N410-L578 VanDerWaalsContact ND2-CD1 3.28Å; N410-L578 WeakPolarHBondContact ND2-CD1 3.03Å; N410-F598 HydrophobicContact CB-CD1 4.46Å; N410-F598 HydrophobicContact CB-CE1 4.02Å; N410-F598 HydrophobicContact CB-CZ 4.1Å; N410-M618 CarbonylContact C-O 3.53Å; N410-M618 WeakPolarHBondContact CA-O 3.39Å; N410-A619 WeakPolarHBondContact OD1-CA 3.47Å; N410-A619 VanDerWaalsContact OD1-CB 3.32Å; N410-A619 WeakPolarHBondContact OD1-CB 3.41Å; N410-E620 PolarHBondContact OD1-N 3.36Å
411	Q	93.9	Very high	88.3	Confident	22 Å²	22	48.5 Å²	48.5	10%	0.103	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	142	-169	-69	-168.9	-12	0	0	111.8	L574 T575 Y617 M618 Y889	Q411-L574 CarbonylContact C-O 3.54Å; Q411-L574 WeakPolarHBondContact CA-O 3.3Å; Q411-T575 HydrophobicContact CG-CG2 3.94Å; Q411-Y617 VanDerWaalsContact O-CA 3.3Å; Q411-Y617 WeakPolarHBondContact O-CA 3.31Å; Q411-M618 PolarHBondContact N-O 3.16Å; Q411-M618 PolarHBondContact O-N 2.89Å; Q411-Y889 HydrophobicContact CB-CE2 4.15Å; Q411-Y889 PolarHBondContact OE1-OH 2.64Å
412	L	94.6	Very high	88.2	Confident	1 Å²	1	44 Å²	44	1%	0.005	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	132.8	166.9	-55.2	78.6	0	0	0	108.9	L414 L449 I453 I573 L574 F576 F598 V602 A616	L412-L414 HydrophobicContact CB-CD1 4.01Å; L412-L449 HydrophobicContact CD2-CD2 4.18Å; L412-I453 HydrophobicContact CD2-CD1 4.46Å; L412-I573 WeakPolarHBondContact O-CA 3.44Å; L412-L574 HydrophobicContact CB-CB 4.33Å; L412-L574 HydrophobicContact CD1-CB 4.37Å; L412-L574 HydrophobicContact CD1-CD2 4.04Å; L412-L574 HydrophobicContact CD1-CG 4.13Å; L412-L574 HydrophobicContact CD2-CD2 4.47Å; L412-L574 PolarHBondContact N-O 3Å; L412-L574 PolarHBondContact O-N 3.46Å; L412-F576 HydrophobicContact CD1-CE2 4.43Å; L412-F598 HydrophobicContact CD1-CE2 3.64Å; L412-F598 HydrophobicContact CD1-CZ 3.46Å; L412-F598 VanDerWaalsContact CD1-CZ 3.46Å; L412-F598 HydrophobicContact CG-CZ 4.15Å; L412-V602 HydrophobicContact CD2-CG1 4.2Å; L412-V602 HydrophobicContact CD2-CG2 3.82Å; L412-A616 CarbonylContact C-O 3.42Å; L412-A616 WeakPolarHBondContact CA-O 3.41Å
413	I	93.9	Very high	88.1	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	112	174.3	-52.8	174.5	0	0	0	106.8	A571 F572 F615 A616 Y889 Y892 L893 Y896	I413-A571 HydrophobicContact CG2-CB 3.87Å; I413-F572 CarbonylContact C-O 3.57Å; I413-F572 WeakPolarHBondContact CA-O 3.3Å; I413-F615 CarbonylContact O-C 3.52Å; I413-F615 WeakPolarHBondContact O-CA 3.32Å; I413-F615 WeakPolarHBondContact O-CB 3.37Å; I413-A616 PolarHBondContact N-O 3.17Å; I413-A616 PolarHBondContact O-N 2.79Å; I413-Y889 HydrophobicContact CD1-CD2 4.3Å; I413-Y889 HydrophobicContact CD1-CE2 4.04Å; I413-Y889 HydrophobicContact CG1-CE2 4.44Å; I413-Y892 HydrophobicContact CB-CD1 4.21Å; I413-Y892 HydrophobicContact CG2-CD1 3.87Å; I413-L893 HydrophobicContact CD1-CB 4.44Å; I413-Y896 HydrophobicContact CG2-CD2 4.23Å
414	L	92.2	Very high	88	Confident	0 Å²	0	47 Å²	47	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	133.6	-175	-51.8	97.1	0	0	0	111.1	L412 L446 L449 A571 F572 L574 F613 F615	L412-L414 HydrophobicContact CB-CD1 4.01Å; L414-L446 HydrophobicContact CD1-CD1 3.84Å; L414-L446 HydrophobicContact CD2-CD1 4.27Å; L414-L449 HydrophobicContact CD2-CD2 4.13Å; L414-A571 CarbonylContact O-C 3.46Å; L414-A571 VanDerWaalsContact O-CA 3.31Å; L414-A571 WeakPolarHBondContact O-CA 3.37Å; L414-F572 HydrophobicContact CB-CB 4.41Å; L414-F572 HydrophobicContact CD1-CB 4.41Å; L414-F572 PolarHBondContact N-O 3.49Å; L414-F572 PolarHBondContact O-N 3.41Å; L414-L574 HydrophobicContact CD1-CB 4.41Å; L414-F613 HydrophobicContact CB-CD1 3.97Å; L414-F613 HydrophobicContact CB-CE1 4.38Å; L414-F613 HydrophobicContact CB-CG 4.33Å; L414-F613 HydrophobicContact CD2-CB 4.24Å; L414-F613 HydrophobicContact CD2-CD1 4.44Å; L414-F613 HydrophobicContact CD2-CD2 4.15Å; L414-F613 HydrophobicContact CD2-CG 4.05Å; L414-F615 HydrophobicContact CB-CB 4.26Å; L414-F615 HydrophobicContact CD2-CB 4.17Å; L414-F615 HydrophobicContact CG-CB 3.88Å
415	T	91.8	Very high	88.3	Confident	6 Å²	6	47 Å²	47	4%	0.037	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	157.6	177.4	64.7	0	0	0	0	109.9	E570 A571 F613 T614 Y892 Y896	T415-E570 WeakPolarHBondContact CG2-O 3.25Å; T415-A571 HydrophobicContact CG2-CB 3.81Å; T415-F613 WeakPolarHBondContact O-CA 3.36Å; T415-T614 PolarHBondContact N-O 3.38Å; T415-T614 PolarHBondContact O-N 3.4Å; T415-T614 PolarHBondContact O-OG1 3.05Å; T415-T614 PolarHBondContact OG1-O 3.45Å; T415-T614 PolarHBondContact OG1-OG1 3.49Å; T415-Y892 HydrophobicContact CG2-CD1 4.15Å; T415-Y892 HydrophobicContact CG2-CE1 3.68Å; T415-Y896 HydrophobicContact CG2-CD2 4.33Å; T415-Y896 HydrophobicContact CG2-CE2 3.74Å
416	A	87.7	Confident	88.2	Confident	11 Å²	11	46 Å²	46	9%	0.091	26%	0.259	C	S	.	.			trans	-133.6	73.9	179.9	0	0	0	0	0	110.1	L437 L442 F613	A416-L437 HydrophobicContact CB-CD1 3.73Å; A416-L442 HydrophobicContact CB-CD1 3.69Å; A416-F613 HydrophobicContact CB-CD1 4.33Å
417	P	78.3	Confident	87.9	Confident	96 Å²	96	46.5 Å²	46.5	62%	0.623	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	144.5	-175.8	26.8	-33.5	0	0	0	111.7	T614	P417-T614 WeakPolarHBondContact CD-OG1 3.37Å; P417-T614 HydrophobicContact CG-CG2 4.15Å
418	G	76.1	Confident	87.2	Confident	83 Å²	83	44.4 Å²	44.4	86%	0.856	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	94	-6.2	174.4	0	0	0	0	0	116
419	R	82.6	Confident	86.5	Confident	96 Å²	96	45 Å²	45	36%	0.362	26%	0.257	S	S	.	.	P	Polyproline II helix	trans	-83.6	130.9	170	-66.9	-170.7	176.3	-162.7	2.3	110.5	S439	R419-S439 PolarHBondContact NH1-OG 3.35Å
420	K	82.6	Confident	86	Confident	198 Å²	198	45 Å²	45	86%	0.861	26%	0.263	S	S	*	.	P	Polyproline II helix	trans	-72.9	139	174.4	-66.7	-174.5	179.7	-178.7	0	109.6
421	G	83.6	Confident	85.6	Confident	52 Å²	52	51.9 Å²	51.9	54%	0.536	29%	0.293	S	S	.	.	P	Polyproline II helix	trans	-61.1	158.9	168.3	0	0	0	0	0	111.4	F434	G421-F434 CarbonylContact C-O 3.59Å; G421-F434 WeakPolarHBondContact CA-O 3.46Å
422	H	87.6	Confident	85.1	Confident	76 Å²	76	53.7 Å²	53.7	35%	0.352	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	149.5	176.4	62.1	-74	0	0	0	110	F434 I438	H422-F434 WeakPolarHBondContact CE1-CB 3.42Å; H422-F434 PolarHBondContact N-O 3.42Å; H422-F434 PolarHBondContact O-N 3.01Å; H422-I438 PolarHBondContact CE1-O 3.27Å
423	L	88.9	Confident	84.8	Confident	103 Å²	103	58.1 Å²	58.1	54%	0.539	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	128.4	173.9	-167	94.7	0	0	0	108.1	K431 N433	L423-K431 HydrophobicContact CD1-CB 4.4Å; L423-K431 HydrophobicContact CD2-CB 4.33Å; L423-K431 HydrophobicContact CD2-CD 4.09Å; L423-K431 HydrophobicContact CD2-CG 4.18Å; L423-N433 VanDerWaalsContact CD1-OD1 3.28Å; L423-N433 WeakPolarHBondContact CD1-OD1 3.36Å
424	Y	87.9	Confident	84.6	Confident	21 Å²	21	58.2 Å²	58.2	8%	0.082	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	124.8	171.8	178.1	-122.2	0	0	0	109.2	K431 Q432 F434 R521 D522 I525	Y424-K431 WeakPolarHBondContact O-CA 3.4Å; Y424-Q432 PolarHBondContact N-O 3.17Å; Y424-Q432 PolarHBondContact O-N 3.39Å; Y424-F434 AromaticContact CD1-CE2 3.77Å; Y424-F434 HydrophobicContact CD1-CE2 3.77Å; Y424-F434 HydrophobicContact CD1-CZ 4.23Å; Y424-F434 HydrophobicContact CG-CE2 4.13Å; Y424-R521 HydrophobicContact CD1-CB 3.9Å; Y424-R521 HydrophobicContact CE1-CB 3.63Å; Y424-D522 WeakPolarHBondContact CE1-OD1 3.24Å; Y424-D522 PolarHBondContact OH-OD1 2.92Å; Y424-D522 PolarHBondContact OH-OD2 3.38Å; Y424-I525 HydrophobicContact CD1-CD1 4.4Å
425	D	87.4	Confident	84.4	Confident	76 Å²	76	59.4 Å²	59.4	41%	0.406	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	97.9	175.9	-154.7	-0.3	0	0	0	108.5	K431 Q516	D425-K431 HydrophobicContact CB-CG 4.23Å; D425-K431 VanDerWaalsContact OD1-CG 3.25Å; D425-K431 WeakPolarHBondContact OD1-CG 3.38Å; D425-K431 PolarHBondContact OD1-N 3Å; D425-K431 VanDerWaalsContact OD2-CE 3.22Å; D425-K431 WeakPolarHBondContact OD2-CE 3.49Å; D425-Q516 PolarHBondContact O-NE2 3.38Å
426	S	83.4	Confident	84.1	Confident	3 Å²	3	59.5 Å²	59.5	2%	0.021	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	141	179.3	170.9	0	0	0	0	110.5	L428 F429 G430 D522	S426-L428 PolarHBondContact O-N 3.44Å; S426-L428 PolarHBondContact OG-N 2.89Å; S426-L428 VanDerWaalsContact OG-N 3.15Å; S426-F429 WeakPolarHBondContact OG-CD2 3.36Å; S426-F429 PolarHBondContact OG-N 2.92Å; S426-F429 VanDerWaalsContact OG-N 3.08Å; S426-G430 PolarHBondContact N-O 3.43Å; S426-G430 VanDerWaalsContact O-CA 3.29Å; S426-G430 WeakPolarHBondContact O-CA 3.43Å; S426-G430 PolarHBondContact O-N 3Å; S426-D522 VanDerWaalsContact CB-OD1 3.24Å; S426-D522 WeakPolarHBondContact CB-OD1 3.47Å; S426-D522 PolarHBondContact OG-OD1 2.94Å
427	L	82.3	Confident	84.1	Confident	32 Å²	32	59.1 Å²	59.1	17%	0.168	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-42.6	171.5	-174.6	65.3	0	0	0	111.3	M509 E511 V514 Q516	L427-M509 HydrophobicContact CD2-CB 4.24Å; L427-M509 HydrophobicContact CD2-CG 4.35Å; L427-E511 HydrophobicContact CD1-CB 4.32Å; L427-E511 HydrophobicContact CD2-CB 3.86Å; L427-E511 HydrophobicContact CG-CB 3.99Å; L427-V514 HydrophobicContact CD1-CB 4.16Å; L427-V514 HydrophobicContact CD1-CG1 4.02Å; L427-Q516 HydrophobicContact CB-CB 4.2Å; L427-Q516 HydrophobicContact CD1-CB 4.09Å; L427-Q516 HydrophobicContact CD2-CB 4.23Å; L427-Q516 HydrophobicContact CG-CB 4.41Å
428	L	76.1	Confident	84.7	Confident	11 Å²	11	54.5 Å²	54.5	6%	0.058	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.4	-36.5	-172.5	-66.1	152.4	0	0	0	112.7	R189 S426 M509 E511 I537 T538	R189-L428 WeakPolarHBondContact CD-O 3.03Å; R189-L428 PolarHBondContact NE-O 3.36Å; R189-L428 VanDerWaalsContact NH1-CD2 3.3Å; R189-L428 PolarHBondContact NH1-O 3.42Å; S426-L428 PolarHBondContact O-N 3.44Å; S426-L428 PolarHBondContact OG-N 2.89Å; S426-L428 VanDerWaalsContact OG-N 3.15Å; L428-M509 HydrophobicContact CD1-SD 4.45Å; L428-M509 HydrophobicContact CD2-CE 4.31Å; L428-E511 WeakPolarHBondContact CD2-OE2 3.41Å; L428-I537 HydrophobicContact CD1-CG1 4.5Å; L428-I537 HydrophobicContact CD2-CD1 3.87Å; L428-I537 HydrophobicContact CD2-CG1 4.39Å; L428-T538 HydrophobicContact CD1-CG2 3.64Å
429	F	76.8	Confident	85.3	Confident	30 Å²	30	51.6 Å²	51.6	13%	0.132	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.8	-3.1	-169.6	-58.4	-86	0	0	0	113.8	R189 S426 Q432 D522 I525 Y526	R189-F429 HydrophobicContact CB-CD1 4.02Å; R189-F429 HydrophobicContact CB-CE1 3.28Å; R189-F429 HydrophobicContact CB-CZ 3.64Å; R189-F429 HydrophobicContact CG-CE1 4.41Å; R189-F429 WeakPolarHBondContact O-CE1 3.4Å; S426-F429 WeakPolarHBondContact OG-CD2 3.36Å; S426-F429 PolarHBondContact OG-N 2.92Å; S426-F429 VanDerWaalsContact OG-N 3.08Å; F429-Q432 HydrophobicContact CB-CG 4.14Å; F429-Q432 PolarHBondContact O-NE2 3.32Å; F429-D522 HydrophobicContact CE2-CB 4.35Å; F429-D522 WeakPolarHBondContact CE2-O 3.43Å; F429-I525 HydrophobicContact CB-CD1 4.48Å; F429-I525 HydrophobicContact CB-CG2 4.44Å; F429-I525 HydrophobicContact CD1-CB 4.5Å; F429-I525 HydrophobicContact CD1-CG2 3.51Å; F429-I525 HydrophobicContact CD2-CB 4.2Å; F429-I525 HydrophobicContact CD2-CD1 4.15Å; F429-I525 HydrophobicContact CD2-CG2 4.02Å; F429-I525 HydrophobicContact CE1-CB 4.33Å; F429-I525 HydrophobicContact CE1-CG2 3.53Å; F429-I525 HydrophobicContact CE2-CB 4.12Å; F429-I525 HydrophobicContact CE2-CG2 4.13Å; F429-I525 HydrophobicContact CG-CB 4.42Å; F429-I525 HydrophobicContact CG-CD1 4.4Å; F429-I525 HydrophobicContact CG-CG2 3.75Å; F429-I525 HydrophobicContact CZ-CB 4.2Å; F429-I525 HydrophobicContact CZ-CG2 3.9Å; F429-Y526 HydrophobicContact CZ-CD2 4.28Å
430	G	83	Confident	85.6	Confident	29 Å²	29	49.7 Å²	49.7	30%	0.299	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	63.9	-154.9	-172.6	0	0	0	0	0	112.6	S426 Q432	S426-G430 PolarHBondContact N-O 3.43Å; S426-G430 VanDerWaalsContact O-CA 3.29Å; S426-G430 WeakPolarHBondContact O-CA 3.43Å; S426-G430 PolarHBondContact O-N 3Å; G430-Q432 PolarHBondContact O-N 2.68Å
431	K	86.1	Confident	86	Confident	144 Å²	144	43.4 Å²	43.4	63%	0.626	24%	0.244	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-73	114.2	-177.6	-66	179.7	178.3	-176.3	0	111.6	L423 Y424 D425	L423-K431 HydrophobicContact CD1-CB 4.4Å; L423-K431 HydrophobicContact CD2-CB 4.33Å; L423-K431 HydrophobicContact CD2-CD 4.09Å; L423-K431 HydrophobicContact CD2-CG 4.18Å; Y424-K431 WeakPolarHBondContact O-CA 3.4Å; D425-K431 HydrophobicContact CB-CG 4.23Å; D425-K431 VanDerWaalsContact OD1-CG 3.25Å; D425-K431 WeakPolarHBondContact OD1-CG 3.38Å; D425-K431 PolarHBondContact OD1-N 3Å; D425-K431 VanDerWaalsContact OD2-CE 3.22Å; D425-K431 WeakPolarHBondContact OD2-CE 3.49Å
432	Q	83.6	Confident	86.3	Confident	60 Å²	60	41 Å²	41	28%	0.28	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	140.5	177.8	-64.7	-61.2	-26.4	0	0	111.1	Y424 F429 G430 F434 I525	Y424-Q432 PolarHBondContact N-O 3.17Å; Y424-Q432 PolarHBondContact O-N 3.39Å; F429-Q432 HydrophobicContact CB-CG 4.14Å; F429-Q432 PolarHBondContact O-NE2 3.32Å; G430-Q432 PolarHBondContact O-N 2.68Å; Q432-F434 HydrophobicContact CB-CD2 4.29Å; Q432-F434 HydrophobicContact CB-CE2 3.92Å; Q432-I525 HydrophobicContact CB-CD1 4.49Å; Q432-I525 HydrophobicContact CG-CD1 4.11Å
433	N	88.9	Confident	86.5	Confident	93 Å²	93	37.3 Å²	37.3	50%	0.497	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	125.5	171.4	-73.8	-30.9	0	0	0	109.1	L423 T567 N568	L423-N433 VanDerWaalsContact CD1-OD1 3.28Å; L423-N433 WeakPolarHBondContact CD1-OD1 3.36Å; N433-T567 WeakPolarHBondContact O-CB 3.26Å; N433-T567 PolarHBondContact O-OG1 3.33Å; N433-N568 WeakPolarHBondContact CB-OD1 3.47Å; N433-N568 PolarHBondContact O-OD1 2.92Å
434	F	89.2	Confident	86.7	Confident	2 Å²	2	35 Å²	35	1%	0.009	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	128	171.3	-81.9	-107	0	0	0	109.5	G421 H422 Y424 Q432 I438 R521 I525 T567	G421-F434 CarbonylContact C-O 3.59Å; G421-F434 WeakPolarHBondContact CA-O 3.46Å; H422-F434 WeakPolarHBondContact CE1-CB 3.42Å; H422-F434 PolarHBondContact N-O 3.42Å; H422-F434 PolarHBondContact O-N 3.01Å; Y424-F434 AromaticContact CD1-CE2 3.77Å; Y424-F434 HydrophobicContact CD1-CE2 3.77Å; Y424-F434 HydrophobicContact CD1-CZ 4.23Å; Y424-F434 HydrophobicContact CG-CE2 4.13Å; Q432-F434 HydrophobicContact CB-CD2 4.29Å; Q432-F434 HydrophobicContact CB-CE2 3.92Å; F434-I438 HydrophobicContact CD1-CB 3.92Å; F434-I438 HydrophobicContact CD1-CG2 3.61Å; F434-I438 HydrophobicContact CE1-CG2 3.85Å; F434-R521 HydrophobicContact CE1-CB 4.36Å; F434-R521 HydrophobicContact CE1-CG 4.14Å; F434-R521 HydrophobicContact CZ-CB 3.98Å; F434-R521 HydrophobicContact CZ-CG 4.18Å; F434-I525 HydrophobicContact CE2-CD1 3.93Å; F434-I525 HydrophobicContact CE2-CG1 4.4Å; F434-I525 HydrophobicContact CZ-CD1 3.69Å; F434-I525 HydrophobicContact CZ-CG1 3.81Å; F434-T567 HydrophobicContact CE1-CG2 4.36Å; F434-T567 HydrophobicContact CE2-CG2 4.3Å; F434-T567 HydrophobicContact CZ-CG2 4.1Å
435	S	89	Confident	86.8	Confident	25 Å²	25	35.6 Å²	35.6	18%	0.175	19%	0.193	C	C	.	.			trans	-56.8	149.2	168.1	174.5	0	0	0	0	110.7	L437 I438 T567 A569	S435-L437 PolarHBondContact O-N 3.22Å; S435-L437 PolarHBondContact OG-N 3.48Å; S435-I438 PolarHBondContact O-N 2.99Å; S435-T567 PolarHBondContact N-O 3.27Å; S435-A569 WeakPolarHBondContact CB-O 3.46Å; S435-A569 PolarHBondContact OG-O 3.42Å
436	G	85.4	Confident	87	Confident	8 Å²	8	32 Å²	32	8%	0.082	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-16.4	174.5	0	0	0	0	0	113.4
437	L	88.1	Confident	87.5	Confident	3 Å²	3	32.1 Å²	32.1	2%	0.016	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-42.5	173.2	-176	71.6	0	0	0	112.6	A416 S435 S439 L442 A571 F572 F613	A416-L437 HydrophobicContact CB-CD1 3.73Å; S435-L437 PolarHBondContact O-N 3.22Å; S435-L437 PolarHBondContact OG-N 3.48Å; L437-S439 PolarHBondContact O-N 3.4Å; L437-L442 HydrophobicContact CD1-CD1 4.4Å; L437-L442 WeakPolarHBondContact O-CD1 3.34Å; L437-A571 VanDerWaalsContact CD2-C 3.45Å; L437-F572 HydrophobicContact CD1-CD2 4Å; L437-F572 HydrophobicContact CD1-CE2 3.94Å; L437-F572 HydrophobicContact CD1-CZ 4.39Å; L437-F572 HydrophobicContact CD2-CD1 3.74Å; L437-F572 HydrophobicContact CD2-CD2 4.22Å; L437-F572 HydrophobicContact CD2-CE1 3.82Å; L437-F572 HydrophobicContact CD2-CE2 4.31Å; L437-F572 HydrophobicContact CD2-CG 3.95Å; L437-F572 HydrophobicContact CD2-CZ 4.13Å; L437-F572 HydrophobicContact CG-CD1 4.2Å; L437-F572 HydrophobicContact CG-CD2 4.04Å; L437-F572 HydrophobicContact CG-CE1 3.9Å; L437-F572 HydrophobicContact CG-CE2 3.75Å; L437-F572 HydrophobicContact CG-CG 4.27Å; L437-F572 HydrophobicContact CG-CZ 3.68Å; L437-F572 WeakPolarHBondContact O-CZ 3.42Å; L437-F613 HydrophobicContact CD1-CD1 4.41Å; L437-F613 HydrophobicContact CD1-CE1 3.97Å
438	I	89.5	Confident	88	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	19%	0.186	C	C	.	.	S	Bend	trans	-80.8	72.5	-176.4	-51	-174.7	0	0	0	109.1	H422 F434 S435 I443 W520 L524 T567 F572	H422-I438 PolarHBondContact CE1-O 3.27Å; F434-I438 HydrophobicContact CD1-CB 3.92Å; F434-I438 HydrophobicContact CD1-CG2 3.61Å; F434-I438 HydrophobicContact CE1-CG2 3.85Å; S435-I438 PolarHBondContact O-N 2.99Å; I438-I443 HydrophobicContact CG2-CD1 4.47Å; I438-W520 HydrophobicContact CG2-CH2 4Å; I438-W520 HydrophobicContact CG2-CZ3 3.97Å; I438-L524 HydrophobicContact CG2-CD2 3.66Å; I438-T567 VanDerWaalsContact CD1-O 3.27Å; I438-T567 WeakPolarHBondContact CD1-O 3.34Å; I438-F572 HydrophobicContact CG1-CE1 4.14Å; I438-F572 HydrophobicContact CG1-CZ 4.42Å
439	S	89.6	Confident	88.7	Confident	21 Å²	21	33.9 Å²	33.9	15%	0.147	18%	0.184	C	C	.	.			trans	-122.4	144.1	176.7	65.7	0	0	0	0	110.1	R419 L437 S441 L442 I443	R419-S439 PolarHBondContact NH1-OG 3.35Å; L437-S439 PolarHBondContact O-N 3.4Å; S439-S441 VanDerWaalsContact C-N 3.26Å; S439-S441 PolarHBondContact O-N 2.84Å; S439-L442 PolarHBondContact O-N 2.88Å; S439-L442 VanDerWaalsContact O-N 3.1Å; S439-L442 WeakPolarHBondContact OG-CB 3.45Å; S439-L442 WeakPolarHBondContact OG-CD1 3.43Å; S439-L442 VanDerWaalsContact OG-CG 3.26Å; S439-L442 WeakPolarHBondContact OG-CG 3.42Å; S439-I443 WeakPolarHBondContact O-CG1 3.39Å; S439-I443 PolarHBondContact O-N 3.13Å; S439-I443 VanDerWaalsContact O-N 3.08Å
440	K	89.3	Confident	89.5	Confident	57 Å²	57	32.5 Å²	32.5	25%	0.248	18%	0.178	C	C	.	.	H	α-helix	trans	-55.4	-40.8	-176.9	-173.2	170.9	179.3	160.8	0	112.6	L442 I443 L444 I503 N504 W520	K440-L442 PolarHBondContact O-N 2.89Å; K440-I443 PolarHBondContact O-N 2.92Å; K440-L444 HydrophobicContact CG-CD1 4.33Å; K440-L444 VanDerWaalsContact O-CG 3.3Å; K440-L444 WeakPolarHBondContact O-CG 3.22Å; K440-L444 PolarHBondContact O-N 3.09Å; K440-I503 PolarHBondContact NZ-O 3.28Å; K440-N504 WeakPolarHBondContact CE-OD1 3.3Å; K440-N504 PolarHBondContact NZ-OD1 3.29Å; K440-W520 HydrophobicContact CB-CZ2 3.83Å
441	S	90.2	Very high	89.9	Confident	66 Å²	66	35.9 Å²	35.9	46%	0.462	18%	0.182	S	C	.	.	H	α-helix	trans	-62.6	-40.5	179.2	51.9	0	0	0	0	112.9	S439 L444 E445	S439-S441 VanDerWaalsContact C-N 3.26Å; S439-S441 PolarHBondContact O-N 2.84Å; S441-L444 PolarHBondContact O-N 3.4Å; S441-E445 WeakPolarHBondContact O-CB 3.16Å; S441-E445 PolarHBondContact O-N 3.3Å
442	L	90.5	Very high	90.2	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-70.8	-36.9	177.9	-69.9	-178.7	0	0	0	112.1	A416 L437 S439 K440 L444 E445 L446 F572 N612 F613	A416-L442 HydrophobicContact CB-CD1 3.69Å; L437-L442 HydrophobicContact CD1-CD1 4.4Å; L437-L442 WeakPolarHBondContact O-CD1 3.34Å; S439-L442 PolarHBondContact O-N 2.88Å; S439-L442 VanDerWaalsContact O-N 3.1Å; S439-L442 WeakPolarHBondContact OG-CB 3.45Å; S439-L442 WeakPolarHBondContact OG-CD1 3.43Å; S439-L442 VanDerWaalsContact OG-CG 3.26Å; S439-L442 WeakPolarHBondContact OG-CG 3.42Å; K440-L442 PolarHBondContact O-N 2.89Å; L442-L444 VanDerWaalsContact C-N 3.34Å; L442-E445 PolarHBondContact O-N 3.16Å; L442-L446 WeakPolarHBondContact O-CB 3.38Å; L442-L446 PolarHBondContact O-N 3.43Å; L442-F572 HydrophobicContact CB-CE2 4.44Å; L442-N612 HydrophobicContact CD2-CB 3.65Å; L442-F613 HydrophobicContact CB-CE1 3.97Å; L442-F613 HydrophobicContact CB-CE2 4.43Å; L442-F613 HydrophobicContact CB-CZ 3.55Å; L442-F613 HydrophobicContact CD1-CE1 4.09Å; L442-F613 HydrophobicContact CD1-CZ 4.47Å; L442-F613 HydrophobicContact CD2-CD1 4.33Å; L442-F613 HydrophobicContact CD2-CD2 4.42Å; L442-F613 HydrophobicContact CD2-CE1 3.82Å; L442-F613 HydrophobicContact CD2-CE2 3.92Å; L442-F613 HydrophobicContact CD2-CZ 3.62Å; L442-F613 HydrophobicContact CG-CE1 4.15Å; L442-F613 HydrophobicContact CG-CZ 4.03Å; L442-F613 WeakPolarHBondContact O-CZ 3.48Å
443	I	91.4	Very high	90.7	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-65.2	-39.5	175.8	-63.4	169.4	0	0	0	110.9	I438 S439 K440 L446 L447 L492 P493 I503 W520 F572	I438-I443 HydrophobicContact CG2-CD1 4.47Å; S439-I443 WeakPolarHBondContact O-CG1 3.39Å; S439-I443 PolarHBondContact O-N 3.13Å; S439-I443 VanDerWaalsContact O-N 3.08Å; K440-I443 PolarHBondContact O-N 2.92Å; I443-L446 PolarHBondContact O-N 3.29Å; I443-L447 WeakPolarHBondContact O-CB 3.4Å; I443-L447 PolarHBondContact O-N 3.29Å; I443-L492 HydrophobicContact CD1-CD2 3.85Å; I443-L492 HydrophobicContact CG1-CD2 4.01Å; I443-L492 HydrophobicContact CG2-CD2 4.02Å; I443-P493 HydrophobicContact CG2-CG 4.44Å; I443-I503 HydrophobicContact CG2-CD1 4.35Å; I443-W520 HydrophobicContact CD1-CE3 3.87Å; I443-W520 HydrophobicContact CD1-CH2 3.68Å; I443-W520 HydrophobicContact CD1-CZ3 3.25Å; I443-F572 HydrophobicContact CG1-CZ 4.2Å
444	L	92.6	Very high	90.8	Very high	53 Å²	53	29.3 Å²	29.3	28%	0.277	15%	0.145	S	C	.	.	H	α-helix	trans	-67	-40.8	175.1	-67.4	178.8	0	0	0	112.2	K440 S441 L442 L446 L447 D448 L500 I503	K440-L444 HydrophobicContact CG-CD1 4.33Å; K440-L444 VanDerWaalsContact O-CG 3.3Å; K440-L444 WeakPolarHBondContact O-CG 3.22Å; K440-L444 PolarHBondContact O-N 3.09Å; S441-L444 PolarHBondContact O-N 3.4Å; L442-L444 VanDerWaalsContact C-N 3.34Å; L444-L446 VanDerWaalsContact C-N 3.33Å; L444-L447 PolarHBondContact O-N 3.47Å; L444-D448 PolarHBondContact O-N 3.46Å; L444-L500 HydrophobicContact CD2-CD1 3.28Å; L444-I503 HydrophobicContact CD2-CD1 4.34Å; L444-I503 HydrophobicContact CD2-CG2 3.98Å
445	E	90.4	Very high	91	Very high	34 Å²	34	34.4 Å²	34.4	16%	0.159	17%	0.172	C	C	.	.	H	α-helix	trans	-63.5	-39.7	174.6	-171.9	177.4	159.7	0	0	111.2	S441 L442 D448 L449 Y605 N612 F613	S441-E445 WeakPolarHBondContact O-CB 3.16Å; S441-E445 PolarHBondContact O-N 3.3Å; L442-E445 PolarHBondContact O-N 3.16Å; E445-D448 PolarHBondContact O-N 3.32Å; E445-L449 PolarHBondContact O-N 2.91Å; E445-Y605 VanDerWaalsContact CD-OH 3.24Å; E445-Y605 WeakPolarHBondContact CG-OH 3.4Å; E445-Y605 PolarHBondContact OE1-OH 3.38Å; E445-N612 PolarHBondContact OE1-N 3.41Å; E445-N612 PolarHBondContact OE2-ND2 3.13Å; E445-F613 HydrophobicContact CB-CE2 4.04Å; E445-F613 HydrophobicContact CG-CD2 4.34Å; E445-F613 HydrophobicContact CG-CE2 3.94Å
446	L	91.8	Very high	91.2	Very high	1 Å²	1	33.7 Å²	33.7	1%	0.005	17%	0.166	C	C	.	.	H	α-helix	trans	-63.8	-42.9	173.2	178.9	63.3	0	0	0	112.2	L414 L442 I443 L444 L449 Q450 P493 F572 L574	L414-L446 HydrophobicContact CD1-CD1 3.84Å; L414-L446 HydrophobicContact CD2-CD1 4.27Å; L442-L446 WeakPolarHBondContact O-CB 3.38Å; L442-L446 PolarHBondContact O-N 3.43Å; I443-L446 PolarHBondContact O-N 3.29Å; L444-L446 VanDerWaalsContact C-N 3.33Å; L446-L449 PolarHBondContact O-N 3.45Å; L446-Q450 WeakPolarHBondContact O-CB 3.21Å; L446-Q450 PolarHBondContact O-N 3.29Å; L446-P493 HydrophobicContact CD2-CG 4.07Å; L446-P493 HydrophobicContact CG-CG 4.19Å; L446-F572 HydrophobicContact CD2-CB 4.24Å; L446-F572 HydrophobicContact CD2-CD2 3.92Å; L446-F572 HydrophobicContact CD2-CG 4.18Å; L446-L574 HydrophobicContact CD1-CD2 4.32Å
447	L	93.2	Very high	91.5	Very high	5 Å²	5	40 Å²	40	3%	0.026	19%	0.193	C	C	.	.	H	α-helix	trans	-63.8	-40.6	176.9	178.3	61.9	0	0	0	111.6	I443 L444 Q450 R451 P493 N498 I503	I443-L447 WeakPolarHBondContact O-CB 3.4Å; I443-L447 PolarHBondContact O-N 3.29Å; L444-L447 PolarHBondContact O-N 3.47Å; L447-Q450 PolarHBondContact O-N 2.86Å; L447-R451 HydrophobicContact CD1-CG 4.39Å; L447-R451 WeakPolarHBondContact O-CG 3.37Å; L447-R451 PolarHBondContact O-N 3.4Å; L447-P493 HydrophobicContact CB-CB 4.44Å; L447-P493 HydrophobicContact CB-CG 4.29Å; L447-P493 HydrophobicContact CD1-CB 4Å; L447-N498 HydrophobicContact CD1-CB 4.07Å; L447-I503 HydrophobicContact CD2-CD1 3.9Å
448	D	92.4	Very high	91.6	Very high	78 Å²	78	41 Å²	41	42%	0.417	20%	0.198	S	C	.	.	H	α-helix	trans	-64.5	-42.8	176.4	-167	36	0	0	0	111.2	L444 E445 R451 R452	L444-D448 PolarHBondContact O-N 3.46Å; E445-D448 PolarHBondContact O-N 3.32Å; D448-R451 PolarHBondContact O-N 3.23Å; D448-R452 VanDerWaalsContact O-CG 3.29Å; D448-R452 WeakPolarHBondContact O-CG 3.47Å; D448-R452 PolarHBondContact O-N 2.91Å; D448-R452 IonicContact OD1-NE 2.88Å; D448-R452 IonicContact OD2-CZ 3.06Å; D448-R452 IonicContact OD2-NE 3.48Å; D448-R452 PolarHBondContact OD2-NE 3.41Å; D448-R452 IonicContact OD2-NH2 3.72Å; D448-R452 PolarHBondContact OD2-NH2 3.22Å
449	L	91.1	Very high	91.7	Very high	3 Å²	3	48.1 Å²	48.1	2%	0.016	23%	0.225	C	C	.	.	H	α-helix	trans	-61.1	-44.9	173.4	179.4	62.2	0	0	0	111.9	L412 L414 E445 L446 R451 R452 I453 Y605	L412-L449 HydrophobicContact CD2-CD2 4.18Å; L414-L449 HydrophobicContact CD2-CD2 4.13Å; E445-L449 PolarHBondContact O-N 2.91Å; L446-L449 PolarHBondContact O-N 3.45Å; L449-R451 PolarHBondContact O-N 2.97Å; L449-R452 PolarHBondContact O-N 3.17Å; L449-I453 HydrophobicContact CD1-CD1 4.1Å; L449-I453 HydrophobicContact CG-CD1 4.04Å; L449-I453 WeakPolarHBondContact O-CG1 3.4Å; L449-I453 PolarHBondContact O-N 2.97Å; L449-I453 VanDerWaalsContact O-N 3.15Å; L449-Y605 HydrophobicContact CD1-CD2 3.96Å; L449-Y605 HydrophobicContact CD1-CE2 4.36Å; L449-Y605 HydrophobicContact CD1-CG 4.12Å
450	Q	93.7	Very high	91.6	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-60.2	-46.3	178.3	-176.2	-175.3	-54.5	0	0	111.5	L446 L447 I453 Q454 V489 S491 N498 L574 F576	L446-Q450 WeakPolarHBondContact O-CB 3.21Å; L446-Q450 PolarHBondContact O-N 3.29Å; L447-Q450 PolarHBondContact O-N 2.86Å; Q450-I453 PolarHBondContact O-N 2.89Å; Q450-Q454 WeakPolarHBondContact O-CG 3.17Å; Q450-Q454 PolarHBondContact O-N 3.02Å; Q450-V489 HydrophobicContact CG-CG1 4.16Å; Q450-S491 VanDerWaalsContact OE1-CB 3.29Å; Q450-S491 PolarHBondContact OE1-OG 2.97Å; Q450-N498 PolarHBondContact NE2-ND2 2.86Å; Q450-N498 PolarHBondContact NE2-OD1 3.4Å; Q450-L574 HydrophobicContact CB-CD2 4.48Å; Q450-L574 HydrophobicContact CG-CD1 4.13Å; Q450-F576 HydrophobicContact CG-CZ 4.15Å
451	R	92.9	Very high	91.4	Very high	100 Å²	100	52.3 Å²	52.3	38%	0.377	24%	0.243	S	C	.	.	H	α-helix	trans	-61.7	-44.9	178.3	-74.6	178.9	179.4	-173.3	-1.7	111.9	L447 D448 L449 I453 Q454 D455 N498	L447-R451 HydrophobicContact CD1-CG 4.39Å; L447-R451 WeakPolarHBondContact O-CG 3.37Å; L447-R451 PolarHBondContact O-N 3.4Å; D448-R451 PolarHBondContact O-N 3.23Å; L449-R451 PolarHBondContact O-N 2.97Å; R451-I453 PolarHBondContact O-N 2.87Å; R451-Q454 PolarHBondContact O-N 2.9Å; R451-D455 WeakPolarHBondContact O-CB 3.35Å; R451-D455 PolarHBondContact O-N 3.17Å; R451-N498 PolarHBondContact NH2-O 3.15Å
452	R	92.3	Very high	91.1	Very high	136 Å²	136	52.5 Å²	52.5	51%	0.513	24%	0.239	S	C	.	.	H	α-helix	trans	-57.3	-34.9	175.4	-70.9	174.2	-165.1	-146	8.2	113.1	D448 L449	D448-R452 VanDerWaalsContact O-CG 3.29Å; D448-R452 WeakPolarHBondContact O-CG 3.47Å; D448-R452 PolarHBondContact O-N 2.91Å; D448-R452 IonicContact OD1-NE 2.88Å; D448-R452 IonicContact OD2-CZ 3.06Å; D448-R452 IonicContact OD2-NE 3.48Å; D448-R452 PolarHBondContact OD2-NE 3.41Å; D448-R452 IonicContact OD2-NH2 3.72Å; D448-R452 PolarHBondContact OD2-NH2 3.22Å; L449-R452 PolarHBondContact O-N 3.17Å
453	I	92.9	Very high	90.7	Very high	0 Å²	0	55 Å²	55	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-76.7	-36.4	176.5	-65.7	163.3	0	0	0	111.3	L412 L449 Q450 R451 D455 I456 L574 F576 W594 F598 I601 V602	L412-I453 HydrophobicContact CD2-CD1 4.46Å; L449-I453 HydrophobicContact CD1-CD1 4.1Å; L449-I453 HydrophobicContact CG-CD1 4.04Å; L449-I453 WeakPolarHBondContact O-CG1 3.4Å; L449-I453 PolarHBondContact O-N 2.97Å; L449-I453 VanDerWaalsContact O-N 3.15Å; Q450-I453 PolarHBondContact O-N 2.89Å; R451-I453 PolarHBondContact O-N 2.87Å; I453-D455 VanDerWaalsContact C-N 3.3Å; I453-D455 PolarHBondContact O-N 2.62Å; I453-I456 HydrophobicContact CG2-CD1 4.06Å; I453-I456 VanDerWaalsContact O-CD1 3.25Å; I453-I456 WeakPolarHBondContact O-CD1 3.4Å; I453-I456 WeakPolarHBondContact O-CG1 3.47Å; I453-I456 PolarHBondContact O-N 3.23Å; I453-L574 HydrophobicContact CD1-CD2 4.49Å; I453-F576 HydrophobicContact CB-CE1 4.4Å; I453-F576 HydrophobicContact CB-CE2 4.27Å; I453-F576 HydrophobicContact CB-CZ 3.79Å; I453-F576 HydrophobicContact CD1-CE2 4.08Å; I453-F576 HydrophobicContact CD1-CZ 4.32Å; I453-F576 HydrophobicContact CG2-CD1 4.31Å; I453-F576 HydrophobicContact CG2-CD2 4.27Å; I453-F576 HydrophobicContact CG2-CE1 3.74Å; I453-F576 HydrophobicContact CG2-CE2 3.68Å; I453-F576 HydrophobicContact CG2-CZ 3.39Å; I453-W594 HydrophobicContact CG2-CH2 4.02Å; I453-W594 HydrophobicContact CG2-CZ2 3.95Å; I453-F598 HydrophobicContact CD1-CD2 4.35Å; I453-F598 HydrophobicContact CD1-CE2 4.07Å; I453-F598 HydrophobicContact CG1-CD2 4.41Å; I453-F598 HydrophobicContact CG2-CD2 3.73Å; I453-F598 HydrophobicContact CG2-CE2 4.17Å; I453-I601 HydrophobicContact CG1-CG2 4.28Å; I453-V602 HydrophobicContact CD1-CG2 4.38Å
454	Q	91.9	Very high	90.5	Very high	24 Å²	24	61 Å²	61	11%	0.112	28%	0.284	C	S	.	.	H	α-helix	trans	-66.3	-33.8	176.2	-72.2	175.9	-53.7	0	0	112.2	Q450 R451 I456 L469 F576	Q450-Q454 WeakPolarHBondContact O-CG 3.17Å; Q450-Q454 PolarHBondContact O-N 3.02Å; R451-Q454 PolarHBondContact O-N 2.9Å; Q454-I456 PolarHBondContact O-N 3.14Å; Q454-L469 HydrophobicContact CB-CD2 4.28Å; Q454-L469 HydrophobicContact CG-CD2 4.03Å; Q454-F576 HydrophobicContact CG-CE1 3.95Å
455	D	92.7	Very high	90.4	Very high	109 Å²	109	64.2 Å²	64.2	58%	0.583	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	16.9	-179.3	-63.9	-22.8	0	0	0	113.7	R451 I453 E457	R451-D455 WeakPolarHBondContact O-CB 3.35Å; R451-D455 PolarHBondContact O-N 3.17Å; I453-D455 VanDerWaalsContact C-N 3.3Å; I453-D455 PolarHBondContact O-N 2.62Å; D455-E457 PolarHBondContact O-N 3.42Å
456	I	92.6	Very high	90.4	Very high	9 Å²	9	66.5 Å²	66.5	5%	0.046	31%	0.309	C	S	.	.			trans	-65.7	122.6	174.8	-68.9	169.1	0	0	0	110	I453 Q454 F458 W594 E597 F598 I601	I453-I456 HydrophobicContact CG2-CD1 4.06Å; I453-I456 VanDerWaalsContact O-CD1 3.25Å; I453-I456 WeakPolarHBondContact O-CD1 3.4Å; I453-I456 WeakPolarHBondContact O-CG1 3.47Å; I453-I456 PolarHBondContact O-N 3.23Å; Q454-I456 PolarHBondContact O-N 3.14Å; I456-F458 HydrophobicContact CG2-CD1 4.2Å; I456-W594 HydrophobicContact CD1-CZ2 4.04Å; I456-E597 HydrophobicContact CG2-CB 3.89Å; I456-F598 HydrophobicContact CD1-CB 4.24Å; I456-I601 HydrophobicContact CD1-CD1 3.71Å; I456-I601 HydrophobicContact CG1-CD1 3.49Å; I456-I601 VanDerWaalsContact CG1-CD1 3.49Å
457	E	92.2	Very high	90.3	Very high	140 Å²	140	66.5 Å²	66.5	65%	0.654	31%	0.309	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.5	133.9	172.9	-52.5	-167.2	150.7	0	0	110.1	D455 T468	D455-E457 PolarHBondContact O-N 3.42Å; E457-T468 HydrophobicContact CB-CG2 4.39Å; E457-T468 HydrophobicContact CG-CG2 3.81Å
458	F	91.5	Very high	90.2	Very high	25 Å²	25	67 Å²	67	11%	0.11	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	154.1	174	63.4	-87.1	0	0	0	111.4	I456 S460 T466 A467 V590 Q593 W594 E597	I456-F458 HydrophobicContact CG2-CD1 4.2Å; F458-S460 PolarHBondContact O-N 3.38Å; F458-T466 CarbonylContact O-C 3.54Å; F458-T466 WeakPolarHBondContact O-CA 3.26Å; F458-A467 HydrophobicContact CD2-CB 4.5Å; F458-A467 HydrophobicContact CE1-CB 4.24Å; F458-A467 HydrophobicContact CE2-CB 3.96Å; F458-A467 HydrophobicContact CZ-CB 3.82Å; F458-A467 PolarHBondContact N-O 3.41Å; F458-A467 VanDerWaalsContact N-O 3.15Å; F458-A467 PolarHBondContact O-N 3.16Å; F458-V590 HydrophobicContact CE2-CG1 4.17Å; F458-V590 HydrophobicContact CZ-CG1 3.78Å; F458-V590 WeakPolarHBondContact CZ-O 3.48Å; F458-Q593 HydrophobicContact CD2-CB 4.18Å; F458-Q593 HydrophobicContact CE2-CB 3.54Å; F458-Q593 HydrophobicContact CE2-CG 4.47Å; F458-Q593 VanDerWaalsContact CE2-OE1 3.28Å; F458-Q593 HydrophobicContact CZ-CB 3.8Å; F458-W594 HydrophobicContact CE1-CB 3.68Å; F458-W594 AromaticContact CE1-CD1 3.97Å; F458-W594 HydrophobicContact CE1-CG 4.24Å; F458-W594 HydrophobicContact CZ-CB 4.09Å; F458-E597 HydrophobicContact CD1-CG 4.49Å
459	W	90.3	Very high	90.1	Very high	149 Å²	149	63.3 Å²	63.3	56%	0.564	29%	0.292	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.9	121.2	175.1	-178.1	-99.7	0	0	0	110.5	N464 T466	W459-N464 WeakPolarHBondContact CZ2-OD1 3.43Å; W459-T466 HydrophobicContact CE3-CG2 3.99Å; W459-T466 HydrophobicContact CZ3-CG2 4.5Å
460	S	88.2	Confident	90	Very high	0 Å²	0	67.7 Å²	67.7	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	118.8	175.3	178.1	0	0	0	0	110.5	F458 D462 L463 N464 R465 V590	F458-S460 PolarHBondContact O-N 3.38Å; S460-D462 VanDerWaalsContact C-N 3.32Å; S460-L463 PolarHBondContact OG-N 3.2Å; S460-N464 WeakPolarHBondContact O-CA 3.18Å; S460-N464 PolarHBondContact O-N 3.3Å; S460-R465 PolarHBondContact N-O 3.17Å; S460-V590 WeakPolarHBondContact OG-CG2 3.17Å
461	E	85.3	Confident	89.8	Confident	166 Å²	166	69.2 Å²	69.2	78%	0.776	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-36.9	173.7	-64.5	-173.8	172	0	0	112	N464	E461-N464 PolarHBondContact O-N 3.32Å
462	D	82.4	Confident	89.6	Confident	71 Å²	71	64.5 Å²	64.5	38%	0.38	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-32.9	-178.4	-66.7	-60	0	0	0	112.7	S460 P586 K589	S460-D462 VanDerWaalsContact C-N 3.32Å; D462-P586 HydrophobicContact CB-CB 4.15Å; D462-K589 IonicContact OD1-NZ 3.09Å; D462-K589 VanDerWaalsContact OD2-CD 3.31Å; D462-K589 WeakPolarHBondContact OD2-CD 3.48Å
463	L	82.2	Confident	89.7	Confident	52 Å²	52	58.2 Å²	58.2	27%	0.272	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.1	-9.5	177.6	-65.6	176.2	0	0	0	113.7	S460 R465 A467 V590	S460-L463 PolarHBondContact OG-N 3.2Å; L463-R465 HydrophobicContact CB-CG 4Å; L463-R465 PolarHBondContact O-N 3.29Å; L463-A467 HydrophobicContact CD1-CB 4.45Å; L463-V590 HydrophobicContact CD1-CB 4.44Å; L463-V590 HydrophobicContact CD1-CG1 4.01Å; L463-V590 HydrophobicContact CD1-CG2 3.74Å; L463-V590 HydrophobicContact CG-CG2 3.88Å
464	N	87.7	Confident	89.6	Confident	126 Å²	126	60.7 Å²	60.7	67%	0.674	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	51	36.3	-175.6	-159.7	23.4	0	0	0	113.9	W459 S460 E461	W459-N464 WeakPolarHBondContact CZ2-OD1 3.43Å; S460-N464 WeakPolarHBondContact O-CA 3.18Å; S460-N464 PolarHBondContact O-N 3.3Å; E461-N464 PolarHBondContact O-N 3.32Å
465	R	90.9	Very high	89.6	Confident	121 Å²	121	59.9 Å²	59.9	46%	0.457	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155	166.4	177.8	67.9	-177	-174.6	160.8	8.6	110.6	S460 L463 A467 D471	S460-R465 PolarHBondContact N-O 3.17Å; L463-R465 HydrophobicContact CB-CG 4Å; L463-R465 PolarHBondContact O-N 3.29Å; R465-A467 PolarHBondContact O-N 3.35Å; R465-D471 IonicContact CZ-OD1 2.74Å; R465-D471 IonicContact NH2-OD1 3.25Å; R465-D471 PolarHBondContact NH2-OD1 3.43Å; R465-D471 IonicContact NH2-OD2 3.44Å; R465-D471 PolarHBondContact NH2-OD2 2.94Å
466	T	90.5	Very high	89.2	Confident	81 Å²	81	55.3 Å²	55.3	50%	0.497	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	115.5	168	49.6	0	0	0	0	109.4	F458 W459	F458-T466 CarbonylContact O-C 3.54Å; F458-T466 WeakPolarHBondContact O-CA 3.26Å; W459-T466 HydrophobicContact CE3-CG2 3.99Å; W459-T466 HydrophobicContact CZ3-CG2 4.5Å
467	A	90	Very high	88.9	Confident	1 Å²	1	56.2 Å²	56.2	1%	0.008	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	140.2	174.6	0	0	0	0	0	109.6	F458 L463 R465 D471 V590	F458-A467 HydrophobicContact CD2-CB 4.5Å; F458-A467 HydrophobicContact CE1-CB 4.24Å; F458-A467 HydrophobicContact CE2-CB 3.96Å; F458-A467 HydrophobicContact CZ-CB 3.82Å; F458-A467 PolarHBondContact N-O 3.41Å; F458-A467 VanDerWaalsContact N-O 3.15Å; F458-A467 PolarHBondContact O-N 3.16Å; L463-A467 HydrophobicContact CD1-CB 4.45Å; R465-A467 PolarHBondContact O-N 3.35Å; A467-D471 WeakPolarHBondContact CA-OD2 3.04Å; A467-V590 HydrophobicContact CB-CG1 3.77Å
468	T	91.4	Very high	88.6	Confident	15 Å²	15	52.4 Å²	52.4	9%	0.092	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	175.7	174.9	77.6	0	0	0	0	110.7	E457 K470 D471	E457-T468 HydrophobicContact CB-CG2 4.39Å; E457-T468 HydrophobicContact CG-CG2 3.81Å; T468-K470 PolarHBondContact O-N 3.36Å; T468-K470 VanDerWaalsContact O-N 3.13Å; T468-K470 WeakPolarHBondContact OG1-CG 3.5Å; T468-D471 PolarHBondContact N-OD2 2.91Å; T468-D471 PolarHBondContact O-N 2.93Å
469	L	89.8	Confident	88.1	Confident	2 Å²	2	54.9 Å²	54.9	1%	0.01	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-51.8	-37.8	179.7	176.9	58.4	0	0	0	112.9	Q454 D471 V472 C473 L484 F576 L578 W594	Q454-L469 HydrophobicContact CB-CD2 4.28Å; Q454-L469 HydrophobicContact CG-CD2 4.03Å; L469-D471 PolarHBondContact O-N 3.25Å; L469-D471 VanDerWaalsContact O-N 3.13Å; L469-V472 WeakPolarHBondContact O-CG2 3.38Å; L469-V472 PolarHBondContact O-N 3.09Å; L469-V472 VanDerWaalsContact O-N 3.13Å; L469-C473 HydrophobicContact CD1-CB 3.79Å; L469-C473 HydrophobicContact CG-CB 4.02Å; L469-C473 VanDerWaalsContact O-CB 3.25Å; L469-C473 WeakPolarHBondContact O-CB 3.48Å; L469-C473 PolarHBondContact O-N 2.95Å; L469-L484 HydrophobicContact CB-CD2 4.16Å; L469-F576 HydrophobicContact CD2-CD1 4.46Å; L469-L578 HydrophobicContact CD1-CD2 3.78Å; L469-W594 HydrophobicContact CD1-CH2 4.31Å; L469-W594 HydrophobicContact CD1-CZ2 3.65Å
470	K	89.3	Confident	87.6	Confident	94 Å²	94	53.4 Å²	53.4	41%	0.409	28%	0.282	S	S	.	.	G	3₁₀ helix	trans	-60.7	-24.8	-178.8	78.9	-165.4	174.6	-177.8	0	114	T468 V472 P482 L484	T468-K470 PolarHBondContact O-N 3.36Å; T468-K470 VanDerWaalsContact O-N 3.13Å; T468-K470 WeakPolarHBondContact OG1-CG 3.5Å; K470-V472 VanDerWaalsContact C-N 3.31Å; K470-P482 VanDerWaalsContact O-CG 3.28Å; K470-P482 WeakPolarHBondContact O-CG 2.98Å; K470-L484 HydrophobicContact CB-CD2 4.25Å
471	D	88.2	Confident	87.4	Confident	32 Å²	32	59.6 Å²	59.6	17%	0.171	32%	0.315	C	S	.	.	G	3₁₀ helix	trans	-78.6	-19.3	-177.7	-67.7	-43.4	0	0	0	112.7	R465 A467 T468 L469	R465-D471 IonicContact CZ-OD1 2.74Å; R465-D471 IonicContact NH2-OD1 3.25Å; R465-D471 PolarHBondContact NH2-OD1 3.43Å; R465-D471 IonicContact NH2-OD2 3.44Å; R465-D471 PolarHBondContact NH2-OD2 2.94Å; A467-D471 WeakPolarHBondContact CA-OD2 3.04Å; T468-D471 PolarHBondContact N-OD2 2.91Å; T468-D471 PolarHBondContact O-N 2.93Å; L469-D471 PolarHBondContact O-N 3.25Å; L469-D471 VanDerWaalsContact O-N 3.13Å
472	V	90.1	Very high	87.5	Confident	2 Å²	2	53 Å²	53	1%	0.012	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-125.1	-17.9	-173.7	-67.1	0	0	0	0	113.9	L469 K470 L578 N579 V590 A591 W594	L469-V472 WeakPolarHBondContact O-CG2 3.38Å; L469-V472 PolarHBondContact O-N 3.09Å; L469-V472 VanDerWaalsContact O-N 3.13Å; K470-V472 VanDerWaalsContact C-N 3.31Å; V472-L578 HydrophobicContact CG2-CD2 4.09Å; V472-N579 PolarHBondContact O-N 3.26Å; V472-V590 HydrophobicContact CG1-CB 4.31Å; V472-V590 HydrophobicContact CG1-CG1 3.87Å; V472-A591 HydrophobicContact CG1-CB 4.31Å; V472-W594 HydrophobicContact CG2-CB 4.4Å; V472-W594 HydrophobicContact CG2-CG 4.22Å
473	C	92.8	Very high	87.8	Confident	4 Å²	4	51.9 Å²	51.9	3%	0.027	28%	0.284	C	S	.	.	B	Isolated β-bridge	trans	-67.2	151.6	-176	78.4	0	0	0	0	113.1	L469 C487 N579	L469-C473 HydrophobicContact CD1-CB 3.79Å; L469-C473 HydrophobicContact CG-CB 4.02Å; L469-C473 VanDerWaalsContact O-CB 3.25Å; L469-C473 WeakPolarHBondContact O-CB 3.48Å; L469-C473 PolarHBondContact O-N 2.95Å; C473-C487 HydrophobicContact CB-CB 3.58Å; C473-C487 WeakPolarHBondContact CB-SG 3.07Å; C473-C487 VanDerWaalsContact SG-CA 3.57Å; C473-C487 WeakPolarHBondContact SG-CB 3.41Å; C473-C487 CovalentContact SG-SG 2.04Å; C473-C487 PolarHBondContact SG-SG 3.21Å; C473-N579 PolarHBondContact O-ND2 3.41Å
474	Y	91.4	Very high	88	Confident	52 Å²	52	53 Å²	53	20%	0.204	29%	0.29	C	S	.	.			trans	-79.2	123.1	167.6	178.2	-103.7	0	0	0	109.5	P476 A488 S577 N579	Y474-P476 HydrophobicContact CE1-CB 4.1Å; Y474-A488 HydrophobicContact CD1-CB 3.96Å; Y474-A488 WeakPolarHBondContact O-CB 3.27Å; Y474-A488 PolarHBondContact O-N 3.05Å; Y474-S577 PolarHBondContact N-O 3.36Å; Y474-N579 WeakPolarHBondContact CD2-OD1 3.24Å
475	A	91.4	Very high	87.9	Confident	6 Å²	6	50.7 Å²	50.7	5%	0.05	28%	0.281	C	S	.	.			trans	-125.6	106.3	-179.1	0	0	0	0	0	110.1	P482 D486	A475-P482 HydrophobicContact CB-CB 3.78Å; A475-D486 WeakPolarHBondContact CA-O 3.27Å; A475-D486 HydrophobicContact CB-CB 4.17Å; A475-D486 WeakPolarHBondContact CB-O 3.41Å
476	P	86	Confident	87.8	Confident	13 Å²	13	46.4 Å²	46.4	8%	0.084	27%	0.267	C	S	.	.	S	Bend	trans	-73.6	-39.9	-170.2	26	-32.9	0	0	0	113.8	Y474 Y548 G1035	Y474-P476 HydrophobicContact CE1-CB 4.1Å; P476-Y548 HydrophobicContact CG-CD2 3.86Å; P476-Y548 HydrophobicContact CG-CE2 4.24Å; P476-G1035 WeakPolarHBondContact O-CA 3.24Å
477	L	85.8	Confident	87.9	Confident	28 Å²	28	42.6 Å²	42.6	15%	0.147	24%	0.244	C	C	.	.	S	Bend	trans	-88.1	-26.8	-175.1	-64.6	-174.4	0	0	0	113.9	Y548	L477-Y548 WeakPolarHBondContact CD1-O 3.44Å
478	N	85.8	Confident	88	Confident	60 Å²	60	42.9 Å²	42.9	32%	0.321	25%	0.246	S	C	.	.			trans	-136.6	69.8	-176.9	-175.4	16.4	0	0	0	111.8	S480 N481 D486	N478-S480 VanDerWaalsContact C-N 3.33Å; N478-S480 PolarHBondContact O-N 2.98Å; N478-N481 PolarHBondContact ND2-O 2.75Å; N478-D486 HydrophobicContact CB-CB 4.45Å; N478-D486 PolarHBondContact ND2-OD2 3.28Å
479	P	80.4	Confident	88.2	Confident	77 Å²	77	42.3 Å²	42.3	50%	0.5	24%	0.242	S	C	.	.			trans	-73.2	-20.8	-173.6	27.6	-35.2	0	0	0	114.1
480	S	80.1	Confident	88.4	Confident	119 Å²	119	43.1 Å²	43.1	83%	0.832	25%	0.247	S	C	*	.	S	Bend	trans	-83.6	-36.5	-172.6	-63.9	0	0	0	0	113.7	N478	N478-S480 VanDerWaalsContact C-N 3.33Å; N478-S480 PolarHBondContact O-N 2.98Å
481	N	84.6	Confident	88.6	Confident	129 Å²	129	38.6 Å²	38.6	69%	0.69	23%	0.227	S	C	*	.	S	Bend	trans	-144.8	73.8	178.2	-173.4	31.8	0	0	0	109.8	N478	N478-N481 PolarHBondContact ND2-O 2.75Å
482	P	86.2	Confident	88.9	Confident	28 Å²	28	37.1 Å²	37.1	18%	0.182	22%	0.219	C	C	.	.			trans	-70.6	138.9	-173	28.8	-35.3	0	0	0	111.6	K470 A475 D486	K470-P482 VanDerWaalsContact O-CG 3.28Å; K470-P482 WeakPolarHBondContact O-CG 2.98Å; A475-P482 HydrophobicContact CB-CB 3.78Å; P482-D486 HydrophobicContact CB-CB 4.39Å
483	S	88.8	Confident	89.1	Confident	48 Å²	48	37 Å²	37	34%	0.336	22%	0.218	S	C	.	.			trans	-88.3	169.5	161	68.2	0	0	0	0	110.7	T485 D486	S483-T485 PolarHBondContact O-N 3.22Å; S483-T485 PolarHBondContact OG-OG1 3.48Å; S483-D486 WeakPolarHBondContact CB-OD2 3.38Å; S483-D486 PolarHBondContact N-OD2 3.38Å; S483-D486 PolarHBondContact O-N 3.36Å; S483-D486 VanDerWaalsContact O-N 3.09Å; S483-D486 PolarHBondContact OG-OD2 2.99Å
484	L	85.9	Confident	89.2	Confident	75 Å²	75	36.8 Å²	36.8	39%	0.393	22%	0.217	S	C	.	.	G	3₁₀ helix	trans	-61.9	-30.5	177.4	-73	170.2	0	0	0	112.6	L469 K470 D486	L469-L484 HydrophobicContact CB-CD2 4.16Å; K470-L484 HydrophobicContact CB-CD2 4.25Å; L484-D486 VanDerWaalsContact C-N 3.29Å
485	T	86.8	Confident	89.3	Confident	77 Å²	77	34.3 Å²	34.3	47%	0.472	21%	0.207	S	C	.	.	G	3₁₀ helix	trans	-77	-15.4	177.3	53.9	0	0	0	0	112.9	S483 C487 Y548	S483-T485 PolarHBondContact O-N 3.22Å; S483-T485 PolarHBondContact OG-OG1 3.48Å; T485-C487 VanDerWaalsContact C-N 3.35Å; T485-Y548 WeakPolarHBondContact O-CA 3.47Å; T485-Y548 VanDerWaalsContact O-CB 3.24Å; T485-Y548 WeakPolarHBondContact O-CB 3.32Å; T485-Y548 PolarHBondContact O-N 2.89Å
486	D	89.5	Confident	89.4	Confident	31 Å²	31	34 Å²	34	17%	0.166	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-85.1	-11.5	176.9	-61.1	-44.9	0	0	0	112.4	A475 N478 P482 S483 L484	A475-D486 WeakPolarHBondContact CA-O 3.27Å; A475-D486 HydrophobicContact CB-CB 4.17Å; A475-D486 WeakPolarHBondContact CB-O 3.41Å; N478-D486 HydrophobicContact CB-CB 4.45Å; N478-D486 PolarHBondContact ND2-OD2 3.28Å; P482-D486 HydrophobicContact CB-CB 4.39Å; S483-D486 WeakPolarHBondContact CB-OD2 3.38Å; S483-D486 PolarHBondContact N-OD2 3.38Å; S483-D486 PolarHBondContact O-N 3.36Å; S483-D486 VanDerWaalsContact O-N 3.09Å; S483-D486 PolarHBondContact OG-OD2 2.99Å; L484-D486 VanDerWaalsContact C-N 3.29Å
487	C	92.1	Very high	89.7	Confident	2 Å²	2	35.8 Å²	35.8	1%	0.014	21%	0.212	C	C	.	.	S	Bend	trans	-73.4	132	-178.4	-66.6	0	0	0	0	111.6	C473 T485 V489	C473-C487 HydrophobicContact CB-CB 3.58Å; C473-C487 WeakPolarHBondContact CB-SG 3.07Å; C473-C487 VanDerWaalsContact SG-CA 3.57Å; C473-C487 WeakPolarHBondContact SG-CB 3.41Å; C473-C487 CovalentContact SG-SG 2.04Å; C473-C487 PolarHBondContact SG-SG 3.21Å; T485-C487 VanDerWaalsContact C-N 3.35Å; C487-V489 PolarHBondContact O-N 2.59Å
488	A	92	Very high	89.9	Confident	7 Å²	7	35.1 Å²	35.1	6%	0.058	21%	0.209	C	C	.	.			trans	-71.4	96.2	179.3	0	0	0	0	0	112	Y474 S577	Y474-A488 HydrophobicContact CD1-CB 3.96Å; Y474-A488 WeakPolarHBondContact O-CB 3.27Å; Y474-A488 PolarHBondContact O-N 3.05Å; A488-S577 PolarHBondContact O-N 2.79Å
489	V	94.6	Very high	90.2	Very high	2 Å²	2	33.6 Å²	33.6	1%	0.012	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	115.6	172	-177.4	0	0	0	0	108.2	Q450 C487 Q494 L574 T575 F576	Q450-V489 HydrophobicContact CG-CG1 4.16Å; C487-V489 PolarHBondContact O-N 2.59Å; V489-Q494 VanDerWaalsContact O-CG 3.23Å; V489-Q494 WeakPolarHBondContact O-CG 3.21Å; V489-Q494 PolarHBondContact O-NE2 2.78Å; V489-L574 HydrophobicContact CG1-CD1 3.92Å; V489-T575 WeakPolarHBondContact CA-O 3.48Å; V489-F576 HydrophobicContact CB-CD1 4.48Å; V489-F576 HydrophobicContact CB-CE1 4.44Å; V489-F576 HydrophobicContact CG1-CD1 4.12Å; V489-F576 HydrophobicContact CG1-CE1 3.79Å; V489-F576 HydrophobicContact CG1-CZ 4.09Å; V489-F576 HydrophobicContact CG2-CD1 3.66Å; V489-F576 HydrophobicContact CG2-CE1 3.74Å
490	N	94.3	Very high	90.7	Very high	19 Å²	19	33.4 Å²	33.4	10%	0.102	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	122.5	178.7	-67.2	-37.5	0	0	0	110	Y548 L574 T575	N490-Y548 PolarHBondContact OD1-OH 2.98Å; N490-L574 WeakPolarHBondContact O-CA 3.46Å; N490-T575 PolarHBondContact N-O 3.33Å; N490-T575 PolarHBondContact O-N 3.2Å
491	S	94.3	Very high	91.3	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	19%	0.189	C	C	.	.	S	Bend	trans	-163	168.7	-179	72.9	0	0	0	0	110.8	Q450 P493 Q494	Q450-S491 VanDerWaalsContact OE1-CB 3.29Å; Q450-S491 PolarHBondContact OE1-OG 2.97Å; S491-P493 WeakPolarHBondContact OG-CD 3.47Å; S491-Q494 WeakPolarHBondContact O-CB 3.42Å; S491-Q494 PolarHBondContact O-N 3.02Å
492	L	93.9	Very high	91.6	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	17%	0.168	C	C	.	.	G	3₁₀ helix	trans	-64.9	-41.2	173.9	-173.6	154.4	0	0	0	113.4	I443 Q494 Y495 F496 L524 V558 F572	I443-L492 HydrophobicContact CD1-CD2 3.85Å; I443-L492 HydrophobicContact CG1-CD2 4.01Å; I443-L492 HydrophobicContact CG2-CD2 4.02Å; L492-Q494 PolarHBondContact O-N 3.43Å; L492-Y495 HydrophobicContact CG-CD2 4.42Å; L492-Y495 WeakPolarHBondContact O-CD2 3.42Å; L492-Y495 PolarHBondContact O-N 3.47Å; L492-F496 HydrophobicContact CD2-CE2 4.3Å; L492-L524 HydrophobicContact CD1-CD1 4.12Å; L492-L524 HydrophobicContact CD1-CD2 4.3Å; L492-L524 HydrophobicContact CD2-CD1 4.05Å; L492-L524 HydrophobicContact CD2-CD2 4.5Å; L492-L524 HydrophobicContact CG-CD1 3.96Å; L492-V558 HydrophobicContact CD1-CG1 3.83Å; L492-F572 HydrophobicContact CD1-CD1 4.01Å; L492-F572 HydrophobicContact CD1-CE1 3.54Å; L492-F572 HydrophobicContact CD1-CZ 4.27Å
493	P	94.4	Very high	91.8	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	16%	0.16	C	C	.	.	G	3₁₀ helix	trans	-56.8	-17.5	174.9	-29	35	0	0	0	115.8	I443 L446 L447 S491 Y495 F496 Q497 N498	I443-P493 HydrophobicContact CG2-CG 4.44Å; L446-P493 HydrophobicContact CD2-CG 4.07Å; L446-P493 HydrophobicContact CG-CG 4.19Å; L447-P493 HydrophobicContact CB-CB 4.44Å; L447-P493 HydrophobicContact CB-CG 4.29Å; L447-P493 HydrophobicContact CD1-CB 4Å; S491-P493 WeakPolarHBondContact OG-CD 3.47Å; P493-Y495 VanDerWaalsContact C-N 3.27Å; P493-Y495 PolarHBondContact O-N 3.28Å; P493-F496 CarbonylContact O-C 3.32Å; P493-F496 PolarHBondContact O-N 3.28Å; P493-Q497 PolarHBondContact O-N 2.81Å; P493-N498 PolarHBondContact O-N 3.22Å; P493-N498 VanDerWaalsContact O-N 3.16Å
494	Q	94.1	Very high	92	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.163	C	C	.	.	G	3₁₀ helix	trans	-65.3	-26.3	176.6	-75.9	-70.7	12.7	0	0	114.2	V489 S491 L492 F496 Q497 N498 A546 D547 V552	V489-Q494 VanDerWaalsContact O-CG 3.23Å; V489-Q494 WeakPolarHBondContact O-CG 3.21Å; V489-Q494 PolarHBondContact O-NE2 2.78Å; S491-Q494 WeakPolarHBondContact O-CB 3.42Å; S491-Q494 PolarHBondContact O-N 3.02Å; L492-Q494 PolarHBondContact O-N 3.43Å; Q494-F496 PolarHBondContact O-N 3.11Å; Q494-F496 VanDerWaalsContact O-N 3.16Å; Q494-Q497 PolarHBondContact O-N 3.31Å; Q494-N498 VanDerWaalsContact CD-ND2 3.3Å; Q494-N498 PolarHBondContact NE2-ND2 2.9Å; Q494-N498 VanDerWaalsContact NE2-ND2 3.13Å; Q494-N498 PolarHBondContact OE1-ND2 3.07Å; Q494-A546 HydrophobicContact CB-CB 4.16Å; Q494-A546 HydrophobicContact CG-CB 4.34Å; Q494-D547 PolarHBondContact NE2-OD1 2.95Å; Q494-D547 PolarHBondContact OE1-OD1 3.45Å; Q494-V552 HydrophobicContact CB-CG2 3.81Å; Q494-V552 HydrophobicContact CG-CG2 4.4Å
495	Y	93.4	Very high	92.2	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	16%	0.158	C	C	.	.	G	3₁₀ helix	trans	-61.3	-22.8	171.7	-64.6	-57.4	0	0	0	112.1	L492 P493 Q497 H523 L524 C527 L528 S543 V552 A557	L492-Y495 HydrophobicContact CG-CD2 4.42Å; L492-Y495 WeakPolarHBondContact O-CD2 3.42Å; L492-Y495 PolarHBondContact O-N 3.47Å; P493-Y495 VanDerWaalsContact C-N 3.27Å; P493-Y495 PolarHBondContact O-N 3.28Å; Y495-Q497 PolarHBondContact O-NE2 2.94Å; Y495-Q497 VanDerWaalsContact O-NE2 3.16Å; Y495-H523 PolarHBondContact O-NE2 2.91Å; Y495-L524 HydrophobicContact CD2-CD1 3.87Å; Y495-L524 HydrophobicContact CE2-CD1 4.37Å; Y495-C527 HydrophobicContact CD1-CB 3.52Å; Y495-C527 HydrophobicContact CE1-CB 3.94Å; Y495-C527 HydrophobicContact CG-CB 3.92Å; Y495-L528 HydrophobicContact CE2-CD2 3.86Å; Y495-L528 HydrophobicContact CE2-CG 4.49Å; Y495-S543 VanDerWaalsContact O-O 3.11Å; Y495-V552 HydrophobicContact CE1-CB 4.14Å; Y495-V552 WeakPolarHBondContact CE1-O 3.29Å; Y495-V552 PolarHBondContact OH-O 3.5Å; Y495-A557 HydrophobicContact CE2-CB 4.32Å
496	F	93.8	Very high	92.4	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	16%	0.156	C	C	.	.	G	3₁₀ helix	trans	-105.2	17.1	175.9	-52.6	-82.9	0	0	0	112.5	L492 P493 Q494 N498 S499 N502 I503 W520 H523 L524 M542	L492-F496 HydrophobicContact CD2-CE2 4.3Å; P493-F496 CarbonylContact O-C 3.32Å; P493-F496 PolarHBondContact O-N 3.28Å; Q494-F496 PolarHBondContact O-N 3.11Å; Q494-F496 VanDerWaalsContact O-N 3.16Å; F496-N498 PolarHBondContact O-N 3.27Å; F496-N498 VanDerWaalsContact O-N 3.13Å; F496-S499 WeakPolarHBondContact O-CB 3.24Å; F496-S499 PolarHBondContact O-N 3.45Å; F496-N502 HydrophobicContact CB-CB 4.14Å; F496-N502 PolarHBondContact O-ND2 3.11Å; F496-I503 HydrophobicContact CB-CD1 4.3Å; F496-I503 HydrophobicContact CB-CG1 3.66Å; F496-I503 HydrophobicContact CD1-CG1 4.02Å; F496-I503 HydrophobicContact CD2-CD1 4.38Å; F496-I503 HydrophobicContact CD2-CG1 3.84Å; F496-I503 HydrophobicContact CE2-CG1 4.5Å; F496-I503 HydrophobicContact CG-CD1 4.42Å; F496-I503 HydrophobicContact CG-CG1 3.56Å; F496-W520 HydrophobicContact CE1-CB 3.78Å; F496-W520 HydrophobicContact CZ-CB 3.91Å; F496-W520 HydrophobicContact CZ-CE3 4.31Å; F496-H523 AromaticContact CD1-CD2 3.75Å; F496-H523 HydrophobicContact CE1-CB 4.29Å; F496-H523 AromaticContact CE1-CD2 3.4Å; F496-H523 WeakPolarHBondContact CE1-CD2 3.39Å; F496-L524 HydrophobicContact CZ-CB 4.24Å; F496-M542 HydrophobicContact CD1-CE 4.45Å
497	Q	92.3	Very high	92.4	Very high	50 Å²	50	29.9 Å²	29.9	23%	0.234	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.2	37.2	-178.5	-59.5	73.4	40.7	0	0	112.7	P493 Q494 Y495 S499 N502 S543 M545	P493-Q497 PolarHBondContact O-N 2.81Å; Q494-Q497 PolarHBondContact O-N 3.31Å; Y495-Q497 PolarHBondContact O-NE2 2.94Å; Y495-Q497 VanDerWaalsContact O-NE2 3.16Å; Q497-S499 PolarHBondContact O-N 2.81Å; Q497-N502 PolarHBondContact OE1-ND2 3.25Å; Q497-S543 PolarHBondContact NE2-O 3.2Å; Q497-M545 PolarHBondContact NE2-O 3.19Å
498	N	91.3	Very high	92.2	Very high	13 Å²	13	35 Å²	35	7%	0.07	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.2	20.4	-179.1	-57.4	-43.4	0	0	0	114.5	L447 Q450 R451 P493 Q494 F496 D547	L447-N498 HydrophobicContact CD1-CB 4.07Å; Q450-N498 PolarHBondContact NE2-ND2 2.86Å; Q450-N498 PolarHBondContact NE2-OD1 3.4Å; R451-N498 PolarHBondContact NH2-O 3.15Å; P493-N498 PolarHBondContact O-N 3.22Å; P493-N498 VanDerWaalsContact O-N 3.16Å; Q494-N498 VanDerWaalsContact CD-ND2 3.3Å; Q494-N498 PolarHBondContact NE2-ND2 2.9Å; Q494-N498 VanDerWaalsContact NE2-ND2 3.13Å; Q494-N498 PolarHBondContact OE1-ND2 3.07Å; F496-N498 PolarHBondContact O-N 3.27Å; F496-N498 VanDerWaalsContact O-N 3.13Å; N498-D547 PolarHBondContact ND2-OD2 3.43Å
499	S	91.5	Very high	91.8	Very high	29 Å²	29	35.5 Å²	35.5	20%	0.203	19%	0.192	C	C	.	.			trans	-96.5	129.9	-177.9	178	0	0	0	0	112.4	F496 Q497 D501 N502 I503	F496-S499 WeakPolarHBondContact O-CB 3.24Å; F496-S499 PolarHBondContact O-N 3.45Å; Q497-S499 PolarHBondContact O-N 2.81Å; S499-D501 VanDerWaalsContact C-N 3.31Å; S499-D501 PolarHBondContact OG-N 3.05Å; S499-N502 PolarHBondContact OG-N 3.21Å; S499-I503 WeakPolarHBondContact O-CG1 3.35Å; S499-I503 PolarHBondContact O-N 2.88Å
500	L	91.3	Very high	91.2	Very high	73 Å²	73	39.4 Å²	39.4	38%	0.382	22%	0.216	S	C	.	.	H	α-helix	trans	-69.5	-33.5	174.7	-177.9	64.2	0	0	0	111.5	L444 I503 N504	L444-L500 HydrophobicContact CD2-CD1 3.28Å; L500-I503 PolarHBondContact O-N 2.95Å; L500-N504 WeakPolarHBondContact O-CB 3.46Å; L500-N504 PolarHBondContact O-N 3.41Å; L500-N504 VanDerWaalsContact O-N 3.09Å; L500-N504 PolarHBondContact O-ND2 3.24Å
501	D	91.4	Very high	90.3	Very high	123 Å²	123	40.6 Å²	40.6	66%	0.658	22%	0.22	S	C	*	.	H	α-helix	trans	-67.9	-41.8	-178.9	-60.4	-35.8	0	0	0	110.2	S499 I503 N504 A505	S499-D501 VanDerWaalsContact C-N 3.31Å; S499-D501 PolarHBondContact OG-N 3.05Å; D501-I503 PolarHBondContact O-N 3.45Å; D501-N504 CarbonylContact O-C 3.6Å; D501-N504 PolarHBondContact O-N 3.11Å; D501-N504 VanDerWaalsContact O-N 3.13Å; D501-A505 PolarHBondContact O-N 3.03Å
502	N	91	Very high	89.2	Confident	48 Å²	48	48.9 Å²	48.9	26%	0.257	26%	0.264	S	S	.	.	H	α-helix	trans	-63	-39.6	177	-67.6	6.2	0	0	0	111.9	F496 Q497 S499 N504 A505 M542	F496-N502 HydrophobicContact CB-CB 4.14Å; F496-N502 PolarHBondContact O-ND2 3.11Å; Q497-N502 PolarHBondContact OE1-ND2 3.25Å; S499-N502 PolarHBondContact OG-N 3.21Å; N502-N504 VanDerWaalsContact C-N 3.29Å; N502-N504 PolarHBondContact O-N 2.93Å; N502-A505 WeakPolarHBondContact O-CB 3.49Å; N502-A505 PolarHBondContact O-N 2.81Å; N502-M542 HydrophobicContact CB-SD 3.73Å
503	I	91.3	Very high	88.2	Confident	1 Å²	1	52.3 Å²	52.3	1%	0.005	30%	0.299	C	S	.	.	H	α-helix	trans	-70	-27.9	176.9	-64.7	167.6	0	0	0	112	K440 I443 L444 L447 F496 S499 L500 D501	K440-I503 PolarHBondContact NZ-O 3.28Å; I443-I503 HydrophobicContact CG2-CD1 4.35Å; L444-I503 HydrophobicContact CD2-CD1 4.34Å; L444-I503 HydrophobicContact CD2-CG2 3.98Å; L447-I503 HydrophobicContact CD2-CD1 3.9Å; F496-I503 HydrophobicContact CB-CD1 4.3Å; F496-I503 HydrophobicContact CB-CG1 3.66Å; F496-I503 HydrophobicContact CD1-CG1 4.02Å; F496-I503 HydrophobicContact CD2-CD1 4.38Å; F496-I503 HydrophobicContact CD2-CG1 3.84Å; F496-I503 HydrophobicContact CE2-CG1 4.5Å; F496-I503 HydrophobicContact CG-CD1 4.42Å; F496-I503 HydrophobicContact CG-CG1 3.56Å; S499-I503 WeakPolarHBondContact O-CG1 3.35Å; S499-I503 PolarHBondContact O-N 2.88Å; L500-I503 PolarHBondContact O-N 2.95Å; D501-I503 PolarHBondContact O-N 3.45Å
504	N	92.6	Very high	87.6	Confident	73 Å²	73	56.4 Å²	56.4	39%	0.39	32%	0.324	S	S	.	.	H	α-helix	trans	-91.9	-10.4	179.2	-73.3	-33.6	0	0	0	114	K440 L500 D501 N502	K440-N504 WeakPolarHBondContact CE-OD1 3.3Å; K440-N504 PolarHBondContact NZ-OD1 3.29Å; L500-N504 WeakPolarHBondContact O-CB 3.46Å; L500-N504 PolarHBondContact O-N 3.41Å; L500-N504 VanDerWaalsContact O-N 3.09Å; L500-N504 PolarHBondContact O-ND2 3.24Å; D501-N504 CarbonylContact O-C 3.6Å; D501-N504 PolarHBondContact O-N 3.11Å; D501-N504 VanDerWaalsContact O-N 3.13Å; N502-N504 VanDerWaalsContact C-N 3.29Å; N502-N504 PolarHBondContact O-N 2.93Å
505	A	91.1	Very high	87.1	Confident	35 Å²	35	60.6 Å²	60.6	29%	0.289	35%	0.35	S	S	.	.			trans	-61.6	139.7	177.5	0	0	0	0	0	111.4	D501 N502 L540	D501-A505 PolarHBondContact O-N 3.03Å; N502-A505 WeakPolarHBondContact O-CB 3.49Å; N502-A505 PolarHBondContact O-N 2.81Å; A505-L540 HydrophobicContact CB-CD2 3.73Å
506	K	91.3	Very high	86.8	Confident	100 Å²	100	63.8 Å²	63.8	44%	0.435	37%	0.365	S	S	.	.			trans	-147.9	140	177	-59.1	-164.9	-177.1	-175.5	0	109.7	E517 V518 D519	K506-E517 HydrophobicContact CB-CG 4.31Å; K506-E517 HydrophobicContact CD-CG 4.19Å; K506-E517 WeakPolarHBondContact CD-OE1 3.42Å; K506-E517 IonicContact NZ-OE1 2.81Å; K506-E517 PolarHBondContact NZ-OE1 3.27Å; K506-E517 VanDerWaalsContact NZ-OE1 3.07Å; K506-E517 IonicContact NZ-OE2 2.74Å; K506-E517 PolarHBondContact NZ-OE2 3.41Å; K506-V518 WeakPolarHBondContact CA-O 3.31Å; K506-D519 HydrophobicContact CD-CB 4.32Å; K506-D519 HydrophobicContact CG-CB 3.93Å
507	V	88.4	Confident	86.5	Confident	52 Å²	52	68.1 Å²	68.1	32%	0.315	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	141.1	-179.5	-177.4	0	0	0	0	109.3	V518 D539 L540	V507-V518 PolarHBondContact N-O 2.96Å; V507-V518 VanDerWaalsContact N-O 3.07Å; V507-V518 PolarHBondContact O-N 3.5Å; V507-D539 HydrophobicContact CB-CB 4.22Å; V507-D539 HydrophobicContact CG1-CB 3.54Å; V507-L540 HydrophobicContact CB-CD2 4.49Å; V507-L540 HydrophobicContact CG2-CD2 3.82Å; V507-L540 HydrophobicContact CG2-CG 4.38Å
508	N	88.8	Confident	86.4	Confident	110 Å²	110	65.8 Å²	65.8	59%	0.588	37%	0.374	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.1	118	171.7	-71.7	-27.3	0	0	0	108.7	T515 E517	N508-T515 HydrophobicContact CB-CG2 4.29Å; N508-E517 WeakPolarHBondContact OD1-CA 3.41Å; N508-E517 WeakPolarHBondContact OD1-CB 3.47Å
509	M	83.1	Confident	86.3	Confident	17 Å²	17	65.5 Å²	65.5	8%	0.084	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	143.5	178.9	-174.7	177.1	-178.7	0	0	109.3	L427 L428 T515 Q516 V518 D539	L427-M509 HydrophobicContact CD2-CB 4.24Å; L427-M509 HydrophobicContact CD2-CG 4.35Å; L428-M509 HydrophobicContact CD1-SD 4.45Å; L428-M509 HydrophobicContact CD2-CE 4.31Å; M509-T515 WeakPolarHBondContact O-CA 3.32Å; M509-Q516 PolarHBondContact N-O 3.33Å; M509-Q516 PolarHBondContact O-N 3.49Å; M509-V518 HydrophobicContact CB-CG2 3.62Å; M509-V518 HydrophobicContact SD-CG2 4.27Å; M509-D539 WeakPolarHBondContact CB-OD2 3.32Å; M509-D539 WeakPolarHBondContact CG-OD2 3.3Å
510	T	82.3	Confident	86.3	Confident	84 Å²	84	64.4 Å²	64.4	52%	0.515	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	115.5	175.5	-51.6	0	0	0	0	109.9	V514 T515	T510-V514 CarbonylContact C-O 3.55Å; T510-V514 VanDerWaalsContact CA-O 3.32Å; T510-V514 WeakPolarHBondContact CA-O 3.32Å; T510-T515 WeakPolarHBondContact CG2-OG1 3.49Å; T510-T515 PolarHBondContact OG1-OG1 3.46Å
511	E	74.1	Confident	86.3	Confident	44 Å²	44	63.3 Å²	63.3	21%	0.206	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	131.8	176	-164	-179.1	175.1	0	0	109	R189 L427 L428 G513 V514	R189-E511 IonicContact CZ-OE1 3.67Å; R189-E511 IonicContact NH1-OE1 3.03Å; R189-E511 PolarHBondContact NH1-OE1 2.78Å; R189-E511 IonicContact NH1-OE2 3.58Å; R189-E511 PolarHBondContact NH1-OE2 2.83Å; R189-E511 IonicContact NH2-OE1 3.59Å; R189-E511 PolarHBondContact NH2-OE1 2.78Å; L427-E511 HydrophobicContact CD1-CB 4.32Å; L427-E511 HydrophobicContact CD2-CB 3.86Å; L427-E511 HydrophobicContact CG-CB 3.99Å; L428-E511 WeakPolarHBondContact CD2-OE2 3.41Å; E511-G513 PolarHBondContact O-N 3.24Å; E511-V514 PolarHBondContact N-O 2.95Å; E511-V514 PolarHBondContact O-N 2.94Å
512	L	72.5	Confident	86.2	Confident	175 Å²	175	57.4 Å²	57.4	92%	0.916	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.2	31.9	-178.1	-62.1	170.2	0	0	0	114.6	V514	L512-V514 VanDerWaalsContact C-N 3.3Å; L512-V514 PolarHBondContact O-N 2.76Å
513	G	73	Confident	86.2	Confident	72 Å²	72	55.1 Å²	55.1	74%	0.742	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.9	2	-179	0	0	0	0	0	115	E511	E511-G513 PolarHBondContact O-N 3.24Å
514	V	80.7	Confident	86.1	Confident	85 Å²	85	55.1 Å²	55.1	52%	0.515	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	122.7	173.6	-178.3	0	0	0	0	108.7	L427 T510 E511 L512	L427-V514 HydrophobicContact CD1-CB 4.16Å; L427-V514 HydrophobicContact CD1-CG1 4.02Å; T510-V514 CarbonylContact C-O 3.55Å; T510-V514 VanDerWaalsContact CA-O 3.32Å; T510-V514 WeakPolarHBondContact CA-O 3.32Å; E511-V514 PolarHBondContact N-O 2.95Å; E511-V514 PolarHBondContact O-N 2.94Å; L512-V514 VanDerWaalsContact C-N 3.3Å; L512-V514 PolarHBondContact O-N 2.76Å
515	T	85.1	Confident	85.9	Confident	88 Å²	88	51.9 Å²	51.9	54%	0.54	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	121.9	176.3	-52.6	0	0	0	0	109.6	N508 M509 T510	N508-T515 HydrophobicContact CB-CG2 4.29Å; M509-T515 WeakPolarHBondContact O-CA 3.32Å; T510-T515 WeakPolarHBondContact CG2-OG1 3.49Å; T510-T515 PolarHBondContact OG1-OG1 3.46Å
516	Q	86.3	Confident	85.8	Confident	67 Å²	67	50.3 Å²	50.3	31%	0.313	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	150.9	179	-165.7	174.6	2.8	0	0	110.4	D425 L427 M509 V518	D425-Q516 PolarHBondContact O-NE2 3.38Å; L427-Q516 HydrophobicContact CB-CB 4.2Å; L427-Q516 HydrophobicContact CD1-CB 4.09Å; L427-Q516 HydrophobicContact CD2-CB 4.23Å; L427-Q516 HydrophobicContact CG-CB 4.41Å; M509-Q516 PolarHBondContact N-O 3.33Å; M509-Q516 PolarHBondContact O-N 3.49Å; Q516-V518 PolarHBondContact O-N 3.1Å
517	E	88.3	Confident	85.6	Confident	92 Å²	92	45.6 Å²	45.6	43%	0.43	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	119.3	174.6	-169.9	-176.7	-154.8	0	0	109.4	K506 N508	K506-E517 HydrophobicContact CB-CG 4.31Å; K506-E517 HydrophobicContact CD-CG 4.19Å; K506-E517 WeakPolarHBondContact CD-OE1 3.42Å; K506-E517 IonicContact NZ-OE1 2.81Å; K506-E517 PolarHBondContact NZ-OE1 3.27Å; K506-E517 VanDerWaalsContact NZ-OE1 3.07Å; K506-E517 IonicContact NZ-OE2 2.74Å; K506-E517 PolarHBondContact NZ-OE2 3.41Å; N508-E517 WeakPolarHBondContact OD1-CA 3.41Å; N508-E517 WeakPolarHBondContact OD1-CB 3.47Å
518	V	88.6	Confident	85.6	Confident	1 Å²	1	43.2 Å²	43.2	1%	0.006	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	137.5	174.7	-179.7	0	0	0	0	108.7	K506 V507 M509 Q516 D522 T538 L540	K506-V518 WeakPolarHBondContact CA-O 3.31Å; V507-V518 PolarHBondContact N-O 2.96Å; V507-V518 VanDerWaalsContact N-O 3.07Å; V507-V518 PolarHBondContact O-N 3.5Å; M509-V518 HydrophobicContact CB-CG2 3.62Å; M509-V518 HydrophobicContact SD-CG2 4.27Å; Q516-V518 PolarHBondContact O-N 3.1Å; V518-D522 WeakPolarHBondContact CA-OD2 3.5Å; V518-D522 HydrophobicContact CG1-CB 3.64Å; V518-D522 VanDerWaalsContact CG1-OD2 3.3Å; V518-D522 WeakPolarHBondContact CG1-OD2 3.34Å; V518-T538 HydrophobicContact CG1-CG2 3.71Å; V518-L540 HydrophobicContact CG1-CD1 4.1Å
519	D	90.6	Very high	85.4	Confident	7 Å²	7	40.4 Å²	40.4	4%	0.037	23%	0.23	C	C	.	.			trans	-140.6	-167.6	179.8	76.8	10	0	0	0	113.7	K506 R521 D522 H523	K506-D519 HydrophobicContact CD-CB 4.32Å; K506-D519 HydrophobicContact CG-CB 3.93Å; D519-R521 VanDerWaalsContact CG-CZ 3.42Å; D519-R521 VanDerWaalsContact CG-NH1 3.35Å; D519-R521 PolarHBondContact O-N 3.49Å; D519-R521 WeakPolarHBondContact OD1-CB 3.36Å; D519-R521 IonicContact OD1-CZ 2.66Å; D519-R521 PolarHBondContact OD1-N 3.42Å; D519-R521 IonicContact OD1-NE 3.07Å; D519-R521 IonicContact OD1-NH1 3.37Å; D519-R521 PolarHBondContact OD1-NH1 3.01Å; D519-R521 IonicContact OD1-NH2 2.68Å; D519-R521 PolarHBondContact OD1-NH2 3.46Å; D519-R521 IonicContact OD2-CZ 3.44Å; D519-R521 IonicContact OD2-NH1 2.82Å; D519-R521 PolarHBondContact OD2-NH1 2.81Å; D519-R521 IonicContact OD2-NH2 3.44Å; D519-R521 PolarHBondContact OD2-NH2 2.94Å; D519-D522 PolarHBondContact N-OD2 3.06Å; D519-D522 PolarHBondContact O-N 2.94Å; D519-D522 VanDerWaalsContact O-N 3.1Å; D519-H523 PolarHBondContact O-N 3.27Å
520	W	91	Very high	85.4	Confident	6 Å²	6	39.9 Å²	39.9	2%	0.023	23%	0.228	C	C	.	.	H	α-helix	trans	-50.8	-25.4	179.5	72.7	-85.3	0	0	0	114.5	I438 K440 I443 F496 L524	I438-W520 HydrophobicContact CG2-CH2 4Å; I438-W520 HydrophobicContact CG2-CZ3 3.97Å; K440-W520 HydrophobicContact CB-CZ2 3.83Å; I443-W520 HydrophobicContact CD1-CE3 3.87Å; I443-W520 HydrophobicContact CD1-CH2 3.68Å; I443-W520 HydrophobicContact CD1-CZ3 3.25Å; F496-W520 HydrophobicContact CE1-CB 3.78Å; F496-W520 HydrophobicContact CZ-CB 3.91Å; F496-W520 HydrophobicContact CZ-CE3 4.31Å; W520-L524 HydrophobicContact CE3-CB 4.43Å; W520-L524 HydrophobicContact CE3-CD2 4.2Å; W520-L524 HydrophobicContact CZ3-CD2 3.7Å; W520-L524 VanDerWaalsContact O-CB 3.23Å; W520-L524 WeakPolarHBondContact O-CB 3.5Å; W520-L524 PolarHBondContact O-N 2.74Å
521	R	90.8	Very high	85.4	Confident	49 Å²	49	36.7 Å²	36.7	19%	0.185	21%	0.209	C	C	.	.	H	α-helix	trans	-68.2	-43.1	179.4	-71.7	-177.4	-64.9	-67.9	-3.6	111.5	Y424 F434 D519 L524 I525	Y424-R521 HydrophobicContact CD1-CB 3.9Å; Y424-R521 HydrophobicContact CE1-CB 3.63Å; F434-R521 HydrophobicContact CE1-CB 4.36Å; F434-R521 HydrophobicContact CE1-CG 4.14Å; F434-R521 HydrophobicContact CZ-CB 3.98Å; F434-R521 HydrophobicContact CZ-CG 4.18Å; D519-R521 VanDerWaalsContact CG-CZ 3.42Å; D519-R521 VanDerWaalsContact CG-NH1 3.35Å; D519-R521 PolarHBondContact O-N 3.49Å; D519-R521 WeakPolarHBondContact OD1-CB 3.36Å; D519-R521 IonicContact OD1-CZ 2.66Å; D519-R521 PolarHBondContact OD1-N 3.42Å; D519-R521 IonicContact OD1-NE 3.07Å; D519-R521 IonicContact OD1-NH1 3.37Å; D519-R521 PolarHBondContact OD1-NH1 3.01Å; D519-R521 IonicContact OD1-NH2 2.68Å; D519-R521 PolarHBondContact OD1-NH2 3.46Å; D519-R521 IonicContact OD2-CZ 3.44Å; D519-R521 IonicContact OD2-NH1 2.82Å; D519-R521 PolarHBondContact OD2-NH1 2.81Å; D519-R521 IonicContact OD2-NH2 3.44Å; D519-R521 PolarHBondContact OD2-NH2 2.94Å; R521-L524 PolarHBondContact O-N 2.89Å; R521-I525 WeakPolarHBondContact O-CD1 3.27Å; R521-I525 VanDerWaalsContact O-CG1 3.24Å; R521-I525 WeakPolarHBondContact O-CG1 3.34Å; R521-I525 PolarHBondContact O-N 2.82Å
522	D	88.9	Confident	85.8	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-66.6	-44	178.8	-58.8	-68.2	0	0	0	110.9	Y424 S426 F429 V518 D519 L524 I525 Y526 T538	Y424-D522 WeakPolarHBondContact CE1-OD1 3.24Å; Y424-D522 PolarHBondContact OH-OD1 2.92Å; Y424-D522 PolarHBondContact OH-OD2 3.38Å; S426-D522 VanDerWaalsContact CB-OD1 3.24Å; S426-D522 WeakPolarHBondContact CB-OD1 3.47Å; S426-D522 PolarHBondContact OG-OD1 2.94Å; F429-D522 HydrophobicContact CE2-CB 4.35Å; F429-D522 WeakPolarHBondContact CE2-O 3.43Å; V518-D522 WeakPolarHBondContact CA-OD2 3.5Å; V518-D522 HydrophobicContact CG1-CB 3.64Å; V518-D522 VanDerWaalsContact CG1-OD2 3.3Å; V518-D522 WeakPolarHBondContact CG1-OD2 3.34Å; D519-D522 PolarHBondContact N-OD2 3.06Å; D519-D522 PolarHBondContact O-N 2.94Å; D519-D522 VanDerWaalsContact O-N 3.1Å; D522-L524 VanDerWaalsContact C-N 3.34Å; D522-L524 PolarHBondContact O-N 3.48Å; D522-I525 PolarHBondContact O-N 3Å; D522-Y526 WeakPolarHBondContact O-CB 3.42Å; D522-Y526 PolarHBondContact O-N 3.26Å; D522-T538 HydrophobicContact CB-CG2 4.21Å
523	H	90.4	Very high	86.1	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-59.8	-44.3	174.7	-176.5	72.8	0	0	0	111.7	Y495 F496 D519 Y526 C527 D536 L540 M542	Y495-H523 PolarHBondContact O-NE2 2.91Å; F496-H523 AromaticContact CD1-CD2 3.75Å; F496-H523 HydrophobicContact CE1-CB 4.29Å; F496-H523 AromaticContact CE1-CD2 3.4Å; F496-H523 WeakPolarHBondContact CE1-CD2 3.39Å; D519-H523 PolarHBondContact O-N 3.27Å; H523-Y526 WeakPolarHBondContact O-CB 3.32Å; H523-Y526 PolarHBondContact O-N 3.49Å; H523-C527 PolarHBondContact CE1-SG 3.45Å; H523-C527 PolarHBondContact NE2-SG 3.49Å; H523-C527 PolarHBondContact O-N 3.35Å; H523-C527 PolarHBondContact O-SG 3.06Å; H523-C527 VanDerWaalsContact O-SG 3.42Å; H523-D536 IonicContact CE1-OD2 3.37Å; H523-D536 IonicContact CG-OD2 3.22Å; H523-D536 IonicContact ND1-OD2 3.18Å; H523-D536 PolarHBondContact ND1-OD2 3.35Å; H523-L540 HydrophobicContact CB-CD1 4.38Å; H523-M542 HydrophobicContact CB-CE 3.88Å; H523-M542 WeakPolarHBondContact CE1-CB 3.46Å
524	L	90.9	Very high	86.4	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-62.6	-46.8	178	-179.3	64.4	0	0	0	112	I438 L492 Y495 F496 W520 R521 D522 Y526 C527 L528	I438-L524 HydrophobicContact CG2-CD2 3.66Å; L492-L524 HydrophobicContact CD1-CD1 4.12Å; L492-L524 HydrophobicContact CD1-CD2 4.3Å; L492-L524 HydrophobicContact CD2-CD1 4.05Å; L492-L524 HydrophobicContact CD2-CD2 4.5Å; L492-L524 HydrophobicContact CG-CD1 3.96Å; Y495-L524 HydrophobicContact CD2-CD1 3.87Å; Y495-L524 HydrophobicContact CE2-CD1 4.37Å; F496-L524 HydrophobicContact CZ-CB 4.24Å; W520-L524 HydrophobicContact CE3-CB 4.43Å; W520-L524 HydrophobicContact CE3-CD2 4.2Å; W520-L524 HydrophobicContact CZ3-CD2 3.7Å; W520-L524 VanDerWaalsContact O-CB 3.23Å; W520-L524 WeakPolarHBondContact O-CB 3.5Å; W520-L524 PolarHBondContact O-N 2.74Å; R521-L524 PolarHBondContact O-N 2.89Å; D522-L524 VanDerWaalsContact C-N 3.34Å; D522-L524 PolarHBondContact O-N 3.48Å; L524-Y526 PolarHBondContact O-N 3.25Å; L524-C527 PolarHBondContact O-N 3.21Å; L524-L528 HydrophobicContact CD1-CD1 3.97Å; L524-L528 HydrophobicContact CD1-CG 4.09Å; L524-L528 HydrophobicContact CD2-CD1 4.46Å; L524-L528 HydrophobicContact CG-CD1 3.79Å; L524-L528 HydrophobicContact CG-CG 4.34Å; L524-L528 WeakPolarHBondContact O-CB 3.14Å; L524-L528 VanDerWaalsContact O-CG 3.22Å; L524-L528 WeakPolarHBondContact O-CG 3.41Å; L524-L528 PolarHBondContact O-N 3.2Å
525	I	88.6	Confident	86.5	Confident	5 Å²	5	27.4 Å²	27.4	3%	0.026	14%	0.138	C	C	.	.	H	α-helix	trans	-58.7	-42.9	176.7	-64.2	159.1	0	0	0	109.9	Y424 F429 Q432 F434 R521 D522 N529 T567	Y424-I525 HydrophobicContact CD1-CD1 4.4Å; F429-I525 HydrophobicContact CB-CD1 4.48Å; F429-I525 HydrophobicContact CB-CG2 4.44Å; F429-I525 HydrophobicContact CD1-CB 4.5Å; F429-I525 HydrophobicContact CD1-CG2 3.51Å; F429-I525 HydrophobicContact CD2-CB 4.2Å; F429-I525 HydrophobicContact CD2-CD1 4.15Å; F429-I525 HydrophobicContact CD2-CG2 4.02Å; F429-I525 HydrophobicContact CE1-CB 4.33Å; F429-I525 HydrophobicContact CE1-CG2 3.53Å; F429-I525 HydrophobicContact CE2-CB 4.12Å; F429-I525 HydrophobicContact CE2-CG2 4.13Å; F429-I525 HydrophobicContact CG-CB 4.42Å; F429-I525 HydrophobicContact CG-CD1 4.4Å; F429-I525 HydrophobicContact CG-CG2 3.75Å; F429-I525 HydrophobicContact CZ-CB 4.2Å; F429-I525 HydrophobicContact CZ-CG2 3.9Å; Q432-I525 HydrophobicContact CB-CD1 4.49Å; Q432-I525 HydrophobicContact CG-CD1 4.11Å; F434-I525 HydrophobicContact CE2-CD1 3.93Å; F434-I525 HydrophobicContact CE2-CG1 4.4Å; F434-I525 HydrophobicContact CZ-CD1 3.69Å; F434-I525 HydrophobicContact CZ-CG1 3.81Å; R521-I525 WeakPolarHBondContact O-CD1 3.27Å; R521-I525 VanDerWaalsContact O-CG1 3.24Å; R521-I525 WeakPolarHBondContact O-CG1 3.34Å; R521-I525 PolarHBondContact O-N 2.82Å; D522-I525 PolarHBondContact O-N 3Å; I525-N529 PolarHBondContact O-N 2.94Å; I525-N529 PolarHBondContact O-ND2 2.88Å; I525-T567 HydrophobicContact CG1-CG2 3.86Å
526	Y	87.4	Confident	86.3	Confident	3 Å²	3	23.2 Å²	23.2	1%	0.012	11%	0.112	C	C	.	.	H	α-helix	trans	-60.3	-51.4	178.3	-175.1	-93.7	0	0	0	111.9	G188 R189 F429 D522 H523 L524 L528 N529 S530 S533 D536 I537	G188-Y526 VanDerWaalsContact C-CE2 3.46Å; R189-Y526 HydrophobicContact CB-CD2 4.36Å; F429-Y526 HydrophobicContact CZ-CD2 4.28Å; D522-Y526 WeakPolarHBondContact O-CB 3.42Å; D522-Y526 PolarHBondContact O-N 3.26Å; H523-Y526 WeakPolarHBondContact O-CB 3.32Å; H523-Y526 PolarHBondContact O-N 3.49Å; L524-Y526 PolarHBondContact O-N 3.25Å; Y526-L528 PolarHBondContact O-N 2.83Å; Y526-N529 PolarHBondContact O-N 3.25Å; Y526-S530 PolarHBondContact O-N 3.25Å; Y526-S533 PolarHBondContact OH-OG 3.03Å; Y526-S533 VanDerWaalsContact OH-OG 3.06Å; Y526-D536 HydrophobicContact CD1-CB 3.63Å; Y526-D536 HydrophobicContact CE1-CB 3.8Å; Y526-D536 HydrophobicContact CG-CB 4.17Å; Y526-I537 HydrophobicContact CD2-CD1 4.29Å; Y526-I537 HydrophobicContact CD2-CG1 3.93Å; Y526-I537 HydrophobicContact CE2-CB 4.3Å; Y526-I537 HydrophobicContact CE2-CD1 4.23Å; Y526-I537 HydrophobicContact CE2-CG1 3.84Å; Y526-I537 HydrophobicContact CE2-CG2 3.75Å
527	C	88.9	Confident	86	Confident	0 Å²	0	20.4 Å²	20.4	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-69.1	-31.8	-178	-63.5	0	0	0	0	113.6	Y495 H523 L524 N529 S530 P531 C544	Y495-C527 HydrophobicContact CD1-CB 3.52Å; Y495-C527 HydrophobicContact CE1-CB 3.94Å; Y495-C527 HydrophobicContact CG-CB 3.92Å; H523-C527 PolarHBondContact CE1-SG 3.45Å; H523-C527 PolarHBondContact NE2-SG 3.49Å; H523-C527 PolarHBondContact O-N 3.35Å; H523-C527 PolarHBondContact O-SG 3.06Å; H523-C527 VanDerWaalsContact O-SG 3.42Å; L524-C527 PolarHBondContact O-N 3.21Å; C527-N529 VanDerWaalsContact C-N 3.29Å; C527-N529 PolarHBondContact O-N 3.34Å; C527-S530 CarbonylContact O-C 3.6Å; C527-S530 PolarHBondContact O-N 3.1Å; C527-P531 VanDerWaalsContact O-CA 3.22Å; C527-P531 WeakPolarHBondContact O-CA 3.18Å; C527-P531 WeakPolarHBondContact O-CD 3.43Å; C527-P531 VanDerWaalsContact O-N 3.08Å; C527-C544 WeakPolarHBondContact CA-SG 3.39Å; C527-C544 HydrophobicContact CB-CB 3.66Å; C527-C544 WeakPolarHBondContact CB-SG 3.43Å; C527-C544 WeakPolarHBondContact SG-CA 3.45Å; C527-C544 WeakPolarHBondContact SG-CB 3.31Å; C527-C544 CovalentContact SG-SG 2.04Å; C527-C544 PolarHBondContact SG-SG 2.93Å
528	L	87.8	Confident	85.7	Confident	2 Å²	2	16.2 Å²	16.2	1%	0.01	8%	0.08	C	C	.	.	H	α-helix	trans	-65	-34.9	173.7	-71.4	169.1	0	0	0	111.9	Y495 L524 Y526 P554 V558 Y566	Y495-L528 HydrophobicContact CE2-CD2 3.86Å; Y495-L528 HydrophobicContact CE2-CG 4.49Å; L524-L528 HydrophobicContact CD1-CD1 3.97Å; L524-L528 HydrophobicContact CD1-CG 4.09Å; L524-L528 HydrophobicContact CD2-CD1 4.46Å; L524-L528 HydrophobicContact CG-CD1 3.79Å; L524-L528 HydrophobicContact CG-CG 4.34Å; L524-L528 WeakPolarHBondContact O-CB 3.14Å; L524-L528 VanDerWaalsContact O-CG 3.22Å; L524-L528 WeakPolarHBondContact O-CG 3.41Å; L524-L528 PolarHBondContact O-N 3.2Å; Y526-L528 PolarHBondContact O-N 2.83Å; L528-P554 HydrophobicContact CD2-CB 4.07Å; L528-P554 HydrophobicContact CD2-CG 4.36Å; L528-P554 WeakPolarHBondContact O-CG 3.48Å; L528-V558 HydrophobicContact CD2-CG2 4.27Å; L528-Y566 HydrophobicContact CB-CD2 3.87Å; L528-Y566 HydrophobicContact CB-CG 4.16Å; L528-Y566 WeakPolarHBondContact O-CE2 3.44Å
529	N	83.9	Confident	85.3	Confident	51 Å²	51	20.3 Å²	20.3	27%	0.273	10%	0.101	S	C	.	.	H	α-helix	trans	-83.3	-31.7	177	-68.3	-27.3	0	0	0	113	I525 Y526 C527	I525-N529 PolarHBondContact O-N 2.94Å; I525-N529 PolarHBondContact O-ND2 2.88Å; Y526-N529 PolarHBondContact O-N 3.25Å; C527-N529 VanDerWaalsContact C-N 3.29Å; C527-N529 PolarHBondContact O-N 3.34Å
530	S	82.4	Confident	84.9	Confident	6 Å²	6	21.3 Å²	21.3	4%	0.042	11%	0.107	C	C	.	.			trans	-137	67.5	-171.7	-64.1	0	0	0	0	111.6	A184 G188 Y526 C527 L532 S533	A184-S530 PolarHBondContact O-OG 3.48Å; G188-S530 PolarHBondContact O-OG 2.78Å; Y526-S530 PolarHBondContact O-N 3.25Å; C527-S530 CarbonylContact O-C 3.6Å; C527-S530 PolarHBondContact O-N 3.1Å; S530-L532 PolarHBondContact O-N 3.31Å; S530-L532 VanDerWaalsContact O-N 3.1Å; S530-S533 PolarHBondContact O-N 2.96Å
531	P	83.7	Confident	84.4	Confident	17 Å²	17	22.7 Å²	22.7	11%	0.11	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-12.4	-172.5	27.3	-36.4	0	0	0	114.4	C527 V552 F553	C527-P531 VanDerWaalsContact O-CA 3.22Å; C527-P531 WeakPolarHBondContact O-CA 3.18Å; C527-P531 WeakPolarHBondContact O-CD 3.43Å; C527-P531 VanDerWaalsContact O-N 3.08Å; P531-V552 WeakPolarHBondContact CB-O 3.32Å; P531-F553 HydrophobicContact CG-CD1 4.28Å
532	L	81.9	Confident	84.2	Confident	40 Å²	40	21.2 Å²	21.2	21%	0.209	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.4	4.4	-179.6	-62.3	171	0	0	0	113.3	I175 T178 T185 S530 P551	I175-L532 HydrophobicContact CD1-CD1 4.21Å; T178-L532 HydrophobicContact CG2-CD1 3.93Å; T178-L532 HydrophobicContact CG2-CD2 3.57Å; T178-L532 HydrophobicContact CG2-CG 4.39Å; T185-L532 HydrophobicContact CG2-CB 3.92Å; T185-L532 HydrophobicContact CG2-CD1 4.02Å; S530-L532 PolarHBondContact O-N 3.31Å; S530-L532 VanDerWaalsContact O-N 3.1Å; L532-P551 HydrophobicContact CD2-CB 3.61Å; L532-P551 HydrophobicContact CD2-CG 3.59Å
533	S	79.8	Confident	84.2	Confident	20 Å²	20	22.6 Å²	22.6	14%	0.14	13%	0.127	C	C	.	.			trans	-78.9	133.7	-176.3	-163.6	0	0	0	0	112.6	Y526 S530 K535 C544	Y526-S533 PolarHBondContact OH-OG 3.03Å; Y526-S533 VanDerWaalsContact OH-OG 3.06Å; S530-S533 PolarHBondContact O-N 2.96Å; S533-K535 PolarHBondContact OG-O 3.44Å; S533-C544 WeakPolarHBondContact O-CB 3.47Å; S533-C544 PolarHBondContact O-N 3.31Å
534	F	78.4	Confident	84.1	Confident	77 Å²	77	22.6 Å²	22.6	34%	0.338	13%	0.127	S	C	.	.	S	Bend	trans	-81.9	-25.5	176.5	-67.2	-85.7	0	0	0	112.9	S543 M545 L1027	F534-S543 VanDerWaalsContact O-CA 3.32Å; F534-S543 WeakPolarHBondContact O-CA 3.44Å; F534-S543 WeakPolarHBondContact O-CB 3.21Å; F534-M545 HydrophobicContact CD1-CE 3.43Å; F534-M545 VanDerWaalsContact CD1-CE 3.43Å; F534-M545 HydrophobicContact CD1-SD 3.95Å; F534-M545 HydrophobicContact CE1-CE 3.35Å; F534-M545 HydrophobicContact CE1-SD 3.54Å; F534-M545 VanDerWaalsContact CE1-SD 3.54Å; F534-M545 HydrophobicContact CZ-SD 4.2Å; F534-L1027 HydrophobicContact CB-CD1 4.24Å; F534-L1027 HydrophobicContact CD1-CD1 4.21Å; F534-L1027 HydrophobicContact CD2-CD1 3.68Å; F534-L1027 HydrophobicContact CE2-CD1 4.04Å; F534-L1027 HydrophobicContact CG-CD1 3.78Å; F534-L1027 HydrophobicContact CZ-CD1 4.45Å
535	K	81.8	Confident	83.9	Confident	45 Å²	45	24.7 Å²	24.7	20%	0.196	14%	0.138	C	C	.	.	S	Bend	trans	-145.5	130.8	179.5	-168.1	-175.4	179.9	-174.2	0	108.7	E43 L45 S533 M542	E43-K535 PolarHBondContact O-NZ 3.27Å; E43-K535 VanDerWaalsContact O-NZ 3.08Å; L45-K535 HydrophobicContact CD1-CB 4.29Å; S533-K535 PolarHBondContact OG-O 3.44Å; K535-M542 CarbonylContact C-O 3.53Å; K535-M542 WeakPolarHBondContact CA-O 3.42Å
536	D	81.2	Confident	84	Confident	0 Å²	0	24.7 Å²	24.7	0%	0	14%	0.138	C	C	.	.			trans	-73.5	161.9	172.7	68.3	-14.6	0	0	0	112.2	H523 Y526 T538 G541 M542	H523-D536 IonicContact CE1-OD2 3.37Å; H523-D536 IonicContact CG-OD2 3.22Å; H523-D536 IonicContact ND1-OD2 3.18Å; H523-D536 PolarHBondContact ND1-OD2 3.35Å; Y526-D536 HydrophobicContact CD1-CB 3.63Å; Y526-D536 HydrophobicContact CE1-CB 3.8Å; Y526-D536 HydrophobicContact CG-CB 4.17Å; D536-T538 VanDerWaalsContact CG-OG1 3.28Å; D536-T538 PolarHBondContact O-N 3.23Å; D536-T538 PolarHBondContact OD1-OG1 3.09Å; D536-T538 PolarHBondContact OD2-OG1 3.19Å; D536-G541 VanDerWaalsContact OD1-C 3.29Å; D536-G541 WeakPolarHBondContact OD1-CA 3.39Å; D536-G541 PolarHBondContact OD1-N 3.28Å; D536-M542 PolarHBondContact N-O 3.32Å; D536-M542 PolarHBondContact OD1-N 2.87Å
537	I	79.6	Confident	84.1	Confident	8 Å²	8	26.8 Å²	26.8	4%	0.041	15%	0.15	C	C	.	.	S	Bend	trans	-80.6	-3	179.5	62.2	171.1	0	0	0	112.7	R189 F203 S208 N209 L428 Y526	R189-I537 HydrophobicContact CB-CD1 3.67Å; R189-I537 HydrophobicContact CG-CD1 3.88Å; F203-I537 HydrophobicContact CD2-CG2 4.36Å; F203-I537 HydrophobicContact CE2-CG2 3.9Å; S208-I537 PolarHBondContact OG-O 3.44Å; N209-I537 HydrophobicContact CB-CG2 4.49Å; L428-I537 HydrophobicContact CD1-CG1 4.5Å; L428-I537 HydrophobicContact CD2-CD1 3.87Å; L428-I537 HydrophobicContact CD2-CG1 4.39Å; Y526-I537 HydrophobicContact CD2-CD1 4.29Å; Y526-I537 HydrophobicContact CD2-CG1 3.93Å; Y526-I537 HydrophobicContact CE2-CB 4.3Å; Y526-I537 HydrophobicContact CE2-CD1 4.23Å; Y526-I537 HydrophobicContact CE2-CG1 3.84Å; Y526-I537 HydrophobicContact CE2-CG2 3.75Å
538	T	82.2	Confident	84.1	Confident	4 Å²	4	27.5 Å²	27.5	3%	0.025	15%	0.153	C	C	.	.	S	Bend	trans	-83.8	160.4	179	78.1	0	0	0	0	109.8	L428 V518 D522 D536 L540 G541	L428-T538 HydrophobicContact CD1-CG2 3.64Å; V518-T538 HydrophobicContact CG1-CG2 3.71Å; D522-T538 HydrophobicContact CB-CG2 4.21Å; D536-T538 VanDerWaalsContact CG-OG1 3.28Å; D536-T538 PolarHBondContact O-N 3.23Å; D536-T538 PolarHBondContact OD1-OG1 3.09Å; D536-T538 PolarHBondContact OD2-OG1 3.19Å; T538-L540 PolarHBondContact O-N 3.36Å; T538-L540 VanDerWaalsContact OG1-CB 3.24Å; T538-L540 WeakPolarHBondContact OG1-CB 3.42Å; T538-L540 PolarHBondContact OG1-N 3.03Å; T538-L540 VanDerWaalsContact OG1-N 3.17Å; T538-G541 PolarHBondContact O-N 3.49Å; T538-G541 VanDerWaalsContact O-N 3.14Å
539	D	80.2	Confident	84	Confident	87 Å²	87	28.6 Å²	28.6	47%	0.465	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-1.4	172.9	-68.1	-20.3	0	0	0	113.5	V507 M509	V507-D539 HydrophobicContact CB-CB 4.22Å; V507-D539 HydrophobicContact CG1-CB 3.54Å; M509-D539 WeakPolarHBondContact CB-OD2 3.32Å; M509-D539 WeakPolarHBondContact CG-OD2 3.3Å
540	L	83.1	Confident	84.1	Confident	28 Å²	28	27.4 Å²	27.4	15%	0.147	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-31.7	170.8	-63.6	157.5	0	0	0	111.9	A505 V507 V518 H523 T538 M542	A505-L540 HydrophobicContact CB-CD2 3.73Å; V507-L540 HydrophobicContact CB-CD2 4.49Å; V507-L540 HydrophobicContact CG2-CD2 3.82Å; V507-L540 HydrophobicContact CG2-CG 4.38Å; V518-L540 HydrophobicContact CG1-CD1 4.1Å; H523-L540 HydrophobicContact CB-CD1 4.38Å; T538-L540 PolarHBondContact O-N 3.36Å; T538-L540 VanDerWaalsContact OG1-CB 3.24Å; T538-L540 WeakPolarHBondContact OG1-CB 3.42Å; T538-L540 PolarHBondContact OG1-N 3.03Å; T538-L540 VanDerWaalsContact OG1-N 3.17Å; L540-M542 VanDerWaalsContact C-N 3.3Å; L540-M542 HydrophobicContact CB-CE 3.81Å; L540-M542 HydrophobicContact CB-CG 4.21Å; L540-M542 HydrophobicContact CD1-CE 3.76Å; L540-M542 HydrophobicContact CD2-CE 4.27Å; L540-M542 HydrophobicContact CG-CE 4.15Å; L540-M542 PolarHBondContact O-N 3.39Å
541	G	80.4	Confident	84.3	Confident	34 Å²	34	28.6 Å²	28.6	35%	0.351	17%	0.169	S	C	.	.			trans	60.1	31.6	177.4	0	0	0	0	0	115.2	D536 T538	D536-G541 VanDerWaalsContact OD1-C 3.29Å; D536-G541 WeakPolarHBondContact OD1-CA 3.39Å; D536-G541 PolarHBondContact OD1-N 3.28Å; T538-G541 PolarHBondContact O-N 3.49Å; T538-G541 VanDerWaalsContact O-N 3.14Å
542	M	86.9	Confident	84.6	Confident	18 Å²	18	27.8 Å²	27.8	9%	0.089	16%	0.164	C	C	.	.			trans	-88.1	154.9	-175.6	-71	-169.9	-72.4	0	0	113.1	F496 N502 H523 K535 D536 L540	F496-M542 HydrophobicContact CD1-CE 4.45Å; N502-M542 HydrophobicContact CB-SD 3.73Å; H523-M542 HydrophobicContact CB-CE 3.88Å; H523-M542 WeakPolarHBondContact CE1-CB 3.46Å; K535-M542 CarbonylContact C-O 3.53Å; K535-M542 WeakPolarHBondContact CA-O 3.42Å; D536-M542 PolarHBondContact N-O 3.32Å; D536-M542 PolarHBondContact OD1-N 2.87Å; L540-M542 VanDerWaalsContact C-N 3.3Å; L540-M542 HydrophobicContact CB-CE 3.81Å; L540-M542 HydrophobicContact CB-CG 4.21Å; L540-M542 HydrophobicContact CD1-CE 3.76Å; L540-M542 HydrophobicContact CD2-CE 4.27Å; L540-M542 HydrophobicContact CG-CE 4.15Å; L540-M542 PolarHBondContact O-N 3.39Å
543	S	87.9	Confident	85	Confident	29 Å²	29	28.1 Å²	28.1	20%	0.203	16%	0.164	C	C	.	.			trans	-85.3	148.6	175	-174.6	0	0	0	0	111.9	Y495 Q497 F534 M545	Y495-S543 VanDerWaalsContact O-O 3.11Å; Q497-S543 PolarHBondContact NE2-O 3.2Å; F534-S543 VanDerWaalsContact O-CA 3.32Å; F534-S543 WeakPolarHBondContact O-CA 3.44Å; F534-S543 WeakPolarHBondContact O-CB 3.21Å; S543-M545 PolarHBondContact OG-N 3.18Å
544	C	88.8	Confident	85.5	Confident	0 Å²	0	27.5 Å²	27.5	0%	0	16%	0.159	C	C	.	.			trans	-93.8	-2.4	170.8	-64.8	0	0	0	0	113.8	C527 S533	C527-C544 WeakPolarHBondContact CA-SG 3.39Å; C527-C544 HydrophobicContact CB-CB 3.66Å; C527-C544 WeakPolarHBondContact CB-SG 3.43Å; C527-C544 WeakPolarHBondContact SG-CA 3.45Å; C527-C544 WeakPolarHBondContact SG-CB 3.31Å; C527-C544 CovalentContact SG-SG 2.04Å; C527-C544 PolarHBondContact SG-SG 2.93Å; S533-C544 WeakPolarHBondContact O-CB 3.47Å; S533-C544 PolarHBondContact O-N 3.31Å
545	M	87.3	Confident	86	Confident	44 Å²	44	25.4 Å²	25.4	22%	0.217	15%	0.15	C	C	.	.	B	Isolated β-bridge	trans	-80.1	149.4	178.8	-62.1	-164.5	-57.6	0	0	111.4	Q497 F534 S543	Q497-M545 PolarHBondContact NE2-O 3.19Å; F534-M545 HydrophobicContact CD1-CE 3.43Å; F534-M545 VanDerWaalsContact CD1-CE 3.43Å; F534-M545 HydrophobicContact CD1-SD 3.95Å; F534-M545 HydrophobicContact CE1-CE 3.35Å; F534-M545 HydrophobicContact CE1-SD 3.54Å; F534-M545 VanDerWaalsContact CE1-SD 3.54Å; F534-M545 HydrophobicContact CZ-SD 4.2Å; S543-M545 PolarHBondContact OG-N 3.18Å
546	A	90.8	Very high	86.5	Confident	5 Å²	5	24.7 Å²	24.7	4%	0.041	15%	0.148	C	C	.	.			trans	-66	162.2	172.5	0	0	0	0	0	112	Q494 Y548 G549 A550 V552	Q494-A546 HydrophobicContact CB-CB 4.16Å; Q494-A546 HydrophobicContact CG-CB 4.34Å; A546-Y548 VanDerWaalsContact C-N 3.26Å; A546-Y548 HydrophobicContact CB-CD1 3.45Å; A546-Y548 VanDerWaalsContact CB-CD1 3.45Å; A546-Y548 HydrophobicContact CB-CE1 3.25Å; A546-Y548 HydrophobicContact CB-CG 4.24Å; A546-Y548 PolarHBondContact O-N 3.46Å; A546-G549 PolarHBondContact O-N 3.36Å; A546-A550 WeakPolarHBondContact CB-O 3.48Å; A546-A550 PolarHBondContact N-O 2.93Å; A546-V552 HydrophobicContact CB-CG2 3.83Å
547	D	89.9	Confident	87	Confident	47 Å²	47	24.7 Å²	24.7	25%	0.251	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-37	174.7	56.1	-2.5	0	0	0	113.5	Q494 N498 G549	Q494-D547 PolarHBondContact NE2-OD1 2.95Å; Q494-D547 PolarHBondContact OE1-OD1 3.45Å; N498-D547 PolarHBondContact ND2-OD2 3.43Å; D547-G549 PolarHBondContact O-N 3.23Å
548	Y	88.9	Confident	87.7	Confident	16 Å²	16	24.3 Å²	24.3	6%	0.063	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.8	2.6	175.8	70.6	-93.5	0	0	0	114.1	P476 L477 T485 N490 A546 A550	P476-Y548 HydrophobicContact CG-CD2 3.86Å; P476-Y548 HydrophobicContact CG-CE2 4.24Å; L477-Y548 WeakPolarHBondContact CD1-O 3.44Å; T485-Y548 WeakPolarHBondContact O-CA 3.47Å; T485-Y548 VanDerWaalsContact O-CB 3.24Å; T485-Y548 WeakPolarHBondContact O-CB 3.32Å; T485-Y548 PolarHBondContact O-N 2.89Å; N490-Y548 PolarHBondContact OD1-OH 2.98Å; A546-Y548 VanDerWaalsContact C-N 3.26Å; A546-Y548 HydrophobicContact CB-CD1 3.45Å; A546-Y548 VanDerWaalsContact CB-CD1 3.45Å; A546-Y548 HydrophobicContact CB-CE1 3.25Å; A546-Y548 HydrophobicContact CB-CG 4.24Å; A546-Y548 PolarHBondContact O-N 3.46Å; Y548-A550 HydrophobicContact CD2-CB 3.87Å; Y548-A550 HydrophobicContact CE2-CB 3.24Å
549	G	84.1	Confident	88.2	Confident	24 Å²	24	24.1 Å²	24.1	25%	0.247	15%	0.145	C	C	.	.	S	Bend	trans	83.1	22.7	169.1	0	0	0	0	0	116	A546 D547	A546-G549 PolarHBondContact O-N 3.36Å; D547-G549 PolarHBondContact O-N 3.23Å
550	A	86.1	Confident	88.6	Confident	26 Å²	26	20.7 Å²	20.7	22%	0.215	13%	0.13	C	C	.	.	S	Bend	trans	-123.9	159	171.7	0	0	0	0	0	111.8	A546 Y548	A546-A550 WeakPolarHBondContact CB-O 3.48Å; A546-A550 PolarHBondContact N-O 2.93Å; Y548-A550 HydrophobicContact CD2-CB 3.87Å; Y548-A550 HydrophobicContact CE2-CB 3.24Å
551	P	87.8	Confident	88.9	Confident	32 Å²	32	20.4 Å²	20.4	21%	0.208	13%	0.127	C	C	.	.	B	Isolated β-bridge	trans	-74.2	138.1	176.3	30.9	-35.2	0	0	0	111.5	L532 F553	L532-P551 HydrophobicContact CD2-CB 3.61Å; L532-P551 HydrophobicContact CD2-CG 3.59Å; P551-F553 HydrophobicContact CG-CZ 4.3Å
552	V	90.4	Very high	89.1	Confident	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.147	C	C	.	.			trans	-94	114.9	169.6	-176.3	0	0	0	0	107.8	Q494 Y495 P531 A546 A557	Q494-V552 HydrophobicContact CB-CG2 3.81Å; Q494-V552 HydrophobicContact CG-CG2 4.4Å; Y495-V552 HydrophobicContact CE1-CB 4.14Å; Y495-V552 WeakPolarHBondContact CE1-O 3.29Å; Y495-V552 PolarHBondContact OH-O 3.5Å; P531-V552 WeakPolarHBondContact CB-O 3.32Å; A546-V552 HydrophobicContact CB-CG2 3.83Å; V552-A557 HydrophobicContact CG1-CB 3.98Å
553	F	89.4	Confident	88.7	Confident	47 Å²	47	31.1 Å²	31.1	21%	0.206	18%	0.176	C	C	.	.			trans	-75.5	145.8	175.9	-64.1	-73.2	0	0	0	111	T178 P531 P551 F555 L556	T178-F553 HydrophobicContact CG2-CZ 4.18Å; P531-F553 HydrophobicContact CG-CD1 4.28Å; P551-F553 HydrophobicContact CG-CZ 4.3Å; F553-F555 VanDerWaalsContact C-N 3.29Å; F553-F555 HydrophobicContact CB-CD1 3.79Å; F553-F555 HydrophobicContact CB-CD2 4.44Å; F553-F555 HydrophobicContact CB-CE1 3.33Å; F553-F555 HydrophobicContact CB-CE2 4.06Å; F553-F555 HydrophobicContact CB-CG 4.32Å; F553-F555 HydrophobicContact CB-CZ 3.48Å; F553-F555 VanDerWaalsContact CB-CZ 3.48Å; F553-F555 HydrophobicContact CD1-CE1 4.21Å; F553-F555 HydrophobicContact CD2-CE1 4.35Å; F553-F555 AromaticContact CD2-CZ 3.88Å; F553-F555 HydrophobicContact CD2-CZ 3.88Å; F553-F555 AromaticContact CG-CE1 3.73Å; F553-F555 HydrophobicContact CG-CE1 3.73Å; F553-F555 AromaticContact CG-CZ 3.72Å; F553-F555 HydrophobicContact CG-CZ 3.72Å; F553-F555 PolarHBondContact O-N 3.08Å; F553-L556 HydrophobicContact CB-CD1 4.43Å; F553-L556 HydrophobicContact CB-CG 4.49Å; F553-L556 HydrophobicContact CD2-CD1 4.34Å; F553-L556 WeakPolarHBondContact O-CB 3.16Å; F553-L556 PolarHBondContact O-N 3.27Å
554	P	90.3	Very high	88.1	Confident	7 Å²	7	32.6 Å²	32.6	5%	0.045	18%	0.182	C	C	.	.	H	α-helix	trans	-53.6	-42.5	-178.6	-28.3	34.4	0	0	0	113.8	L528 L556 A557 V558 Y566	L528-P554 HydrophobicContact CD2-CB 4.07Å; L528-P554 HydrophobicContact CD2-CG 4.36Å; L528-P554 WeakPolarHBondContact O-CG 3.48Å; P554-L556 PolarHBondContact O-N 3.11Å; P554-L556 VanDerWaalsContact O-N 3.1Å; P554-A557 PolarHBondContact O-N 3.48Å; P554-V558 WeakPolarHBondContact O-CG2 3.46Å; P554-V558 PolarHBondContact O-N 3.44Å; P554-Y566 HydrophobicContact CB-CD1 3.67Å; P554-Y566 HydrophobicContact CB-CE1 3.55Å; P554-Y566 HydrophobicContact CB-CG 4.21Å; P554-Y566 HydrophobicContact CG-CD1 4.46Å; P554-Y566 HydrophobicContact CG-CE1 4.11Å; P554-Y566 HydrophobicContact CG-CE2 4.34Å
555	F	89.6	Confident	87.9	Confident	32 Å²	32	38 Å²	38	14%	0.14	21%	0.208	C	C	.	.	H	α-helix	trans	-65.3	-11.5	179.6	60.7	-102.4	0	0	0	114.4	F553 V899 I951	F553-F555 VanDerWaalsContact C-N 3.29Å; F553-F555 HydrophobicContact CB-CD1 3.79Å; F553-F555 HydrophobicContact CB-CD2 4.44Å; F553-F555 HydrophobicContact CB-CE1 3.33Å; F553-F555 HydrophobicContact CB-CE2 4.06Å; F553-F555 HydrophobicContact CB-CG 4.32Å; F553-F555 HydrophobicContact CB-CZ 3.48Å; F553-F555 VanDerWaalsContact CB-CZ 3.48Å; F553-F555 HydrophobicContact CD1-CE1 4.21Å; F553-F555 HydrophobicContact CD2-CE1 4.35Å; F553-F555 AromaticContact CD2-CZ 3.88Å; F553-F555 HydrophobicContact CD2-CZ 3.88Å; F553-F555 AromaticContact CG-CE1 3.73Å; F553-F555 HydrophobicContact CG-CE1 3.73Å; F553-F555 AromaticContact CG-CZ 3.72Å; F553-F555 HydrophobicContact CG-CZ 3.72Å; F553-F555 PolarHBondContact O-N 3.08Å; F555-V899 HydrophobicContact CB-CG1 4.12Å; F555-V899 HydrophobicContact CB-CG2 4.46Å; F555-V899 HydrophobicContact CD1-CG1 4.44Å; F555-V899 HydrophobicContact CD2-CB 4.32Å; F555-V899 HydrophobicContact CD2-CG1 3.82Å; F555-V899 HydrophobicContact CD2-CG2 3.54Å; F555-V899 HydrophobicContact CE2-CG1 4.33Å; F555-V899 HydrophobicContact CE2-CG2 4.14Å; F555-V899 HydrophobicContact CG-CG1 3.88Å; F555-V899 HydrophobicContact CG-CG2 4.29Å; F555-I951 HydrophobicContact CE1-CD1 3.99Å; F555-I951 HydrophobicContact CE2-CD1 4.32Å; F555-I951 HydrophobicContact CZ-CD1 3.77Å
556	L	91.2	Very high	87.9	Confident	30 Å²	30	37.7 Å²	37.7	16%	0.157	20%	0.204	C	C	.	.	H	α-helix	trans	-96.1	-15.7	173.6	-62.3	176.8	0	0	0	113.1	F553 P554	F553-L556 HydrophobicContact CB-CD1 4.43Å; F553-L556 HydrophobicContact CB-CG 4.49Å; F553-L556 HydrophobicContact CD2-CD1 4.34Å; F553-L556 WeakPolarHBondContact O-CB 3.16Å; F553-L556 PolarHBondContact O-N 3.27Å; P554-L556 PolarHBondContact O-N 3.11Å; P554-L556 VanDerWaalsContact O-N 3.1Å
557	A	92.9	Very high	87.8	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-110.6	-33.2	-174.9	0	0	0	0	0	113	Y495 V552 P554 I573	Y495-A557 HydrophobicContact CE2-CB 4.32Å; V552-A557 HydrophobicContact CG1-CB 3.98Å; P554-A557 PolarHBondContact O-N 3.48Å; A557-I573 PolarHBondContact O-N 2.98Å
558	V	93.6	Very high	87.7	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	154.8	-179.1	-61.3	0	0	0	0	111	L492 L528 P554 Y561 A569 A571 F572	L492-V558 HydrophobicContact CD1-CG1 3.83Å; L528-V558 HydrophobicContact CD2-CG2 4.27Å; P554-V558 WeakPolarHBondContact O-CG2 3.46Å; P554-V558 PolarHBondContact O-N 3.44Å; V558-Y561 HydrophobicContact CG2-CD1 4.16Å; V558-Y561 HydrophobicContact CG2-CE1 4Å; V558-A569 HydrophobicContact CB-CB 3.76Å; V558-A569 HydrophobicContact CG1-CB 4.38Å; V558-A569 HydrophobicContact CG2-CB 4.21Å; V558-A571 CarbonylContact C-O 3.54Å; V558-A571 WeakPolarHBondContact CA-O 3.42Å; V558-F572 HydrophobicContact CG1-CD1 4.18Å
559	G	92.4	Very high	87.9	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	167.1	-178.8	0	0	0	0	0	113.8	E570 A571 Y896	G559-E570 PolarHBondContact O-N 3.47Å; G559-A571 PolarHBondContact N-O 3.2Å; G559-A571 PolarHBondContact O-N 2.91Å; G559-Y896 CarbonylContact C-O 3.59Å; G559-Y896 WeakPolarHBondContact CA-O 3.18Å
560	G	89.4	Confident	88.2	Confident	15 Å²	15	40.9 Å²	40.9	16%	0.155	21%	0.213	C	C	.	.	S	Bend	trans	72.1	40.4	179.8	0	0	0	0	0	113.8	Y896	G560-Y896 PolarHBondContact N-O 3.38Å
561	Y	89.6	Confident	88.6	Confident	22 Å²	22	39.7 Å²	39.7	9%	0.086	20%	0.203	C	C	.	.			trans	-115.2	153.6	176.5	57.5	-95.6	0	0	0	109.4	V558 S563 Y566 A569 E898	V558-Y561 HydrophobicContact CG2-CD1 4.16Å; V558-Y561 HydrophobicContact CG2-CE1 4Å; Y561-S563 VanDerWaalsContact CD2-O 3.27Å; Y561-S563 WeakPolarHBondContact CD2-O 3.41Å; Y561-S563 WeakPolarHBondContact CE2-O 3.19Å; Y561-Y566 HydrophobicContact CD1-CD1 4.27Å; Y561-Y566 AromaticContact CD2-CD1 3.97Å; Y561-Y566 HydrophobicContact CD2-CD1 3.97Å; Y561-Y566 HydrophobicContact CD2-CE1 4.19Å; Y561-Y566 AromaticContact CE1-CD1 4Å; Y561-Y566 HydrophobicContact CE1-CD1 4Å; Y561-Y566 HydrophobicContact CE1-CE1 4.36Å; Y561-Y566 AromaticContact CE2-CD1 3.69Å; Y561-Y566 HydrophobicContact CE2-CD1 3.69Å; Y561-Y566 AromaticContact CE2-CE1 3.53Å; Y561-Y566 HydrophobicContact CE2-CE1 3.53Å; Y561-Y566 HydrophobicContact CG-CD1 4.26Å; Y561-Y566 AromaticContact CZ-CD1 3.7Å; Y561-Y566 AromaticContact CZ-CE1 3.62Å; Y561-A569 HydrophobicContact CD1-CB 4.44Å; Y561-E898 HydrophobicContact CD1-CG 4.48Å; Y561-E898 HydrophobicContact CE1-CG 3.96Å; Y561-E898 HydrophobicContact CE2-CG 4.25Å
562	K	83.6	Confident	88.9	Confident	176 Å²	176	38.2 Å²	38.2	77%	0.765	19%	0.193	S	C	*	.	S	Bend	trans	-98.9	129.6	175.4	-67.5	-178.7	-178.6	177	0	109.2	D564 E565	K562-D564 PolarHBondContact O-N 2.86Å; K562-E565 PolarHBondContact O-N 3.3Å
563	S	78.7	Confident	89	Confident	101 Å²	101	38.3 Å²	38.3	71%	0.706	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.5	-119.6	179.2	-52.7	0	0	0	0	111.9	Y561	Y561-S563 VanDerWaalsContact CD2-O 3.27Å; Y561-S563 WeakPolarHBondContact CD2-O 3.41Å; Y561-S563 WeakPolarHBondContact CE2-O 3.19Å
564	D	75.1	Confident	89.3	Confident	61 Å²	61	36.1 Å²	36.1	33%	0.326	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-115.8	18.6	-179	-42.7	-73.6	0	0	0	112.3	K193 K562 Y566	K193-D564 WeakPolarHBondContact CD-OD2 3.33Å; K193-D564 WeakPolarHBondContact CE-OD2 3.35Å; K193-D564 IonicContact NZ-OD1 3.09Å; K193-D564 PolarHBondContact NZ-OD1 3.3Å; K193-D564 IonicContact NZ-OD2 2.84Å; K193-D564 PolarHBondContact NZ-OD2 3.18Å; K562-D564 PolarHBondContact O-N 2.86Å; D564-Y566 HydrophobicContact CB-CE2 3.99Å; D564-Y566 VanDerWaalsContact O-CD2 3.23Å; D564-Y566 WeakPolarHBondContact O-CD2 3.33Å; D564-Y566 WeakPolarHBondContact O-CE2 3.28Å; D564-Y566 PolarHBondContact O-N 3.29Å
565	E	84.2	Confident	89.5	Confident	113 Å²	113	36.3 Å²	36.3	53%	0.528	19%	0.185	S	C	.	.			trans	-80.8	64.8	176.8	-66.4	-175.9	-174.5	0	0	111.1	K562 T567 N568	K562-E565 PolarHBondContact O-N 3.3Å; E565-T567 PolarHBondContact O-N 3.19Å; E565-T567 VanDerWaalsContact O-N 3.16Å; E565-N568 HydrophobicContact CB-CB 4.39Å; E565-N568 WeakPolarHBondContact O-CB 3.37Å; E565-N568 PolarHBondContact O-N 3.07Å; E565-N568 PolarHBondContact OE2-ND2 3.11Å
566	Y	88.1	Confident	89.8	Confident	37 Å²	37	34.8 Å²	34.8	15%	0.145	18%	0.179	C	C	.	.	G	3₁₀ helix	trans	-61.2	-26.8	-174	-52.9	-64.6	0	0	0	113.7	L528 P554 Y561 D564 N568 A569	L528-Y566 HydrophobicContact CB-CD2 3.87Å; L528-Y566 HydrophobicContact CB-CG 4.16Å; L528-Y566 WeakPolarHBondContact O-CE2 3.44Å; P554-Y566 HydrophobicContact CB-CD1 3.67Å; P554-Y566 HydrophobicContact CB-CE1 3.55Å; P554-Y566 HydrophobicContact CB-CG 4.21Å; P554-Y566 HydrophobicContact CG-CD1 4.46Å; P554-Y566 HydrophobicContact CG-CE1 4.11Å; P554-Y566 HydrophobicContact CG-CE2 4.34Å; Y561-Y566 HydrophobicContact CD1-CD1 4.27Å; Y561-Y566 AromaticContact CD2-CD1 3.97Å; Y561-Y566 HydrophobicContact CD2-CD1 3.97Å; Y561-Y566 HydrophobicContact CD2-CE1 4.19Å; Y561-Y566 AromaticContact CE1-CD1 4Å; Y561-Y566 HydrophobicContact CE1-CD1 4Å; Y561-Y566 HydrophobicContact CE1-CE1 4.36Å; Y561-Y566 AromaticContact CE2-CD1 3.69Å; Y561-Y566 HydrophobicContact CE2-CD1 3.69Å; Y561-Y566 AromaticContact CE2-CE1 3.53Å; Y561-Y566 HydrophobicContact CE2-CE1 3.53Å; Y561-Y566 HydrophobicContact CG-CD1 4.26Å; Y561-Y566 AromaticContact CZ-CD1 3.7Å; Y561-Y566 AromaticContact CZ-CE1 3.62Å; D564-Y566 HydrophobicContact CB-CE2 3.99Å; D564-Y566 VanDerWaalsContact O-CD2 3.23Å; D564-Y566 WeakPolarHBondContact O-CD2 3.33Å; D564-Y566 WeakPolarHBondContact O-CE2 3.28Å; D564-Y566 PolarHBondContact O-N 3.29Å; Y566-N568 PolarHBondContact O-N 3.31Å; Y566-A569 VanDerWaalsContact O-CB 3.26Å; Y566-A569 WeakPolarHBondContact O-CB 3.48Å; Y566-A569 PolarHBondContact O-N 3.28Å
567	T	87.6	Confident	90	Very high	10 Å²	10	33.9 Å²	33.9	6%	0.061	18%	0.175	C	C	.	.	G	3₁₀ helix	trans	-69.1	-18.7	177.4	59.2	0	0	0	0	113.2	N433 F434 S435 I438 I525 E565 A569	N433-T567 WeakPolarHBondContact O-CB 3.26Å; N433-T567 PolarHBondContact O-OG1 3.33Å; F434-T567 HydrophobicContact CE1-CG2 4.36Å; F434-T567 HydrophobicContact CE2-CG2 4.3Å; F434-T567 HydrophobicContact CZ-CG2 4.1Å; S435-T567 PolarHBondContact N-O 3.27Å; I438-T567 VanDerWaalsContact CD1-O 3.27Å; I438-T567 WeakPolarHBondContact CD1-O 3.34Å; I525-T567 HydrophobicContact CG1-CG2 3.86Å; E565-T567 PolarHBondContact O-N 3.19Å; E565-T567 VanDerWaalsContact O-N 3.16Å; T567-A569 VanDerWaalsContact C-N 3.32Å
568	N	89.8	Confident	90	Very high	52 Å²	52	33.9 Å²	33.9	28%	0.278	18%	0.175	S	C	.	.	G	3₁₀ helix	trans	-89.8	8.5	175.3	-74.8	-25.4	0	0	0	113	N433 E565 Y566	N433-N568 WeakPolarHBondContact CB-OD1 3.47Å; N433-N568 PolarHBondContact O-OD1 2.92Å; E565-N568 HydrophobicContact CB-CB 4.39Å; E565-N568 WeakPolarHBondContact O-CB 3.37Å; E565-N568 PolarHBondContact O-N 3.07Å; E565-N568 PolarHBondContact OE2-ND2 3.11Å; Y566-N568 PolarHBondContact O-N 3.31Å
569	A	91.6	Very high	89.9	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.188	C	C	.	.			trans	-54.8	139.7	-179.4	0	0	0	0	0	113.1	S435 V558 Y561 Y566 T567	S435-A569 WeakPolarHBondContact CB-O 3.46Å; S435-A569 PolarHBondContact OG-O 3.42Å; V558-A569 HydrophobicContact CB-CB 3.76Å; V558-A569 HydrophobicContact CG1-CB 4.38Å; V558-A569 HydrophobicContact CG2-CB 4.21Å; Y561-A569 HydrophobicContact CD1-CB 4.44Å; Y566-A569 VanDerWaalsContact O-CB 3.26Å; Y566-A569 WeakPolarHBondContact O-CB 3.48Å; Y566-A569 PolarHBondContact O-N 3.28Å; T567-A569 VanDerWaalsContact C-N 3.32Å
570	E	91.1	Very high	89.8	Confident	98 Å²	98	38 Å²	38	46%	0.458	20%	0.197	S	C	.	.	S	Bend	trans	-97.7	-13.7	-179.2	-68.8	-171.9	-173.7	0	0	113.1	T415 G559 Y896	T415-E570 WeakPolarHBondContact CG2-O 3.25Å; G559-E570 PolarHBondContact O-N 3.47Å; E570-Y896 HydrophobicContact CB-CD1 4.08Å; E570-Y896 HydrophobicContact CB-CE1 3.58Å; E570-Y896 WeakPolarHBondContact OE2-CE1 3.43Å
571	A	93.5	Very high	89.8	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	146	-179.8	0	0	0	0	0	113.7	I413 L414 T415 L437 V558 G559 Y896	I413-A571 HydrophobicContact CG2-CB 3.87Å; L414-A571 CarbonylContact O-C 3.46Å; L414-A571 VanDerWaalsContact O-CA 3.31Å; L414-A571 WeakPolarHBondContact O-CA 3.37Å; T415-A571 HydrophobicContact CG2-CB 3.81Å; L437-A571 VanDerWaalsContact CD2-C 3.45Å; V558-A571 CarbonylContact C-O 3.54Å; V558-A571 WeakPolarHBondContact CA-O 3.42Å; G559-A571 PolarHBondContact N-O 3.2Å; G559-A571 PolarHBondContact O-N 2.91Å; A571-Y896 HydrophobicContact CB-CD1 3.91Å; A571-Y896 HydrophobicContact CB-CD2 4.14Å; A571-Y896 HydrophobicContact CB-CE1 4.46Å; A571-Y896 HydrophobicContact CB-CG 3.72Å
572	F	94.2	Very high	89.5	Confident	1 Å²	1	44.1 Å²	44.1	0%	0.004	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	140.3	163.7	-65.2	-33.7	0	0	0	109.8	I413 L414 L437 I438 L442 I443 L446 L492 V558 F613	I413-F572 CarbonylContact C-O 3.57Å; I413-F572 WeakPolarHBondContact CA-O 3.3Å; L414-F572 HydrophobicContact CB-CB 4.41Å; L414-F572 HydrophobicContact CD1-CB 4.41Å; L414-F572 PolarHBondContact N-O 3.49Å; L414-F572 PolarHBondContact O-N 3.41Å; L437-F572 HydrophobicContact CD1-CD2 4Å; L437-F572 HydrophobicContact CD1-CE2 3.94Å; L437-F572 HydrophobicContact CD1-CZ 4.39Å; L437-F572 HydrophobicContact CD2-CD1 3.74Å; L437-F572 HydrophobicContact CD2-CD2 4.22Å; L437-F572 HydrophobicContact CD2-CE1 3.82Å; L437-F572 HydrophobicContact CD2-CE2 4.31Å; L437-F572 HydrophobicContact CD2-CG 3.95Å; L437-F572 HydrophobicContact CD2-CZ 4.13Å; L437-F572 HydrophobicContact CG-CD1 4.2Å; L437-F572 HydrophobicContact CG-CD2 4.04Å; L437-F572 HydrophobicContact CG-CE1 3.9Å; L437-F572 HydrophobicContact CG-CE2 3.75Å; L437-F572 HydrophobicContact CG-CG 4.27Å; L437-F572 HydrophobicContact CG-CZ 3.68Å; L437-F572 WeakPolarHBondContact O-CZ 3.42Å; I438-F572 HydrophobicContact CG1-CE1 4.14Å; I438-F572 HydrophobicContact CG1-CZ 4.42Å; L442-F572 HydrophobicContact CB-CE2 4.44Å; I443-F572 HydrophobicContact CG1-CZ 4.2Å; L446-F572 HydrophobicContact CD2-CB 4.24Å; L446-F572 HydrophobicContact CD2-CD2 3.92Å; L446-F572 HydrophobicContact CD2-CG 4.18Å; L492-F572 HydrophobicContact CD1-CD1 4.01Å; L492-F572 HydrophobicContact CD1-CE1 3.54Å; L492-F572 HydrophobicContact CD1-CZ 4.27Å; V558-F572 HydrophobicContact CG1-CD1 4.18Å; F572-F613 HydrophobicContact CD2-CE1 4.06Å; F572-F613 HydrophobicContact CD2-CZ 4.33Å; F572-F613 HydrophobicContact CE2-CE1 4.24Å; F572-F613 HydrophobicContact CE2-CZ 4.39Å
573	I	94.2	Very high	89.2	Confident	3 Å²	3	41.2 Å²	41.2	2%	0.015	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	123.9	179.8	-55.6	167.1	0	0	0	107.6	L412 A557 F897	L412-I573 WeakPolarHBondContact O-CA 3.44Å; A557-I573 PolarHBondContact O-N 2.98Å; I573-F897 HydrophobicContact CD1-CD2 3.74Å; I573-F897 HydrophobicContact CD1-CE2 3.88Å; I573-F897 HydrophobicContact CG2-CE2 4.32Å
574	L	95.1	Very high	89.3	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	118	175.3	173.3	62	0	0	0	108.2	Q411 L412 L414 L446 Q450 I453 V489 N490 F576	Q411-L574 CarbonylContact C-O 3.54Å; Q411-L574 WeakPolarHBondContact CA-O 3.3Å; L412-L574 HydrophobicContact CB-CB 4.33Å; L412-L574 HydrophobicContact CD1-CB 4.37Å; L412-L574 HydrophobicContact CD1-CD2 4.04Å; L412-L574 HydrophobicContact CD1-CG 4.13Å; L412-L574 HydrophobicContact CD2-CD2 4.47Å; L412-L574 PolarHBondContact N-O 3Å; L412-L574 PolarHBondContact O-N 3.46Å; L414-L574 HydrophobicContact CD1-CB 4.41Å; L446-L574 HydrophobicContact CD1-CD2 4.32Å; Q450-L574 HydrophobicContact CB-CD2 4.48Å; Q450-L574 HydrophobicContact CG-CD1 4.13Å; I453-L574 HydrophobicContact CD1-CD2 4.49Å; V489-L574 HydrophobicContact CG1-CD1 3.92Å; N490-L574 WeakPolarHBondContact O-CA 3.46Å; L574-F576 HydrophobicContact CD1-CE2 3.83Å; L574-F576 HydrophobicContact CD1-CZ 4.13Å; L574-F576 HydrophobicContact CD2-CE2 3.71Å; L574-F576 HydrophobicContact CD2-CZ 4.27Å; L574-F576 HydrophobicContact CG-CD2 4.26Å; L574-F576 HydrophobicContact CG-CE2 3.62Å; L574-F576 HydrophobicContact CG-CZ 4.35Å
575	T	95.1	Very high	89.8	Confident	11 Å²	11	44 Å²	44	7%	0.067	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	124.2	-177.6	-56.8	0	0	0	0	111.1	N410 Q411 V489 N490	N410-T575 WeakPolarHBondContact O-CA 3.21Å; Q411-T575 HydrophobicContact CG-CG2 3.94Å; V489-T575 WeakPolarHBondContact CA-O 3.48Å; N490-T575 PolarHBondContact N-O 3.33Å; N490-T575 PolarHBondContact O-N 3.2Å
576	F	95.1	Very high	90	Very high	1 Å²	1	41.6 Å²	41.6	0%	0.004	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	124.6	168.8	-66	-94.5	0	0	0	109.6	N410 L412 Q450 I453 Q454 L469 V489 L574 W594 F598	N410-F576 HydrophobicContact CB-CB 4.32Å; N410-F576 PolarHBondContact N-O 2.93Å; N410-F576 PolarHBondContact O-N 2.97Å; L412-F576 HydrophobicContact CD1-CE2 4.43Å; Q450-F576 HydrophobicContact CG-CZ 4.15Å; I453-F576 HydrophobicContact CB-CE1 4.4Å; I453-F576 HydrophobicContact CB-CE2 4.27Å; I453-F576 HydrophobicContact CB-CZ 3.79Å; I453-F576 HydrophobicContact CD1-CE2 4.08Å; I453-F576 HydrophobicContact CD1-CZ 4.32Å; I453-F576 HydrophobicContact CG2-CD1 4.31Å; I453-F576 HydrophobicContact CG2-CD2 4.27Å; I453-F576 HydrophobicContact CG2-CE1 3.74Å; I453-F576 HydrophobicContact CG2-CE2 3.68Å; I453-F576 HydrophobicContact CG2-CZ 3.39Å; Q454-F576 HydrophobicContact CG-CE1 3.95Å; L469-F576 HydrophobicContact CD2-CD1 4.46Å; V489-F576 HydrophobicContact CB-CD1 4.48Å; V489-F576 HydrophobicContact CB-CE1 4.44Å; V489-F576 HydrophobicContact CG1-CD1 4.12Å; V489-F576 HydrophobicContact CG1-CE1 3.79Å; V489-F576 HydrophobicContact CG1-CZ 4.09Å; V489-F576 HydrophobicContact CG2-CD1 3.66Å; V489-F576 HydrophobicContact CG2-CE1 3.74Å; L574-F576 HydrophobicContact CD1-CE2 3.83Å; L574-F576 HydrophobicContact CD1-CZ 4.13Å; L574-F576 HydrophobicContact CD2-CE2 3.71Å; L574-F576 HydrophobicContact CD2-CZ 4.27Å; L574-F576 HydrophobicContact CG-CD2 4.26Å; L574-F576 HydrophobicContact CG-CE2 3.62Å; L574-F576 HydrophobicContact CG-CZ 4.35Å; F576-W594 HydrophobicContact CB-CH2 4.22Å; F576-W594 HydrophobicContact CD1-CH2 4.32Å; F576-W594 HydrophobicContact CG-CH2 4.23Å; F576-F598 HydrophobicContact CD2-CE2 4.3Å; F576-F598 HydrophobicContact CE2-CE2 4.47Å
577	S	94.2	Very high	89.9	Confident	10 Å²	10	44 Å²	44	7%	0.07	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	121.5	178.2	-55	0	0	0	0	110.6	Y474 A488	Y474-S577 PolarHBondContact N-O 3.36Å; A488-S577 PolarHBondContact O-N 2.79Å
578	L	94.1	Very high	90	Very high	1 Å²	1	44.5 Å²	44.5	1%	0.005	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	147.2	177	-52.1	179.6	0	0	0	111.1	F407 R408 N410 L469 V472 N580 W594 E595	F407-L578 CarbonylContact C-O 3.58Å; F407-L578 WeakPolarHBondContact CA-O 3.31Å; F407-L578 VanDerWaalsContact CB-O 3.26Å; F407-L578 WeakPolarHBondContact CB-O 3.22Å; R408-L578 HydrophobicContact CB-CB 4.27Å; R408-L578 PolarHBondContact N-O 2.87Å; R408-L578 PolarHBondContact O-N 2.92Å; N410-L578 VanDerWaalsContact ND2-CD1 3.28Å; N410-L578 WeakPolarHBondContact ND2-CD1 3.03Å; L469-L578 HydrophobicContact CD1-CD2 3.78Å; V472-L578 HydrophobicContact CG2-CD2 4.09Å; L578-N580 PolarHBondContact O-N 3.45Å; L578-W594 HydrophobicContact CD1-CD2 4.37Å; L578-W594 HydrophobicContact CD1-CE3 3.55Å; L578-W594 HydrophobicContact CD1-CZ3 3.87Å; L578-W594 HydrophobicContact CD2-CE3 4.25Å; L578-W594 HydrophobicContact CD2-CZ3 4.22Å; L578-W594 HydrophobicContact CG-CE3 4.43Å; L578-W594 HydrophobicContact CG-CZ3 4.4Å; L578-E595 HydrophobicContact CD1-CG 4.05Å
579	N	91.8	Very high	89.9	Confident	49 Å²	49	47.2 Å²	47.2	26%	0.262	23%	0.231	S	C	.	.			trans	-62.6	136.3	170.2	-76.3	-39.5	0	0	0	110.4	V472 C473 Y474 Y581	V472-N579 PolarHBondContact O-N 3.26Å; C473-N579 PolarHBondContact O-ND2 3.41Å; Y474-N579 WeakPolarHBondContact CD2-OD1 3.24Å; N579-Y581 HydrophobicContact CB-CE1 4.44Å; N579-Y581 HydrophobicContact CB-CE2 3.86Å; N579-Y581 WeakPolarHBondContact O-CE2 3.3Å
580	N	90.6	Very high	89.9	Confident	37 Å²	37	47.3 Å²	47.3	20%	0.198	23%	0.232	C	C	.	.			trans	-98.9	149.3	174.1	-160.6	7.1	0	0	0	110.2	P405 F406 R408 L578	P405-N580 HydrophobicContact CB-CB 4.12Å; F406-N580 WeakPolarHBondContact O-CB 3.44Å; F406-N580 PolarHBondContact O-ND2 3.49Å; R408-N580 HydrophobicContact CG-CB 3.8Å; L578-N580 PolarHBondContact O-N 3.45Å
581	Y	87.8	Confident	90	Very high	43 Å²	43	42.6 Å²	42.6	17%	0.169	21%	0.21	C	C	.	.			trans	-136.3	156.8	-175	-57.6	-81	0	0	0	110	N579 K587 F588	N579-Y581 HydrophobicContact CB-CE1 4.44Å; N579-Y581 HydrophobicContact CB-CE2 3.86Å; N579-Y581 WeakPolarHBondContact O-CE2 3.3Å; Y581-K587 HydrophobicContact CD1-CB 4.26Å; Y581-K587 HydrophobicContact CD2-CB 3.79Å; Y581-K587 HydrophobicContact CE1-CB 4.17Å; Y581-K587 HydrophobicContact CE1-CD 3.79Å; Y581-K587 HydrophobicContact CE2-CB 3.7Å; Y581-K587 HydrophobicContact CE2-CD 4.33Å; Y581-K587 HydrophobicContact CG-CB 4.07Å; Y581-F588 WeakPolarHBondContact O-CD2 3.41Å
582	L	83.3	Confident	89.9	Confident	122 Å²	122	44.4 Å²	44.4	64%	0.639	22%	0.219	S	C	*	.			trans	-60.3	145.3	168.3	-63.9	173	0	0	0	110	D584 N585	L582-D584 PolarHBondContact O-N 2.87Å; L582-D584 VanDerWaalsContact O-N 3.08Å; L582-N585 VanDerWaalsContact O-CB 3.25Å; L582-N585 WeakPolarHBondContact O-CB 3.36Å; L582-N585 PolarHBondContact O-N 2.84Å
583	R	78.3	Confident	89.8	Confident	116 Å²	116	47.7 Å²	47.7	44%	0.438	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-25.8	-174.5	-73.3	-173.4	176.5	-103.3	-1.8	114	D380 N585 F588 E624	D380-R583 IonicContact OD1-NH2 2.97Å; D380-R583 IonicContact OD2-CZ 2.94Å; D380-R583 VanDerWaalsContact OD2-CZ 3.24Å; D380-R583 IonicContact OD2-NE 3.96Å; D380-R583 PolarHBondContact OD2-NE 3.39Å; D380-R583 IonicContact OD2-NH2 2.75Å; D380-R583 PolarHBondContact OD2-NH2 2.88Å; R583-N585 VanDerWaalsContact C-N 3.3Å; R583-N585 PolarHBondContact O-N 3Å; R583-F588 HydrophobicContact CG-CD1 4.46Å; R583-F588 HydrophobicContact CG-CE1 4.01Å; R583-F588 HydrophobicContact CG-CZ 4.14Å; R583-E624 IonicContact NH2-OE2 3.59Å
584	D	80.4	Confident	89.8	Confident	162 Å²	162	47.6 Å²	47.6	87%	0.866	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.2	-15.8	177.5	-62	-32.8	0	0	0	113.4	L582	L582-D584 PolarHBondContact O-N 2.87Å; L582-D584 VanDerWaalsContact O-N 3.08Å
585	N	86.1	Confident	89.8	Confident	58 Å²	58	47.6 Å²	47.6	31%	0.31	23%	0.234	S	C	.	.	S	Bend	trans	-77.8	129.5	-178.7	-170	-40.5	0	0	0	110.4	L582 R583 K587 F588	L582-N585 VanDerWaalsContact O-CB 3.25Å; L582-N585 WeakPolarHBondContact O-CB 3.36Å; L582-N585 PolarHBondContact O-N 2.84Å; R583-N585 VanDerWaalsContact C-N 3.3Å; R583-N585 PolarHBondContact O-N 3Å; N585-K587 PolarHBondContact O-N 2.81Å; N585-K587 VanDerWaalsContact O-N 3.15Å; N585-K587 WeakPolarHBondContact OD1-CB 3.41Å; N585-K587 PolarHBondContact OD1-N 3.2Å; N585-F588 WeakPolarHBondContact O-CB 3.21Å; N585-F588 PolarHBondContact O-N 2.61Å
586	P	87.1	Confident	89.8	Confident	62 Å²	62	49 Å²	49	40%	0.403	24%	0.243	S	C	.	.	H	α-helix	trans	-57.7	-31.7	178.5	23.1	-34.4	0	0	0	113	D462 F588 K589 V590	D462-P586 HydrophobicContact CB-CB 4.15Å; P586-F588 PolarHBondContact O-N 3.09Å; P586-F588 VanDerWaalsContact O-N 3.17Å; P586-K589 PolarHBondContact O-N 2.92Å; P586-K589 VanDerWaalsContact O-N 3.09Å; P586-V590 PolarHBondContact O-N 3.36Å
587	K	87.3	Confident	89.7	Confident	89 Å²	89	52 Å²	52	39%	0.387	26%	0.257	S	S	.	.	H	α-helix	trans	-61.2	-24.5	176.9	-65.9	-170.4	175.9	-169.8	0	113.3	Y581 N585 V590 A591	Y581-K587 HydrophobicContact CD1-CB 4.26Å; Y581-K587 HydrophobicContact CD2-CB 3.79Å; Y581-K587 HydrophobicContact CE1-CB 4.17Å; Y581-K587 HydrophobicContact CE1-CD 3.79Å; Y581-K587 HydrophobicContact CE2-CB 3.7Å; Y581-K587 HydrophobicContact CE2-CD 4.33Å; Y581-K587 HydrophobicContact CG-CB 4.07Å; N585-K587 PolarHBondContact O-N 2.81Å; N585-K587 VanDerWaalsContact O-N 3.15Å; N585-K587 WeakPolarHBondContact OD1-CB 3.41Å; N585-K587 PolarHBondContact OD1-N 3.2Å; K587-V590 PolarHBondContact O-N 3.01Å; K587-A591 PolarHBondContact O-N 3.43Å
588	F	89.1	Confident	89.7	Confident	19 Å²	19	51.5 Å²	51.5	8%	0.083	25%	0.253	C	S	.	.	H	α-helix	trans	-61.9	-44.2	174.4	-177.5	-105	0	0	0	111.3	Y581 R583 N585 P586 V590 A591 L592	Y581-F588 WeakPolarHBondContact O-CD2 3.41Å; R583-F588 HydrophobicContact CG-CD1 4.46Å; R583-F588 HydrophobicContact CG-CE1 4.01Å; R583-F588 HydrophobicContact CG-CZ 4.14Å; N585-F588 WeakPolarHBondContact O-CB 3.21Å; N585-F588 PolarHBondContact O-N 2.61Å; P586-F588 PolarHBondContact O-N 3.09Å; P586-F588 VanDerWaalsContact O-N 3.17Å; F588-V590 VanDerWaalsContact C-N 3.34Å; F588-V590 PolarHBondContact O-N 3.42Å; F588-A591 PolarHBondContact O-N 2.79Å; F588-L592 HydrophobicContact CD1-CD1 3.9Å; F588-L592 HydrophobicContact CD1-CG 4.48Å; F588-L592 HydrophobicContact CE1-CD1 3.47Å; F588-L592 VanDerWaalsContact CE1-CD1 3.47Å; F588-L592 HydrophobicContact CE1-CG 4.17Å; F588-L592 HydrophobicContact CZ-CD1 4.02Å; F588-L592 HydrophobicContact CZ-CD2 4.45Å; F588-L592 HydrophobicContact CZ-CG 4.35Å; F588-L592 WeakPolarHBondContact O-CG 3.1Å; F588-L592 PolarHBondContact O-N 2.94Å
589	K	88.6	Confident	89.7	Confident	110 Å²	110	52 Å²	52	48%	0.478	26%	0.256	S	S	.	.	H	α-helix	trans	-65.6	-38.3	177	-66.2	179.7	-179.3	175.8	0	112	D462 P586 L592 Q593	D462-K589 IonicContact OD1-NZ 3.09Å; D462-K589 VanDerWaalsContact OD2-CD 3.31Å; D462-K589 WeakPolarHBondContact OD2-CD 3.48Å; P586-K589 PolarHBondContact O-N 2.92Å; P586-K589 VanDerWaalsContact O-N 3.09Å; K589-L592 PolarHBondContact O-N 2.97Å; K589-Q593 WeakPolarHBondContact O-CG 3.04Å; K589-Q593 PolarHBondContact O-N 3.47Å
590	V	91.5	Very high	89.8	Confident	1 Å²	1	54.2 Å²	54.2	1%	0.006	26%	0.263	C	S	.	.	H	α-helix	trans	-62.1	-44	176.2	-174.8	0	0	0	0	110.8	F458 S460 L463 A467 V472 P586 K587 F588 L592 Q593 W594	F458-V590 HydrophobicContact CE2-CG1 4.17Å; F458-V590 HydrophobicContact CZ-CG1 3.78Å; F458-V590 WeakPolarHBondContact CZ-O 3.48Å; S460-V590 WeakPolarHBondContact OG-CG2 3.17Å; L463-V590 HydrophobicContact CD1-CB 4.44Å; L463-V590 HydrophobicContact CD1-CG1 4.01Å; L463-V590 HydrophobicContact CD1-CG2 3.74Å; L463-V590 HydrophobicContact CG-CG2 3.88Å; A467-V590 HydrophobicContact CB-CG1 3.77Å; V472-V590 HydrophobicContact CG1-CB 4.31Å; V472-V590 HydrophobicContact CG1-CG1 3.87Å; P586-V590 PolarHBondContact O-N 3.36Å; K587-V590 PolarHBondContact O-N 3.01Å; F588-V590 VanDerWaalsContact C-N 3.34Å; F588-V590 PolarHBondContact O-N 3.42Å; V590-L592 PolarHBondContact O-N 2.95Å; V590-Q593 PolarHBondContact O-N 3.4Å; V590-W594 PolarHBondContact O-N 3.28Å
591	A	92.4	Very high	89.9	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-61.2	-43.4	175	0	0	0	0	0	111.8	V472 K587 F588 Q593 W594 E595	V472-A591 HydrophobicContact CG1-CB 4.31Å; K587-A591 PolarHBondContact O-N 3.43Å; F588-A591 PolarHBondContact O-N 2.79Å; A591-Q593 VanDerWaalsContact C-N 3.32Å; A591-Q593 PolarHBondContact O-N 3.38Å; A591-W594 PolarHBondContact O-N 2.89Å; A591-E595 WeakPolarHBondContact O-CG 3.39Å; A591-E595 PolarHBondContact O-N 3.37Å
592	L	91.9	Very high	90	Very high	37 Å²	37	52.8 Å²	52.8	19%	0.194	26%	0.258	C	S	.	.	H	α-helix	trans	-62.9	-35.7	175.6	-69.9	177.6	0	0	0	113.2	F588 K589 V590 T596 R621	F588-L592 HydrophobicContact CD1-CD1 3.9Å; F588-L592 HydrophobicContact CD1-CG 4.48Å; F588-L592 HydrophobicContact CE1-CD1 3.47Å; F588-L592 VanDerWaalsContact CE1-CD1 3.47Å; F588-L592 HydrophobicContact CE1-CG 4.17Å; F588-L592 HydrophobicContact CZ-CD1 4.02Å; F588-L592 HydrophobicContact CZ-CD2 4.45Å; F588-L592 HydrophobicContact CZ-CG 4.35Å; F588-L592 WeakPolarHBondContact O-CG 3.1Å; F588-L592 PolarHBondContact O-N 2.94Å; K589-L592 PolarHBondContact O-N 2.97Å; V590-L592 PolarHBondContact O-N 2.95Å; L592-T596 PolarHBondContact O-N 2.97Å; L592-T596 VanDerWaalsContact O-N 3.15Å; L592-T596 PolarHBondContact O-OG1 2.96Å; L592-R621 HydrophobicContact CD2-CB 3.87Å; L592-R621 PolarHBondContact O-NH1 3Å
593	Q	92.2	Very high	90.4	Very high	71 Å²	71	49.4 Å²	49.4	33%	0.332	24%	0.239	S	C	.	.	H	α-helix	trans	-67.8	-45	174.7	-75.7	177.4	-12	0	0	111.1	F458 K589 V590 A591 E595 T596 E597	F458-Q593 HydrophobicContact CD2-CB 4.18Å; F458-Q593 HydrophobicContact CE2-CB 3.54Å; F458-Q593 HydrophobicContact CE2-CG 4.47Å; F458-Q593 VanDerWaalsContact CE2-OE1 3.28Å; F458-Q593 HydrophobicContact CZ-CB 3.8Å; K589-Q593 WeakPolarHBondContact O-CG 3.04Å; K589-Q593 PolarHBondContact O-N 3.47Å; V590-Q593 PolarHBondContact O-N 3.4Å; A591-Q593 VanDerWaalsContact C-N 3.32Å; A591-Q593 PolarHBondContact O-N 3.38Å; Q593-E595 VanDerWaalsContact C-N 3.31Å; Q593-E595 PolarHBondContact O-N 3Å; Q593-T596 WeakPolarHBondContact O-CA 3.29Å; Q593-T596 VanDerWaalsContact O-CB 3.27Å; Q593-T596 WeakPolarHBondContact O-CB 3.26Å; Q593-T596 PolarHBondContact O-N 2.91Å; Q593-E597 PolarHBondContact O-N 3.47Å; Q593-E597 VanDerWaalsContact O-N 3.14Å
594	W	94.1	Very high	90.9	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-57.3	-45	174.2	-172.8	91.9	0	0	0	111.5	I453 I456 F458 L469 V472 F576 L578 V590 A591 T596 E597 F598	I453-W594 HydrophobicContact CG2-CH2 4.02Å; I453-W594 HydrophobicContact CG2-CZ2 3.95Å; I456-W594 HydrophobicContact CD1-CZ2 4.04Å; F458-W594 HydrophobicContact CE1-CB 3.68Å; F458-W594 AromaticContact CE1-CD1 3.97Å; F458-W594 HydrophobicContact CE1-CG 4.24Å; F458-W594 HydrophobicContact CZ-CB 4.09Å; L469-W594 HydrophobicContact CD1-CH2 4.31Å; L469-W594 HydrophobicContact CD1-CZ2 3.65Å; V472-W594 HydrophobicContact CG2-CB 4.4Å; V472-W594 HydrophobicContact CG2-CG 4.22Å; F576-W594 HydrophobicContact CB-CH2 4.22Å; F576-W594 HydrophobicContact CD1-CH2 4.32Å; F576-W594 HydrophobicContact CG-CH2 4.23Å; L578-W594 HydrophobicContact CD1-CD2 4.37Å; L578-W594 HydrophobicContact CD1-CE3 3.55Å; L578-W594 HydrophobicContact CD1-CZ3 3.87Å; L578-W594 HydrophobicContact CD2-CE3 4.25Å; L578-W594 HydrophobicContact CD2-CZ3 4.22Å; L578-W594 HydrophobicContact CG-CE3 4.43Å; L578-W594 HydrophobicContact CG-CZ3 4.4Å; V590-W594 PolarHBondContact O-N 3.28Å; A591-W594 PolarHBondContact O-N 2.89Å; W594-T596 PolarHBondContact O-N 3.36Å; W594-E597 PolarHBondContact O-N 2.86Å; W594-F598 HydrophobicContact CE3-CB 4.2Å; W594-F598 HydrophobicContact CH2-CB 4.26Å; W594-F598 HydrophobicContact CH2-CD2 4.08Å; W594-F598 HydrophobicContact CH2-CG 4.35Å; W594-F598 HydrophobicContact CZ3-CB 3.93Å; W594-F598 HydrophobicContact CZ3-CD2 4.28Å; W594-F598 HydrophobicContact CZ3-CG 4.13Å; W594-F598 WeakPolarHBondContact O-CB 3.25Å; W594-F598 PolarHBondContact O-N 3.38Å
595	E	95.3	Very high	91.2	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-60.7	-30.7	175.8	-73	174.7	-176.5	0	0	112.5	R408 L578 A591 Q593 F598 L599 A619 R621	R408-E595 IonicContact CZ-OE1 2.59Å; R408-E595 IonicContact CZ-OE2 3.71Å; R408-E595 IonicContact NE-OE1 3.97Å; R408-E595 PolarHBondContact NE-OE1 2.92Å; R408-E595 IonicContact NE-OE2 3.25Å; R408-E595 IonicContact NH2-OE1 4Å; R408-E595 PolarHBondContact NH2-OE1 3.34Å; R408-E595 IonicContact NH2-OE2 2.74Å; R408-E595 PolarHBondContact NH2-OE2 3.37Å; L578-E595 HydrophobicContact CD1-CG 4.05Å; A591-E595 WeakPolarHBondContact O-CG 3.39Å; A591-E595 PolarHBondContact O-N 3.37Å; Q593-E595 VanDerWaalsContact C-N 3.31Å; Q593-E595 PolarHBondContact O-N 3Å; E595-F598 WeakPolarHBondContact O-CB 3.37Å; E595-L599 VanDerWaalsContact O-CG 3.27Å; E595-L599 WeakPolarHBondContact O-CG 3.46Å; E595-L599 PolarHBondContact O-N 2.94Å; E595-A619 HydrophobicContact CB-CB 4.26Å; E595-A619 HydrophobicContact CG-CB 4.44Å; E595-R621 HydrophobicContact CB-CG 3.94Å; E595-R621 WeakPolarHBondContact OE2-CB 3.48Å; E595-R621 VanDerWaalsContact OE2-CG 3.3Å; E595-R621 WeakPolarHBondContact OE2-CG 2.93Å; E595-R621 PolarHBondContact OE2-N 2.85Å
596	T	94.1	Very high	91.2	Very high	42 Å²	42	43.7 Å²	43.7	26%	0.258	21%	0.212	S	C	.	.	H	α-helix	trans	-70.1	-45	177.2	-50.8	0	0	0	0	111.3	L592 Q593 W594 F598 L599 K600 R621	L592-T596 PolarHBondContact O-N 2.97Å; L592-T596 VanDerWaalsContact O-N 3.15Å; L592-T596 PolarHBondContact O-OG1 2.96Å; Q593-T596 WeakPolarHBondContact O-CA 3.29Å; Q593-T596 VanDerWaalsContact O-CB 3.27Å; Q593-T596 WeakPolarHBondContact O-CB 3.26Å; Q593-T596 PolarHBondContact O-N 2.91Å; W594-T596 PolarHBondContact O-N 3.36Å; T596-F598 VanDerWaalsContact C-N 3.34Å; T596-L599 PolarHBondContact O-N 3.1Å; T596-K600 WeakPolarHBondContact O-CG 3.29Å; T596-K600 PolarHBondContact O-N 3.23Å; T596-K600 VanDerWaalsContact O-N 3.08Å; T596-R621 PolarHBondContact OG1-NH1 3.43Å
597	E	93.4	Very high	91.1	Very high	62 Å²	62	49.5 Å²	49.5	29%	0.29	23%	0.226	S	C	.	.	H	α-helix	trans	-66.8	-38.5	176.3	-63.8	-51.6	135.5	0	0	111.5	I456 F458 Q593 W594 L599 K600 I601	I456-E597 HydrophobicContact CG2-CB 3.89Å; F458-E597 HydrophobicContact CD1-CG 4.49Å; Q593-E597 PolarHBondContact O-N 3.47Å; Q593-E597 VanDerWaalsContact O-N 3.14Å; W594-E597 PolarHBondContact O-N 2.86Å; E597-L599 PolarHBondContact O-N 2.95Å; E597-K600 PolarHBondContact O-N 3.08Å; E597-K600 IonicContact OE1-NZ 2.78Å; E597-K600 PolarHBondContact OE1-NZ 3.01Å; E597-K600 WeakPolarHBondContact OE2-CD 3.23Å; E597-K600 IonicContact OE2-NZ 2.78Å; E597-I601 WeakPolarHBondContact O-CG1 3.28Å; E597-I601 PolarHBondContact O-N 3.34Å
598	F	94.8	Very high	91	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-54.3	-51.7	170.7	166.1	-99	0	0	0	111.8	N410 L412 I453 I456 F576 W594 E595 T596 K600 I601 V602 A619	N410-F598 HydrophobicContact CB-CD1 4.46Å; N410-F598 HydrophobicContact CB-CE1 4.02Å; N410-F598 HydrophobicContact CB-CZ 4.1Å; L412-F598 HydrophobicContact CD1-CE2 3.64Å; L412-F598 HydrophobicContact CD1-CZ 3.46Å; L412-F598 VanDerWaalsContact CD1-CZ 3.46Å; L412-F598 HydrophobicContact CG-CZ 4.15Å; I453-F598 HydrophobicContact CD1-CD2 4.35Å; I453-F598 HydrophobicContact CD1-CE2 4.07Å; I453-F598 HydrophobicContact CG1-CD2 4.41Å; I453-F598 HydrophobicContact CG2-CD2 3.73Å; I453-F598 HydrophobicContact CG2-CE2 4.17Å; I456-F598 HydrophobicContact CD1-CB 4.24Å; F576-F598 HydrophobicContact CD2-CE2 4.3Å; F576-F598 HydrophobicContact CE2-CE2 4.47Å; W594-F598 HydrophobicContact CE3-CB 4.2Å; W594-F598 HydrophobicContact CH2-CB 4.26Å; W594-F598 HydrophobicContact CH2-CD2 4.08Å; W594-F598 HydrophobicContact CH2-CG 4.35Å; W594-F598 HydrophobicContact CZ3-CB 3.93Å; W594-F598 HydrophobicContact CZ3-CD2 4.28Å; W594-F598 HydrophobicContact CZ3-CG 4.13Å; W594-F598 WeakPolarHBondContact O-CB 3.25Å; W594-F598 PolarHBondContact O-N 3.38Å; E595-F598 WeakPolarHBondContact O-CB 3.37Å; T596-F598 VanDerWaalsContact C-N 3.34Å; F598-K600 VanDerWaalsContact C-N 3.32Å; F598-K600 PolarHBondContact O-N 3.09Å; F598-I601 PolarHBondContact O-N 3.33Å; F598-V602 HydrophobicContact CD2-CG2 4.3Å; F598-V602 HydrophobicContact CE2-CG2 3.96Å; F598-V602 HydrophobicContact CZ-CG2 4.07Å; F598-V602 VanDerWaalsContact O-CG2 3.32Å; F598-V602 WeakPolarHBondContact O-CG2 3.43Å; F598-V602 PolarHBondContact O-N 3.43Å; F598-V602 VanDerWaalsContact O-N 3.1Å; F598-A619 HydrophobicContact CD1-CB 4.15Å; F598-A619 HydrophobicContact CE1-CB 4.25Å
599	L	94	Very high	90.2	Very high	13 Å²	13	54 Å²	54	7%	0.068	26%	0.262	C	S	.	.	H	α-helix	trans	-61.5	-38.9	179	-72.2	172.8	0	0	0	112.3	E595 T596 E597 V602 Q603 Y617 A619 R621	E595-L599 VanDerWaalsContact O-CG 3.27Å; E595-L599 WeakPolarHBondContact O-CG 3.46Å; E595-L599 PolarHBondContact O-N 2.94Å; T596-L599 PolarHBondContact O-N 3.1Å; E597-L599 PolarHBondContact O-N 2.95Å; L599-V602 PolarHBondContact O-N 3.22Å; L599-Q603 VanDerWaalsContact O-CB 3.31Å; L599-Q603 WeakPolarHBondContact O-CB 3.36Å; L599-Q603 WeakPolarHBondContact O-CG 3.22Å; L599-Q603 PolarHBondContact O-N 3.12Å; L599-Y617 HydrophobicContact CD2-CD2 3.7Å; L599-Y617 HydrophobicContact CD2-CE2 3.77Å; L599-A619 HydrophobicContact CD1-CB 4.01Å; L599-A619 HydrophobicContact CD2-CB 3.83Å; L599-A619 HydrophobicContact CG-CB 3.9Å; L599-R621 HydrophobicContact CD1-CG 4.37Å
600	K	92.9	Very high	89.4	Confident	94 Å²	94	56.9 Å²	56.9	41%	0.409	28%	0.275	S	S	.	.	H	α-helix	trans	-61.5	-49	176.8	-72.6	171.8	-175.8	169.6	0	111.7	T596 E597 F598 V602 Q603 D604	T596-K600 WeakPolarHBondContact O-CG 3.29Å; T596-K600 PolarHBondContact O-N 3.23Å; T596-K600 VanDerWaalsContact O-N 3.08Å; E597-K600 PolarHBondContact O-N 3.08Å; E597-K600 IonicContact OE1-NZ 2.78Å; E597-K600 PolarHBondContact OE1-NZ 3.01Å; E597-K600 WeakPolarHBondContact OE2-CD 3.23Å; E597-K600 IonicContact OE2-NZ 2.78Å; F598-K600 VanDerWaalsContact C-N 3.32Å; F598-K600 PolarHBondContact O-N 3.09Å; K600-V602 VanDerWaalsContact C-N 3.31Å; K600-V602 PolarHBondContact O-N 2.91Å; K600-Q603 PolarHBondContact O-N 2.74Å; K600-D604 WeakPolarHBondContact O-CB 3.39Å; K600-D604 PolarHBondContact O-N 3.14Å
601	I	92.4	Very high	88.4	Confident	48 Å²	48	58.1 Å²	58.1	25%	0.246	29%	0.285	C	S	.	.	H	α-helix	trans	-59.5	-45	179.7	-70.6	168.5	0	0	0	110.7	I453 I456 E597 F598 D604 Y605	I453-I601 HydrophobicContact CG1-CG2 4.28Å; I456-I601 HydrophobicContact CD1-CD1 3.71Å; I456-I601 HydrophobicContact CG1-CD1 3.49Å; I456-I601 VanDerWaalsContact CG1-CD1 3.49Å; E597-I601 WeakPolarHBondContact O-CG1 3.28Å; E597-I601 PolarHBondContact O-N 3.34Å; F598-I601 PolarHBondContact O-N 3.33Å; I601-D604 PolarHBondContact O-N 3.17Å; I601-Y605 WeakPolarHBondContact O-CB 3.43Å; I601-Y605 PolarHBondContact O-N 3.14Å
602	V	91.2	Very high	87.7	Confident	2 Å²	2	61.8 Å²	61.8	1%	0.012	31%	0.305	C	S	.	.	H	α-helix	trans	-66.5	-41.2	-179.7	175	0	0	0	0	111.3	L412 I453 F598 L599 K600 Y605 Q606 F615 Y617	L412-V602 HydrophobicContact CD2-CG1 4.2Å; L412-V602 HydrophobicContact CD2-CG2 3.82Å; I453-V602 HydrophobicContact CD1-CG2 4.38Å; F598-V602 HydrophobicContact CD2-CG2 4.3Å; F598-V602 HydrophobicContact CE2-CG2 3.96Å; F598-V602 HydrophobicContact CZ-CG2 4.07Å; F598-V602 VanDerWaalsContact O-CG2 3.32Å; F598-V602 WeakPolarHBondContact O-CG2 3.43Å; F598-V602 PolarHBondContact O-N 3.43Å; F598-V602 VanDerWaalsContact O-N 3.1Å; L599-V602 PolarHBondContact O-N 3.22Å; K600-V602 VanDerWaalsContact C-N 3.31Å; K600-V602 PolarHBondContact O-N 2.91Å; V602-Y605 WeakPolarHBondContact O-CB 3.25Å; V602-Y605 PolarHBondContact O-N 3.24Å; V602-Q606 PolarHBondContact O-N 2.99Å; V602-F615 HydrophobicContact CG1-CD2 4.06Å; V602-F615 HydrophobicContact CG1-CE2 3.48Å; V602-F615 VanDerWaalsContact CG1-CE2 3.48Å; V602-F615 HydrophobicContact CG1-CZ 4.37Å; V602-F615 WeakPolarHBondContact O-CZ 3.3Å; V602-Y617 HydrophobicContact CG1-CD1 3.54Å; V602-Y617 HydrophobicContact CG1-CD2 4.04Å; V602-Y617 HydrophobicContact CG1-CE1 4.08Å; V602-Y617 HydrophobicContact CG1-CG 3.51Å
603	Q	90.5	Very high	87.3	Confident	51 Å²	51	60.6 Å²	60.6	24%	0.238	30%	0.298	C	S	.	.	H	α-helix	trans	-65.9	-40.7	175.9	-76.1	172.9	6.1	0	0	112.9	L599 K600 Y605 Q606 R607 Y617	L599-Q603 VanDerWaalsContact O-CB 3.31Å; L599-Q603 WeakPolarHBondContact O-CB 3.36Å; L599-Q603 WeakPolarHBondContact O-CG 3.22Å; L599-Q603 PolarHBondContact O-N 3.12Å; K600-Q603 PolarHBondContact O-N 2.74Å; Q603-Y605 VanDerWaalsContact C-N 3.32Å; Q603-Q606 WeakPolarHBondContact O-CB 3.29Å; Q603-Q606 PolarHBondContact O-N 2.74Å; Q603-Q606 VanDerWaalsContact O-N 3.15Å; Q603-R607 WeakPolarHBondContact O-CG 3.48Å; Q603-R607 PolarHBondContact O-N 3.25Å; Q603-Y617 HydrophobicContact CG-CE2 4.31Å; Q603-Y617 WeakPolarHBondContact CG-OH 3.33Å; Q603-Y617 PolarHBondContact NE2-OH 2.8Å
604	D	89.9	Confident	86.9	Confident	98 Å²	98	60 Å²	60	52%	0.524	30%	0.299	S	S	.	.	H	α-helix	trans	-67.1	-36.7	176.5	-73.3	-20.1	0	0	0	111.3	K600 I601 Q606 R607 N608	K600-D604 WeakPolarHBondContact O-CB 3.39Å; K600-D604 PolarHBondContact O-N 3.14Å; I601-D604 PolarHBondContact O-N 3.17Å; D604-Q606 VanDerWaalsContact C-N 3.29Å; D604-Q606 PolarHBondContact O-N 3.29Å; D604-R607 PolarHBondContact O-N 3.25Å; D604-R607 IonicContact OD1-NH1 3.76Å; D604-N608 PolarHBondContact O-N 2.97Å
605	Y	86.3	Confident	86.4	Confident	31 Å²	31	60.7 Å²	60.7	12%	0.122	30%	0.302	C	S	.	.	H	α-helix	trans	-61.2	-39.6	170.5	-161	-92.1	0	0	0	111.6	E445 L449 I601 V602 Q603 R607 N608 A611 F615	E445-Y605 VanDerWaalsContact CD-OH 3.24Å; E445-Y605 WeakPolarHBondContact CG-OH 3.4Å; E445-Y605 PolarHBondContact OE1-OH 3.38Å; L449-Y605 HydrophobicContact CD1-CD2 3.96Å; L449-Y605 HydrophobicContact CD1-CE2 4.36Å; L449-Y605 HydrophobicContact CD1-CG 4.12Å; I601-Y605 WeakPolarHBondContact O-CB 3.43Å; I601-Y605 PolarHBondContact O-N 3.14Å; V602-Y605 WeakPolarHBondContact O-CB 3.25Å; V602-Y605 PolarHBondContact O-N 3.24Å; Q603-Y605 VanDerWaalsContact C-N 3.32Å; Y605-R607 VanDerWaalsContact C-N 3.35Å; Y605-R607 PolarHBondContact O-N 3.07Å; Y605-N608 WeakPolarHBondContact O-CB 3.43Å; Y605-N608 PolarHBondContact O-N 2.92Å; Y605-A611 HydrophobicContact CD1-CB 4.35Å; Y605-A611 HydrophobicContact CE1-CB 3.9Å; Y605-F615 AromaticContact CD1-CE1 3.69Å; Y605-F615 HydrophobicContact CD1-CE1 3.69Å; Y605-F615 HydrophobicContact CD1-CZ 4Å; Y605-F615 HydrophobicContact CE1-CE1 4.37Å
606	Q	85.1	Confident	86.3	Confident	88 Å²	88	60.8 Å²	60.8	41%	0.411	30%	0.303	S	S	.	.	H	α-helix	trans	-67.7	-37.3	-177.9	-158.8	178.4	6.4	0	0	112	V602 Q603 D604 N608 F615	V602-Q606 PolarHBondContact O-N 2.99Å; Q603-Q606 WeakPolarHBondContact O-CB 3.29Å; Q603-Q606 PolarHBondContact O-N 2.74Å; Q603-Q606 VanDerWaalsContact O-N 3.15Å; D604-Q606 VanDerWaalsContact C-N 3.29Å; D604-Q606 PolarHBondContact O-N 3.29Å; Q606-N608 PolarHBondContact O-N 3.24Å; Q606-F615 HydrophobicContact CB-CE1 4Å; Q606-F615 HydrophobicContact CB-CE2 3.8Å; Q606-F615 HydrophobicContact CB-CZ 3.24Å; Q606-F615 HydrophobicContact CG-CE1 4.01Å; Q606-F615 HydrophobicContact CG-CE2 3.94Å; Q606-F615 HydrophobicContact CG-CZ 3.57Å
607	R	85.8	Confident	86.3	Confident	184 Å²	184	59.1 Å²	59.1	69%	0.694	29%	0.292	S	S	*	.	H	α-helix	trans	-72.2	-16.6	179.1	-70.6	173	-177.3	164.5	2	112.7	Q603 D604 Y605 P609	Q603-R607 WeakPolarHBondContact O-CG 3.48Å; Q603-R607 PolarHBondContact O-N 3.25Å; D604-R607 PolarHBondContact O-N 3.25Å; D604-R607 IonicContact OD1-NH1 3.76Å; Y605-R607 VanDerWaalsContact C-N 3.35Å; Y605-R607 PolarHBondContact O-N 3.07Å; R607-P609 VanDerWaalsContact O-CD 3.25Å; R607-P609 WeakPolarHBondContact O-CD 3.26Å
608	N	85.3	Confident	86.3	Confident	71 Å²	71	57.3 Å²	57.3	38%	0.38	28%	0.284	S	S	.	.			trans	-73.4	113.1	-179.4	-172.3	-5.4	0	0	0	110.6	D604 Y605 Q606 K610 A611	D604-N608 PolarHBondContact O-N 2.97Å; Y605-N608 WeakPolarHBondContact O-CB 3.43Å; Y605-N608 PolarHBondContact O-N 2.92Å; Q606-N608 PolarHBondContact O-N 3.24Å; N608-K610 PolarHBondContact O-N 2.98Å; N608-K610 WeakPolarHBondContact OD1-CB 3.36Å; N608-K610 PolarHBondContact OD1-N 3.44Å; N608-K610 VanDerWaalsContact OD1-N 3.16Å; N608-A611 WeakPolarHBondContact O-CB 3.47Å; N608-A611 PolarHBondContact O-N 2.96Å
609	P	72.7	Confident	86.3	Confident	130 Å²	130	57.3 Å²	57.3	84%	0.844	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-8.5	-177.9	29.1	-36	0	0	0	113.6	R607	R607-P609 VanDerWaalsContact O-CD 3.25Å; R607-P609 WeakPolarHBondContact O-CD 3.26Å
610	K	71.3	Confident	86.2	Confident	172 Å²	172	59.1 Å²	59.1	75%	0.748	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86	-6.7	174.4	-62.4	-177.5	178.9	179.5	0	113.5	N608 N612	N608-K610 PolarHBondContact O-N 2.98Å; N608-K610 WeakPolarHBondContact OD1-CB 3.36Å; N608-K610 PolarHBondContact OD1-N 3.44Å; N608-K610 VanDerWaalsContact OD1-N 3.16Å; K610-N612 PolarHBondContact O-N 3.4Å
611	A	69.8	Low	86.1	Confident	26 Å²	26	57.1 Å²	57.1	22%	0.215	28%	0.282	C	S	.	.			trans	-67.7	130	179.8	0	0	0	0	0	110.5	Y605 N608 F613	Y605-A611 HydrophobicContact CD1-CB 4.35Å; Y605-A611 HydrophobicContact CE1-CB 3.9Å; N608-A611 WeakPolarHBondContact O-CB 3.47Å; N608-A611 PolarHBondContact O-N 2.96Å; A611-F613 VanDerWaalsContact C-N 3.33Å
612	N	78.5	Confident	86	Confident	78 Å²	78	54.8 Å²	54.8	42%	0.417	27%	0.27	S	S	.	.			trans	-86.3	-8.4	179.6	-67.4	-56.6	0	0	0	113.3	L442 E445 K610	L442-N612 HydrophobicContact CD2-CB 3.65Å; E445-N612 PolarHBondContact OE1-N 3.41Å; E445-N612 PolarHBondContact OE2-ND2 3.13Å; K610-N612 PolarHBondContact O-N 3.4Å
613	F	83.9	Confident	85.8	Confident	12 Å²	12	57.1 Å²	57.1	5%	0.053	28%	0.282	C	S	.	.			trans	-102.4	137.7	-176.6	-67.7	-70.6	0	0	0	111.9	L414 T415 A416 L437 L442 E445 F572 A611 F615	L414-F613 HydrophobicContact CB-CD1 3.97Å; L414-F613 HydrophobicContact CB-CE1 4.38Å; L414-F613 HydrophobicContact CB-CG 4.33Å; L414-F613 HydrophobicContact CD2-CB 4.24Å; L414-F613 HydrophobicContact CD2-CD1 4.44Å; L414-F613 HydrophobicContact CD2-CD2 4.15Å; L414-F613 HydrophobicContact CD2-CG 4.05Å; T415-F613 WeakPolarHBondContact O-CA 3.36Å; A416-F613 HydrophobicContact CB-CD1 4.33Å; L437-F613 HydrophobicContact CD1-CD1 4.41Å; L437-F613 HydrophobicContact CD1-CE1 3.97Å; L442-F613 HydrophobicContact CB-CE1 3.97Å; L442-F613 HydrophobicContact CB-CE2 4.43Å; L442-F613 HydrophobicContact CB-CZ 3.55Å; L442-F613 HydrophobicContact CD1-CE1 4.09Å; L442-F613 HydrophobicContact CD1-CZ 4.47Å; L442-F613 HydrophobicContact CD2-CD1 4.33Å; L442-F613 HydrophobicContact CD2-CD2 4.42Å; L442-F613 HydrophobicContact CD2-CE1 3.82Å; L442-F613 HydrophobicContact CD2-CE2 3.92Å; L442-F613 HydrophobicContact CD2-CZ 3.62Å; L442-F613 HydrophobicContact CG-CE1 4.15Å; L442-F613 HydrophobicContact CG-CZ 4.03Å; L442-F613 WeakPolarHBondContact O-CZ 3.48Å; E445-F613 HydrophobicContact CB-CE2 4.04Å; E445-F613 HydrophobicContact CG-CD2 4.34Å; E445-F613 HydrophobicContact CG-CE2 3.94Å; F572-F613 HydrophobicContact CD2-CE1 4.06Å; F572-F613 HydrophobicContact CD2-CZ 4.33Å; F572-F613 HydrophobicContact CE2-CE1 4.24Å; F572-F613 HydrophobicContact CE2-CZ 4.39Å; A611-F613 VanDerWaalsContact C-N 3.33Å; F613-F615 HydrophobicContact CB-CD1 4.28Å
614	T	84.8	Confident	85.6	Confident	57 Å²	57	57 Å²	57	35%	0.35	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	129.1	152.8	46.5	0	0	0	0	107.4	T415 P417	T415-T614 PolarHBondContact N-O 3.38Å; T415-T614 PolarHBondContact O-N 3.4Å; T415-T614 PolarHBondContact O-OG1 3.05Å; T415-T614 PolarHBondContact OG1-O 3.45Å; T415-T614 PolarHBondContact OG1-OG1 3.49Å; P417-T614 WeakPolarHBondContact CD-OG1 3.37Å; P417-T614 HydrophobicContact CG-CG2 4.15Å
615	F	83.6	Confident	85.5	Confident	15 Å²	15	54.9 Å²	54.9	7%	0.066	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	150.4	-177.3	57.9	-90.1	0	0	0	111.4	I413 L414 V602 Y605 Q606 F613 Y617	I413-F615 CarbonylContact O-C 3.52Å; I413-F615 WeakPolarHBondContact O-CA 3.32Å; I413-F615 WeakPolarHBondContact O-CB 3.37Å; L414-F615 HydrophobicContact CB-CB 4.26Å; L414-F615 HydrophobicContact CD2-CB 4.17Å; L414-F615 HydrophobicContact CG-CB 3.88Å; V602-F615 HydrophobicContact CG1-CD2 4.06Å; V602-F615 HydrophobicContact CG1-CE2 3.48Å; V602-F615 VanDerWaalsContact CG1-CE2 3.48Å; V602-F615 HydrophobicContact CG1-CZ 4.37Å; V602-F615 WeakPolarHBondContact O-CZ 3.3Å; Y605-F615 AromaticContact CD1-CE1 3.69Å; Y605-F615 HydrophobicContact CD1-CE1 3.69Å; Y605-F615 HydrophobicContact CD1-CZ 4Å; Y605-F615 HydrophobicContact CE1-CE1 4.37Å; Q606-F615 HydrophobicContact CB-CE1 4Å; Q606-F615 HydrophobicContact CB-CE2 3.8Å; Q606-F615 HydrophobicContact CB-CZ 3.24Å; Q606-F615 HydrophobicContact CG-CE1 4.01Å; Q606-F615 HydrophobicContact CG-CE2 3.94Å; Q606-F615 HydrophobicContact CG-CZ 3.57Å; F613-F615 HydrophobicContact CB-CD1 4.28Å; F615-Y617 AromaticContact CD2-CD1 3.87Å; F615-Y617 HydrophobicContact CD2-CD1 3.87Å; F615-Y617 AromaticContact CE2-CD1 3.87Å; F615-Y617 HydrophobicContact CE2-CD1 3.87Å; F615-Y617 HydrophobicContact CE2-CE1 4.2Å
616	A	92.1	Very high	85.6	Confident	2 Å²	2	54.1 Å²	54.1	2%	0.017	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	144.7	170.6	0	0	0	0	0	108.5	L412 I413 Y892	L412-A616 CarbonylContact C-O 3.42Å; L412-A616 WeakPolarHBondContact CA-O 3.41Å; I413-A616 PolarHBondContact N-O 3.17Å; I413-A616 PolarHBondContact O-N 2.79Å; A616-Y892 HydrophobicContact CB-CD1 3.87Å; A616-Y892 HydrophobicContact CB-CD2 4.22Å; A616-Y892 HydrophobicContact CB-CE1 4.42Å; A616-Y892 HydrophobicContact CB-CG 3.77Å
617	Y	93.9	Very high	85.5	Confident	7 Å²	7	52.7 Å²	52.7	3%	0.027	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	153.7	-172.7	60	-87.4	0	0	0	111.4	Q411 L599 V602 Q603 F615 Y885	Q411-Y617 VanDerWaalsContact O-CA 3.3Å; Q411-Y617 WeakPolarHBondContact O-CA 3.31Å; L599-Y617 HydrophobicContact CD2-CD2 3.7Å; L599-Y617 HydrophobicContact CD2-CE2 3.77Å; V602-Y617 HydrophobicContact CG1-CD1 3.54Å; V602-Y617 HydrophobicContact CG1-CD2 4.04Å; V602-Y617 HydrophobicContact CG1-CE1 4.08Å; V602-Y617 HydrophobicContact CG1-CG 3.51Å; Q603-Y617 HydrophobicContact CG-CE2 4.31Å; Q603-Y617 WeakPolarHBondContact CG-OH 3.33Å; Q603-Y617 PolarHBondContact NE2-OH 2.8Å; F615-Y617 AromaticContact CD2-CD1 3.87Å; F615-Y617 HydrophobicContact CD2-CD1 3.87Å; F615-Y617 AromaticContact CE2-CD1 3.87Å; F615-Y617 HydrophobicContact CE2-CD1 3.87Å; F615-Y617 HydrophobicContact CE2-CE1 4.2Å; Y617-Y885 AromaticContact CD2-CD2 3.9Å; Y617-Y885 HydrophobicContact CD2-CD2 3.9Å; Y617-Y885 HydrophobicContact CD2-CE2 4.01Å; Y617-Y885 HydrophobicContact CE1-CD2 4.43Å; Y617-Y885 HydrophobicContact CE1-CG 4.48Å; Y617-Y885 HydrophobicContact CE2-CD1 4.42Å; Y617-Y885 AromaticContact CE2-CD2 3.37Å; Y617-Y885 HydrophobicContact CE2-CD2 3.37Å; Y617-Y885 AromaticContact CE2-CE2 3.53Å; Y617-Y885 HydrophobicContact CE2-CE2 3.53Å; Y617-Y885 AromaticContact CE2-CG 3.86Å; Y617-Y885 HydrophobicContact CE2-CG 3.86Å; Y617-Y885 AromaticContact CZ-CD2 3.68Å; Y617-Y885 AromaticContact CZ-CG 3.71Å
618	M	94	Very high	85.4	Confident	25 Å²	25	46.1 Å²	46.1	12%	0.123	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	134.4	174.9	174.1	-173	174.8	0	0	108.7	N410 Q411 M886 Y889	N410-M618 CarbonylContact C-O 3.53Å; N410-M618 WeakPolarHBondContact CA-O 3.39Å; Q411-M618 PolarHBondContact N-O 3.16Å; Q411-M618 PolarHBondContact O-N 2.89Å; M618-M886 HydrophobicContact CB-CE 4.3Å; M618-M886 HydrophobicContact CB-SD 4.16Å; M618-M886 HydrophobicContact CG-CE 3.97Å; M618-M886 HydrophobicContact CG-SD 4.02Å; M618-M886 HydrophobicContact SD-CE 4.16Å; M618-Y889 HydrophobicContact CB-CD1 3.89Å; M618-Y889 HydrophobicContact CB-CD2 3.78Å; M618-Y889 HydrophobicContact CB-CE1 3.74Å; M618-Y889 HydrophobicContact CB-CE2 3.62Å; M618-Y889 HydrophobicContact CB-CG 3.89Å; M618-Y889 HydrophobicContact CG-CD1 4.45Å; M618-Y889 HydrophobicContact CG-CE1 4.11Å; M618-Y889 HydrophobicContact SD-CD1 4.11Å; M618-Y889 HydrophobicContact SD-CE1 3.35Å; M618-Y889 WeakPolarHBondContact SD-CE1 3.44Å
619	A	94.5	Very high	85.4	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.239	C	C	.	.			trans	-104.5	154.5	155.2	0	0	0	0	0	109.1	N410 E595 F598 L599 R621 S622	N410-A619 WeakPolarHBondContact OD1-CA 3.47Å; N410-A619 VanDerWaalsContact OD1-CB 3.32Å; N410-A619 WeakPolarHBondContact OD1-CB 3.41Å; E595-A619 HydrophobicContact CB-CB 4.26Å; E595-A619 HydrophobicContact CG-CB 4.44Å; F598-A619 HydrophobicContact CD1-CB 4.15Å; F598-A619 HydrophobicContact CE1-CB 4.25Å; L599-A619 HydrophobicContact CD1-CB 4.01Å; L599-A619 HydrophobicContact CD2-CB 3.83Å; L599-A619 HydrophobicContact CG-CB 3.9Å; A619-R621 HydrophobicContact CB-CG 4.13Å; A619-R621 PolarHBondContact O-N 2.99Å; A619-R621 VanDerWaalsContact O-N 3.16Å; A619-S622 PolarHBondContact N-OG 2.86Å; A619-S622 WeakPolarHBondContact O-CB 3.36Å; A619-S622 PolarHBondContact O-N 3.24Å; A619-S622 PolarHBondContact O-OG 3.47Å
620	E	91.1	Very high	85.9	Confident	51 Å²	51	41 Å²	41	24%	0.238	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-32.7	-179	-176.7	65.8	-167.1	0	0	112	R408 N410	R408-E620 HydrophobicContact CB-CB 4.02Å; R408-E620 HydrophobicContact CB-CG 4.12Å; R408-E620 HydrophobicContact CG-CG 4.29Å; N410-E620 PolarHBondContact OD1-N 3.36Å
621	R	90.7	Very high	86.4	Confident	51 Å²	51	33.9 Å²	33.9	19%	0.192	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-20.4	173.5	65.4	175.2	-67.2	149.1	7.8	115.5	L592 E595 T596 L599 A619 L623 E624 D625	L592-R621 HydrophobicContact CD2-CB 3.87Å; L592-R621 PolarHBondContact O-NH1 3Å; E595-R621 HydrophobicContact CB-CG 3.94Å; E595-R621 WeakPolarHBondContact OE2-CB 3.48Å; E595-R621 VanDerWaalsContact OE2-CG 3.3Å; E595-R621 WeakPolarHBondContact OE2-CG 2.93Å; E595-R621 PolarHBondContact OE2-N 2.85Å; T596-R621 PolarHBondContact OG1-NH1 3.43Å; L599-R621 HydrophobicContact CD1-CG 4.37Å; A619-R621 HydrophobicContact CB-CG 4.13Å; A619-R621 PolarHBondContact O-N 2.99Å; A619-R621 VanDerWaalsContact O-N 3.16Å; R621-L623 PolarHBondContact O-N 3.39Å; R621-E624 PolarHBondContact O-N 3.12Å; R621-E624 VanDerWaalsContact O-N 3.08Å; R621-D625 IonicContact CZ-OD1 2.62Å; R621-D625 IonicContact CZ-OD2 2.78Å; R621-D625 VanDerWaalsContact CZ-OD2 3.23Å; R621-D625 IonicContact NE-OD1 2.75Å; R621-D625 IonicContact NE-OD2 2.8Å; R621-D625 PolarHBondContact NE-OD2 3.22Å; R621-D625 IonicContact NH2-OD1 2.75Å; R621-D625 PolarHBondContact NH2-OD1 3.33Å; R621-D625 IonicContact NH2-OD2 3.73Å; R621-D625 PolarHBondContact NH2-OD2 2.81Å; R621-D625 PolarHBondContact O-N 2.7Å; R621-D625 VanDerWaalsContact O-N 3.09Å
622	S	91.9	Very high	87.1	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-57.1	-35.9	-172.7	-70.6	0	0	0	0	112.9	A619 E626 Y885	A619-S622 PolarHBondContact N-OG 2.86Å; A619-S622 WeakPolarHBondContact O-CB 3.36Å; A619-S622 PolarHBondContact O-N 3.24Å; A619-S622 PolarHBondContact O-OG 3.47Å; S622-E626 WeakPolarHBondContact O-CB 3.47Å; S622-E626 WeakPolarHBondContact O-CG 3.26Å; S622-E626 PolarHBondContact O-N 3.35Å; S622-Y885 WeakPolarHBondContact CB-OH 3.15Å; S622-Y885 PolarHBondContact OG-OH 3.39Å
623	L	86.6	Confident	87.4	Confident	50 Å²	50	35.9 Å²	35.9	26%	0.262	18%	0.184	S	C	.	.	H	α-helix	trans	-62.6	-45.5	177.6	178.6	63.3	0	0	0	112.1	R621 I627 M880	R621-L623 PolarHBondContact O-N 3.39Å; L623-I627 HydrophobicContact CD1-CD1 3.99Å; L623-I627 HydrophobicContact CG-CD1 4.31Å; L623-I627 WeakPolarHBondContact O-CD1 3.4Å; L623-I627 VanDerWaalsContact O-CG1 3.27Å; L623-I627 WeakPolarHBondContact O-CG1 3.17Å; L623-I627 PolarHBondContact O-N 2.93Å; L623-M880 HydrophobicContact CB-CE 4.48Å; L623-M880 HydrophobicContact CD1-CE 3.11Å; L623-M880 HydrophobicContact CD1-SD 4.39Å; L623-M880 HydrophobicContact CG-CE 4.35Å
624	E	85.8	Confident	87.4	Confident	49 Å²	49	35.4 Å²	35.4	23%	0.229	18%	0.182	C	C	.	.	H	α-helix	trans	-68.9	-42.4	179	-174.2	170.7	177	0	0	110.9	T379 R583 R621 N628	T379-E624 WeakPolarHBondContact CB-OE1 3.38Å; T379-E624 PolarHBondContact OG1-OE1 3.36Å; R583-E624 IonicContact NH2-OE2 3.59Å; R621-E624 PolarHBondContact O-N 3.12Å; R621-E624 VanDerWaalsContact O-N 3.08Å; E624-N628 WeakPolarHBondContact O-CB 3.42Å; E624-N628 VanDerWaalsContact O-CG 3.3Å; E624-N628 PolarHBondContact O-N 3.45Å; E624-N628 VanDerWaalsContact O-N 3.15Å; E624-N628 PolarHBondContact O-ND2 3.36Å; E624-N628 VanDerWaalsContact O-ND2 3.16Å
625	D	88	Confident	87.5	Confident	53 Å²	53	37 Å²	37	28%	0.283	19%	0.187	S	C	.	.	H	α-helix	trans	-65.5	-44.1	-179.1	-72	-22.4	0	0	0	112.5	R621 N628 R629	R621-D625 IonicContact CZ-OD1 2.62Å; R621-D625 IonicContact CZ-OD2 2.78Å; R621-D625 VanDerWaalsContact CZ-OD2 3.23Å; R621-D625 IonicContact NE-OD1 2.75Å; R621-D625 IonicContact NE-OD2 2.8Å; R621-D625 PolarHBondContact NE-OD2 3.22Å; R621-D625 IonicContact NH2-OD1 2.75Å; R621-D625 PolarHBondContact NH2-OD1 3.33Å; R621-D625 IonicContact NH2-OD2 3.73Å; R621-D625 PolarHBondContact NH2-OD2 2.81Å; R621-D625 PolarHBondContact O-N 2.7Å; R621-D625 VanDerWaalsContact O-N 3.09Å; D625-N628 PolarHBondContact O-N 2.88Å; D625-R629 WeakPolarHBondContact O-CB 3.36Å; D625-R629 PolarHBondContact O-N 3.47Å
626	E	87.8	Confident	87.8	Confident	16 Å²	16	39.8 Å²	39.8	8%	0.075	21%	0.207	C	C	.	.	H	α-helix	trans	-69	-35.6	-178.3	-77.6	-67.9	117.9	0	0	112.9	S622 R629 T630 M880 S884 Y885 M886	S622-E626 WeakPolarHBondContact O-CB 3.47Å; S622-E626 WeakPolarHBondContact O-CG 3.26Å; S622-E626 PolarHBondContact O-N 3.35Å; E626-R629 IonicContact OE1-CZ 3.67Å; E626-R629 IonicContact OE1-NE 2.7Å; E626-R629 PolarHBondContact OE1-NE 3.34Å; E626-R629 VanDerWaalsContact OE1-NE 3.08Å; E626-R629 IonicContact OE1-NH2 3.35Å; E626-R629 IonicContact OE2-CZ 3.87Å; E626-R629 IonicContact OE2-NE 3.24Å; E626-R629 PolarHBondContact OE2-NE 3.5Å; E626-R629 IonicContact OE2-NH2 3.87Å; E626-R629 PolarHBondContact OE2-NH2 2.95Å; E626-T630 WeakPolarHBondContact O-CB 3.27Å; E626-T630 PolarHBondContact O-N 2.95Å; E626-T630 VanDerWaalsContact O-N 3.08Å; E626-T630 PolarHBondContact O-OG1 3.04Å; E626-M880 HydrophobicContact CB-SD 4Å; E626-S884 VanDerWaalsContact CD-OG 3.27Å; E626-S884 WeakPolarHBondContact CG-OG 3.49Å; E626-S884 WeakPolarHBondContact OE2-CB 3.42Å; E626-S884 PolarHBondContact OE2-OG 3.08Å; E626-Y885 HydrophobicContact CG-CE1 4.03Å; E626-M886 HydrophobicContact CG-CG 4.2Å
627	I	83.9	Confident	87.6	Confident	57 Å²	57	41 Å²	41	29%	0.292	21%	0.212	S	C	.	.	H	α-helix	trans	-65.5	-44.6	174	-68.4	170.1	0	0	0	110.3	L623 T630 T631	L623-I627 HydrophobicContact CD1-CD1 3.99Å; L623-I627 HydrophobicContact CG-CD1 4.31Å; L623-I627 WeakPolarHBondContact O-CD1 3.4Å; L623-I627 VanDerWaalsContact O-CG1 3.27Å; L623-I627 WeakPolarHBondContact O-CG1 3.17Å; L623-I627 PolarHBondContact O-N 2.93Å; I627-T630 PolarHBondContact O-N 3.19Å; I627-T631 PolarHBondContact O-N 3.19Å; I627-T631 VanDerWaalsContact O-N 3.08Å; I627-T631 PolarHBondContact O-OG1 3.48Å
628	N	83.5	Confident	87.2	Confident	46 Å²	46	41.2 Å²	41.2	25%	0.246	21%	0.214	C	C	.	.	H	α-helix	trans	-66.2	-41.1	178.9	-73.7	-28.1	0	0	0	112	E624 D625 T630 T631 A632 L698	E624-N628 WeakPolarHBondContact O-CB 3.42Å; E624-N628 VanDerWaalsContact O-CG 3.3Å; E624-N628 PolarHBondContact O-N 3.45Å; E624-N628 VanDerWaalsContact O-N 3.15Å; E624-N628 PolarHBondContact O-ND2 3.36Å; E624-N628 VanDerWaalsContact O-ND2 3.16Å; D625-N628 PolarHBondContact O-N 2.88Å; N628-T630 PolarHBondContact O-N 2.95Å; N628-T631 WeakPolarHBondContact O-CB 3.34Å; N628-T631 PolarHBondContact O-N 3.35Å; N628-A632 PolarHBondContact O-N 2.9Å; N628-A632 VanDerWaalsContact O-N 3.14Å; N628-L698 VanDerWaalsContact OD1-CD1 3.3Å; N628-L698 WeakPolarHBondContact OD1-CD1 3.17Å
629	R	86.1	Confident	86.9	Confident	88 Å²	88	45.7 Å²	45.7	33%	0.332	24%	0.236	S	C	.	.	H	α-helix	trans	-58.6	-48.4	175.2	-176.6	179.9	68.8	77.3	-1.4	111.5	D625 E626 T631 A632 E633	D625-R629 WeakPolarHBondContact O-CB 3.36Å; D625-R629 PolarHBondContact O-N 3.47Å; E626-R629 IonicContact OE1-CZ 3.67Å; E626-R629 IonicContact OE1-NE 2.7Å; E626-R629 PolarHBondContact OE1-NE 3.34Å; E626-R629 VanDerWaalsContact OE1-NE 3.08Å; E626-R629 IonicContact OE1-NH2 3.35Å; E626-R629 IonicContact OE2-CZ 3.87Å; E626-R629 IonicContact OE2-NE 3.24Å; E626-R629 PolarHBondContact OE2-NE 3.5Å; E626-R629 IonicContact OE2-NH2 3.87Å; E626-R629 PolarHBondContact OE2-NH2 2.95Å; R629-T631 VanDerWaalsContact C-N 3.3Å; R629-T631 PolarHBondContact O-N 3.25Å; R629-A632 PolarHBondContact O-N 2.75Å; R629-A632 VanDerWaalsContact O-N 3.16Å; R629-E633 IonicContact CZ-OE1 2.9Å; R629-E633 IonicContact NH1-OE1 3.27Å; R629-E633 PolarHBondContact NH1-OE1 2.93Å; R629-E633 IonicContact NH1-OE2 3.52Å; R629-E633 PolarHBondContact NH1-OE2 3.33Å; R629-E633 VanDerWaalsContact NH1-OE2 3.16Å; R629-E633 PolarHBondContact O-N 2.92Å
630	T	82.7	Confident	86.7	Confident	6 Å²	6	50.2 Å²	50.2	4%	0.037	26%	0.259	C	S	.	.	H	α-helix	trans	-59	-45	179.3	-54.9	0	0	0	0	111.5	E626 I627 N628 A632 E633 D634 P881 A1237	E626-T630 WeakPolarHBondContact O-CB 3.27Å; E626-T630 PolarHBondContact O-N 2.95Å; E626-T630 VanDerWaalsContact O-N 3.08Å; E626-T630 PolarHBondContact O-OG1 3.04Å; I627-T630 PolarHBondContact O-N 3.19Å; N628-T630 PolarHBondContact O-N 2.95Å; T630-A632 VanDerWaalsContact C-N 3.27Å; T630-A632 PolarHBondContact O-N 3.49Å; T630-E633 PolarHBondContact O-N 2.66Å; T630-D634 PolarHBondContact O-N 2.9Å; T630-D634 VanDerWaalsContact O-N 3.15Å; T630-P881 HydrophobicContact CG2-CB 4.03Å; T630-P881 WeakPolarHBondContact OG1-CB 3.41Å; T630-P881 VanDerWaalsContact OG1-CD 3.25Å; T630-P881 WeakPolarHBondContact OG1-CD 3.42Å; T630-P881 WeakPolarHBondContact OG1-CG 3.48Å; T630-A1237 HydrophobicContact CG2-CB 3.44Å; T630-A1237 VanDerWaalsContact CG2-CB 3.44Å
631	T	81.9	Confident	86.6	Confident	23 Å²	23	47.8 Å²	47.8	14%	0.141	25%	0.248	C	C	.	.	H	α-helix	trans	-57.4	-42.1	178	-58.2	0	0	0	0	111.3	I627 N628 R629 I635 L698 Q702	I627-T631 PolarHBondContact O-N 3.19Å; I627-T631 VanDerWaalsContact O-N 3.08Å; I627-T631 PolarHBondContact O-OG1 3.48Å; N628-T631 WeakPolarHBondContact O-CB 3.34Å; N628-T631 PolarHBondContact O-N 3.35Å; R629-T631 VanDerWaalsContact C-N 3.3Å; R629-T631 PolarHBondContact O-N 3.25Å; T631-I635 WeakPolarHBondContact O-CG1 3.5Å; T631-L698 HydrophobicContact CG2-CB 3.85Å; T631-L698 HydrophobicContact CG2-CD1 4.06Å; T631-L698 HydrophobicContact CG2-CD2 4.14Å; T631-L698 HydrophobicContact CG2-CG 4.22Å; T631-Q702 PolarHBondContact O-NE2 3.3Å; T631-Q702 VanDerWaalsContact O-NE2 3.1Å
632	A	83.2	Confident	86.4	Confident	60 Å²	60	47.4 Å²	47.4	50%	0.496	25%	0.247	S	C	.	.	H	α-helix	trans	-68.8	-38.5	178.5	0	0	0	0	0	112.8	N628 R629 T630 D634 I635	N628-A632 PolarHBondContact O-N 2.9Å; N628-A632 VanDerWaalsContact O-N 3.14Å; R629-A632 PolarHBondContact O-N 2.75Å; R629-A632 VanDerWaalsContact O-N 3.16Å; T630-A632 VanDerWaalsContact C-N 3.27Å; T630-A632 PolarHBondContact O-N 3.49Å; A632-D634 VanDerWaalsContact C-N 3.3Å; A632-D634 PolarHBondContact O-N 2.92Å; A632-I635 PolarHBondContact O-N 2.84Å
633	E	84.7	Confident	86.3	Confident	86 Å²	86	49.9 Å²	49.9	40%	0.402	27%	0.267	S	S	.	.	H	α-helix	trans	-66.6	-28.7	178.9	-75	178.8	-172.8	0	0	113.6	R629 T630 P636	R629-E633 IonicContact CZ-OE1 2.9Å; R629-E633 IonicContact NH1-OE1 3.27Å; R629-E633 PolarHBondContact NH1-OE1 2.93Å; R629-E633 IonicContact NH1-OE2 3.52Å; R629-E633 PolarHBondContact NH1-OE2 3.33Å; R629-E633 VanDerWaalsContact NH1-OE2 3.16Å; R629-E633 PolarHBondContact O-N 2.92Å; T630-E633 PolarHBondContact O-N 2.66Å; E633-P636 WeakPolarHBondContact O-CD 3.36Å
634	D	85.4	Confident	86.4	Confident	1 Å²	1	50.1 Å²	50.1	1%	0.005	27%	0.27	C	S	.	.	H	α-helix	trans	-85.7	-16.6	-179	-73.9	-35.9	0	0	0	113.5	T630 A632 I637 F638 K1236 A1237 I1240	T630-D634 PolarHBondContact O-N 2.9Å; T630-D634 VanDerWaalsContact O-N 3.15Å; A632-D634 VanDerWaalsContact C-N 3.3Å; A632-D634 PolarHBondContact O-N 2.92Å; D634-I637 WeakPolarHBondContact O-CB 3.29Å; D634-I637 PolarHBondContact O-N 2.81Å; D634-F638 HydrophobicContact CB-CE2 4.39Å; D634-F638 WeakPolarHBondContact O-CD2 3.25Å; D634-F638 PolarHBondContact O-N 3.28Å; D634-K1236 PolarHBondContact OD1-N 3.47Å; D634-A1237 WeakPolarHBondContact OD2-CB 3.36Å; D634-A1237 PolarHBondContact OD2-N 3.36Å; D634-I1240 HydrophobicContact CB-CD1 4.05Å; D634-I1240 WeakPolarHBondContact OD2-CD1 3.49Å
635	I	86.3	Confident	86.4	Confident	91 Å²	91	48.1 Å²	48.1	47%	0.467	26%	0.261	S	S	.	.	H	α-helix	trans	-52.7	-47.6	178.8	-70.7	168.9	0	0	0	112.6	T631 A632 I637 F638 M639	T631-I635 WeakPolarHBondContact O-CG1 3.5Å; A632-I635 PolarHBondContact O-N 2.84Å; I635-I637 PolarHBondContact O-N 3.23Å; I635-F638 PolarHBondContact O-N 3.36Å; I635-M639 WeakPolarHBondContact O-CG 3.35Å; I635-M639 PolarHBondContact O-N 3.09Å; I635-M639 VanDerWaalsContact O-N 3.11Å
636	P	89.2	Confident	86.3	Confident	73 Å²	73	47.5 Å²	47.5	47%	0.474	26%	0.256	S	S	.	.	H	α-helix	trans	-59.8	-33.1	177.4	-24.3	35	0	0	0	113.6	E633 M639 I640	E633-P636 WeakPolarHBondContact O-CD 3.36Å; P636-M639 PolarHBondContact O-N 3.46Å; P636-I640 WeakPolarHBondContact O-CG1 3.31Å; P636-I640 PolarHBondContact O-N 3.2Å
637	I	88.8	Confident	86.2	Confident	27 Å²	27	50.8 Å²	50.8	14%	0.138	28%	0.277	C	S	.	.	H	α-helix	trans	-69.2	-41.1	-179.4	-59.4	175.2	0	0	0	110.2	D634 I635 M639 I640 S641 V1231	D634-I637 WeakPolarHBondContact O-CB 3.29Å; D634-I637 PolarHBondContact O-N 2.81Å; I635-I637 PolarHBondContact O-N 3.23Å; I637-M639 VanDerWaalsContact C-N 3.33Å; I637-M639 PolarHBondContact O-N 3.47Å; I637-I640 PolarHBondContact O-N 2.96Å; I637-S641 PolarHBondContact O-N 2.77Å; I637-V1231 HydrophobicContact CG2-CG1 4.1Å
638	F	86.1	Confident	86.4	Confident	13 Å²	13	50.4 Å²	50.4	6%	0.057	27%	0.272	C	S	.	.	H	α-helix	trans	-61.5	-40.9	171.3	-77.7	-78.4	0	0	0	112.1	D634 I635 I640 S641 Y642 Q702 L1232 I1240	D634-F638 HydrophobicContact CB-CE2 4.39Å; D634-F638 WeakPolarHBondContact O-CD2 3.25Å; D634-F638 PolarHBondContact O-N 3.28Å; I635-F638 PolarHBondContact O-N 3.36Å; F638-I640 VanDerWaalsContact C-N 3.31Å; F638-I640 PolarHBondContact O-N 3.23Å; F638-S641 WeakPolarHBondContact O-CB 3.2Å; F638-S641 PolarHBondContact O-N 2.92Å; F638-S641 VanDerWaalsContact O-N 3.11Å; F638-Y642 HydrophobicContact CB-CE2 4.18Å; F638-Y642 WeakPolarHBondContact O-CD2 3.47Å; F638-Y642 PolarHBondContact O-N 3.26Å; F638-Q702 HydrophobicContact CE2-CB 4.21Å; F638-Q702 HydrophobicContact CE2-CG 4.33Å; F638-Q702 HydrophobicContact CZ-CB 4.28Å; F638-L1232 HydrophobicContact CD1-CD2 3.79Å; F638-L1232 HydrophobicContact CE1-CD1 4.49Å; F638-L1232 HydrophobicContact CE1-CD2 3.56Å; F638-L1232 HydrophobicContact CG-CD2 4.47Å; F638-L1232 HydrophobicContact CZ-CD2 4.07Å; F638-I1240 HydrophobicContact CE2-CD1 3.83Å; F638-I1240 HydrophobicContact CZ-CD1 4.09Å; F638-I1240 HydrophobicContact CZ-CG2 4.34Å
639	M	87.5	Confident	86.5	Confident	118 Å²	118	48.5 Å²	48.5	58%	0.581	26%	0.262	S	S	*	.	H	α-helix	trans	-62.5	-38.2	176.3	-65.9	-58.5	-68.2	0	0	112.4	I635 P636 I637 Y642 A643	I635-M639 WeakPolarHBondContact O-CG 3.35Å; I635-M639 PolarHBondContact O-N 3.09Å; I635-M639 VanDerWaalsContact O-N 3.11Å; P636-M639 PolarHBondContact O-N 3.46Å; I637-M639 VanDerWaalsContact C-N 3.33Å; I637-M639 PolarHBondContact O-N 3.47Å; M639-Y642 PolarHBondContact O-N 2.86Å; M639-Y642 HydrophobicContact SD-CD2 4.09Å; M639-A643 WeakPolarHBondContact O-CB 3.46Å; M639-A643 PolarHBondContact O-N 3.36Å
640	I	90.3	Very high	86.3	Confident	96 Å²	96	44.9 Å²	44.9	49%	0.492	25%	0.251	S	S	.	.	H	α-helix	trans	-64.3	-42.7	172.6	-66.1	165.5	0	0	0	110.5	P636 I637 F638 Y642 A643 V644 V1231	P636-I640 WeakPolarHBondContact O-CG1 3.31Å; P636-I640 PolarHBondContact O-N 3.2Å; I637-I640 PolarHBondContact O-N 2.96Å; F638-I640 VanDerWaalsContact C-N 3.31Å; F638-I640 PolarHBondContact O-N 3.23Å; I640-Y642 PolarHBondContact O-N 3.39Å; I640-A643 PolarHBondContact O-N 3.28Å; I640-V644 HydrophobicContact CG2-CG2 4.43Å; I640-V644 WeakPolarHBondContact O-CG2 3.3Å; I640-V644 PolarHBondContact O-N 3.48Å; I640-V1231 HydrophobicContact CB-CG1 4.33Å; I640-V1231 HydrophobicContact CG2-CG1 4Å
641	S	88.6	Confident	86.3	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-57.7	-47.3	176	-177.2	0	0	0	0	111.5	I637 F638 A643 V644 I645 G1228	I637-S641 PolarHBondContact O-N 2.77Å; F638-S641 WeakPolarHBondContact O-CB 3.2Å; F638-S641 PolarHBondContact O-N 2.92Å; F638-S641 VanDerWaalsContact O-N 3.11Å; S641-A643 PolarHBondContact O-N 3.44Å; S641-V644 PolarHBondContact O-N 2.94Å; S641-I645 WeakPolarHBondContact O-CG1 3.47Å; S641-I645 PolarHBondContact O-N 3.27Å; S641-G1228 WeakPolarHBondContact OG-CA 3.43Å; S641-G1228 PolarHBondContact OG-O 3.02Å
642	Y	86.9	Confident	86.3	Confident	43 Å²	43	48.9 Å²	48.9	17%	0.169	28%	0.279	C	S	.	.	H	α-helix	trans	-61.6	-40.2	175.2	-61.6	-41.2	0	0	0	113	F638 M639 I640 V644 I645 F646 Q702 F706 L709	F638-Y642 HydrophobicContact CB-CE2 4.18Å; F638-Y642 WeakPolarHBondContact O-CD2 3.47Å; F638-Y642 PolarHBondContact O-N 3.26Å; M639-Y642 PolarHBondContact O-N 2.86Å; M639-Y642 HydrophobicContact SD-CD2 4.09Å; I640-Y642 PolarHBondContact O-N 3.39Å; Y642-V644 VanDerWaalsContact C-N 3.35Å; Y642-V644 PolarHBondContact O-N 2.96Å; Y642-I645 PolarHBondContact O-N 3.33Å; Y642-F646 WeakPolarHBondContact O-CB 3.4Å; Y642-F646 PolarHBondContact O-N 2.97Å; Y642-Q702 PolarHBondContact OH-O 2.95Å; Y642-F706 HydrophobicContact CE1-CB 4.09Å; Y642-F706 HydrophobicContact CE1-CD2 4.11Å; Y642-F706 PolarHBondContact OH-N 3.47Å; Y642-F706 VanDerWaalsContact OH-N 3.16Å; Y642-L709 HydrophobicContact CD1-CD2 3.48Å; Y642-L709 VanDerWaalsContact CD1-CD2 3.48Å; Y642-L709 HydrophobicContact CE1-CD2 4.01Å; Y642-L709 HydrophobicContact CG-CD2 4.47Å
643	A	88.2	Confident	86.1	Confident	51 Å²	51	46.1 Å²	46.1	42%	0.421	26%	0.256	S	S	.	.	H	α-helix	trans	-63.8	-39.3	175.9	0	0	0	0	0	112.1	M639 I640 S641 F646 V647	M639-A643 WeakPolarHBondContact O-CB 3.46Å; M639-A643 PolarHBondContact O-N 3.36Å; I640-A643 PolarHBondContact O-N 3.28Å; S641-A643 PolarHBondContact O-N 3.44Å; A643-F646 WeakPolarHBondContact O-CB 3.46Å; A643-F646 PolarHBondContact O-N 3.49Å; A643-V647 WeakPolarHBondContact O-CG2 3.38Å; A643-V647 PolarHBondContact O-N 3.38Å
644	V	89.3	Confident	85.6	Confident	55 Å²	55	42.5 Å²	42.5	33%	0.333	24%	0.242	S	C	.	.	H	α-helix	trans	-66.2	-44.5	176.6	171.9	0	0	0	0	111.1	I640 S641 Y642 F646 V647 Y648 P1227 V1231	I640-V644 HydrophobicContact CG2-CG2 4.43Å; I640-V644 WeakPolarHBondContact O-CG2 3.3Å; I640-V644 PolarHBondContact O-N 3.48Å; S641-V644 PolarHBondContact O-N 2.94Å; Y642-V644 VanDerWaalsContact C-N 3.35Å; Y642-V644 PolarHBondContact O-N 2.96Å; V644-F646 VanDerWaalsContact C-N 3.28Å; V644-F646 PolarHBondContact O-N 2.94Å; V644-V647 PolarHBondContact O-N 3.09Å; V644-Y648 WeakPolarHBondContact O-CB 3.36Å; V644-Y648 PolarHBondContact O-N 3.35Å; V644-P1227 HydrophobicContact CG1-CB 3.68Å; V644-V1231 HydrophobicContact CB-CG2 4.48Å; V644-V1231 HydrophobicContact CG2-CG2 4.14Å
645	I	85.9	Confident	85	Confident	8 Å²	8	43.8 Å²	43.8	4%	0.041	25%	0.248	C	C	.	.	H	α-helix	trans	-59.8	-42.3	175.1	-64.9	165.7	0	0	0	110.2	S641 Y642 Y648 I649 F706 L709	S641-I645 WeakPolarHBondContact O-CG1 3.47Å; S641-I645 PolarHBondContact O-N 3.27Å; Y642-I645 PolarHBondContact O-N 3.33Å; I645-Y648 WeakPolarHBondContact O-CB 3.43Å; I645-Y648 PolarHBondContact O-N 3.03Å; I645-I649 HydrophobicContact CG2-CD1 3.73Å; I645-I649 HydrophobicContact CG2-CG1 4.33Å; I645-I649 WeakPolarHBondContact O-CG1 3.22Å; I645-I649 PolarHBondContact O-N 3.41Å; I645-F706 HydrophobicContact CD1-CE2 4.35Å; I645-L709 HydrophobicContact CB-CD2 4.3Å; I645-L709 HydrophobicContact CD1-CD2 3.77Å; I645-L709 HydrophobicContact CG2-CD2 3.96Å; I645-L709 HydrophobicContact CG2-CG 4.29Å
646	F	85.8	Confident	84.2	Confident	39 Å²	39	46 Å²	46	17%	0.171	25%	0.251	C	S	.	.	H	α-helix	trans	-60.2	-49.8	176.5	171.6	-118.4	0	0	0	113.2	Y642 A643 V644 Y648 I649 A650 F668 L672 I675	Y642-F646 WeakPolarHBondContact O-CB 3.4Å; Y642-F646 PolarHBondContact O-N 2.97Å; A643-F646 WeakPolarHBondContact O-CB 3.46Å; A643-F646 PolarHBondContact O-N 3.49Å; V644-F646 VanDerWaalsContact C-N 3.28Å; V644-F646 PolarHBondContact O-N 2.94Å; F646-Y648 PolarHBondContact O-N 3.15Å; F646-I649 PolarHBondContact O-N 3.17Å; F646-A650 WeakPolarHBondContact O-CB 3.4Å; F646-A650 PolarHBondContact O-N 3.16Å; F646-F668 AromaticContact CE1-CE2 3.6Å; F646-F668 HydrophobicContact CE1-CE2 3.6Å; F646-F668 AromaticContact CE1-CZ 3.81Å; F646-F668 HydrophobicContact CE1-CZ 3.81Å; F646-F668 HydrophobicContact CE2-CE2 4.4Å; F646-F668 HydrophobicContact CZ-CD2 4.04Å; F646-F668 HydrophobicContact CZ-CE1 4.18Å; F646-F668 AromaticContact CZ-CE2 3.33Å; F646-F668 HydrophobicContact CZ-CE2 3.33Å; F646-F668 AromaticContact CZ-CZ 3.42Å; F646-F668 HydrophobicContact CZ-CZ 3.42Å; F646-F668 VanDerWaalsContact CZ-CZ 3.42Å; F646-L672 HydrophobicContact CE2-CB 3.99Å; F646-L672 HydrophobicContact CE2-CD1 4.15Å; F646-L672 HydrophobicContact CZ-CB 4.36Å; F646-L672 HydrophobicContact CZ-CD1 4.22Å; F646-I675 HydrophobicContact CB-CD1 3.41Å; F646-I675 VanDerWaalsContact CB-CD1 3.41Å; F646-I675 HydrophobicContact CD2-CD1 3.4Å; F646-I675 VanDerWaalsContact CD2-CD1 3.4Å; F646-I675 HydrophobicContact CD2-CG1 4.38Å; F646-I675 HydrophobicContact CE2-CD1 4.5Å; F646-I675 HydrophobicContact CG-CD1 3.81Å
647	V	86.8	Confident	83	Confident	86 Å²	86	44.7 Å²	44.7	52%	0.521	24%	0.244	S	C	.	.	H	α-helix	trans	-59.1	-41.5	177.3	171.4	0	0	0	0	110	A643 V644 V651	A643-V647 WeakPolarHBondContact O-CG2 3.38Å; A643-V647 PolarHBondContact O-N 3.38Å; V644-V647 PolarHBondContact O-N 3.09Å; V647-V651 HydrophobicContact CG1-CG2 4.4Å; V647-V651 WeakPolarHBondContact O-CB 3.41Å; V647-V651 WeakPolarHBondContact O-CG2 3.37Å; V647-V651 PolarHBondContact O-N 3.16Å; V647-V651 VanDerWaalsContact O-N 3.09Å
648	Y	87.9	Confident	81.8	Confident	48 Å²	48	46.7 Å²	46.7	19%	0.188	26%	0.26	C	S	.	.	H	α-helix	trans	-59.4	-53.4	175.9	176.8	-99.4	0	0	0	112.1	V644 I645 F646 A650 V651 A652 A1219 M1223 T1224	V644-Y648 WeakPolarHBondContact O-CB 3.36Å; V644-Y648 PolarHBondContact O-N 3.35Å; I645-Y648 WeakPolarHBondContact O-CB 3.43Å; I645-Y648 PolarHBondContact O-N 3.03Å; F646-Y648 PolarHBondContact O-N 3.15Å; Y648-A650 PolarHBondContact O-N 2.74Å; Y648-V651 PolarHBondContact O-N 3.14Å; Y648-A652 HydrophobicContact CD2-CB 4.46Å; Y648-A652 HydrophobicContact CE1-CB 4.02Å; Y648-A652 HydrophobicContact CE2-CB 3.99Å; Y648-A652 WeakPolarHBondContact O-CB 3.27Å; Y648-A652 PolarHBondContact O-N 2.98Å; Y648-A1219 PolarHBondContact OH-O 3.18Å; Y648-M1223 HydrophobicContact CE1-CB 4.11Å; Y648-M1223 HydrophobicContact CE2-CB 4.03Å; Y648-M1223 HydrophobicContact CE2-CE 4.41Å; Y648-M1223 VanDerWaalsContact CZ-CB 3.48Å; Y648-M1223 WeakPolarHBondContact OH-CB 3.37Å; Y648-T1224 HydrophobicContact CD1-CG2 4.04Å; Y648-T1224 HydrophobicContact CE1-CG2 3.76Å
649	I	84.4	Confident	80.7	Confident	7 Å²	7	51.7 Å²	51.7	4%	0.036	30%	0.295	C	S	.	.	H	α-helix	trans	-59.7	-45.8	-178.7	-67	167.7	0	0	0	110.9	I645 F646 V651 L653 A713	I645-I649 HydrophobicContact CG2-CD1 3.73Å; I645-I649 HydrophobicContact CG2-CG1 4.33Å; I645-I649 WeakPolarHBondContact O-CG1 3.22Å; I645-I649 PolarHBondContact O-N 3.41Å; F646-I649 PolarHBondContact O-N 3.17Å; I649-V651 VanDerWaalsContact C-N 3.31Å; I649-V651 PolarHBondContact O-N 2.79Å; I649-L653 HydrophobicContact CG2-CD1 3.6Å; I649-L653 HydrophobicContact CG2-CG 4.31Å; I649-L653 WeakPolarHBondContact O-CB 3.41Å; I649-L653 VanDerWaalsContact O-CG 3.28Å; I649-L653 WeakPolarHBondContact O-CG 3.37Å; I649-L653 PolarHBondContact O-N 3Å; I649-L653 VanDerWaalsContact O-N 3.13Å; I649-A713 HydrophobicContact CD1-CB 3.6Å
650	A	82.8	Confident	79.7	Confident	12 Å²	12	55 Å²	55	10%	0.099	31%	0.306	C	S	.	.	H	α-helix	trans	-63	-36.3	-178.8	0	0	0	0	0	112.9	F646 Y648 F668	F646-A650 WeakPolarHBondContact O-CB 3.4Å; F646-A650 PolarHBondContact O-N 3.16Å; Y648-A650 PolarHBondContact O-N 2.74Å; A650-F668 HydrophobicContact CB-CD2 3.93Å
651	V	83.1	Confident	78.7	Confident	77 Å²	77	50.9 Å²	50.9	47%	0.467	29%	0.285	S	S	.	.	H	α-helix	trans	-79.4	-48.5	178.4	171	0	0	0	0	111	V647 Y648 I649 L653 G654 Y656	V647-V651 HydrophobicContact CG1-CG2 4.4Å; V647-V651 WeakPolarHBondContact O-CB 3.41Å; V647-V651 WeakPolarHBondContact O-CG2 3.37Å; V647-V651 PolarHBondContact O-N 3.16Å; V647-V651 VanDerWaalsContact O-N 3.09Å; Y648-V651 PolarHBondContact O-N 3.14Å; I649-V651 VanDerWaalsContact C-N 3.31Å; I649-V651 PolarHBondContact O-N 2.79Å; V651-L653 VanDerWaalsContact C-N 3.29Å; V651-L653 PolarHBondContact O-N 3.32Å; V651-G654 PolarHBondContact O-N 3.1Å; V651-G654 VanDerWaalsContact O-N 3.09Å; V651-Y656 WeakPolarHBondContact CG1-OH 3.38Å; V651-Y656 PolarHBondContact O-OH 3.42Å
652	A	81.8	Confident	77.9	Confident	36 Å²	36	54.5 Å²	54.5	30%	0.298	30%	0.303	S	S	.	.	H	α-helix	trans	-66.9	-28.6	-173.8	0	0	0	0	0	113.2	Y648 G654 F717	Y648-A652 HydrophobicContact CD2-CB 4.46Å; Y648-A652 HydrophobicContact CE1-CB 4.02Å; Y648-A652 HydrophobicContact CE2-CB 3.99Å; Y648-A652 WeakPolarHBondContact O-CB 3.27Å; Y648-A652 PolarHBondContact O-N 2.98Å; A652-G654 VanDerWaalsContact C-N 3.34Å; A652-F717 HydrophobicContact CB-CE2 3.7Å; A652-F717 HydrophobicContact CB-CZ 4.14Å
653	L	79.4	Confident	77.2	Confident	1 Å²	1	58 Å²	58	1%	0.005	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-10.4	175	-69.2	177.3	0	0	0	114.1	I649 V651 K667 F717 V720 Q724	I649-L653 HydrophobicContact CG2-CD1 3.6Å; I649-L653 HydrophobicContact CG2-CG 4.31Å; I649-L653 WeakPolarHBondContact O-CB 3.41Å; I649-L653 VanDerWaalsContact O-CG 3.28Å; I649-L653 WeakPolarHBondContact O-CG 3.37Å; I649-L653 PolarHBondContact O-N 3Å; I649-L653 VanDerWaalsContact O-N 3.13Å; V651-L653 VanDerWaalsContact C-N 3.29Å; V651-L653 PolarHBondContact O-N 3.32Å; L653-K667 HydrophobicContact CB-CB 4.03Å; L653-K667 WeakPolarHBondContact O-CG 3.42Å; L653-F717 HydrophobicContact CD2-CD2 3.43Å; L653-F717 VanDerWaalsContact CD2-CD2 3.43Å; L653-F717 HydrophobicContact CD2-CE2 3.58Å; L653-F717 HydrophobicContact CD2-CG 4.07Å; L653-F717 HydrophobicContact CD2-CZ 4.32Å; L653-F717 HydrophobicContact CG-CD2 3.92Å; L653-F717 HydrophobicContact CG-CE2 3.96Å; L653-V720 HydrophobicContact CD2-CB 3.91Å; L653-V720 HydrophobicContact CD2-CG1 3.84Å; L653-Q724 PolarHBondContact O-NE2 3.34Å
654	G	74.3	Confident	76.4	Confident	11 Å²	11	55.6 Å²	55.6	11%	0.113	31%	0.305	C	S	.	.			trans	-73.5	143.1	-177.5	0	0	0	0	0	114	V651 A652	V651-G654 PolarHBondContact O-N 3.1Å; V651-G654 VanDerWaalsContact O-N 3.09Å; A652-G654 VanDerWaalsContact C-N 3.34Å
655	E	71.7	Confident	75.7	Confident	27 Å²	27	53.1 Å²	53.1	13%	0.126	29%	0.29	C	S	.	.			trans	-90.1	113.3	171.7	-85.1	177.4	-157.5	0	0	110.8	S657 D665 R822	E655-S657 PolarHBondContact O-N 3.45Å; E655-D665 HydrophobicContact CB-CB 4.08Å; E655-D665 PolarHBondContact N-O 3.22Å; E655-D665 VanDerWaalsContact O-CB 3.27Å; E655-D665 WeakPolarHBondContact O-CB 3.38Å; E655-R822 IonicContact OE1-NH2 3.08Å; E655-R822 PolarHBondContact OE1-NH2 3.38Å; E655-R822 IonicContact OE2-CZ 3.3Å; E655-R822 IonicContact OE2-NE 3.73Å; E655-R822 IonicContact OE2-NH2 3.74Å; E655-R822 PolarHBondContact OE2-NH2 2.96Å
656	Y	70.3	Confident	75.3	Confident	138 Å²	138	54 Å²	54	54%	0.541	30%	0.297	S	S	.	.			trans	-95.9	73.3	179.7	-59.6	-74.1	0	0	0	111.8	V651 L662	V651-Y656 WeakPolarHBondContact CG1-OH 3.38Å; V651-Y656 PolarHBondContact O-OH 3.42Å; Y656-L662 HydrophobicContact CD1-CD1 3.44Å; Y656-L662 VanDerWaalsContact CD1-CD1 3.44Å; Y656-L662 HydrophobicContact CE1-CD1 3.65Å
657	S	63.5	Low	75.1	Confident	46 Å²	46	52.3 Å²	52.3	32%	0.322	29%	0.289	S	S	.	.	S	Bend	trans	-87.1	-37.4	-179.5	69.4	0	0	0	0	113.7	E655 D665	E655-S657 PolarHBondContact O-N 3.45Å; S657-D665 PolarHBondContact OG-OD2 2.96Å; S657-D665 VanDerWaalsContact OG-OD2 3.04Å
658	S	63.6	Low	75	Confident	68 Å²	68	52.1 Å²	52.1	48%	0.476	28%	0.282	S	S	.	.			trans	-160.6	143.4	-179.4	-173.5	0	0	0	0	111.5	K660 R661 L662	S658-K660 PolarHBondContact O-N 2.99Å; S658-K660 VanDerWaalsContact O-N 3.14Å; S658-R661 PolarHBondContact O-N 3.26Å; S658-L662 PolarHBondContact O-N 2.8Å
659	C	63.8	Low	74.8	Confident	118 Å²	118	53.9 Å²	53.9	80%	0.797	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-28.4	-178.3	-153.1	0	0	0	0	113.1
660	K	64.6	Low	74.9	Confident	187 Å²	187	53.6 Å²	53.6	81%	0.813	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.2	-13.5	176.9	-66.1	-173.7	-179.9	-177.8	0	114.3	S658	S658-K660 PolarHBondContact O-N 2.99Å; S658-K660 VanDerWaalsContact O-N 3.14Å
661	R	71.2	Confident	75	Confident	10 Å²	10	53 Å²	53	4%	0.038	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.1	2.8	-177.7	-156.8	178.7	162.9	115.1	13.6	112.8	S658 L663 V664 D665 N808 T820 R821 R822	S658-R661 PolarHBondContact O-N 3.26Å; R661-L663 VanDerWaalsContact C-N 3.31Å; R661-L663 PolarHBondContact O-N 3.28Å; R661-V664 HydrophobicContact CG-CB 4.13Å; R661-V664 PolarHBondContact O-N 2.81Å; R661-D665 WeakPolarHBondContact CD-OD2 3.24Å; R661-D665 VanDerWaalsContact CG-OD2 3.28Å; R661-D665 WeakPolarHBondContact CG-OD2 3.48Å; R661-D665 IonicContact CZ-OD1 3.33Å; R661-D665 VanDerWaalsContact NE-CG 3.33Å; R661-D665 IonicContact NE-OD1 2.88Å; R661-D665 PolarHBondContact NE-OD1 3Å; R661-D665 IonicContact NE-OD2 3.5Å; R661-D665 PolarHBondContact NE-OD2 3.28Å; R661-D665 IonicContact NH2-OD1 3.57Å; R661-D665 PolarHBondContact O-N 2.85Å; R661-N808 PolarHBondContact NH2-OD1 3.29Å; R661-N808 VanDerWaalsContact NH2-OD1 3.13Å; R661-T820 PolarHBondContact NH1-O 2.85Å; R661-R821 PolarHBondContact NH1-O 3.41Å; R661-R822 VanDerWaalsContact NH1-N 3.11Å
662	L	71.5	Confident	75.2	Confident	76 Å²	76	52.8 Å²	52.8	40%	0.398	28%	0.283	S	S	.	.	H	α-helix	trans	-51.6	-43.8	-175	-161.2	84.4	0	0	0	113.8	Y656 S658 V664 S666	Y656-L662 HydrophobicContact CD1-CD1 3.44Å; Y656-L662 VanDerWaalsContact CD1-CD1 3.44Å; Y656-L662 HydrophobicContact CE1-CD1 3.65Å; S658-L662 PolarHBondContact O-N 2.8Å; L662-V664 VanDerWaalsContact C-N 3.34Å; L662-S666 WeakPolarHBondContact O-CB 3.39Å; L662-S666 PolarHBondContact O-N 2.67Å; L662-S666 VanDerWaalsContact O-N 3.12Å
663	L	71	Confident	75.5	Confident	116 Å²	116	51.3 Å²	51.3	61%	0.607	27%	0.272	S	S	*	.	H	α-helix	trans	-81.2	-10.4	-177.9	-68.4	170.8	0	0	0	114.3	R661 S666 E811	R661-L663 VanDerWaalsContact C-N 3.31Å; R661-L663 PolarHBondContact O-N 3.28Å; L663-S666 PolarHBondContact O-OG 3.35Å; L663-E811 PolarHBondContact O-N 2.97Å
664	V	71.6	Confident	75.9	Confident	2 Å²	2	51.4 Å²	51.4	1%	0.012	27%	0.273	C	S	.	.	H	α-helix	trans	-94.6	-42	176.3	178.4	0	0	0	0	109.9	R661 L662 S666 V818	R661-V664 HydrophobicContact CG-CB 4.13Å; R661-V664 PolarHBondContact O-N 2.81Å; L662-V664 VanDerWaalsContact C-N 3.34Å; V664-S666 VanDerWaalsContact C-N 3.34Å; V664-V818 HydrophobicContact CG2-CB 4.14Å; V664-V818 HydrophobicContact CG2-CG2 3.58Å
665	D	73.9	Confident	76.6	Confident	2 Å²	2	53 Å²	53	1%	0.011	28%	0.279	C	S	.	.	H	α-helix	trans	-87.7	-2	-178.4	-66.6	-18.2	0	0	0	113.1	E655 S657 R661 Q805	E655-D665 HydrophobicContact CB-CB 4.08Å; E655-D665 PolarHBondContact N-O 3.22Å; E655-D665 VanDerWaalsContact O-CB 3.27Å; E655-D665 WeakPolarHBondContact O-CB 3.38Å; S657-D665 PolarHBondContact OG-OD2 2.96Å; S657-D665 VanDerWaalsContact OG-OD2 3.04Å; R661-D665 WeakPolarHBondContact CD-OD2 3.24Å; R661-D665 VanDerWaalsContact CG-OD2 3.28Å; R661-D665 WeakPolarHBondContact CG-OD2 3.48Å; R661-D665 IonicContact CZ-OD1 3.33Å; R661-D665 VanDerWaalsContact NE-CG 3.33Å; R661-D665 IonicContact NE-OD1 2.88Å; R661-D665 PolarHBondContact NE-OD1 3Å; R661-D665 IonicContact NE-OD2 3.5Å; R661-D665 PolarHBondContact NE-OD2 3.28Å; R661-D665 IonicContact NH2-OD1 3.57Å; R661-D665 PolarHBondContact O-N 2.85Å; D665-Q805 PolarHBondContact OD1-NE2 3Å
666	S	78.7	Confident	77.5	Confident	28 Å²	28	56.7 Å²	56.7	20%	0.196	30%	0.299	C	S	.	.			trans	-65.3	147.5	168	62.7	0	0	0	0	111.1	L662 L663 V664 R804 E811	L662-S666 WeakPolarHBondContact O-CB 3.39Å; L662-S666 PolarHBondContact O-N 2.67Å; L662-S666 VanDerWaalsContact O-N 3.12Å; L663-S666 PolarHBondContact O-OG 3.35Å; V664-S666 VanDerWaalsContact C-N 3.34Å; S666-R804 PolarHBondContact O-NH2 3.16Å; S666-E811 VanDerWaalsContact CB-OE2 3.28Å; S666-E811 WeakPolarHBondContact CB-OE2 3.37Å; S666-E811 VanDerWaalsContact O-CD 3.29Å; S666-E811 PolarHBondContact OG-OE2 2.63Å
667	K	82	Confident	78.6	Confident	3 Å²	3	50.9 Å²	50.9	1%	0.013	28%	0.277	C	S	.	.			trans	-119.3	33.6	-177.6	-64.4	-68.6	177.6	171	0	111.6	L653 L669 V670 G671 D801 E811	L653-K667 HydrophobicContact CB-CB 4.03Å; L653-K667 WeakPolarHBondContact O-CG 3.42Å; K667-L669 PolarHBondContact O-N 3.34Å; K667-V670 HydrophobicContact CB-CB 4.33Å; K667-V670 HydrophobicContact CD-CG2 4.18Å; K667-V670 PolarHBondContact O-N 3.43Å; K667-G671 PolarHBondContact O-N 3.06Å; K667-D801 VanDerWaalsContact CD-OD2 3.31Å; K667-D801 WeakPolarHBondContact CD-OD2 3.41Å; K667-D801 IonicContact NZ-OD2 2.76Å; K667-D801 PolarHBondContact NZ-OD2 3.37Å; K667-E811 VanDerWaalsContact C-OE1 3.23Å; K667-E811 WeakPolarHBondContact CA-OE1 3.46Å; K667-E811 PolarHBondContact N-OE2 3.3Å
668	F	84.8	Confident	79.9	Confident	82 Å²	82	48.9 Å²	48.9	36%	0.36	26%	0.263	S	S	.	.	H	α-helix	trans	-58.7	-43.4	-178.6	-178.2	-93.2	0	0	0	112.9	F646 A650 V670 G671 L672 E811 L812	F646-F668 AromaticContact CE1-CE2 3.6Å; F646-F668 HydrophobicContact CE1-CE2 3.6Å; F646-F668 AromaticContact CE1-CZ 3.81Å; F646-F668 HydrophobicContact CE1-CZ 3.81Å; F646-F668 HydrophobicContact CE2-CE2 4.4Å; F646-F668 HydrophobicContact CZ-CD2 4.04Å; F646-F668 HydrophobicContact CZ-CE1 4.18Å; F646-F668 AromaticContact CZ-CE2 3.33Å; F646-F668 HydrophobicContact CZ-CE2 3.33Å; F646-F668 AromaticContact CZ-CZ 3.42Å; F646-F668 HydrophobicContact CZ-CZ 3.42Å; F646-F668 VanDerWaalsContact CZ-CZ 3.42Å; A650-F668 HydrophobicContact CB-CD2 3.93Å; F668-V670 VanDerWaalsContact C-N 3.34Å; F668-G671 PolarHBondContact O-N 3.03Å; F668-L672 WeakPolarHBondContact O-CB 3.3Å; F668-L672 PolarHBondContact O-N 3.49Å; F668-E811 WeakPolarHBondContact CB-OE2 3.4Å; F668-E811 PolarHBondContact N-OE1 3.43Å; F668-E811 PolarHBondContact N-OE2 2.76Å; F668-L812 HydrophobicContact CD1-CD1 4.36Å
669	L	83.7	Confident	81.3	Confident	85 Å²	85	47.2 Å²	47.2	45%	0.445	26%	0.257	S	S	.	.	H	α-helix	trans	-69.4	-33.5	-179.8	-162.7	112	0	0	0	111.7	K667 G673 E811	K667-L669 PolarHBondContact O-N 3.34Å; L669-G673 PolarHBondContact O-N 3.31Å; L669-E811 HydrophobicContact CB-CG 4.12Å; L669-E811 WeakPolarHBondContact CB-OE1 3.48Å; L669-E811 PolarHBondContact N-OE1 3.38Å
670	V	85.8	Confident	82.7	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-68.9	-42.9	173	-179.7	0	0	0	0	110.4	K667 F668 G673 G674 V720 F794 L797 L798 D801	K667-V670 HydrophobicContact CB-CB 4.33Å; K667-V670 HydrophobicContact CD-CG2 4.18Å; K667-V670 PolarHBondContact O-N 3.43Å; F668-V670 VanDerWaalsContact C-N 3.34Å; V670-G673 PolarHBondContact O-N 3.44Å; V670-G674 PolarHBondContact O-N 3.39Å; V670-V720 HydrophobicContact CG1-CG2 4.23Å; V670-F794 HydrophobicContact CG1-CE2 3.75Å; V670-F794 HydrophobicContact CG1-CZ 3.58Å; V670-L797 HydrophobicContact CB-CD2 4.44Å; V670-L797 HydrophobicContact CG2-CD2 4.34Å; V670-L798 HydrophobicContact CG1-CD1 4.4Å; V670-D801 HydrophobicContact CG2-CB 3.63Å; V670-D801 VanDerWaalsContact CG2-CG 3.46Å; V670-D801 WeakPolarHBondContact CG2-OD2 3.41Å
671	G	84.8	Confident	84.1	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-60.3	-46.2	172.9	0	0	0	0	0	112.5	K667 F668 G674 I675	K667-G671 PolarHBondContact O-N 3.06Å; F668-G671 PolarHBondContact O-N 3.03Å; G671-G674 PolarHBondContact O-N 3.46Å; G671-I675 PolarHBondContact O-N 3.3Å; G671-I675 VanDerWaalsContact O-N 3.09Å
672	L	87.1	Confident	85.2	Confident	72 Å²	72	34.7 Å²	34.7	38%	0.377	20%	0.195	S	C	.	.	H	α-helix	trans	-63.2	-44.7	176.4	-177.4	66.2	0	0	0	111.5	F646 F668 G674 I675 L676	F646-L672 HydrophobicContact CE2-CB 3.99Å; F646-L672 HydrophobicContact CE2-CD1 4.15Å; F646-L672 HydrophobicContact CZ-CB 4.36Å; F646-L672 HydrophobicContact CZ-CD1 4.22Å; F668-L672 WeakPolarHBondContact O-CB 3.3Å; F668-L672 PolarHBondContact O-N 3.49Å; L672-G674 VanDerWaalsContact C-N 3.3Å; L672-G674 PolarHBondContact O-N 2.98Å; L672-I675 PolarHBondContact O-N 2.91Å; L672-L676 HydrophobicContact CG-CD1 4.07Å; L672-L676 WeakPolarHBondContact O-CB 3.23Å; L672-L676 WeakPolarHBondContact O-CG 3.44Å; L672-L676 PolarHBondContact O-N 3.4Å
673	G	88.8	Confident	86.2	Confident	6 Å²	6	34.9 Å²	34.9	6%	0.062	20%	0.196	C	C	.	.	H	α-helix	trans	-60.3	-39.5	175.9	0	0	0	0	0	112.4	L669 V670 L676 V677	L669-G673 PolarHBondContact O-N 3.31Å; V670-G673 PolarHBondContact O-N 3.44Å; G673-L676 PolarHBondContact O-N 3.36Å; G673-V677 VanDerWaalsContact O-CG2 3.32Å; G673-V677 WeakPolarHBondContact O-CG2 3.46Å; G673-V677 PolarHBondContact O-N 3.21Å
674	G	87.9	Confident	87.3	Confident	3 Å²	3	29.5 Å²	29.5	3%	0.031	17%	0.168	C	C	.	.	H	α-helix	trans	-60	-50.3	174.1	0	0	0	0	0	113	V670 G671 L672 L676 V677 V678	V670-G674 PolarHBondContact O-N 3.39Å; G671-G674 PolarHBondContact O-N 3.46Å; L672-G674 VanDerWaalsContact C-N 3.3Å; L672-G674 PolarHBondContact O-N 2.98Å; G674-L676 VanDerWaalsContact C-N 3.35Å; G674-L676 PolarHBondContact O-N 3.48Å; G674-V677 WeakPolarHBondContact O-CB 3.34Å; G674-V677 PolarHBondContact O-N 2.77Å; G674-V678 WeakPolarHBondContact O-CG2 3.45Å; G674-V678 PolarHBondContact O-N 2.78Å; G674-V678 VanDerWaalsContact O-N 3.08Å
675	I	88	Confident	88.4	Confident	44 Å²	44	29.4 Å²	29.4	23%	0.226	17%	0.168	C	C	.	.	H	α-helix	trans	-65.5	-38.3	178.1	-64.2	-171.4	0	0	0	111.9	F646 G671 L672 V677 V678 G679 L709	F646-I675 HydrophobicContact CB-CD1 3.41Å; F646-I675 VanDerWaalsContact CB-CD1 3.41Å; F646-I675 HydrophobicContact CD2-CD1 3.4Å; F646-I675 VanDerWaalsContact CD2-CD1 3.4Å; F646-I675 HydrophobicContact CD2-CG1 4.38Å; F646-I675 HydrophobicContact CE2-CD1 4.5Å; F646-I675 HydrophobicContact CG-CD1 3.81Å; G671-I675 PolarHBondContact O-N 3.3Å; G671-I675 VanDerWaalsContact O-N 3.09Å; L672-I675 PolarHBondContact O-N 2.91Å; I675-V677 VanDerWaalsContact C-N 3.3Å; I675-V677 PolarHBondContact O-N 2.85Å; I675-V678 PolarHBondContact O-N 3.26Å; I675-G679 PolarHBondContact O-N 3.43Å; I675-L709 HydrophobicContact CG1-CD1 4.16Å
676	L	91	Very high	89.3	Confident	105 Å²	105	29.9 Å²	29.9	55%	0.55	17%	0.17	S	C	.	.	H	α-helix	trans	-62.2	-39.7	175.1	-75.9	170.1	0	0	0	111.6	L672 G673 G674 G679 C680	L672-L676 HydrophobicContact CG-CD1 4.07Å; L672-L676 WeakPolarHBondContact O-CB 3.23Å; L672-L676 WeakPolarHBondContact O-CG 3.44Å; L672-L676 PolarHBondContact O-N 3.4Å; G673-L676 PolarHBondContact O-N 3.36Å; G674-L676 VanDerWaalsContact C-N 3.35Å; G674-L676 PolarHBondContact O-N 3.48Å; L676-G679 PolarHBondContact O-N 3.2Å; L676-C680 WeakPolarHBondContact O-CB 2.98Å; L676-C680 PolarHBondContact O-N 3.19Å; L676-C680 PolarHBondContact O-SG 3.23Å
677	V	92.8	Very high	90	Very high	15 Å²	15	28.6 Å²	28.6	9%	0.091	16%	0.161	C	C	.	.	H	α-helix	trans	-60.9	-47.7	175.1	161.1	0	0	0	0	111.1	G673 G674 I675 C680 S681 L789 Q790 A793	G673-V677 VanDerWaalsContact O-CG2 3.32Å; G673-V677 WeakPolarHBondContact O-CG2 3.46Å; G673-V677 PolarHBondContact O-N 3.21Å; G674-V677 WeakPolarHBondContact O-CB 3.34Å; G674-V677 PolarHBondContact O-N 2.77Å; I675-V677 VanDerWaalsContact C-N 3.3Å; I675-V677 PolarHBondContact O-N 2.85Å; V677-C680 PolarHBondContact O-N 3.3Å; V677-S681 PolarHBondContact O-N 3.04Å; V677-L789 HydrophobicContact CG1-CB 3.62Å; V677-Q790 HydrophobicContact CG1-CG 4.1Å; V677-A793 HydrophobicContact CG2-CB 4.2Å
678	V	91.7	Very high	90.6	Very high	5 Å²	5	31.4 Å²	31.4	3%	0.03	17%	0.173	C	C	.	.	H	α-helix	trans	-61.1	-45.3	175.1	173.3	0	0	0	0	111.1	G674 I675 C680 S681 V682 V708 L709 I716	G674-V678 WeakPolarHBondContact O-CG2 3.45Å; G674-V678 PolarHBondContact O-N 2.78Å; G674-V678 VanDerWaalsContact O-N 3.08Å; I675-V678 PolarHBondContact O-N 3.26Å; V678-C680 VanDerWaalsContact C-N 3.31Å; V678-C680 PolarHBondContact O-N 3.24Å; V678-S681 PolarHBondContact O-N 3.27Å; V678-S681 PolarHBondContact O-OG 2.92Å; V678-V682 WeakPolarHBondContact O-CG2 3.38Å; V678-V682 PolarHBondContact O-N 2.9Å; V678-V708 HydrophobicContact CG1-CG1 4.06Å; V678-L709 HydrophobicContact CB-CD1 4.34Å; V678-L709 HydrophobicContact CG1-CB 3.99Å; V678-L709 HydrophobicContact CG1-CD1 3.96Å; V678-L709 HydrophobicContact CG2-CD1 4.42Å; V678-I716 HydrophobicContact CG2-CD1 4.44Å
679	G	91.8	Very high	91	Very high	33 Å²	33	28.2 Å²	28.2	34%	0.34	16%	0.159	S	C	.	.	H	α-helix	trans	-61.8	-40	177.8	0	0	0	0	0	112.4	I675 L676 V682 L683	I675-G679 PolarHBondContact O-N 3.43Å; L676-G679 PolarHBondContact O-N 3.2Å; G679-V682 PolarHBondContact O-N 2.86Å; G679-L683 WeakPolarHBondContact O-CG 3.44Å; G679-L683 PolarHBondContact O-N 3.09Å
680	C	93.8	Very high	91.4	Very high	42 Å²	42	24.4 Å²	24.4	28%	0.284	14%	0.139	S	C	.	.	H	α-helix	trans	-64.9	-36.7	176.2	-71.8	0	0	0	0	112.7	V365 L676 V677 V678 A684 L789	V365-C680 HydrophobicContact CB-CB 4.49Å; V365-C680 HydrophobicContact CG1-CB 3.76Å; V365-C680 HydrophobicContact CG2-CB 3.91Å; L676-C680 WeakPolarHBondContact O-CB 2.98Å; L676-C680 PolarHBondContact O-N 3.19Å; L676-C680 PolarHBondContact O-SG 3.23Å; V677-C680 PolarHBondContact O-N 3.3Å; V678-C680 VanDerWaalsContact C-N 3.31Å; V678-C680 PolarHBondContact O-N 3.24Å; C680-A684 VanDerWaalsContact O-CB 3.27Å; C680-A684 WeakPolarHBondContact O-CB 3.29Å; C680-A684 PolarHBondContact O-N 3.07Å; C680-L789 HydrophobicContact CB-CD1 4.04Å
681	S	95.1	Very high	91.7	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-66.9	-40.5	177.7	71.1	0	0	0	0	111.9	V677 V678 A684 S685	V677-S681 PolarHBondContact O-N 3.04Å; V678-S681 PolarHBondContact O-N 3.27Å; V678-S681 PolarHBondContact O-OG 2.92Å; S681-A684 PolarHBondContact O-N 3.38Å; S681-S685 WeakPolarHBondContact O-CB 3.4Å; S681-S685 PolarHBondContact O-N 3.25Å
682	V	93.4	Very high	92	Very high	9 Å²	9	38.2 Å²	38.2	6%	0.055	20%	0.198	C	C	.	.	H	α-helix	trans	-64.1	-47.7	176	176.2	0	0	0	0	111	V678 G679 A684 S685 M686 P705 V708	V678-V682 WeakPolarHBondContact O-CG2 3.38Å; V678-V682 PolarHBondContact O-N 2.9Å; G679-V682 PolarHBondContact O-N 2.86Å; V682-A684 VanDerWaalsContact C-N 3.35Å; V682-A684 PolarHBondContact O-N 2.94Å; V682-S685 PolarHBondContact O-N 3.48Å; V682-M686 HydrophobicContact CG1-CE 3.6Å; V682-M686 HydrophobicContact CG1-CG 4.48Å; V682-M686 HydrophobicContact CG1-SD 4.03Å; V682-M686 WeakPolarHBondContact O-CG 3.39Å; V682-M686 PolarHBondContact O-N 2.77Å; V682-P705 HydrophobicContact CG1-CB 4.31Å; V682-P705 HydrophobicContact CG1-CG 4.02Å; V682-P705 HydrophobicContact CG2-CB 4.46Å; V682-V708 HydrophobicContact CG2-CB 3.92Å; V682-V708 HydrophobicContact CG2-CG1 4.01Å; V682-V708 HydrophobicContact CG2-CG2 4.21Å
683	L	93.2	Very high	92.1	Very high	80 Å²	80	37.6 Å²	37.6	42%	0.419	21%	0.209	S	C	.	.	H	α-helix	trans	-62.3	-40.9	177.4	-69.7	173.1	0	0	0	112.1	L372 G679 M686 G687	L372-L683 HydrophobicContact CD1-CD2 3.97Å; G679-L683 WeakPolarHBondContact O-CG 3.44Å; G679-L683 PolarHBondContact O-N 3.09Å; L683-M686 PolarHBondContact O-N 2.97Å; L683-G687 PolarHBondContact O-N 3.42Å
684	A	94.5	Very high	92	Very high	3 Å²	3	39.4 Å²	39.4	3%	0.025	22%	0.217	C	C	.	.	H	α-helix	trans	-63.9	-43.3	176.3	0	0	0	0	0	111.9	F368 C680 S681 V682 F688	F368-A684 HydrophobicContact CB-CB 3.87Å; F368-A684 HydrophobicContact CD2-CB 4.42Å; F368-A684 HydrophobicContact CG-CB 4.5Å; C680-A684 VanDerWaalsContact O-CB 3.27Å; C680-A684 WeakPolarHBondContact O-CB 3.29Å; C680-A684 PolarHBondContact O-N 3.07Å; S681-A684 PolarHBondContact O-N 3.38Å; V682-A684 VanDerWaalsContact C-N 3.35Å; V682-A684 PolarHBondContact O-N 2.94Å; A684-F688 WeakPolarHBondContact O-CB 3.38Å; A684-F688 PolarHBondContact O-N 3.49Å
685	S	94.6	Very high	92	Very high	1 Å²	1	41.9 Å²	41.9	1%	0.007	23%	0.232	C	C	.	.	H	α-helix	trans	-62.6	-48.3	175.9	179.1	0	0	0	0	111.8	S681 V682 G687 F688 Y689 Y778 A782	S681-S685 WeakPolarHBondContact O-CB 3.4Å; S681-S685 PolarHBondContact O-N 3.25Å; V682-S685 PolarHBondContact O-N 3.48Å; S685-G687 PolarHBondContact O-N 3.36Å; S685-F688 PolarHBondContact O-N 3.46Å; S685-Y689 WeakPolarHBondContact O-CD2 3.15Å; S685-Y689 PolarHBondContact O-N 3.01Å; S685-Y689 VanDerWaalsContact O-N 3.15Å; S685-Y778 PolarHBondContact OG-O 2.88Å; S685-A782 PolarHBondContact OG-N 3.29Å
686	M	92.3	Very high	91.9	Very high	12 Å²	12	39.8 Å²	39.8	6%	0.059	22%	0.222	C	C	.	.	H	α-helix	trans	-62.6	-42.7	179.1	-71.6	179	179.2	0	0	112.1	L372 V682 L683 S690 I700 L701 P705 Y778	L372-M686 HydrophobicContact CD2-CB 3.79Å; V682-M686 HydrophobicContact CG1-CE 3.6Å; V682-M686 HydrophobicContact CG1-CG 4.48Å; V682-M686 HydrophobicContact CG1-SD 4.03Å; V682-M686 WeakPolarHBondContact O-CG 3.39Å; V682-M686 PolarHBondContact O-N 2.77Å; L683-M686 PolarHBondContact O-N 2.97Å; M686-S690 WeakPolarHBondContact O-CB 3.41Å; M686-S690 PolarHBondContact O-N 3.31Å; M686-I700 HydrophobicContact CE-CG2 4.27Å; M686-L701 HydrophobicContact CE-CD2 3.99Å; M686-L701 HydrophobicContact SD-CD2 3.91Å; M686-P705 HydrophobicContact CE-CG 4.4Å; M686-Y778 HydrophobicContact CB-CD1 4.49Å; M686-Y778 HydrophobicContact CB-CE1 4.28Å; M686-Y778 HydrophobicContact CG-CD1 3.95Å; M686-Y778 HydrophobicContact CG-CE1 4.11Å
687	G	94.1	Very high	91.7	Very high	0 Å²	0	35 Å²	35	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-64.7	-41.1	176.7	0	0	0	0	0	112.9	F368 G371 L683 S685 S690 W691	F368-G687 CarbonylContact O-C 3.3Å; F368-G687 VanDerWaalsContact O-C 3.3Å; F368-G687 VanDerWaalsContact O-CA 3.24Å; F368-G687 WeakPolarHBondContact O-CA 3.42Å; G371-G687 WeakPolarHBondContact CA-O 3.3Å; L683-G687 PolarHBondContact O-N 3.42Å; S685-G687 PolarHBondContact O-N 3.36Å; G687-S690 PolarHBondContact O-N 3.43Å; G687-W691 PolarHBondContact O-N 2.89Å
688	F	93.9	Very high	91.1	Very high	63 Å²	63	36.6 Å²	36.6	28%	0.276	20%	0.204	S	C	.	.	H	α-helix	trans	-60.8	-50	177.3	177.3	-99.3	0	0	0	112.5	F368 A684 S685 S690 W691 I692 L781	F368-F688 HydrophobicContact CD1-CB 4.21Å; F368-F688 AromaticContact CD1-CD2 3.95Å; F368-F688 HydrophobicContact CD1-CD2 3.95Å; F368-F688 AromaticContact CE1-CD2 3.77Å; F368-F688 HydrophobicContact CE1-CD2 3.77Å; F368-F688 HydrophobicContact CE1-CE2 4.39Å; A684-F688 WeakPolarHBondContact O-CB 3.38Å; A684-F688 PolarHBondContact O-N 3.49Å; S685-F688 PolarHBondContact O-N 3.46Å; F688-S690 VanDerWaalsContact C-N 3.35Å; F688-W691 WeakPolarHBondContact O-CB 3.49Å; F688-W691 PolarHBondContact O-N 2.99Å; F688-W691 VanDerWaalsContact O-N 3.14Å; F688-I692 HydrophobicContact CD1-CD1 3.85Å; F688-I692 HydrophobicContact CE1-CD1 3.29Å; F688-I692 HydrophobicContact CE1-CG1 4.45Å; F688-I692 HydrophobicContact CE2-CD1 4.35Å; F688-I692 HydrophobicContact CZ-CD1 3.59Å; F688-I692 PolarHBondContact O-N 2.66Å; F688-I692 VanDerWaalsContact O-N 3.16Å; F688-L781 HydrophobicContact CB-CD2 3.92Å; F688-L781 HydrophobicContact CD1-CD2 3.23Å; F688-L781 HydrophobicContact CE1-CD2 3.9Å; F688-L781 HydrophobicContact CG-CD2 3.78Å
689	Y	92.6	Very high	90.5	Very high	14 Å²	14	39 Å²	39	6%	0.055	22%	0.219	C	C	.	.	H	α-helix	trans	-71	-31.8	179.3	-76.2	-61	0	0	0	113.2	S685 W691 I692 G693 I694 L777 Y778 L781	S685-Y689 WeakPolarHBondContact O-CD2 3.15Å; S685-Y689 PolarHBondContact O-N 3.01Å; S685-Y689 VanDerWaalsContact O-N 3.15Å; Y689-W691 PolarHBondContact O-N 3.35Å; Y689-I692 HydrophobicContact CD1-CD1 4.15Å; Y689-I692 HydrophobicContact CE1-CD1 4.49Å; Y689-I692 PolarHBondContact O-N 3.45Å; Y689-G693 PolarHBondContact O-N 3.48Å; Y689-I694 HydrophobicContact CD1-CD1 3.71Å; Y689-I694 HydrophobicContact CD1-CG1 4.46Å; Y689-I694 HydrophobicContact CE1-CD1 4.15Å; Y689-I694 PolarHBondContact O-N 2.98Å; Y689-I694 VanDerWaalsContact O-N 3.11Å; Y689-L777 HydrophobicContact CE1-CB 4.27Å; Y689-L777 VanDerWaalsContact CE2-C 3.49Å; Y689-L777 HydrophobicContact CE2-CB 4.33Å; Y689-L777 WeakPolarHBondContact CE2-O 3.27Å; Y689-L777 PolarHBondContact OH-O 3.13Å; Y689-Y778 WeakPolarHBondContact CB-OH 3.47Å; Y689-Y778 HydrophobicContact CD2-CD1 4.05Å; Y689-Y778 AromaticContact CD2-CD2 3.79Å; Y689-Y778 HydrophobicContact CD2-CD2 3.79Å; Y689-Y778 HydrophobicContact CD2-CE1 4.26Å; Y689-Y778 HydrophobicContact CD2-CE2 4.04Å; Y689-Y778 AromaticContact CD2-CG 3.84Å; Y689-Y778 HydrophobicContact CD2-CG 3.84Å; Y689-Y778 HydrophobicContact CE2-CD2 4.36Å; Y689-Y778 HydrophobicContact CE2-CG 4.4Å; Y689-Y778 HydrophobicContact CG-CD2 4.12Å; Y689-Y778 HydrophobicContact CG-CE1 4.47Å; Y689-Y778 AromaticContact CG-CE2 3.92Å; Y689-Y778 HydrophobicContact CG-CE2 3.92Å; Y689-L781 HydrophobicContact CD2-CD2 4.11Å; Y689-L781 HydrophobicContact CE2-CB 3.75Å; Y689-L781 HydrophobicContact CE2-CD2 3.64Å; Y689-L781 HydrophobicContact CE2-CG 4.36Å
690	S	92	Very high	90.2	Very high	5 Å²	5	37.5 Å²	37.5	4%	0.035	20%	0.203	C	C	.	.	H	α-helix	trans	-62.6	-31.9	170.6	-171.3	0	0	0	0	112	G371 S374 I375 M686 G687 F688 G693	G371-S690 WeakPolarHBondContact O-CB 3.39Å; G371-S690 PolarHBondContact O-OG 2.88Å; S374-S690 VanDerWaalsContact C-OG 3.23Å; S374-S690 PolarHBondContact O-OG 3.3Å; I375-S690 VanDerWaalsContact CA-OG 3.22Å; I375-S690 WeakPolarHBondContact CA-OG 3.39Å; I375-S690 PolarHBondContact N-OG 3.04Å; I375-S690 VanDerWaalsContact N-OG 3.11Å; M686-S690 WeakPolarHBondContact O-CB 3.41Å; M686-S690 PolarHBondContact O-N 3.31Å; G687-S690 PolarHBondContact O-N 3.43Å; F688-S690 VanDerWaalsContact C-N 3.35Å; S690-G693 PolarHBondContact O-N 2.87Å
691	W	92.1	Very high	89.7	Confident	191 Å²	191	38.7 Å²	38.7	72%	0.723	21%	0.206	S	C	*	.	H	α-helix	trans	-72.9	-35.7	174.9	-170.9	23.9	0	0	0	112.6	G687 F688 Y689 G693	G687-W691 PolarHBondContact O-N 2.89Å; F688-W691 WeakPolarHBondContact O-CB 3.49Å; F688-W691 PolarHBondContact O-N 2.99Å; F688-W691 VanDerWaalsContact O-N 3.14Å; Y689-W691 PolarHBondContact O-N 3.35Å; W691-G693 PolarHBondContact O-N 3.37Å
692	I	91.3	Very high	89.1	Confident	99 Å²	99	39.8 Å²	39.8	51%	0.508	21%	0.212	S	C	.	.	H	α-helix	trans	-67.6	-21.9	172.3	-65.1	172.9	0	0	0	111.7	F688 Y689 I694	F688-I692 HydrophobicContact CD1-CD1 3.85Å; F688-I692 HydrophobicContact CE1-CD1 3.29Å; F688-I692 HydrophobicContact CE1-CG1 4.45Å; F688-I692 HydrophobicContact CE2-CD1 4.35Å; F688-I692 HydrophobicContact CZ-CD1 3.59Å; F688-I692 PolarHBondContact O-N 2.66Å; F688-I692 VanDerWaalsContact O-N 3.16Å; Y689-I692 HydrophobicContact CD1-CD1 4.15Å; Y689-I692 HydrophobicContact CE1-CD1 4.49Å; Y689-I692 PolarHBondContact O-N 3.45Å; I692-I694 HydrophobicContact CG2-CD1 4.36Å; I692-I694 HydrophobicContact CG2-CG1 4.02Å
693	G	88.3	Confident	88.6	Confident	59 Å²	59	39.9 Å²	39.9	61%	0.608	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	89.7	19.4	-179.9	0	0	0	0	0	114	Y689 S690 W691	Y689-G693 PolarHBondContact O-N 3.48Å; S690-G693 PolarHBondContact O-N 2.87Å; W691-G693 PolarHBondContact O-N 3.37Å
694	I	88.3	Confident	88.3	Confident	45 Å²	45	36.1 Å²	36.1	23%	0.231	19%	0.193	C	C	.	.	P	Polyproline II helix	trans	-75.9	125	171.2	-57.7	-172.5	0	0	0	108.1	Y689 I692 L777 Y778	Y689-I694 HydrophobicContact CD1-CD1 3.71Å; Y689-I694 HydrophobicContact CD1-CG1 4.46Å; Y689-I694 HydrophobicContact CE1-CD1 4.15Å; Y689-I694 PolarHBondContact O-N 2.98Å; Y689-I694 VanDerWaalsContact O-N 3.11Å; I692-I694 HydrophobicContact CG2-CD1 4.36Å; I692-I694 HydrophobicContact CG2-CG1 4.02Å; I694-L777 HydrophobicContact CD1-CD1 4.35Å; I694-Y778 HydrophobicContact CG2-CE2 4.09Å; I694-Y778 PolarHBondContact O-OH 3.49Å; I694-Y778 VanDerWaalsContact O-OH 3.11Å
695	P	86.6	Confident	88.1	Confident	54 Å²	54	37.4 Å²	37.4	35%	0.351	20%	0.2	S	C	.	.	P	Polyproline II helix	trans	-67	144.8	179.3	26.6	-32.8	0	0	0	111.3	T378	T378-P695 HydrophobicContact CG2-CB 3.61Å; T378-P695 HydrophobicContact CG2-CG 4.14Å
696	S	87.6	Confident	87.6	Confident	1 Å²	1	38.1 Å²	38.1	1%	0.007	20%	0.204	C	C	.	.	B	Isolated β-bridge	trans	-96.1	159.5	173.8	-64	0	0	0	0	111	K376 L377 T378 Y778	K376-S696 PolarHBondContact O-N 3.47Å; L377-S696 WeakPolarHBondContact CA-O 3.14Å; T378-S696 PolarHBondContact N-O 3.44Å; T378-S696 PolarHBondContact OG1-O 2.83Å; S696-Y778 PolarHBondContact OG-OH 3.43Å
697	S	85.8	Confident	87.2	Confident	5 Å²	5	38 Å²	38	4%	0.035	20%	0.203	C	C	.	.			trans	-125.3	161.8	175.9	71.4	0	0	0	0	111.4	V699 I700 L701	S697-V699 VanDerWaalsContact C-N 3.26Å; S697-V699 PolarHBondContact O-N 3.47Å; S697-I700 PolarHBondContact O-N 3.05Å; S697-I700 WeakPolarHBondContact OG-CG1 3.4Å; S697-I700 PolarHBondContact OG-N 3.48Å; S697-L701 PolarHBondContact O-N 3.23Å
698	L	79.4	Confident	87.1	Confident	47 Å²	47	38 Å²	38	25%	0.246	20%	0.203	C	C	.	.	H	α-helix	trans	-61.7	-35.6	177.2	-68.3	169	0	0	0	112.3	N628 T631 I700 L701 Q702	N628-L698 VanDerWaalsContact OD1-CD1 3.3Å; N628-L698 WeakPolarHBondContact OD1-CD1 3.17Å; T631-L698 HydrophobicContact CG2-CB 3.85Å; T631-L698 HydrophobicContact CG2-CD1 4.06Å; T631-L698 HydrophobicContact CG2-CD2 4.14Å; T631-L698 HydrophobicContact CG2-CG 4.22Å; L698-I700 VanDerWaalsContact C-N 3.32Å; L698-I700 PolarHBondContact O-N 3.03Å; L698-L701 PolarHBondContact O-N 3.17Å; L698-Q702 PolarHBondContact O-N 3.41Å
699	V	79	Confident	86.8	Confident	56 Å²	56	35.4 Å²	35.4	34%	0.339	19%	0.192	S	C	.	.	H	α-helix	trans	-62.1	-40.1	176.3	-177.6	0	0	0	0	111.2	S697 Q702 V703	S697-V699 VanDerWaalsContact C-N 3.26Å; S697-V699 PolarHBondContact O-N 3.47Å; V699-Q702 PolarHBondContact O-N 2.84Å; V699-V703 HydrophobicContact CG1-CG2 3.95Å; V699-V703 WeakPolarHBondContact O-CB 3.35Å; V699-V703 VanDerWaalsContact O-CG2 3.31Å; V699-V703 WeakPolarHBondContact O-CG2 3.25Å; V699-V703 PolarHBondContact O-N 2.75Å
700	I	86.1	Confident	86.4	Confident	1 Å²	1	35.1 Å²	35.1	1%	0.005	19%	0.192	C	C	.	.	H	α-helix	trans	-63.4	-44.5	178.2	-70.2	169.7	0	0	0	110.8	M686 S697 L698 Q702 V704 F775 Y778	M686-I700 HydrophobicContact CE-CG2 4.27Å; S697-I700 PolarHBondContact O-N 3.05Å; S697-I700 WeakPolarHBondContact OG-CG1 3.4Å; S697-I700 PolarHBondContact OG-N 3.48Å; L698-I700 VanDerWaalsContact C-N 3.32Å; L698-I700 PolarHBondContact O-N 3.03Å; I700-Q702 PolarHBondContact O-N 3.08Å; I700-V704 HydrophobicContact CB-CG2 4.47Å; I700-V704 HydrophobicContact CG2-CG2 3.9Å; I700-V704 WeakPolarHBondContact O-CB 3.47Å; I700-V704 PolarHBondContact O-N 2.79Å; I700-V704 VanDerWaalsContact O-N 3.17Å; I700-F775 HydrophobicContact CG1-CB 4.35Å; I700-Y778 HydrophobicContact CD1-CD2 4.35Å; I700-Y778 HydrophobicContact CG2-CD1 4Å; I700-Y778 HydrophobicContact CG2-CG 4.16Å
701	L	84.5	Confident	86.1	Confident	67 Å²	67	35.1 Å²	35.1	35%	0.351	19%	0.192	S	C	.	.	H	α-helix	trans	-61.9	-31	179.9	-70.6	175.3	0	0	0	112.9	L377 M686 S697 L698 P705	L377-L701 HydrophobicContact CD2-CD1 3.94Å; M686-L701 HydrophobicContact CE-CD2 3.99Å; M686-L701 HydrophobicContact SD-CD2 3.91Å; S697-L701 PolarHBondContact O-N 3.23Å; L698-L701 PolarHBondContact O-N 3.17Å; L701-P705 WeakPolarHBondContact O-CD 3.11Å; L701-P705 WeakPolarHBondContact O-CG 3.08Å
702	Q	80.7	Confident	85.9	Confident	24 Å²	24	26 Å²	26	11%	0.112	16%	0.158	C	C	.	.	H	α-helix	trans	-87.3	-46	-179.6	-68	-178.1	-16	0	0	112.9	T631 F638 Y642 L698 V699 I700	T631-Q702 PolarHBondContact O-NE2 3.3Å; T631-Q702 VanDerWaalsContact O-NE2 3.1Å; F638-Q702 HydrophobicContact CE2-CB 4.21Å; F638-Q702 HydrophobicContact CE2-CG 4.33Å; F638-Q702 HydrophobicContact CZ-CB 4.28Å; Y642-Q702 PolarHBondContact OH-O 2.95Å; L698-Q702 PolarHBondContact O-N 3.41Å; V699-Q702 PolarHBondContact O-N 2.84Å; I700-Q702 PolarHBondContact O-N 3.08Å
703	V	83.1	Confident	85.7	Confident	10 Å²	10	21.5 Å²	21.5	6%	0.061	14%	0.136	C	C	.	.	H	α-helix	trans	-89.4	-39.2	-166.5	-178.6	0	0	0	0	112.9	V699 F706 L707 F775 F1244	V699-V703 HydrophobicContact CG1-CG2 3.95Å; V699-V703 WeakPolarHBondContact O-CB 3.35Å; V699-V703 VanDerWaalsContact O-CG2 3.31Å; V699-V703 WeakPolarHBondContact O-CG2 3.25Å; V699-V703 PolarHBondContact O-N 2.75Å; V703-F706 WeakPolarHBondContact O-CB 3.34Å; V703-F706 PolarHBondContact O-N 2.82Å; V703-L707 PolarHBondContact O-N 2.64Å; V703-F775 HydrophobicContact CB-CE2 4.07Å; V703-F775 HydrophobicContact CG1-CE2 3.66Å; V703-F775 HydrophobicContact CG1-CZ 4.14Å; V703-F1244 HydrophobicContact CB-CE1 4.14Å; V703-F1244 HydrophobicContact CG1-CD1 4.38Å; V703-F1244 HydrophobicContact CG1-CE1 3.61Å; V703-F1244 HydrophobicContact CG1-CZ 4.41Å; V703-F1244 HydrophobicContact CG2-CD1 4.15Å; V703-F1244 HydrophobicContact CG2-CE1 3.32Å; V703-F1244 HydrophobicContact CG2-CE2 4.38Å; V703-F1244 HydrophobicContact CG2-CZ 3.45Å; V703-F1244 VanDerWaalsContact CG2-CZ 3.45Å
704	V	88.6	Confident	85.6	Confident	2 Å²	2	18.9 Å²	18.9	1%	0.012	11%	0.107	C	C	.	.	H	α-helix	trans	-61.4	-45.6	-176.2	174.6	0	0	0	0	112.2	I700 F706 L707 V708 F775 A782	I700-V704 HydrophobicContact CB-CG2 4.47Å; I700-V704 HydrophobicContact CG2-CG2 3.9Å; I700-V704 WeakPolarHBondContact O-CB 3.47Å; I700-V704 PolarHBondContact O-N 2.79Å; I700-V704 VanDerWaalsContact O-N 3.17Å; V704-F706 VanDerWaalsContact C-N 3.26Å; V704-F706 PolarHBondContact O-N 2.92Å; V704-L707 PolarHBondContact O-N 3.16Å; V704-V708 HydrophobicContact CG1-CG2 4.01Å; V704-V708 VanDerWaalsContact O-CG2 3.24Å; V704-V708 WeakPolarHBondContact O-CG2 3.41Å; V704-V708 PolarHBondContact O-N 3.08Å; V704-F775 HydrophobicContact CG2-CD2 3.8Å; V704-F775 HydrophobicContact CG2-CE2 3.72Å; V704-A782 HydrophobicContact CG1-CB 4.31Å
705	P	89.1	Confident	85.6	Confident	29 Å²	29	16.8 Å²	16.8	19%	0.188	10%	0.097	C	C	.	.	H	α-helix	trans	-61.8	-35.4	177.5	-13.6	23.7	0	0	0	112.7	V682 M686 L701 L709	V682-P705 HydrophobicContact CG1-CB 4.31Å; V682-P705 HydrophobicContact CG1-CG 4.02Å; V682-P705 HydrophobicContact CG2-CB 4.46Å; M686-P705 HydrophobicContact CE-CG 4.4Å; L701-P705 WeakPolarHBondContact O-CD 3.11Å; L701-P705 WeakPolarHBondContact O-CG 3.08Å; P705-L709 WeakPolarHBondContact O-CB 3.26Å; P705-L709 PolarHBondContact O-N 2.94Å
706	F	84.2	Confident	85.8	Confident	17 Å²	17	14.5 Å²	14.5	8%	0.075	8%	0.082	C	C	.	.	H	α-helix	trans	-65.4	-46.6	176.5	-179.2	-94.9	0	0	0	112.5	Y642 I645 V703 V704 L709 A710 I1229 L1232	Y642-F706 HydrophobicContact CE1-CB 4.09Å; Y642-F706 HydrophobicContact CE1-CD2 4.11Å; Y642-F706 PolarHBondContact OH-N 3.47Å; Y642-F706 VanDerWaalsContact OH-N 3.16Å; I645-F706 HydrophobicContact CD1-CE2 4.35Å; V703-F706 WeakPolarHBondContact O-CB 3.34Å; V703-F706 PolarHBondContact O-N 2.82Å; V704-F706 VanDerWaalsContact C-N 3.26Å; V704-F706 PolarHBondContact O-N 2.92Å; F706-L709 PolarHBondContact O-N 3.41Å; F706-A710 PolarHBondContact O-N 2.94Å; F706-I1229 HydrophobicContact CE1-CG1 4.46Å; F706-I1229 HydrophobicContact CZ-CG1 3.84Å; F706-L1232 HydrophobicContact CE2-CD1 4.39Å; F706-L1232 HydrophobicContact CZ-CD1 4.25Å
707	L	84.8	Confident	85.8	Confident	9 Å²	9	14.7 Å²	14.7	5%	0.047	8%	0.082	C	C	.	.	H	α-helix	trans	-62.4	-47.2	177.5	-177.7	158.3	0	0	0	111.8	V703 V704 L709 A710 V711 F760 F775 V783 T1178	V703-L707 PolarHBondContact O-N 2.64Å; V704-L707 PolarHBondContact O-N 3.16Å; L707-L709 VanDerWaalsContact C-N 3.31Å; L707-L709 PolarHBondContact O-N 3.11Å; L707-A710 WeakPolarHBondContact O-CB 3.26Å; L707-A710 PolarHBondContact O-N 3.3Å; L707-V711 PolarHBondContact O-N 3.42Å; L707-F760 HydrophobicContact CD1-CE1 4.44Å; L707-F760 HydrophobicContact CD1-CZ 3.91Å; L707-F760 HydrophobicContact CD2-CE2 4.32Å; L707-F760 HydrophobicContact CD2-CZ 4.35Å; L707-F775 HydrophobicContact CD1-CE1 4.5Å; L707-F775 HydrophobicContact CD1-CZ 3.83Å; L707-V783 HydrophobicContact CD2-CG2 4.22Å; L707-T1178 HydrophobicContact CD1-CG2 3.51Å; L707-T1178 WeakPolarHBondContact CD1-OG1 3.44Å; L707-T1178 HydrophobicContact CG-CG2 4.09Å
708	V	90.3	Very high	85.8	Confident	0 Å²	0	14.7 Å²	14.7	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-70.1	-32.7	-177.5	-178.3	0	0	0	0	110.6	V678 V682 V704 G712 A782 V783 D786	V678-V708 HydrophobicContact CG1-CG1 4.06Å; V682-V708 HydrophobicContact CG2-CB 3.92Å; V682-V708 HydrophobicContact CG2-CG1 4.01Å; V682-V708 HydrophobicContact CG2-CG2 4.21Å; V704-V708 HydrophobicContact CG1-CG2 4.01Å; V704-V708 VanDerWaalsContact O-CG2 3.24Å; V704-V708 WeakPolarHBondContact O-CG2 3.41Å; V704-V708 PolarHBondContact O-N 3.08Å; V708-G712 WeakPolarHBondContact O-CA 3.29Å; V708-G712 PolarHBondContact O-N 3.43Å; V708-A782 HydrophobicContact CG1-CB 4.45Å; V708-A782 HydrophobicContact CG2-CB 3.58Å; V708-V783 HydrophobicContact CG2-CG2 4.37Å; V708-D786 HydrophobicContact CG1-CB 4.04Å
709	L	88.3	Confident	86.3	Confident	8 Å²	8	12.7 Å²	12.7	4%	0.042	7%	0.071	C	C	.	.	H	α-helix	trans	-65.4	-41	172.7	-177	66.8	0	0	0	112.4	Y642 I645 I675 V678 P705 F706 L707 A713	Y642-L709 HydrophobicContact CD1-CD2 3.48Å; Y642-L709 VanDerWaalsContact CD1-CD2 3.48Å; Y642-L709 HydrophobicContact CE1-CD2 4.01Å; Y642-L709 HydrophobicContact CG-CD2 4.47Å; I645-L709 HydrophobicContact CB-CD2 4.3Å; I645-L709 HydrophobicContact CD1-CD2 3.77Å; I645-L709 HydrophobicContact CG2-CD2 3.96Å; I645-L709 HydrophobicContact CG2-CG 4.29Å; I675-L709 HydrophobicContact CG1-CD1 4.16Å; V678-L709 HydrophobicContact CB-CD1 4.34Å; V678-L709 HydrophobicContact CG1-CB 3.99Å; V678-L709 HydrophobicContact CG1-CD1 3.96Å; V678-L709 HydrophobicContact CG2-CD1 4.42Å; P705-L709 WeakPolarHBondContact O-CB 3.26Å; P705-L709 PolarHBondContact O-N 2.94Å; F706-L709 PolarHBondContact O-N 3.41Å; L707-L709 VanDerWaalsContact C-N 3.31Å; L707-L709 PolarHBondContact O-N 3.11Å; L709-A713 WeakPolarHBondContact O-CB 3.37Å; L709-A713 PolarHBondContact O-N 3.24Å
710	A	83.9	Confident	86.7	Confident	8 Å²	8	10 Å²	10	7%	0.066	6%	0.055	C	C	.	.	H	α-helix	trans	-56.5	-57.7	175.3	0	0	0	0	0	111.2	F706 L707 D714 N1225	F706-A710 PolarHBondContact O-N 2.94Å; L707-A710 WeakPolarHBondContact O-CB 3.26Å; L707-A710 PolarHBondContact O-N 3.3Å; A710-D714 PolarHBondContact O-N 3.05Å; A710-N1225 WeakPolarHBondContact CB-OD1 3.19Å
711	V	86.3	Confident	86.7	Confident	5 Å²	5	11.3 Å²	11.3	3%	0.03	6%	0.062	C	C	.	.	H	α-helix	trans	-63.3	-46.1	-179.4	175.3	0	0	0	0	111.7	L707 D714 N715 E756	L707-V711 PolarHBondContact O-N 3.42Å; V711-D714 PolarHBondContact O-N 3.4Å; V711-N715 PolarHBondContact O-N 2.84Å; V711-E756 WeakPolarHBondContact CG1-OE2 3.46Å
712	G	88.1	Confident	86.7	Confident	0 Å²	0	10.8 Å²	10.8	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-70	-40	-173.9	0	0	0	0	0	113.3	V708 D714 N715 I716 D786 Q790	V708-G712 WeakPolarHBondContact O-CA 3.29Å; V708-G712 PolarHBondContact O-N 3.43Å; G712-D714 PolarHBondContact O-N 3.39Å; G712-N715 PolarHBondContact O-N 3.4Å; G712-I716 WeakPolarHBondContact O-CD1 3.41Å; G712-I716 WeakPolarHBondContact O-CG1 3.42Å; G712-I716 PolarHBondContact O-N 3.25Å; G712-I716 VanDerWaalsContact O-N 3.12Å; G712-D786 WeakPolarHBondContact CA-OD2 3.47Å; G712-Q790 PolarHBondContact O-NE2 3.06Å
713	A	87.1	Confident	87.1	Confident	5 Å²	5	10.2 Å²	10.2	4%	0.041	5%	0.054	C	C	.	.	H	α-helix	trans	-61.1	-36.3	175	0	0	0	0	0	111.8	I649 L709 I716 F717 T1224	I649-A713 HydrophobicContact CD1-CB 3.6Å; L709-A713 WeakPolarHBondContact O-CB 3.37Å; L709-A713 PolarHBondContact O-N 3.24Å; A713-I716 PolarHBondContact O-N 3.11Å; A713-F717 WeakPolarHBondContact O-CB 3.2Å; A713-F717 PolarHBondContact O-N 3.26Å; A713-T1224 HydrophobicContact CB-CG2 4.47Å
714	D	86.1	Confident	87.1	Confident	3 Å²	3	11.2 Å²	11.2	2%	0.016	6%	0.058	C	C	.	.	H	α-helix	trans	-66.3	-46.2	-179.4	-68	-16.4	0	0	0	111.8	A710 V711 G712 I716 F717 I718 V1221 T1224	A710-D714 PolarHBondContact O-N 3.05Å; V711-D714 PolarHBondContact O-N 3.4Å; G712-D714 PolarHBondContact O-N 3.39Å; D714-I716 VanDerWaalsContact C-N 3.34Å; D714-I716 PolarHBondContact O-N 3.37Å; D714-F717 PolarHBondContact O-N 3.24Å; D714-F717 VanDerWaalsContact O-N 3.16Å; D714-I718 WeakPolarHBondContact O-CG1 3.42Å; D714-I718 PolarHBondContact O-N 3.37Å; D714-V1221 HydrophobicContact CB-CG2 4.15Å; D714-V1221 VanDerWaalsContact CG-CA 3.48Å; D714-V1221 VanDerWaalsContact OD1-CA 3.28Å; D714-V1221 WeakPolarHBondContact OD1-CA 3.41Å; D714-V1221 PolarHBondContact OD1-N 3.25Å; D714-V1221 VanDerWaalsContact OD2-CA 3.29Å; D714-V1221 WeakPolarHBondContact OD2-CA 3.34Å; D714-V1221 WeakPolarHBondContact OD2-CG1 3.38Å; D714-V1221 WeakPolarHBondContact OD2-CG2 3.35Å; D714-T1224 PolarHBondContact OD1-OG1 2.74Å
715	N	88.8	Confident	86.8	Confident	2 Å²	2	13.8 Å²	13.8	1%	0.011	7%	0.068	C	C	.	.	H	α-helix	trans	-59.2	-46.8	174.6	-75.6	-36.1	0	0	0	111.3	V711 G712 F717 I718 F719 M749 S753	V711-N715 PolarHBondContact O-N 2.84Å; G712-N715 PolarHBondContact O-N 3.4Å; N715-F717 VanDerWaalsContact C-N 3.29Å; N715-F717 PolarHBondContact O-N 3.11Å; N715-I718 PolarHBondContact O-N 3.38Å; N715-F719 PolarHBondContact O-N 2.91Å; N715-M749 HydrophobicContact CB-CG 4.34Å; N715-M749 VanDerWaalsContact O-CE 3.24Å; N715-M749 WeakPolarHBondContact O-CE 3.35Å; N715-M749 WeakPolarHBondContact OD1-CG 3.34Å; N715-S753 PolarHBondContact ND2-OG 2.94Å
716	I	89.2	Confident	86.5	Confident	6 Å²	6	14.3 Å²	14.3	3%	0.031	7%	0.069	C	C	.	.	H	α-helix	trans	-57	-45.2	175.6	-72.9	160.7	0	0	0	111	V678 G712 A713 D714 F719 V720 Q790 F794	V678-I716 HydrophobicContact CG2-CD1 4.44Å; G712-I716 WeakPolarHBondContact O-CD1 3.41Å; G712-I716 WeakPolarHBondContact O-CG1 3.42Å; G712-I716 PolarHBondContact O-N 3.25Å; G712-I716 VanDerWaalsContact O-N 3.12Å; A713-I716 PolarHBondContact O-N 3.11Å; D714-I716 VanDerWaalsContact C-N 3.34Å; D714-I716 PolarHBondContact O-N 3.37Å; I716-F719 PolarHBondContact O-N 2.97Å; I716-V720 WeakPolarHBondContact O-CG2 3.33Å; I716-V720 PolarHBondContact O-N 3.1Å; I716-Q790 HydrophobicContact CG1-CG 4.3Å; I716-F794 HydrophobicContact CB-CE1 4.39Å; I716-F794 HydrophobicContact CB-CZ 4.21Å; I716-F794 HydrophobicContact CD1-CD2 4.43Å; I716-F794 HydrophobicContact CD1-CE2 4.47Å; I716-F794 HydrophobicContact CG1-CD1 4.28Å; I716-F794 HydrophobicContact CG1-CD2 4.21Å; I716-F794 HydrophobicContact CG1-CE1 4.21Å; I716-F794 HydrophobicContact CG1-CE2 4.14Å; I716-F794 HydrophobicContact CG1-CG 4.29Å; I716-F794 HydrophobicContact CG1-CZ 4.16Å; I716-F794 HydrophobicContact CG2-CE1 3.94Å; I716-F794 HydrophobicContact CG2-CE2 3.71Å; I716-F794 HydrophobicContact CG2-CZ 3.35Å
717	F	87.7	Confident	86.4	Confident	5 Å²	5	16.4 Å²	16.4	2%	0.022	9%	0.089	C	C	.	.	H	α-helix	trans	-64.9	-47.3	-177.7	-161.5	-86.4	0	0	0	112.2	A652 L653 A713 D714 N715 F719 V720 L721 A1219	A652-F717 HydrophobicContact CB-CE2 3.7Å; A652-F717 HydrophobicContact CB-CZ 4.14Å; L653-F717 HydrophobicContact CD2-CD2 3.43Å; L653-F717 VanDerWaalsContact CD2-CD2 3.43Å; L653-F717 HydrophobicContact CD2-CE2 3.58Å; L653-F717 HydrophobicContact CD2-CG 4.07Å; L653-F717 HydrophobicContact CD2-CZ 4.32Å; L653-F717 HydrophobicContact CG-CD2 3.92Å; L653-F717 HydrophobicContact CG-CE2 3.96Å; A713-F717 WeakPolarHBondContact O-CB 3.2Å; A713-F717 PolarHBondContact O-N 3.26Å; D714-F717 PolarHBondContact O-N 3.24Å; D714-F717 VanDerWaalsContact O-N 3.16Å; N715-F717 VanDerWaalsContact C-N 3.29Å; N715-F717 PolarHBondContact O-N 3.11Å; F717-F719 VanDerWaalsContact C-N 3.32Å; F717-F719 PolarHBondContact O-N 3.48Å; F717-V720 PolarHBondContact O-N 3.29Å; F717-L721 HydrophobicContact CE1-CD2 4.09Å; F717-L721 WeakPolarHBondContact O-CB 3.43Å; F717-L721 PolarHBondContact O-N 3.29Å; F717-A1219 HydrophobicContact CE1-CB 3.58Å; F717-A1219 HydrophobicContact CZ-CB 3.92Å
718	I	86.5	Confident	86.3	Confident	4 Å²	4	20.8 Å²	20.8	2%	0.021	11%	0.105	C	C	.	.	H	α-helix	trans	-61.6	-42	178.6	-64.8	172.4	0	0	0	110.3	D714 N715 E722 V745 M749 H1189	D714-I718 WeakPolarHBondContact O-CG1 3.42Å; D714-I718 PolarHBondContact O-N 3.37Å; N715-I718 PolarHBondContact O-N 3.38Å; I718-E722 WeakPolarHBondContact O-CB 3.42Å; I718-E722 PolarHBondContact O-N 3.21Å; I718-E722 VanDerWaalsContact O-N 3.12Å; I718-V745 HydrophobicContact CG2-CG1 3.64Å; I718-M749 HydrophobicContact CB-CE 4.35Å; I718-M749 HydrophobicContact CG2-CE 4.37Å; I718-H1189 WeakPolarHBondContact CD1-NE2 3.41Å
719	F	89.6	Confident	86	Confident	5 Å²	5	28.3 Å²	28.3	2%	0.022	13%	0.134	C	C	.	.	H	α-helix	trans	-63.1	-50.1	179.2	-175.2	-145.8	0	0	0	112.4	N715 I716 F717 E722 Y723 I738 V741 L742 M749 F794 V795 L798	N715-F719 PolarHBondContact O-N 2.91Å; I716-F719 PolarHBondContact O-N 2.97Å; F717-F719 VanDerWaalsContact C-N 3.32Å; F717-F719 PolarHBondContact O-N 3.48Å; F719-E722 PolarHBondContact O-N 3.18Å; F719-Y723 PolarHBondContact O-N 2.86Å; F719-Y723 VanDerWaalsContact O-N 3.07Å; F719-I738 HydrophobicContact CZ-CG2 4.22Å; F719-V741 HydrophobicContact CD2-CG1 4.29Å; F719-V741 HydrophobicContact CE2-CG1 4.08Å; F719-L742 HydrophobicContact CD2-CD1 4.21Å; F719-L742 HydrophobicContact CE1-CD1 4.28Å; F719-L742 HydrophobicContact CE2-CB 3.95Å; F719-L742 HydrophobicContact CE2-CD1 3.73Å; F719-L742 HydrophobicContact CE2-CG 4.47Å; F719-L742 HydrophobicContact CZ-CB 4.21Å; F719-L742 HydrophobicContact CZ-CD1 3.78Å; F719-M749 HydrophobicContact CB-CE 3.49Å; F719-M749 VanDerWaalsContact CB-CE 3.49Å; F719-M749 HydrophobicContact CG-CE 4.34Å; F719-F794 AromaticContact CD1-CD1 3.99Å; F719-F794 HydrophobicContact CD1-CD1 3.99Å; F719-F794 AromaticContact CD1-CE1 3.83Å; F719-F794 HydrophobicContact CD1-CE1 3.83Å; F719-F794 HydrophobicContact CE1-CD1 4.39Å; F719-F794 HydrophobicContact CE1-CE1 4.44Å; F719-V795 HydrophobicContact CE1-CG2 3.93Å; F719-V795 HydrophobicContact CZ-CG2 4.29Å; F719-L798 HydrophobicContact CD1-CD2 4.01Å; F719-L798 HydrophobicContact CE1-CD2 3.45Å; F719-L798 VanDerWaalsContact CE1-CD2 3.45Å; F719-L798 HydrophobicContact CZ-CD2 3.82Å
720	V	88.8	Confident	85.4	Confident	1 Å²	1	37 Å²	37	1%	0.006	18%	0.179	C	C	.	.	H	α-helix	trans	-67.4	-40.8	-176.7	175.9	0	0	0	0	110.8	L653 V670 I716 F717 E722 Y723 Q724 F794 L798	L653-V720 HydrophobicContact CD2-CB 3.91Å; L653-V720 HydrophobicContact CD2-CG1 3.84Å; V670-V720 HydrophobicContact CG1-CG2 4.23Å; I716-V720 WeakPolarHBondContact O-CG2 3.33Å; I716-V720 PolarHBondContact O-N 3.1Å; F717-V720 PolarHBondContact O-N 3.29Å; V720-E722 PolarHBondContact O-N 2.98Å; V720-Y723 WeakPolarHBondContact O-CB 3.48Å; V720-Y723 PolarHBondContact O-N 3.04Å; V720-Q724 HydrophobicContact CG1-CG 4.48Å; V720-Q724 WeakPolarHBondContact O-CG 3.49Å; V720-Q724 PolarHBondContact O-N 2.93Å; V720-F794 HydrophobicContact CG2-CE1 3.88Å; V720-F794 HydrophobicContact CG2-CZ 3.72Å; V720-L798 HydrophobicContact CG2-CD1 4.28Å
721	L	85.3	Confident	85.2	Confident	27 Å²	27	40.5 Å²	40.5	14%	0.141	22%	0.216	C	C	.	.	H	α-helix	trans	-64.5	-40.7	179.6	-171.6	70	0	0	0	111.9	F717 Y723 Q724 R725 A1216	F717-L721 HydrophobicContact CE1-CD2 4.09Å; F717-L721 WeakPolarHBondContact O-CB 3.43Å; F717-L721 PolarHBondContact O-N 3.29Å; L721-Y723 VanDerWaalsContact C-N 3.35Å; L721-Q724 PolarHBondContact O-N 3.35Å; L721-R725 VanDerWaalsContact O-CG 3.26Å; L721-R725 WeakPolarHBondContact O-CG 3.29Å; L721-R725 PolarHBondContact O-N 2.91Å; L721-A1216 HydrophobicContact CD2-CB 3.7Å
722	E	85.3	Confident	85.2	Confident	56 Å²	56	41.8 Å²	41.8	26%	0.262	22%	0.222	S	C	.	.	H	α-helix	trans	-69.4	-35.5	177.1	-159.3	65.1	-171.3	0	0	111.7	I718 F719 V720 Q724 R725 D726 V741 V745	I718-E722 WeakPolarHBondContact O-CB 3.42Å; I718-E722 PolarHBondContact O-N 3.21Å; I718-E722 VanDerWaalsContact O-N 3.12Å; F719-E722 PolarHBondContact O-N 3.18Å; V720-E722 PolarHBondContact O-N 2.98Å; E722-Q724 VanDerWaalsContact C-N 3.33Å; E722-Q724 PolarHBondContact O-N 3.48Å; E722-R725 PolarHBondContact O-N 3.26Å; E722-R725 IonicContact OE2-NH1 3.16Å; E722-D726 WeakPolarHBondContact O-CB 3.41Å; E722-D726 PolarHBondContact O-N 3.07Å; E722-V741 HydrophobicContact CB-CG1 4.28Å; E722-V741 HydrophobicContact CG-CG1 4.42Å; E722-V745 HydrophobicContact CB-CG2 3.84Å; E722-V745 HydrophobicContact CG-CG2 3.73Å
723	Y	87.4	Confident	85.2	Confident	13 Å²	13	45 Å²	45	5%	0.051	24%	0.241	C	C	.	.	H	α-helix	trans	-62.2	-38.3	171.5	174.3	-102.2	0	0	0	112.7	F719 V720 L721 Q737 I738 V741 A802	F719-Y723 PolarHBondContact O-N 2.86Å; F719-Y723 VanDerWaalsContact O-N 3.07Å; V720-Y723 WeakPolarHBondContact O-CB 3.48Å; V720-Y723 PolarHBondContact O-N 3.04Å; L721-Y723 VanDerWaalsContact C-N 3.35Å; Y723-Q737 HydrophobicContact CE2-CG 4.26Å; Y723-I738 HydrophobicContact CD2-CG1 4.26Å; Y723-I738 HydrophobicContact CE2-CG1 3.77Å; Y723-V741 HydrophobicContact CD2-CG2 4.36Å; Y723-A802 WeakPolarHBondContact OH-CB 3.42Å
724	Q	83.8	Confident	85.2	Confident	30 Å²	30	47.9 Å²	47.9	14%	0.14	25%	0.251	C	S	.	.	H	α-helix	trans	-70.5	-32.6	176.4	-72.6	177.1	-11.6	0	0	113	L653 V720 L721 E722	L653-Q724 PolarHBondContact O-NE2 3.34Å; V720-Q724 HydrophobicContact CG1-CG 4.48Å; V720-Q724 WeakPolarHBondContact O-CG 3.49Å; V720-Q724 PolarHBondContact O-N 2.93Å; L721-Q724 PolarHBondContact O-N 3.35Å; E722-Q724 VanDerWaalsContact C-N 3.33Å; E722-Q724 PolarHBondContact O-N 3.48Å
725	R	81.8	Confident	85.4	Confident	57 Å²	57	49.5 Å²	49.5	22%	0.215	26%	0.259	C	S	.	.	H	α-helix	trans	-76.3	-29.9	178.2	-72	167.3	175.8	-171.5	-4.6	112.8	L721 E722 T1212 S1215	L721-R725 VanDerWaalsContact O-CG 3.26Å; L721-R725 WeakPolarHBondContact O-CG 3.29Å; L721-R725 PolarHBondContact O-N 2.91Å; E722-R725 PolarHBondContact O-N 3.26Å; E722-R725 IonicContact OE2-NH1 3.16Å; R725-T1212 PolarHBondContact NH1-O 3.37Å; R725-S1215 PolarHBondContact NH2-OG 3Å
726	D	83.9	Confident	85.4	Confident	39 Å²	39	53.7 Å²	53.7	21%	0.209	28%	0.278	C	S	.	.	S	Bend	trans	-75.3	138.8	179.7	-171.7	74.8	0	0	0	112.2	E722 R740 V741	E722-D726 WeakPolarHBondContact O-CB 3.41Å; E722-D726 PolarHBondContact O-N 3.07Å; D726-R740 VanDerWaalsContact CG-NH1 3.27Å; D726-R740 IonicContact OD1-CZ 3.51Å; D726-R740 IonicContact OD1-NH1 3.6Å; D726-R740 PolarHBondContact OD1-NH1 3.31Å; D726-R740 IonicContact OD1-NH2 3.66Å; D726-R740 IonicContact OD2-CZ 3.58Å; D726-R740 VanDerWaalsContact OD2-CZ 3.3Å; D726-R740 IonicContact OD2-NH1 2.85Å; D726-R740 PolarHBondContact OD2-NH1 2.9Å; D726-R740 VanDerWaalsContact OD2-NH1 3.08Å; D726-R740 IonicContact OD2-NH2 2.78Å; D726-R740 PolarHBondContact OD2-NH2 3.39Å; D726-V741 HydrophobicContact CB-CG2 3.87Å
727	A	81.1	Confident	85.4	Confident	61 Å²	61	53.9 Å²	53.9	50%	0.504	28%	0.279	S	S	.	.	P	Polyproline II helix	trans	-101.4	133.6	174.8	0	0	0	0	0	110.7	R729	A727-R729 PolarHBondContact O-N 3.32Å
728	R	82.8	Confident	85.6	Confident	102 Å²	102	53.6 Å²	53.6	39%	0.385	28%	0.278	S	S	.	.	P	Polyproline II helix	trans	-61.8	130.8	177.3	-165.5	-179.4	-67.5	171.7	0.2	110.5	E732 D806	R728-E732 WeakPolarHBondContact CD-O 3.22Å; R728-E732 HydrophobicContact CG-CB 4.3Å; R728-D806 IonicContact CZ-OD2 3.08Å; R728-D806 IonicContact NH1-OD2 2.66Å; R728-D806 IonicContact NH2-OD1 3.56Å; R728-D806 IonicContact NH2-OD2 3.8Å; R728-D806 PolarHBondContact NH2-OD2 2.94Å
729	R	84.4	Confident	85.8	Confident	158 Å²	158	53.4 Å²	53.4	60%	0.596	28%	0.277	S	S	*	.	P	Polyproline II helix	trans	-74.8	154.6	177.6	-63.3	175.8	-179.8	180	-0.5	111	A727 G731 E732	A727-R729 PolarHBondContact O-N 3.32Å; R729-G731 PolarHBondContact O-N 2.86Å; R729-G731 VanDerWaalsContact O-N 3.14Å; R729-E732 HydrophobicContact CB-CB 4.1Å; R729-E732 PolarHBondContact N-OE2 3.06Å; R729-E732 VanDerWaalsContact N-OE2 3.08Å; R729-E732 WeakPolarHBondContact O-CB 3.17Å; R729-E732 PolarHBondContact O-N 2.9Å; R729-E732 VanDerWaalsContact O-N 3.16Å
730	L	76.7	Confident	85.8	Confident	190 Å²	190	54.1 Å²	54.1	100%	0.995	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	115	175.2	-84.1	145.7	0	0	0	110.2
731	G	79.7	Confident	85.9	Confident	82 Å²	82	54 Å²	54	85%	0.845	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.2	-0.4	179.6	0	0	0	0	0	116.2	R729	R729-G731 PolarHBondContact O-N 2.86Å; R729-G731 VanDerWaalsContact O-N 3.14Å
732	E	86.3	Confident	86.2	Confident	32 Å²	32	52.8 Å²	52.8	15%	0.15	27%	0.272	C	S	.	.			trans	-83	134	179.6	-172	174.3	-138.8	0	0	111.5	R728 R729 E736 Q737 R740	R728-E732 WeakPolarHBondContact CD-O 3.22Å; R728-E732 HydrophobicContact CG-CB 4.3Å; R729-E732 HydrophobicContact CB-CB 4.1Å; R729-E732 PolarHBondContact N-OE2 3.06Å; R729-E732 VanDerWaalsContact N-OE2 3.08Å; R729-E732 WeakPolarHBondContact O-CB 3.17Å; R729-E732 PolarHBondContact O-N 2.9Å; R729-E732 VanDerWaalsContact O-N 3.16Å; E732-E736 HydrophobicContact CG-CB 3.87Å; E732-Q737 HydrophobicContact CG-CB 4.48Å; E732-R740 IonicContact OE1-CZ 3.48Å; E732-R740 IonicContact OE1-NE 2.73Å; E732-R740 PolarHBondContact OE1-NE 2.89Å; E732-R740 IonicContact OE1-NH2 2.7Å; E732-R740 IonicContact OE2-CZ 4Å; E732-R740 IonicContact OE2-NE 3.85Å; E732-R740 IonicContact OE2-NH2 3.72Å; E732-R740 PolarHBondContact OE2-NH2 3.47Å
733	T	88	Confident	86.4	Confident	66 Å²	66	50.1 Å²	50.1	41%	0.405	26%	0.26	S	S	.	.			trans	-75.3	161.3	174.5	60.3	0	0	0	0	111.7	E735 E736 Q737	T733-E735 VanDerWaalsContact C-N 3.28Å; T733-E735 PolarHBondContact O-N 3.08Å; T733-E736 PolarHBondContact N-OE2 2.88Å; T733-E736 PolarHBondContact O-N 3.35Å; T733-E736 WeakPolarHBondContact OG1-CB 3.48Å; T733-E736 WeakPolarHBondContact OG1-CG 3.46Å; T733-E736 PolarHBondContact OG1-N 2.74Å; T733-E736 PolarHBondContact OG1-OE2 3.09Å; T733-Q737 PolarHBondContact O-N 3.37Å
734	R	87	Confident	86.3	Confident	67 Å²	67	53.2 Å²	53.2	25%	0.253	28%	0.275	S	S	.	.	H	α-helix	trans	-63.4	-36.6	179.3	66.5	176.3	-176.7	-134	-15.3	111.6	Q737 I738 R803	R734-Q737 PolarHBondContact O-N 3.15Å; R734-I738 WeakPolarHBondContact O-CG1 3.46Å; R734-I738 PolarHBondContact O-N 3.17Å; R734-R803 VanDerWaalsContact NH1-CG 3.3Å
735	E	88.8	Confident	86.6	Confident	37 Å²	37	52.3 Å²	52.3	17%	0.173	27%	0.271	C	S	.	.	H	α-helix	trans	-67.2	-43.3	179.7	-64.1	79.3	-172.7	0	0	110.2	A351 T733 I738 G739	A351-E735 HydrophobicContact CB-CB 4.11Å; A351-E735 HydrophobicContact CB-CG 4.04Å; T733-E735 VanDerWaalsContact C-N 3.28Å; T733-E735 PolarHBondContact O-N 3.08Å; E735-I738 PolarHBondContact O-N 2.89Å; E735-G739 PolarHBondContact O-N 3Å
736	E	88.9	Confident	86.9	Confident	90 Å²	90	49.6 Å²	49.6	42%	0.421	26%	0.261	S	S	.	.	H	α-helix	trans	-63.9	-38.7	174.5	-73.2	167.3	155.1	0	0	112.7	T348 E732 T733 G739 R740	T348-E736 HydrophobicContact CG2-CG 4.4Å; E732-E736 HydrophobicContact CG-CB 3.87Å; T733-E736 PolarHBondContact N-OE2 2.88Å; T733-E736 PolarHBondContact O-N 3.35Å; T733-E736 WeakPolarHBondContact OG1-CB 3.48Å; T733-E736 WeakPolarHBondContact OG1-CG 3.46Å; T733-E736 PolarHBondContact OG1-N 2.74Å; T733-E736 PolarHBondContact OG1-OE2 3.09Å; E736-G739 PolarHBondContact O-N 3.5Å; E736-R740 WeakPolarHBondContact O-CB 3.47Å; E736-R740 PolarHBondContact O-N 3.21Å
737	Q	90.2	Very high	87.2	Confident	9 Å²	9	48 Å²	48	4%	0.042	25%	0.253	C	S	.	.	H	α-helix	trans	-61.4	-50.9	173.8	-174.9	-174.2	1.6	0	0	111	Y723 E732 T733 R734 G739 R740 V741	Y723-Q737 HydrophobicContact CE2-CG 4.26Å; E732-Q737 HydrophobicContact CG-CB 4.48Å; T733-Q737 PolarHBondContact O-N 3.37Å; R734-Q737 PolarHBondContact O-N 3.15Å; Q737-G739 VanDerWaalsContact C-N 3.32Å; Q737-G739 PolarHBondContact O-N 3.18Å; Q737-R740 PolarHBondContact O-N 3.38Å; Q737-V741 WeakPolarHBondContact O-CG2 3.28Å; Q737-V741 PolarHBondContact O-N 3.4Å
738	I	90.8	Very high	87.4	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-60	-44.5	178.2	-69.5	167.5	0	0	0	110.3	A351 F719 Y723 R734 E735 R740 V741 L742 V795 A802	A351-I738 HydrophobicContact CB-CG2 4.42Å; F719-I738 HydrophobicContact CZ-CG2 4.22Å; Y723-I738 HydrophobicContact CD2-CG1 4.26Å; Y723-I738 HydrophobicContact CE2-CG1 3.77Å; R734-I738 WeakPolarHBondContact O-CG1 3.46Å; R734-I738 PolarHBondContact O-N 3.17Å; E735-I738 PolarHBondContact O-N 2.89Å; I738-R740 PolarHBondContact O-N 3.01Å; I738-V741 PolarHBondContact O-N 3.05Å; I738-L742 VanDerWaalsContact O-CB 3.29Å; I738-L742 WeakPolarHBondContact O-CB 3.32Å; I738-L742 PolarHBondContact O-N 3.34Å; I738-V795 HydrophobicContact CG2-CG1 3.95Å; I738-A802 HydrophobicContact CD1-CB 4.42Å
739	G	90.9	Very high	87.7	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-59.9	-44.1	175.8	0	0	0	0	0	112.3	Q344 E735 E736 Q737 L742 G743	Q344-G739 VanDerWaalsContact CA-O 3.3Å; Q344-G739 WeakPolarHBondContact CA-O 3.28Å; E735-G739 PolarHBondContact O-N 3Å; E736-G739 PolarHBondContact O-N 3.5Å; Q737-G739 VanDerWaalsContact C-N 3.32Å; Q737-G739 PolarHBondContact O-N 3.18Å; G739-L742 PolarHBondContact O-N 2.9Å; G739-G743 PolarHBondContact O-N 3.45Å
740	R	90.9	Very high	88	Confident	19 Å²	19	34.8 Å²	34.8	7%	0.072	19%	0.194	C	C	.	.	H	α-helix	trans	-64.4	-44.8	179.2	-179.9	170.6	56.5	74.1	-1.3	112.1	D726 E732 E736 Q737 I738 G743 Q744	D726-R740 VanDerWaalsContact CG-NH1 3.27Å; D726-R740 IonicContact OD1-CZ 3.51Å; D726-R740 IonicContact OD1-NH1 3.6Å; D726-R740 PolarHBondContact OD1-NH1 3.31Å; D726-R740 IonicContact OD1-NH2 3.66Å; D726-R740 IonicContact OD2-CZ 3.58Å; D726-R740 VanDerWaalsContact OD2-CZ 3.3Å; D726-R740 IonicContact OD2-NH1 2.85Å; D726-R740 PolarHBondContact OD2-NH1 2.9Å; D726-R740 VanDerWaalsContact OD2-NH1 3.08Å; D726-R740 IonicContact OD2-NH2 2.78Å; D726-R740 PolarHBondContact OD2-NH2 3.39Å; E732-R740 IonicContact OE1-CZ 3.48Å; E732-R740 IonicContact OE1-NE 2.73Å; E732-R740 PolarHBondContact OE1-NE 2.89Å; E732-R740 IonicContact OE1-NH2 2.7Å; E732-R740 IonicContact OE2-CZ 4Å; E732-R740 IonicContact OE2-NE 3.85Å; E732-R740 IonicContact OE2-NH2 3.72Å; E732-R740 PolarHBondContact OE2-NH2 3.47Å; E736-R740 WeakPolarHBondContact O-CB 3.47Å; E736-R740 PolarHBondContact O-N 3.21Å; Q737-R740 PolarHBondContact O-N 3.38Å; I738-R740 PolarHBondContact O-N 3.01Å; R740-G743 PolarHBondContact O-N 3.28Å; R740-Q744 PolarHBondContact O-N 3.07Å
741	V	90.9	Very high	88.5	Confident	0 Å²	0	25.9 Å²	25.9	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-63.3	-45.8	176.4	175.6	0	0	0	0	110.1	F719 E722 Y723 D726 Q737 I738 G743 Q744 V745	F719-V741 HydrophobicContact CD2-CG1 4.29Å; F719-V741 HydrophobicContact CE2-CG1 4.08Å; E722-V741 HydrophobicContact CB-CG1 4.28Å; E722-V741 HydrophobicContact CG-CG1 4.42Å; Y723-V741 HydrophobicContact CD2-CG2 4.36Å; D726-V741 HydrophobicContact CB-CG2 3.87Å; Q737-V741 WeakPolarHBondContact O-CG2 3.28Å; Q737-V741 PolarHBondContact O-N 3.4Å; I738-V741 PolarHBondContact O-N 3.05Å; V741-G743 VanDerWaalsContact C-N 3.29Å; V741-G743 PolarHBondContact O-N 3.44Å; V741-Q744 PolarHBondContact O-N 3.08Å; V741-V745 HydrophobicContact CG1-CG2 4.48Å; V741-V745 PolarHBondContact O-N 3.15Å
742	L	91.4	Very high	88.9	Confident	0 Å²	0	22 Å²	22	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-58.8	-41.6	176	-170.2	69.6	0	0	0	111.3	G347 F719 I738 G739 Q744 V745 A746 M791 V795	G347-L742 VanDerWaalsContact CA-CD2 3.47Å; F719-L742 HydrophobicContact CD2-CD1 4.21Å; F719-L742 HydrophobicContact CE1-CD1 4.28Å; F719-L742 HydrophobicContact CE2-CB 3.95Å; F719-L742 HydrophobicContact CE2-CD1 3.73Å; F719-L742 HydrophobicContact CE2-CG 4.47Å; F719-L742 HydrophobicContact CZ-CB 4.21Å; F719-L742 HydrophobicContact CZ-CD1 3.78Å; I738-L742 VanDerWaalsContact O-CB 3.29Å; I738-L742 WeakPolarHBondContact O-CB 3.32Å; I738-L742 PolarHBondContact O-N 3.34Å; G739-L742 PolarHBondContact O-N 2.9Å; L742-Q744 PolarHBondContact O-N 3.08Å; L742-V745 PolarHBondContact O-N 3.28Å; L742-A746 HydrophobicContact CD1-CB 4.09Å; L742-A746 HydrophobicContact CG-CB 4.09Å; L742-A746 WeakPolarHBondContact O-CB 3.5Å; L742-A746 PolarHBondContact O-N 2.99Å; L742-M791 HydrophobicContact CD1-CE 4.4Å; L742-M791 HydrophobicContact CD1-SD 4.02Å; L742-V795 HydrophobicContact CD1-CG2 4.14Å; L742-V795 HydrophobicContact CD2-CG2 4.04Å
743	G	89	Confident	89.1	Confident	1 Å²	1	20.5 Å²	20.5	1%	0.01	10%	0.1	C	C	.	.	H	α-helix	trans	-61.4	-23	175.9	0	0	0	0	0	114.7	S340 G739 R740 V741	S340-G743 WeakPolarHBondContact CA-O 3.35Å; S340-G743 VanDerWaalsContact CB-O 3.28Å; S340-G743 WeakPolarHBondContact CB-O 3.48Å; S340-G743 PolarHBondContact OG-O 2.72Å; G739-G743 PolarHBondContact O-N 3.45Å; R740-G743 PolarHBondContact O-N 3.28Å; V741-G743 VanDerWaalsContact C-N 3.29Å; V741-G743 PolarHBondContact O-N 3.44Å
744	Q	86.1	Confident	89.2	Confident	78 Å²	78	20.5 Å²	20.5	36%	0.364	10%	0.097	S	C	.	.	H	α-helix	trans	-85.8	-38.6	177.1	-69.8	177.2	-8.9	0	0	112.4	R740 V741 L742 R1192	R740-Q744 PolarHBondContact O-N 3.07Å; V741-Q744 PolarHBondContact O-N 3.08Å; L742-Q744 PolarHBondContact O-N 3.08Å; Q744-R1192 PolarHBondContact O-NH1 3.38Å; Q744-R1192 PolarHBondContact O-NH2 2.87Å
745	V	88.4	Confident	89.2	Confident	10 Å²	10	17.3 Å²	17.3	6%	0.061	9%	0.085	C	C	.	.	H	α-helix	trans	-97.8	-36.1	-170.9	-167.4	0	0	0	0	113.2	I718 E722 V741 L742 P747 S748 M749	I718-V745 HydrophobicContact CG2-CG1 3.64Å; E722-V745 HydrophobicContact CB-CG2 3.84Å; E722-V745 HydrophobicContact CG-CG2 3.73Å; V741-V745 HydrophobicContact CG1-CG2 4.48Å; V741-V745 PolarHBondContact O-N 3.15Å; L742-V745 PolarHBondContact O-N 3.28Å; V745-P747 VanDerWaalsContact C-CD 3.41Å; V745-P747 VanDerWaalsContact C-N 3.34Å; V745-S748 WeakPolarHBondContact O-CB 3.41Å; V745-S748 PolarHBondContact O-N 2.82Å; V745-M749 HydrophobicContact CB-CE 4.11Å; V745-M749 HydrophobicContact CG1-CE 3.23Å; V745-M749 HydrophobicContact CG1-CG 4.44Å; V745-M749 HydrophobicContact CG1-SD 4Å; V745-M749 PolarHBondContact O-N 3.1Å
746	A	89.8	Confident	89.2	Confident	0 Å²	0	15.6 Å²	15.6	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-55.6	-34.8	-176.3	0	0	0	0	0	115.2	F343 L742 S748 M749 L750 M791	F343-A746 HydrophobicContact CB-CB 4.05Å; F343-A746 HydrophobicContact CD1-CB 3.7Å; F343-A746 HydrophobicContact CD2-CB 3.93Å; F343-A746 HydrophobicContact CE1-CB 4.09Å; F343-A746 HydrophobicContact CE2-CB 4.29Å; F343-A746 HydrophobicContact CG-CB 3.63Å; F343-A746 HydrophobicContact CZ-CB 4.36Å; L742-A746 HydrophobicContact CD1-CB 4.09Å; L742-A746 HydrophobicContact CG-CB 4.09Å; L742-A746 WeakPolarHBondContact O-CB 3.5Å; L742-A746 PolarHBondContact O-N 2.99Å; A746-S748 PolarHBondContact O-N 3.29Å; A746-M749 PolarHBondContact O-N 3.21Å; A746-L750 WeakPolarHBondContact O-CB 3.41Å; A746-L750 PolarHBondContact O-N 3.06Å; A746-M791 HydrophobicContact CB-SD 4.1Å
747	P	88.6	Confident	89.3	Confident	7 Å²	7	11.5 Å²	11.5	5%	0.045	6%	0.058	C	C	.	.	H	α-helix	trans	-62.1	-30.9	174.2	-24.7	34.9	0	0	0	113.7	M339 F343 V745 L751	M339-P747 HydrophobicContact CB-CG 4.31Å; F343-P747 HydrophobicContact CD2-CG 4.1Å; F343-P747 HydrophobicContact CE2-CG 4.42Å; V745-P747 VanDerWaalsContact C-CD 3.41Å; V745-P747 VanDerWaalsContact C-N 3.34Å; P747-L751 WeakPolarHBondContact O-CB 3.4Å; P747-L751 PolarHBondContact O-N 2.87Å
748	S	86.6	Confident	89.3	Confident	3 Å²	3	13.4 Å²	13.4	2%	0.021	7%	0.07	C	C	.	.	H	α-helix	trans	-70.8	-46.7	173.2	-58.7	0	0	0	0	111.4	V745 A746 L750 L751 C752 H1189 R1192	V745-S748 WeakPolarHBondContact O-CB 3.41Å; V745-S748 PolarHBondContact O-N 2.82Å; A746-S748 PolarHBondContact O-N 3.29Å; S748-L750 VanDerWaalsContact C-N 3.32Å; S748-L750 PolarHBondContact O-N 3.11Å; S748-L751 WeakPolarHBondContact O-CB 3.46Å; S748-L751 PolarHBondContact O-N 3.16Å; S748-L751 VanDerWaalsContact O-N 3.09Å; S748-C752 PolarHBondContact O-N 3.14Å; S748-C752 PolarHBondContact O-SG 3.18Å; S748-H1189 WeakPolarHBondContact CB-CE1 3.42Å; S748-H1189 WeakPolarHBondContact CB-ND1 3.42Å; S748-R1192 VanDerWaalsContact OG-CD 3.32Å; S748-R1192 WeakPolarHBondContact OG-CD 3.01Å; S748-R1192 PolarHBondContact OG-NH1 3.05Å
749	M	89.3	Confident	89.1	Confident	1 Å²	1	13.4 Å²	13.4	1%	0.005	7%	0.071	C	C	.	.	H	α-helix	trans	-60.7	-43.4	179.7	-64.7	155.4	173.5	0	0	111.1	N715 I718 F719 V745 A746 L751 C752 S753 F787 M791	N715-M749 HydrophobicContact CB-CG 4.34Å; N715-M749 VanDerWaalsContact O-CE 3.24Å; N715-M749 WeakPolarHBondContact O-CE 3.35Å; N715-M749 WeakPolarHBondContact OD1-CG 3.34Å; I718-M749 HydrophobicContact CB-CE 4.35Å; I718-M749 HydrophobicContact CG2-CE 4.37Å; F719-M749 HydrophobicContact CB-CE 3.49Å; F719-M749 VanDerWaalsContact CB-CE 3.49Å; F719-M749 HydrophobicContact CG-CE 4.34Å; V745-M749 HydrophobicContact CB-CE 4.11Å; V745-M749 HydrophobicContact CG1-CE 3.23Å; V745-M749 HydrophobicContact CG1-CG 4.44Å; V745-M749 HydrophobicContact CG1-SD 4Å; V745-M749 PolarHBondContact O-N 3.1Å; A746-M749 PolarHBondContact O-N 3.21Å; M749-L751 VanDerWaalsContact C-N 3.29Å; M749-L751 PolarHBondContact O-N 3.49Å; M749-C752 PolarHBondContact O-N 2.66Å; M749-S753 WeakPolarHBondContact O-CB 3.38Å; M749-S753 PolarHBondContact O-N 2.85Å; M749-S753 PolarHBondContact O-OG 2.82Å; M749-F787 HydrophobicContact CB-CE2 4.13Å; M749-M791 HydrophobicContact CB-CE 4.47Å; M749-M791 HydrophobicContact SD-CE 3.76Å
750	L	90.6	Very high	89	Confident	39 Å²	39	13.6 Å²	13.6	20%	0.204	7%	0.071	C	C	.	.	H	α-helix	trans	-59	-42.4	174.4	179.2	70.3	0	0	0	111.2	F343 A746 S748 L754 F787	F343-L750 HydrophobicContact CE2-CD2 4.25Å; F343-L750 HydrophobicContact CZ-CB 4.39Å; F343-L750 HydrophobicContact CZ-CD2 4.02Å; A746-L750 WeakPolarHBondContact O-CB 3.41Å; A746-L750 PolarHBondContact O-N 3.06Å; S748-L750 VanDerWaalsContact C-N 3.32Å; S748-L750 PolarHBondContact O-N 3.11Å; L750-L754 WeakPolarHBondContact O-CB 3.37Å; L750-L754 PolarHBondContact O-N 2.73Å; L750-F787 HydrophobicContact CB-CE2 4.08Å; L750-F787 HydrophobicContact CB-CZ 3.83Å; L750-F787 HydrophobicContact CD1-CD1 4.47Å; L750-F787 HydrophobicContact CD1-CE1 3.6Å; L750-F787 HydrophobicContact CD1-CE2 4.36Å; L750-F787 HydrophobicContact CD1-CZ 3.53Å; L750-F787 HydrophobicContact CG-CZ 4.29Å
751	L	86.9	Confident	88.9	Confident	2 Å²	2	16.1 Å²	16.1	1%	0.01	8%	0.083	C	C	.	.	H	α-helix	trans	-60.8	-49.1	179.3	-178.7	163.6	0	0	0	110.7	P747 S748 M749 S755 V1131 L1135 L1136 V1184	P747-L751 WeakPolarHBondContact O-CB 3.4Å; P747-L751 PolarHBondContact O-N 2.87Å; S748-L751 WeakPolarHBondContact O-CB 3.46Å; S748-L751 PolarHBondContact O-N 3.16Å; S748-L751 VanDerWaalsContact O-N 3.09Å; M749-L751 VanDerWaalsContact C-N 3.29Å; M749-L751 PolarHBondContact O-N 3.49Å; L751-S755 WeakPolarHBondContact O-CB 3.39Å; L751-S755 PolarHBondContact O-N 3.12Å; L751-S755 PolarHBondContact O-OG 3.12Å; L751-S755 VanDerWaalsContact O-OG 3.06Å; L751-V1131 HydrophobicContact CG-CG1 4.4Å; L751-L1135 HydrophobicContact CB-CD1 3.6Å; L751-L1135 HydrophobicContact CD1-CB 4.02Å; L751-L1135 HydrophobicContact CD1-CD1 4.44Å; L751-L1135 HydrophobicContact CG-CB 4.43Å; L751-L1135 HydrophobicContact CG-CD1 3.96Å; L751-L1136 HydrophobicContact CD1-CG 4.31Å; L751-V1184 HydrophobicContact CD2-CG1 4.2Å
752	C	87.7	Confident	88.6	Confident	0 Å²	0	18.9 Å²	18.9	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-61.8	-60.7	178.3	-59.7	0	0	0	0	111.1	S748 M749 L754 S755 E756 E1185 S1188 H1189	S748-C752 PolarHBondContact O-N 3.14Å; S748-C752 PolarHBondContact O-SG 3.18Å; M749-C752 PolarHBondContact O-N 2.66Å; C752-L754 VanDerWaalsContact C-N 3.32Å; C752-L754 PolarHBondContact O-N 2.94Å; C752-S755 PolarHBondContact O-N 3.33Å; C752-S755 PolarHBondContact O-OG 3.23Å; C752-E756 WeakPolarHBondContact O-CG 3.27Å; C752-E756 PolarHBondContact O-N 3.04Å; C752-E1185 WeakPolarHBondContact CB-OE1 3.42Å; C752-E1185 VanDerWaalsContact SG-CD 3.58Å; C752-E1185 PolarHBondContact SG-OE2 2.99Å; C752-S1188 PolarHBondContact SG-OG 3.24Å; C752-H1189 PolarHBondContact SG-NE2 2.53Å
753	S	90.6	Very high	88	Confident	2 Å²	2	19 Å²	19	1%	0.014	10%	0.098	C	C	.	.	H	α-helix	trans	-60.8	-37.2	-174.7	-55.3	0	0	0	0	113.2	N715 M749 S757	N715-S753 PolarHBondContact ND2-OG 2.94Å; M749-S753 WeakPolarHBondContact O-CB 3.38Å; M749-S753 PolarHBondContact O-N 2.85Å; M749-S753 PolarHBondContact O-OG 2.82Å; S753-S757 WeakPolarHBondContact O-CB 3.1Å; S753-S757 PolarHBondContact O-N 3.43Å
754	L	89.8	Confident	87.3	Confident	65 Å²	65	19 Å²	19	34%	0.34	10%	0.098	S	C	.	.	H	α-helix	trans	-69.5	-42.6	176.1	-175.5	65.3	0	0	0	111.3	L750 C752 E756 V758 V1131	L750-L754 WeakPolarHBondContact O-CB 3.37Å; L750-L754 PolarHBondContact O-N 2.73Å; C752-L754 VanDerWaalsContact C-N 3.32Å; C752-L754 PolarHBondContact O-N 2.94Å; L754-E756 VanDerWaalsContact C-N 3.35Å; L754-V758 HydrophobicContact CD1-CG2 4.09Å; L754-V758 HydrophobicContact CG-CG2 4.37Å; L754-V758 WeakPolarHBondContact O-CB 3.35Å; L754-V758 WeakPolarHBondContact O-CG2 3.42Å; L754-V758 PolarHBondContact O-N 3.26Å; L754-V1131 HydrophobicContact CD2-CG1 4.24Å; L754-V1131 HydrophobicContact CD2-CG2 4.5Å
755	S	87.9	Confident	86.9	Confident	0 Å²	0	18.4 Å²	18.4	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-64.8	-40.5	179.4	73	0	0	0	0	112.1	L751 C752 C759	L751-S755 WeakPolarHBondContact O-CB 3.39Å; L751-S755 PolarHBondContact O-N 3.12Å; L751-S755 PolarHBondContact O-OG 3.12Å; L751-S755 VanDerWaalsContact O-OG 3.06Å; C752-S755 PolarHBondContact O-N 3.33Å; C752-S755 PolarHBondContact O-OG 3.23Å; S755-C759 WeakPolarHBondContact O-CB 3.15Å; S755-C759 PolarHBondContact O-N 2.87Å
756	E	88.1	Confident	86.5	Confident	2 Å²	2	22.4 Å²	22.4	1%	0.009	13%	0.127	C	C	.	.	H	α-helix	trans	-67.3	-50.3	175.9	-70.2	-178.9	164.5	0	0	111.6	V711 C752 L754 V758 C759 F760 V783	V711-E756 WeakPolarHBondContact CG1-OE2 3.46Å; C752-E756 WeakPolarHBondContact O-CG 3.27Å; C752-E756 PolarHBondContact O-N 3.04Å; L754-E756 VanDerWaalsContact C-N 3.35Å; E756-V758 VanDerWaalsContact C-N 3.33Å; E756-V758 PolarHBondContact O-N 3.3Å; E756-C759 PolarHBondContact O-N 3.19Å; E756-F760 HydrophobicContact CB-CD2 4.43Å; E756-F760 HydrophobicContact CB-CE2 4.36Å; E756-F760 WeakPolarHBondContact O-CD2 3.18Å; E756-F760 PolarHBondContact O-N 3.24Å; E756-V783 HydrophobicContact CB-CG1 4.32Å
757	S	90.9	Very high	86	Confident	4 Å²	4	22.7 Å²	22.7	3%	0.028	13%	0.13	C	C	.	.	H	α-helix	trans	-59.6	-43.3	179.3	-177.5	0	0	0	0	111.2	S753 F760 F761 A780	S753-S757 WeakPolarHBondContact O-CB 3.1Å; S753-S757 PolarHBondContact O-N 3.43Å; S757-F760 PolarHBondContact O-N 2.88Å; S757-F761 WeakPolarHBondContact O-CB 3.43Å; S757-F761 VanDerWaalsContact O-CD2 3.28Å; S757-F761 WeakPolarHBondContact O-CD2 3.46Å; S757-F761 PolarHBondContact O-N 2.9Å; S757-A780 PolarHBondContact OG-O 3.17Å
758	V	89.6	Confident	85.6	Confident	48 Å²	48	25.8 Å²	25.8	29%	0.291	15%	0.148	S	C	.	.	H	α-helix	trans	-66.7	-40.6	176.8	175.8	0	0	0	0	111.9	L754 E756 F761 L762 P1127	L754-V758 HydrophobicContact CD1-CG2 4.09Å; L754-V758 HydrophobicContact CG-CG2 4.37Å; L754-V758 WeakPolarHBondContact O-CB 3.35Å; L754-V758 WeakPolarHBondContact O-CG2 3.42Å; L754-V758 PolarHBondContact O-N 3.26Å; E756-V758 VanDerWaalsContact C-N 3.33Å; E756-V758 PolarHBondContact O-N 3.3Å; V758-F761 PolarHBondContact O-N 2.97Å; V758-L762 HydrophobicContact CG1-CD1 3.86Å; V758-L762 HydrophobicContact CG1-CG 4.33Å; V758-L762 WeakPolarHBondContact O-CB 3.25Å; V758-L762 VanDerWaalsContact O-CG 3.31Å; V758-L762 WeakPolarHBondContact O-CG 3.48Å; V758-L762 PolarHBondContact O-N 2.82Å; V758-P1127 HydrophobicContact CB-CB 4.3Å; V758-P1127 HydrophobicContact CG1-CB 3.61Å; V758-P1127 HydrophobicContact CG1-CG 3.9Å
759	C	87	Confident	85.1	Confident	1 Å²	1	26.2 Å²	26.2	1%	0.007	15%	0.15	C	C	.	.	H	α-helix	trans	-60.9	-49.1	173.8	159.5	0	0	0	0	111.2	S755 E756 F761 L762 A763 C1124	S755-C759 WeakPolarHBondContact O-CB 3.15Å; S755-C759 PolarHBondContact O-N 2.87Å; E756-C759 PolarHBondContact O-N 3.19Å; C759-F761 PolarHBondContact O-N 2.77Å; C759-L762 PolarHBondContact O-N 3.36Å; C759-A763 WeakPolarHBondContact O-CB 3.13Å; C759-A763 PolarHBondContact O-N 2.81Å; C759-C1124 VanDerWaalsContact C-SG 3.58Å; C759-C1124 HydrophobicContact CB-CB 3.97Å; C759-C1124 WeakPolarHBondContact CB-SG 3.49Å; C759-C1124 PolarHBondContact O-SG 3.07Å; C759-C1124 WeakPolarHBondContact SG-CB 3.5Å; C759-C1124 CovalentContact SG-SG 2.06Å; C759-C1124 PolarHBondContact SG-SG 3.47Å
760	F	88.6	Confident	84.9	Confident	4 Å²	4	27.5 Å²	27.5	2%	0.018	16%	0.159	C	C	.	.	H	α-helix	trans	-63.8	-39.2	178.1	-73.2	-58.1	0	0	0	112.4	L707 E756 S757 G764 F775 A776 A779 A780 V1177	L707-F760 HydrophobicContact CD1-CE1 4.44Å; L707-F760 HydrophobicContact CD1-CZ 3.91Å; L707-F760 HydrophobicContact CD2-CE2 4.32Å; L707-F760 HydrophobicContact CD2-CZ 4.35Å; E756-F760 HydrophobicContact CB-CD2 4.43Å; E756-F760 HydrophobicContact CB-CE2 4.36Å; E756-F760 WeakPolarHBondContact O-CD2 3.18Å; E756-F760 PolarHBondContact O-N 3.24Å; S757-F760 PolarHBondContact O-N 2.88Å; F760-G764 PolarHBondContact O-N 2.76Å; F760-F775 HydrophobicContact CE1-CE1 4.47Å; F760-A776 WeakPolarHBondContact O-CB 3.34Å; F760-A779 HydrophobicContact CD1-CB 4.41Å; F760-A779 HydrophobicContact CG-CB 4.36Å; F760-A780 HydrophobicContact CB-CB 3.58Å; F760-V1177 HydrophobicContact CD1-CG1 4.09Å; F760-V1177 HydrophobicContact CE1-CG1 3.98Å
761	F	89.8	Confident	84.5	Confident	72 Å²	72	26.3 Å²	26.3	32%	0.316	15%	0.154	S	C	.	.	H	α-helix	trans	-63.1	-44.7	175.6	-94.2	-60.9	0	0	0	112.3	S757 V758 C759 G764 A765 L777 A780	S757-F761 WeakPolarHBondContact O-CB 3.43Å; S757-F761 VanDerWaalsContact O-CD2 3.28Å; S757-F761 WeakPolarHBondContact O-CD2 3.46Å; S757-F761 PolarHBondContact O-N 2.9Å; V758-F761 PolarHBondContact O-N 2.97Å; C759-F761 PolarHBondContact O-N 2.77Å; F761-G764 PolarHBondContact O-N 3.3Å; F761-A765 VanDerWaalsContact O-CB 3.3Å; F761-A765 WeakPolarHBondContact O-CB 3.41Å; F761-A765 PolarHBondContact O-N 3.15Å; F761-L777 HydrophobicContact CD1-CD2 4.04Å; F761-L777 HydrophobicContact CE1-CD2 4.24Å; F761-A780 HydrophobicContact CB-CB 4.29Å; F761-A780 HydrophobicContact CD1-CB 4.01Å; F761-A780 HydrophobicContact CD2-CB 3.49Å; F761-A780 VanDerWaalsContact CD2-CB 3.49Å; F761-A780 HydrophobicContact CE1-CB 4.16Å; F761-A780 HydrophobicContact CE2-CB 3.65Å; F761-A780 HydrophobicContact CG-CB 3.66Å; F761-A780 HydrophobicContact CZ-CB 3.99Å
762	L	84.8	Confident	84.2	Confident	57 Å²	57	26.6 Å²	26.6	30%	0.298	16%	0.156	S	C	.	.	H	α-helix	trans	-67.9	-42.4	179.2	-73	173.1	0	0	0	111.8	V758 C759 G764 A765 L766 L1123 P1127	V758-L762 HydrophobicContact CG1-CD1 3.86Å; V758-L762 HydrophobicContact CG1-CG 4.33Å; V758-L762 WeakPolarHBondContact O-CB 3.25Å; V758-L762 VanDerWaalsContact O-CG 3.31Å; V758-L762 WeakPolarHBondContact O-CG 3.48Å; V758-L762 PolarHBondContact O-N 2.82Å; C759-L762 PolarHBondContact O-N 3.36Å; L762-G764 VanDerWaalsContact C-N 3.32Å; L762-G764 PolarHBondContact O-N 3.01Å; L762-A765 PolarHBondContact O-N 2.67Å; L762-L766 PolarHBondContact O-N 2.85Å; L762-L1123 HydrophobicContact CB-CD2 3.95Å; L762-L1123 HydrophobicContact CB-CG 4.26Å; L762-P1127 HydrophobicContact CD1-CB 4.48Å; L762-P1127 HydrophobicContact CD1-CG 3.34Å
763	A	77.1	Confident	84.2	Confident	3 Å²	3	30.9 Å²	30.9	3%	0.025	18%	0.175	C	C	.	.	H	α-helix	trans	-60.1	-43.3	173.3	0	0	0	0	0	111.3	C759 S767 A776 V1177	C759-A763 WeakPolarHBondContact O-CB 3.13Å; C759-A763 PolarHBondContact O-N 2.81Å; A763-S767 WeakPolarHBondContact O-CB 3.47Å; A763-S767 PolarHBondContact O-N 2.9Å; A763-A776 HydrophobicContact CB-CB 4.46Å; A763-V1177 HydrophobicContact CB-CG1 4.31Å
764	G	75.9	Confident	84.1	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-68.5	-39.7	178.9	0	0	0	0	0	113.8	F760 F761 L762 L766 K773	F760-G764 PolarHBondContact O-N 2.76Å; F761-G764 PolarHBondContact O-N 3.3Å; L762-G764 VanDerWaalsContact C-N 3.32Å; L762-G764 PolarHBondContact O-N 3.01Å; G764-L766 VanDerWaalsContact C-N 3.33Å; G764-L766 PolarHBondContact O-N 2.03Å; G764-K773 VanDerWaalsContact O-CG 3.3Å; G764-K773 WeakPolarHBondContact O-CG 3.44Å
765	A	76.9	Confident	83.9	Confident	67 Å²	67	28.8 Å²	28.8	55%	0.554	17%	0.165	S	C	*	.	H	α-helix	trans	-68.5	-32.3	-178.6	0	0	0	0	0	113.1	F761 L762	F761-A765 VanDerWaalsContact O-CB 3.3Å; F761-A765 WeakPolarHBondContact O-CB 3.41Å; F761-A765 PolarHBondContact O-N 3.15Å; L762-A765 PolarHBondContact O-N 2.67Å
766	L	79.5	Confident	84	Confident	93 Å²	93	29 Å²	29	49%	0.487	17%	0.166	S	C	.	.	H	α-helix	trans	-107.5	-16.5	-170.1	-70.9	156.4	0	0	0	114.2	L762 G764 T768 L1123	L762-L766 PolarHBondContact O-N 2.85Å; G764-L766 VanDerWaalsContact C-N 3.33Å; G764-L766 PolarHBondContact O-N 2.03Å; L766-T768 PolarHBondContact O-N 3.47Å; L766-L1123 HydrophobicContact CD1-CD2 3.24Å; L766-L1123 HydrophobicContact CG-CD2 4.49Å
767	S	80.7	Confident	84.1	Confident	7 Å²	7	30 Å²	30	5%	0.049	17%	0.172	C	C	.	.			trans	-66.6	133.3	174.5	-172.4	0	0	0	0	111.3	A763 M769	A763-S767 WeakPolarHBondContact O-CB 3.47Å; A763-S767 PolarHBondContact O-N 2.9Å; S767-M769 PolarHBondContact OG-N 3Å
768	T	79.3	Confident	84.2	Confident	72 Å²	72	29.9 Å²	29.9	44%	0.442	17%	0.171	S	C	.	.			trans	-77.6	-25.4	176.6	53.7	0	0	0	0	111.9	A387 L766 E1116	A387-T768 WeakPolarHBondContact CB-O 3.27Å; L766-T768 PolarHBondContact O-N 3.47Å; T768-E1116 PolarHBondContact OG1-OE2 3.26Å; T768-E1116 VanDerWaalsContact OG1-OE2 3.05Å
769	M	77.4	Confident	84.2	Confident	11 Å²	11	27.6 Å²	27.6	5%	0.054	16%	0.157	C	C	.	.			trans	-78.7	121.3	-174.9	-63.9	-177.1	-177.4	0	0	111.5	S767 A771 V772 K773 Q1109 I1113 A1170	S767-M769 PolarHBondContact OG-N 3Å; M769-A771 PolarHBondContact O-N 3.28Å; M769-V772 HydrophobicContact CB-CB 4.09Å; M769-V772 HydrophobicContact CB-CG2 3.81Å; M769-V772 PolarHBondContact O-N 3.07Å; M769-V772 HydrophobicContact SD-CG2 4.06Å; M769-K773 WeakPolarHBondContact O-CB 3.43Å; M769-K773 PolarHBondContact O-N 3.22Å; M769-Q1109 HydrophobicContact CE-CB 3.84Å; M769-I1113 HydrophobicContact CE-CB 4.42Å; M769-I1113 HydrophobicContact CE-CD1 4.06Å; M769-I1113 HydrophobicContact CE-CG1 3.98Å; M769-A1170 HydrophobicContact SD-CB 3.58Å; M769-A1170 VanDerWaalsContact SD-CB 3.58Å
770	P	84.8	Confident	84.5	Confident	29 Å²	29	27.6 Å²	27.6	19%	0.188	16%	0.157	C	C	.	.	H	α-helix	trans	-58.3	-44.7	-176.2	-26.9	36	0	0	0	113.7	S386 V772 K773 S774	S386-P770 WeakPolarHBondContact O-CG 3.17Å; P770-V772 PolarHBondContact O-N 3.48Å; P770-K773 PolarHBondContact O-N 3.48Å; P770-S774 WeakPolarHBondContact O-CB 3.37Å; P770-S774 PolarHBondContact O-N 2.85Å; P770-S774 PolarHBondContact O-OG 3.5Å
771	A	80.9	Confident	84.7	Confident	13 Å²	13	28.1 Å²	28.1	11%	0.107	16%	0.159	C	C	.	.	H	α-helix	trans	-60.8	-45.9	178.8	0	0	0	0	0	112.8	L384 W385 M769 F775	L384-A771 WeakPolarHBondContact O-CB 3.46Å; L384-A771 PolarHBondContact O-N 3.4Å; W385-A771 HydrophobicContact CZ3-CB 4.43Å; M769-A771 PolarHBondContact O-N 3.28Å; A771-F775 WeakPolarHBondContact O-CB 3.43Å; A771-F775 PolarHBondContact O-N 3.05Å
772	V	81.2	Confident	84.9	Confident	8 Å²	8	24.7 Å²	24.7	5%	0.048	14%	0.144	C	C	.	.	H	α-helix	trans	-67.2	-43.1	178.7	-176.6	0	0	0	0	110.6	M769 P770 F775 A776 A1170 I1174	M769-V772 HydrophobicContact CB-CB 4.09Å; M769-V772 HydrophobicContact CB-CG2 3.81Å; M769-V772 PolarHBondContact O-N 3.07Å; M769-V772 HydrophobicContact SD-CG2 4.06Å; P770-V772 PolarHBondContact O-N 3.48Å; V772-F775 PolarHBondContact O-N 2.81Å; V772-A776 VanDerWaalsContact O-CB 3.26Å; V772-A776 WeakPolarHBondContact O-CB 3.27Å; V772-A776 PolarHBondContact O-N 2.91Å; V772-A1170 HydrophobicContact CG2-CB 4.38Å; V772-I1174 HydrophobicContact CB-CD1 4.44Å; V772-I1174 HydrophobicContact CB-CG1 4.27Å; V772-I1174 HydrophobicContact CG1-CG1 4Å; V772-I1174 HydrophobicContact CG2-CD1 3.92Å; V772-I1174 HydrophobicContact CG2-CG1 3.86Å
773	K	87.1	Confident	85.3	Confident	91 Å²	91	22 Å²	22	40%	0.396	13%	0.13	S	C	.	.	H	α-helix	trans	-59	-54.3	177.9	170.1	164.2	-171.6	-179.2	0	111.8	G764 M769 P770 A776 L777	G764-K773 VanDerWaalsContact O-CG 3.3Å; G764-K773 WeakPolarHBondContact O-CG 3.44Å; M769-K773 WeakPolarHBondContact O-CB 3.43Å; M769-K773 PolarHBondContact O-N 3.22Å; P770-K773 PolarHBondContact O-N 3.48Å; K773-A776 PolarHBondContact O-N 3.3Å; K773-L777 HydrophobicContact CG-CD1 4.14Å; K773-L777 WeakPolarHBondContact O-CB 3.41Å; K773-L777 VanDerWaalsContact O-CG 3.3Å; K773-L777 WeakPolarHBondContact O-CG 3.43Å; K773-L777 PolarHBondContact O-N 3.4Å
774	S	88.5	Confident	86.1	Confident	17 Å²	17	24.9 Å²	24.9	12%	0.119	15%	0.145	C	C	.	.	H	α-helix	trans	-62.8	-45.8	177.5	-67	0	0	0	0	110.6	P770 A776 L777 Y778	P770-S774 WeakPolarHBondContact O-CB 3.37Å; P770-S774 PolarHBondContact O-N 2.85Å; P770-S774 PolarHBondContact O-OG 3.5Å; S774-A776 PolarHBondContact O-N 2.81Å; S774-L777 PolarHBondContact O-N 3.32Å; S774-Y778 WeakPolarHBondContact O-CD2 3.46Å; S774-Y778 PolarHBondContact O-N 3.34Å
775	F	87.3	Confident	87	Confident	6 Å²	6	26.6 Å²	26.6	3%	0.026	15%	0.154	C	C	.	.	H	α-helix	trans	-53.7	-51.3	176.7	172.4	-93.1	0	0	0	112.6	I700 V703 V704 L707 F760 A771 V772 L777 Y778 A779 I1174	I700-F775 HydrophobicContact CG1-CB 4.35Å; V703-F775 HydrophobicContact CB-CE2 4.07Å; V703-F775 HydrophobicContact CG1-CE2 3.66Å; V703-F775 HydrophobicContact CG1-CZ 4.14Å; V704-F775 HydrophobicContact CG2-CD2 3.8Å; V704-F775 HydrophobicContact CG2-CE2 3.72Å; L707-F775 HydrophobicContact CD1-CE1 4.5Å; L707-F775 HydrophobicContact CD1-CZ 3.83Å; F760-F775 HydrophobicContact CE1-CE1 4.47Å; A771-F775 WeakPolarHBondContact O-CB 3.43Å; A771-F775 PolarHBondContact O-N 3.05Å; V772-F775 PolarHBondContact O-N 2.81Å; F775-L777 PolarHBondContact O-N 3.1Å; F775-Y778 PolarHBondContact O-N 3.16Å; F775-A779 WeakPolarHBondContact O-CB 3.36Å; F775-A779 PolarHBondContact O-N 3.16Å; F775-I1174 HydrophobicContact CD1-CG1 4.34Å; F775-I1174 HydrophobicContact CD1-CG2 3.57Å; F775-I1174 HydrophobicContact CE1-CG2 3.29Å; F775-I1174 HydrophobicContact CE2-CG2 4.29Å; F775-I1174 HydrophobicContact CG-CD1 4.5Å; F775-I1174 HydrophobicContact CG-CG2 4.2Å; F775-I1174 HydrophobicContact CZ-CG2 3.67Å
776	A	88.4	Confident	87.9	Confident	3 Å²	3	23.4 Å²	23.4	3%	0.025	13%	0.127	C	C	.	.	H	α-helix	trans	-67.4	-38.3	-175.9	0	0	0	0	0	112.1	F760 A763 V772 K773 S774 A780	F760-A776 WeakPolarHBondContact O-CB 3.34Å; A763-A776 HydrophobicContact CB-CB 4.46Å; V772-A776 VanDerWaalsContact O-CB 3.26Å; V772-A776 WeakPolarHBondContact O-CB 3.27Å; V772-A776 PolarHBondContact O-N 2.91Å; K773-A776 PolarHBondContact O-N 3.3Å; S774-A776 PolarHBondContact O-N 2.81Å; A776-A780 WeakPolarHBondContact O-CB 3.48Å; A776-A780 PolarHBondContact O-N 3.44Å
777	L	91	Very high	88.6	Confident	25 Å²	25	20 Å²	20	13%	0.131	11%	0.109	C	C	.	.	H	α-helix	trans	-63.5	-45.5	175.1	-72.7	174.6	0	0	0	112.2	Y689 I694 F761 K773 S774 F775 A780 L781	Y689-L777 HydrophobicContact CE1-CB 4.27Å; Y689-L777 VanDerWaalsContact CE2-C 3.49Å; Y689-L777 HydrophobicContact CE2-CB 4.33Å; Y689-L777 WeakPolarHBondContact CE2-O 3.27Å; Y689-L777 PolarHBondContact OH-O 3.13Å; I694-L777 HydrophobicContact CD1-CD1 4.35Å; F761-L777 HydrophobicContact CD1-CD2 4.04Å; F761-L777 HydrophobicContact CE1-CD2 4.24Å; K773-L777 HydrophobicContact CG-CD1 4.14Å; K773-L777 WeakPolarHBondContact O-CB 3.41Å; K773-L777 VanDerWaalsContact O-CG 3.3Å; K773-L777 WeakPolarHBondContact O-CG 3.43Å; K773-L777 PolarHBondContact O-N 3.4Å; S774-L777 PolarHBondContact O-N 3.32Å; F775-L777 PolarHBondContact O-N 3.1Å; L777-A780 PolarHBondContact O-N 3.32Å; L777-L781 PolarHBondContact O-N 3.42Å
778	Y	91.9	Very high	89.2	Confident	1 Å²	1	23 Å²	23	0%	0.004	13%	0.126	C	C	.	.	H	α-helix	trans	-64.8	-43.9	178	-82.9	-110.4	0	0	0	111.6	S685 M686 Y689 I694 S696 I700 S774 F775 A782	S685-Y778 PolarHBondContact OG-O 2.88Å; M686-Y778 HydrophobicContact CB-CD1 4.49Å; M686-Y778 HydrophobicContact CB-CE1 4.28Å; M686-Y778 HydrophobicContact CG-CD1 3.95Å; M686-Y778 HydrophobicContact CG-CE1 4.11Å; Y689-Y778 WeakPolarHBondContact CB-OH 3.47Å; Y689-Y778 HydrophobicContact CD2-CD1 4.05Å; Y689-Y778 AromaticContact CD2-CD2 3.79Å; Y689-Y778 HydrophobicContact CD2-CD2 3.79Å; Y689-Y778 HydrophobicContact CD2-CE1 4.26Å; Y689-Y778 HydrophobicContact CD2-CE2 4.04Å; Y689-Y778 AromaticContact CD2-CG 3.84Å; Y689-Y778 HydrophobicContact CD2-CG 3.84Å; Y689-Y778 HydrophobicContact CE2-CD2 4.36Å; Y689-Y778 HydrophobicContact CE2-CG 4.4Å; Y689-Y778 HydrophobicContact CG-CD2 4.12Å; Y689-Y778 HydrophobicContact CG-CE1 4.47Å; Y689-Y778 AromaticContact CG-CE2 3.92Å; Y689-Y778 HydrophobicContact CG-CE2 3.92Å; I694-Y778 HydrophobicContact CG2-CE2 4.09Å; I694-Y778 PolarHBondContact O-OH 3.49Å; I694-Y778 VanDerWaalsContact O-OH 3.11Å; S696-Y778 PolarHBondContact OG-OH 3.43Å; I700-Y778 HydrophobicContact CD1-CD2 4.35Å; I700-Y778 HydrophobicContact CG2-CD1 4Å; I700-Y778 HydrophobicContact CG2-CG 4.16Å; S774-Y778 WeakPolarHBondContact O-CD2 3.46Å; S774-Y778 PolarHBondContact O-N 3.34Å; F775-Y778 PolarHBondContact O-N 3.16Å; Y778-A782 VanDerWaalsContact O-CB 3.24Å; Y778-A782 WeakPolarHBondContact O-CB 3.46Å; Y778-A782 PolarHBondContact O-N 2.77Å
779	A	91	Very high	89.9	Confident	0 Å²	0	20.3 Å²	20.3	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-63.9	-43.9	176.6	0	0	0	0	0	112	F760 F775 L781 A782 V783	F760-A779 HydrophobicContact CD1-CB 4.41Å; F760-A779 HydrophobicContact CG-CB 4.36Å; F775-A779 WeakPolarHBondContact O-CB 3.36Å; F775-A779 PolarHBondContact O-N 3.16Å; A779-L781 PolarHBondContact O-N 3.42Å; A779-A782 PolarHBondContact O-N 2.95Å; A779-V783 WeakPolarHBondContact O-CG2 3.31Å; A779-V783 PolarHBondContact O-N 3.44Å
780	A	92.4	Very high	90.7	Very high	0 Å²	0	20 Å²	20	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-60.2	-42.9	-178.4	0	0	0	0	0	113.2	S757 F760 F761 A776 L777 L784	S757-A780 PolarHBondContact OG-O 3.17Å; F760-A780 HydrophobicContact CB-CB 3.58Å; F761-A780 HydrophobicContact CB-CB 4.29Å; F761-A780 HydrophobicContact CD1-CB 4.01Å; F761-A780 HydrophobicContact CD2-CB 3.49Å; F761-A780 VanDerWaalsContact CD2-CB 3.49Å; F761-A780 HydrophobicContact CE1-CB 4.16Å; F761-A780 HydrophobicContact CE2-CB 3.65Å; F761-A780 HydrophobicContact CG-CB 3.66Å; F761-A780 HydrophobicContact CZ-CB 3.99Å; A776-A780 WeakPolarHBondContact O-CB 3.48Å; A776-A780 PolarHBondContact O-N 3.44Å; L777-A780 PolarHBondContact O-N 3.32Å; A780-L784 WeakPolarHBondContact O-CB 3.08Å; A780-L784 PolarHBondContact O-N 3.09Å
781	L	93.3	Very high	91.1	Very high	15 Å²	15	19 Å²	19	8%	0.079	10%	0.101	C	C	.	.	H	α-helix	trans	-74.9	-35.7	177	-177.3	62.6	0	0	0	111.7	F688 Y689 L777 A779 L784 M785	F688-L781 HydrophobicContact CB-CD2 3.92Å; F688-L781 HydrophobicContact CD1-CD2 3.23Å; F688-L781 HydrophobicContact CE1-CD2 3.9Å; F688-L781 HydrophobicContact CG-CD2 3.78Å; Y689-L781 HydrophobicContact CD2-CD2 4.11Å; Y689-L781 HydrophobicContact CE2-CB 3.75Å; Y689-L781 HydrophobicContact CE2-CD2 3.64Å; Y689-L781 HydrophobicContact CE2-CG 4.36Å; L777-L781 PolarHBondContact O-N 3.42Å; A779-L781 PolarHBondContact O-N 3.42Å; L781-L784 PolarHBondContact O-N 3.14Å; L781-M785 HydrophobicContact CD1-CE 4.23Å; L781-M785 HydrophobicContact CD1-CG 4.13Å; L781-M785 HydrophobicContact CG-CG 4.31Å; L781-M785 WeakPolarHBondContact O-CB 3.25Å; L781-M785 WeakPolarHBondContact O-CG 3.1Å; L781-M785 PolarHBondContact O-N 3.09Å
782	A	94.8	Very high	91.7	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-64.4	-45.8	177.7	0	0	0	0	0	111.5	S685 V704 V708 Y778 A779 L784 M785 D786	S685-A782 PolarHBondContact OG-N 3.29Å; V704-A782 HydrophobicContact CG1-CB 4.31Å; V708-A782 HydrophobicContact CG1-CB 4.45Å; V708-A782 HydrophobicContact CG2-CB 3.58Å; Y778-A782 VanDerWaalsContact O-CB 3.24Å; Y778-A782 WeakPolarHBondContact O-CB 3.46Å; Y778-A782 PolarHBondContact O-N 2.77Å; A779-A782 PolarHBondContact O-N 2.95Å; A782-L784 VanDerWaalsContact C-N 3.34Å; A782-L784 PolarHBondContact O-N 3.02Å; A782-M785 PolarHBondContact O-N 3.45Å; A782-D786 WeakPolarHBondContact O-CB 3.47Å; A782-D786 PolarHBondContact O-N 3.25Å
783	V	93.3	Very high	92.3	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-62.8	-40	175.1	173.6	0	0	0	0	111.5	L707 V708 E756 A779 D786 F787	L707-V783 HydrophobicContact CD2-CG2 4.22Å; V708-V783 HydrophobicContact CG2-CG2 4.37Å; E756-V783 HydrophobicContact CB-CG1 4.32Å; A779-V783 WeakPolarHBondContact O-CG2 3.31Å; A779-V783 PolarHBondContact O-N 3.44Å; V783-D786 PolarHBondContact O-N 3.17Å; V783-F787 PolarHBondContact O-N 3.34Å
784	L	93.2	Very high	92.6	Very high	65 Å²	65	15.2 Å²	15.2	34%	0.34	8%	0.084	S	C	.	.	H	α-helix	trans	-64.8	-46.4	176.8	-176.4	66.5	0	0	0	112	A780 L781 A782 D786 F787 V788	A780-L784 WeakPolarHBondContact O-CB 3.08Å; A780-L784 PolarHBondContact O-N 3.09Å; L781-L784 PolarHBondContact O-N 3.14Å; A782-L784 VanDerWaalsContact C-N 3.34Å; A782-L784 PolarHBondContact O-N 3.02Å; L784-D786 VanDerWaalsContact C-N 3.32Å; L784-F787 PolarHBondContact O-N 3.15Å; L784-V788 WeakPolarHBondContact O-CG2 3.1Å; L784-V788 PolarHBondContact O-N 3.48Å; L784-V788 VanDerWaalsContact O-N 3.13Å
785	M	94.5	Very high	92.9	Very high	36 Å²	36	14.4 Å²	14.4	18%	0.177	8%	0.079	C	C	.	.	H	α-helix	trans	-67	-35	177.4	-74.3	-61.2	-168.3	0	0	112	F368 L781 A782 V788 L789	F368-M785 HydrophobicContact CD2-CE 4.16Å; F368-M785 HydrophobicContact CE2-CE 3.6Å; F368-M785 HydrophobicContact CZ-CE 3.94Å; L781-M785 HydrophobicContact CD1-CE 4.23Å; L781-M785 HydrophobicContact CD1-CG 4.13Å; L781-M785 HydrophobicContact CG-CG 4.31Å; L781-M785 WeakPolarHBondContact O-CB 3.25Å; L781-M785 WeakPolarHBondContact O-CG 3.1Å; L781-M785 PolarHBondContact O-N 3.09Å; A782-M785 PolarHBondContact O-N 3.45Å; M785-V788 PolarHBondContact O-N 3.21Å; M785-L789 WeakPolarHBondContact O-CB 3.48Å; M785-L789 WeakPolarHBondContact O-CG 3.1Å; M785-L789 PolarHBondContact O-N 3.26Å
786	D	94.8	Very high	93.2	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-60	-49.2	174.2	-177.8	49.9	0	0	0	110.9	V708 G712 A782 V783 L784 V788 L789 Q790	V708-D786 HydrophobicContact CG1-CB 4.04Å; G712-D786 WeakPolarHBondContact CA-OD2 3.47Å; A782-D786 WeakPolarHBondContact O-CB 3.47Å; A782-D786 PolarHBondContact O-N 3.25Å; V783-D786 PolarHBondContact O-N 3.17Å; L784-D786 VanDerWaalsContact C-N 3.32Å; D786-V788 VanDerWaalsContact C-N 3.35Å; D786-V788 PolarHBondContact O-N 3.4Å; D786-L789 PolarHBondContact O-N 2.82Å; D786-Q790 WeakPolarHBondContact O-CB 3.42Å; D786-Q790 VanDerWaalsContact O-CG 3.23Å; D786-Q790 WeakPolarHBondContact O-CG 3.22Å; D786-Q790 PolarHBondContact O-N 2.96Å; D786-Q790 PolarHBondContact OD1-NE2 2.93Å; D786-Q790 PolarHBondContact OD2-NE2 3.05Å
787	F	94.3	Very high	93.3	Very high	22 Å²	22	15.6 Å²	15.6	10%	0.096	9%	0.085	C	C	.	.	H	α-helix	trans	-57.8	-44.4	174.3	176	-100.1	0	0	0	112.5	M749 L750 V783 L784 L789 Q790 M791	M749-F787 HydrophobicContact CB-CE2 4.13Å; L750-F787 HydrophobicContact CB-CE2 4.08Å; L750-F787 HydrophobicContact CB-CZ 3.83Å; L750-F787 HydrophobicContact CD1-CD1 4.47Å; L750-F787 HydrophobicContact CD1-CE1 3.6Å; L750-F787 HydrophobicContact CD1-CE2 4.36Å; L750-F787 HydrophobicContact CD1-CZ 3.53Å; L750-F787 HydrophobicContact CG-CZ 4.29Å; V783-F787 PolarHBondContact O-N 3.34Å; L784-F787 PolarHBondContact O-N 3.15Å; F787-L789 PolarHBondContact O-N 3.07Å; F787-Q790 PolarHBondContact O-N 3.26Å; F787-M791 HydrophobicContact CD1-CG 4.36Å; F787-M791 HydrophobicContact CD2-CE 4.36Å; F787-M791 HydrophobicContact CD2-CG 4.16Å; F787-M791 HydrophobicContact CE1-CG 3.91Å; F787-M791 HydrophobicContact CE2-CE 3.96Å; F787-M791 HydrophobicContact CE2-CG 3.68Å; F787-M791 HydrophobicContact CE2-SD 4.03Å; F787-M791 HydrophobicContact CG-CG 4.48Å; F787-M791 HydrophobicContact CZ-CG 3.53Å; F787-M791 HydrophobicContact CZ-SD 4.15Å; F787-M791 VanDerWaalsContact O-CG 3.31Å; F787-M791 WeakPolarHBondContact O-CG 3.47Å; F787-M791 PolarHBondContact O-N 2.94Å
788	V	94.2	Very high	93.3	Very high	69 Å²	69	14.5 Å²	14.5	42%	0.418	8%	0.079	S	C	.	.	H	α-helix	trans	-62.6	-44.4	179	171.8	0	0	0	0	111.5	L784 M785 D786 M791 T792	L784-V788 WeakPolarHBondContact O-CG2 3.1Å; L784-V788 PolarHBondContact O-N 3.48Å; L784-V788 VanDerWaalsContact O-N 3.13Å; M785-V788 PolarHBondContact O-N 3.21Å; D786-V788 VanDerWaalsContact C-N 3.35Å; D786-V788 PolarHBondContact O-N 3.4Å; V788-M791 PolarHBondContact O-N 2.7Å; V788-T792 WeakPolarHBondContact O-CG2 3.44Å; V788-T792 PolarHBondContact O-N 3.24Å; V788-T792 PolarHBondContact O-OG1 3.22Å
789	L	94.6	Very high	93.3	Very high	15 Å²	15	14.6 Å²	14.6	8%	0.079	8%	0.08	C	C	.	.	H	α-helix	trans	-70.4	-33.7	178.6	-68.5	175.2	0	0	0	112.1	A361 V365 V677 C680 M785 D786 F787 T792 A793 F794	A361-L789 HydrophobicContact CB-CD2 4.15Å; V365-L789 HydrophobicContact CG2-CD1 4.03Å; V365-L789 HydrophobicContact CG2-CD2 4.08Å; V677-L789 HydrophobicContact CG1-CB 3.62Å; C680-L789 HydrophobicContact CB-CD1 4.04Å; M785-L789 WeakPolarHBondContact O-CB 3.48Å; M785-L789 WeakPolarHBondContact O-CG 3.1Å; M785-L789 PolarHBondContact O-N 3.26Å; D786-L789 PolarHBondContact O-N 2.82Å; F787-L789 PolarHBondContact O-N 3.07Å; L789-T792 PolarHBondContact O-N 3.48Å; L789-T792 PolarHBondContact O-OG1 3.14Å; L789-A793 WeakPolarHBondContact O-CB 3.28Å; L789-A793 PolarHBondContact O-N 3.4Å; L789-F794 PolarHBondContact O-N 3.48Å; L789-F794 VanDerWaalsContact O-N 3.16Å
790	Q	93.9	Very high	93.2	Very high	4 Å²	4	16.8 Å²	16.8	2%	0.019	9%	0.091	C	C	.	.	I	π-helix	trans	-65	-44.5	173.1	-74.4	169.7	12.6	0	0	112	V677 G712 I716 D786 F787 T792 F794 V795	V677-Q790 HydrophobicContact CG1-CG 4.1Å; G712-Q790 PolarHBondContact O-NE2 3.06Å; I716-Q790 HydrophobicContact CG1-CG 4.3Å; D786-Q790 WeakPolarHBondContact O-CB 3.42Å; D786-Q790 VanDerWaalsContact O-CG 3.23Å; D786-Q790 WeakPolarHBondContact O-CG 3.22Å; D786-Q790 PolarHBondContact O-N 2.96Å; D786-Q790 PolarHBondContact OD1-NE2 2.93Å; D786-Q790 PolarHBondContact OD2-NE2 3.05Å; F787-Q790 PolarHBondContact O-N 3.26Å; Q790-T792 PolarHBondContact O-N 3.14Å; Q790-F794 WeakPolarHBondContact O-CB 3.28Å; Q790-V795 PolarHBondContact O-N 3.13Å
791	M	93.2	Very high	92.9	Very high	10 Å²	10	17 Å²	17	5%	0.049	9%	0.092	C	C	.	.	I	π-helix	trans	-71	-8.4	179	-66.6	-58.8	112.1	0	0	114	W346 L742 A746 M749 F787 V788	W346-M791 PolarHBondContact NE1-O 2.83Å; L742-M791 HydrophobicContact CD1-CE 4.4Å; L742-M791 HydrophobicContact CD1-SD 4.02Å; A746-M791 HydrophobicContact CB-SD 4.1Å; M749-M791 HydrophobicContact CB-CE 4.47Å; M749-M791 HydrophobicContact SD-CE 3.76Å; F787-M791 HydrophobicContact CD1-CG 4.36Å; F787-M791 HydrophobicContact CD2-CE 4.36Å; F787-M791 HydrophobicContact CD2-CG 4.16Å; F787-M791 HydrophobicContact CE1-CG 3.91Å; F787-M791 HydrophobicContact CE2-CE 3.96Å; F787-M791 HydrophobicContact CE2-CG 3.68Å; F787-M791 HydrophobicContact CE2-SD 4.03Å; F787-M791 HydrophobicContact CG-CG 4.48Å; F787-M791 HydrophobicContact CZ-CG 3.53Å; F787-M791 HydrophobicContact CZ-SD 4.15Å; F787-M791 VanDerWaalsContact O-CG 3.31Å; F787-M791 WeakPolarHBondContact O-CG 3.47Å; F787-M791 PolarHBondContact O-N 2.94Å; V788-M791 PolarHBondContact O-N 2.7Å
792	T	93.8	Very high	92.5	Very high	22 Å²	22	16.2 Å²	16.2	14%	0.135	9%	0.088	C	C	.	.	I	π-helix	trans	-122.1	-77.4	-177.5	54.3	0	0	0	0	111.9	W346 M350 V788 L789 Q790 F794 V795 A796	W346-T792 HydrophobicContact CZ2-CG2 4.06Å; M350-T792 HydrophobicContact SD-CG2 4.19Å; V788-T792 WeakPolarHBondContact O-CG2 3.44Å; V788-T792 PolarHBondContact O-N 3.24Å; V788-T792 PolarHBondContact O-OG1 3.22Å; L789-T792 PolarHBondContact O-N 3.48Å; L789-T792 PolarHBondContact O-OG1 3.14Å; Q790-T792 PolarHBondContact O-N 3.14Å; T792-F794 PolarHBondContact O-N 3Å; T792-V795 PolarHBondContact O-N 3.39Å; T792-A796 WeakPolarHBondContact O-CB 3.36Å; T792-A796 PolarHBondContact O-N 2.89Å
793	A	93.4	Very high	92.1	Very high	8 Å²	8	22 Å²	22	7%	0.066	11%	0.11	C	C	.	.	I	π-helix	trans	-62.4	-42.3	-175.6	0	0	0	0	0	112.5	L358 A361 V677 L789 A796 L797	L358-A793 HydrophobicContact CD2-CB 4.04Å; A361-A793 HydrophobicContact CB-CB 4.06Å; V677-A793 HydrophobicContact CG2-CB 4.2Å; L789-A793 WeakPolarHBondContact O-CB 3.28Å; L789-A793 PolarHBondContact O-N 3.4Å; A793-A796 PolarHBondContact O-N 2.84Å; A793-L797 WeakPolarHBondContact O-CB 3.47Å; A793-L797 PolarHBondContact O-N 3.27Å
794	F	94	Very high	91.8	Very high	2 Å²	2	23.5 Å²	23.5	1%	0.009	12%	0.116	C	C	.	.	I	π-helix	trans	-70.2	-40.7	-179.5	-173.5	-100	0	0	0	112.5	V670 I716 F719 V720 L789 Q790 T792 A796 L797 L798	V670-F794 HydrophobicContact CG1-CE2 3.75Å; V670-F794 HydrophobicContact CG1-CZ 3.58Å; I716-F794 HydrophobicContact CB-CE1 4.39Å; I716-F794 HydrophobicContact CB-CZ 4.21Å; I716-F794 HydrophobicContact CD1-CD2 4.43Å; I716-F794 HydrophobicContact CD1-CE2 4.47Å; I716-F794 HydrophobicContact CG1-CD1 4.28Å; I716-F794 HydrophobicContact CG1-CD2 4.21Å; I716-F794 HydrophobicContact CG1-CE1 4.21Å; I716-F794 HydrophobicContact CG1-CE2 4.14Å; I716-F794 HydrophobicContact CG1-CG 4.29Å; I716-F794 HydrophobicContact CG1-CZ 4.16Å; I716-F794 HydrophobicContact CG2-CE1 3.94Å; I716-F794 HydrophobicContact CG2-CE2 3.71Å; I716-F794 HydrophobicContact CG2-CZ 3.35Å; F719-F794 AromaticContact CD1-CD1 3.99Å; F719-F794 HydrophobicContact CD1-CD1 3.99Å; F719-F794 AromaticContact CD1-CE1 3.83Å; F719-F794 HydrophobicContact CD1-CE1 3.83Å; F719-F794 HydrophobicContact CE1-CD1 4.39Å; F719-F794 HydrophobicContact CE1-CE1 4.44Å; V720-F794 HydrophobicContact CG2-CE1 3.88Å; V720-F794 HydrophobicContact CG2-CZ 3.72Å; L789-F794 PolarHBondContact O-N 3.48Å; L789-F794 VanDerWaalsContact O-N 3.16Å; Q790-F794 WeakPolarHBondContact O-CB 3.28Å; T792-F794 PolarHBondContact O-N 3Å; F794-A796 VanDerWaalsContact C-N 3.32Å; F794-A796 PolarHBondContact O-N 3.13Å; F794-L797 PolarHBondContact O-N 3.41Å; F794-L798 WeakPolarHBondContact O-CB 3.23Å; F794-L798 PolarHBondContact O-N 2.78Å
795	V	93.6	Very high	91.1	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-59.9	-43.2	173.3	176.7	0	0	0	0	111.1	M350 F719 I738 L742 Q790 T792 L798 S799	M350-V795 HydrophobicContact CB-CG1 4.16Å; F719-V795 HydrophobicContact CE1-CG2 3.93Å; F719-V795 HydrophobicContact CZ-CG2 4.29Å; I738-V795 HydrophobicContact CG2-CG1 3.95Å; L742-V795 HydrophobicContact CD1-CG2 4.14Å; L742-V795 HydrophobicContact CD2-CG2 4.04Å; Q790-V795 PolarHBondContact O-N 3.13Å; T792-V795 PolarHBondContact O-N 3.39Å; V795-L798 PolarHBondContact O-N 3.15Å; V795-S799 PolarHBondContact O-N 3.26Å
796	A	92.9	Very high	90.5	Very high	0 Å²	0	22 Å²	22	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-61.3	-44	175	0	0	0	0	0	111.8	P354 V357 L358 T792 A793 F794 S799 L800	P354-A796 HydrophobicContact CB-CB 3.88Å; V357-A796 HydrophobicContact CB-CB 4.3Å; V357-A796 HydrophobicContact CG1-CB 4.22Å; L358-A796 HydrophobicContact CG-CB 4.2Å; T792-A796 WeakPolarHBondContact O-CB 3.36Å; T792-A796 PolarHBondContact O-N 2.89Å; A793-A796 PolarHBondContact O-N 2.84Å; F794-A796 VanDerWaalsContact C-N 3.32Å; F794-A796 PolarHBondContact O-N 3.13Å; A796-S799 PolarHBondContact O-N 2.85Å; A796-S799 PolarHBondContact O-OG 2.94Å; A796-L800 PolarHBondContact O-N 2.96Å
797	L	91.8	Very high	89.9	Confident	34 Å²	34	25.7 Å²	25.7	18%	0.178	13%	0.129	C	C	.	.	H	α-helix	trans	-64.6	-41.8	177.8	-169.7	132.1	0	0	0	112.2	V670 A793 F794 S799 L800 D801	V670-L797 HydrophobicContact CB-CD2 4.44Å; V670-L797 HydrophobicContact CG2-CD2 4.34Å; A793-L797 WeakPolarHBondContact O-CB 3.47Å; A793-L797 PolarHBondContact O-N 3.27Å; F794-L797 PolarHBondContact O-N 3.41Å; L797-S799 VanDerWaalsContact C-N 3.31Å; L797-S799 PolarHBondContact O-N 3.26Å; L797-L800 PolarHBondContact O-N 3.07Å; L797-D801 PolarHBondContact O-N 2.73Å
798	L	90.6	Very high	89.2	Confident	1 Å²	1	26.5 Å²	26.5	1%	0.005	13%	0.134	C	C	.	.	H	α-helix	trans	-63	-37	175	-173.5	65.6	0	0	0	111.8	V670 F719 V720 F794 V795 L800 D801 A802	V670-L798 HydrophobicContact CG1-CD1 4.4Å; F719-L798 HydrophobicContact CD1-CD2 4.01Å; F719-L798 HydrophobicContact CE1-CD2 3.45Å; F719-L798 VanDerWaalsContact CE1-CD2 3.45Å; F719-L798 HydrophobicContact CZ-CD2 3.82Å; V720-L798 HydrophobicContact CG2-CD1 4.28Å; F794-L798 WeakPolarHBondContact O-CB 3.23Å; F794-L798 PolarHBondContact O-N 2.78Å; V795-L798 PolarHBondContact O-N 3.15Å; L798-L800 VanDerWaalsContact C-N 3.34Å; L798-L800 PolarHBondContact O-N 2.93Å; L798-D801 PolarHBondContact O-N 2.83Å; L798-A802 WeakPolarHBondContact O-CB 3.25Å; L798-A802 PolarHBondContact O-N 3.3Å
799	S	91	Very high	88.5	Confident	4 Å²	4	28.8 Å²	28.8	3%	0.028	14%	0.135	C	C	.	.	H	α-helix	trans	-64.7	-37.3	176.1	80.7	0	0	0	0	112.7	V795 A796 L797 R803	V795-S799 PolarHBondContact O-N 3.26Å; A796-S799 PolarHBondContact O-N 2.85Å; A796-S799 PolarHBondContact O-OG 2.94Å; L797-S799 VanDerWaalsContact C-N 3.31Å; L797-S799 PolarHBondContact O-N 3.26Å; S799-R803 WeakPolarHBondContact O-CB 3.44Å; S799-R803 PolarHBondContact O-N 2.92Å
800	L	88.9	Confident	87.6	Confident	46 Å²	46	28.7 Å²	28.7	24%	0.241	14%	0.136	C	C	.	.	H	α-helix	trans	-69.3	-40.7	175.4	-69.6	175.4	0	0	0	111.3	P354 F355 L358 A796 L797 L798 R803 R804	P354-L800 HydrophobicContact CB-CD1 4.21Å; P354-L800 HydrophobicContact CB-CD2 4.09Å; P354-L800 HydrophobicContact CB-CG 3.89Å; P354-L800 HydrophobicContact CG-CD2 3.73Å; P354-L800 HydrophobicContact CG-CG 4.1Å; F355-L800 HydrophobicContact CE1-CD1 4.37Å; F355-L800 HydrophobicContact CE2-CD2 4.07Å; F355-L800 HydrophobicContact CZ-CD2 4.01Å; L358-L800 HydrophobicContact CD1-CD1 3.94Å; A796-L800 PolarHBondContact O-N 2.96Å; L797-L800 PolarHBondContact O-N 3.07Å; L798-L800 VanDerWaalsContact C-N 3.34Å; L798-L800 PolarHBondContact O-N 2.93Å; L800-R803 WeakPolarHBondContact O-CB 3.42Å; L800-R803 PolarHBondContact O-N 2.91Å; L800-R804 PolarHBondContact O-N 2.92Å
801	D	87.6	Confident	86.5	Confident	3 Å²	3	29 Å²	29	2%	0.016	14%	0.137	C	C	.	.	H	α-helix	trans	-67.7	-39.8	175.9	-174.9	65.2	0	0	0	112.1	K667 V670 L797 L798 R803 R804 Q805	K667-D801 VanDerWaalsContact CD-OD2 3.31Å; K667-D801 WeakPolarHBondContact CD-OD2 3.41Å; K667-D801 IonicContact NZ-OD2 2.76Å; K667-D801 PolarHBondContact NZ-OD2 3.37Å; V670-D801 HydrophobicContact CG2-CB 3.63Å; V670-D801 VanDerWaalsContact CG2-CG 3.46Å; V670-D801 WeakPolarHBondContact CG2-OD2 3.41Å; L797-D801 PolarHBondContact O-N 2.73Å; L798-D801 PolarHBondContact O-N 2.83Å; D801-R803 VanDerWaalsContact C-N 3.31Å; D801-R803 PolarHBondContact O-N 3.16Å; D801-R804 WeakPolarHBondContact O-CA 3.24Å; D801-R804 WeakPolarHBondContact O-CB 3.34Å; D801-R804 PolarHBondContact O-N 3.18Å; D801-R804 VanDerWaalsContact O-N 3.07Å; D801-R804 IonicContact OD1-CZ 2.75Å; D801-R804 VanDerWaalsContact OD1-CZ 3.27Å; D801-R804 IonicContact OD1-NE 3.05Å; D801-R804 PolarHBondContact OD1-NE 2.66Å; D801-R804 IonicContact OD1-NH2 3.74Å; D801-R804 PolarHBondContact OD1-NH2 3.48Å; D801-Q805 PolarHBondContact O-N 2.89Å
802	A	84.6	Confident	85.3	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-59.7	-42.4	171.8	0	0	0	0	0	111.5	Y723 I738 L798 R804 Q805 D806	Y723-A802 WeakPolarHBondContact OH-CB 3.42Å; I738-A802 HydrophobicContact CD1-CB 4.42Å; L798-A802 WeakPolarHBondContact O-CB 3.25Å; L798-A802 PolarHBondContact O-N 3.3Å; A802-R804 VanDerWaalsContact C-N 3.32Å; A802-R804 PolarHBondContact O-N 3.31Å; A802-Q805 PolarHBondContact O-N 2.82Å; A802-D806 PolarHBondContact O-N 3.06Å
803	R	87	Confident	84.2	Confident	120 Å²	120	39.4 Å²	39.4	45%	0.453	19%	0.191	S	C	.	.	H	α-helix	trans	-62.5	-35.9	173	178.9	174.6	-174.2	-178.3	0.9	112.4	R734 S799 L800 D801 N807	R734-R803 VanDerWaalsContact NH1-CG 3.3Å; S799-R803 WeakPolarHBondContact O-CB 3.44Å; S799-R803 PolarHBondContact O-N 2.92Å; L800-R803 WeakPolarHBondContact O-CB 3.42Å; L800-R803 PolarHBondContact O-N 2.91Å; D801-R803 VanDerWaalsContact C-N 3.31Å; D801-R803 PolarHBondContact O-N 3.16Å; R803-N807 PolarHBondContact O-ND2 3.43Å
804	R	85.3	Confident	82.6	Confident	33 Å²	33	43.4 Å²	43.4	13%	0.125	22%	0.217	C	C	.	.	H	α-helix	trans	-66.7	-46.4	174.4	-179.8	-169.3	67.9	98.9	-12	111.1	S666 L800 D801 A802 N807 N808 R809 E811	S666-R804 PolarHBondContact O-NH2 3.16Å; L800-R804 PolarHBondContact O-N 2.92Å; D801-R804 WeakPolarHBondContact O-CA 3.24Å; D801-R804 WeakPolarHBondContact O-CB 3.34Å; D801-R804 PolarHBondContact O-N 3.18Å; D801-R804 VanDerWaalsContact O-N 3.07Å; D801-R804 IonicContact OD1-CZ 2.75Å; D801-R804 VanDerWaalsContact OD1-CZ 3.27Å; D801-R804 IonicContact OD1-NE 3.05Å; D801-R804 PolarHBondContact OD1-NE 2.66Å; D801-R804 IonicContact OD1-NH2 3.74Å; D801-R804 PolarHBondContact OD1-NH2 3.48Å; A802-R804 VanDerWaalsContact C-N 3.32Å; A802-R804 PolarHBondContact O-N 3.31Å; R804-N807 PolarHBondContact O-N 3.36Å; R804-N807 VanDerWaalsContact O-N 3.14Å; R804-N808 PolarHBondContact O-N 3.08Å; R804-R809 HydrophobicContact CG-CB 4.24Å; R804-R809 PolarHBondContact NH1-O 3.21Å; R804-E811 VanDerWaalsContact NH1-CB 3.29Å; R804-E811 IonicContact NH2-OE1 3.78Å; R804-E811 PolarHBondContact NH2-OE1 2.84Å
805	Q	80.2	Confident	81.3	Confident	4 Å²	4	49.3 Å²	49.3	2%	0.019	26%	0.257	C	S	.	.	H	α-helix	trans	-66.9	-39.4	-176.8	-161.7	176.9	7.9	0	0	112.1	D665 D801 A802 N807 N808	D665-Q805 PolarHBondContact OD1-NE2 3Å; D801-Q805 PolarHBondContact O-N 2.89Å; A802-Q805 PolarHBondContact O-N 2.82Å; Q805-N807 PolarHBondContact O-N 3.36Å; Q805-N808 PolarHBondContact O-N 3.12Å
806	D	80.8	Confident	80.2	Confident	66 Å²	66	52.8 Å²	52.8	35%	0.353	28%	0.278	S	S	.	.	H	α-helix	trans	-62.2	-26.5	174.3	-78.4	-7	0	0	0	112.1	R728 A802	R728-D806 IonicContact CZ-OD2 3.08Å; R728-D806 IonicContact NH1-OD2 2.66Å; R728-D806 IonicContact NH2-OD1 3.56Å; R728-D806 IonicContact NH2-OD2 3.8Å; R728-D806 PolarHBondContact NH2-OD2 2.94Å; A802-D806 PolarHBondContact O-N 3.06Å
807	N	82.3	Confident	79	Confident	77 Å²	77	57.7 Å²	57.7	41%	0.412	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	4.8	176.1	-71.1	-48.7	0	0	0	114.3	R803 R804 Q805 R809	R803-N807 PolarHBondContact O-ND2 3.43Å; R804-N807 PolarHBondContact O-N 3.36Å; R804-N807 VanDerWaalsContact O-N 3.14Å; Q805-N807 PolarHBondContact O-N 3.36Å; N807-R809 VanDerWaalsContact C-N 3.31Å; N807-R809 HydrophobicContact CB-CG 4.19Å; N807-R809 PolarHBondContact O-N 2.99Å
808	N	79	Confident	77.9	Confident	39 Å²	39	57.8 Å²	57.8	21%	0.209	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	50.9	38.5	-179.7	-57.4	-61.1	0	0	0	115.3	R661 R804 Q805 V818	R661-N808 PolarHBondContact NH2-OD1 3.29Å; R661-N808 VanDerWaalsContact NH2-OD1 3.13Å; R804-N808 PolarHBondContact O-N 3.08Å; Q805-N808 PolarHBondContact O-N 3.12Å; N808-V818 PolarHBondContact O-N 3.21Å; N808-V818 VanDerWaalsContact O-N 3.14Å
809	R	80.6	Confident	76.2	Confident	116 Å²	116	63.6 Å²	63.6	44%	0.438	35%	0.351	S	S	.	.	B	Isolated β-bridge	trans	-95.6	140.4	177.6	-56.5	-174.1	-159.6	177.7	4.9	111.9	R804 N807 T817	R804-R809 HydrophobicContact CG-CB 4.24Å; R804-R809 PolarHBondContact NH1-O 3.21Å; N807-R809 VanDerWaalsContact C-N 3.31Å; N807-R809 HydrophobicContact CB-CG 4.19Å; N807-R809 PolarHBondContact O-N 2.99Å; R809-T817 HydrophobicContact CG-CG2 4.21Å
810	C	74.9	Confident	74.6	Confident	14 Å²	14	67.3 Å²	67.3	10%	0.095	37%	0.374	C	S	.	.			trans	-61.8	153	173.2	-67.1	0	0	0	0	112.3	L813 V816	C810-L813 HydrophobicContact CB-CB 4.45Å; C810-V816 HydrophobicContact CB-CB 4.49Å; C810-V816 PolarHBondContact N-O 3.2Å; C810-V816 VanDerWaalsContact N-O 3.11Å
811	E	70.3	Confident	73.1	Confident	9 Å²	9	75.8 Å²	75.8	4%	0.042	40%	0.402	C	S	.	.	S	Bend	trans	-77.2	-56.8	-172.4	-163.9	167.6	-153.4	0	0	113.7	L663 S666 K667 F668 L669 R804	L663-E811 PolarHBondContact O-N 2.97Å; S666-E811 VanDerWaalsContact CB-OE2 3.28Å; S666-E811 WeakPolarHBondContact CB-OE2 3.37Å; S666-E811 VanDerWaalsContact O-CD 3.29Å; S666-E811 PolarHBondContact OG-OE2 2.63Å; K667-E811 VanDerWaalsContact C-OE1 3.23Å; K667-E811 WeakPolarHBondContact CA-OE1 3.46Å; K667-E811 PolarHBondContact N-OE2 3.3Å; F668-E811 WeakPolarHBondContact CB-OE2 3.4Å; F668-E811 PolarHBondContact N-OE1 3.43Å; F668-E811 PolarHBondContact N-OE2 2.76Å; L669-E811 HydrophobicContact CB-CG 4.12Å; L669-E811 WeakPolarHBondContact CB-OE1 3.48Å; L669-E811 PolarHBondContact N-OE1 3.38Å; R804-E811 VanDerWaalsContact NH1-CB 3.29Å; R804-E811 IonicContact NH2-OE1 3.78Å; R804-E811 PolarHBondContact NH2-OE1 2.84Å
812	L	69.8	Low	71.7	Confident	135 Å²	135	80 Å²	80	71%	0.707	42%	0.418	S	S	*	.	S	Bend	trans	-75.9	-27.7	178.1	-91	91.1	0	0	0	113.4	F668	F668-L812 HydrophobicContact CD1-CD1 4.36Å
813	L	68.9	Low	70.5	Confident	117 Å²	117	83.5 Å²	83.5	61%	0.613	44%	0.441	S	S	*	.			trans	-115.7	84.8	-176	-75.8	152.3	0	0	0	109.1	C810 C815 V816	C810-L813 HydrophobicContact CB-CB 4.45Å; L813-C815 PolarHBondContact O-N 3.3Å; L813-V816 HydrophobicContact CB-CG2 4.27Å; L813-V816 PolarHBondContact O-N 2.03Å
814	C	60.4	Low	68.9	Low	91 Å²	91	86 Å²	86	62%	0.615	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-10.8	-175.1	-70.9	0	0	0	0	115.1
815	C	67.1	Low	67.6	Low	127 Å²	127	93 Å²	93	86%	0.858	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.3	-6.7	-175.3	-58.2	0	0	0	0	114.7	L813	L813-C815 PolarHBondContact O-N 3.3Å
816	V	71.1	Confident	66.7	Low	73 Å²	73	96.1 Å²	96.1	44%	0.442	52%	0.515	S	S	.	.			trans	-104.4	120.5	-176.1	-177.1	0	0	0	0	110.6	C810 L813	C810-V816 HydrophobicContact CB-CB 4.49Å; C810-V816 PolarHBondContact N-O 3.2Å; C810-V816 VanDerWaalsContact N-O 3.11Å; L813-V816 HydrophobicContact CB-CG2 4.27Å; L813-V816 PolarHBondContact O-N 2.03Å
817	T	67.9	Low	65.9	Low	102 Å²	102	96.8 Å²	96.8	63%	0.626	52%	0.519	S	S	*	.	B	Isolated β-bridge	trans	-104.3	132.8	177	50.6	0	0	0	0	111.4	R809	R809-T817 HydrophobicContact CG-CG2 4.21Å
818	V	67.6	Low	65	Low	37 Å²	37	99.1 Å²	99.1	22%	0.224	53%	0.527	C	S	.	.			trans	-98.8	134	177.8	-179.6	0	0	0	0	110.3	V664 N808 T820	V664-V818 HydrophobicContact CG2-CB 4.14Å; V664-V818 HydrophobicContact CG2-CG2 3.58Å; N808-V818 PolarHBondContact O-N 3.21Å; N808-V818 VanDerWaalsContact O-N 3.14Å; V818-T820 VanDerWaalsContact CG1-OG1 3.25Å; V818-T820 WeakPolarHBondContact CG1-OG1 3.27Å
819	S	54.8	Low	64.5	Low	123 Å²	123	99.9 Å²	99.9	86%	0.86	54%	0.544	S	S	*	.			trans	-76.6	-21.4	-173.3	137.6	0	0	0	0	114.6	R821	S819-R821 PolarHBondContact O-N 3.06Å
820	T	58.2	Low	64.4	Low	82 Å²	82	102.5 Å²	102.5	50%	0.503	56%	0.559	S	S	.	*	P	Polyproline II helix	trans	-71.7	120	-179.5	13.6	0	0	0	0	112.3	R661 V818	R661-T820 PolarHBondContact NH1-O 2.85Å; V818-T820 VanDerWaalsContact CG1-OG1 3.25Å; V818-T820 WeakPolarHBondContact CG1-OG1 3.27Å
821	R	56	Low	64.6	Low	223 Å²	223	104.8 Å²	104.8	84%	0.842	57%	0.57	S	S	*	*	P	Polyproline II helix	trans	-73.9	153.2	178.2	-73.8	-175.1	178.5	-177.6	-0.4	113	R661 S819	R661-R821 PolarHBondContact NH1-O 3.41Å; S819-R821 PolarHBondContact O-N 3.06Å
822	R	59.7	Low	65.2	Low	91 Å²	91	105.9 Å²	105.9	34%	0.343	58%	0.576	S	S	.	*	P	Polyproline II helix	trans	-66.6	135.5	179.4	-160.2	177.1	-170.8	-171	-1.6	109.7	E655 R661	E655-R822 IonicContact OE1-NH2 3.08Å; E655-R822 PolarHBondContact OE1-NH2 3.38Å; E655-R822 IonicContact OE2-CZ 3.3Å; E655-R822 IonicContact OE2-NE 3.73Å; E655-R822 IonicContact OE2-NH2 3.74Å; E655-R822 PolarHBondContact OE2-NH2 2.96Å; R661-R822 VanDerWaalsContact NH1-N 3.11Å
823	P	59.1	Low	65.9	Low	75 Å²	75	101.8 Å²	101.8	49%	0.487	56%	0.558	S	S	.	*	P	Polyproline II helix	trans	-65.1	141.8	173	24.9	-31.3	0	0	0	111	K825	P823-K825 VanDerWaalsContact C-N 3.25Å; P823-K825 PolarHBondContact O-N 3.4Å
824	N	53.9	Low	66.9	Low	173 Å²	173	100.5 Å²	100.5	93%	0.925	55%	0.548	S	S	*	.	S	Bend	trans	-73.5	-9.1	-178.2	-82.3	-6.9	0	0	0	114.4
825	K	57.7	Low	68.2	Low	179 Å²	179	96.6 Å²	96.6	78%	0.778	52%	0.52	S	S	*	.	S	Bend	trans	-97.1	133.5	178.4	-72.5	-173	178.9	-178	0	110	P823	P823-K825 VanDerWaalsContact C-N 3.25Å; P823-K825 PolarHBondContact O-N 3.4Å
826	P	61.6	Low	69.2	Low	69 Å²	69	98.5 Å²	98.5	45%	0.448	51%	0.509	S	S	.	.			trans	-63	137.3	173.6	26.1	-31.9	0	0	0	109.8	E828	P826-E828 PolarHBondContact O-N 3.25Å
827	N	62.4	Low	70	Confident	81 Å²	81	102.3 Å²	102.3	43%	0.433	52%	0.52	S	S	.	.			trans	-75.4	114.8	173.5	-93.3	-17.5	0	0	0	108.7	G829	N827-G829 PolarHBondContact O-N 2.97Å; N827-G829 VanDerWaalsContact O-N 3.15Å
828	E	63.3	Low	71.1	Confident	125 Å²	125	104.3 Å²	104.3	58%	0.584	52%	0.517	S	S	*	.			trans	-71.6	-3.9	179	-64.4	-170.8	166.5	0	0	113.2	P826 L832 P833	P826-E828 PolarHBondContact O-N 3.25Å; E828-L832 WeakPolarHBondContact O-CB 3.32Å; E828-P833 HydrophobicContact CB-CG 4.26Å; E828-P833 WeakPolarHBondContact O-CD 3.38Å
829	G	68.5	Low	72.2	Confident	55 Å²	55	105.5 Å²	105.5	57%	0.567	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.1	-178.7	-177.4	0	0	0	0	0	113.1	N827 P833	N827-G829 PolarHBondContact O-N 2.97Å; N827-G829 VanDerWaalsContact O-N 3.15Å; G829-P833 WeakPolarHBondContact O-CD 3.49Å; G829-P833 VanDerWaalsContact O-CG 3.3Å; G829-P833 WeakPolarHBondContact O-CG 3.49Å
830	F	78.7	Confident	73.9	Confident	171 Å²	171	99.8 Å²	99.8	75%	0.75	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	-38.1	176.7	177.3	-101.9	0	0	0	112.8	P833 F834	F830-P833 WeakPolarHBondContact O-CD 3.29Å; F830-F834 WeakPolarHBondContact O-CB 3.49Å; F830-F834 PolarHBondContact O-N 3.45Å
831	L	80.6	Confident	75.5	Confident	63 Å²	63	98.3 Å²	98.3	33%	0.33	47%	0.47	S	S	.	.	H	α-helix	trans	-68.2	-41.3	-172.5	-86.7	155.4	0	0	0	114	F834 M835 F1218 A1219	L831-F834 PolarHBondContact O-N 3.46Å; L831-M835 WeakPolarHBondContact O-CB 3.28Å; L831-M835 WeakPolarHBondContact O-CG 3.18Å; L831-M835 PolarHBondContact O-N 3.43Å; L831-F1218 HydrophobicContact CD2-CD1 3.96Å; L831-F1218 HydrophobicContact CD2-CE1 4.24Å; L831-A1219 HydrophobicContact CD1-CB 3.93Å
832	L	82.6	Confident	77.3	Confident	31 Å²	31	92.2 Å²	92.2	16%	0.162	46%	0.457	C	S	.	.	H	α-helix	trans	-69.1	-46.5	-176.3	-179.5	74.8	0	0	0	112.1	E828 F834 M835 R836 A1211 T1212	E828-L832 WeakPolarHBondContact O-CB 3.32Å; L832-F834 VanDerWaalsContact C-N 3.31Å; L832-F834 PolarHBondContact O-N 3.43Å; L832-M835 PolarHBondContact O-N 2.92Å; L832-R836 VanDerWaalsContact O-CB 3.23Å; L832-R836 WeakPolarHBondContact O-CB 3.37Å; L832-R836 PolarHBondContact O-N 2.82Å; L832-A1211 VanDerWaalsContact CD1-O 3.29Å; L832-A1211 WeakPolarHBondContact CD1-O 3.24Å; L832-T1212 HydrophobicContact CD1-CG2 4.43Å
833	P	84.4	Confident	78.8	Confident	50 Å²	50	88.6 Å²	88.6	33%	0.325	45%	0.445	S	S	.	.	H	α-helix	trans	-59.9	-39.6	172.5	-25.5	34.9	0	0	0	113	E828 G829 F830 K837	E828-P833 HydrophobicContact CB-CG 4.26Å; E828-P833 WeakPolarHBondContact O-CD 3.38Å; G829-P833 WeakPolarHBondContact O-CD 3.49Å; G829-P833 VanDerWaalsContact O-CG 3.3Å; G829-P833 WeakPolarHBondContact O-CG 3.49Å; F830-P833 WeakPolarHBondContact O-CD 3.29Å; P833-K837 WeakPolarHBondContact O-CB 3.28Å; P833-K837 PolarHBondContact O-N 2.84Å
834	F	88.9	Confident	80.4	Confident	90 Å²	90	85.3 Å²	85.3	40%	0.395	42%	0.423	S	S	.	.	H	α-helix	trans	-61.5	-51.2	176.5	174.8	-98.5	0	0	0	111.6	F830 L831 L832 R836 Y838 Y839	F830-F834 WeakPolarHBondContact O-CB 3.49Å; F830-F834 PolarHBondContact O-N 3.45Å; L831-F834 PolarHBondContact O-N 3.46Å; L832-F834 VanDerWaalsContact C-N 3.31Å; L832-F834 PolarHBondContact O-N 3.43Å; F834-R836 VanDerWaalsContact C-N 3.35Å; F834-R836 PolarHBondContact O-N 3.39Å; F834-Y838 HydrophobicContact CD2-CD2 4.42Å; F834-Y838 PolarHBondContact O-N 2.86Å; F834-Y839 PolarHBondContact O-N 3.24Å
835	M	88.1	Confident	82.2	Confident	9 Å²	9	81.9 Å²	81.9	4%	0.044	40%	0.401	C	S	.	.	I	π-helix	trans	-63.5	-40	179.8	-76.1	-65.9	-171.9	0	0	112.2	L831 L832 Y839 A840 F1218	L831-M835 WeakPolarHBondContact O-CB 3.28Å; L831-M835 WeakPolarHBondContact O-CG 3.18Å; L831-M835 PolarHBondContact O-N 3.43Å; L832-M835 PolarHBondContact O-N 2.92Å; M835-Y839 HydrophobicContact CE-CD1 4.41Å; M835-Y839 VanDerWaalsContact SD-CB 3.57Å; M835-Y839 HydrophobicContact SD-CD1 3.36Å; M835-Y839 WeakPolarHBondContact SD-CD1 3.5Å; M835-Y839 HydrophobicContact SD-CD2 4.26Å; M835-Y839 HydrophobicContact SD-CE1 4.06Å; M835-Y839 HydrophobicContact SD-CG 3.48Å; M835-A840 WeakPolarHBondContact O-CB 3.36Å; M835-A840 PolarHBondContact O-N 3.29Å; M835-F1218 HydrophobicContact CE-CB 4.44Å; M835-F1218 HydrophobicContact CE-CG 4.42Å
836	R	88.5	Confident	83.6	Confident	167 Å²	167	81 Å²	81	63%	0.63	39%	0.393	S	S	*	.	I	π-helix	trans	-72.7	-41.7	-179.2	-173.2	177.5	178.3	-180	0.3	113.4	L832 F834 P841 A1211	L832-R836 VanDerWaalsContact O-CB 3.23Å; L832-R836 WeakPolarHBondContact O-CB 3.37Å; L832-R836 PolarHBondContact O-N 2.82Å; F834-R836 VanDerWaalsContact C-N 3.35Å; F834-R836 PolarHBondContact O-N 3.39Å; R836-P841 WeakPolarHBondContact O-CD 3.3Å; R836-P841 WeakPolarHBondContact O-CG 3.31Å; R836-A1211 HydrophobicContact CB-CB 3.99Å; R836-A1211 HydrophobicContact CG-CB 4.38Å
837	K	88.4	Confident	84.9	Confident	153 Å²	153	84.5 Å²	84.5	67%	0.665	40%	0.402	S	S	*	.	I	π-helix	trans	-90.7	-34.2	-171.2	-165.7	175	-178.1	-178.2	0	113.2	P833	P833-K837 WeakPolarHBondContact O-CB 3.28Å; P833-K837 PolarHBondContact O-N 2.84Å
838	Y	89.9	Confident	86.3	Confident	143 Å²	143	82.6 Å²	82.6	56%	0.561	39%	0.393	S	S	*	.	I	π-helix	trans	-112.5	-57.8	-175.2	-65.9	-82.9	0	0	0	112.4	F834 V842	F834-Y838 HydrophobicContact CD2-CD2 4.42Å; F834-Y838 PolarHBondContact O-N 2.86Å; Y838-V842 WeakPolarHBondContact O-CB 3.19Å; Y838-V842 WeakPolarHBondContact O-CG2 3.39Å; Y838-V842 PolarHBondContact O-N 2.82Å
839	Y	92	Very high	87.6	Confident	63 Å²	63	78.1 Å²	78.1	25%	0.247	37%	0.37	C	S	.	.	I	π-helix	trans	-67.4	-57.9	-169.6	-172.4	-98.9	0	0	0	113.9	F834 M835 V842 L843 T1210 L1260 V1261	F834-Y839 PolarHBondContact O-N 3.24Å; M835-Y839 HydrophobicContact CE-CD1 4.41Å; M835-Y839 VanDerWaalsContact SD-CB 3.57Å; M835-Y839 HydrophobicContact SD-CD1 3.36Å; M835-Y839 WeakPolarHBondContact SD-CD1 3.5Å; M835-Y839 HydrophobicContact SD-CD2 4.26Å; M835-Y839 HydrophobicContact SD-CE1 4.06Å; M835-Y839 HydrophobicContact SD-CG 3.48Å; Y839-V842 PolarHBondContact O-N 2.97Å; Y839-L843 HydrophobicContact CE1-CD2 3.88Å; Y839-L843 WeakPolarHBondContact O-CB 3.26Å; Y839-L843 PolarHBondContact O-N 2.6Å; Y839-T1210 HydrophobicContact CD1-CG2 4.05Å; Y839-T1210 HydrophobicContact CE1-CG2 4.01Å; Y839-L1260 PolarHBondContact OH-O 3.26Å; Y839-V1261 WeakPolarHBondContact OH-CG2 3.36Å
840	A	89.9	Confident	88.6	Confident	2 Å²	2	78 Å²	78	2%	0.017	36%	0.357	C	S	.	.	H	α-helix	trans	-62.8	-40.1	-175	0	0	0	0	0	113.6	M835 L844 T1210	M835-A840 WeakPolarHBondContact O-CB 3.36Å; M835-A840 PolarHBondContact O-N 3.29Å; A840-L844 WeakPolarHBondContact O-CB 3.17Å; A840-L844 PolarHBondContact O-N 3.37Å; A840-L844 VanDerWaalsContact O-N 3.09Å; A840-T1210 HydrophobicContact CB-CG2 4.24Å
841	P	90.9	Very high	89.2	Confident	52 Å²	52	74.8 Å²	74.8	34%	0.338	35%	0.346	S	S	.	.	H	α-helix	trans	-64.7	-38.6	174.7	-24.9	36.5	0	0	0	114	R836 H845	R836-P841 WeakPolarHBondContact O-CD 3.3Å; R836-P841 WeakPolarHBondContact O-CG 3.31Å; P841-H845 PolarHBondContact O-N 3.33Å
842	V	93.4	Very high	89.9	Confident	95 Å²	95	72.8 Å²	72.8	58%	0.576	34%	0.336	S	S	*	.	H	α-helix	trans	-70	-47.4	178.6	171.2	0	0	0	0	110.6	Y838 Y839 L844 H845 T848	Y838-V842 WeakPolarHBondContact O-CB 3.19Å; Y838-V842 WeakPolarHBondContact O-CG2 3.39Å; Y838-V842 PolarHBondContact O-N 2.82Å; Y839-V842 PolarHBondContact O-N 2.97Å; V842-L844 VanDerWaalsContact C-N 3.34Å; V842-L844 PolarHBondContact O-N 2.89Å; V842-H845 WeakPolarHBondContact O-CB 3.28Å; V842-H845 PolarHBondContact O-N 2.88Å; V842-T848 WeakPolarHBondContact O-CB 3.32Å; V842-T848 WeakPolarHBondContact O-CG2 3.18Å; V842-T848 PolarHBondContact O-OG1 2.96Å
843	L	92.4	Very high	90.3	Very high	15 Å²	15	71.8 Å²	71.8	8%	0.079	33%	0.331	C	S	.	.	H	α-helix	trans	-61.2	-41.4	-179.9	-179	62.8	0	0	0	112.2	Y839 H845 T848 V852 T1210 L1260 V1261 P1264 V1265	Y839-L843 HydrophobicContact CE1-CD2 3.88Å; Y839-L843 WeakPolarHBondContact O-CB 3.26Å; Y839-L843 PolarHBondContact O-N 2.6Å; L843-H845 VanDerWaalsContact C-N 3.34Å; L843-H845 PolarHBondContact O-N 3.41Å; L843-T848 PolarHBondContact O-OG1 2.89Å; L843-T848 VanDerWaalsContact O-OG1 3.1Å; L843-V852 HydrophobicContact CD1-CG2 4.28Å; L843-T1210 HydrophobicContact CD2-CG2 4.48Å; L843-L1260 WeakPolarHBondContact CD2-O 3.43Å; L843-V1261 HydrophobicContact CD1-CG1 3.68Å; L843-P1264 HydrophobicContact CD2-CB 4.25Å; L843-P1264 HydrophobicContact CD2-CG 4.39Å; L843-V1265 HydrophobicContact CD1-CG2 4.13Å; L843-V1265 HydrophobicContact CG-CG2 4.24Å
844	L	92.3	Very high	90.6	Very high	6 Å²	6	72.4 Å²	72.4	3%	0.031	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	14.2	-176.5	-66.8	166.1	0	0	0	113.9	A840 V842 R849 V1203 A1206 K1207	A840-L844 WeakPolarHBondContact O-CB 3.17Å; A840-L844 PolarHBondContact O-N 3.37Å; A840-L844 VanDerWaalsContact O-N 3.09Å; V842-L844 VanDerWaalsContact C-N 3.34Å; V842-L844 PolarHBondContact O-N 2.89Å; L844-R849 HydrophobicContact CD2-CG 4.49Å; L844-R849 PolarHBondContact O-NE 3.48Å; L844-V1203 HydrophobicContact CB-CG1 4.38Å; L844-A1206 HydrophobicContact CD1-CB 3.72Å; L844-A1206 HydrophobicContact CD2-CB 4.09Å; L844-K1207 HydrophobicContact CB-CG 4.24Å; L844-K1207 HydrophobicContact CD1-CB 4.06Å; L844-K1207 HydrophobicContact CD1-CG 3.4Å; L844-K1207 VanDerWaalsContact CD1-N 3.31Å; L844-K1207 HydrophobicContact CG-CG 4.44Å
845	H	91.8	Very high	90.9	Very high	101 Å²	101	71.6 Å²	71.6	47%	0.468	33%	0.333	S	S	.	.	S	Bend	trans	-65.2	159.3	171.9	-169.9	-103.6	0	0	0	112	P841 V842 L843 F847 T848 R849	P841-H845 PolarHBondContact O-N 3.33Å; V842-H845 WeakPolarHBondContact O-CB 3.28Å; V842-H845 PolarHBondContact O-N 2.88Å; L843-H845 VanDerWaalsContact C-N 3.34Å; L843-H845 PolarHBondContact O-N 3.41Å; H845-F847 AromaticContact CE1-CD2 3.66Å; H845-F847 AromaticContact ND1-CD2 3.96Å; H845-F847 PolarHBondContact O-N 2.9Å; H845-T848 WeakPolarHBondContact CA-OG1 3.49Å; H845-T848 HydrophobicContact CB-CG2 4.39Å; H845-T848 VanDerWaalsContact CB-OG1 3.31Å; H845-T848 WeakPolarHBondContact CB-OG1 3.29Å; H845-T848 PolarHBondContact N-OG1 3.39Å; H845-T848 PolarHBondContact O-OG1 3.33Å; H845-T848 VanDerWaalsContact O-OG1 3.13Å; H845-R849 WeakPolarHBondContact O-CG 3.27Å; H845-R849 PolarHBondContact O-N 3.07Å; H845-R849 PolarHBondContact O-NE 3.25Å; H845-R849 VanDerWaalsContact O-NE 3.16Å
846	R	86.8	Confident	91.2	Very high	159 Å²	159	71.8 Å²	71.8	60%	0.6	33%	0.334	S	S	*	.	H	α-helix	trans	-64.9	-41.3	-171.6	-173.8	178.1	-70.5	-173.9	0.9	113
847	F	88.8	Confident	91.3	Very high	144 Å²	144	64.8 Å²	64.8	63%	0.632	31%	0.309	S	S	*	.	H	α-helix	trans	-79.3	-40.9	-179.1	-64.2	-70.8	0	0	0	112.7	H845 R849 I850 I851	H845-F847 AromaticContact CE1-CD2 3.66Å; H845-F847 AromaticContact ND1-CD2 3.96Å; H845-F847 PolarHBondContact O-N 2.9Å; F847-R849 VanDerWaalsContact C-N 3.33Å; F847-R849 PolarHBondContact O-N 3.49Å; F847-I850 PolarHBondContact O-N 3.18Å; F847-I851 WeakPolarHBondContact O-CG1 3.27Å; F847-I851 PolarHBondContact O-N 3.25Å
848	T	91.3	Very high	91.5	Very high	40 Å²	40	63.6 Å²	63.6	25%	0.245	30%	0.304	C	S	.	.	H	α-helix	trans	-61.8	-41	-178.6	48.7	0	0	0	0	111.7	V842 L843 H845 I850 I851 V852	V842-T848 WeakPolarHBondContact O-CB 3.32Å; V842-T848 WeakPolarHBondContact O-CG2 3.18Å; V842-T848 PolarHBondContact O-OG1 2.96Å; L843-T848 PolarHBondContact O-OG1 2.89Å; L843-T848 VanDerWaalsContact O-OG1 3.1Å; H845-T848 WeakPolarHBondContact CA-OG1 3.49Å; H845-T848 HydrophobicContact CB-CG2 4.39Å; H845-T848 VanDerWaalsContact CB-OG1 3.31Å; H845-T848 WeakPolarHBondContact CB-OG1 3.29Å; H845-T848 PolarHBondContact N-OG1 3.39Å; H845-T848 PolarHBondContact O-OG1 3.33Å; H845-T848 VanDerWaalsContact O-OG1 3.13Å; T848-I850 VanDerWaalsContact C-N 3.31Å; T848-I850 PolarHBondContact O-N 2.82Å; T848-I851 PolarHBondContact O-N 3.03Å; T848-V852 VanDerWaalsContact O-CG2 3.3Å; T848-V852 WeakPolarHBondContact O-CG2 3.18Å; T848-V852 PolarHBondContact O-N 3.45Å
849	R	90.9	Very high	91.7	Very high	31 Å²	31	59.6 Å²	59.6	12%	0.117	29%	0.291	C	S	.	.	H	α-helix	trans	-58.5	-37.7	175.8	-70.5	-177.7	-56.5	154.3	10.7	114.3	L844 H845 F847 M853 V1265 Y1269	L844-R849 HydrophobicContact CD2-CG 4.49Å; L844-R849 PolarHBondContact O-NE 3.48Å; H845-R849 WeakPolarHBondContact O-CG 3.27Å; H845-R849 PolarHBondContact O-N 3.07Å; H845-R849 PolarHBondContact O-NE 3.25Å; H845-R849 VanDerWaalsContact O-NE 3.16Å; F847-R849 VanDerWaalsContact C-N 3.33Å; F847-R849 PolarHBondContact O-N 3.49Å; R849-M853 WeakPolarHBondContact O-CG 3.38Å; R849-M853 PolarHBondContact O-N 2.61Å; R849-V1265 HydrophobicContact CB-CG1 3.84Å; R849-V1265 HydrophobicContact CG-CG1 3.98Å; R849-V1265 HydrophobicContact CG-CG2 4.13Å; R849-Y1269 HydrophobicContact CB-CE2 3.98Å
850	I	90.4	Very high	91.7	Very high	54 Å²	54	58.2 Å²	58.2	28%	0.277	29%	0.288	S	S	.	.	H	α-helix	trans	-69.7	-45.1	177.7	-63.4	172.3	0	0	0	109.6	F299 L303 F847 T848 V852 M853 L854	F299-I850 HydrophobicContact CE1-CG2 4.42Å; L303-I850 HydrophobicContact CD1-CD1 4.36Å; L303-I850 HydrophobicContact CD1-CG1 4.32Å; F847-I850 PolarHBondContact O-N 3.18Å; T848-I850 VanDerWaalsContact C-N 3.31Å; T848-I850 PolarHBondContact O-N 2.82Å; I850-V852 PolarHBondContact O-N 3.25Å; I850-M853 PolarHBondContact O-N 3.4Å; I850-L854 HydrophobicContact CG2-CD1 4.15Å; I850-L854 WeakPolarHBondContact O-CG 3.43Å; I850-L854 PolarHBondContact O-N 3.39Å; I850-L854 VanDerWaalsContact O-N 3.09Å
851	I	91.9	Very high	91.8	Very high	102 Å²	102	58.3 Å²	58.3	52%	0.523	29%	0.288	S	S	.	.	H	α-helix	trans	-59.9	-47.5	178.1	-64.9	168.4	0	0	0	110.4	F847 T848 M853 L854 V855	F847-I851 WeakPolarHBondContact O-CG1 3.27Å; F847-I851 PolarHBondContact O-N 3.25Å; T848-I851 PolarHBondContact O-N 3.03Å; I851-M853 PolarHBondContact O-N 2.67Å; I851-L854 PolarHBondContact O-N 3.48Å; I851-V855 HydrophobicContact CG2-CG2 4.22Å; I851-V855 WeakPolarHBondContact O-CG2 3.48Å; I851-V855 PolarHBondContact O-N 3.35Å
852	V	93.5	Very high	91.9	Very high	21 Å²	21	57.5 Å²	57.5	13%	0.127	29%	0.286	C	S	.	.	H	α-helix	trans	-57.4	-49.4	178.5	171.2	0	0	0	0	110.7	L843 T848 I850 L854 V855 F856 V1261 V1265	L843-V852 HydrophobicContact CD1-CG2 4.28Å; T848-V852 VanDerWaalsContact O-CG2 3.3Å; T848-V852 WeakPolarHBondContact O-CG2 3.18Å; T848-V852 PolarHBondContact O-N 3.45Å; I850-V852 PolarHBondContact O-N 3.25Å; V852-L854 VanDerWaalsContact C-N 3.33Å; V852-L854 PolarHBondContact O-N 2.93Å; V852-V855 PolarHBondContact O-N 3.44Å; V852-F856 HydrophobicContact CG1-CD2 3.77Å; V852-F856 HydrophobicContact CG1-CE2 3.91Å; V852-F856 VanDerWaalsContact O-CD2 3.32Å; V852-F856 WeakPolarHBondContact O-CD2 3.32Å; V852-F856 PolarHBondContact O-N 3.31Å; V852-V1261 HydrophobicContact CG1-CG1 4.05Å; V852-V1261 HydrophobicContact CG2-CG1 4.15Å; V852-V1265 HydrophobicContact CB-CG2 4.3Å; V852-V1265 HydrophobicContact CG1-CB 4.28Å; V852-V1265 HydrophobicContact CG1-CG1 4.46Å; V852-V1265 HydrophobicContact CG1-CG2 4Å
853	M	91.4	Very high	91.9	Very high	11 Å²	11	53.3 Å²	53.3	5%	0.054	26%	0.261	C	S	.	.	H	α-helix	trans	-59.2	-42.2	178.6	-72.4	-62.7	-57.1	0	0	112.7	F299 R849 I850 I851 I857 F1262 V1265 L1266 Y1269	F299-M853 HydrophobicContact CD2-CE 4.45Å; F299-M853 HydrophobicContact CE1-CB 3.88Å; F299-M853 HydrophobicContact CE2-CB 4.06Å; F299-M853 HydrophobicContact CE2-CE 4.08Å; F299-M853 HydrophobicContact CE2-CG 3.98Å; F299-M853 HydrophobicContact CZ-CB 3.55Å; F299-M853 HydrophobicContact CZ-CG 3.7Å; R849-M853 WeakPolarHBondContact O-CG 3.38Å; R849-M853 PolarHBondContact O-N 2.61Å; I850-M853 PolarHBondContact O-N 3.4Å; I851-M853 PolarHBondContact O-N 2.67Å; M853-I857 WeakPolarHBondContact O-CB 3.09Å; M853-I857 WeakPolarHBondContact O-CD1 3.42Å; M853-I857 WeakPolarHBondContact O-CG1 2.93Å; M853-I857 PolarHBondContact O-N 3.5Å; M853-F1262 HydrophobicContact CE-CE2 4.15Å; M853-F1262 HydrophobicContact SD-CD2 4.32Å; M853-F1262 HydrophobicContact SD-CE2 3.74Å; M853-V1265 HydrophobicContact CG-CG1 3.92Å; M853-V1265 HydrophobicContact SD-CG1 4.15Å; M853-L1266 HydrophobicContact CE-CD1 4.25Å; M853-L1266 HydrophobicContact SD-CD1 4.42Å; M853-Y1269 HydrophobicContact CG-CE2 4.28Å
854	L	91.4	Very high	91.8	Very high	62 Å²	62	55 Å²	55	33%	0.325	27%	0.269	S	S	.	.	H	α-helix	trans	-66.4	-42.3	178.7	-69.7	173.9	0	0	0	112.3	I296 F299 I850 I851 V852 I857 F858	I296-L854 HydrophobicContact CG1-CD2 4.17Å; I296-L854 HydrophobicContact CG2-CD2 4.16Å; F299-L854 HydrophobicContact CD1-CD2 4.38Å; I850-L854 HydrophobicContact CG2-CD1 4.15Å; I850-L854 WeakPolarHBondContact O-CG 3.43Å; I850-L854 PolarHBondContact O-N 3.39Å; I850-L854 VanDerWaalsContact O-N 3.09Å; I851-L854 PolarHBondContact O-N 3.48Å; V852-L854 VanDerWaalsContact C-N 3.33Å; V852-L854 PolarHBondContact O-N 2.93Å; L854-I857 PolarHBondContact O-N 3.17Å; L854-F858 WeakPolarHBondContact O-CB 3.39Å; L854-F858 PolarHBondContact O-N 3.35Å
855	V	94.3	Very high	91.8	Very high	73 Å²	73	57 Å²	57	44%	0.442	28%	0.278	S	S	.	.	H	α-helix	trans	-63.4	-44.9	178.6	170.3	0	0	0	0	111.2	I851 V852 F858 M859	I851-V855 HydrophobicContact CG2-CG2 4.22Å; I851-V855 WeakPolarHBondContact O-CG2 3.48Å; I851-V855 PolarHBondContact O-N 3.35Å; V852-V855 PolarHBondContact O-N 3.44Å; V855-F858 PolarHBondContact O-N 3.21Å; V855-M859 WeakPolarHBondContact O-CB 3.45Å; V855-M859 PolarHBondContact O-N 2.99Å
856	F	94.1	Very high	91.8	Very high	13 Å²	13	53.7 Å²	53.7	6%	0.057	26%	0.264	C	S	.	.	H	α-helix	trans	-72	-31.8	179.6	-82.9	-90.4	0	0	0	113.1	V852 M859 L860 M1152 A1257 H1258 V1261 F1262	V852-F856 HydrophobicContact CG1-CD2 3.77Å; V852-F856 HydrophobicContact CG1-CE2 3.91Å; V852-F856 VanDerWaalsContact O-CD2 3.32Å; V852-F856 WeakPolarHBondContact O-CD2 3.32Å; V852-F856 PolarHBondContact O-N 3.31Å; F856-M859 HydrophobicContact CD1-SD 4.47Å; F856-L860 WeakPolarHBondContact O-CB 3.35Å; F856-L860 PolarHBondContact O-N 3.12Å; F856-M1152 HydrophobicContact CB-CE 4.33Å; F856-A1257 HydrophobicContact CZ-CB 4.25Å; F856-H1258 AromaticContact CD1-CE1 3.47Å; F856-H1258 VanDerWaalsContact CD1-CE1 3.47Å; F856-H1258 WeakPolarHBondContact CD1-CE1 3.34Å; F856-H1258 AromaticContact CD1-ND1 3.74Å; F856-H1258 AromaticContact CD1-NE2 3.99Å; F856-H1258 AromaticContact CE1-CE1 3.65Å; F856-H1258 AromaticContact CE1-CG 3.92Å; F856-H1258 AromaticContact CE1-ND1 3.67Å; F856-H1258 AromaticContact CE1-NE2 3.85Å; F856-V1261 HydrophobicContact CE2-CB 4.4Å; F856-V1261 HydrophobicContact CE2-CG1 4.13Å; F856-V1261 HydrophobicContact CZ-CB 4.4Å; F856-F1262 HydrophobicContact CB-CD2 3.63Å; F856-F1262 HydrophobicContact CB-CE2 3.85Å; F856-F1262 HydrophobicContact CB-CG 4.41Å; F856-F1262 HydrophobicContact CD1-CB 3.9Å; F856-F1262 HydrophobicContact CD1-CD2 4.06Å; F856-F1262 HydrophobicContact CD1-CG 4Å; F856-F1262 HydrophobicContact CD2-CB 4.08Å; F856-F1262 AromaticContact CD2-CD2 3.96Å; F856-F1262 HydrophobicContact CD2-CD2 3.96Å; F856-F1262 HydrophobicContact CD2-CG 4.39Å; F856-F1262 HydrophobicContact CE1-CB 3.75Å; F856-F1262 HydrophobicContact CE1-CG 4.35Å; F856-F1262 HydrophobicContact CE2-CB 3.95Å; F856-F1262 HydrophobicContact CG-CB 4.05Å; F856-F1262 AromaticContact CG-CD2 3.61Å; F856-F1262 HydrophobicContact CG-CD2 3.61Å; F856-F1262 HydrophobicContact CG-CE2 4.33Å; F856-F1262 HydrophobicContact CG-CG 4.02Å; F856-F1262 HydrophobicContact CZ-CB 3.77Å
857	I	91.8	Very high	91.9	Very high	20 Å²	20	48.8 Å²	48.8	10%	0.103	25%	0.248	C	C	.	.	H	α-helix	trans	-66.1	-42.6	170.9	-71.3	167.3	0	0	0	110.8	L292 L295 I296 F299 M853 L854 L860 C861	L292-I857 HydrophobicContact CD1-CG2 4Å; L295-I857 HydrophobicContact CB-CG2 3.85Å; L295-I857 HydrophobicContact CD1-CG2 4.27Å; I296-I857 HydrophobicContact CG1-CG2 4.37Å; F299-I857 HydrophobicContact CB-CD1 4.48Å; M853-I857 WeakPolarHBondContact O-CB 3.09Å; M853-I857 WeakPolarHBondContact O-CD1 3.42Å; M853-I857 WeakPolarHBondContact O-CG1 2.93Å; M853-I857 PolarHBondContact O-N 3.5Å; L854-I857 PolarHBondContact O-N 3.17Å; I857-L860 PolarHBondContact O-N 3.48Å; I857-C861 PolarHBondContact O-N 3.22Å; I857-C861 VanDerWaalsContact O-N 3.09Å; I857-C861 PolarHBondContact O-SG 2.78Å
858	F	93.3	Very high	91.9	Very high	128 Å²	128	46.1 Å²	46.1	56%	0.561	24%	0.24	S	C	*	.	H	α-helix	trans	-61.7	-47.2	174.7	173.9	-96.3	0	0	0	111.4	L292 L854 V855 L860 C861 A862	L292-F858 HydrophobicContact CD1-CB 4.45Å; L292-F858 HydrophobicContact CD2-CD2 4.02Å; L854-F858 WeakPolarHBondContact O-CB 3.39Å; L854-F858 PolarHBondContact O-N 3.35Å; V855-F858 PolarHBondContact O-N 3.21Å; F858-L860 PolarHBondContact O-N 3.19Å; F858-C861 PolarHBondContact O-N 2.88Å; F858-A862 WeakPolarHBondContact O-CB 3.33Å; F858-A862 PolarHBondContact O-N 3.32Å
859	M	93.4	Very high	91.7	Very high	60 Å²	60	47.8 Å²	47.8	30%	0.296	25%	0.247	S	C	.	.	H	α-helix	trans	-55.3	-50.7	176.6	-172.4	-177.8	-66.5	0	0	110.8	V855 F856 C861 A862 S863 L1254	V855-M859 WeakPolarHBondContact O-CB 3.45Å; V855-M859 PolarHBondContact O-N 2.99Å; F856-M859 HydrophobicContact CD1-SD 4.47Å; M859-C861 PolarHBondContact O-N 2.87Å; M859-A862 PolarHBondContact O-N 2.84Å; M859-S863 WeakPolarHBondContact O-CB 3.11Å; M859-S863 PolarHBondContact O-N 3.25Å; M859-S863 PolarHBondContact O-OG 3.06Å; M859-L1254 HydrophobicContact SD-CD2 4.43Å
860	L	91.9	Very high	91.7	Very high	33 Å²	33	47.9 Å²	47.9	17%	0.173	25%	0.251	C	S	.	.	H	α-helix	trans	-57	-46.5	178	179.4	65	0	0	0	112.6	F856 I857 F858 S863 I864 M1152 V1155	F856-L860 WeakPolarHBondContact O-CB 3.35Å; F856-L860 PolarHBondContact O-N 3.12Å; I857-L860 PolarHBondContact O-N 3.48Å; F858-L860 PolarHBondContact O-N 3.19Å; L860-S863 PolarHBondContact O-N 3.43Å; L860-I864 HydrophobicContact CD1-CD1 4.26Å; L860-I864 HydrophobicContact CD1-CG1 4.49Å; L860-I864 HydrophobicContact CG-CD1 4.06Å; L860-I864 VanDerWaalsContact O-CG1 3.27Å; L860-I864 WeakPolarHBondContact O-CG1 3.25Å; L860-I864 PolarHBondContact O-N 3.09Å; L860-M1152 HydrophobicContact CB-CE 4.29Å; L860-M1152 HydrophobicContact CD1-CG 4.14Å; L860-M1152 HydrophobicContact CD2-CE 4.27Å; L860-M1152 HydrophobicContact CD2-CG 4.26Å; L860-V1155 HydrophobicContact CD1-CB 4.15Å; L860-V1155 HydrophobicContact CD1-CG1 3.8Å
861	C	92.3	Very high	91.6	Very high	5 Å²	5	51.7 Å²	51.7	3%	0.034	27%	0.266	C	S	.	.	H	α-helix	trans	-67.8	-38.2	-179.2	-62.8	0	0	0	0	112.1	L292 I857 F858 M859 I864 F865	L292-C861 HydrophobicContact CB-CB 4.07Å; L292-C861 HydrophobicContact CD1-CB 4.08Å; I857-C861 PolarHBondContact O-N 3.22Å; I857-C861 VanDerWaalsContact O-N 3.09Å; I857-C861 PolarHBondContact O-SG 2.78Å; F858-C861 PolarHBondContact O-N 2.88Å; M859-C861 PolarHBondContact O-N 2.87Å; C861-I864 PolarHBondContact O-N 3.07Å; C861-F865 PolarHBondContact O-N 3.27Å
862	A	92.1	Very high	91.6	Very high	35 Å²	35	48.7 Å²	48.7	29%	0.289	25%	0.252	S	S	.	.	H	α-helix	trans	-64.4	-43.3	174.1	0	0	0	0	0	111.2	F858 M859 F865 L866	F858-A862 WeakPolarHBondContact O-CB 3.33Å; F858-A862 PolarHBondContact O-N 3.32Å; M859-A862 PolarHBondContact O-N 2.84Å; A862-F865 PolarHBondContact O-N 2.92Å; A862-L866 VanDerWaalsContact O-CG 3.32Å; A862-L866 WeakPolarHBondContact O-CG 3.39Å; A862-L866 PolarHBondContact O-N 2.97Å
863	S	93.2	Very high	91.5	Very high	7 Å²	7	47.7 Å²	47.7	5%	0.049	25%	0.246	C	C	.	.	H	α-helix	trans	-63.6	-39.6	176.7	-60.4	0	0	0	0	112.7	M859 L860 F865 L866 M867 D1156	M859-S863 WeakPolarHBondContact O-CB 3.11Å; M859-S863 PolarHBondContact O-N 3.25Å; M859-S863 PolarHBondContact O-OG 3.06Å; L860-S863 PolarHBondContact O-N 3.43Å; S863-F865 VanDerWaalsContact C-N 3.33Å; S863-F865 PolarHBondContact O-N 2.59Å; S863-L866 PolarHBondContact O-N 3.45Å; S863-M867 VanDerWaalsContact O-CB 3.26Å; S863-M867 WeakPolarHBondContact O-CB 3.09Å; S863-M867 PolarHBondContact O-N 2.89Å; S863-D1156 WeakPolarHBondContact CB-OD1 3.39Å; S863-D1156 WeakPolarHBondContact OG-CA 3.39Å; S863-D1156 PolarHBondContact OG-OD1 3.08Å
864	I	91.5	Very high	91.4	Very high	50 Å²	50	48.4 Å²	48.4	26%	0.256	25%	0.25	S	S	.	.	H	α-helix	trans	-60.9	-42.6	174.3	-71.1	166.2	0	0	0	110.9	L291 L860 C861 L868 V1155	L291-I864 HydrophobicContact CD2-CD1 4.14Å; L860-I864 HydrophobicContact CD1-CD1 4.26Å; L860-I864 HydrophobicContact CD1-CG1 4.49Å; L860-I864 HydrophobicContact CG-CD1 4.06Å; L860-I864 VanDerWaalsContact O-CG1 3.27Å; L860-I864 WeakPolarHBondContact O-CG1 3.25Å; L860-I864 PolarHBondContact O-N 3.09Å; C861-I864 PolarHBondContact O-N 3.07Å; I864-L868 WeakPolarHBondContact O-CG 3.14Å; I864-V1155 HydrophobicContact CG1-CG1 3.78Å
865	F	91.4	Very high	91.1	Very high	47 Å²	47	47.8 Å²	47.8	21%	0.206	25%	0.247	C	C	.	.	H	α-helix	trans	-63.6	-44.9	175.4	168.8	-105.9	0	0	0	111.9	L285 C861 A862 S863 L868 N869	L285-F865 HydrophobicContact CB-CD2 3.97Å; L285-F865 HydrophobicContact CB-CE2 3.62Å; L285-F865 HydrophobicContact CB-CZ 4.32Å; L285-F865 HydrophobicContact CD1-CE1 4.26Å; L285-F865 HydrophobicContact CD1-CE2 3.97Å; L285-F865 HydrophobicContact CD1-CZ 3.81Å; L285-F865 HydrophobicContact CG-CE2 4.29Å; C861-F865 PolarHBondContact O-N 3.27Å; A862-F865 PolarHBondContact O-N 2.92Å; S863-F865 VanDerWaalsContact C-N 3.33Å; S863-F865 PolarHBondContact O-N 2.59Å; F865-L868 PolarHBondContact O-N 2.63Å; F865-N869 PolarHBondContact O-ND2 3Å; F865-N869 VanDerWaalsContact O-ND2 3.1Å
866	L	92.1	Very high	90.6	Very high	32 Å²	32	47.7 Å²	47.7	17%	0.168	24%	0.242	C	C	.	.	H	α-helix	trans	-66	-41.1	-179.9	-71.5	165	0	0	0	112	A862 S863 L868 N869 T1162 L1163	A862-L866 VanDerWaalsContact O-CG 3.32Å; A862-L866 WeakPolarHBondContact O-CG 3.39Å; A862-L866 PolarHBondContact O-N 2.97Å; S863-L866 PolarHBondContact O-N 3.45Å; L866-L868 PolarHBondContact O-N 3.15Å; L866-L868 VanDerWaalsContact O-N 3.11Å; L866-N869 PolarHBondContact O-N 2.85Å; L866-T1162 HydrophobicContact CD2-CG2 4.48Å; L866-T1162 PolarHBondContact O-OG1 2.84Å; L866-T1162 VanDerWaalsContact O-OG1 3.11Å; L866-L1163 HydrophobicContact CD1-CD1 3.76Å; L866-L1163 HydrophobicContact CD1-CD2 3.87Å; L866-L1163 HydrophobicContact CD1-CG 3.69Å; L866-L1163 HydrophobicContact CD2-CD2 3.78Å; L866-L1163 HydrophobicContact CD2-CG 4.24Å; L866-L1163 HydrophobicContact CG-CD2 4.49Å
867	M	89.8	Confident	90.2	Very high	57 Å²	57	50 Å²	50	28%	0.281	25%	0.253	S	S	.	.	H	α-helix	trans	-52.5	-34.3	176.6	170.9	-176.9	-74.2	0	0	112.6	S863 N869 V870 V1155 V1158	S863-M867 VanDerWaalsContact O-CB 3.26Å; S863-M867 WeakPolarHBondContact O-CB 3.09Å; S863-M867 PolarHBondContact O-N 2.89Å; M867-N869 PolarHBondContact O-N 3.13Å; M867-V870 VanDerWaalsContact O-CG1 3.28Å; M867-V870 WeakPolarHBondContact O-CG1 3.34Å; M867-V870 PolarHBondContact O-N 3.28Å; M867-V1155 HydrophobicContact CE-CB 4.04Å; M867-V1155 HydrophobicContact CE-CG1 3.89Å; M867-V1155 HydrophobicContact CE-CG2 3.98Å; M867-V1158 HydrophobicContact CB-CG1 4.06Å; M867-V1158 HydrophobicContact CE-CB 3.68Å; M867-V1158 HydrophobicContact CE-CG1 3.86Å; M867-V1158 HydrophobicContact CE-CG2 4.17Å; M867-V1158 HydrophobicContact CG-CG1 3.74Å
868	L	87.3	Confident	89.9	Confident	88 Å²	88	50.4 Å²	50.4	46%	0.461	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-12.9	-179.9	-64.8	167.9	0	0	0	113.7	F284 I864 F865 L866	F284-L868 HydrophobicContact CB-CD1 3.77Å; F284-L868 HydrophobicContact CD1-CD1 3.53Å; F284-L868 HydrophobicContact CE1-CD1 4.23Å; F284-L868 HydrophobicContact CG-CD1 3.74Å; I864-L868 WeakPolarHBondContact O-CG 3.14Å; F865-L868 PolarHBondContact O-N 2.63Å; L866-L868 PolarHBondContact O-N 3.15Å; L866-L868 VanDerWaalsContact O-N 3.11Å
869	N	88.3	Confident	89.4	Confident	74 Å²	74	45.6 Å²	45.6	40%	0.396	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.8	9.3	177.8	-61	-66.7	0	0	0	112.7	F865 L866 M867 K871 T1162	F865-N869 PolarHBondContact O-ND2 3Å; F865-N869 VanDerWaalsContact O-ND2 3.1Å; L866-N869 PolarHBondContact O-N 2.85Å; M867-N869 PolarHBondContact O-N 3.13Å; N869-K871 PolarHBondContact O-N 2.68Å; N869-T1162 HydrophobicContact CB-CG2 4.2Å
870	V	89.3	Confident	88.9	Confident	33 Å²	33	42.7 Å²	42.7	20%	0.2	23%	0.225	C	C	.	.			trans	-65.2	130.9	178	74.7	0	0	0	0	110	M867	M867-V870 VanDerWaalsContact O-CG1 3.28Å; M867-V870 WeakPolarHBondContact O-CG1 3.34Å; M867-V870 PolarHBondContact O-N 3.28Å
871	K	90.3	Very high	88.6	Confident	135 Å²	135	41.3 Å²	41.3	59%	0.587	22%	0.217	S	C	*	.			trans	-76.2	138.7	174.3	-66.3	-177.3	-178.8	-176.9	0	109.4	N869 D1167 Y1168	N869-K871 PolarHBondContact O-N 2.68Å; K871-D1167 WeakPolarHBondContact CB-OD1 3.23Å; K871-Y1168 WeakPolarHBondContact O-CB 3.43Å; K871-Y1168 PolarHBondContact O-N 3.13Å
872	V	91.6	Very high	88	Confident	38 Å²	38	47 Å²	47	23%	0.23	24%	0.242	C	C	.	.	B	Isolated β-bridge	trans	-105	131.9	175.3	-177.5	0	0	0	0	108.3	Q1065 Y1110 I1113 V1114 Y1168	V872-Q1065 PolarHBondContact O-NE2 3.2Å; V872-Q1065 VanDerWaalsContact O-NE2 3.08Å; V872-Y1110 HydrophobicContact CG1-CD1 4.09Å; V872-I1113 HydrophobicContact CG1-CG2 3.57Å; V872-V1114 HydrophobicContact CG1-CG2 4.44Å; V872-V1114 HydrophobicContact CG2-CG2 3.77Å; V872-Y1168 WeakPolarHBondContact CA-O 3.31Å
873	G	90.4	Very high	87.6	Confident	0 Å²	0	49 Å²	49	0%	0	27%	0.265	C	S	.	.			trans	137.8	170.3	-178.7	0	0	0	0	0	113.4	D1167 Y1168	G873-D1167 VanDerWaalsContact O-CB 3.26Å; G873-D1167 WeakPolarHBondContact O-CB 3.46Å; G873-Y1168 PolarHBondContact N-O 2.87Å
874	L	88.9	Confident	87.4	Confident	27 Å²	27	48.8 Å²	48.8	14%	0.141	26%	0.264	C	S	.	.			trans	-135.1	118.9	164.5	-178.5	73.6	0	0	0	106.6	L878 Y1110 N1169 F1243	L874-L878 HydrophobicContact CD1-CB 4.13Å; L874-L878 HydrophobicContact CD1-CD1 4.06Å; L874-Y1110 VanDerWaalsContact CB-OH 3.26Å; L874-Y1110 WeakPolarHBondContact CB-OH 3.48Å; L874-Y1110 PolarHBondContact N-OH 2.03Å; L874-N1169 HydrophobicContact CB-CB 4.22Å; L874-N1169 WeakPolarHBondContact CD1-ND2 3.14Å; L874-F1243 HydrophobicContact CD1-CE2 3.5Å; L874-F1243 VanDerWaalsContact CD1-CE2 3.5Å; L874-F1243 HydrophobicContact CD1-CZ 3.56Å
875	D	86.7	Confident	87.4	Confident	48 Å²	48	48.1 Å²	48.1	26%	0.257	26%	0.258	S	S	.	.			trans	-74.7	137.7	173.3	-62.8	-27.1	0	0	0	109.3	E877 L878 S1064	D875-E877 PolarHBondContact O-N 2.66Å; D875-L878 HydrophobicContact CB-CD1 4.45Å; D875-L878 HydrophobicContact CB-CG 4.48Å; D875-L878 WeakPolarHBondContact O-CB 3.33Å; D875-L878 PolarHBondContact O-N 3.09Å; D875-S1064 VanDerWaalsContact OD1-CB 3.25Å; D875-S1064 WeakPolarHBondContact OD1-CB 3.43Å; D875-S1064 PolarHBondContact OD1-N 2.91Å; D875-S1064 PolarHBondContact OD1-OG 3.3Å
876	Q	83.7	Confident	87.4	Confident	71 Å²	71	45.9 Å²	45.9	33%	0.332	25%	0.249	S	C	.	.	G	3₁₀ helix	trans	-61.3	-31.4	-172.2	-62.3	177.7	8.5	0	0	112.1	L878 A879 F890 Y1107	Q876-L878 PolarHBondContact O-N 2.04Å; Q876-A879 WeakPolarHBondContact O-CB 3.26Å; Q876-A879 PolarHBondContact O-N 3.47Å; Q876-A879 VanDerWaalsContact O-N 3.12Å; Q876-F890 HydrophobicContact CB-CE2 4.38Å; Q876-F890 HydrophobicContact CB-CZ 4.13Å; Q876-Y1107 WeakPolarHBondContact CG-OH 3.36Å; Q876-Y1107 PolarHBondContact NE2-OH 2.91Å
877	E	85.2	Confident	87.4	Confident	62 Å²	62	45.4 Å²	45.4	29%	0.29	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	-57.2	-32.8	176.6	-60.8	179.5	-173.3	0	0	112.4	D875 A879 M880 L887 F890 N894	D875-E877 PolarHBondContact O-N 2.66Å; E877-A879 VanDerWaalsContact C-N 3.26Å; E877-A879 PolarHBondContact O-N 3.36Å; E877-M880 PolarHBondContact O-N 3.01Å; E877-L887 HydrophobicContact CB-CD2 3.89Å; E877-L887 HydrophobicContact CG-CD2 4.44Å; E877-L887 WeakPolarHBondContact O-CD2 3.23Å; E877-F890 HydrophobicContact CG-CB 3.89Å; E877-F890 HydrophobicContact CG-CD2 3.95Å; E877-F890 HydrophobicContact CG-CG 4.15Å; E877-N894 PolarHBondContact OE1-ND2 3.22Å
878	L	85.1	Confident	87.5	Confident	29 Å²	29	46.5 Å²	46.5	15%	0.152	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-72.4	-18.3	-178.7	-62.3	175.5	0	0	0	113.4	L874 D875 Q876 M880 Q1238 L1239 I1242	L874-L878 HydrophobicContact CD1-CB 4.13Å; L874-L878 HydrophobicContact CD1-CD1 4.06Å; D875-L878 HydrophobicContact CB-CD1 4.45Å; D875-L878 HydrophobicContact CB-CG 4.48Å; D875-L878 WeakPolarHBondContact O-CB 3.33Å; D875-L878 PolarHBondContact O-N 3.09Å; Q876-L878 PolarHBondContact O-N 2.04Å; L878-M880 VanDerWaalsContact C-N 3.29Å; L878-Q1238 WeakPolarHBondContact O-CB 3.42Å; L878-L1239 PolarHBondContact O-N 2.93Å; L878-I1242 HydrophobicContact CD2-CD1 3.8Å
879	A	82.3	Confident	87.7	Confident	26 Å²	26	42.8 Å²	42.8	22%	0.215	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-79.4	-15.3	175	0	0	0	0	0	112.3	Q876 E877	Q876-A879 WeakPolarHBondContact O-CB 3.26Å; Q876-A879 PolarHBondContact O-N 3.47Å; Q876-A879 VanDerWaalsContact O-N 3.12Å; E877-A879 VanDerWaalsContact C-N 3.26Å; E877-A879 PolarHBondContact O-N 3.36Å
880	M	84.4	Confident	87.9	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	22%	0.217	C	C	.	.	S	Bend	trans	-90	150.3	-176.4	-61.5	-62	-173.2	0	0	112.5	L623 E626 E877 L878 M886 L887 F890	L623-M880 HydrophobicContact CB-CE 4.48Å; L623-M880 HydrophobicContact CD1-CE 3.11Å; L623-M880 HydrophobicContact CD1-SD 4.39Å; L623-M880 HydrophobicContact CG-CE 4.35Å; E626-M880 HydrophobicContact CB-SD 4Å; E877-M880 PolarHBondContact O-N 3.01Å; L878-M880 VanDerWaalsContact C-N 3.29Å; M880-M886 HydrophobicContact CE-CB 3.71Å; M880-M886 HydrophobicContact CE-CE 4.23Å; M880-M886 HydrophobicContact CE-CG 3.85Å; M880-M886 HydrophobicContact CG-CB 4.21Å; M880-M886 HydrophobicContact SD-CB 3.96Å; M880-M886 HydrophobicContact SD-CG 4.32Å; M880-L887 HydrophobicContact CB-CD2 3.81Å; M880-L887 HydrophobicContact CB-CG 3.92Å; M880-L887 HydrophobicContact CG-CD2 4.39Å; M880-F890 HydrophobicContact CE-CE2 3.74Å; M880-F890 HydrophobicContact CE-CZ 4.17Å; M880-F890 HydrophobicContact CG-CE2 4.19Å
881	P	84.6	Confident	88	Confident	3 Å²	3	43.4 Å²	43.4	2%	0.019	23%	0.231	C	C	.	.	B	Isolated β-bridge	trans	-73.2	151.3	175.7	29	-32.1	0	0	0	111.6	T630 G883 S884 L887	T630-P881 HydrophobicContact CG2-CB 4.03Å; T630-P881 WeakPolarHBondContact OG1-CB 3.41Å; T630-P881 VanDerWaalsContact OG1-CD 3.25Å; T630-P881 WeakPolarHBondContact OG1-CD 3.42Å; T630-P881 WeakPolarHBondContact OG1-CG 3.48Å; P881-G883 PolarHBondContact O-N 3.03Å; P881-S884 PolarHBondContact O-N 3.25Å; P881-S884 VanDerWaalsContact O-N 3.08Å; P881-L887 VanDerWaalsContact O-CD1 3.25Å; P881-L887 WeakPolarHBondContact O-CD1 3.39Å
882	K	80.1	Confident	88.1	Confident	126 Å²	126	39.4 Å²	39.4	55%	0.548	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	108.6	174.2	-70.1	180	174.9	175.1	0	109.6	Q1238	K882-Q1238 HydrophobicContact CD-CG 4.39Å; K882-Q1238 HydrophobicContact CG-CG 3.71Å
883	G	84.3	Confident	88.1	Confident	76 Å²	76	39.6 Å²	39.6	78%	0.784	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	107.4	7.5	-176.3	0	0	0	0	0	115.1	P881	P881-G883 PolarHBondContact O-N 3.03Å
884	S	89.1	Confident	88.1	Confident	3 Å²	3	42.6 Å²	42.6	2%	0.021	23%	0.228	C	C	.	.			trans	-68.1	139.8	169.2	-168.1	0	0	0	0	111.7	E626 P881 M886 L887	E626-S884 VanDerWaalsContact CD-OG 3.27Å; E626-S884 WeakPolarHBondContact CG-OG 3.49Å; E626-S884 WeakPolarHBondContact OE2-CB 3.42Å; E626-S884 PolarHBondContact OE2-OG 3.08Å; P881-S884 PolarHBondContact O-N 3.25Å; P881-S884 VanDerWaalsContact O-N 3.08Å; S884-M886 PolarHBondContact O-N 2.74Å; S884-M886 PolarHBondContact OG-N 3.38Å; S884-L887 PolarHBondContact O-N 3.39Å; S884-L887 VanDerWaalsContact O-N 3.15Å
885	Y	91	Very high	88.2	Confident	36 Å²	36	47.5 Å²	47.5	14%	0.141	25%	0.248	C	C	.	.	H	α-helix	trans	-61.7	-22.8	170.5	63.4	-92.2	0	0	0	112.4	Y617 S622 E626 L887 D888 Y889	Y617-Y885 AromaticContact CD2-CD2 3.9Å; Y617-Y885 HydrophobicContact CD2-CD2 3.9Å; Y617-Y885 HydrophobicContact CD2-CE2 4.01Å; Y617-Y885 HydrophobicContact CE1-CD2 4.43Å; Y617-Y885 HydrophobicContact CE1-CG 4.48Å; Y617-Y885 HydrophobicContact CE2-CD1 4.42Å; Y617-Y885 AromaticContact CE2-CD2 3.37Å; Y617-Y885 HydrophobicContact CE2-CD2 3.37Å; Y617-Y885 AromaticContact CE2-CE2 3.53Å; Y617-Y885 HydrophobicContact CE2-CE2 3.53Å; Y617-Y885 AromaticContact CE2-CG 3.86Å; Y617-Y885 HydrophobicContact CE2-CG 3.86Å; Y617-Y885 AromaticContact CZ-CD2 3.68Å; Y617-Y885 AromaticContact CZ-CG 3.71Å; S622-Y885 WeakPolarHBondContact CB-OH 3.15Å; S622-Y885 PolarHBondContact OG-OH 3.39Å; E626-Y885 HydrophobicContact CG-CE1 4.03Å; Y885-L887 VanDerWaalsContact C-N 3.29Å; Y885-L887 PolarHBondContact O-N 3.22Å; Y885-D888 PolarHBondContact O-N 3.02Å; Y885-Y889 PolarHBondContact O-N 3.15Å; Y885-Y889 VanDerWaalsContact O-N 3.11Å
886	M	90.8	Very high	88.4	Confident	0 Å²	0	46 Å²	46	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-66	-29.8	176	-76.7	-59.1	-44.2	0	0	113.1	M618 E626 M880 S884 Y889 F890	M618-M886 HydrophobicContact CB-CE 4.3Å; M618-M886 HydrophobicContact CB-SD 4.16Å; M618-M886 HydrophobicContact CG-CE 3.97Å; M618-M886 HydrophobicContact CG-SD 4.02Å; M618-M886 HydrophobicContact SD-CE 4.16Å; E626-M886 HydrophobicContact CG-CG 4.2Å; M880-M886 HydrophobicContact CE-CB 3.71Å; M880-M886 HydrophobicContact CE-CE 4.23Å; M880-M886 HydrophobicContact CE-CG 3.85Å; M880-M886 HydrophobicContact CG-CB 4.21Å; M880-M886 HydrophobicContact SD-CB 3.96Å; M880-M886 HydrophobicContact SD-CG 4.32Å; S884-M886 PolarHBondContact O-N 2.74Å; S884-M886 PolarHBondContact OG-N 3.38Å; M886-Y889 HydrophobicContact CE-CD1 3.67Å; M886-Y889 HydrophobicContact CE-CE1 4.33Å; M886-Y889 HydrophobicContact CE-CG 4.35Å; M886-Y889 WeakPolarHBondContact O-CB 3.46Å; M886-Y889 PolarHBondContact O-N 3.38Å; M886-F890 HydrophobicContact CB-CE2 4.47Å; M886-F890 HydrophobicContact CE-CE1 4.22Å; M886-F890 HydrophobicContact CE-CE2 3.92Å; M886-F890 HydrophobicContact CE-CZ 3.74Å; M886-F890 WeakPolarHBondContact O-CD2 3.35Å; M886-F890 PolarHBondContact O-N 2.94Å
887	L	91.3	Very high	88.6	Confident	21 Å²	21	44.3 Å²	44.3	11%	0.11	23%	0.231	C	C	.	.	H	α-helix	trans	-66.6	-41.6	175.9	-71.7	174.9	0	0	0	111	E877 M880 P881 S884 Y885 Y889 F890 Q891	E877-L887 HydrophobicContact CB-CD2 3.89Å; E877-L887 HydrophobicContact CG-CD2 4.44Å; E877-L887 WeakPolarHBondContact O-CD2 3.23Å; M880-L887 HydrophobicContact CB-CD2 3.81Å; M880-L887 HydrophobicContact CB-CG 3.92Å; M880-L887 HydrophobicContact CG-CD2 4.39Å; P881-L887 VanDerWaalsContact O-CD1 3.25Å; P881-L887 WeakPolarHBondContact O-CD1 3.39Å; S884-L887 PolarHBondContact O-N 3.39Å; S884-L887 VanDerWaalsContact O-N 3.15Å; Y885-L887 VanDerWaalsContact C-N 3.29Å; Y885-L887 PolarHBondContact O-N 3.22Å; L887-Y889 VanDerWaalsContact C-N 3.29Å; L887-Y889 PolarHBondContact O-N 3.45Å; L887-F890 PolarHBondContact O-N 2.85Å; L887-Q891 WeakPolarHBondContact O-CG 3.44Å; L887-Q891 PolarHBondContact O-N 2.03Å; L887-Q891 VanDerWaalsContact O-N 3.08Å
888	D	92.1	Very high	88.7	Confident	81 Å²	81	44.9 Å²	44.9	43%	0.433	23%	0.233	S	C	.	.	H	α-helix	trans	-64.7	-38.5	175.7	-61.6	-25.3	0	0	0	110.5	Y885 Q891 Y892	Y885-D888 PolarHBondContact O-N 3.02Å; D888-Q891 PolarHBondContact O-N 3.31Å; D888-Y892 WeakPolarHBondContact O-CD2 3.36Å; D888-Y892 PolarHBondContact O-N 2.87Å
889	Y	93.1	Very high	88.8	Confident	9 Å²	9	44 Å²	44	4%	0.035	23%	0.229	C	C	.	.	H	α-helix	trans	-60.4	-49.2	173.6	174.1	-96.2	0	0	0	112.8	Q411 I413 M618 Y885 M886 L887 Q891 Y892 L893	Q411-Y889 HydrophobicContact CB-CE2 4.15Å; Q411-Y889 PolarHBondContact OE1-OH 2.64Å; I413-Y889 HydrophobicContact CD1-CD2 4.3Å; I413-Y889 HydrophobicContact CD1-CE2 4.04Å; I413-Y889 HydrophobicContact CG1-CE2 4.44Å; M618-Y889 HydrophobicContact CB-CD1 3.89Å; M618-Y889 HydrophobicContact CB-CD2 3.78Å; M618-Y889 HydrophobicContact CB-CE1 3.74Å; M618-Y889 HydrophobicContact CB-CE2 3.62Å; M618-Y889 HydrophobicContact CB-CG 3.89Å; M618-Y889 HydrophobicContact CG-CD1 4.45Å; M618-Y889 HydrophobicContact CG-CE1 4.11Å; M618-Y889 HydrophobicContact SD-CD1 4.11Å; M618-Y889 HydrophobicContact SD-CE1 3.35Å; M618-Y889 WeakPolarHBondContact SD-CE1 3.44Å; Y885-Y889 PolarHBondContact O-N 3.15Å; Y885-Y889 VanDerWaalsContact O-N 3.11Å; M886-Y889 HydrophobicContact CE-CD1 3.67Å; M886-Y889 HydrophobicContact CE-CE1 4.33Å; M886-Y889 HydrophobicContact CE-CG 4.35Å; M886-Y889 WeakPolarHBondContact O-CB 3.46Å; M886-Y889 PolarHBondContact O-N 3.38Å; L887-Y889 VanDerWaalsContact C-N 3.29Å; L887-Y889 PolarHBondContact O-N 3.45Å; Y889-Q891 VanDerWaalsContact C-N 3.3Å; Y889-Q891 PolarHBondContact O-N 2.99Å; Y889-Y892 PolarHBondContact O-N 3.44Å; Y889-Y892 VanDerWaalsContact O-N 3.17Å; Y889-L893 HydrophobicContact CE1-CD2 4.24Å; Y889-L893 WeakPolarHBondContact O-CB 3.45Å; Y889-L893 PolarHBondContact O-N 3.34Å
890	F	91.8	Very high	89.1	Confident	14 Å²	14	43.2 Å²	43.2	6%	0.061	22%	0.224	C	C	.	.	H	α-helix	trans	-62.4	-38	177.9	-69.2	-52.6	0	0	0	112.5	Q876 E877 M880 M886 L887 Y892 L893 N894	Q876-F890 HydrophobicContact CB-CE2 4.38Å; Q876-F890 HydrophobicContact CB-CZ 4.13Å; E877-F890 HydrophobicContact CG-CB 3.89Å; E877-F890 HydrophobicContact CG-CD2 3.95Å; E877-F890 HydrophobicContact CG-CG 4.15Å; M880-F890 HydrophobicContact CE-CE2 3.74Å; M880-F890 HydrophobicContact CE-CZ 4.17Å; M880-F890 HydrophobicContact CG-CE2 4.19Å; M886-F890 HydrophobicContact CB-CE2 4.47Å; M886-F890 HydrophobicContact CE-CE1 4.22Å; M886-F890 HydrophobicContact CE-CE2 3.92Å; M886-F890 HydrophobicContact CE-CZ 3.74Å; M886-F890 WeakPolarHBondContact O-CD2 3.35Å; M886-F890 PolarHBondContact O-N 2.94Å; L887-F890 PolarHBondContact O-N 2.85Å; F890-Y892 VanDerWaalsContact C-N 3.35Å; F890-Y892 PolarHBondContact O-N 2.92Å; F890-L893 HydrophobicContact CD1-CD2 4.5Å; F890-L893 PolarHBondContact O-N 2.93Å; F890-N894 WeakPolarHBondContact O-CB 3.15Å; F890-N894 VanDerWaalsContact O-CG 3.23Å; F890-N894 PolarHBondContact O-N 3.11Å; F890-N894 PolarHBondContact O-ND2 3.32Å
891	Q	91.9	Very high	89.4	Confident	107 Å²	107	45.1 Å²	45.1	50%	0.5	24%	0.236	S	C	.	.	H	α-helix	trans	-62.6	-41.9	174.4	-71.5	174.7	15.2	0	0	112.1	L887 D888 Y889 K895	L887-Q891 WeakPolarHBondContact O-CG 3.44Å; L887-Q891 PolarHBondContact O-N 2.03Å; L887-Q891 VanDerWaalsContact O-N 3.08Å; D888-Q891 PolarHBondContact O-N 3.31Å; Y889-Q891 VanDerWaalsContact C-N 3.3Å; Y889-Q891 PolarHBondContact O-N 2.99Å; Q891-K895 VanDerWaalsContact O-CB 3.27Å; Q891-K895 WeakPolarHBondContact O-CB 3.32Å; Q891-K895 PolarHBondContact O-N 3.43Å; Q891-K895 VanDerWaalsContact O-N 3.11Å
892	Y	92.5	Very high	89.8	Confident	51 Å²	51	45.9 Å²	45.9	20%	0.2	24%	0.24	C	C	.	.	H	α-helix	trans	-69.6	-41	178	-85.5	-130.4	0	0	0	111.3	I413 T415 A616 D888 Y889 F890 K895 Y896	I413-Y892 HydrophobicContact CB-CD1 4.21Å; I413-Y892 HydrophobicContact CG2-CD1 3.87Å; T415-Y892 HydrophobicContact CG2-CD1 4.15Å; T415-Y892 HydrophobicContact CG2-CE1 3.68Å; A616-Y892 HydrophobicContact CB-CD1 3.87Å; A616-Y892 HydrophobicContact CB-CD2 4.22Å; A616-Y892 HydrophobicContact CB-CE1 4.42Å; A616-Y892 HydrophobicContact CB-CG 3.77Å; D888-Y892 WeakPolarHBondContact O-CD2 3.36Å; D888-Y892 PolarHBondContact O-N 2.87Å; Y889-Y892 PolarHBondContact O-N 3.44Å; Y889-Y892 VanDerWaalsContact O-N 3.17Å; F890-Y892 VanDerWaalsContact C-N 3.35Å; F890-Y892 PolarHBondContact O-N 2.92Å; Y892-K895 PolarHBondContact O-N 3.21Å; Y892-Y896 AromaticContact CD1-CD2 3.93Å; Y892-Y896 HydrophobicContact CD1-CD2 3.93Å; Y892-Y896 AromaticContact CD1-CE2 3.76Å; Y892-Y896 HydrophobicContact CD1-CE2 3.76Å; Y892-Y896 HydrophobicContact CD2-CE2 4.48Å; Y892-Y896 HydrophobicContact CE1-CE2 4.08Å; Y892-Y896 HydrophobicContact CG-CD2 4.05Å; Y892-Y896 AromaticContact CG-CE2 3.98Å; Y892-Y896 HydrophobicContact CG-CE2 3.98Å; Y892-Y896 WeakPolarHBondContact O-CB 3.46Å; Y892-Y896 WeakPolarHBondContact O-CD2 3.19Å; Y892-Y896 PolarHBondContact O-N 3.5Å
893	L	91.2	Very high	90.5	Very high	42 Å²	42	39.9 Å²	39.9	22%	0.22	21%	0.214	C	C	.	.	H	α-helix	trans	-58.2	-50.7	174.9	-174.2	72.5	0	0	0	110.7	I413 Y889 F890 K895 F897	I413-L893 HydrophobicContact CD1-CB 4.44Å; Y889-L893 HydrophobicContact CE1-CD2 4.24Å; Y889-L893 WeakPolarHBondContact O-CB 3.45Å; Y889-L893 PolarHBondContact O-N 3.34Å; F890-L893 HydrophobicContact CD1-CD2 4.5Å; F890-L893 PolarHBondContact O-N 2.93Å; L893-K895 VanDerWaalsContact C-N 3.25Å; L893-K895 PolarHBondContact O-N 3.08Å; L893-F897 HydrophobicContact CD1-CB 3.91Å; L893-F897 HydrophobicContact CD1-CD1 3.97Å; L893-F897 HydrophobicContact CD1-CD2 4.25Å; L893-F897 HydrophobicContact CD1-CG 3.8Å; L893-F897 HydrophobicContact CG-CB 4.47Å; L893-F897 WeakPolarHBondContact O-CB 3.3Å; L893-F897 PolarHBondContact O-N 3.08Å; L893-F897 VanDerWaalsContact O-N 3.14Å
894	N	90.6	Very high	91	Very high	62 Å²	62	36.6 Å²	36.6	33%	0.332	18%	0.178	S	C	.	.	H	α-helix	trans	-64.8	-27.3	180	-72.4	-24.5	0	0	0	113.3	E877 F890 T1062	E877-N894 PolarHBondContact OE1-ND2 3.22Å; F890-N894 WeakPolarHBondContact O-CB 3.15Å; F890-N894 VanDerWaalsContact O-CG 3.23Å; F890-N894 PolarHBondContact O-N 3.11Å; F890-N894 PolarHBondContact O-ND2 3.32Å; N894-T1062 HydrophobicContact CB-CG2 4.35Å
895	K	90.9	Very high	91.3	Very high	130 Å²	130	36.4 Å²	36.4	57%	0.565	18%	0.177	S	C	*	.	H	α-helix	trans	-90.3	-39	-176.8	-174.8	178.9	174.2	-163.2	0	113.6	Q891 Y892 L893	Q891-K895 VanDerWaalsContact O-CB 3.27Å; Q891-K895 WeakPolarHBondContact O-CB 3.32Å; Q891-K895 PolarHBondContact O-N 3.43Å; Q891-K895 VanDerWaalsContact O-N 3.11Å; Y892-K895 PolarHBondContact O-N 3.21Å; L893-K895 VanDerWaalsContact C-N 3.25Å; L893-K895 PolarHBondContact O-N 3.08Å
896	Y	91.3	Very high	91.5	Very high	18 Å²	18	34.7 Å²	34.7	7%	0.071	17%	0.17	C	C	.	.	H	α-helix	trans	-110.8	-17.4	-165.9	-63.4	-61	0	0	0	114.3	I413 T415 G559 G560 E570 A571 Y892	I413-Y896 HydrophobicContact CG2-CD2 4.23Å; T415-Y896 HydrophobicContact CG2-CD2 4.33Å; T415-Y896 HydrophobicContact CG2-CE2 3.74Å; G559-Y896 CarbonylContact C-O 3.59Å; G559-Y896 WeakPolarHBondContact CA-O 3.18Å; G560-Y896 PolarHBondContact N-O 3.38Å; E570-Y896 HydrophobicContact CB-CD1 4.08Å; E570-Y896 HydrophobicContact CB-CE1 3.58Å; E570-Y896 WeakPolarHBondContact OE2-CE1 3.43Å; A571-Y896 HydrophobicContact CB-CD1 3.91Å; A571-Y896 HydrophobicContact CB-CD2 4.14Å; A571-Y896 HydrophobicContact CB-CE1 4.46Å; A571-Y896 HydrophobicContact CB-CG 3.72Å; Y892-Y896 AromaticContact CD1-CD2 3.93Å; Y892-Y896 HydrophobicContact CD1-CD2 3.93Å; Y892-Y896 AromaticContact CD1-CE2 3.76Å; Y892-Y896 HydrophobicContact CD1-CE2 3.76Å; Y892-Y896 HydrophobicContact CD2-CE2 4.48Å; Y892-Y896 HydrophobicContact CE1-CE2 4.08Å; Y892-Y896 HydrophobicContact CG-CD2 4.05Å; Y892-Y896 AromaticContact CG-CE2 3.98Å; Y892-Y896 HydrophobicContact CG-CE2 3.98Å; Y892-Y896 WeakPolarHBondContact O-CB 3.46Å; Y892-Y896 WeakPolarHBondContact O-CD2 3.19Å; Y892-Y896 PolarHBondContact O-N 3.5Å
897	F	87.9	Confident	91.7	Very high	34 Å²	34	34.7 Å²	34.7	15%	0.149	17%	0.17	C	C	.	.			trans	-90	123.5	-172.6	-149.5	-112.3	0	0	0	111.2	I573 L893 V899	I573-F897 HydrophobicContact CD1-CD2 3.74Å; I573-F897 HydrophobicContact CD1-CE2 3.88Å; I573-F897 HydrophobicContact CG2-CE2 4.32Å; L893-F897 HydrophobicContact CD1-CB 3.91Å; L893-F897 HydrophobicContact CD1-CD1 3.97Å; L893-F897 HydrophobicContact CD1-CD2 4.25Å; L893-F897 HydrophobicContact CD1-CG 3.8Å; L893-F897 HydrophobicContact CG-CB 4.47Å; L893-F897 WeakPolarHBondContact O-CB 3.3Å; L893-F897 PolarHBondContact O-N 3.08Å; L893-F897 VanDerWaalsContact O-N 3.14Å; F897-V899 HydrophobicContact CD1-CG2 4.46Å; F897-V899 WeakPolarHBondContact CD1-O 3.23Å; F897-V899 HydrophobicContact CE1-CG2 3.83Å; F897-V899 WeakPolarHBondContact CE1-O 3.17Å; F897-V899 HydrophobicContact CZ-CG2 4.16Å
898	E	86.8	Confident	91.8	Very high	74 Å²	74	36.2 Å²	36.2	35%	0.346	18%	0.176	S	C	.	.			trans	-93.8	-12.6	-170.8	-61.7	-62.3	155.5	0	0	114.1	Y561 P1060	Y561-E898 HydrophobicContact CD1-CG 4.48Å; Y561-E898 HydrophobicContact CE1-CG 3.96Å; Y561-E898 HydrophobicContact CE2-CG 4.25Å; E898-P1060 WeakPolarHBondContact O-CD 3.35Å; E898-P1060 WeakPolarHBondContact O-CG 3.38Å
899	V	87.2	Confident	91.7	Very high	11 Å²	11	36.8 Å²	36.8	7%	0.067	18%	0.175	C	C	.	.	S	Bend	trans	-124.9	148.8	179.6	-66.4	0	0	0	0	111.4	F555 F897 I951	F555-V899 HydrophobicContact CB-CG1 4.12Å; F555-V899 HydrophobicContact CB-CG2 4.46Å; F555-V899 HydrophobicContact CD1-CG1 4.44Å; F555-V899 HydrophobicContact CD2-CB 4.32Å; F555-V899 HydrophobicContact CD2-CG1 3.82Å; F555-V899 HydrophobicContact CD2-CG2 3.54Å; F555-V899 HydrophobicContact CE2-CG1 4.33Å; F555-V899 HydrophobicContact CE2-CG2 4.14Å; F555-V899 HydrophobicContact CG-CG1 3.88Å; F555-V899 HydrophobicContact CG-CG2 4.29Å; F897-V899 HydrophobicContact CD1-CG2 4.46Å; F897-V899 WeakPolarHBondContact CD1-O 3.23Å; F897-V899 HydrophobicContact CE1-CG2 3.83Å; F897-V899 WeakPolarHBondContact CE1-O 3.17Å; F897-V899 HydrophobicContact CZ-CG2 4.16Å; V899-I951 HydrophobicContact CG1-CD1 4.07Å
900	G	87.9	Confident	91.5	Very high	10 Å²	10	37.4 Å²	37.4	10%	0.103	18%	0.183	C	C	.	.			trans	-83.1	-168.8	177.1	0	0	0	0	0	113.8	H1058 T1059	G900-H1058 VanDerWaalsContact CA-O 3.29Å; G900-H1058 WeakPolarHBondContact CA-O 3.39Å; G900-H1058 PolarHBondContact N-O 2.02Å; G900-T1059 VanDerWaalsContact CA-O 3.23Å; G900-T1059 WeakPolarHBondContact CA-O 3.36Å
901	V	90.2	Very high	91.4	Very high	40 Å²	40	37.2 Å²	37.2	24%	0.242	18%	0.182	C	C	.	.			trans	-66.8	146.7	172.7	-63.8	0	0	0	0	111.5	H1058 T1103	V901-H1058 WeakPolarHBondContact O-CB 3.49Å; V901-H1058 PolarHBondContact O-N 3.29Å; V901-T1103 HydrophobicContact CG1-CG2 4.32Å; V901-T1103 HydrophobicContact CG2-CG2 4.41Å
902	P	93.1	Very high	91.3	Very high	18 Å²	18	34.8 Å²	34.8	12%	0.117	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	146.8	174.3	29	-34.6	0	0	0	111.2	F406 Y904 M1055 A1056 Y1057 T1101	F406-P902 HydrophobicContact CE2-CG 3.79Å; F406-P902 HydrophobicContact CZ-CG 3.8Å; P902-Y904 HydrophobicContact CB-CE2 4.48Å; P902-M1055 HydrophobicContact CB-CE 3.55Å; P902-M1055 HydrophobicContact CG-CE 4.3Å; P902-A1056 CarbonylContact C-O 3.34Å; P902-A1056 WeakPolarHBondContact CA-O 3.28Å; P902-Y1057 HydrophobicContact CB-CD1 4.19Å; P902-Y1057 HydrophobicContact CB-CE1 4.05Å; P902-T1101 VanDerWaalsContact O-CB 3.27Å; P902-T1101 WeakPolarHBondContact O-CB 3.37Å; P902-T1101 PolarHBondContact O-OG1 2.84Å
903	V	94.6	Very high	91.2	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	130.9	174.3	60.7	0	0	0	0	109.7	F905 M949 A1056 P1099	V903-F905 HydrophobicContact CG1-CE2 4.17Å; V903-M949 HydrophobicContact CG1-CE 3.66Å; V903-M949 HydrophobicContact CG1-SD 3.81Å; V903-A1056 HydrophobicContact CG1-CB 4.04Å; V903-A1056 PolarHBondContact N-O 2.03Å; V903-A1056 PolarHBondContact O-N 2.89Å; V903-P1099 HydrophobicContact CG2-CB 3.94Å
904	Y	95.3	Very high	91.1	Very high	7 Å²	7	31.5 Å²	31.5	3%	0.027	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	116.4	179.7	-61.2	-80	0	0	0	109.7	F406 P902 V906 R1053 F1054 M1055 P1099 Y1100	F406-Y904 AromaticContact CD2-CE2 3.76Å; F406-Y904 HydrophobicContact CD2-CE2 3.76Å; F406-Y904 AromaticContact CE2-CE2 3.69Å; F406-Y904 HydrophobicContact CE2-CE2 3.69Å; P902-Y904 HydrophobicContact CB-CE2 4.48Å; Y904-V906 PolarHBondContact O-N 2.99Å; Y904-R1053 HydrophobicContact CD1-CB 4.46Å; Y904-R1053 HydrophobicContact CD1-CG 4.32Å; Y904-F1054 CarbonylContact C-O 3.58Å; Y904-F1054 WeakPolarHBondContact CA-O 3.46Å; Y904-M1055 HydrophobicContact CD1-CB 3.77Å; Y904-M1055 HydrophobicContact CD1-CG 3.97Å; Y904-M1055 HydrophobicContact CE1-CB 3.64Å; Y904-M1055 HydrophobicContact CE1-CE 4.49Å; Y904-M1055 HydrophobicContact CE1-CG 3.47Å; Y904-M1055 VanDerWaalsContact CE1-CG 3.47Å; Y904-M1055 HydrophobicContact CE1-SD 3.71Å; Y904-P1099 CarbonylContact O-C 3.57Å; Y904-P1099 WeakPolarHBondContact O-CA 3.33Å; Y904-Y1100 HydrophobicContact CD2-CD1 4.03Å; Y904-Y1100 PolarHBondContact N-O 2.84Å; Y904-Y1100 PolarHBondContact O-N 3.2Å
905	F	96	Very high	91.1	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	103.9	167.3	-67	-90	0	0	0	108.4	V903 M933 I937 M949 R1053 F1054 A1056 L1077 A1078 I1081 V1097 P1099	V903-F905 HydrophobicContact CG1-CE2 4.17Å; F905-M933 HydrophobicContact CB-CE 3.53Å; F905-M933 HydrophobicContact CG-CE 4.45Å; F905-I937 HydrophobicContact CB-CD1 4.39Å; F905-I937 HydrophobicContact CD1-CD1 4.44Å; F905-I937 HydrophobicContact CD2-CD1 3.62Å; F905-I937 HydrophobicContact CD2-CG1 4.3Å; F905-I937 HydrophobicContact CE2-CD1 3.96Å; F905-I937 HydrophobicContact CE2-CG1 4.14Å; F905-I937 HydrophobicContact CE2-CG2 4.22Å; F905-I937 HydrophobicContact CG-CD1 3.89Å; F905-I937 HydrophobicContact CZ-CG1 4.35Å; F905-M949 HydrophobicContact CE2-CE 3.84Å; F905-M949 HydrophobicContact CZ-CE 4.25Å; F905-R1053 WeakPolarHBondContact O-CA 3.25Å; F905-F1054 HydrophobicContact CB-CB 4.4Å; F905-F1054 PolarHBondContact N-O 2.78Å; F905-F1054 PolarHBondContact O-N 3.39Å; F905-A1056 HydrophobicContact CE2-CB 4.38Å; F905-L1077 HydrophobicContact CE1-CD2 4.16Å; F905-L1077 HydrophobicContact CE1-CG 4.37Å; F905-L1077 HydrophobicContact CZ-CD2 3.88Å; F905-A1078 HydrophobicContact CD1-CB 4.31Å; F905-A1078 HydrophobicContact CE1-CB 4.32Å; F905-I1081 HydrophobicContact CD1-CD1 4.5Å; F905-V1097 HydrophobicContact CB-CG1 4.22Å; F905-P1099 HydrophobicContact CD1-CB 4.26Å; F905-P1099 HydrophobicContact CE1-CB 4.11Å
906	V	95.8	Very high	91	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	129	-176.4	-177.6	0	0	0	0	109.4	F398 F403 Y904 T1052 R1053 V1097 F1098	F398-V906 HydrophobicContact CD1-CG1 4.36Å; F398-V906 HydrophobicContact CE1-CG1 4.07Å; F403-V906 HydrophobicContact CE2-CG1 3.78Å; F403-V906 HydrophobicContact CZ-CG1 4.39Å; Y904-V906 PolarHBondContact O-N 2.99Å; V906-T1052 CarbonylContact C-O 3.39Å; V906-T1052 WeakPolarHBondContact CA-O 3.29Å; V906-R1053 HydrophobicContact CG2-CB 4.07Å; V906-V1097 VanDerWaalsContact O-CA 3.29Å; V906-V1097 WeakPolarHBondContact O-CA 3.35Å; V906-F1098 HydrophobicContact CB-CD1 4.43Å; V906-F1098 HydrophobicContact CB-CD2 4.36Å; V906-F1098 HydrophobicContact CB-CE1 3.96Å; V906-F1098 HydrophobicContact CB-CE2 3.89Å; V906-F1098 HydrophobicContact CB-CZ 3.68Å; V906-F1098 HydrophobicContact CG1-CE1 3.87Å; V906-F1098 HydrophobicContact CG1-CE2 4.35Å; V906-F1098 HydrophobicContact CG1-CZ 3.66Å; V906-F1098 HydrophobicContact CG2-CE2 4.17Å; V906-F1098 HydrophobicContact CG2-CZ 4.29Å; V906-F1098 PolarHBondContact N-O 3.37Å; V906-F1098 PolarHBondContact O-N 3.42Å
907	T	94.6	Very high	91	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	130.6	175	69.7	0	0	0	0	110	M933 A1051 T1052 F1054 F1095 V1097	T907-M933 HydrophobicContact CG2-CE 4.13Å; T907-M933 HydrophobicContact CG2-SD 4.09Å; T907-A1051 WeakPolarHBondContact O-CA 3.49Å; T907-T1052 HydrophobicContact CG2-CG2 4.38Å; T907-T1052 PolarHBondContact N-O 3.33Å; T907-T1052 PolarHBondContact O-N 3.17Å; T907-T1052 WeakPolarHBondContact OG1-CG2 3.45Å; T907-T1052 PolarHBondContact OG1-O 3.39Å; T907-F1054 HydrophobicContact CG2-CD2 4.49Å; T907-F1054 HydrophobicContact CG2-CE2 4.14Å; T907-F1095 HydrophobicContact CG2-CZ 4.37Å; T907-V1097 HydrophobicContact CG2-CG1 4.33Å; T907-V1097 HydrophobicContact CG2-CG2 3.89Å
908	K	93	Very high	91.1	Very high	52 Å²	52	30.8 Å²	30.8	23%	0.226	17%	0.165	C	C	.	.	P	Polyproline II helix	trans	-78.5	171.8	174.8	-65.8	-162.6	177.4	174.5	0	112.6	F398 I1050 F1095 E1096 F1098	F398-K908 HydrophobicContact CD2-CD 4.46Å; F398-K908 HydrophobicContact CE1-CG 4.17Å; F398-K908 HydrophobicContact CE2-CD 4.09Å; F398-K908 HydrophobicContact CE2-CG 4.1Å; F398-K908 HydrophobicContact CZ-CB 4.29Å; F398-K908 HydrophobicContact CZ-CD 4.3Å; F398-K908 HydrophobicContact CZ-CG 3.79Å; K908-I1050 CarbonylContact C-O 3.54Å; K908-F1095 WeakPolarHBondContact O-CD2 3.33Å; K908-F1095 VanDerWaalsContact O-CE2 3.3Å; K908-F1095 WeakPolarHBondContact O-CE2 3.5Å; K908-E1096 HydrophobicContact CD-CG 3.63Å; K908-E1096 WeakPolarHBondContact CD-OE1 3.29Å; K908-E1096 WeakPolarHBondContact CE-OE1 3.42Å; K908-E1096 HydrophobicContact CG-CG 4Å; K908-E1096 PolarHBondContact N-O 2.81Å; K908-E1096 IonicContact NZ-OE1 2.79Å; K908-E1096 PolarHBondContact NZ-OE1 3.35Å; K908-F1098 HydrophobicContact CD-CE1 4.36Å; K908-F1098 HydrophobicContact CG-CD1 4.29Å; K908-F1098 HydrophobicContact CG-CE1 3.9Å
909	K	90.8	Very high	91.3	Very high	94 Å²	94	27.3 Å²	27.3	41%	0.409	15%	0.149	S	C	.	.	S	Bend	trans	-58.4	149.2	172.7	-174.6	170.1	-178.5	161	0	110.8	E1048 I1050	K909-E1048 VanDerWaalsContact CE-CD 3.46Å; K909-E1048 WeakPolarHBondContact CE-OE1 3.02Å; K909-E1048 WeakPolarHBondContact CE-OE2 3.09Å; K909-E1048 IonicContact NZ-OE1 3.27Å; K909-E1048 IonicContact NZ-OE2 2.73Å; K909-E1048 PolarHBondContact NZ-OE2 2.69Å; K909-I1050 VanDerWaalsContact CA-O 3.26Å; K909-I1050 WeakPolarHBondContact CA-O 3.35Å; K909-I1050 HydrophobicContact CB-CG2 4.49Å; K909-I1050 WeakPolarHBondContact CB-O 3.46Å; K909-I1050 PolarHBondContact N-O 3.14Å
910	G	87.6	Confident	91.5	Very high	21 Å²	21	28.1 Å²	28.1	22%	0.216	15%	0.152	C	C	.	.			trans	110	9.2	174.1	0	0	0	0	0	114.8	T1091 S1092	G910-T1091 WeakPolarHBondContact O-CA 3.39Å; G910-S1092 PolarHBondContact O-N 3.48Å
911	Y	91.1	Very high	91.6	Very high	10 Å²	10	27.8 Å²	27.8	4%	0.039	15%	0.149	C	C	.	.			trans	-112.2	130.6	169.3	-172.7	-96	0	0	0	110.3	F913 G918 V922 M1085 I1088 T1091 F1095	Y911-F913 AromaticContact CD1-CD1 3.82Å; Y911-F913 HydrophobicContact CD1-CD1 3.82Å; Y911-F913 AromaticContact CD1-CD2 3.92Å; Y911-F913 HydrophobicContact CD1-CD2 3.92Å; Y911-F913 AromaticContact CD1-CE1 3.67Å; Y911-F913 HydrophobicContact CD1-CE1 3.67Å; Y911-F913 AromaticContact CD1-CE2 3.76Å; Y911-F913 HydrophobicContact CD1-CE2 3.76Å; Y911-F913 AromaticContact CD1-CG 3.95Å; Y911-F913 HydrophobicContact CD1-CG 3.95Å; Y911-F913 AromaticContact CD1-CZ 3.63Å; Y911-F913 HydrophobicContact CD1-CZ 3.63Å; Y911-F913 AromaticContact CE1-CD1 3.91Å; Y911-F913 HydrophobicContact CE1-CD1 3.91Å; Y911-F913 AromaticContact CE1-CE1 3.9Å; Y911-F913 HydrophobicContact CE1-CE1 3.9Å; Y911-F913 HydrophobicContact CE1-CG 4.35Å; Y911-F913 HydrophobicContact CE1-CZ 4.32Å; Y911-F913 HydrophobicContact CG-CE2 4.48Å; Y911-F913 HydrophobicContact CG-CZ 4.47Å; Y911-F913 WeakPolarHBondContact O-CD2 3.08Å; Y911-F913 PolarHBondContact O-N 3.11Å; Y911-G918 VanDerWaalsContact CE1-O 3.25Å; Y911-G918 WeakPolarHBondContact CE1-O 3.04Å; Y911-G918 WeakPolarHBondContact OH-CA 3.49Å; Y911-G918 PolarHBondContact OH-O 3.29Å; Y911-V922 HydrophobicContact CE1-CG2 3.69Å; Y911-M1085 HydrophobicContact CD1-CE 3.99Å; Y911-M1085 HydrophobicContact CD2-CB 4.43Å; Y911-M1085 HydrophobicContact CD2-CE 3.74Å; Y911-M1085 HydrophobicContact CE1-CE 3.75Å; Y911-M1085 HydrophobicContact CE2-CB 4.04Å; Y911-M1085 HydrophobicContact CE2-CE 3.49Å; Y911-M1085 VanDerWaalsContact CE2-CE 3.49Å; Y911-M1085 HydrophobicContact CE2-CG 4.42Å; Y911-M1085 HydrophobicContact CG-CE 3.96Å; Y911-M1085 VanDerWaalsContact CZ-CE 3.48Å; Y911-I1088 HydrophobicContact CE2-CB 4.47Å; Y911-I1088 HydrophobicContact CE2-CD1 3.92Å; Y911-I1088 WeakPolarHBondContact OH-CD1 3.4Å; Y911-T1091 HydrophobicContact CD2-CG2 3.88Å; Y911-F1095 HydrophobicContact CD2-CD1 4.41Å; Y911-F1095 HydrophobicContact CD2-CE1 4.07Å; Y911-F1095 HydrophobicContact CD2-CZ 4.13Å; Y911-F1095 HydrophobicContact CG-CE1 4.45Å; Y911-F1095 HydrophobicContact CG-CE2 4.15Å; Y911-F1095 HydrophobicContact CG-CZ 4.05Å
912	N	89.9	Confident	91.7	Very high	57 Å²	57	25.9 Å²	25.9	31%	0.305	14%	0.138	S	C	.	.			trans	-94.6	87.9	-173.1	-167.4	-8.1	0	0	0	111.8	N914 T915	N912-N914 PolarHBondContact O-N 3.08Å; N912-N914 WeakPolarHBondContact OD1-CB 3.25Å; N912-N914 PolarHBondContact OD1-N 2.92Å; N912-N914 VanDerWaalsContact OD1-N 3.14Å; N912-T915 HydrophobicContact CB-CG2 4.35Å; N912-T915 WeakPolarHBondContact ND2-CG2 3.27Å; N912-T915 PolarHBondContact O-N 3.15Å; N912-T915 PolarHBondContact O-OG1 3.36Å
913	F	90.2	Very high	91.6	Very high	5 Å²	5	25 Å²	25	2%	0.022	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-14.6	176	-63.7	-84.9	0	0	0	114.1	Y911 T915 M919 V922 W956 F1013 I1049 T1052	Y911-F913 AromaticContact CD1-CD1 3.82Å; Y911-F913 HydrophobicContact CD1-CD1 3.82Å; Y911-F913 AromaticContact CD1-CD2 3.92Å; Y911-F913 HydrophobicContact CD1-CD2 3.92Å; Y911-F913 AromaticContact CD1-CE1 3.67Å; Y911-F913 HydrophobicContact CD1-CE1 3.67Å; Y911-F913 AromaticContact CD1-CE2 3.76Å; Y911-F913 HydrophobicContact CD1-CE2 3.76Å; Y911-F913 AromaticContact CD1-CG 3.95Å; Y911-F913 HydrophobicContact CD1-CG 3.95Å; Y911-F913 AromaticContact CD1-CZ 3.63Å; Y911-F913 HydrophobicContact CD1-CZ 3.63Å; Y911-F913 AromaticContact CE1-CD1 3.91Å; Y911-F913 HydrophobicContact CE1-CD1 3.91Å; Y911-F913 AromaticContact CE1-CE1 3.9Å; Y911-F913 HydrophobicContact CE1-CE1 3.9Å; Y911-F913 HydrophobicContact CE1-CG 4.35Å; Y911-F913 HydrophobicContact CE1-CZ 4.32Å; Y911-F913 HydrophobicContact CG-CE2 4.48Å; Y911-F913 HydrophobicContact CG-CZ 4.47Å; Y911-F913 WeakPolarHBondContact O-CD2 3.08Å; Y911-F913 PolarHBondContact O-N 3.11Å; F913-T915 VanDerWaalsContact C-N 3.28Å; F913-T915 PolarHBondContact O-N 2.76Å; F913-M919 WeakPolarHBondContact O-CG 3.45Å; F913-V922 HydrophobicContact CD1-CG2 4.43Å; F913-V922 HydrophobicContact CE1-CG2 3.99Å; F913-W956 HydrophobicContact CD1-CZ2 4.12Å; F913-W956 HydrophobicContact CE1-CZ2 4.41Å; F913-W956 HydrophobicContact CG-CZ2 4.39Å; F913-F1013 HydrophobicContact CB-CZ 4.22Å; F913-I1049 HydrophobicContact CB-CD1 3.94Å; F913-I1049 HydrophobicContact CD2-CB 4.1Å; F913-I1049 HydrophobicContact CD2-CD1 3.94Å; F913-I1049 HydrophobicContact CD2-CG2 4.13Å; F913-I1049 HydrophobicContact CE2-CG2 4.13Å; F913-I1049 HydrophobicContact CG-CD1 4.09Å; F913-T1052 HydrophobicContact CE1-CG2 4.09Å; F913-T1052 HydrophobicContact CE2-CG2 3.93Å; F913-T1052 HydrophobicContact CZ-CG2 3.46Å; F913-T1052 VanDerWaalsContact CZ-CG2 3.46Å
914	N	89.1	Confident	91.3	Very high	19 Å²	19	25.3 Å²	25.3	10%	0.102	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-8.4	-176	-53.5	6.5	0	0	0	112.3	N912 M1010 F1013 S1014	N912-N914 PolarHBondContact O-N 3.08Å; N912-N914 WeakPolarHBondContact OD1-CB 3.25Å; N912-N914 PolarHBondContact OD1-N 2.92Å; N912-N914 VanDerWaalsContact OD1-N 3.14Å; N914-M1010 HydrophobicContact CB-CE 4.16Å; N914-M1010 HydrophobicContact CB-CG 3.58Å; N914-F1013 HydrophobicContact CB-CD1 4.06Å; N914-F1013 HydrophobicContact CB-CG 4.38Å; N914-F1013 VanDerWaalsContact OD1-CD1 3.24Å; N914-F1013 WeakPolarHBondContact OD1-CD1 3.42Å; N914-F1013 WeakPolarHBondContact OD1-CE1 3.5Å; N914-S1014 PolarHBondContact ND2-OG 3.13Å
915	T	90.5	Very high	90.8	Very high	47 Å²	47	25.1 Å²	25.1	29%	0.288	13%	0.134	S	C	.	.	S	Bend	trans	-93.1	153.1	177.4	61.1	0	0	0	0	110.9	N912 F913 G918 M919	N912-T915 HydrophobicContact CB-CG2 4.35Å; N912-T915 WeakPolarHBondContact ND2-CG2 3.27Å; N912-T915 PolarHBondContact O-N 3.15Å; N912-T915 PolarHBondContact O-OG1 3.36Å; F913-T915 VanDerWaalsContact C-N 3.28Å; F913-T915 PolarHBondContact O-N 2.76Å; T915-G918 PolarHBondContact O-N 2.8Å; T915-G918 PolarHBondContact OG1-N 3.27Å; T915-G918 VanDerWaalsContact OG1-N 3.09Å; T915-M919 WeakPolarHBondContact O-CG 3.04Å; T915-M919 PolarHBondContact O-N 2.97Å
916	V	89.3	Confident	90.3	Very high	71 Å²	71	25.6 Å²	25.6	43%	0.43	14%	0.137	S	C	.	.	H	α-helix	trans	-60.7	-49.1	177.4	-179.8	0	0	0	0	110.9	G918 M919 D920 R1007	V916-G918 VanDerWaalsContact C-N 3.28Å; V916-G918 PolarHBondContact O-N 3.09Å; V916-M919 HydrophobicContact CG2-CE 4.46Å; V916-M919 PolarHBondContact O-N 3.48Å; V916-M919 VanDerWaalsContact O-N 3.13Å; V916-D920 WeakPolarHBondContact CG1-OD2 3.49Å; V916-D920 VanDerWaalsContact O-CG 3.27Å; V916-D920 PolarHBondContact O-N 3.29Å; V916-R1007 HydrophobicContact CG1-CG 4.09Å; V916-R1007 HydrophobicContact CG2-CB 4.25Å
917	E	89.9	Confident	89.7	Confident	110 Å²	110	27.4 Å²	27.4	51%	0.514	16%	0.155	S	C	.	.	H	α-helix	trans	-58.7	-39.3	176.1	-61.3	178.2	-179.8	0	0	112.2	D920 G921 I1088 P1089	E917-D920 PolarHBondContact O-N 3.13Å; E917-G921 PolarHBondContact O-N 3.11Å; E917-I1088 HydrophobicContact CB-CG2 4.08Å; E917-P1089 VanDerWaalsContact OE2-CD 3.31Å; E917-P1089 WeakPolarHBondContact OE2-CD 3.46Å; E917-P1089 WeakPolarHBondContact OE2-CG 3.37Å
918	G	90.3	Very high	89.4	Confident	1 Å²	1	28.4 Å²	28.4	1%	0.01	16%	0.162	C	C	.	.	H	α-helix	trans	-64.8	-41.7	175.9	0	0	0	0	0	113.1	Y911 T915 V916	Y911-G918 VanDerWaalsContact CE1-O 3.25Å; Y911-G918 WeakPolarHBondContact CE1-O 3.04Å; Y911-G918 WeakPolarHBondContact OH-CA 3.49Å; Y911-G918 PolarHBondContact OH-O 3.29Å; T915-G918 PolarHBondContact O-N 2.8Å; T915-G918 PolarHBondContact OG1-N 3.27Å; T915-G918 VanDerWaalsContact OG1-N 3.09Å; V916-G918 VanDerWaalsContact C-N 3.28Å; V916-G918 PolarHBondContact O-N 3.09Å
919	M	91.3	Very high	89.1	Confident	1 Å²	1	30.1 Å²	30.1	1%	0.005	17%	0.174	C	C	.	.	H	α-helix	trans	-64.9	-46.4	174	-71.4	-175.6	-80.6	0	0	111.1	F913 T915 V916 G921 V922 C923 V957 R1007 P1008 F1013	F913-M919 WeakPolarHBondContact O-CG 3.45Å; T915-M919 WeakPolarHBondContact O-CG 3.04Å; T915-M919 PolarHBondContact O-N 2.97Å; V916-M919 HydrophobicContact CG2-CE 4.46Å; V916-M919 PolarHBondContact O-N 3.48Å; V916-M919 VanDerWaalsContact O-N 3.13Å; M919-G921 VanDerWaalsContact C-N 3.3Å; M919-G921 PolarHBondContact O-N 2.91Å; M919-V922 PolarHBondContact O-N 3.22Å; M919-C923 WeakPolarHBondContact O-CB 3.36Å; M919-C923 PolarHBondContact O-N 3.38Å; M919-C923 PolarHBondContact O-SG 2.94Å; M919-V957 HydrophobicContact CG-CG1 4.49Å; M919-R1007 HydrophobicContact CE-CB 4.41Å; M919-P1008 HydrophobicContact CE-CG 4.13Å; M919-P1008 HydrophobicContact SD-CG 4.07Å; M919-F1013 HydrophobicContact SD-CD2 4.08Å; M919-F1013 HydrophobicContact SD-CE2 4.22Å
920	D	91.3	Very high	88.8	Confident	27 Å²	27	31 Å²	31	14%	0.144	18%	0.179	C	C	.	.	H	α-helix	trans	-64.4	-32.7	-176.5	-67.5	-23	0	0	0	112.9	V916 E917 V922 D929 R1007	V916-D920 WeakPolarHBondContact CG1-OD2 3.49Å; V916-D920 VanDerWaalsContact O-CG 3.27Å; V916-D920 PolarHBondContact O-N 3.29Å; E917-D920 PolarHBondContact O-N 3.13Å; D920-V922 PolarHBondContact O-N 2.73Å; D920-D929 WeakPolarHBondContact O-CB 3.03Å; D920-D929 PolarHBondContact O-N 3.26Å; D920-D929 VanDerWaalsContact O-N 3.07Å; D920-R1007 IonicContact OD1-CZ 3.12Å; D920-R1007 IonicContact OD1-NE 3.22Å; D920-R1007 PolarHBondContact OD1-NE 3.49Å; D920-R1007 IonicContact OD1-NH2 2.74Å; D920-R1007 PolarHBondContact OD1-NH2 3.15Å
921	G	90	Very high	88.7	Confident	4 Å²	4	35.2 Å²	35.2	4%	0.041	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-14.4	173.3	0	0	0	0	0	114.8	E917 M919 S932 M933	E917-G921 PolarHBondContact O-N 3.11Å; M919-G921 VanDerWaalsContact C-N 3.3Å; M919-G921 PolarHBondContact O-N 2.91Å; G921-S932 WeakPolarHBondContact O-CA 3.03Å; G921-S932 WeakPolarHBondContact O-CB 3.36Å; G921-M933 PolarHBondContact O-N 3.39Å
922	V	92.4	Very high	88.7	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115	-43.8	-176.2	178.4	0	0	0	0	112.6	Y911 F913 M919 D920 T934 V957 F1054 M1085	Y911-V922 HydrophobicContact CE1-CG2 3.69Å; F913-V922 HydrophobicContact CD1-CG2 4.43Å; F913-V922 HydrophobicContact CE1-CG2 3.99Å; M919-V922 PolarHBondContact O-N 3.22Å; D920-V922 PolarHBondContact O-N 2.73Å; V922-T934 VanDerWaalsContact O-CG2 3.28Å; V922-T934 WeakPolarHBondContact O-CG2 3.34Å; V922-T934 PolarHBondContact O-N 3.18Å; V922-T934 PolarHBondContact O-OG1 2.97Å; V922-V957 HydrophobicContact CG1-CB 4.47Å; V922-V957 HydrophobicContact CG1-CG2 3.96Å; V922-F1054 HydrophobicContact CG1-CE1 3.88Å; V922-F1054 HydrophobicContact CG1-CE2 4.4Å; V922-F1054 HydrophobicContact CG1-CZ 3.54Å; V922-M1085 HydrophobicContact CG2-CE 3.66Å
923	C	91.1	Very high	88.8	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	18%	0.176	C	C	.	.			trans	-72.6	169.1	-173.9	65.9	0	0	0	0	113.1	M919 C928 S932 V957 D958 I961	M919-C923 WeakPolarHBondContact O-CB 3.36Å; M919-C923 PolarHBondContact O-N 3.38Å; M919-C923 PolarHBondContact O-SG 2.94Å; C923-C928 HydrophobicContact CB-CB 4.19Å; C923-C928 WeakPolarHBondContact CB-SG 3.45Å; C923-C928 WeakPolarHBondContact O-CB 3.41Å; C923-C928 WeakPolarHBondContact SG-CB 2.97Å; C923-C928 CovalentContact SG-SG 2.03Å; C923-C928 PolarHBondContact SG-SG 2.81Å; C923-S932 WeakPolarHBondContact O-CB 3.38Å; C923-S932 PolarHBondContact O-OG 3.29Å; C923-V957 HydrophobicContact CB-CG1 4.03Å; C923-D958 WeakPolarHBondContact CA-OD2 3.21Å; C923-I961 HydrophobicContact CB-CD1 4.11Å
924	S	88.4	Confident	88.9	Confident	5 Å²	5	32.2 Å²	32.2	4%	0.035	18%	0.177	C	C	.	.			trans	-133.7	13.3	174.9	61.3	0	0	0	0	113.7	R108 S255 Q257 T934 D958	R108-S924 VanDerWaalsContact NH2-C 3.31Å; R108-S924 PolarHBondContact NH2-O 3.18Å; R108-S924 PolarHBondContact NH2-OG 3.09Å; S255-S924 WeakPolarHBondContact CB-O 3.42Å; S255-S924 PolarHBondContact OG-O 3.23Å; Q257-S924 PolarHBondContact OE1-OG 3.31Å; S924-T934 WeakPolarHBondContact CB-OG1 3.44Å; S924-D958 PolarHBondContact N-OD1 3.19Å; S924-D958 PolarHBondContact N-OD2 2.87Å; S924-D958 PolarHBondContact OG-OD1 3.33Å
925	S	84.5	Confident	88.9	Confident	4 Å²	4	32.1 Å²	32.1	3%	0.028	18%	0.176	C	C	.	.	S	Bend	trans	-71.6	-178.2	169.8	70.4	0	0	0	0	112.2	R108 G927 C928 D958	R108-S925 VanDerWaalsContact NH2-N 3.19Å; S925-G927 PolarHBondContact O-N 2.85Å; S925-C928 PolarHBondContact N-SG 3.15Å; S925-C928 WeakPolarHBondContact O-CB 3.47Å; S925-C928 PolarHBondContact O-N 2.63Å; S925-C928 PolarHBondContact O-SG 2.84Å; S925-C928 PolarHBondContact OG-SG 2.77Å; S925-D958 PolarHBondContact N-OD1 3.5Å
926	V	84.9	Confident	88.8	Confident	10 Å²	10	31.4 Å²	31.4	6%	0.061	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58	136.1	176.5	-172.7	0	0	0	0	110.6	R108 P110 M252 C928 V1005 R1007	R108-V926 WeakPolarHBondContact O-CG2 3.36Å; P110-V926 HydrophobicContact CG-CG2 4.04Å; M252-V926 HydrophobicContact CB-CG1 3.76Å; V926-C928 VanDerWaalsContact C-N 3.31Å; V926-C928 PolarHBondContact O-N 3.19Å; V926-V1005 HydrophobicContact CG1-CG2 4.13Å; V926-R1007 PolarHBondContact O-NH1 3.19Å; V926-R1007 PolarHBondContact O-NH2 3.38Å
927	G	83.1	Confident	88.9	Confident	37 Å²	37	28 Å²	28	38%	0.381	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.3	-5.1	-179.6	0	0	0	0	0	115.5	S925	S925-G927 PolarHBondContact O-N 2.85Å
928	C	88.3	Confident	88.8	Confident	21 Å²	21	23.4 Å²	23.4	14%	0.142	13%	0.126	C	C	.	.	S	Bend	trans	-77.1	163.1	176.4	-51.4	0	0	0	0	112.4	C923 S925 V926 R1007	C923-C928 HydrophobicContact CB-CB 4.19Å; C923-C928 WeakPolarHBondContact CB-SG 3.45Å; C923-C928 WeakPolarHBondContact O-CB 3.41Å; C923-C928 WeakPolarHBondContact SG-CB 2.97Å; C923-C928 CovalentContact SG-SG 2.03Å; C923-C928 PolarHBondContact SG-SG 2.81Å; S925-C928 PolarHBondContact N-SG 3.15Å; S925-C928 WeakPolarHBondContact O-CB 3.47Å; S925-C928 PolarHBondContact O-N 2.63Å; S925-C928 PolarHBondContact O-SG 2.84Å; S925-C928 PolarHBondContact OG-SG 2.77Å; V926-C928 VanDerWaalsContact C-N 3.31Å; V926-C928 PolarHBondContact O-N 3.19Å; C928-R1007 PolarHBondContact SG-NH2 3.05Å
929	D	87.6	Confident	88.7	Confident	88 Å²	88	26.7 Å²	26.7	47%	0.471	14%	0.139	S	C	.	.			trans	-63.5	137.1	178.2	-76.7	-23.1	0	0	0	112.3	D920 F931 S932	D920-D929 WeakPolarHBondContact O-CB 3.03Å; D920-D929 PolarHBondContact O-N 3.26Å; D920-D929 VanDerWaalsContact O-N 3.07Å; D929-F931 PolarHBondContact O-N 2.93Å; D929-F931 VanDerWaalsContact O-N 3.09Å; D929-S932 WeakPolarHBondContact O-CB 3.06Å; D929-S932 PolarHBondContact O-N 3.13Å; D929-S932 VanDerWaalsContact O-N 3.14Å
930	Q	83.2	Confident	88.6	Confident	112 Å²	112	27.2 Å²	27.2	52%	0.523	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-22.7	178.9	-66.6	-173.4	-10.3	0	0	113.8	Q935	Q930-Q935 WeakPolarHBondContact O-CG 3.47Å
931	F	87.1	Confident	88.4	Confident	111 Å²	111	26.6 Å²	26.6	49%	0.487	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	-122.5	38.8	177.6	-64.7	-73.1	0	0	0	111.6	P264 V266 D929 K936	P264-F931 HydrophobicContact CG-CE2 4.48Å; P264-F931 HydrophobicContact CG-CZ 4.14Å; V266-F931 HydrophobicContact CG2-CE1 3.97Å; V266-F931 HydrophobicContact CG2-CZ 4.04Å; D929-F931 PolarHBondContact O-N 2.93Å; D929-F931 VanDerWaalsContact O-N 3.09Å; F931-K936 WeakPolarHBondContact O-CE 3.5Å; F931-K936 PolarHBondContact O-NZ 3.32Å
932	S	91.2	Very high	88.3	Confident	2 Å²	2	30.2 Å²	30.2	1%	0.014	16%	0.159	C	C	.	.			trans	-60.6	169.2	171.8	72.4	0	0	0	0	112.4	G921 C923 D929 T934 Q935 K936	G921-S932 WeakPolarHBondContact O-CA 3.03Å; G921-S932 WeakPolarHBondContact O-CB 3.36Å; C923-S932 WeakPolarHBondContact O-CB 3.38Å; C923-S932 PolarHBondContact O-OG 3.29Å; D929-S932 WeakPolarHBondContact O-CB 3.06Å; D929-S932 PolarHBondContact O-N 3.13Å; D929-S932 VanDerWaalsContact O-N 3.14Å; S932-T934 PolarHBondContact O-N 2.7Å; S932-Q935 PolarHBondContact O-N 2.93Å; S932-Q935 WeakPolarHBondContact OG-CB 3.49Å; S932-K936 WeakPolarHBondContact O-CG 3.36Å; S932-K936 PolarHBondContact O-N 3.43Å
933	M	92.2	Very high	88.1	Confident	1 Å²	1	33.9 Å²	33.9	1%	0.005	17%	0.173	C	C	.	.	H	α-helix	trans	-54.7	-52.5	180	175.2	171	173	0	0	112.8	F905 T907 G921 Q935 K936 I937 F1054 I1081 M1085 V1097	F905-M933 HydrophobicContact CB-CE 3.53Å; F905-M933 HydrophobicContact CG-CE 4.45Å; T907-M933 HydrophobicContact CG2-CE 4.13Å; T907-M933 HydrophobicContact CG2-SD 4.09Å; G921-M933 PolarHBondContact O-N 3.39Å; M933-Q935 VanDerWaalsContact C-N 3.34Å; M933-Q935 PolarHBondContact O-N 3.15Å; M933-K936 PolarHBondContact O-N 2.88Å; M933-I937 HydrophobicContact CE-CD1 4.37Å; M933-I937 HydrophobicContact CG-CD1 4.34Å; M933-I937 WeakPolarHBondContact O-CG1 3.34Å; M933-I937 PolarHBondContact O-N 3.22Å; M933-F1054 HydrophobicContact CE-CB 4.35Å; M933-F1054 HydrophobicContact CE-CD2 3.53Å; M933-F1054 HydrophobicContact CE-CE2 4.07Å; M933-F1054 HydrophobicContact CE-CG 4.05Å; M933-F1054 HydrophobicContact SD-CD2 4.24Å; M933-F1054 HydrophobicContact SD-CE2 4.21Å; M933-I1081 HydrophobicContact CB-CG2 4.07Å; M933-I1081 HydrophobicContact CG-CD1 4.3Å; M933-I1081 HydrophobicContact CG-CG2 3.71Å; M933-I1081 HydrophobicContact SD-CG2 4.02Å; M933-M1085 HydrophobicContact CB-SD 4.31Å; M933-M1085 HydrophobicContact SD-CE 4.48Å; M933-M1085 HydrophobicContact SD-SD 3.99Å; M933-V1097 HydrophobicContact CE-CG1 3.85Å
934	T	90.9	Very high	88	Confident	5 Å²	5	36.4 Å²	36.4	3%	0.031	19%	0.189	C	C	.	.	H	α-helix	trans	-67.4	-36.6	-177.2	54	0	0	0	0	111.4	V922 S924 S932 K936 I937 R938 F1054	V922-T934 VanDerWaalsContact O-CG2 3.28Å; V922-T934 WeakPolarHBondContact O-CG2 3.34Å; V922-T934 PolarHBondContact O-N 3.18Å; V922-T934 PolarHBondContact O-OG1 2.97Å; S924-T934 WeakPolarHBondContact CB-OG1 3.44Å; S932-T934 PolarHBondContact O-N 2.7Å; T934-K936 PolarHBondContact O-N 3.23Å; T934-I937 PolarHBondContact O-N 3.49Å; T934-R938 PolarHBondContact O-N 3.27Å; T934-F1054 HydrophobicContact CG2-CD1 4.26Å; T934-F1054 HydrophobicContact CG2-CE1 4.37Å
935	Q	88.6	Confident	87.9	Confident	17 Å²	17	44.4 Å²	44.4	8%	0.079	23%	0.226	C	C	.	.	H	α-helix	trans	-67.4	-36.6	178.6	-163.3	66.6	-3.4	0	0	112.7	C256 Q930 S932 M933 I937 R938 Y939	C256-Q935 PolarHBondContact SG-NE2 2.92Å; Q930-Q935 WeakPolarHBondContact O-CG 3.47Å; S932-Q935 PolarHBondContact O-N 2.93Å; S932-Q935 WeakPolarHBondContact OG-CB 3.49Å; M933-Q935 VanDerWaalsContact C-N 3.34Å; M933-Q935 PolarHBondContact O-N 3.15Å; Q935-I937 VanDerWaalsContact C-N 3.34Å; Q935-R938 PolarHBondContact O-N 3.49Å; Q935-Y939 WeakPolarHBondContact O-CB 3.33Å; Q935-Y939 PolarHBondContact O-N 2.94Å
936	K	89.8	Confident	88	Confident	32 Å²	32	48.4 Å²	48.4	14%	0.139	24%	0.241	C	C	.	.	H	α-helix	trans	-63	-40.2	172.4	-77.9	169.2	172.1	139	0	112.3	F931 S932 M933 T934 Y939 A940 L1077 I1081 D1084	F931-K936 WeakPolarHBondContact O-CE 3.5Å; F931-K936 PolarHBondContact O-NZ 3.32Å; S932-K936 WeakPolarHBondContact O-CG 3.36Å; S932-K936 PolarHBondContact O-N 3.43Å; M933-K936 PolarHBondContact O-N 2.88Å; T934-K936 PolarHBondContact O-N 3.23Å; K936-Y939 PolarHBondContact O-N 3.23Å; K936-A940 PolarHBondContact O-N 3.07Å; K936-A940 VanDerWaalsContact O-N 3.09Å; K936-L1077 HydrophobicContact CB-CD1 4.32Å; K936-I1081 HydrophobicContact CB-CG1 4.28Å; K936-I1081 HydrophobicContact CD-CG1 3.86Å; K936-D1084 VanDerWaalsContact CE-OD2 3.22Å; K936-D1084 WeakPolarHBondContact CE-OD2 3.19Å; K936-D1084 VanDerWaalsContact NZ-CB 3.3Å; K936-D1084 IonicContact NZ-OD2 3.29Å; K936-D1084 PolarHBondContact NZ-OD2 3.35Å
937	I	91	Very high	88.2	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-66.5	-42.9	176.8	-62.2	165.5	0	0	0	109.9	F905 M933 T934 Q935 Y939 A940 T941 M949 A953 A1056 L1077 I1081	F905-I937 HydrophobicContact CB-CD1 4.39Å; F905-I937 HydrophobicContact CD1-CD1 4.44Å; F905-I937 HydrophobicContact CD2-CD1 3.62Å; F905-I937 HydrophobicContact CD2-CG1 4.3Å; F905-I937 HydrophobicContact CE2-CD1 3.96Å; F905-I937 HydrophobicContact CE2-CG1 4.14Å; F905-I937 HydrophobicContact CE2-CG2 4.22Å; F905-I937 HydrophobicContact CG-CD1 3.89Å; F905-I937 HydrophobicContact CZ-CG1 4.35Å; M933-I937 HydrophobicContact CE-CD1 4.37Å; M933-I937 HydrophobicContact CG-CD1 4.34Å; M933-I937 WeakPolarHBondContact O-CG1 3.34Å; M933-I937 PolarHBondContact O-N 3.22Å; T934-I937 PolarHBondContact O-N 3.49Å; Q935-I937 VanDerWaalsContact C-N 3.34Å; I937-Y939 PolarHBondContact O-N 3.42Å; I937-A940 VanDerWaalsContact O-CB 3.3Å; I937-A940 WeakPolarHBondContact O-CB 3.48Å; I937-A940 PolarHBondContact O-N 2.02Å; I937-A940 VanDerWaalsContact O-N 3.12Å; I937-T941 PolarHBondContact O-N 2.93Å; I937-T941 VanDerWaalsContact O-N 3.17Å; I937-M949 HydrophobicContact CG2-CE 4.09Å; I937-A953 HydrophobicContact CB-CB 4.3Å; I937-A953 HydrophobicContact CD1-CB 3.79Å; I937-A953 HydrophobicContact CG2-CB 3.86Å; I937-A1056 HydrophobicContact CG2-CB 4.36Å; I937-L1077 HydrophobicContact CG1-CD2 4.32Å; I937-I1081 HydrophobicContact CD1-CD1 4.35Å; I937-I1081 HydrophobicContact CG1-CD1 3.99Å
938	R	87.9	Confident	88.7	Confident	13 Å²	13	49.6 Å²	49.6	5%	0.049	24%	0.236	C	C	.	.	H	α-helix	trans	-59.8	-46.3	174.3	-177.3	-129.4	176.8	165.5	13.1	112.1	C256 Q257 T934 Q935 A940 T941 D942 P952	C256-R938 VanDerWaalsContact C-NH1 3.33Å; C256-R938 PolarHBondContact O-NH1 2.97Å; Q257-R938 PolarHBondContact O-NH2 3.05Å; T934-R938 PolarHBondContact O-N 3.27Å; Q935-R938 PolarHBondContact O-N 3.49Å; R938-A940 PolarHBondContact O-N 3.46Å; R938-T941 PolarHBondContact O-N 3.3Å; R938-T941 PolarHBondContact O-OG1 3.27Å; R938-D942 PolarHBondContact O-N 3.47Å; R938-P952 HydrophobicContact CB-CB 4.37Å
939	Y	87.5	Confident	88.9	Confident	70 Å²	70	48.7 Å²	48.7	28%	0.275	23%	0.23	S	C	.	.	H	α-helix	trans	-59.1	-33.3	175.8	-176.7	-100.9	0	0	0	112.3	V266 P267 Q935 K936 I937 T941 D942 Y943	V266-Y939 HydrophobicContact CB-CE2 3.86Å; V266-Y939 HydrophobicContact CG1-CE1 4.28Å; V266-Y939 HydrophobicContact CG1-CE2 3.91Å; V266-Y939 WeakPolarHBondContact CG1-OH 3.46Å; V266-Y939 HydrophobicContact CG2-CE2 4.42Å; P267-Y939 PolarHBondContact O-OH 3.39Å; Q935-Y939 WeakPolarHBondContact O-CB 3.33Å; Q935-Y939 PolarHBondContact O-N 2.94Å; K936-Y939 PolarHBondContact O-N 3.23Å; I937-Y939 PolarHBondContact O-N 3.42Å; Y939-T941 VanDerWaalsContact C-N 3.33Å; Y939-D942 PolarHBondContact O-N 3.1Å; Y939-Y943 HydrophobicContact CE1-CE2 4.28Å; Y939-Y943 AromaticContact CE2-CE2 3.91Å; Y939-Y943 HydrophobicContact CE2-CE2 3.91Å; Y939-Y943 AromaticContact CZ-CE2 3.71Å
940	A	88.7	Confident	88.9	Confident	12 Å²	12	46.3 Å²	46.3	10%	0.099	22%	0.222	C	C	.	.	H	α-helix	trans	-65.7	-35.3	173.3	0	0	0	0	0	112.2	K936 I937 R938 D942 Y943 S947 M949 L1077	K936-A940 PolarHBondContact O-N 3.07Å; K936-A940 VanDerWaalsContact O-N 3.09Å; I937-A940 VanDerWaalsContact O-CB 3.3Å; I937-A940 WeakPolarHBondContact O-CB 3.48Å; I937-A940 PolarHBondContact O-N 2.02Å; I937-A940 VanDerWaalsContact O-N 3.12Å; R938-A940 PolarHBondContact O-N 3.46Å; A940-D942 VanDerWaalsContact C-N 3.3Å; A940-D942 PolarHBondContact O-N 3.33Å; A940-Y943 CarbonylContact O-C 3.54Å; A940-Y943 PolarHBondContact O-N 3.43Å; A940-S947 VanDerWaalsContact O-CB 3.29Å; A940-S947 WeakPolarHBondContact O-CB 3.03Å; A940-S947 PolarHBondContact O-OG 2.88Å; A940-M949 HydrophobicContact CB-CG 4.46Å; A940-L1077 HydrophobicContact CB-CD2 3.92Å
941	T	89	Confident	89.2	Confident	15 Å²	15	42.6 Å²	42.6	9%	0.092	21%	0.205	C	C	.	.	H	α-helix	trans	-72	-19.8	179.2	59.4	0	0	0	0	114.6	I937 R938 Y939 Y943 P944 M949 P952	I937-T941 PolarHBondContact O-N 2.93Å; I937-T941 VanDerWaalsContact O-N 3.17Å; R938-T941 PolarHBondContact O-N 3.3Å; R938-T941 PolarHBondContact O-OG1 3.27Å; Y939-T941 VanDerWaalsContact C-N 3.33Å; T941-Y943 PolarHBondContact O-N 2.92Å; T941-P944 WeakPolarHBondContact O-CD 2.86Å; T941-M949 HydrophobicContact CG2-CB 3.75Å; T941-P952 HydrophobicContact CG2-CB 4.3Å
942	D	86.6	Confident	89.3	Confident	80 Å²	80	38 Å²	38	43%	0.428	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-14.6	174	-63.1	-29.4	0	0	0	111.9	R938 Y939 A940	R938-D942 PolarHBondContact O-N 3.47Å; Y939-D942 PolarHBondContact O-N 3.1Å; A940-D942 VanDerWaalsContact C-N 3.3Å; A940-D942 PolarHBondContact O-N 3.33Å
943	Y	88.8	Confident	89.1	Confident	77 Å²	77	38.4 Å²	38.4	30%	0.302	19%	0.19	S	C	.	.			trans	-128	64.5	178.7	-58.4	-77.5	0	0	0	112.3	P268 P269 Y939 A940 T941 E945 R946 S947	P268-Y943 HydrophobicContact CB-CE1 4.21Å; P269-Y943 HydrophobicContact CG-CD2 4.18Å; P269-Y943 HydrophobicContact CG-CG 4.19Å; Y939-Y943 HydrophobicContact CE1-CE2 4.28Å; Y939-Y943 AromaticContact CE2-CE2 3.91Å; Y939-Y943 HydrophobicContact CE2-CE2 3.91Å; Y939-Y943 AromaticContact CZ-CE2 3.71Å; A940-Y943 CarbonylContact O-C 3.54Å; A940-Y943 PolarHBondContact O-N 3.43Å; T941-Y943 PolarHBondContact O-N 2.92Å; Y943-E945 VanDerWaalsContact C-N 3.32Å; Y943-E945 PolarHBondContact O-N 2.94Å; Y943-R946 PolarHBondContact O-N 3.07Å; Y943-R946 VanDerWaalsContact O-N 3.07Å; Y943-S947 PolarHBondContact O-N 3.26Å; Y943-S947 VanDerWaalsContact O-N 3.08Å; Y943-S947 PolarHBondContact O-OG 3.01Å; Y943-S947 VanDerWaalsContact O-OG 3.06Å
944	P	88.6	Confident	89	Confident	52 Å²	52	39.7 Å²	39.7	34%	0.338	20%	0.197	S	C	.	.	H	α-helix	trans	-61.9	-35.4	-170.9	24.6	-33.6	0	0	0	113.2	T941 R946 Y948 M949 T1059	T941-P944 WeakPolarHBondContact O-CD 2.86Å; P944-R946 PolarHBondContact O-N 3.15Å; P944-R946 VanDerWaalsContact O-N 3.09Å; P944-Y948 VanDerWaalsContact O-CA 3.23Å; P944-Y948 WeakPolarHBondContact O-CA 3.35Å; P944-Y948 PolarHBondContact O-N 3.26Å; P944-M949 WeakPolarHBondContact CB-O 3.25Å; P944-T1059 HydrophobicContact CB-CG2 3.69Å
945	E	87.1	Confident	89	Confident	173 Å²	173	39.6 Å²	39.6	81%	0.808	20%	0.196	S	C	*	.	H	α-helix	trans	-62.7	-17.9	178.4	-61.8	-178	174.6	0	0	113.8	Y943	Y943-E945 VanDerWaalsContact C-N 3.32Å; Y943-E945 PolarHBondContact O-N 2.94Å
946	R	86.3	Confident	89.2	Confident	89 Å²	89	38.8 Å²	38.8	34%	0.336	19%	0.193	S	C	.	.	H	α-helix	trans	-112.8	-37	-175.4	-60.2	-176.4	-175.5	-172.3	7.1	113.2	P269 P270 Y943 P944	P269-R946 PolarHBondContact O-NH1 3.02Å; P270-R946 PolarHBondContact O-NH1 3.2Å; Y943-R946 PolarHBondContact O-N 3.07Å; Y943-R946 VanDerWaalsContact O-N 3.07Å; P944-R946 PolarHBondContact O-N 3.15Å; P944-R946 VanDerWaalsContact O-N 3.09Å
947	S	89.4	Confident	89.3	Confident	17 Å²	17	37.3 Å²	37.3	12%	0.119	19%	0.186	C	C	.	.	H	α-helix	trans	-92.1	-17.7	-179.5	66.2	0	0	0	0	112.8	A940 Y943 M949	A940-S947 VanDerWaalsContact O-CB 3.29Å; A940-S947 WeakPolarHBondContact O-CB 3.03Å; A940-S947 PolarHBondContact O-OG 2.88Å; Y943-S947 PolarHBondContact O-N 3.26Å; Y943-S947 VanDerWaalsContact O-N 3.08Å; Y943-S947 PolarHBondContact O-OG 3.01Å; Y943-S947 VanDerWaalsContact O-OG 3.06Å; S947-M949 PolarHBondContact O-N 3.2Å; S947-M949 PolarHBondContact OG-N 2.95Å
948	Y	92.9	Very high	89.3	Confident	55 Å²	55	37.3 Å²	37.3	22%	0.216	19%	0.186	C	C	.	.			trans	58.1	27	-170.1	-59.3	-90.2	0	0	0	113.1	P944 H1058 T1059 L1061 E1066 A1069 A1070 K1073	P944-Y948 VanDerWaalsContact O-CA 3.23Å; P944-Y948 WeakPolarHBondContact O-CA 3.35Å; P944-Y948 PolarHBondContact O-N 3.26Å; Y948-H1058 CarbonylContact O-C 3.41Å; Y948-H1058 WeakPolarHBondContact O-CA 3.19Å; Y948-H1058 WeakPolarHBondContact O-CB 3.23Å; Y948-H1058 PolarHBondContact O-ND1 3.15Å; Y948-T1059 PolarHBondContact O-N 3.28Å; Y948-L1061 HydrophobicContact CD1-CD2 3.71Å; Y948-L1061 HydrophobicContact CE1-CD2 4.48Å; Y948-L1061 HydrophobicContact CG-CD2 4.38Å; Y948-E1066 HydrophobicContact CE1-CB 4.34Å; Y948-E1066 HydrophobicContact CE1-CG 4.08Å; Y948-A1069 HydrophobicContact CD2-CB 4.5Å; Y948-A1069 HydrophobicContact CE2-CB 3.69Å; Y948-A1070 HydrophobicContact CD1-CB 4.49Å; Y948-A1070 HydrophobicContact CD2-CB 4.32Å; Y948-A1070 HydrophobicContact CG-CB 3.93Å; Y948-K1073 HydrophobicContact CD2-CG 4.43Å
949	M	91.5	Very high	89.3	Confident	2 Å²	2	36.9 Å²	36.9	1%	0.01	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	125.1	178.4	-63.1	-66.3	-68.4	0	0	109.6	V903 F905 I937 A940 T941 P944 S947 A1056	V903-M949 HydrophobicContact CG1-CE 3.66Å; V903-M949 HydrophobicContact CG1-SD 3.81Å; F905-M949 HydrophobicContact CE2-CE 3.84Å; F905-M949 HydrophobicContact CZ-CE 4.25Å; I937-M949 HydrophobicContact CG2-CE 4.09Å; A940-M949 HydrophobicContact CB-CG 4.46Å; T941-M949 HydrophobicContact CG2-CB 3.75Å; P944-M949 WeakPolarHBondContact CB-O 3.25Å; S947-M949 PolarHBondContact O-N 3.2Å; S947-M949 PolarHBondContact OG-N 2.95Å; M949-A1056 HydrophobicContact CE-CB 3.4Å; M949-A1056 VanDerWaalsContact CE-CB 3.4Å
950	A	88.6	Confident	89.5	Confident	38 Å²	38	33.6 Å²	33.6	31%	0.314	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	-46.1	-177.9	0	0	0	0	0	112.5	Y1057 T1059	A950-Y1057 PolarHBondContact N-O 3.14Å; A950-T1059 HydrophobicContact CB-CG2 4.07Å
951	I	88.7	Confident	89.6	Confident	34 Å²	34	33.2 Å²	33.2	17%	0.174	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	132.6	-176.2	-55.3	177.6	0	0	0	108.9	F555 V899 Y1057	F555-I951 HydrophobicContact CE1-CD1 3.99Å; F555-I951 HydrophobicContact CE2-CD1 4.32Å; F555-I951 HydrophobicContact CZ-CD1 3.77Å; V899-I951 HydrophobicContact CG1-CD1 4.07Å; I951-Y1057 HydrophobicContact CB-CD2 4.07Å; I951-Y1057 HydrophobicContact CB-CG 4.43Å; I951-Y1057 HydrophobicContact CD1-CD2 3.95Å; I951-Y1057 HydrophobicContact CD1-CG 4.09Å; I951-Y1057 HydrophobicContact CG1-CD2 4.5Å; I951-Y1057 HydrophobicContact CG2-CD2 4.32Å; I951-Y1057 PolarHBondContact N-O 2.9Å; I951-Y1057 PolarHBondContact O-N 3.05Å
952	P	88.9	Confident	89.4	Confident	14 Å²	14	32.8 Å²	32.8	9%	0.091	17%	0.166	C	C	.	.	P	Polyproline II helix	trans	-66.7	163.9	-179.4	28.5	-36.3	0	0	0	111.9	R938 T941	R938-P952 HydrophobicContact CB-CB 4.37Å; T941-P952 HydrophobicContact CG2-CB 4.3Å
953	A	88.9	Confident	89.5	Confident	10 Å²	10	29 Å²	29	8%	0.083	15%	0.145	C	C	.	.	P	Polyproline II helix	trans	-68.4	137.7	179.5	0	0	0	0	0	112.1	I937 F1054 M1055 A1056	I937-A953 HydrophobicContact CB-CB 4.3Å; I937-A953 HydrophobicContact CD1-CB 3.79Å; I937-A953 HydrophobicContact CG2-CB 3.86Å; A953-F1054 HydrophobicContact CB-CB 4.25Å; A953-M1055 CarbonylContact C-O 3.55Å; A953-M1055 VanDerWaalsContact CA-O 3.23Å; A953-M1055 WeakPolarHBondContact CA-O 3.37Å; A953-A1056 HydrophobicContact CB-CB 4.18Å
954	N	89.3	Confident	89.5	Confident	29 Å²	29	25.4 Å²	25.4	16%	0.155	13%	0.131	C	C	.	.	P	Polyproline II helix	trans	-69.1	153.2	161.4	71.4	0.3	0	0	0	110.1	P176 Y1037 F1054 M1055	P176-N954 WeakPolarHBondContact O-CA 3.25Å; N954-Y1037 HydrophobicContact CB-CE1 4.3Å; N954-F1054 VanDerWaalsContact O-CD1 3.31Å; N954-F1054 WeakPolarHBondContact O-CD1 3.42Å; N954-M1055 PolarHBondContact N-O 2.84Å; N954-M1055 WeakPolarHBondContact OD1-CB 3.39Å; N954-M1055 PolarHBondContact OD1-N 3.37Å; N954-M1055 PolarHBondContact OD1-O 3.26Å
955	S	90.9	Very high	89.4	Confident	2 Å²	2	23.9 Å²	23.9	1%	0.014	12%	0.12	C	C	.	.			trans	-140.6	109.5	-175.6	178.8	0	0	0	0	111.5	V957 D958 D959	S955-V957 VanDerWaalsContact C-N 3.26Å; S955-V957 PolarHBondContact O-N 2.96Å; S955-D958 WeakPolarHBondContact CB-OD2 3.42Å; S955-D958 PolarHBondContact O-N 3.31Å; S955-D958 PolarHBondContact OG-N 2.99Å; S955-D958 PolarHBondContact OG-OD2 2.72Å; S955-D959 PolarHBondContact O-N 2.94Å
956	W	92.1	Very high	89.1	Confident	1 Å²	1	16 Å²	16	0%	0.004	8%	0.084	C	C	.	.	H	α-helix	trans	-67.5	-28.3	176	69.9	-92.7	0	0	0	112.2	F913 F960 F1013 L1017 Y1037 V1041 I1049 T1052 F1054	F913-W956 HydrophobicContact CD1-CZ2 4.12Å; F913-W956 HydrophobicContact CE1-CZ2 4.41Å; F913-W956 HydrophobicContact CG-CZ2 4.39Å; W956-F960 HydrophobicContact CE3-CB 4.42Å; W956-F960 WeakPolarHBondContact O-CB 3.19Å; W956-F960 PolarHBondContact O-N 2.95Å; W956-F1013 AromaticContact CH2-CZ 3.91Å; W956-F1013 HydrophobicContact CH2-CZ 3.91Å; W956-F1013 HydrophobicContact CZ3-CE2 4.48Å; W956-F1013 HydrophobicContact CZ3-CZ 4.07Å; W956-L1017 HydrophobicContact CE3-CD1 4.1Å; W956-L1017 HydrophobicContact CZ3-CD1 3.67Å; W956-L1017 HydrophobicContact CZ3-CD2 4.46Å; W956-Y1037 HydrophobicContact CB-CD1 3.52Å; W956-Y1037 HydrophobicContact CB-CD2 3.92Å; W956-Y1037 HydrophobicContact CB-CE1 3.95Å; W956-Y1037 HydrophobicContact CB-CE2 4.32Å; W956-Y1037 HydrophobicContact CB-CG 3.49Å; W956-Y1037 VanDerWaalsContact CB-CG 3.49Å; W956-V1041 HydrophobicContact CB-CG2 4.45Å; W956-V1041 HydrophobicContact CD2-CG2 3.57Å; W956-V1041 HydrophobicContact CE3-CG2 4.08Å; W956-V1041 HydrophobicContact CG-CG2 3.74Å; W956-V1041 HydrophobicContact CZ2-CG2 4.19Å; W956-I1049 HydrophobicContact CH2-CD1 3.49Å; W956-I1049 VanDerWaalsContact CH2-CD1 3.49Å; W956-I1049 HydrophobicContact CZ2-CD1 3.87Å; W956-T1052 HydrophobicContact CZ2-CG2 4.35Å; W956-T1052 PolarHBondContact NE1-OG1 2.89Å; W956-F1054 AromaticContact CD1-CE1 3.94Å; W956-F1054 AromaticContact CD1-CZ 3.92Å; W956-F1054 AromaticContact NE1-CZ 3.54Å
957	V	92.6	Very high	88.4	Confident	1 Å²	1	13.1 Å²	13.1	1%	0.006	8%	0.082	C	C	.	.	H	α-helix	trans	-66.5	-44.1	178.8	-178.4	0	0	0	0	109.8	M919 V922 C923 S955 F960 I961 F1054	M919-V957 HydrophobicContact CG-CG1 4.49Å; V922-V957 HydrophobicContact CG1-CB 4.47Å; V922-V957 HydrophobicContact CG1-CG2 3.96Å; C923-V957 HydrophobicContact CB-CG1 4.03Å; S955-V957 VanDerWaalsContact C-N 3.26Å; S955-V957 PolarHBondContact O-N 2.96Å; V957-F960 PolarHBondContact O-N 2.89Å; V957-I961 HydrophobicContact CG1-CD1 3.94Å; V957-I961 VanDerWaalsContact O-CG1 3.26Å; V957-I961 WeakPolarHBondContact O-CG1 3.23Å; V957-I961 PolarHBondContact O-N 2.89Å; V957-F1054 HydrophobicContact CG2-CE1 4.5Å; V957-F1054 HydrophobicContact CG2-CZ 4.3Å
958	D	90.1	Very high	87.8	Confident	0 Å²	0	12.7 Å²	12.7	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-63.1	-48.1	177.1	-78.9	-77	0	0	0	111.8	R108 P176 C923 S924 S925 S955 F960 I961 D962	R108-D958 IonicContact CZ-OD1 2.99Å; R108-D958 IonicContact NH1-OD1 3.57Å; R108-D958 PolarHBondContact NH1-OD1 3.15Å; R108-D958 IonicContact NH2-OD1 2.53Å; R108-D958 PolarHBondContact NH2-OD1 2.92Å; P176-D958 HydrophobicContact CB-CB 4.18Å; P176-D958 HydrophobicContact CG-CB 3.92Å; C923-D958 WeakPolarHBondContact CA-OD2 3.21Å; S924-D958 PolarHBondContact N-OD1 3.19Å; S924-D958 PolarHBondContact N-OD2 2.87Å; S924-D958 PolarHBondContact OG-OD1 3.33Å; S925-D958 PolarHBondContact N-OD1 3.5Å; S955-D958 WeakPolarHBondContact CB-OD2 3.42Å; S955-D958 PolarHBondContact O-N 3.31Å; S955-D958 PolarHBondContact OG-N 2.99Å; S955-D958 PolarHBondContact OG-OD2 2.72Å; D958-F960 VanDerWaalsContact C-N 3.32Å; D958-F960 PolarHBondContact O-N 2.85Å; D958-I961 PolarHBondContact O-N 3.21Å; D958-D962 WeakPolarHBondContact O-CB 3.34Å; D958-D962 VanDerWaalsContact O-CG 3.25Å; D958-D962 PolarHBondContact O-N 3.13Å
959	D	89.4	Confident	87.1	Confident	4 Å²	4	13 Å²	13	2%	0.021	8%	0.082	C	C	.	.	H	α-helix	trans	-70.2	-29	179.4	-75.5	-22.2	0	0	0	112.7	A177 S955 W963 F1020 Y1037	A177-D959 WeakPolarHBondContact CA-OD2 3.29Å; A177-D959 WeakPolarHBondContact CB-OD2 3.41Å; A177-D959 PolarHBondContact N-OD2 2.71Å; A177-D959 VanDerWaalsContact N-OD2 3.13Å; S955-D959 PolarHBondContact O-N 2.94Å; D959-W963 WeakPolarHBondContact O-CB 3.31Å; D959-W963 PolarHBondContact O-N 2.95Å; D959-F1020 HydrophobicContact CB-CZ 4.16Å; D959-Y1037 HydrophobicContact CB-CE2 3.91Å; D959-Y1037 VanDerWaalsContact OD2-CE2 3.31Å; D959-Y1037 WeakPolarHBondContact OD2-CE2 3.4Å; D959-Y1037 PolarHBondContact OD2-OH 3.1Å
960	F	91.3	Very high	86.7	Confident	0 Å²	0	13.1 Å²	13.1	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-67.7	-47	172.5	176.5	-117.4	0	0	0	112.1	W956 V957 D958 D962 W963 L964 P1008 F1013 F1016 L1017 F1020	W956-F960 HydrophobicContact CE3-CB 4.42Å; W956-F960 WeakPolarHBondContact O-CB 3.19Å; W956-F960 PolarHBondContact O-N 2.95Å; V957-F960 PolarHBondContact O-N 2.89Å; D958-F960 VanDerWaalsContact C-N 3.32Å; D958-F960 PolarHBondContact O-N 2.85Å; F960-D962 VanDerWaalsContact C-N 3.29Å; F960-D962 PolarHBondContact O-N 2.9Å; F960-W963 HydrophobicContact CD2-CE3 4.25Å; F960-W963 HydrophobicContact CE2-CE3 4.26Å; F960-W963 HydrophobicContact CE2-CZ3 4.28Å; F960-W963 PolarHBondContact O-N 2.82Å; F960-L964 HydrophobicContact CD1-CD1 4.1Å; F960-L964 HydrophobicContact CD2-CD1 4.42Å; F960-L964 HydrophobicContact CD2-CG 4.36Å; F960-L964 HydrophobicContact CE1-CD1 3.55Å; F960-L964 HydrophobicContact CE1-CG 4.46Å; F960-L964 HydrophobicContact CE2-CD1 3.93Å; F960-L964 HydrophobicContact CE2-CD2 4.31Å; F960-L964 HydrophobicContact CE2-CG 4.01Å; F960-L964 HydrophobicContact CZ-CD1 3.49Å; F960-L964 VanDerWaalsContact CZ-CD1 3.49Å; F960-L964 HydrophobicContact CZ-CD2 4.42Å; F960-L964 HydrophobicContact CZ-CG 4.08Å; F960-L964 WeakPolarHBondContact O-CG 3.42Å; F960-L964 PolarHBondContact O-N 2.98Å; F960-P1008 HydrophobicContact CE1-CG 4.26Å; F960-F1013 HydrophobicContact CD1-CD2 4.31Å; F960-F1013 HydrophobicContact CD1-CE2 4.01Å; F960-F1013 AromaticContact CE1-CD2 3.51Å; F960-F1013 HydrophobicContact CE1-CD2 3.51Å; F960-F1013 AromaticContact CE1-CE2 3.61Å; F960-F1013 HydrophobicContact CE1-CE2 3.61Å; F960-F1013 HydrophobicContact CE1-CG 4.3Å; F960-F1013 HydrophobicContact CE1-CZ 4.48Å; F960-F1013 HydrophobicContact CZ-CD2 4.34Å; F960-F1016 HydrophobicContact CE2-CB 4.35Å; F960-F1016 HydrophobicContact CZ-CB 4.39Å; F960-L1017 HydrophobicContact CD2-CD1 4.28Å; F960-L1017 HydrophobicContact CE2-CB 4.3Å; F960-L1017 HydrophobicContact CE2-CD1 4.31Å; F960-L1017 HydrophobicContact CG-CD1 4.48Å; F960-L1017 HydrophobicContact CZ-CB 4.19Å; F960-F1020 HydrophobicContact CB-CD1 4.11Å; F960-F1020 HydrophobicContact CB-CE1 3.97Å; F960-F1020 HydrophobicContact CB-CG 4.45Å; F960-F1020 HydrophobicContact CB-CZ 4.2Å; F960-F1020 HydrophobicContact CD2-CB 3.63Å; F960-F1020 AromaticContact CD2-CD1 3.77Å; F960-F1020 HydrophobicContact CD2-CD1 3.77Å; F960-F1020 HydrophobicContact CD2-CD2 4.22Å; F960-F1020 HydrophobicContact CD2-CE1 4.48Å; F960-F1020 AromaticContact CD2-CG 3.61Å; F960-F1020 HydrophobicContact CD2-CG 3.61Å; F960-F1020 HydrophobicContact CE2-CB 3.91Å; F960-F1020 HydrophobicContact CE2-CG 4.39Å; F960-F1020 HydrophobicContact CG-CD1 4.33Å; F960-F1020 HydrophobicContact CG-CG 4.49Å
961	I	89.9	Confident	86.7	Confident	4 Å²	4	11.7 Å²	11.7	2%	0.021	7%	0.07	C	C	.	.	H	α-helix	trans	-60.5	-43.6	175.8	-70	166.4	0	0	0	110.1	C923 V957 D958 L964 N965 V1006	C923-I961 HydrophobicContact CB-CD1 4.11Å; V957-I961 HydrophobicContact CG1-CD1 3.94Å; V957-I961 VanDerWaalsContact O-CG1 3.26Å; V957-I961 WeakPolarHBondContact O-CG1 3.23Å; V957-I961 PolarHBondContact O-N 2.89Å; D958-I961 PolarHBondContact O-N 3.21Å; I961-L964 PolarHBondContact O-N 3.39Å; I961-N965 PolarHBondContact O-N 3Å; I961-V1006 WeakPolarHBondContact CG2-O 3.42Å
962	D	86.3	Confident	86.7	Confident	7 Å²	7	11.8 Å²	11.8	4%	0.037	7%	0.068	C	C	.	.	H	α-helix	trans	-67.1	-36.3	178.4	-73.9	-17.7	0	0	0	112.5	R108 D958 F960 N965 K1031	R108-D962 WeakPolarHBondContact CD-OD2 3.47Å; R108-D962 WeakPolarHBondContact CG-OD2 3.45Å; R108-D962 IonicContact CZ-OD2 2.63Å; R108-D962 IonicContact NH1-OD1 2.94Å; R108-D962 IonicContact NH1-OD2 3.84Å; R108-D962 PolarHBondContact NH1-OD2 3.28Å; D958-D962 WeakPolarHBondContact O-CB 3.34Å; D958-D962 VanDerWaalsContact O-CG 3.25Å; D958-D962 PolarHBondContact O-N 3.13Å; F960-D962 VanDerWaalsContact C-N 3.29Å; F960-D962 PolarHBondContact O-N 2.9Å; D962-N965 WeakPolarHBondContact O-CB 3.09Å; D962-N965 PolarHBondContact O-N 3.14Å; D962-K1031 HydrophobicContact CB-CD 3.51Å; D962-K1031 IonicContact OD2-NZ 3.96Å; D962-K1031 PolarHBondContact OD2-NZ 3.1Å
963	W	87.7	Confident	86.6	Confident	0 Å²	0	11.5 Å²	11.5	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-67.9	-36	176	176.3	86.5	0	0	0	112.7	D959 F960 N965 C970 C971 F983 F1016 D1019 F1020 N1023 K1031	D959-W963 WeakPolarHBondContact O-CB 3.31Å; D959-W963 PolarHBondContact O-N 2.95Å; F960-W963 HydrophobicContact CD2-CE3 4.25Å; F960-W963 HydrophobicContact CE2-CE3 4.26Å; F960-W963 HydrophobicContact CE2-CZ3 4.28Å; F960-W963 PolarHBondContact O-N 2.82Å; W963-N965 PolarHBondContact O-N 3.5Å; W963-C970 VanDerWaalsContact CD1-CB 3.4Å; W963-C970 HydrophobicContact CG-CB 4.04Å; W963-C970 WeakPolarHBondContact O-CB 3.2Å; W963-C971 HydrophobicContact CD2-CB 4.25Å; W963-C971 HydrophobicContact CE3-CB 4.08Å; W963-C971 HydrophobicContact CH2-CB 3.93Å; W963-C971 WeakPolarHBondContact CH2-SG 3.42Å; W963-C971 HydrophobicContact CZ2-CB 4.09Å; W963-C971 HydrophobicContact CZ3-CB 3.91Å; W963-C971 WeakPolarHBondContact CZ3-SG 3.18Å; W963-F983 HydrophobicContact CH2-CD2 4.24Å; W963-F983 AromaticContact CH2-CE2 3.95Å; W963-F983 HydrophobicContact CH2-CE2 3.95Å; W963-F983 HydrophobicContact CZ2-CD2 4.08Å; W963-F983 AromaticContact CZ2-CE2 3.36Å; W963-F983 HydrophobicContact CZ2-CE2 3.36Å; W963-F983 AromaticContact CZ2-CZ 3.76Å; W963-F983 HydrophobicContact CZ2-CZ 3.76Å; W963-F1016 HydrophobicContact CZ3-CB 4.14Å; W963-D1019 HydrophobicContact CH2-CB 4.03Å; W963-F1020 HydrophobicContact CB-CD2 3.88Å; W963-F1020 HydrophobicContact CB-CE2 4.05Å; W963-F1020 HydrophobicContact CD2-CB 4.22Å; W963-F1020 AromaticContact CD2-CD2 3.86Å; W963-F1020 HydrophobicContact CD2-CD2 3.86Å; W963-F1020 HydrophobicContact CE3-CB 3.92Å; W963-F1020 HydrophobicContact CE3-CD2 4.2Å; W963-F1020 HydrophobicContact CE3-CG 4.46Å; W963-F1020 AromaticContact CG-CD2 3.7Å; W963-F1020 HydrophobicContact CG-CD2 3.7Å; W963-F1020 HydrophobicContact CG-CE2 4.27Å; W963-F1020 HydrophobicContact CH2-CB 4.29Å; W963-F1020 HydrophobicContact CZ3-CB 3.96Å; W963-N1023 PolarHBondContact NE1-ND2 2.99Å; W963-K1031 HydrophobicContact CB-CB 4.46Å
964	L	89.4	Confident	86.6	Confident	2 Å²	2	13 Å²	13	1%	0.01	7%	0.069	C	C	.	.	H	α-helix	trans	-70.1	-15.9	174.1	-76.1	177.4	0	0	0	113.3	F960 I961 C971 L998 P1008 F1016	F960-L964 HydrophobicContact CD1-CD1 4.1Å; F960-L964 HydrophobicContact CD2-CD1 4.42Å; F960-L964 HydrophobicContact CD2-CG 4.36Å; F960-L964 HydrophobicContact CE1-CD1 3.55Å; F960-L964 HydrophobicContact CE1-CG 4.46Å; F960-L964 HydrophobicContact CE2-CD1 3.93Å; F960-L964 HydrophobicContact CE2-CD2 4.31Å; F960-L964 HydrophobicContact CE2-CG 4.01Å; F960-L964 HydrophobicContact CZ-CD1 3.49Å; F960-L964 VanDerWaalsContact CZ-CD1 3.49Å; F960-L964 HydrophobicContact CZ-CD2 4.42Å; F960-L964 HydrophobicContact CZ-CG 4.08Å; F960-L964 WeakPolarHBondContact O-CG 3.42Å; F960-L964 PolarHBondContact O-N 2.98Å; I961-L964 PolarHBondContact O-N 3.39Å; L964-C971 HydrophobicContact CD2-CB 4.49Å; L964-L998 HydrophobicContact CB-CD1 3.91Å; L964-L998 HydrophobicContact CD1-CD1 4.27Å; L964-L998 HydrophobicContact CD2-CD1 4.44Å; L964-L998 HydrophobicContact CG-CD1 4.46Å; L964-P1008 HydrophobicContact CD1-CB 3.96Å; L964-P1008 HydrophobicContact CD1-CG 3.77Å; L964-F1016 HydrophobicContact CD2-CB 3.87Å; L964-F1016 HydrophobicContact CD2-CD2 3.93Å; L964-F1016 HydrophobicContact CD2-CG 4.1Å
965	N	85.5	Confident	86.3	Confident	20 Å²	20	14.5 Å²	14.5	11%	0.107	8%	0.08	C	C	.	.			trans	-62.9	123.8	-172.8	-166.2	-44.9	0	0	0	111.3	I107 I961 D962 W963 G967 S968 V1006	I107-N965 HydrophobicContact CD1-CB 4.4Å; I107-N965 WeakPolarHBondContact CD1-ND2 3.46Å; I107-N965 VanDerWaalsContact CD1-OD1 3.25Å; I107-N965 WeakPolarHBondContact CD1-OD1 3.46Å; I107-N965 VanDerWaalsContact CG1-ND2 3.34Å; I107-N965 WeakPolarHBondContact CG1-ND2 3.32Å; I961-N965 PolarHBondContact O-N 3Å; D962-N965 WeakPolarHBondContact O-CB 3.09Å; D962-N965 PolarHBondContact O-N 3.14Å; W963-N965 PolarHBondContact O-N 3.5Å; N965-G967 PolarHBondContact O-N 3.1Å; N965-G967 VanDerWaalsContact O-N 3.11Å; N965-G967 PolarHBondContact OD1-N 2.95Å; N965-S968 WeakPolarHBondContact O-CB 3.09Å; N965-S968 PolarHBondContact O-N 3.2Å; N965-S968 PolarHBondContact O-OG 3.14Å; N965-V1006 HydrophobicContact CB-CG2 4.43Å
966	P	80.9	Confident	85.6	Confident	7 Å²	7	17.7 Å²	17.7	5%	0.045	10%	0.102	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-11.3	-178.2	27.3	-34.8	0	0	0	113.8	K996	P966-K996 HydrophobicContact CB-CD 3.82Å; P966-K996 WeakPolarHBondContact O-CE 3.2Å; P966-K996 PolarHBondContact O-NZ 3.3Å
967	G	72	Confident	85	Confident	28 Å²	28	20.2 Å²	20.2	29%	0.289	13%	0.128	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-18.6	169.2	0	0	0	0	0	113.6	N965	N965-G967 PolarHBondContact O-N 3.1Å; N965-G967 VanDerWaalsContact O-N 3.11Å; N965-G967 PolarHBondContact OD1-N 2.95Å
968	S	76.7	Confident	84.4	Confident	9 Å²	9	26.3 Å²	26.3	6%	0.063	17%	0.168	C	C	.	.	S	Bend	trans	-96	163.9	175.9	78.6	0	0	0	0	112.1	N965 C970	N965-S968 WeakPolarHBondContact O-CB 3.09Å; N965-S968 PolarHBondContact O-N 3.2Å; N965-S968 PolarHBondContact O-OG 3.14Å; S968-C970 VanDerWaalsContact C-N 3.28Å; S968-C970 WeakPolarHBondContact OG-CB 3.24Å; S968-C970 PolarHBondContact OG-N 2.89Å
969	K	78.4	Confident	83.9	Confident	62 Å²	62	30.1 Å²	30.1	27%	0.27	19%	0.188	S	C	.	.	S	Bend	trans	-89.4	7.2	171.7	-69.3	-176.5	179.7	174	0	113.5	T100 R972	T100-K969 WeakPolarHBondContact OG1-CE 3.41Å; K969-R972 PolarHBondContact O-NE 3.27Å
970	C	83.7	Confident	83.5	Confident	4 Å²	4	32.5 Å²	32.5	3%	0.027	21%	0.209	C	C	.	.	S	Bend	trans	-70.3	-60.5	-169.4	-76.9	0	0	0	0	113.3	W963 S968 R972 C1029	W963-C970 VanDerWaalsContact CD1-CB 3.4Å; W963-C970 HydrophobicContact CG-CB 4.04Å; W963-C970 WeakPolarHBondContact O-CB 3.2Å; S968-C970 VanDerWaalsContact C-N 3.28Å; S968-C970 WeakPolarHBondContact OG-CB 3.24Å; S968-C970 PolarHBondContact OG-N 2.89Å; C970-R972 PolarHBondContact O-N 3.28Å; C970-C1029 WeakPolarHBondContact CA-SG 3.43Å; C970-C1029 HydrophobicContact CB-CB 4.06Å; C970-C1029 WeakPolarHBondContact CB-SG 3.07Å; C970-C1029 VanDerWaalsContact SG-CA 3.55Å; C970-C1029 WeakPolarHBondContact SG-CB 3.02Å; C970-C1029 CovalentContact SG-SG 2.03Å; C970-C1029 PolarHBondContact SG-SG 3.01Å
971	C	88.1	Confident	82.9	Confident	7 Å²	7	33.8 Å²	33.8	5%	0.047	22%	0.222	C	C	.	.	S	Bend	trans	-94.6	102.4	-178	-160.4	0	0	0	0	112.1	W963 L964 C997	W963-C971 HydrophobicContact CD2-CB 4.25Å; W963-C971 HydrophobicContact CE3-CB 4.08Å; W963-C971 HydrophobicContact CH2-CB 3.93Å; W963-C971 WeakPolarHBondContact CH2-SG 3.42Å; W963-C971 HydrophobicContact CZ2-CB 4.09Å; W963-C971 HydrophobicContact CZ3-CB 3.91Å; W963-C971 WeakPolarHBondContact CZ3-SG 3.18Å; L964-C971 HydrophobicContact CD2-CB 4.49Å; C971-C997 VanDerWaalsContact CA-SG 3.53Å; C971-C997 HydrophobicContact CB-CB 3.7Å; C971-C997 WeakPolarHBondContact CB-SG 3.38Å; C971-C997 PolarHBondContact O-N 3.27Å; C971-C997 PolarHBondContact O-SG 2.02Å; C971-C997 WeakPolarHBondContact SG-CB 3.36Å; C971-C997 CovalentContact SG-SG 2.03Å; C971-C997 PolarHBondContact SG-SG 3.23Å
972	R	88.3	Confident	82.7	Confident	37 Å²	37	38.1 Å²	38.1	14%	0.14	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	155.9	177.6	-60.6	-177.4	-63.9	152.2	3.9	111.5	K969 C970 C984 P985 A986 I988 K995	K969-R972 PolarHBondContact O-NE 3.27Å; C970-R972 PolarHBondContact O-N 3.28Å; R972-C984 HydrophobicContact CB-CB 4.39Å; R972-C984 PolarHBondContact O-N 2.92Å; R972-P985 PolarHBondContact NH2-O 3.11Å; R972-A986 PolarHBondContact NH2-O 2.78Å; R972-A986 VanDerWaalsContact NH2-O 3.15Å; R972-I988 PolarHBondContact NH2-O 2.74Å; R972-K995 WeakPolarHBondContact CA-O 3.45Å
973	L	87.8	Confident	82.8	Confident	8 Å²	8	39.5 Å²	39.5	4%	0.042	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	146.1	178.4	-59.9	176.8	0	0	0	110.7	T975 N982 K995 F1016	L973-T975 PolarHBondContact O-N 3.09Å; L973-N982 WeakPolarHBondContact CA-O 3.2Å; L973-K995 HydrophobicContact CB-CB 4.42Å; L973-K995 PolarHBondContact N-O 3.07Å; L973-F1016 HydrophobicContact CD2-CE1 4.19Å
974	Y	87.3	Confident	82.7	Confident	40 Å²	40	39.5 Å²	39.5	16%	0.157	25%	0.251	C	S	.	.			trans	-63.9	129.1	170.3	-74.6	-82.6	0	0	0	110.7	N979 A980 G981 N982 F983 C984 I988 S992 C993	Y974-N979 VanDerWaalsContact CB-O 3.29Å; Y974-N979 WeakPolarHBondContact CB-O 3.31Å; Y974-N979 HydrophobicContact CD2-CB 3.82Å; Y974-N979 HydrophobicContact CE2-CB 4.13Å; Y974-N979 HydrophobicContact CG-CB 4.09Å; Y974-A980 WeakPolarHBondContact O-CA 3.43Å; Y974-G981 PolarHBondContact O-N 3.02Å; Y974-N982 WeakPolarHBondContact CD2-O 3.4Å; Y974-N982 PolarHBondContact N-O 3.3Å; Y974-F983 VanDerWaalsContact CE2-O 3.31Å; Y974-F983 WeakPolarHBondContact CE2-O 3.38Å; Y974-C984 HydrophobicContact CD1-CB 4.49Å; Y974-C984 HydrophobicContact CD2-CB 3.83Å; Y974-C984 HydrophobicContact CE1-CB 4.43Å; Y974-C984 HydrophobicContact CE2-CB 3.76Å; Y974-C984 HydrophobicContact CG-CB 4.2Å; Y974-I988 WeakPolarHBondContact OH-CD1 3.25Å; Y974-S992 CarbonylContact C-O 3.39Å; Y974-S992 WeakPolarHBondContact CA-O 3.4Å; Y974-C993 WeakPolarHBondContact CD1-SG 3.24Å; Y974-C993 WeakPolarHBondContact CE1-SG 3.18Å
975	T	83.3	Confident	82.4	Confident	62 Å²	62	41.7 Å²	41.7	38%	0.38	27%	0.265	S	S	.	.			trans	-88	-27.3	178.2	49.6	0	0	0	0	113.4	L973 L991 S992 L994 K995	L973-T975 PolarHBondContact O-N 3.09Å; T975-L991 PolarHBondContact OG1-O 3.04Å; T975-S992 PolarHBondContact N-O 2.95Å; T975-S992 WeakPolarHBondContact OG1-CA 3.38Å; T975-S992 PolarHBondContact OG1-O 3.32Å; T975-L994 HydrophobicContact CG2-CB 3.98Å; T975-K995 HydrophobicContact CG2-CB 3.62Å
976	S	77.4	Confident	82.1	Confident	68 Å²	68	41 Å²	41	48%	0.476	26%	0.262	S	S	.	.	S	Bend	trans	-150.2	155.6	-175.4	54.9	0	0	0	0	111.3
977	G	79.8	Confident	81.8	Confident	54 Å²	54	46.5 Å²	46.5	56%	0.557	29%	0.291	S	S	*	.	S	Bend	trans	99	-176.2	-178.5	0	0	0	0	0	114.3	N979 A980	G977-N979 PolarHBondContact O-N 3.17Å; G977-A980 VanDerWaalsContact O-CB 3.32Å; G977-A980 WeakPolarHBondContact O-CB 3.32Å; G977-A980 PolarHBondContact O-N 2.89Å; G977-A980 VanDerWaalsContact O-N 3.14Å
978	P	78.5	Confident	82.1	Confident	130 Å²	130	48 Å²	48	84%	0.844	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-20.1	-175.1	26.3	-34.3	0	0	0	113.7
979	N	79.8	Confident	81.5	Confident	79 Å²	79	54.2 Å²	54.2	42%	0.422	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98	12	178.2	-65	-28.3	0	0	0	113	Y974 G977 G981 N982	Y974-N979 VanDerWaalsContact CB-O 3.29Å; Y974-N979 WeakPolarHBondContact CB-O 3.31Å; Y974-N979 HydrophobicContact CD2-CB 3.82Å; Y974-N979 HydrophobicContact CE2-CB 4.13Å; Y974-N979 HydrophobicContact CG-CB 4.09Å; G977-N979 PolarHBondContact O-N 3.17Å; N979-G981 PolarHBondContact O-N 3.07Å; N979-N982 HydrophobicContact CB-CB 4.49Å; N979-N982 VanDerWaalsContact O-CB 3.28Å; N979-N982 WeakPolarHBondContact O-CB 3.4Å; N979-N982 PolarHBondContact O-N 2.96Å
980	A	80.6	Confident	80.8	Confident	55 Å²	55	52.7 Å²	52.7	46%	0.455	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.5	127.6	-177.8	0	0	0	0	0	111.6	Y974 G977	Y974-A980 WeakPolarHBondContact O-CA 3.43Å; G977-A980 VanDerWaalsContact O-CB 3.32Å; G977-A980 WeakPolarHBondContact O-CB 3.32Å; G977-A980 PolarHBondContact O-N 2.89Å; G977-A980 VanDerWaalsContact O-N 3.14Å
981	G	79.6	Confident	80	Confident	27 Å²	27	59.6 Å²	59.6	28%	0.278	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.4	-7.5	-175.9	0	0	0	0	0	116	Y974 N979 R1015	Y974-G981 PolarHBondContact O-N 3.02Å; N979-G981 PolarHBondContact O-N 3.07Å; G981-R1015 PolarHBondContact O-NH2 3.47Å
982	N	86.6	Confident	79.3	Confident	95 Å²	95	61.1 Å²	61.1	51%	0.508	38%	0.378	S	S	.	.	S	Bend	trans	-87.2	162.4	171.6	-63.4	-23.1	0	0	0	111.6	L973 Y974 N979	L973-N982 WeakPolarHBondContact CA-O 3.2Å; Y974-N982 WeakPolarHBondContact CD2-O 3.4Å; Y974-N982 PolarHBondContact N-O 3.3Å; N979-N982 HydrophobicContact CB-CB 4.49Å; N979-N982 VanDerWaalsContact O-CB 3.28Å; N979-N982 WeakPolarHBondContact O-CB 3.4Å; N979-N982 PolarHBondContact O-N 2.96Å
983	F	87.3	Confident	78.8	Confident	35 Å²	35	59.5 Å²	59.5	15%	0.154	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.1	132.5	177.1	176.4	-112	0	0	0	112	W963 Y974 P985 D1019 N1023	W963-F983 HydrophobicContact CH2-CD2 4.24Å; W963-F983 AromaticContact CH2-CE2 3.95Å; W963-F983 HydrophobicContact CH2-CE2 3.95Å; W963-F983 HydrophobicContact CZ2-CD2 4.08Å; W963-F983 AromaticContact CZ2-CE2 3.36Å; W963-F983 HydrophobicContact CZ2-CE2 3.36Å; W963-F983 AromaticContact CZ2-CZ 3.76Å; W963-F983 HydrophobicContact CZ2-CZ 3.76Å; Y974-F983 VanDerWaalsContact CE2-O 3.31Å; Y974-F983 WeakPolarHBondContact CE2-O 3.38Å; F983-P985 HydrophobicContact CE1-CG 4.35Å; F983-D1019 HydrophobicContact CB-CB 4.14Å; F983-D1019 HydrophobicContact CD1-CB 4.43Å; F983-D1019 HydrophobicContact CD2-CB 4.29Å; F983-D1019 HydrophobicContact CG-CB 4.02Å; F983-N1023 HydrophobicContact CE1-CB 4.45Å; F983-N1023 HydrophobicContact CZ-CB 4.45Å
984	C	86.3	Confident	78.4	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	115.2	176.7	-179	0	0	0	0	110.6	R972 Y974 C993	R972-C984 HydrophobicContact CB-CB 4.39Å; R972-C984 PolarHBondContact O-N 2.92Å; Y974-C984 HydrophobicContact CD1-CB 4.49Å; Y974-C984 HydrophobicContact CD2-CB 3.83Å; Y974-C984 HydrophobicContact CE1-CB 4.43Å; Y974-C984 HydrophobicContact CE2-CB 3.76Å; Y974-C984 HydrophobicContact CG-CB 4.2Å; C984-C993 HydrophobicContact CB-CB 3.77Å; C984-C993 WeakPolarHBondContact CB-SG 3.5Å; C984-C993 WeakPolarHBondContact SG-CB 3.31Å; C984-C993 CovalentContact SG-SG 2.03Å; C984-C993 PolarHBondContact SG-SG 3.07Å
985	P	83.4	Confident	78.1	Confident	48 Å²	48	69.4 Å²	69.4	31%	0.312	42%	0.422	S	S	.	.			trans	-55.4	151.4	177.2	-27.5	34.5	0	0	0	114	R972 F983 N987 I988	R972-P985 PolarHBondContact NH2-O 3.11Å; F983-P985 HydrophobicContact CE1-CG 4.35Å; P985-N987 VanDerWaalsContact C-N 3.3Å; P985-N987 PolarHBondContact O-N 3Å; P985-I988 HydrophobicContact CG-CD1 4.44Å; P985-I988 PolarHBondContact O-N 3.23Å
986	A	77.8	Confident	78.3	Confident	5 Å²	5	71.3 Å²	71.3	4%	0.041	43%	0.425	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-32.5	-177.4	0	0	0	0	0	113.4	R972 I988 Q1028 C1029	R972-A986 PolarHBondContact NH2-O 2.78Å; R972-A986 VanDerWaalsContact NH2-O 3.15Å; A986-I988 VanDerWaalsContact C-N 3.26Å; A986-I988 PolarHBondContact O-N 3.36Å; A986-Q1028 HydrophobicContact CB-CB 3.96Å; A986-C1029 HydrophobicContact CB-CB 3.57Å
987	N	75.9	Confident	78.7	Confident	123 Å²	123	68.9 Å²	68.9	66%	0.658	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-23.1	178.6	-164.1	12	0	0	0	114.4	P985 T989 D1026	P985-N987 VanDerWaalsContact C-N 3.3Å; P985-N987 PolarHBondContact O-N 3Å; N987-T989 PolarHBondContact O-N 3.23Å; N987-D1026 PolarHBondContact N-OD2 3.4Å
988	I	77.9	Confident	79	Confident	61 Å²	61	67.1 Å²	67.1	31%	0.313	39%	0.386	S	S	.	.			trans	-79.1	114.9	-178.2	-60.6	176.7	0	0	0	110.1	R972 Y974 P985 A986	R972-I988 PolarHBondContact NH2-O 2.74Å; Y974-I988 WeakPolarHBondContact OH-CD1 3.25Å; P985-I988 HydrophobicContact CG-CD1 4.44Å; P985-I988 PolarHBondContact O-N 3.23Å; A986-I988 VanDerWaalsContact C-N 3.26Å; A986-I988 PolarHBondContact O-N 3.36Å
989	T	64.6	Low	79.2	Confident	138 Å²	138	65.2 Å²	65.2	85%	0.847	38%	0.381	S	S	*	.			trans	-103.4	77.2	179.8	48.2	0	0	0	0	109.9	N987	N987-T989 PolarHBondContact O-N 3.23Å
990	G	63.2	Low	78.9	Confident	31 Å²	31	65.7 Å²	65.7	32%	0.32	39%	0.39	S	S	.	.	S	Bend	trans	-141	152.9	179.2	0	0	0	0	0	113.6	S992 C993	G990-S992 PolarHBondContact O-N 3.29Å; G990-C993 PolarHBondContact O-N 3.33Å; G990-C993 VanDerWaalsContact O-N 3.15Å
991	L	66.3	Low	78.7	Confident	149 Å²	149	65.7 Å²	65.7	78%	0.78	39%	0.385	S	S	*	.	G	3₁₀ helix	trans	-57.4	-13.5	169.4	-80.5	120.3	0	0	0	112.9	T975 C993 L994	T975-L991 PolarHBondContact OG1-O 3.04Å; L991-C993 VanDerWaalsContact C-N 3.26Å; L991-C993 PolarHBondContact O-N 2.03Å; L991-L994 HydrophobicContact CD2-CD1 4.34Å; L991-L994 VanDerWaalsContact O-CD1 3.31Å; L991-L994 WeakPolarHBondContact O-CD1 3.19Å
992	S	72.8	Confident	78.2	Confident	38 Å²	38	68.8 Å²	68.8	27%	0.266	40%	0.403	S	S	.	.	G	3₁₀ helix	trans	-72	-7.7	175.4	51.7	0	0	0	0	114.4	Y974 T975 G990	Y974-S992 CarbonylContact C-O 3.39Å; Y974-S992 WeakPolarHBondContact CA-O 3.4Å; T975-S992 PolarHBondContact N-O 2.95Å; T975-S992 WeakPolarHBondContact OG1-CA 3.38Å; T975-S992 PolarHBondContact OG1-O 3.32Å; G990-S992 PolarHBondContact O-N 3.29Å
993	C	79.8	Confident	77.3	Confident	4 Å²	4	68.6 Å²	68.6	3%	0.027	40%	0.402	C	S	.	.	G	3₁₀ helix	trans	-130.7	49.3	-178.1	-58.8	0	0	0	0	113.7	Y974 C984 G990 L991	Y974-C993 WeakPolarHBondContact CD1-SG 3.24Å; Y974-C993 WeakPolarHBondContact CE1-SG 3.18Å; C984-C993 HydrophobicContact CB-CB 3.77Å; C984-C993 WeakPolarHBondContact CB-SG 3.5Å; C984-C993 WeakPolarHBondContact SG-CB 3.31Å; C984-C993 CovalentContact SG-SG 2.03Å; C984-C993 PolarHBondContact SG-SG 3.07Å; G990-C993 PolarHBondContact O-N 3.33Å; G990-C993 VanDerWaalsContact O-N 3.15Å; L991-C993 VanDerWaalsContact C-N 3.26Å; L991-C993 PolarHBondContact O-N 2.03Å
994	L	77.5	Confident	76.4	Confident	126 Å²	126	68.5 Å²	68.5	66%	0.66	41%	0.411	S	S	*	.			trans	-84.5	-16.7	-179.1	-72	161.7	0	0	0	114.2	T975 L991	T975-L994 HydrophobicContact CG2-CB 3.98Å; L991-L994 HydrophobicContact CD2-CD1 4.34Å; L991-L994 VanDerWaalsContact O-CD1 3.31Å; L991-L994 WeakPolarHBondContact O-CD1 3.19Å
995	K	82.9	Confident	76.2	Confident	130 Å²	130	70 Å²	70	57%	0.565	42%	0.42	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.2	123.1	-176.6	-175.2	173.5	-176.3	-178.8	0	110.5	R972 L973 T975	R972-K995 WeakPolarHBondContact CA-O 3.45Å; L973-K995 HydrophobicContact CB-CB 4.42Å; L973-K995 PolarHBondContact N-O 3.07Å; T975-K995 HydrophobicContact CG2-CB 3.62Å
996	K	85.6	Confident	76.3	Confident	102 Å²	102	68.2 Å²	68.2	44%	0.443	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	154.7	171.9	-59.1	-173.5	-178.4	-173.7	0	110.6	P966	P966-K996 HydrophobicContact CB-CD 3.82Å; P966-K996 WeakPolarHBondContact O-CE 3.2Å; P966-K996 PolarHBondContact O-NZ 3.3Å
997	C	86.4	Confident	76.8	Confident	17 Å²	17	70 Å²	70	12%	0.115	41%	0.414	C	S	.	.	S	Bend	trans	-67.6	-46.3	178.4	-65.9	0	0	0	0	113	C971 F1016	C971-C997 VanDerWaalsContact CA-SG 3.53Å; C971-C997 HydrophobicContact CB-CB 3.7Å; C971-C997 WeakPolarHBondContact CB-SG 3.38Å; C971-C997 PolarHBondContact O-N 3.27Å; C971-C997 PolarHBondContact O-SG 2.02Å; C971-C997 WeakPolarHBondContact SG-CB 3.36Å; C971-C997 CovalentContact SG-SG 2.03Å; C971-C997 PolarHBondContact SG-SG 3.23Å; C997-F1016 HydrophobicContact CB-CE1 4.15Å; C997-F1016 HydrophobicContact CB-CE2 4Å; C997-F1016 HydrophobicContact CB-CZ 3.79Å
998	L	86.6	Confident	77.4	Confident	17 Å²	17	64.2 Å²	64.2	9%	0.089	38%	0.383	C	S	.	.	S	Bend	trans	-116.8	154.1	179.1	-64.5	179	0	0	0	111.4	L964 V1006 E1012	L964-L998 HydrophobicContact CB-CD1 3.91Å; L964-L998 HydrophobicContact CD1-CD1 4.27Å; L964-L998 HydrophobicContact CD2-CD1 4.44Å; L964-L998 HydrophobicContact CG-CD1 4.46Å; L998-V1006 HydrophobicContact CD1-CG1 3.73Å; L998-E1012 HydrophobicContact CD2-CB 4.4Å; L998-E1012 VanDerWaalsContact CD2-CD 3.45Å; L998-E1012 HydrophobicContact CD2-CG 4.22Å; L998-E1012 WeakPolarHBondContact CD2-OE1 3.42Å
999	A	82.1	Confident	78	Confident	90 Å²	90	65 Å²	65	74%	0.744	39%	0.39	S	S	*	.	P	Polyproline II helix	trans	-76.4	152.9	168.6	0	0	0	0	0	110.7	P1001	A999-P1001 WeakPolarHBondContact O-CD 3.45Å
1000	S	74.4	Confident	79	Confident	89 Å²	89	63.3 Å²	63.3	62%	0.622	37%	0.374	S	S	*	.	P	Polyproline II helix	trans	-72.6	117.3	175	-66.3	0	0	0	0	110.4
1001	P	76.3	Confident	80.1	Confident	54 Å²	54	69.7 Å²	69.7	35%	0.351	40%	0.396	S	S	.	.	P	Polyproline II helix	trans	-72.1	151.7	178.5	29.5	-33.2	0	0	0	111.3	A999 D1003 V1005 V1006	A999-P1001 WeakPolarHBondContact O-CD 3.45Å; P1001-D1003 VanDerWaalsContact C-N 3.33Å; P1001-V1005 WeakPolarHBondContact CG-O 3.23Å; P1001-V1006 HydrophobicContact CG-CG2 4.08Å
1002	S	67.8	Low	81.3	Confident	93 Å²	93	65.6 Å²	65.6	65%	0.65	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-33.3	177.5	52.4	0	0	0	0	113.1
1003	D	68	Low	82.1	Confident	90 Å²	90	63.9 Å²	63.9	48%	0.481	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.1	6.1	-170.3	-54.5	-3.5	0	0	0	112	G251 M252 P1001 V1005	G251-D1003 WeakPolarHBondContact CA-O 3.39Å; M252-D1003 PolarHBondContact N-O 3.22Å; P1001-D1003 VanDerWaalsContact C-N 3.33Å; D1003-V1005 PolarHBondContact O-N 2.95Å
1004	G	69.7	Low	82.5	Confident	33 Å²	33	66.2 Å²	66.2	34%	0.34	38%	0.377	S	S	.	.	S	Bend	trans	72.5	-14	179.7	0	0	0	0	0	115.9	V1006	G1004-V1006 PolarHBondContact O-N 3.42Å
1005	V	80.8	Confident	83	Confident	33 Å²	33	66.6 Å²	66.6	20%	0.2	37%	0.369	C	S	.	.			trans	-81.5	115.8	178.6	-176.4	0	0	0	0	110.4	M252 V926 P1001 D1003 R1007	M252-V1005 HydrophobicContact CB-CG2 4.49Å; M252-V1005 HydrophobicContact CG-CG2 4.24Å; M252-V1005 HydrophobicContact SD-CG2 3.86Å; V926-V1005 HydrophobicContact CG1-CG2 4.13Å; P1001-V1005 WeakPolarHBondContact CG-O 3.23Å; D1003-V1005 PolarHBondContact O-N 2.95Å; V1005-R1007 HydrophobicContact CG1-CG 4.16Å
1006	V	85	Confident	83.5	Confident	9 Å²	9	60.6 Å²	60.6	6%	0.055	34%	0.344	C	S	.	.			trans	-92	118.6	177.5	-178.4	0	0	0	0	109.4	I961 N965 L998 P1001 G1004	I961-V1006 WeakPolarHBondContact CG2-O 3.42Å; N965-V1006 HydrophobicContact CB-CG2 4.43Å; L998-V1006 HydrophobicContact CD1-CG1 3.73Å; P1001-V1006 HydrophobicContact CG-CG2 4.08Å; G1004-V1006 PolarHBondContact O-N 3.42Å
1007	R	88.3	Confident	83.7	Confident	42 Å²	42	55.9 Å²	55.9	16%	0.158	32%	0.323	C	S	.	.			trans	-136.7	123.6	170.6	-66.6	-67.3	-178.4	-82.4	-4	109.2	V916 M919 D920 V926 C928 V1005	V916-R1007 HydrophobicContact CG1-CG 4.09Å; V916-R1007 HydrophobicContact CG2-CB 4.25Å; M919-R1007 HydrophobicContact CE-CB 4.41Å; D920-R1007 IonicContact OD1-CZ 3.12Å; D920-R1007 IonicContact OD1-NE 3.22Å; D920-R1007 PolarHBondContact OD1-NE 3.49Å; D920-R1007 IonicContact OD1-NH2 2.74Å; D920-R1007 PolarHBondContact OD1-NH2 3.15Å; V926-R1007 PolarHBondContact O-NH1 3.19Å; V926-R1007 PolarHBondContact O-NH2 3.38Å; C928-R1007 PolarHBondContact SG-NH2 3.05Å; V1005-R1007 HydrophobicContact CG1-CG 4.16Å
1008	P	90.3	Very high	84	Confident	2 Å²	2	57.6 Å²	57.6	1%	0.013	33%	0.334	C	S	.	.			trans	-70.6	150.7	173.8	30.1	-34.8	0	0	0	110.8	M919 F960 L964 E1012 F1013	M919-P1008 HydrophobicContact CE-CG 4.13Å; M919-P1008 HydrophobicContact SD-CG 4.07Å; F960-P1008 HydrophobicContact CE1-CG 4.26Å; L964-P1008 HydrophobicContact CD1-CB 3.96Å; L964-P1008 HydrophobicContact CD1-CG 3.77Å; P1008-E1012 HydrophobicContact CB-CB 3.96Å; P1008-F1013 HydrophobicContact CB-CB 4.27Å; P1008-F1013 HydrophobicContact CG-CB 4.11Å; P1008-F1013 HydrophobicContact CG-CD2 3.98Å
1009	T	89.3	Confident	84.2	Confident	77 Å²	77	59.1 Å²	59.1	47%	0.472	34%	0.342	S	S	.	.			trans	-69.2	166.4	164.1	60.7	0	0	0	0	110.9	E1011 E1012 F1013	T1009-E1011 PolarHBondContact O-N 3.46Å; T1009-E1012 WeakPolarHBondContact CB-OE2 3.5Å; T1009-E1012 WeakPolarHBondContact CG2-OE2 3.38Å; T1009-E1012 PolarHBondContact N-OE2 3.24Å; T1009-E1012 PolarHBondContact O-N 3.39Å; T1009-E1012 VanDerWaalsContact OG1-CG 3.23Å; T1009-E1012 WeakPolarHBondContact OG1-CG 3.3Å; T1009-E1012 PolarHBondContact OG1-N 3.39Å; T1009-E1012 PolarHBondContact OG1-OE2 3.37Å; T1009-F1013 WeakPolarHBondContact O-CB 3.47Å; T1009-F1013 PolarHBondContact O-N 2.99Å
1010	M	86.3	Confident	84.6	Confident	104 Å²	104	54.9 Å²	54.9	51%	0.512	31%	0.307	S	S	.	.	H	α-helix	trans	-57.4	-36.4	-177.9	-156.7	-177.5	-177.3	0	0	113.1	N914 S1014	N914-M1010 HydrophobicContact CB-CE 4.16Å; N914-M1010 HydrophobicContact CB-CG 3.58Å; M1010-S1014 PolarHBondContact O-N 2.82Å; M1010-S1014 PolarHBondContact O-OG 3.4Å
1011	E	87.1	Confident	85.4	Confident	165 Å²	165	51.1 Å²	51.1	77%	0.771	28%	0.28	S	S	*	.	H	α-helix	trans	-73.9	-44.8	178.1	-65.2	174.9	-174.2	0	0	111.6	T1009 F1013 S1014 R1015	T1009-E1011 PolarHBondContact O-N 3.46Å; E1011-F1013 VanDerWaalsContact C-N 3.34Å; E1011-F1013 PolarHBondContact O-N 3.44Å; E1011-S1014 PolarHBondContact O-N 3.21Å; E1011-R1015 WeakPolarHBondContact O-CB 3.43Å; E1011-R1015 PolarHBondContact O-N 2.89Å
1012	E	89.6	Confident	85.9	Confident	63 Å²	63	51 Å²	51	29%	0.294	29%	0.289	S	S	.	.	H	α-helix	trans	-63.8	-40.6	177.2	-70.7	166.3	151.7	0	0	111.6	L998 P1008 T1009 R1015 F1016	L998-E1012 HydrophobicContact CD2-CB 4.4Å; L998-E1012 VanDerWaalsContact CD2-CD 3.45Å; L998-E1012 HydrophobicContact CD2-CG 4.22Å; L998-E1012 WeakPolarHBondContact CD2-OE1 3.42Å; P1008-E1012 HydrophobicContact CB-CB 3.96Å; T1009-E1012 WeakPolarHBondContact CB-OE2 3.5Å; T1009-E1012 WeakPolarHBondContact CG2-OE2 3.38Å; T1009-E1012 PolarHBondContact N-OE2 3.24Å; T1009-E1012 PolarHBondContact O-N 3.39Å; T1009-E1012 VanDerWaalsContact OG1-CG 3.23Å; T1009-E1012 WeakPolarHBondContact OG1-CG 3.3Å; T1009-E1012 PolarHBondContact OG1-N 3.39Å; T1009-E1012 PolarHBondContact OG1-OE2 3.37Å; E1012-R1015 PolarHBondContact O-N 2.63Å; E1012-F1016 HydrophobicContact CB-CD2 4.15Å; E1012-F1016 HydrophobicContact CB-CE2 4.11Å; E1012-F1016 HydrophobicContact CG-CE2 4.3Å; E1012-F1016 WeakPolarHBondContact O-CB 3.1Å; E1012-F1016 WeakPolarHBondContact O-CD2 3.33Å; E1012-F1016 PolarHBondContact O-N 3.37Å
1013	F	90.9	Very high	86.8	Confident	2 Å²	2	47.2 Å²	47.2	1%	0.009	26%	0.261	C	S	.	.	H	α-helix	trans	-56.7	-52.8	175.7	-178.4	-82.3	0	0	0	110.7	F913 N914 M919 W956 F960 P1008 T1009 E1011 R1015 F1016 L1017 I1049	F913-F1013 HydrophobicContact CB-CZ 4.22Å; N914-F1013 HydrophobicContact CB-CD1 4.06Å; N914-F1013 HydrophobicContact CB-CG 4.38Å; N914-F1013 VanDerWaalsContact OD1-CD1 3.24Å; N914-F1013 WeakPolarHBondContact OD1-CD1 3.42Å; N914-F1013 WeakPolarHBondContact OD1-CE1 3.5Å; M919-F1013 HydrophobicContact SD-CD2 4.08Å; M919-F1013 HydrophobicContact SD-CE2 4.22Å; W956-F1013 AromaticContact CH2-CZ 3.91Å; W956-F1013 HydrophobicContact CH2-CZ 3.91Å; W956-F1013 HydrophobicContact CZ3-CE2 4.48Å; W956-F1013 HydrophobicContact CZ3-CZ 4.07Å; F960-F1013 HydrophobicContact CD1-CD2 4.31Å; F960-F1013 HydrophobicContact CD1-CE2 4.01Å; F960-F1013 AromaticContact CE1-CD2 3.51Å; F960-F1013 HydrophobicContact CE1-CD2 3.51Å; F960-F1013 AromaticContact CE1-CE2 3.61Å; F960-F1013 HydrophobicContact CE1-CE2 3.61Å; F960-F1013 HydrophobicContact CE1-CG 4.3Å; F960-F1013 HydrophobicContact CE1-CZ 4.48Å; F960-F1013 HydrophobicContact CZ-CD2 4.34Å; P1008-F1013 HydrophobicContact CB-CB 4.27Å; P1008-F1013 HydrophobicContact CG-CB 4.11Å; P1008-F1013 HydrophobicContact CG-CD2 3.98Å; T1009-F1013 WeakPolarHBondContact O-CB 3.47Å; T1009-F1013 PolarHBondContact O-N 2.99Å; E1011-F1013 VanDerWaalsContact C-N 3.34Å; E1011-F1013 PolarHBondContact O-N 3.44Å; F1013-R1015 VanDerWaalsContact C-N 3.27Å; F1013-R1015 PolarHBondContact O-N 2.88Å; F1013-F1016 PolarHBondContact O-N 2.9Å; F1013-L1017 HydrophobicContact CE1-CD2 3.74Å; F1013-L1017 HydrophobicContact CZ-CD2 4.05Å; F1013-L1017 VanDerWaalsContact O-CB 3.27Å; F1013-L1017 WeakPolarHBondContact O-CB 3.16Å; F1013-L1017 PolarHBondContact O-N 2.8Å; F1013-I1049 HydrophobicContact CE1-CD1 4.21Å; F1013-I1049 HydrophobicContact CZ-CD1 4.18Å
1014	S	87.7	Confident	87.5	Confident	53 Å²	53	50.3 Å²	50.3	37%	0.371	27%	0.266	S	S	.	.	H	α-helix	trans	-65.3	-33.3	-177	-54.4	0	0	0	0	112	N914 M1010 E1011 P1018	N914-S1014 PolarHBondContact ND2-OG 3.13Å; M1010-S1014 PolarHBondContact O-N 2.82Å; M1010-S1014 PolarHBondContact O-OG 3.4Å; E1011-S1014 PolarHBondContact O-N 3.21Å; S1014-P1018 WeakPolarHBondContact O-CD 3.27Å
1015	R	89.1	Confident	88.1	Confident	133 Å²	133	50.9 Å²	50.9	50%	0.502	26%	0.264	S	S	.	.	H	α-helix	trans	-70.7	-46.9	177.8	179.5	179.8	179.9	165.1	1.9	113	G981 E1011 E1012 F1013 P1018	G981-R1015 PolarHBondContact O-NH2 3.47Å; E1011-R1015 WeakPolarHBondContact O-CB 3.43Å; E1011-R1015 PolarHBondContact O-N 2.89Å; E1012-R1015 PolarHBondContact O-N 2.63Å; F1013-R1015 VanDerWaalsContact C-N 3.27Å; F1013-R1015 PolarHBondContact O-N 2.88Å; R1015-P1018 WeakPolarHBondContact O-CD 3.49Å
1016	F	91.6	Very high	87.9	Confident	5 Å²	5	51.3 Å²	51.3	2%	0.022	27%	0.265	C	S	.	.	H	α-helix	trans	-93.9	-17.4	-168.3	-63.8	-50.7	0	0	0	114.3	F960 W963 L964 L973 C997 E1012 F1013 D1019 F1020	F960-F1016 HydrophobicContact CE2-CB 4.35Å; F960-F1016 HydrophobicContact CZ-CB 4.39Å; W963-F1016 HydrophobicContact CZ3-CB 4.14Å; L964-F1016 HydrophobicContact CD2-CB 3.87Å; L964-F1016 HydrophobicContact CD2-CD2 3.93Å; L964-F1016 HydrophobicContact CD2-CG 4.1Å; L973-F1016 HydrophobicContact CD2-CE1 4.19Å; C997-F1016 HydrophobicContact CB-CE1 4.15Å; C997-F1016 HydrophobicContact CB-CE2 4Å; C997-F1016 HydrophobicContact CB-CZ 3.79Å; E1012-F1016 HydrophobicContact CB-CD2 4.15Å; E1012-F1016 HydrophobicContact CB-CE2 4.11Å; E1012-F1016 HydrophobicContact CG-CE2 4.3Å; E1012-F1016 WeakPolarHBondContact O-CB 3.1Å; E1012-F1016 WeakPolarHBondContact O-CD2 3.33Å; E1012-F1016 PolarHBondContact O-N 3.37Å; F1013-F1016 PolarHBondContact O-N 2.9Å; F1016-D1019 PolarHBondContact O-N 3.39Å; F1016-F1020 PolarHBondContact O-N 3.03Å
1017	L	91.3	Very high	87.4	Confident	3 Å²	3	52.9 Å²	52.9	2%	0.016	27%	0.273	C	S	.	.	H	α-helix	trans	-57.7	-44.1	176.1	-178.6	63.5	0	0	0	113.7	W956 F960 F1013 D1019 F1020 L1021 V1041 I1049	W956-L1017 HydrophobicContact CE3-CD1 4.1Å; W956-L1017 HydrophobicContact CZ3-CD1 3.67Å; W956-L1017 HydrophobicContact CZ3-CD2 4.46Å; F960-L1017 HydrophobicContact CD2-CD1 4.28Å; F960-L1017 HydrophobicContact CE2-CB 4.3Å; F960-L1017 HydrophobicContact CE2-CD1 4.31Å; F960-L1017 HydrophobicContact CG-CD1 4.48Å; F960-L1017 HydrophobicContact CZ-CB 4.19Å; F1013-L1017 HydrophobicContact CE1-CD2 3.74Å; F1013-L1017 HydrophobicContact CZ-CD2 4.05Å; F1013-L1017 VanDerWaalsContact O-CB 3.27Å; F1013-L1017 WeakPolarHBondContact O-CB 3.16Å; F1013-L1017 PolarHBondContact O-N 2.8Å; L1017-D1019 VanDerWaalsContact C-N 3.32Å; L1017-D1019 PolarHBondContact O-N 3.24Å; L1017-F1020 HydrophobicContact CD1-CD1 4.26Å; L1017-F1020 PolarHBondContact O-N 2.89Å; L1017-L1021 HydrophobicContact CD1-CD1 4.23Å; L1017-L1021 HydrophobicContact CD1-CG 4.21Å; L1017-L1021 HydrophobicContact CG-CD1 4.14Å; L1017-L1021 WeakPolarHBondContact O-CG 3.37Å; L1017-L1021 PolarHBondContact O-N 2.84Å; L1017-V1041 HydrophobicContact CD2-CG1 4.47Å; L1017-I1049 HydrophobicContact CD2-CD1 4.11Å; L1017-I1049 HydrophobicContact CD2-CG1 4.49Å
1018	P	91	Very high	86.9	Confident	52 Å²	52	54.2 Å²	54.2	34%	0.338	28%	0.281	S	S	.	.	H	α-helix	trans	-59.2	-41.5	173.7	-11.7	19.3	0	0	0	113.2	S1014 R1015 F1020 L1021 G1022 R1043	S1014-P1018 WeakPolarHBondContact O-CD 3.27Å; R1015-P1018 WeakPolarHBondContact O-CD 3.49Å; P1018-F1020 VanDerWaalsContact C-N 3.34Å; P1018-L1021 PolarHBondContact O-N 2.82Å; P1018-G1022 PolarHBondContact O-N 3.21Å; P1018-R1043 VanDerWaalsContact CD-NH1 3.27Å
1019	D	90.8	Very high	86.4	Confident	50 Å²	50	54.1 Å²	54.1	27%	0.267	28%	0.28	S	S	.	.	H	α-helix	trans	-64.2	-41.7	179.6	-65	-33.4	0	0	0	110.7	W963 F983 F1016 L1017 G1022 N1023	W963-D1019 HydrophobicContact CH2-CB 4.03Å; F983-D1019 HydrophobicContact CB-CB 4.14Å; F983-D1019 HydrophobicContact CD1-CB 4.43Å; F983-D1019 HydrophobicContact CD2-CB 4.29Å; F983-D1019 HydrophobicContact CG-CB 4.02Å; F1016-D1019 PolarHBondContact O-N 3.39Å; L1017-D1019 VanDerWaalsContact C-N 3.32Å; L1017-D1019 PolarHBondContact O-N 3.24Å; D1019-G1022 PolarHBondContact O-N 2.77Å; D1019-N1023 VanDerWaalsContact O-CB 3.27Å; D1019-N1023 WeakPolarHBondContact O-CB 3.19Å; D1019-N1023 PolarHBondContact O-N 2.83Å
1020	F	91.3	Very high	85.8	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-60.7	-49.3	174.4	167.8	-108.9	0	0	0	112.7	D959 F960 W963 F1016 L1017 P1018 G1022 N1023 G1033 Y1037	D959-F1020 HydrophobicContact CB-CZ 4.16Å; F960-F1020 HydrophobicContact CB-CD1 4.11Å; F960-F1020 HydrophobicContact CB-CE1 3.97Å; F960-F1020 HydrophobicContact CB-CG 4.45Å; F960-F1020 HydrophobicContact CB-CZ 4.2Å; F960-F1020 HydrophobicContact CD2-CB 3.63Å; F960-F1020 AromaticContact CD2-CD1 3.77Å; F960-F1020 HydrophobicContact CD2-CD1 3.77Å; F960-F1020 HydrophobicContact CD2-CD2 4.22Å; F960-F1020 HydrophobicContact CD2-CE1 4.48Å; F960-F1020 AromaticContact CD2-CG 3.61Å; F960-F1020 HydrophobicContact CD2-CG 3.61Å; F960-F1020 HydrophobicContact CE2-CB 3.91Å; F960-F1020 HydrophobicContact CE2-CG 4.39Å; F960-F1020 HydrophobicContact CG-CD1 4.33Å; F960-F1020 HydrophobicContact CG-CG 4.49Å; W963-F1020 HydrophobicContact CB-CD2 3.88Å; W963-F1020 HydrophobicContact CB-CE2 4.05Å; W963-F1020 HydrophobicContact CD2-CB 4.22Å; W963-F1020 AromaticContact CD2-CD2 3.86Å; W963-F1020 HydrophobicContact CD2-CD2 3.86Å; W963-F1020 HydrophobicContact CE3-CB 3.92Å; W963-F1020 HydrophobicContact CE3-CD2 4.2Å; W963-F1020 HydrophobicContact CE3-CG 4.46Å; W963-F1020 AromaticContact CG-CD2 3.7Å; W963-F1020 HydrophobicContact CG-CD2 3.7Å; W963-F1020 HydrophobicContact CG-CE2 4.27Å; W963-F1020 HydrophobicContact CH2-CB 4.29Å; W963-F1020 HydrophobicContact CZ3-CB 3.96Å; F1016-F1020 PolarHBondContact O-N 3.03Å; L1017-F1020 HydrophobicContact CD1-CD1 4.26Å; L1017-F1020 PolarHBondContact O-N 2.89Å; P1018-F1020 VanDerWaalsContact C-N 3.34Å; F1020-G1022 VanDerWaalsContact C-N 3.26Å; F1020-G1022 PolarHBondContact O-N 2.89Å; F1020-N1023 WeakPolarHBondContact O-CB 3.45Å; F1020-N1023 PolarHBondContact O-N 2.92Å; F1020-N1023 VanDerWaalsContact O-N 3.12Å; F1020-G1033 VanDerWaalsContact O-CA 3.29Å; F1020-G1033 WeakPolarHBondContact O-CA 3.28Å; F1020-G1033 PolarHBondContact O-N 3Å; F1020-Y1037 HydrophobicContact CE1-CD2 4.23Å; F1020-Y1037 AromaticContact CZ-CD2 3.89Å; F1020-Y1037 HydrophobicContact CZ-CD2 3.89Å; F1020-Y1037 HydrophobicContact CZ-CE2 4.46Å
1021	L	90.4	Very high	85.4	Confident	11 Å²	11	49 Å²	49	6%	0.058	26%	0.255	C	S	.	.	H	α-helix	trans	-65.5	-29.6	-178.6	-65.9	174.3	0	0	0	112.5	L1017 P1018 G1033 L1034 V1041	L1017-L1021 HydrophobicContact CD1-CD1 4.23Å; L1017-L1021 HydrophobicContact CD1-CG 4.21Å; L1017-L1021 HydrophobicContact CG-CD1 4.14Å; L1017-L1021 WeakPolarHBondContact O-CG 3.37Å; L1017-L1021 PolarHBondContact O-N 2.84Å; P1018-L1021 PolarHBondContact O-N 2.82Å; L1021-G1033 CarbonylContact O-C 3.57Å; L1021-L1034 WeakPolarHBondContact O-CA 3.28Å; L1021-L1034 PolarHBondContact O-N 2.9Å; L1021-V1041 HydrophobicContact CD1-CB 4.12Å; L1021-V1041 HydrophobicContact CD1-CG1 4.39Å; L1021-V1041 HydrophobicContact CD2-CB 4.39Å; L1021-V1041 HydrophobicContact CD2-CG2 4.28Å
1022	G	87.4	Confident	85.1	Confident	52 Å²	52	41.6 Å²	41.6	54%	0.536	22%	0.223	S	C	.	.	H	α-helix	trans	-86.9	-8.7	174.3	0	0	0	0	0	114.7	P1018 D1019 F1020	P1018-G1022 PolarHBondContact O-N 3.21Å; D1019-G1022 PolarHBondContact O-N 2.77Å; F1020-G1022 VanDerWaalsContact C-N 3.26Å; F1020-G1022 PolarHBondContact O-N 2.89Å
1023	N	87	Confident	84.8	Confident	12 Å²	12	38.6 Å²	38.6	6%	0.064	21%	0.209	C	C	.	.	P	Polyproline II helix	trans	-80.5	125.8	-175	-172.5	28.3	0	0	0	111.4	W963 F983 D1019 F1020 G1033 L1034	W963-N1023 PolarHBondContact NE1-ND2 2.99Å; F983-N1023 HydrophobicContact CE1-CB 4.45Å; F983-N1023 HydrophobicContact CZ-CB 4.45Å; D1019-N1023 VanDerWaalsContact O-CB 3.27Å; D1019-N1023 WeakPolarHBondContact O-CB 3.19Å; D1019-N1023 PolarHBondContact O-N 2.83Å; F1020-N1023 WeakPolarHBondContact O-CB 3.45Å; F1020-N1023 PolarHBondContact O-N 2.92Å; F1020-N1023 VanDerWaalsContact O-N 3.12Å; N1023-G1033 PolarHBondContact O-N 2.7Å; N1023-L1034 VanDerWaalsContact O-CB 3.27Å; N1023-L1034 WeakPolarHBondContact O-CB 3.39Å; N1023-L1034 PolarHBondContact O-N 3Å
1024	R	83.8	Confident	84.7	Confident	155 Å²	155	40.2 Å²	40.2	59%	0.585	22%	0.218	S	C	*	.	P	Polyproline II helix	trans	-77.4	129.7	174.5	-175.1	-178.5	-179.4	-178.6	3.7	109.6	D1026 L1034	R1024-D1026 PolarHBondContact O-N 2.53Å; R1024-L1034 HydrophobicContact CB-CD2 4.25Å
1025	P	81.1	Confident	84.4	Confident	45 Å²	45	38.5 Å²	38.5	29%	0.292	21%	0.208	S	C	.	.	P	Polyproline II helix	trans	-64.6	133.9	172.1	27.5	-33.1	0	0	0	110
1026	D	77.4	Confident	84.1	Confident	42 Å²	42	34.3 Å²	34.3	23%	0.225	20%	0.202	C	C	.	.			trans	-135.2	178.1	175.8	72.6	26.5	0	0	0	110.9	N987 R1024 Q1028 C1029 S1030	N987-D1026 PolarHBondContact N-OD2 3.4Å; R1024-D1026 PolarHBondContact O-N 2.53Å; D1026-Q1028 VanDerWaalsContact C-N 3.27Å; D1026-Q1028 PolarHBondContact O-N 3.35Å; D1026-Q1028 WeakPolarHBondContact OD1-CA 3.46Å; D1026-Q1028 WeakPolarHBondContact OD1-CB 3.35Å; D1026-Q1028 PolarHBondContact OD1-N 2.7Å; D1026-C1029 PolarHBondContact N-O 2.78Å; D1026-C1029 CarbonylContact O-C 3.51Å; D1026-C1029 PolarHBondContact O-N 3.48Å; D1026-C1029 PolarHBondContact OD1-N 3.5Å; D1026-S1030 WeakPolarHBondContact O-CA 3.31Å; D1026-S1030 PolarHBondContact O-N 3.38Å; D1026-S1030 VanDerWaalsContact O-N 3.13Å
1027	L	74.4	Confident	84	Confident	42 Å²	42	34.1 Å²	34.1	22%	0.22	20%	0.201	C	C	.	.	S	Bend	trans	-65.3	-31	-178.6	-176	68.2	0	0	0	113	L45 L101 F534	L45-L1027 HydrophobicContact CB-CD2 3.98Å; L45-L1027 HydrophobicContact CD1-CD1 4.44Å; L45-L1027 HydrophobicContact CD1-CD2 4.36Å; L45-L1027 HydrophobicContact CD2-CD2 3.82Å; L45-L1027 HydrophobicContact CG-CD2 4.26Å; L101-L1027 VanDerWaalsContact CD1-O 3.23Å; L101-L1027 WeakPolarHBondContact CD1-O 3.26Å; F534-L1027 HydrophobicContact CB-CD1 4.24Å; F534-L1027 HydrophobicContact CD1-CD1 4.21Å; F534-L1027 HydrophobicContact CD2-CD1 3.68Å; F534-L1027 HydrophobicContact CE2-CD1 4.04Å; F534-L1027 HydrophobicContact CG-CD1 3.78Å; F534-L1027 HydrophobicContact CZ-CD1 4.45Å
1028	Q	76.9	Confident	83.8	Confident	70 Å²	70	36.1 Å²	36.1	33%	0.327	21%	0.212	S	C	.	.	S	Bend	trans	-80.4	-24	179.6	-61.7	-62.9	-43.9	0	0	111.6	A986 D1026	A986-Q1028 HydrophobicContact CB-CB 3.96Å; D1026-Q1028 VanDerWaalsContact C-N 3.27Å; D1026-Q1028 PolarHBondContact O-N 3.35Å; D1026-Q1028 WeakPolarHBondContact OD1-CA 3.46Å; D1026-Q1028 WeakPolarHBondContact OD1-CB 3.35Å; D1026-Q1028 PolarHBondContact OD1-N 2.7Å
1029	C	80.6	Confident	83.6	Confident	1 Å²	1	35.4 Å²	35.4	1%	0.007	21%	0.207	C	C	.	.			trans	-142.6	89.7	176.9	-178.9	0	0	0	0	110.1	C970 A986 D1026 K1031	C970-C1029 WeakPolarHBondContact CA-SG 3.43Å; C970-C1029 HydrophobicContact CB-CB 4.06Å; C970-C1029 WeakPolarHBondContact CB-SG 3.07Å; C970-C1029 VanDerWaalsContact SG-CA 3.55Å; C970-C1029 WeakPolarHBondContact SG-CB 3.02Å; C970-C1029 CovalentContact SG-SG 2.03Å; C970-C1029 PolarHBondContact SG-SG 3.01Å; A986-C1029 HydrophobicContact CB-CB 3.57Å; D1026-C1029 PolarHBondContact N-O 2.78Å; D1026-C1029 CarbonylContact O-C 3.51Å; D1026-C1029 PolarHBondContact O-N 3.48Å; D1026-C1029 PolarHBondContact OD1-N 3.5Å; C1029-K1031 PolarHBondContact O-N 3.28Å; C1029-K1031 PolarHBondContact SG-O 3.34Å
1030	S	76.1	Confident	83.6	Confident	50 Å²	50	33.2 Å²	33.2	35%	0.35	20%	0.195	S	C	.	.			trans	-67.9	-15.2	-179.3	55.7	0	0	0	0	113.8	D1026	D1026-S1030 WeakPolarHBondContact O-CA 3.31Å; D1026-S1030 PolarHBondContact O-N 3.38Å; D1026-S1030 VanDerWaalsContact O-N 3.13Å
1031	K	77.9	Confident	83.7	Confident	22 Å²	22	33.6 Å²	33.6	10%	0.096	20%	0.198	C	C	.	.			trans	-98.2	118.3	179.4	-60.1	-174	179.8	178.7	0	109.6	A104 D962 W963 C1029	A104-K1031 WeakPolarHBondContact O-CE 3.45Å; A104-K1031 PolarHBondContact O-NZ 3.42Å; D962-K1031 HydrophobicContact CB-CD 3.51Å; D962-K1031 IonicContact OD2-NZ 3.96Å; D962-K1031 PolarHBondContact OD2-NZ 3.1Å; W963-K1031 HydrophobicContact CB-CB 4.46Å; C1029-K1031 PolarHBondContact O-N 3.28Å; C1029-K1031 PolarHBondContact SG-O 3.34Å
1032	G	81.4	Confident	83.7	Confident	10 Å²	10	34.7 Å²	34.7	10%	0.103	20%	0.204	C	C	.	.			trans	-151.5	148.3	177.2	0	0	0	0	0	110.4
1033	G	83.8	Confident	83.9	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.195	C	C	.	.			trans	-83.8	-20.8	-178.9	0	0	0	0	0	113.9	F1020 L1021 N1023 G1035 Y1037 D1038	F1020-G1033 VanDerWaalsContact O-CA 3.29Å; F1020-G1033 WeakPolarHBondContact O-CA 3.28Å; F1020-G1033 PolarHBondContact O-N 3Å; L1021-G1033 CarbonylContact O-C 3.57Å; N1023-G1033 PolarHBondContact O-N 2.7Å; G1033-G1035 PolarHBondContact O-N 3.43Å; G1033-Y1037 CarbonylContact O-C 3.59Å; G1033-Y1037 WeakPolarHBondContact O-CA 3.41Å; G1033-Y1037 PolarHBondContact O-N 3.21Å; G1033-D1038 PolarHBondContact O-N 3.01Å
1034	L	86.9	Confident	83.8	Confident	37 Å²	37	38.9 Å²	38.9	19%	0.194	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	127.6	-176.3	-171.8	64.6	0	0	0	111.6	L1021 N1023 R1024 A1036 D1038	L1021-L1034 WeakPolarHBondContact O-CA 3.28Å; L1021-L1034 PolarHBondContact O-N 2.9Å; N1023-L1034 VanDerWaalsContact O-CB 3.27Å; N1023-L1034 WeakPolarHBondContact O-CB 3.39Å; N1023-L1034 PolarHBondContact O-N 3Å; R1024-L1034 HydrophobicContact CB-CD2 4.25Å; L1034-A1036 VanDerWaalsContact C-N 3.27Å; L1034-A1036 PolarHBondContact O-N 3.05Å; L1034-D1038 HydrophobicContact CD1-CB 4.26Å
1035	G	81.8	Confident	83.8	Confident	17 Å²	17	40.6 Å²	40.6	18%	0.175	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.5	-25.2	179.1	0	0	0	0	0	115.2	P476 G1033 D1038	P476-G1035 WeakPolarHBondContact O-CA 3.24Å; G1033-G1035 PolarHBondContact O-N 3.43Å; G1035-D1038 PolarHBondContact N-OD1 3.11Å
1036	A	83.9	Confident	83.7	Confident	44 Å²	44	45.3 Å²	45.3	36%	0.364	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.4	-41	176	0	0	0	0	0	113	L1034	L1034-A1036 VanDerWaalsContact C-N 3.27Å; L1034-A1036 PolarHBondContact O-N 3.05Å
1037	Y	89.8	Confident	83.8	Confident	2 Å²	2	44.8 Å²	44.8	1%	0.008	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-129.5	-12	-168.1	-57	-52.5	0	0	0	115	A177 N954 W956 D959 F1020 G1033 T1039 A1040 V1041	A177-Y1037 WeakPolarHBondContact CA-OH 3.42Å; N954-Y1037 HydrophobicContact CB-CE1 4.3Å; W956-Y1037 HydrophobicContact CB-CD1 3.52Å; W956-Y1037 HydrophobicContact CB-CD2 3.92Å; W956-Y1037 HydrophobicContact CB-CE1 3.95Å; W956-Y1037 HydrophobicContact CB-CE2 4.32Å; W956-Y1037 HydrophobicContact CB-CG 3.49Å; W956-Y1037 VanDerWaalsContact CB-CG 3.49Å; D959-Y1037 HydrophobicContact CB-CE2 3.91Å; D959-Y1037 VanDerWaalsContact OD2-CE2 3.31Å; D959-Y1037 WeakPolarHBondContact OD2-CE2 3.4Å; D959-Y1037 PolarHBondContact OD2-OH 3.1Å; F1020-Y1037 HydrophobicContact CE1-CD2 4.23Å; F1020-Y1037 AromaticContact CZ-CD2 3.89Å; F1020-Y1037 HydrophobicContact CZ-CD2 3.89Å; F1020-Y1037 HydrophobicContact CZ-CE2 4.46Å; G1033-Y1037 CarbonylContact O-C 3.59Å; G1033-Y1037 WeakPolarHBondContact O-CA 3.41Å; G1033-Y1037 PolarHBondContact O-N 3.21Å; Y1037-T1039 PolarHBondContact O-N 3.3Å; Y1037-A1040 HydrophobicContact CD1-CB 4.41Å; Y1037-A1040 WeakPolarHBondContact O-CA 3.06Å; Y1037-A1040 WeakPolarHBondContact O-CB 3.09Å; Y1037-A1040 PolarHBondContact O-N 3.31Å; Y1037-V1041 PolarHBondContact O-N 3.05Å
1038	D	85.3	Confident	84.4	Confident	45 Å²	45	46.6 Å²	46.6	24%	0.241	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.7	-41.7	176.4	66.5	-44.7	0	0	0	112.7	G1033 L1034 G1035	G1033-D1038 PolarHBondContact O-N 3.01Å; L1034-D1038 HydrophobicContact CD1-CB 4.26Å; G1035-D1038 PolarHBondContact N-OD1 3.11Å
1039	T	87.5	Confident	85	Confident	37 Å²	37	43.6 Å²	43.6	23%	0.227	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.4	-2.5	174.8	62.4	0	0	0	0	113.4	F403 Y1037 R1053	F403-T1039 VanDerWaalsContact CD1-O 3.24Å; F403-T1039 WeakPolarHBondContact CD1-O 3.49Å; Y1037-T1039 PolarHBondContact O-N 3.3Å; T1039-R1053 PolarHBondContact OG1-NH2 2.96Å
1040	A	90.8	Very high	85.5	Confident	4 Å²	4	45.2 Å²	45.2	3%	0.033	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	-20.4	-177.3	0	0	0	0	0	113.4	F403 Y1037 T1052 R1053	F403-A1040 WeakPolarHBondContact CE1-O 3.37Å; Y1037-A1040 HydrophobicContact CD1-CB 4.41Å; Y1037-A1040 WeakPolarHBondContact O-CA 3.06Å; Y1037-A1040 WeakPolarHBondContact O-CB 3.09Å; Y1037-A1040 PolarHBondContact O-N 3.31Å; A1040-T1052 CarbonylContact O-C 3.5Å; A1040-T1052 WeakPolarHBondContact O-CA 3.28Å; A1040-T1052 PolarHBondContact O-OG1 3.23Å; A1040-R1053 HydrophobicContact CB-CG 3.87Å; A1040-R1053 PolarHBondContact O-N 3.48Å
1041	V	92.9	Very high	86.3	Confident	8 Å²	8	42.9 Å²	42.9	5%	0.048	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	112.1	-177.7	-175.3	0	0	0	0	110.5	W956 L1017 L1021 Y1037 R1043 I1049	W956-V1041 HydrophobicContact CB-CG2 4.45Å; W956-V1041 HydrophobicContact CD2-CG2 3.57Å; W956-V1041 HydrophobicContact CE3-CG2 4.08Å; W956-V1041 HydrophobicContact CG-CG2 3.74Å; W956-V1041 HydrophobicContact CZ2-CG2 4.19Å; L1017-V1041 HydrophobicContact CD2-CG1 4.47Å; L1021-V1041 HydrophobicContact CD1-CB 4.12Å; L1021-V1041 HydrophobicContact CD1-CG1 4.39Å; L1021-V1041 HydrophobicContact CD2-CB 4.39Å; L1021-V1041 HydrophobicContact CD2-CG2 4.28Å; Y1037-V1041 PolarHBondContact O-N 3.05Å; V1041-R1043 HydrophobicContact CG1-CG 4.23Å; V1041-I1049 HydrophobicContact CG1-CD1 4.09Å; V1041-I1049 HydrophobicContact CG1-CG1 4.24Å; V1041-I1049 HydrophobicContact CG1-CG2 4.26Å
1042	V	91.7	Very high	87.1	Confident	33 Å²	33	41.9 Å²	41.9	20%	0.2	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	127.4	-179.3	179.7	0	0	0	0	109.8	H402 F403 I1050 A1051	H402-V1042 HydrophobicContact CB-CG2 4.42Å; H402-V1042 WeakPolarHBondContact O-CG2 3.46Å; F403-V1042 HydrophobicContact CD1-CG2 3.58Å; F403-V1042 HydrophobicContact CE1-CB 4.46Å; F403-V1042 HydrophobicContact CE1-CG2 3.45Å; F403-V1042 VanDerWaalsContact CE1-CG2 3.45Å; F403-V1042 HydrophobicContact CG-CG2 4.5Å; F403-V1042 HydrophobicContact CZ-CG2 4.26Å; V1042-I1050 PolarHBondContact O-N 2.97Å; V1042-A1051 PolarHBondContact N-O 2.81Å
1043	R	90.4	Very high	87.7	Confident	90 Å²	90	42.7 Å²	42.7	34%	0.34	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	147.9	-173.7	-60	176.6	-65.5	-178.4	-0.1	111.8	P1018 V1041 E1048 I1049	P1018-R1043 VanDerWaalsContact CD-NH1 3.27Å; V1041-R1043 HydrophobicContact CG1-CG 4.23Å; R1043-E1048 CarbonylContact C-O 3.23Å; R1043-E1048 VanDerWaalsContact CA-O 3.28Å; R1043-E1048 WeakPolarHBondContact CA-O 3.35Å; R1043-I1049 HydrophobicContact CG-CG1 4.43Å
1044	D	85.9	Confident	88.2	Confident	63 Å²	63	42.7 Å²	42.7	34%	0.337	23%	0.231	S	C	.	.			trans	-80.3	171.3	171.4	-157.9	-1.5	0	0	0	111.6	N1046 G1047 E1048 I1050	D1044-N1046 PolarHBondContact O-N 3.35Å; D1044-G1047 PolarHBondContact O-N 3.11Å; D1044-E1048 PolarHBondContact N-O 3.46Å; D1044-I1050 HydrophobicContact CB-CD1 3.77Å; D1044-I1050 HydrophobicContact CB-CG1 3.95Å
1045	Q	83.1	Confident	88.4	Confident	191 Å²	191	42.8 Å²	42.8	89%	0.893	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-29.6	173.9	-62.3	-176.8	3.1	0	0	112.6	G1047	Q1045-G1047 VanDerWaalsContact C-N 3.27Å; Q1045-G1047 PolarHBondContact O-N 3.36Å
1046	N	80	Confident	89	Confident	143 Å²	143	42 Å²	42	77%	0.765	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.1	-0.9	177.3	-62.9	-18.6	0	0	0	113.5	D1044 E1048	D1044-N1046 PolarHBondContact O-N 3.35Å; N1046-E1048 VanDerWaalsContact C-N 3.32Å; N1046-E1048 PolarHBondContact O-N 2.85Å
1047	G	79.4	Confident	89.3	Confident	31 Å²	31	42.4 Å²	42.4	32%	0.32	22%	0.215	S	C	.	.	S	Bend	trans	81.3	2.9	-177.4	0	0	0	0	0	115.2	D1044 Q1045	D1044-G1047 PolarHBondContact O-N 3.11Å; Q1045-G1047 VanDerWaalsContact C-N 3.27Å; Q1045-G1047 PolarHBondContact O-N 3.36Å
1048	E	85.4	Confident	89.6	Confident	80 Å²	80	42.3 Å²	42.3	37%	0.374	22%	0.215	S	C	.	.			trans	-72.2	140.6	174.7	-165.6	-169.7	175.2	0	0	111	K909 R1043 D1044 N1046 I1050	K909-E1048 VanDerWaalsContact CE-CD 3.46Å; K909-E1048 WeakPolarHBondContact CE-OE1 3.02Å; K909-E1048 WeakPolarHBondContact CE-OE2 3.09Å; K909-E1048 IonicContact NZ-OE1 3.27Å; K909-E1048 IonicContact NZ-OE2 2.73Å; K909-E1048 PolarHBondContact NZ-OE2 2.69Å; R1043-E1048 CarbonylContact C-O 3.23Å; R1043-E1048 VanDerWaalsContact CA-O 3.28Å; R1043-E1048 WeakPolarHBondContact CA-O 3.35Å; D1044-E1048 PolarHBondContact N-O 3.46Å; N1046-E1048 VanDerWaalsContact C-N 3.32Å; N1046-E1048 PolarHBondContact O-N 2.85Å; E1048-I1050 PolarHBondContact O-N 3.12Å
1049	I	90.1	Very high	89.9	Confident	7 Å²	7	41.2 Å²	41.2	4%	0.036	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	115.4	177.5	-58.4	179.9	0	0	0	109.6	F913 W956 F1013 L1017 V1041 R1043 T1052	F913-I1049 HydrophobicContact CB-CD1 3.94Å; F913-I1049 HydrophobicContact CD2-CB 4.1Å; F913-I1049 HydrophobicContact CD2-CD1 3.94Å; F913-I1049 HydrophobicContact CD2-CG2 4.13Å; F913-I1049 HydrophobicContact CE2-CG2 4.13Å; F913-I1049 HydrophobicContact CG-CD1 4.09Å; W956-I1049 HydrophobicContact CH2-CD1 3.49Å; W956-I1049 VanDerWaalsContact CH2-CD1 3.49Å; W956-I1049 HydrophobicContact CZ2-CD1 3.87Å; F1013-I1049 HydrophobicContact CE1-CD1 4.21Å; F1013-I1049 HydrophobicContact CZ-CD1 4.18Å; L1017-I1049 HydrophobicContact CD2-CD1 4.11Å; L1017-I1049 HydrophobicContact CD2-CG1 4.49Å; V1041-I1049 HydrophobicContact CG1-CD1 4.09Å; V1041-I1049 HydrophobicContact CG1-CG1 4.24Å; V1041-I1049 HydrophobicContact CG1-CG2 4.26Å; R1043-I1049 HydrophobicContact CG-CG1 4.43Å; I1049-T1052 HydrophobicContact CG2-CG2 4.44Å
1050	I	91.1	Very high	90.1	Very high	36 Å²	36	42.1 Å²	42.1	19%	0.185	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	-43.5	179.5	-55.4	174.4	0	0	0	110.3	K908 K909 V1042 D1044 E1048	K908-I1050 CarbonylContact C-O 3.54Å; K909-I1050 VanDerWaalsContact CA-O 3.26Å; K909-I1050 WeakPolarHBondContact CA-O 3.35Å; K909-I1050 HydrophobicContact CB-CG2 4.49Å; K909-I1050 WeakPolarHBondContact CB-O 3.46Å; K909-I1050 PolarHBondContact N-O 3.14Å; V1042-I1050 PolarHBondContact O-N 2.97Å; D1044-I1050 HydrophobicContact CB-CD1 3.77Å; D1044-I1050 HydrophobicContact CB-CG1 3.95Å; E1048-I1050 PolarHBondContact O-N 3.12Å
1051	A	93.1	Very high	90.1	Very high	1 Å²	1	42.8 Å²	42.8	1%	0.008	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	144.3	-179	0	0	0	0	0	110	F398 H402 F403 T907 V1042	F398-A1051 HydrophobicContact CE1-CB 4.01Å; F398-A1051 HydrophobicContact CZ-CB 4.17Å; H402-A1051 HydrophobicContact CB-CB 4.22Å; F403-A1051 HydrophobicContact CE2-CB 4.01Å; F403-A1051 HydrophobicContact CZ-CB 3.68Å; T907-A1051 WeakPolarHBondContact O-CA 3.49Å; V1042-A1051 PolarHBondContact N-O 2.81Å
1052	T	94.8	Very high	89.9	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	154.9	168.6	176.9	0	0	0	0	111.1	V906 T907 F913 W956 A1040 I1049 F1054	V906-T1052 CarbonylContact C-O 3.39Å; V906-T1052 WeakPolarHBondContact CA-O 3.29Å; T907-T1052 HydrophobicContact CG2-CG2 4.38Å; T907-T1052 PolarHBondContact N-O 3.33Å; T907-T1052 PolarHBondContact O-N 3.17Å; T907-T1052 WeakPolarHBondContact OG1-CG2 3.45Å; T907-T1052 PolarHBondContact OG1-O 3.39Å; F913-T1052 HydrophobicContact CE1-CG2 4.09Å; F913-T1052 HydrophobicContact CE2-CG2 3.93Å; F913-T1052 HydrophobicContact CZ-CG2 3.46Å; F913-T1052 VanDerWaalsContact CZ-CG2 3.46Å; W956-T1052 HydrophobicContact CZ2-CG2 4.35Å; W956-T1052 PolarHBondContact NE1-OG1 2.89Å; A1040-T1052 CarbonylContact O-C 3.5Å; A1040-T1052 WeakPolarHBondContact O-CA 3.28Å; A1040-T1052 PolarHBondContact O-OG1 3.23Å; I1049-T1052 HydrophobicContact CG2-CG2 4.44Å; T1052-F1054 HydrophobicContact CG2-CE2 3.94Å
1053	R	94	Very high	89.8	Confident	27 Å²	27	45.9 Å²	45.9	10%	0.102	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	145.2	177.7	66.4	-176.8	-177.1	170.9	-0.2	112.6	H399 F403 Y904 F905 V906 T1039 A1040	H399-R1053 PolarHBondContact NE2-NH1 3.37Å; F403-R1053 HydrophobicContact CE1-CG 4.26Å; F403-R1053 HydrophobicContact CZ-CB 4.23Å; F403-R1053 HydrophobicContact CZ-CG 4.4Å; Y904-R1053 HydrophobicContact CD1-CB 4.46Å; Y904-R1053 HydrophobicContact CD1-CG 4.32Å; F905-R1053 WeakPolarHBondContact O-CA 3.25Å; V906-R1053 HydrophobicContact CG2-CB 4.07Å; T1039-R1053 PolarHBondContact OG1-NH2 2.96Å; A1040-R1053 HydrophobicContact CB-CG 3.87Å; A1040-R1053 PolarHBondContact O-N 3.48Å
1054	F	93.9	Very high	89.9	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	119.3	174.4	-62.4	-99.3	0	0	0	108.6	Y904 F905 T907 V922 M933 T934 A953 N954 W956 V957 T1052	Y904-F1054 CarbonylContact C-O 3.58Å; Y904-F1054 WeakPolarHBondContact CA-O 3.46Å; F905-F1054 HydrophobicContact CB-CB 4.4Å; F905-F1054 PolarHBondContact N-O 2.78Å; F905-F1054 PolarHBondContact O-N 3.39Å; T907-F1054 HydrophobicContact CG2-CD2 4.49Å; T907-F1054 HydrophobicContact CG2-CE2 4.14Å; V922-F1054 HydrophobicContact CG1-CE1 3.88Å; V922-F1054 HydrophobicContact CG1-CE2 4.4Å; V922-F1054 HydrophobicContact CG1-CZ 3.54Å; M933-F1054 HydrophobicContact CE-CB 4.35Å; M933-F1054 HydrophobicContact CE-CD2 3.53Å; M933-F1054 HydrophobicContact CE-CE2 4.07Å; M933-F1054 HydrophobicContact CE-CG 4.05Å; M933-F1054 HydrophobicContact SD-CD2 4.24Å; M933-F1054 HydrophobicContact SD-CE2 4.21Å; T934-F1054 HydrophobicContact CG2-CD1 4.26Å; T934-F1054 HydrophobicContact CG2-CE1 4.37Å; A953-F1054 HydrophobicContact CB-CB 4.25Å; N954-F1054 VanDerWaalsContact O-CD1 3.31Å; N954-F1054 WeakPolarHBondContact O-CD1 3.42Å; W956-F1054 AromaticContact CD1-CE1 3.94Å; W956-F1054 AromaticContact CD1-CZ 3.92Å; W956-F1054 AromaticContact NE1-CZ 3.54Å; V957-F1054 HydrophobicContact CG2-CE1 4.5Å; V957-F1054 HydrophobicContact CG2-CZ 4.3Å; T1052-F1054 HydrophobicContact CG2-CE2 3.94Å
1055	M	92.5	Very high	90.1	Very high	39 Å²	39	41.8 Å²	41.8	19%	0.192	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	128.3	-172.5	-176.2	179.7	178.5	0	0	110.9	P902 Y904 A953 N954 Y1057	P902-M1055 HydrophobicContact CB-CE 3.55Å; P902-M1055 HydrophobicContact CG-CE 4.3Å; Y904-M1055 HydrophobicContact CD1-CB 3.77Å; Y904-M1055 HydrophobicContact CD1-CG 3.97Å; Y904-M1055 HydrophobicContact CE1-CB 3.64Å; Y904-M1055 HydrophobicContact CE1-CE 4.49Å; Y904-M1055 HydrophobicContact CE1-CG 3.47Å; Y904-M1055 VanDerWaalsContact CE1-CG 3.47Å; Y904-M1055 HydrophobicContact CE1-SD 3.71Å; A953-M1055 CarbonylContact C-O 3.55Å; A953-M1055 VanDerWaalsContact CA-O 3.23Å; A953-M1055 WeakPolarHBondContact CA-O 3.37Å; N954-M1055 PolarHBondContact N-O 2.84Å; N954-M1055 WeakPolarHBondContact OD1-CB 3.39Å; N954-M1055 PolarHBondContact OD1-N 3.37Å; N954-M1055 PolarHBondContact OD1-O 3.26Å; M1055-Y1057 HydrophobicContact CE-CE1 4.17Å; M1055-Y1057 HydrophobicContact CE-CE2 3.78Å; M1055-Y1057 VanDerWaalsContact CE-CZ 3.44Å; M1055-Y1057 WeakPolarHBondContact CE-OH 3.5Å
1056	A	92.5	Very high	90.6	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	174.4	172.4	0	0	0	0	0	109.8	P902 V903 F905 I937 M949 A953	P902-A1056 CarbonylContact C-O 3.34Å; P902-A1056 WeakPolarHBondContact CA-O 3.28Å; V903-A1056 HydrophobicContact CG1-CB 4.04Å; V903-A1056 PolarHBondContact N-O 2.03Å; V903-A1056 PolarHBondContact O-N 2.89Å; F905-A1056 HydrophobicContact CE2-CB 4.38Å; I937-A1056 HydrophobicContact CG2-CB 4.36Å; M949-A1056 HydrophobicContact CE-CB 3.4Å; M949-A1056 VanDerWaalsContact CE-CB 3.4Å; A953-A1056 HydrophobicContact CB-CB 4.18Å
1057	Y	92.1	Very high	91.2	Very high	53 Å²	53	29.3 Å²	29.3	21%	0.208	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	138.9	177.8	-69.7	-101.3	0	0	0	112.3	P902 A950 I951 M1055	P902-Y1057 HydrophobicContact CB-CD1 4.19Å; P902-Y1057 HydrophobicContact CB-CE1 4.05Å; A950-Y1057 PolarHBondContact N-O 3.14Å; I951-Y1057 HydrophobicContact CB-CD2 4.07Å; I951-Y1057 HydrophobicContact CB-CG 4.43Å; I951-Y1057 HydrophobicContact CD1-CD2 3.95Å; I951-Y1057 HydrophobicContact CD1-CG 4.09Å; I951-Y1057 HydrophobicContact CG1-CD2 4.5Å; I951-Y1057 HydrophobicContact CG2-CD2 4.32Å; I951-Y1057 PolarHBondContact N-O 2.9Å; I951-Y1057 PolarHBondContact O-N 3.05Å; M1055-Y1057 HydrophobicContact CE-CE1 4.17Å; M1055-Y1057 HydrophobicContact CE-CE2 3.78Å; M1055-Y1057 VanDerWaalsContact CE-CZ 3.44Å; M1055-Y1057 WeakPolarHBondContact CE-OH 3.5Å
1058	H	94.3	Very high	91.9	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	163.5	168.5	-79.2	-59.5	0	0	0	111.9	G900 V901 Y948 L1061 Y1104	G900-H1058 VanDerWaalsContact CA-O 3.29Å; G900-H1058 WeakPolarHBondContact CA-O 3.39Å; G900-H1058 PolarHBondContact N-O 2.02Å; V901-H1058 WeakPolarHBondContact O-CB 3.49Å; V901-H1058 PolarHBondContact O-N 3.29Å; Y948-H1058 CarbonylContact O-C 3.41Å; Y948-H1058 WeakPolarHBondContact O-CA 3.19Å; Y948-H1058 WeakPolarHBondContact O-CB 3.23Å; Y948-H1058 PolarHBondContact O-ND1 3.15Å; H1058-L1061 HydrophobicContact CB-CD1 4.26Å; H1058-Y1104 AromaticContact NE2-CZ 3.87Å; H1058-Y1104 PolarHBondContact NE2-OH 2.97Å
1059	T	92.3	Very high	92.2	Very high	23 Å²	23	26.4 Å²	26.4	14%	0.141	14%	0.141	C	C	.	.	P	Polyproline II helix	trans	-65.7	160.8	161.1	54.9	0	0	0	0	110.1	G900 P944 Y948 A950 L1061	G900-T1059 VanDerWaalsContact CA-O 3.23Å; G900-T1059 WeakPolarHBondContact CA-O 3.36Å; P944-T1059 HydrophobicContact CB-CG2 3.69Å; Y948-T1059 PolarHBondContact O-N 3.28Å; A950-T1059 HydrophobicContact CB-CG2 4.07Å; T1059-L1061 WeakPolarHBondContact O-CG 3.31Å; T1059-L1061 PolarHBondContact O-N 2.78Å
1060	P	91.6	Very high	92.4	Very high	55 Å²	55	26 Å²	26	36%	0.357	14%	0.139	S	C	.	.	P	Polyproline II helix	trans	-52.1	124.4	168.6	-26.1	35.6	0	0	0	110.4	E898	E898-P1060 WeakPolarHBondContact O-CD 3.35Å; E898-P1060 WeakPolarHBondContact O-CG 3.38Å
1061	L	91.1	Very high	92.5	Very high	18 Å²	18	24.3 Å²	24.3	9%	0.094	13%	0.13	C	C	.	.			trans	-112.9	121.3	179.5	-56.3	175.2	0	0	0	107.5	Y948 H1058 T1059 E1066 F1067 A1070	Y948-L1061 HydrophobicContact CD1-CD2 3.71Å; Y948-L1061 HydrophobicContact CE1-CD2 4.48Å; Y948-L1061 HydrophobicContact CG-CD2 4.38Å; H1058-L1061 HydrophobicContact CB-CD1 4.26Å; T1059-L1061 WeakPolarHBondContact O-CG 3.31Å; T1059-L1061 PolarHBondContact O-N 2.78Å; L1061-E1066 HydrophobicContact CB-CB 4.46Å; L1061-E1066 HydrophobicContact CD2-CB 4.06Å; L1061-F1067 HydrophobicContact CB-CD1 3.84Å; L1061-F1067 HydrophobicContact CB-CD2 4.16Å; L1061-F1067 HydrophobicContact CB-CE1 3.55Å; L1061-F1067 HydrophobicContact CB-CE2 3.87Å; L1061-F1067 HydrophobicContact CB-CG 4.13Å; L1061-F1067 HydrophobicContact CB-CZ 3.55Å; L1061-F1067 HydrophobicContact CD1-CD1 3.46Å; L1061-F1067 VanDerWaalsContact CD1-CD1 3.46Å; L1061-F1067 HydrophobicContact CD1-CE1 3.67Å; L1061-F1067 HydrophobicContact CD1-CG 4.21Å; L1061-F1067 HydrophobicContact CG-CD1 4.29Å; L1061-F1067 HydrophobicContact CG-CE1 4.22Å; L1061-F1067 WeakPolarHBondContact O-CE2 3.08Å; L1061-F1067 VanDerWaalsContact O-CZ 3.32Å; L1061-F1067 WeakPolarHBondContact O-CZ 3.36Å; L1061-A1070 HydrophobicContact CD1-CB 3.85Å; L1061-A1070 HydrophobicContact CD2-CB 4.05Å
1062	T	88.8	Confident	92.6	Very high	63 Å²	63	28.4 Å²	28.4	39%	0.387	15%	0.151	S	C	.	.			trans	-108.6	-36.7	-170.1	60.2	0	0	0	0	112.7	N894 E1066	N894-T1062 HydrophobicContact CB-CG2 4.35Å; T1062-E1066 PolarHBondContact N-OE2 2.63Å; T1062-E1066 PolarHBondContact OG1-OE2 2.82Å
1063	N	90.1	Very high	92.5	Very high	43 Å²	43	31.9 Å²	31.9	23%	0.23	17%	0.166	C	C	.	.	S	Bend	trans	-119.3	159.1	-174.5	59.6	54.1	0	0	0	112.2	Q1065 E1066 F1067	N1063-Q1065 PolarHBondContact O-N 3.42Å; N1063-Q1065 VanDerWaalsContact O-N 3.17Å; N1063-Q1065 PolarHBondContact OD1-N 2.62Å; N1063-Q1065 PolarHBondContact OD1-OE1 3.15Å; N1063-E1066 PolarHBondContact ND2-OE1 3.2Å; N1063-E1066 PolarHBondContact O-N 3.13Å; N1063-E1066 VanDerWaalsContact O-N 3.16Å; N1063-E1066 VanDerWaalsContact OD1-CB 3.28Å; N1063-E1066 WeakPolarHBondContact OD1-CB 3.04Å; N1063-E1066 WeakPolarHBondContact OD1-CG 3.46Å; N1063-E1066 PolarHBondContact OD1-N 3.26Å; N1063-F1067 WeakPolarHBondContact O-CD2 3.22Å; N1063-F1067 PolarHBondContact O-N 3.49Å; N1063-F1067 VanDerWaalsContact O-N 3.16Å
1064	S	91.6	Very high	92.5	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-58.1	-28.4	-179.9	49.8	0	0	0	0	114	D875 T1068	D875-S1064 VanDerWaalsContact OD1-CB 3.25Å; D875-S1064 WeakPolarHBondContact OD1-CB 3.43Å; D875-S1064 PolarHBondContact OD1-N 2.91Å; D875-S1064 PolarHBondContact OD1-OG 3.3Å; S1064-T1068 WeakPolarHBondContact O-CB 3.12Å; S1064-T1068 PolarHBondContact O-N 2.97Å; S1064-T1068 VanDerWaalsContact O-N 3.1Å; S1064-T1068 PolarHBondContact O-OG1 3.42Å
1065	Q	90.8	Very high	92.6	Very high	68 Å²	68	32.4 Å²	32.4	32%	0.318	17%	0.169	S	C	.	.	H	α-helix	trans	-72	-40.7	177.5	-62.1	79.1	23	0	0	112	V872 N1063 T1068 A1069	V872-Q1065 PolarHBondContact O-NE2 3.2Å; V872-Q1065 VanDerWaalsContact O-NE2 3.08Å; N1063-Q1065 PolarHBondContact O-N 3.42Å; N1063-Q1065 VanDerWaalsContact O-N 3.17Å; N1063-Q1065 PolarHBondContact OD1-N 2.62Å; N1063-Q1065 PolarHBondContact OD1-OE1 3.15Å; Q1065-T1068 PolarHBondContact O-N 2.99Å; Q1065-A1069 VanDerWaalsContact O-CB 3.25Å; Q1065-A1069 WeakPolarHBondContact O-CB 3.42Å; Q1065-A1069 PolarHBondContact O-N 3.03Å
1066	E	92.4	Very high	92.6	Very high	50 Å²	50	34 Å²	34	23%	0.234	18%	0.176	C	C	.	.	H	α-helix	trans	-63.6	-45	175.1	-78.2	165.1	-161.5	0	0	111.1	Y948 L1061 T1062 N1063 T1068 A1069 A1070	Y948-E1066 HydrophobicContact CE1-CB 4.34Å; Y948-E1066 HydrophobicContact CE1-CG 4.08Å; L1061-E1066 HydrophobicContact CB-CB 4.46Å; L1061-E1066 HydrophobicContact CD2-CB 4.06Å; T1062-E1066 PolarHBondContact N-OE2 2.63Å; T1062-E1066 PolarHBondContact OG1-OE2 2.82Å; N1063-E1066 PolarHBondContact ND2-OE1 3.2Å; N1063-E1066 PolarHBondContact O-N 3.13Å; N1063-E1066 VanDerWaalsContact O-N 3.16Å; N1063-E1066 VanDerWaalsContact OD1-CB 3.28Å; N1063-E1066 WeakPolarHBondContact OD1-CB 3.04Å; N1063-E1066 WeakPolarHBondContact OD1-CG 3.46Å; N1063-E1066 PolarHBondContact OD1-N 3.26Å; E1066-T1068 VanDerWaalsContact C-N 3.32Å; E1066-T1068 PolarHBondContact O-N 2.88Å; E1066-A1069 PolarHBondContact O-N 3.25Å; E1066-A1070 VanDerWaalsContact O-CB 3.23Å; E1066-A1070 WeakPolarHBondContact O-CB 3.3Å; E1066-A1070 PolarHBondContact O-N 3.3Å
1067	F	93.5	Very high	92.7	Very high	21 Å²	21	35.2 Å²	35.2	9%	0.092	18%	0.182	C	C	.	.	H	α-helix	trans	-58.8	-43.4	173.5	-76.2	-73.9	0	0	0	112.4	L1061 N1063 L1071 T1103 Y1107	L1061-F1067 HydrophobicContact CB-CD1 3.84Å; L1061-F1067 HydrophobicContact CB-CD2 4.16Å; L1061-F1067 HydrophobicContact CB-CE1 3.55Å; L1061-F1067 HydrophobicContact CB-CE2 3.87Å; L1061-F1067 HydrophobicContact CB-CG 4.13Å; L1061-F1067 HydrophobicContact CB-CZ 3.55Å; L1061-F1067 HydrophobicContact CD1-CD1 3.46Å; L1061-F1067 VanDerWaalsContact CD1-CD1 3.46Å; L1061-F1067 HydrophobicContact CD1-CE1 3.67Å; L1061-F1067 HydrophobicContact CD1-CG 4.21Å; L1061-F1067 HydrophobicContact CG-CD1 4.29Å; L1061-F1067 HydrophobicContact CG-CE1 4.22Å; L1061-F1067 WeakPolarHBondContact O-CE2 3.08Å; L1061-F1067 VanDerWaalsContact O-CZ 3.32Å; L1061-F1067 WeakPolarHBondContact O-CZ 3.36Å; N1063-F1067 WeakPolarHBondContact O-CD2 3.22Å; N1063-F1067 PolarHBondContact O-N 3.49Å; N1063-F1067 VanDerWaalsContact O-N 3.16Å; F1067-L1071 WeakPolarHBondContact O-CB 3.27Å; F1067-L1071 PolarHBondContact O-N 3.33Å; F1067-T1103 HydrophobicContact CD1-CG2 4.33Å; F1067-T1103 HydrophobicContact CE1-CG2 4.03Å; F1067-Y1107 HydrophobicContact CB-CD1 3.73Å; F1067-Y1107 HydrophobicContact CB-CD2 3.66Å; F1067-Y1107 HydrophobicContact CB-CE1 3.84Å; F1067-Y1107 HydrophobicContact CB-CE2 3.76Å; F1067-Y1107 HydrophobicContact CB-CG 3.67Å; F1067-Y1107 HydrophobicContact CD1-CD2 4.29Å; F1067-Y1107 AromaticContact CD1-CE2 3.97Å; F1067-Y1107 HydrophobicContact CD1-CE2 3.97Å; F1067-Y1107 HydrophobicContact CD2-CE1 4.17Å; F1067-Y1107 AromaticContact CD2-CE2 4Å; F1067-Y1107 HydrophobicContact CD2-CE2 4Å; F1067-Y1107 AromaticContact CD2-CZ 3.67Å; F1067-Y1107 HydrophobicContact CG-CD2 4.02Å; F1067-Y1107 HydrophobicContact CG-CE1 4.22Å; F1067-Y1107 AromaticContact CG-CE2 3.64Å; F1067-Y1107 HydrophobicContact CG-CE2 3.64Å; F1067-Y1107 HydrophobicContact CG-CG 4.46Å; F1067-Y1107 AromaticContact CG-CZ 3.76Å
1068	T	93.3	Very high	92.9	Very high	21 Å²	21	32.7 Å²	32.7	13%	0.129	17%	0.173	C	C	.	.	H	α-helix	trans	-69.2	-39	179.4	-54	0	0	0	0	111.7	S1064 Q1065 E1066 L1072 L1111	S1064-T1068 WeakPolarHBondContact O-CB 3.12Å; S1064-T1068 PolarHBondContact O-N 2.97Å; S1064-T1068 VanDerWaalsContact O-N 3.1Å; S1064-T1068 PolarHBondContact O-OG1 3.42Å; Q1065-T1068 PolarHBondContact O-N 2.99Å; E1066-T1068 VanDerWaalsContact C-N 3.32Å; E1066-T1068 PolarHBondContact O-N 2.88Å; T1068-L1072 PolarHBondContact O-N 2.76Å; T1068-L1111 HydrophobicContact CG2-CD2 3.6Å; T1068-L1111 HydrophobicContact CG2-CG 4.25Å
1069	A	91.9	Very high	92.9	Very high	29 Å²	29	40.5 Å²	40.5	24%	0.24	21%	0.207	C	C	.	.	H	α-helix	trans	-68.3	-43.1	177.1	0	0	0	0	0	111.8	Y948 Q1065 E1066 L1071 L1072 K1073	Y948-A1069 HydrophobicContact CD2-CB 4.5Å; Y948-A1069 HydrophobicContact CE2-CB 3.69Å; Q1065-A1069 VanDerWaalsContact O-CB 3.25Å; Q1065-A1069 WeakPolarHBondContact O-CB 3.42Å; Q1065-A1069 PolarHBondContact O-N 3.03Å; E1066-A1069 PolarHBondContact O-N 3.25Å; A1069-L1071 PolarHBondContact O-N 2.94Å; A1069-L1072 PolarHBondContact O-N 3.29Å; A1069-K1073 WeakPolarHBondContact O-CB 3.47Å; A1069-K1073 WeakPolarHBondContact O-CG 3.45Å; A1069-K1073 PolarHBondContact O-N 2.65Å
1070	A	94	Very high	92.9	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-59.5	-45.5	174.9	0	0	0	0	0	111.2	Y948 L1061 E1066 L1072 K1073 A1074	Y948-A1070 HydrophobicContact CD1-CB 4.49Å; Y948-A1070 HydrophobicContact CD2-CB 4.32Å; Y948-A1070 HydrophobicContact CG-CB 3.93Å; L1061-A1070 HydrophobicContact CD1-CB 3.85Å; L1061-A1070 HydrophobicContact CD2-CB 4.05Å; E1066-A1070 VanDerWaalsContact O-CB 3.23Å; E1066-A1070 WeakPolarHBondContact O-CB 3.3Å; E1066-A1070 PolarHBondContact O-N 3.3Å; A1070-L1072 PolarHBondContact O-N 2.78Å; A1070-K1073 PolarHBondContact O-N 3.15Å; A1070-A1074 VanDerWaalsContact O-CB 3.28Å; A1070-A1074 WeakPolarHBondContact O-CB 3.41Å; A1070-A1074 PolarHBondContact O-N 3.34Å
1071	L	94.9	Very high	93.1	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-57	-48.5	173.2	167.8	61.1	0	0	0	112.1	F1067 A1069 K1073 R1075 Y1104 E1108 L1111	F1067-L1071 WeakPolarHBondContact O-CB 3.27Å; F1067-L1071 PolarHBondContact O-N 3.33Å; A1069-L1071 PolarHBondContact O-N 2.94Å; L1071-K1073 VanDerWaalsContact C-N 3.35Å; L1071-K1073 PolarHBondContact O-N 2.94Å; L1071-R1075 HydrophobicContact CD1-CG 4.06Å; L1071-R1075 WeakPolarHBondContact O-CB 3.25Å; L1071-R1075 WeakPolarHBondContact O-CG 3.27Å; L1071-R1075 PolarHBondContact O-N 3.04Å; L1071-Y1104 HydrophobicContact CB-CD1 3.86Å; L1071-Y1104 HydrophobicContact CB-CE1 3.73Å; L1071-Y1104 HydrophobicContact CD1-CD1 3.65Å; L1071-Y1104 HydrophobicContact CD1-CD2 3.46Å; L1071-Y1104 VanDerWaalsContact CD1-CD2 3.46Å; L1071-Y1104 HydrophobicContact CD1-CE1 3.91Å; L1071-Y1104 HydrophobicContact CD1-CE2 3.71Å; L1071-Y1104 HydrophobicContact CD1-CG 3.45Å; L1071-Y1104 VanDerWaalsContact CD1-CG 3.45Å; L1071-Y1104 HydrophobicContact CG-CD1 4.21Å; L1071-Y1104 HydrophobicContact CG-CE1 4.4Å; L1071-Y1104 HydrophobicContact CG-CG 4.42Å; L1071-E1108 HydrophobicContact CD2-CB 4.18Å; L1071-L1111 HydrophobicContact CD2-CD1 3.81Å; L1071-L1111 HydrophobicContact CD2-CG 4.38Å; L1071-L1111 HydrophobicContact CG-CD1 4.21Å
1072	L	93.8	Very high	93.3	Very high	86 Å²	86	42 Å²	42	45%	0.45	21%	0.206	S	C	.	.	H	α-helix	trans	-61.8	-44	-179.9	-176	149	0	0	0	111.3	T1068 A1069 A1070 R1075 E1076 L1111	T1068-L1072 PolarHBondContact O-N 2.76Å; A1069-L1072 PolarHBondContact O-N 3.29Å; A1070-L1072 PolarHBondContact O-N 2.78Å; L1072-R1075 PolarHBondContact O-N 2.98Å; L1072-E1076 WeakPolarHBondContact O-CB 3.25Å; L1072-E1076 PolarHBondContact O-N 3.04Å; L1072-L1111 HydrophobicContact CB-CD2 4.29Å; L1072-L1111 HydrophobicContact CD1-CD2 4.18Å
1073	K	93.2	Very high	93.5	Very high	74 Å²	74	42.1 Å²	42.1	32%	0.322	21%	0.209	S	C	.	.	H	α-helix	trans	-70.1	-40.4	-179.3	-70.8	-71.8	161.3	-160.4	0	112.7	Y948 A1069 A1070 L1071 R1075 E1076 L1077	Y948-K1073 HydrophobicContact CD2-CG 4.43Å; A1069-K1073 WeakPolarHBondContact O-CB 3.47Å; A1069-K1073 WeakPolarHBondContact O-CG 3.45Å; A1069-K1073 PolarHBondContact O-N 2.65Å; A1070-K1073 PolarHBondContact O-N 3.15Å; L1071-K1073 VanDerWaalsContact C-N 3.35Å; L1071-K1073 PolarHBondContact O-N 2.94Å; K1073-R1075 PolarHBondContact O-N 3.42Å; K1073-E1076 IonicContact NZ-OE2 3.23Å; K1073-E1076 PolarHBondContact NZ-OE2 3.45Å; K1073-E1076 PolarHBondContact O-N 2.97Å; K1073-L1077 WeakPolarHBondContact O-CB 3.35Å; K1073-L1077 PolarHBondContact O-N 3.29Å
1074	A	94.6	Very high	93.6	Very high	3 Å²	3	42.7 Å²	42.7	3%	0.025	21%	0.212	C	C	.	.	H	α-helix	trans	-62.1	-42.2	173.3	0	0	0	0	0	111.6	A1070 L1077 A1078 P1099 Y1104	A1070-A1074 VanDerWaalsContact O-CB 3.28Å; A1070-A1074 WeakPolarHBondContact O-CB 3.41Å; A1070-A1074 PolarHBondContact O-N 3.34Å; A1074-L1077 PolarHBondContact O-N 3.37Å; A1074-A1078 WeakPolarHBondContact O-CB 3.48Å; A1074-A1078 PolarHBondContact O-N 3.01Å; A1074-P1099 HydrophobicContact CB-CB 3.94Å; A1074-P1099 HydrophobicContact CB-CG 3.93Å; A1074-Y1104 HydrophobicContact CB-CE2 4.49Å; A1074-Y1104 WeakPolarHBondContact CB-OH 3.46Å
1075	R	95.2	Very high	93.6	Very high	34 Å²	34	42.9 Å²	42.9	13%	0.128	21%	0.213	C	C	.	.	H	α-helix	trans	-65.5	-39.3	175.2	-78	-179.1	166.8	-178.7	-2.4	112.5	E395 L1071 L1072 K1073 A1078 K1079 P1099 E1108	E395-R1075 IonicContact OE2-NH2 3.65Å; E395-R1075 PolarHBondContact OE2-NH2 3.16Å; E395-R1075 VanDerWaalsContact OE2-NH2 3.12Å; L1071-R1075 HydrophobicContact CD1-CG 4.06Å; L1071-R1075 WeakPolarHBondContact O-CB 3.25Å; L1071-R1075 WeakPolarHBondContact O-CG 3.27Å; L1071-R1075 PolarHBondContact O-N 3.04Å; L1072-R1075 PolarHBondContact O-N 2.98Å; K1073-R1075 PolarHBondContact O-N 3.42Å; R1075-A1078 PolarHBondContact O-N 3.13Å; R1075-K1079 WeakPolarHBondContact O-CB 3.19Å; R1075-K1079 PolarHBondContact O-N 3.02Å; R1075-P1099 HydrophobicContact CG-CG 4Å; R1075-E1108 IonicContact CZ-OE1 3.7Å; R1075-E1108 VanDerWaalsContact CZ-OE1 3.22Å; R1075-E1108 IonicContact NH1-OE1 3.64Å; R1075-E1108 PolarHBondContact NH1-OE1 3.45Å; R1075-E1108 IonicContact NH2-OE1 2.89Å; R1075-E1108 PolarHBondContact NH2-OE1 3.31Å
1076	E	93.7	Very high	93.7	Very high	72 Å²	72	45 Å²	45	34%	0.336	22%	0.218	S	C	.	.	H	α-helix	trans	-61.3	-45.3	174.7	-165.2	-165.4	146.7	0	0	111	L1072 K1073 K1079 K1080	L1072-E1076 WeakPolarHBondContact O-CB 3.25Å; L1072-E1076 PolarHBondContact O-N 3.04Å; K1073-E1076 IonicContact NZ-OE2 3.23Å; K1073-E1076 PolarHBondContact NZ-OE2 3.45Å; K1073-E1076 PolarHBondContact O-N 2.97Å; E1076-K1079 PolarHBondContact O-N 3.37Å; E1076-K1080 WeakPolarHBondContact O-CG 3.36Å; E1076-K1080 PolarHBondContact O-N 3.31Å; E1076-K1080 VanDerWaalsContact O-N 3.08Å; E1076-K1080 IonicContact OE1-NZ 3.99Å; E1076-K1080 PolarHBondContact OE1-NZ 2.86Å
1077	L	93.6	Very high	93.7	Very high	26 Å²	26	49.7 Å²	49.7	14%	0.136	24%	0.238	C	C	.	.	H	α-helix	trans	-62.7	-49.2	176.4	179.6	59.6	0	0	0	111.5	F905 K936 I937 A940 K1073 A1074 K1079 K1080 I1081	F905-L1077 HydrophobicContact CE1-CD2 4.16Å; F905-L1077 HydrophobicContact CE1-CG 4.37Å; F905-L1077 HydrophobicContact CZ-CD2 3.88Å; K936-L1077 HydrophobicContact CB-CD1 4.32Å; I937-L1077 HydrophobicContact CG1-CD2 4.32Å; A940-L1077 HydrophobicContact CB-CD2 3.92Å; K1073-L1077 WeakPolarHBondContact O-CB 3.35Å; K1073-L1077 PolarHBondContact O-N 3.29Å; A1074-L1077 PolarHBondContact O-N 3.37Å; L1077-K1079 VanDerWaalsContact C-N 3.31Å; L1077-K1079 PolarHBondContact O-N 2.92Å; L1077-K1080 WeakPolarHBondContact O-CB 3.46Å; L1077-K1080 PolarHBondContact O-N 3.4Å; L1077-K1080 VanDerWaalsContact O-N 3.16Å; L1077-I1081 HydrophobicContact CD1-CD1 4.16Å; L1077-I1081 HydrophobicContact CD1-CG1 4.46Å; L1077-I1081 HydrophobicContact CG-CD1 3.94Å; L1077-I1081 WeakPolarHBondContact O-CG1 3.42Å; L1077-I1081 PolarHBondContact O-N 2.63Å
1078	A	95.3	Very high	93.5	Very high	1 Å²	1	49.8 Å²	49.8	1%	0.008	24%	0.239	C	C	.	.	H	α-helix	trans	-62.3	-35.9	178.7	0	0	0	0	0	112.7	F905 A1074 R1075 I1081 T1082 P1099	F905-A1078 HydrophobicContact CD1-CB 4.31Å; F905-A1078 HydrophobicContact CE1-CB 4.32Å; A1074-A1078 WeakPolarHBondContact O-CB 3.48Å; A1074-A1078 PolarHBondContact O-N 3.01Å; R1075-A1078 PolarHBondContact O-N 3.13Å; A1078-I1081 PolarHBondContact O-N 3.16Å; A1078-T1082 WeakPolarHBondContact O-CB 3.03Å; A1078-T1082 PolarHBondContact O-N 3.35Å; A1078-T1082 PolarHBondContact O-OG1 3.16Å; A1078-P1099 HydrophobicContact CB-CG 4.15Å
1079	K	95	Very high	93.3	Very high	164 Å²	164	53.1 Å²	53.1	71%	0.713	26%	0.261	S	S	*	.	H	α-helix	trans	-66.2	-41.3	174.2	-172.4	178.7	-179.1	-179.3	0	112	R1075 E1076 L1077 T1082 S1083	R1075-K1079 WeakPolarHBondContact O-CB 3.19Å; R1075-K1079 PolarHBondContact O-N 3.02Å; E1076-K1079 PolarHBondContact O-N 3.37Å; L1077-K1079 VanDerWaalsContact C-N 3.31Å; L1077-K1079 PolarHBondContact O-N 2.92Å; K1079-T1082 PolarHBondContact O-N 3.04Å; K1079-S1083 WeakPolarHBondContact O-CB 3.39Å; K1079-S1083 PolarHBondContact O-N 3.04Å
1080	K	93.4	Very high	92.9	Very high	114 Å²	114	55.2 Å²	55.2	50%	0.496	29%	0.286	S	S	.	.	H	α-helix	trans	-62.8	-46	174.3	-76.1	170.1	171.7	165.8	0	111.1	E1076 L1077 S1083 D1084	E1076-K1080 WeakPolarHBondContact O-CG 3.36Å; E1076-K1080 PolarHBondContact O-N 3.31Å; E1076-K1080 VanDerWaalsContact O-N 3.08Å; E1076-K1080 IonicContact OE1-NZ 3.99Å; E1076-K1080 PolarHBondContact OE1-NZ 2.86Å; L1077-K1080 WeakPolarHBondContact O-CB 3.46Å; L1077-K1080 PolarHBondContact O-N 3.4Å; L1077-K1080 VanDerWaalsContact O-N 3.16Å; K1080-S1083 PolarHBondContact O-N 2.86Å; K1080-D1084 PolarHBondContact O-N 3.06Å
1081	I	94.3	Very high	92.7	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-56.9	-52.2	174.7	-69.3	165.9	0	0	0	110.4	F905 M933 K936 I937 L1077 A1078 S1083 D1084 M1085 V1097	F905-I1081 HydrophobicContact CD1-CD1 4.5Å; M933-I1081 HydrophobicContact CB-CG2 4.07Å; M933-I1081 HydrophobicContact CG-CD1 4.3Å; M933-I1081 HydrophobicContact CG-CG2 3.71Å; M933-I1081 HydrophobicContact SD-CG2 4.02Å; K936-I1081 HydrophobicContact CB-CG1 4.28Å; K936-I1081 HydrophobicContact CD-CG1 3.86Å; I937-I1081 HydrophobicContact CD1-CD1 4.35Å; I937-I1081 HydrophobicContact CG1-CD1 3.99Å; L1077-I1081 HydrophobicContact CD1-CD1 4.16Å; L1077-I1081 HydrophobicContact CD1-CG1 4.46Å; L1077-I1081 HydrophobicContact CG-CD1 3.94Å; L1077-I1081 WeakPolarHBondContact O-CG1 3.42Å; L1077-I1081 PolarHBondContact O-N 2.63Å; A1078-I1081 PolarHBondContact O-N 3.16Å; I1081-S1083 VanDerWaalsContact C-N 3.34Å; I1081-S1083 PolarHBondContact O-N 2.83Å; I1081-D1084 PolarHBondContact O-N 2.83Å; I1081-M1085 HydrophobicContact CG2-CG 4.29Å; I1081-M1085 HydrophobicContact CG2-SD 3.58Å; I1081-M1085 VanDerWaalsContact CG2-SD 3.58Å; I1081-M1085 WeakPolarHBondContact O-CG 3.36Å; I1081-M1085 PolarHBondContact O-N 3.06Å; I1081-V1097 HydrophobicContact CG2-CB 4.32Å; I1081-V1097 HydrophobicContact CG2-CG1 4.4Å; I1081-V1097 HydrophobicContact CG2-CG2 4.04Å
1082	T	94.9	Very high	92.6	Very high	12 Å²	12	58.1 Å²	58.1	7%	0.074	31%	0.305	C	S	.	.	H	α-helix	trans	-56.6	-46.3	178.9	-60.7	0	0	0	0	112.2	A1078 K1079 D1084 M1085 R1086 F1095 E1096 V1097	A1078-T1082 WeakPolarHBondContact O-CB 3.03Å; A1078-T1082 PolarHBondContact O-N 3.35Å; A1078-T1082 PolarHBondContact O-OG1 3.16Å; K1079-T1082 PolarHBondContact O-N 3.04Å; T1082-D1084 VanDerWaalsContact C-N 3.26Å; T1082-D1084 PolarHBondContact O-N 2.79Å; T1082-M1085 PolarHBondContact O-N 3.16Å; T1082-R1086 HydrophobicContact CG2-CG 4.41Å; T1082-R1086 WeakPolarHBondContact O-CB 2.97Å; T1082-R1086 VanDerWaalsContact O-CG 3.3Å; T1082-R1086 WeakPolarHBondContact O-CG 3.22Å; T1082-R1086 PolarHBondContact O-N 3.19Å; T1082-F1095 WeakPolarHBondContact CG2-O 3.05Å; T1082-E1096 HydrophobicContact CG2-CB 4.12Å; T1082-V1097 WeakPolarHBondContact OG1-CB 3.39Å; T1082-V1097 PolarHBondContact OG1-N 2.95Å; T1082-V1097 PolarHBondContact OG1-O 3.19Å
1083	S	93.6	Very high	92.3	Very high	66 Å²	66	58.8 Å²	58.8	46%	0.462	32%	0.315	S	S	.	.	H	α-helix	trans	-63.6	-31.5	-178.4	-174.9	0	0	0	0	113.2	K1079 K1080 I1081	K1079-S1083 WeakPolarHBondContact O-CB 3.39Å; K1079-S1083 PolarHBondContact O-N 3.04Å; K1080-S1083 PolarHBondContact O-N 2.86Å; I1081-S1083 VanDerWaalsContact C-N 3.34Å; I1081-S1083 PolarHBondContact O-N 2.83Å
1084	D	91.9	Very high	92.2	Very high	55 Å²	55	61.7 Å²	61.7	29%	0.294	33%	0.334	S	S	.	.	H	α-helix	trans	-83.4	-40.7	178.8	-71.8	-26	0	0	0	111.4	K936 K1080 I1081 T1082 R1086 K1087	K936-D1084 VanDerWaalsContact CE-OD2 3.22Å; K936-D1084 WeakPolarHBondContact CE-OD2 3.19Å; K936-D1084 VanDerWaalsContact NZ-CB 3.3Å; K936-D1084 IonicContact NZ-OD2 3.29Å; K936-D1084 PolarHBondContact NZ-OD2 3.35Å; K1080-D1084 PolarHBondContact O-N 3.06Å; I1081-D1084 PolarHBondContact O-N 2.83Å; T1082-D1084 VanDerWaalsContact C-N 3.26Å; T1082-D1084 PolarHBondContact O-N 2.79Å; D1084-R1086 VanDerWaalsContact C-N 3.27Å; D1084-R1086 PolarHBondContact O-N 3.42Å; D1084-K1087 WeakPolarHBondContact O-CB 3.27Å; D1084-K1087 PolarHBondContact O-N 2.74Å; D1084-K1087 IonicContact OD1-NZ 3.03Å; D1084-K1087 PolarHBondContact OD1-NZ 3.21Å
1085	M	92.4	Very high	92.1	Very high	5 Å²	5	61.5 Å²	61.5	3%	0.025	33%	0.332	C	S	.	.	H	α-helix	trans	-63.1	-32.8	175.5	-69	179.4	76.4	0	0	112.5	Y911 V922 M933 I1081 T1082 K1087 I1088 T1091 F1095 V1097	Y911-M1085 HydrophobicContact CD1-CE 3.99Å; Y911-M1085 HydrophobicContact CD2-CB 4.43Å; Y911-M1085 HydrophobicContact CD2-CE 3.74Å; Y911-M1085 HydrophobicContact CE1-CE 3.75Å; Y911-M1085 HydrophobicContact CE2-CB 4.04Å; Y911-M1085 HydrophobicContact CE2-CE 3.49Å; Y911-M1085 VanDerWaalsContact CE2-CE 3.49Å; Y911-M1085 HydrophobicContact CE2-CG 4.42Å; Y911-M1085 HydrophobicContact CG-CE 3.96Å; Y911-M1085 VanDerWaalsContact CZ-CE 3.48Å; V922-M1085 HydrophobicContact CG2-CE 3.66Å; M933-M1085 HydrophobicContact CB-SD 4.31Å; M933-M1085 HydrophobicContact SD-CE 4.48Å; M933-M1085 HydrophobicContact SD-SD 3.99Å; I1081-M1085 HydrophobicContact CG2-CG 4.29Å; I1081-M1085 HydrophobicContact CG2-SD 3.58Å; I1081-M1085 VanDerWaalsContact CG2-SD 3.58Å; I1081-M1085 WeakPolarHBondContact O-CG 3.36Å; I1081-M1085 PolarHBondContact O-N 3.06Å; T1082-M1085 PolarHBondContact O-N 3.16Å; M1085-K1087 PolarHBondContact O-N 3.22Å; M1085-I1088 WeakPolarHBondContact O-CB 3.37Å; M1085-I1088 PolarHBondContact O-N 2.04Å; M1085-I1088 VanDerWaalsContact O-N 3.12Å; M1085-T1091 PolarHBondContact O-OG1 3.47Å; M1085-F1095 HydrophobicContact CB-CD1 4.35Å; M1085-F1095 HydrophobicContact CB-CE1 3.7Å; M1085-F1095 HydrophobicContact CE-CE1 3.82Å; M1085-F1095 HydrophobicContact CE-CZ 3.64Å; M1085-F1095 HydrophobicContact CG-CE1 4.43Å; M1085-F1095 HydrophobicContact SD-CE1 3.91Å; M1085-F1095 HydrophobicContact SD-CZ 4.09Å; M1085-V1097 HydrophobicContact SD-CG2 3.87Å
1086	R	93.4	Very high	92	Very high	112 Å²	112	62.6 Å²	62.6	42%	0.423	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-17.2	173.7	-77.5	178.9	-175.7	-170.4	-1.3	114.3	T1082 D1084 I1088 P1093 F1095	T1082-R1086 HydrophobicContact CG2-CG 4.41Å; T1082-R1086 WeakPolarHBondContact O-CB 2.97Å; T1082-R1086 VanDerWaalsContact O-CG 3.3Å; T1082-R1086 WeakPolarHBondContact O-CG 3.22Å; T1082-R1086 PolarHBondContact O-N 3.19Å; D1084-R1086 VanDerWaalsContact C-N 3.27Å; D1084-R1086 PolarHBondContact O-N 3.42Å; R1086-I1088 VanDerWaalsContact C-N 3.25Å; R1086-P1093 PolarHBondContact NE-O 3.06Å; R1086-P1093 PolarHBondContact NH1-O 3.05Å; R1086-P1093 PolarHBondContact NH2-O 3.3Å; R1086-F1095 HydrophobicContact CG-CD1 4.43Å; R1086-F1095 PolarHBondContact NE-O 2.91Å; R1086-F1095 PolarHBondContact NH2-O 3.49Å
1087	K	91.7	Very high	92.1	Very high	148 Å²	148	59.3 Å²	59.3	64%	0.643	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-15.9	175.8	-62.3	169.8	-175.4	162	0	111.9	D1084 M1085	D1084-K1087 WeakPolarHBondContact O-CB 3.27Å; D1084-K1087 PolarHBondContact O-N 2.74Å; D1084-K1087 IonicContact OD1-NZ 3.03Å; D1084-K1087 PolarHBondContact OD1-NZ 3.21Å; M1085-K1087 PolarHBondContact O-N 3.22Å
1088	I	89.5	Confident	92.2	Very high	23 Å²	23	58 Å²	58	12%	0.118	32%	0.317	C	S	.	.	S	Bend	trans	-73.7	127.7	-178.2	-60.7	173.9	0	0	0	109.2	Y911 E917 M1085 R1086 G1090 T1091	Y911-I1088 HydrophobicContact CE2-CB 4.47Å; Y911-I1088 HydrophobicContact CE2-CD1 3.92Å; Y911-I1088 WeakPolarHBondContact OH-CD1 3.4Å; E917-I1088 HydrophobicContact CB-CG2 4.08Å; M1085-I1088 WeakPolarHBondContact O-CB 3.37Å; M1085-I1088 PolarHBondContact O-N 2.04Å; M1085-I1088 VanDerWaalsContact O-N 3.12Å; R1086-I1088 VanDerWaalsContact C-N 3.25Å; I1088-G1090 PolarHBondContact O-N 3.4Å; I1088-T1091 WeakPolarHBondContact O-CB 3.48Å; I1088-T1091 PolarHBondContact O-N 2.86Å; I1088-T1091 PolarHBondContact O-OG1 3.13Å
1089	P	88.9	Confident	92.3	Very high	91 Å²	91	58 Å²	58	59%	0.591	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.1	137.1	179.6	-26.9	34.2	0	0	0	113.1	E917 T1091	E917-P1089 VanDerWaalsContact OE2-CD 3.31Å; E917-P1089 WeakPolarHBondContact OE2-CD 3.46Å; E917-P1089 WeakPolarHBondContact OE2-CG 3.37Å; P1089-T1091 VanDerWaalsContact C-N 3.31Å; P1089-T1091 PolarHBondContact O-N 2.9Å
1090	G	83.8	Confident	92.3	Very high	73 Å²	73	50.4 Å²	50.4	75%	0.753	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	83	-0.6	179.1	0	0	0	0	0	115.4	I1088	I1088-G1090 PolarHBondContact O-N 3.4Å
1091	T	90.3	Very high	92.3	Very high	23 Å²	23	45.1 Å²	45.1	14%	0.141	26%	0.261	C	S	.	.			trans	-78.8	134	173.5	-53.4	0	0	0	0	111.2	G910 Y911 M1085 I1088 P1089 F1095	G910-T1091 WeakPolarHBondContact O-CA 3.39Å; Y911-T1091 HydrophobicContact CD2-CG2 3.88Å; M1085-T1091 PolarHBondContact O-OG1 3.47Å; I1088-T1091 WeakPolarHBondContact O-CB 3.48Å; I1088-T1091 PolarHBondContact O-N 2.86Å; I1088-T1091 PolarHBondContact O-OG1 3.13Å; P1089-T1091 VanDerWaalsContact C-N 3.31Å; P1089-T1091 PolarHBondContact O-N 2.9Å; T1091-F1095 HydrophobicContact CG2-CB 3.68Å; T1091-F1095 HydrophobicContact CG2-CD1 3.75Å; T1091-F1095 HydrophobicContact CG2-CG 3.81Å
1092	S	91.2	Very high	92.1	Very high	39 Å²	39	47.7 Å²	47.7	27%	0.273	27%	0.274	S	S	.	.			trans	-65	142.3	176.1	176.9	0	0	0	0	111.7	G910 D1094 F1095	G910-S1092 PolarHBondContact O-N 3.48Å; S1092-D1094 PolarHBondContact O-N 3.05Å; S1092-D1094 PolarHBondContact OG-N 2.89Å; S1092-F1095 WeakPolarHBondContact O-CB 3.35Å; S1092-F1095 PolarHBondContact O-N 2.95Å
1093	P	88.9	Confident	91.9	Very high	100 Å²	100	47.8 Å²	47.8	65%	0.649	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-24.2	172.5	25.9	-35.1	0	0	0	113.3	R1086 F1095	R1086-P1093 PolarHBondContact NE-O 3.06Å; R1086-P1093 PolarHBondContact NH1-O 3.05Å; R1086-P1093 PolarHBondContact NH2-O 3.3Å; P1093-F1095 VanDerWaalsContact C-N 3.32Å
1094	D	89.6	Confident	91.9	Very high	134 Å²	134	44.9 Å²	44.9	72%	0.717	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84	-6.4	178.7	-61.2	-35.7	0	0	0	113	S1092 E1096	S1092-D1094 PolarHBondContact O-N 3.05Å; S1092-D1094 PolarHBondContact OG-N 2.89Å; D1094-E1096 PolarHBondContact O-N 3.36Å
1095	F	92.9	Very high	91.9	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	24%	0.241	C	C	.	.			trans	-60.8	132.1	178.1	173.2	-107.1	0	0	0	110.9	T907 K908 Y911 T1082 M1085 R1086 T1091 S1092 P1093 V1097	T907-F1095 HydrophobicContact CG2-CZ 4.37Å; K908-F1095 WeakPolarHBondContact O-CD2 3.33Å; K908-F1095 VanDerWaalsContact O-CE2 3.3Å; K908-F1095 WeakPolarHBondContact O-CE2 3.5Å; Y911-F1095 HydrophobicContact CD2-CD1 4.41Å; Y911-F1095 HydrophobicContact CD2-CE1 4.07Å; Y911-F1095 HydrophobicContact CD2-CZ 4.13Å; Y911-F1095 HydrophobicContact CG-CE1 4.45Å; Y911-F1095 HydrophobicContact CG-CE2 4.15Å; Y911-F1095 HydrophobicContact CG-CZ 4.05Å; T1082-F1095 WeakPolarHBondContact CG2-O 3.05Å; M1085-F1095 HydrophobicContact CB-CD1 4.35Å; M1085-F1095 HydrophobicContact CB-CE1 3.7Å; M1085-F1095 HydrophobicContact CE-CE1 3.82Å; M1085-F1095 HydrophobicContact CE-CZ 3.64Å; M1085-F1095 HydrophobicContact CG-CE1 4.43Å; M1085-F1095 HydrophobicContact SD-CE1 3.91Å; M1085-F1095 HydrophobicContact SD-CZ 4.09Å; R1086-F1095 HydrophobicContact CG-CD1 4.43Å; R1086-F1095 PolarHBondContact NE-O 2.91Å; R1086-F1095 PolarHBondContact NH2-O 3.49Å; T1091-F1095 HydrophobicContact CG2-CB 3.68Å; T1091-F1095 HydrophobicContact CG2-CD1 3.75Å; T1091-F1095 HydrophobicContact CG2-CG 3.81Å; S1092-F1095 WeakPolarHBondContact O-CB 3.35Å; S1092-F1095 PolarHBondContact O-N 2.95Å; P1093-F1095 VanDerWaalsContact C-N 3.32Å; F1095-V1097 HydrophobicContact CE1-CG2 3.86Å; F1095-V1097 HydrophobicContact CZ-CG2 3.65Å
1096	E	94.2	Very high	91.8	Very high	57 Å²	57	44.7 Å²	44.7	27%	0.266	25%	0.25	S	S	.	.			trans	-144.3	150.5	173.3	62.5	175	-176.4	0	0	112.9	K908 T1082 D1094	K908-E1096 HydrophobicContact CD-CG 3.63Å; K908-E1096 WeakPolarHBondContact CD-OE1 3.29Å; K908-E1096 WeakPolarHBondContact CE-OE1 3.42Å; K908-E1096 HydrophobicContact CG-CG 4Å; K908-E1096 PolarHBondContact N-O 2.81Å; K908-E1096 IonicContact NZ-OE1 2.79Å; K908-E1096 PolarHBondContact NZ-OE1 3.35Å; T1082-E1096 HydrophobicContact CG2-CB 4.12Å; D1094-E1096 PolarHBondContact O-N 3.36Å
1097	V	95.6	Very high	91.8	Very high	2 Å²	2	39.8 Å²	39.8	1%	0.012	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	129.3	168.9	-173.4	0	0	0	0	108	F905 V906 T907 M933 I1081 T1082 M1085 F1095	F905-V1097 HydrophobicContact CB-CG1 4.22Å; V906-V1097 VanDerWaalsContact O-CA 3.29Å; V906-V1097 WeakPolarHBondContact O-CA 3.35Å; T907-V1097 HydrophobicContact CG2-CG1 4.33Å; T907-V1097 HydrophobicContact CG2-CG2 3.89Å; M933-V1097 HydrophobicContact CE-CG1 3.85Å; I1081-V1097 HydrophobicContact CG2-CB 4.32Å; I1081-V1097 HydrophobicContact CG2-CG1 4.4Å; I1081-V1097 HydrophobicContact CG2-CG2 4.04Å; T1082-V1097 WeakPolarHBondContact OG1-CB 3.39Å; T1082-V1097 PolarHBondContact OG1-N 2.95Å; T1082-V1097 PolarHBondContact OG1-O 3.19Å; M1085-V1097 HydrophobicContact SD-CG2 3.87Å; F1095-V1097 HydrophobicContact CE1-CG2 3.86Å; F1095-V1097 HydrophobicContact CZ-CG2 3.65Å
1098	F	96.1	Very high	91.8	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	145.5	176.4	65.1	-90.5	0	0	0	111.2	E395 F398 V906 K908	E395-F1098 HydrophobicContact CB-CD2 3.62Å; E395-F1098 HydrophobicContact CB-CE2 3.62Å; E395-F1098 HydrophobicContact CB-CG 4.45Å; E395-F1098 HydrophobicContact CB-CZ 4.44Å; E395-F1098 HydrophobicContact CG-CB 4.17Å; E395-F1098 HydrophobicContact CG-CD2 3.47Å; E395-F1098 VanDerWaalsContact CG-CD2 3.47Å; E395-F1098 HydrophobicContact CG-CE2 3.91Å; E395-F1098 HydrophobicContact CG-CG 3.82Å; E395-F1098 WeakPolarHBondContact OE1-CB 3.32Å; F398-F1098 HydrophobicContact CB-CZ 4.32Å; F398-F1098 AromaticContact CD1-CE1 3.89Å; F398-F1098 HydrophobicContact CD1-CE1 3.89Å; F398-F1098 AromaticContact CD1-CZ 3.6Å; F398-F1098 HydrophobicContact CD1-CZ 3.6Å; F398-F1098 HydrophobicContact CE1-CE1 4.23Å; F398-F1098 HydrophobicContact CE1-CZ 4.28Å; F398-F1098 HydrophobicContact CG-CE1 4.42Å; F398-F1098 HydrophobicContact CG-CZ 4.2Å; V906-F1098 HydrophobicContact CB-CD1 4.43Å; V906-F1098 HydrophobicContact CB-CD2 4.36Å; V906-F1098 HydrophobicContact CB-CE1 3.96Å; V906-F1098 HydrophobicContact CB-CE2 3.89Å; V906-F1098 HydrophobicContact CB-CZ 3.68Å; V906-F1098 HydrophobicContact CG1-CE1 3.87Å; V906-F1098 HydrophobicContact CG1-CE2 4.35Å; V906-F1098 HydrophobicContact CG1-CZ 3.66Å; V906-F1098 HydrophobicContact CG2-CE2 4.17Å; V906-F1098 HydrophobicContact CG2-CZ 4.29Å; V906-F1098 PolarHBondContact N-O 3.37Å; V906-F1098 PolarHBondContact O-N 3.42Å; K908-F1098 HydrophobicContact CD-CE1 4.36Å; K908-F1098 HydrophobicContact CG-CD1 4.29Å; K908-F1098 HydrophobicContact CG-CE1 3.9Å
1099	P	96.2	Very high	91.8	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	125.2	176	35.6	-30	0	0	0	109.2	V903 Y904 F905 A1074 R1075 A1078 Y1104	V903-P1099 HydrophobicContact CG2-CB 3.94Å; Y904-P1099 CarbonylContact O-C 3.57Å; Y904-P1099 WeakPolarHBondContact O-CA 3.33Å; F905-P1099 HydrophobicContact CD1-CB 4.26Å; F905-P1099 HydrophobicContact CE1-CB 4.11Å; A1074-P1099 HydrophobicContact CB-CB 3.94Å; A1074-P1099 HydrophobicContact CB-CG 3.93Å; R1075-P1099 HydrophobicContact CG-CG 4Å; A1078-P1099 HydrophobicContact CB-CG 4.15Å; P1099-Y1104 HydrophobicContact CB-CE2 3.94Å; P1099-Y1104 HydrophobicContact CG-CE2 3.97Å; P1099-Y1104 WeakPolarHBondContact O-CD2 3.45Å; P1099-Y1104 WeakPolarHBondContact O-CE2 3.43Å
1100	Y	95.2	Very high	91.9	Very high	5 Å²	5	30.6 Å²	30.6	2%	0.02	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	131.8	175.4	172.4	-106.9	0	0	0	110.6	K396 H399 Y904	K396-Y1100 HydrophobicContact CB-CE2 3.87Å; K396-Y1100 HydrophobicContact CG-CE2 4.07Å; H399-Y1100 HydrophobicContact CB-CD1 4.12Å; H399-Y1100 HydrophobicContact CB-CD2 4.32Å; H399-Y1100 HydrophobicContact CB-CE1 4.2Å; H399-Y1100 HydrophobicContact CB-CE2 4.42Å; H399-Y1100 HydrophobicContact CB-CG 4.17Å; H399-Y1100 AromaticContact CD2-CD1 3.42Å; H399-Y1100 VanDerWaalsContact CD2-CD1 3.42Å; H399-Y1100 WeakPolarHBondContact CD2-CD1 3.32Å; H399-Y1100 AromaticContact CD2-CE1 3.67Å; H399-Y1100 AromaticContact CE1-CE1 3.56Å; H399-Y1100 AromaticContact CG-CD1 3.55Å; H399-Y1100 AromaticContact CG-CE1 3.48Å; H399-Y1100 VanDerWaalsContact CG-CE1 3.48Å; H399-Y1100 AromaticContact CG-CZ 4Å; H399-Y1100 AromaticContact ND1-CD1 3.96Å; H399-Y1100 AromaticContact ND1-CE1 3.39Å; H399-Y1100 WeakPolarHBondContact ND1-CE1 3.38Å; H399-Y1100 AromaticContact ND1-CZ 3.81Å; H399-Y1100 AromaticContact NE2-CD1 3.79Å; H399-Y1100 AromaticContact NE2-CE1 3.72Å; Y904-Y1100 HydrophobicContact CD2-CD1 4.03Å; Y904-Y1100 PolarHBondContact N-O 2.84Å; Y904-Y1100 PolarHBondContact O-N 3.2Å
1101	T	94.1	Very high	92.3	Very high	3 Å²	3	30 Å²	30	2%	0.018	16%	0.161	C	C	.	.			trans	-150.2	158.8	163.8	-174.4	0	0	0	0	108.4	P902 T1103 Y1104	P902-T1101 VanDerWaalsContact O-CB 3.27Å; P902-T1101 WeakPolarHBondContact O-CB 3.37Å; P902-T1101 PolarHBondContact O-OG1 2.84Å; T1101-T1103 WeakPolarHBondContact CG2-OG1 3.4Å; T1101-T1103 PolarHBondContact O-N 3.45Å; T1101-Y1104 HydrophobicContact CG2-CD1 3.11Å; T1101-Y1104 HydrophobicContact CG2-CD2 3.69Å; T1101-Y1104 HydrophobicContact CG2-CE1 3.16Å; T1101-Y1104 HydrophobicContact CG2-CE2 3.74Å; T1101-Y1104 HydrophobicContact CG2-CG 3.37Å; T1101-Y1104 VanDerWaalsContact CG2-CZ 3.47Å; T1101-Y1104 PolarHBondContact O-N 3.46Å
1102	I	89.4	Confident	92.2	Very high	54 Å²	54	31.7 Å²	31.7	28%	0.277	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-27.1	-175	-166.7	165.6	0	0	0	112.9	F406 V1105	F406-I1102 HydrophobicContact CD1-CD1 4.24Å; I1102-V1105 WeakPolarHBondContact O-CG2 3.35Å
1103	T	91.4	Very high	92.1	Very high	13 Å²	13	29.9 Å²	29.9	8%	0.08	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-23.5	-176.4	59.9	0	0	0	0	113.3	V901 F1067 T1101 V1105 F1106 Y1107	V901-T1103 HydrophobicContact CG1-CG2 4.32Å; V901-T1103 HydrophobicContact CG2-CG2 4.41Å; F1067-T1103 HydrophobicContact CD1-CG2 4.33Å; F1067-T1103 HydrophobicContact CE1-CG2 4.03Å; T1101-T1103 WeakPolarHBondContact CG2-OG1 3.4Å; T1101-T1103 PolarHBondContact O-N 3.45Å; T1103-V1105 VanDerWaalsContact C-N 3.3Å; T1103-V1105 PolarHBondContact O-N 3.31Å; T1103-F1106 PolarHBondContact O-N 3.46Å; T1103-Y1107 VanDerWaalsContact O-CD2 3.29Å; T1103-Y1107 WeakPolarHBondContact O-CD2 3.42Å; T1103-Y1107 PolarHBondContact O-N 3.22Å
1104	Y	93.8	Very high	92.2	Very high	5 Å²	5	28.3 Å²	28.3	2%	0.02	15%	0.147	C	C	.	.	H	α-helix	trans	-63.7	-32.3	-171.5	-73.4	-3.8	0	0	0	114.1	H1058 L1071 A1074 P1099 T1101 F1106 Y1107 E1108	H1058-Y1104 AromaticContact NE2-CZ 3.87Å; H1058-Y1104 PolarHBondContact NE2-OH 2.97Å; L1071-Y1104 HydrophobicContact CB-CD1 3.86Å; L1071-Y1104 HydrophobicContact CB-CE1 3.73Å; L1071-Y1104 HydrophobicContact CD1-CD1 3.65Å; L1071-Y1104 HydrophobicContact CD1-CD2 3.46Å; L1071-Y1104 VanDerWaalsContact CD1-CD2 3.46Å; L1071-Y1104 HydrophobicContact CD1-CE1 3.91Å; L1071-Y1104 HydrophobicContact CD1-CE2 3.71Å; L1071-Y1104 HydrophobicContact CD1-CG 3.45Å; L1071-Y1104 VanDerWaalsContact CD1-CG 3.45Å; L1071-Y1104 HydrophobicContact CG-CD1 4.21Å; L1071-Y1104 HydrophobicContact CG-CE1 4.4Å; L1071-Y1104 HydrophobicContact CG-CG 4.42Å; A1074-Y1104 HydrophobicContact CB-CE2 4.49Å; A1074-Y1104 WeakPolarHBondContact CB-OH 3.46Å; P1099-Y1104 HydrophobicContact CB-CE2 3.94Å; P1099-Y1104 HydrophobicContact CG-CE2 3.97Å; P1099-Y1104 WeakPolarHBondContact O-CD2 3.45Å; P1099-Y1104 WeakPolarHBondContact O-CE2 3.43Å; T1101-Y1104 HydrophobicContact CG2-CD1 3.11Å; T1101-Y1104 HydrophobicContact CG2-CD2 3.69Å; T1101-Y1104 HydrophobicContact CG2-CE1 3.16Å; T1101-Y1104 HydrophobicContact CG2-CE2 3.74Å; T1101-Y1104 HydrophobicContact CG2-CG 3.37Å; T1101-Y1104 VanDerWaalsContact CG2-CZ 3.47Å; T1101-Y1104 PolarHBondContact O-N 3.46Å; Y1104-F1106 PolarHBondContact O-N 3.18Å; Y1104-Y1107 PolarHBondContact O-N 3.2Å; Y1104-E1108 VanDerWaalsContact O-CB 3.28Å; Y1104-E1108 WeakPolarHBondContact O-CB 3.48Å; Y1104-E1108 PolarHBondContact O-N 3.45Å
1105	V	91.6	Very high	92.1	Very high	7 Å²	7	29.7 Å²	29.7	4%	0.042	15%	0.147	C	C	.	.	H	α-helix	trans	-62.1	-28.2	176.3	-64.5	0	0	0	0	112.7	V382 S386 A392 K396 I1102 T1103	V382-V1105 HydrophobicContact CG1-CB 4.14Å; V382-V1105 HydrophobicContact CG1-CG2 3.86Å; S386-V1105 WeakPolarHBondContact CB-O 3.07Å; A392-V1105 HydrophobicContact CB-CG1 4.11Å; K396-V1105 HydrophobicContact CB-CG1 4.09Å; K396-V1105 HydrophobicContact CD-CG1 3.93Å; I1102-V1105 WeakPolarHBondContact O-CG2 3.35Å; T1103-V1105 VanDerWaalsContact C-N 3.3Å; T1103-V1105 PolarHBondContact O-N 3.31Å
1106	F	89.9	Confident	91.8	Very high	49 Å²	49	31.9 Å²	31.9	22%	0.215	16%	0.157	C	C	.	.	H	α-helix	trans	-87.8	-39.1	179.1	-59.7	-68.9	0	0	0	112.5	P381 V382 T1103 Y1104 Q1109	P381-F1106 HydrophobicContact CB-CE1 4.04Å; P381-F1106 HydrophobicContact CG-CE1 4.36Å; P381-F1106 HydrophobicContact CG-CZ 4.4Å; V382-F1106 HydrophobicContact CB-CE1 4.45Å; V382-F1106 HydrophobicContact CG2-CE1 3.9Å; V382-F1106 HydrophobicContact CG2-CE2 4.42Å; V382-F1106 HydrophobicContact CG2-CZ 3.54Å; T1103-F1106 PolarHBondContact O-N 3.46Å; Y1104-F1106 PolarHBondContact O-N 3.18Å; F1106-Q1109 WeakPolarHBondContact O-CG 3.04Å; F1106-Q1109 PolarHBondContact O-NE2 2.95Å
1107	Y	92.6	Very high	91.5	Very high	9 Å²	9	29.2 Å²	29.2	4%	0.035	15%	0.145	C	C	.	.	H	α-helix	trans	-91.1	-12.5	-173.8	-67	-80.1	0	0	0	114.3	Q876 F1067 T1103 Y1104 Q1109 Y1110	Q876-Y1107 WeakPolarHBondContact CG-OH 3.36Å; Q876-Y1107 PolarHBondContact NE2-OH 2.91Å; F1067-Y1107 HydrophobicContact CB-CD1 3.73Å; F1067-Y1107 HydrophobicContact CB-CD2 3.66Å; F1067-Y1107 HydrophobicContact CB-CE1 3.84Å; F1067-Y1107 HydrophobicContact CB-CE2 3.76Å; F1067-Y1107 HydrophobicContact CB-CG 3.67Å; F1067-Y1107 HydrophobicContact CD1-CD2 4.29Å; F1067-Y1107 AromaticContact CD1-CE2 3.97Å; F1067-Y1107 HydrophobicContact CD1-CE2 3.97Å; F1067-Y1107 HydrophobicContact CD2-CE1 4.17Å; F1067-Y1107 AromaticContact CD2-CE2 4Å; F1067-Y1107 HydrophobicContact CD2-CE2 4Å; F1067-Y1107 AromaticContact CD2-CZ 3.67Å; F1067-Y1107 HydrophobicContact CG-CD2 4.02Å; F1067-Y1107 HydrophobicContact CG-CE1 4.22Å; F1067-Y1107 AromaticContact CG-CE2 3.64Å; F1067-Y1107 HydrophobicContact CG-CE2 3.64Å; F1067-Y1107 HydrophobicContact CG-CG 4.46Å; F1067-Y1107 AromaticContact CG-CZ 3.76Å; T1103-Y1107 VanDerWaalsContact O-CD2 3.29Å; T1103-Y1107 WeakPolarHBondContact O-CD2 3.42Å; T1103-Y1107 PolarHBondContact O-N 3.22Å; Y1104-Y1107 PolarHBondContact O-N 3.2Å; Y1107-Q1109 PolarHBondContact O-N 3.19Å; Y1107-Y1110 AromaticContact CD1-CD2 3.73Å; Y1107-Y1110 HydrophobicContact CD1-CD2 3.73Å; Y1107-Y1110 AromaticContact CD1-CE2 3.68Å; Y1107-Y1110 HydrophobicContact CD1-CE2 3.68Å; Y1107-Y1110 HydrophobicContact CE1-CE2 4.2Å; Y1107-Y1110 HydrophobicContact CG-CD2 4.43Å; Y1107-Y1110 HydrophobicContact CG-CE2 4.49Å; Y1107-Y1110 PolarHBondContact O-N 3.03Å
1108	E	92.6	Very high	91.1	Very high	24 Å²	24	34.1 Å²	34.1	11%	0.112	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56	-37.6	176	172.4	168.9	-121.6	0	0	112.6	S390 R391 A392 L1071 R1075 Y1104 Y1110 L1111	S390-E1108 VanDerWaalsContact CB-OE2 3.24Å; S390-E1108 WeakPolarHBondContact CB-OE2 3.31Å; S390-E1108 PolarHBondContact OG-OE2 3.02Å; R391-E1108 WeakPolarHBondContact CB-OE1 3.21Å; A392-E1108 HydrophobicContact CB-CB 4.1Å; A392-E1108 HydrophobicContact CB-CG 4.46Å; A392-E1108 WeakPolarHBondContact CB-OE2 3.41Å; A392-E1108 PolarHBondContact N-OE1 3.11Å; A392-E1108 PolarHBondContact N-OE2 3.34Å; L1071-E1108 HydrophobicContact CD2-CB 4.18Å; R1075-E1108 IonicContact CZ-OE1 3.7Å; R1075-E1108 VanDerWaalsContact CZ-OE1 3.22Å; R1075-E1108 IonicContact NH1-OE1 3.64Å; R1075-E1108 PolarHBondContact NH1-OE1 3.45Å; R1075-E1108 IonicContact NH2-OE1 2.89Å; R1075-E1108 PolarHBondContact NH2-OE1 3.31Å; Y1104-E1108 VanDerWaalsContact O-CB 3.28Å; Y1104-E1108 WeakPolarHBondContact O-CB 3.48Å; Y1104-E1108 PolarHBondContact O-N 3.45Å; E1108-Y1110 PolarHBondContact O-N 3.35Å; E1108-Y1110 VanDerWaalsContact O-N 3.14Å; E1108-L1111 WeakPolarHBondContact O-CB 3.41Å; E1108-L1111 PolarHBondContact O-N 2.89Å; E1108-L1111 VanDerWaalsContact O-N 3.07Å
1109	Q	89.5	Confident	90.7	Very high	21 Å²	21	39.8 Å²	39.8	10%	0.098	20%	0.195	C	C	.	.	H	α-helix	trans	-56.1	-33.8	-179	70.9	-175.6	-63.8	0	0	112.7	M769 F1106 Y1107 L1111 T1112 I1113	M769-Q1109 HydrophobicContact CE-CB 3.84Å; F1106-Q1109 WeakPolarHBondContact O-CG 3.04Å; F1106-Q1109 PolarHBondContact O-NE2 2.95Å; Y1107-Q1109 PolarHBondContact O-N 3.19Å; Q1109-L1111 PolarHBondContact O-N 3.02Å; Q1109-T1112 PolarHBondContact O-N 3.27Å; Q1109-I1113 VanDerWaalsContact O-CB 3.3Å; Q1109-I1113 WeakPolarHBondContact O-CB 3.1Å; Q1109-I1113 PolarHBondContact O-N 3.33Å
1110	Y	91.4	Very high	90.2	Very high	25 Å²	25	40.1 Å²	40.1	10%	0.098	20%	0.197	C	C	.	.	H	α-helix	trans	-73	-13.5	-176.4	-58.1	-60.8	0	0	0	113.4	V872 L874 Y1107 E1108 I1113 N1169	V872-Y1110 HydrophobicContact CG1-CD1 4.09Å; L874-Y1110 VanDerWaalsContact CB-OH 3.26Å; L874-Y1110 WeakPolarHBondContact CB-OH 3.48Å; L874-Y1110 PolarHBondContact N-OH 2.03Å; Y1107-Y1110 AromaticContact CD1-CD2 3.73Å; Y1107-Y1110 HydrophobicContact CD1-CD2 3.73Å; Y1107-Y1110 AromaticContact CD1-CE2 3.68Å; Y1107-Y1110 HydrophobicContact CD1-CE2 3.68Å; Y1107-Y1110 HydrophobicContact CE1-CE2 4.2Å; Y1107-Y1110 HydrophobicContact CG-CD2 4.43Å; Y1107-Y1110 HydrophobicContact CG-CE2 4.49Å; Y1107-Y1110 PolarHBondContact O-N 3.03Å; E1108-Y1110 PolarHBondContact O-N 3.35Å; E1108-Y1110 VanDerWaalsContact O-N 3.14Å; Y1110-I1113 HydrophobicContact CD1-CD1 4.46Å; Y1110-I1113 HydrophobicContact CD1-CG2 4.31Å; Y1110-N1169 HydrophobicContact CE1-CB 3.98Å
1111	L	91	Very high	89.9	Confident	60 Å²	60	40.8 Å²	40.8	31%	0.314	20%	0.201	S	C	.	.	H	α-helix	trans	-71.3	-31.9	174.3	-62.3	176.2	0	0	0	112.5	T1068 L1071 L1072 E1108 Q1109	T1068-L1111 HydrophobicContact CG2-CD2 3.6Å; T1068-L1111 HydrophobicContact CG2-CG 4.25Å; L1071-L1111 HydrophobicContact CD2-CD1 3.81Å; L1071-L1111 HydrophobicContact CD2-CG 4.38Å; L1071-L1111 HydrophobicContact CG-CD1 4.21Å; L1072-L1111 HydrophobicContact CB-CD2 4.29Å; L1072-L1111 HydrophobicContact CD1-CD2 4.18Å; E1108-L1111 WeakPolarHBondContact O-CB 3.41Å; E1108-L1111 PolarHBondContact O-N 2.89Å; E1108-L1111 VanDerWaalsContact O-N 3.07Å; Q1109-L1111 PolarHBondContact O-N 3.02Å
1112	T	89.6	Confident	89.6	Confident	59 Å²	59	44.1 Å²	44.1	36%	0.362	22%	0.224	S	C	.	.	H	α-helix	trans	-116.6	-12.7	-175.9	58.2	0	0	0	0	113.9	Q1109 V1114 K1115 E1116	Q1109-T1112 PolarHBondContact O-N 3.27Å; T1112-V1114 VanDerWaalsContact C-N 3.27Å; T1112-V1114 PolarHBondContact O-N 3.43Å; T1112-V1114 VanDerWaalsContact O-N 3.1Å; T1112-K1115 PolarHBondContact O-N 3.12Å; T1112-E1116 WeakPolarHBondContact CB-OE1 3.42Å; T1112-E1116 PolarHBondContact O-N 3.37Å; T1112-E1116 PolarHBondContact OG1-OE1 2.78Å
1113	I	89	Confident	89.4	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-54.3	-36.9	-171.9	-162.6	169.7	0	0	0	114.4	M769 V872 Q1109 Y1110 G1117 Y1168 N1169 A1170	M769-I1113 HydrophobicContact CE-CB 4.42Å; M769-I1113 HydrophobicContact CE-CD1 4.06Å; M769-I1113 HydrophobicContact CE-CG1 3.98Å; V872-I1113 HydrophobicContact CG1-CG2 3.57Å; Q1109-I1113 VanDerWaalsContact O-CB 3.3Å; Q1109-I1113 WeakPolarHBondContact O-CB 3.1Å; Q1109-I1113 PolarHBondContact O-N 3.33Å; Y1110-I1113 HydrophobicContact CD1-CD1 4.46Å; Y1110-I1113 HydrophobicContact CD1-CG2 4.31Å; I1113-G1117 WeakPolarHBondContact O-CA 3.22Å; I1113-G1117 PolarHBondContact O-N 3.4Å; I1113-Y1168 HydrophobicContact CD1-CE1 4.48Å; I1113-Y1168 HydrophobicContact CG1-CE1 4.06Å; I1113-Y1168 HydrophobicContact CG2-CD1 4.27Å; I1113-Y1168 HydrophobicContact CG2-CE1 4.26Å; I1113-N1169 VanDerWaalsContact CD1-C 3.42Å; I1113-A1170 HydrophobicContact CD1-CB 4.44Å
1114	V	89.6	Confident	89.1	Confident	67 Å²	67	42.6 Å²	42.6	41%	0.406	22%	0.216	S	C	.	.	H	α-helix	trans	-67.1	-42.2	179.3	179.4	0	0	0	0	110.7	V872 T1112 L1118 Y1168	V872-V1114 HydrophobicContact CG1-CG2 4.44Å; V872-V1114 HydrophobicContact CG2-CG2 3.77Å; T1112-V1114 VanDerWaalsContact C-N 3.27Å; T1112-V1114 PolarHBondContact O-N 3.43Å; T1112-V1114 VanDerWaalsContact O-N 3.1Å; V1114-L1118 HydrophobicContact CG1-CD1 4.29Å; V1114-L1118 WeakPolarHBondContact O-CB 3.38Å; V1114-L1118 VanDerWaalsContact O-CG 3.27Å; V1114-L1118 WeakPolarHBondContact O-CG 3.22Å; V1114-L1118 PolarHBondContact O-N 3.04Å; V1114-Y1168 HydrophobicContact CG2-CD1 4.43Å; V1114-Y1168 HydrophobicContact CG2-CE1 4.44Å
1115	K	88.8	Confident	88.8	Confident	163 Å²	163	43.3 Å²	43.3	71%	0.709	22%	0.22	S	C	*	.	H	α-helix	trans	-69.9	-44.7	178.9	-65.1	-179.3	-177.5	175.5	0	111	T1112 F1119	T1112-K1115 PolarHBondContact O-N 3.12Å; K1115-F1119 WeakPolarHBondContact O-CB 3.11Å; K1115-F1119 PolarHBondContact O-N 3.18Å
1116	E	86.3	Confident	88.5	Confident	47 Å²	47	48 Å²	48	22%	0.22	24%	0.244	C	C	.	.	H	α-helix	trans	-65.1	-40.9	176.9	-70.8	179.5	-161.8	0	0	111.7	T768 T1112 F1119 N1120	T768-E1116 PolarHBondContact OG1-OE2 3.26Å; T768-E1116 VanDerWaalsContact OG1-OE2 3.05Å; T1112-E1116 WeakPolarHBondContact CB-OE1 3.42Å; T1112-E1116 PolarHBondContact O-N 3.37Å; T1112-E1116 PolarHBondContact OG1-OE1 2.78Å; E1116-F1119 PolarHBondContact O-N 2.91Å; E1116-N1120 WeakPolarHBondContact O-CB 3.35Å; E1116-N1120 PolarHBondContact O-N 3.49Å; E1116-N1120 PolarHBondContact O-ND2 3.35Å; E1116-N1120 VanDerWaalsContact O-ND2 3.17Å
1117	G	87	Confident	88.2	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-64.1	-46.3	177.2	0	0	0	0	0	112.7	I1113 F1119 N1120 I1121 Y1168	I1113-G1117 WeakPolarHBondContact O-CA 3.22Å; I1113-G1117 PolarHBondContact O-N 3.4Å; G1117-F1119 VanDerWaalsContact C-N 3.33Å; G1117-F1119 PolarHBondContact O-N 3.41Å; G1117-N1120 PolarHBondContact O-N 3.2Å; G1117-I1121 WeakPolarHBondContact O-CB 3.34Å; G1117-I1121 WeakPolarHBondContact O-CG1 3.26Å; G1117-I1121 PolarHBondContact O-N 2.01Å; G1117-Y1168 WeakPolarHBondContact CA-OH 3.21Å
1118	L	88.5	Confident	87.8	Confident	105 Å²	105	45.9 Å²	45.9	55%	0.55	24%	0.237	S	C	.	.	H	α-helix	trans	-60.6	-41.9	173.2	-73.8	173.1	0	0	0	111.9	V1114 S1122	V1114-L1118 HydrophobicContact CG1-CD1 4.29Å; V1114-L1118 WeakPolarHBondContact O-CB 3.38Å; V1114-L1118 VanDerWaalsContact O-CG 3.27Å; V1114-L1118 WeakPolarHBondContact O-CG 3.22Å; V1114-L1118 PolarHBondContact O-N 3.04Å; L1118-S1122 VanDerWaalsContact O-CB 3.28Å; L1118-S1122 WeakPolarHBondContact O-CB 3.49Å; L1118-S1122 PolarHBondContact O-N 3.5Å; L1118-S1122 PolarHBondContact O-OG 3.3Å
1119	F	87.8	Confident	87.5	Confident	120 Å²	120	47.1 Å²	47.1	53%	0.526	24%	0.242	S	C	.	.	H	α-helix	trans	-62.3	-47.8	175.7	179.7	-99.7	0	0	0	111.8	K1115 E1116 G1117 S1122 L1123	K1115-F1119 WeakPolarHBondContact O-CB 3.11Å; K1115-F1119 PolarHBondContact O-N 3.18Å; E1116-F1119 PolarHBondContact O-N 2.91Å; G1117-F1119 VanDerWaalsContact C-N 3.33Å; G1117-F1119 PolarHBondContact O-N 3.41Å; F1119-S1122 PolarHBondContact O-N 3.32Å; F1119-L1123 HydrophobicContact CE1-CD2 4.46Å; F1119-L1123 VanDerWaalsContact O-CB 3.28Å; F1119-L1123 WeakPolarHBondContact O-CB 2.98Å; F1119-L1123 PolarHBondContact O-N 3Å
1120	N	85.2	Confident	87.4	Confident	6 Å²	6	49.1 Å²	49.1	3%	0.032	26%	0.255	C	S	.	.	H	α-helix	trans	-64.2	-45.1	-179.8	-74.3	-30.1	0	0	0	112.3	E1116 G1117 L1123 C1124	E1116-N1120 WeakPolarHBondContact O-CB 3.35Å; E1116-N1120 PolarHBondContact O-N 3.49Å; E1116-N1120 PolarHBondContact O-ND2 3.35Å; E1116-N1120 VanDerWaalsContact O-ND2 3.17Å; G1117-N1120 PolarHBondContact O-N 3.2Å; N1120-L1123 PolarHBondContact O-N 2.81Å; N1120-C1124 PolarHBondContact O-N 2.71Å
1121	I	88.3	Confident	87.2	Confident	19 Å²	19	48.8 Å²	48.8	10%	0.097	26%	0.255	C	S	.	.	H	α-helix	trans	-63.4	-45.2	176.8	-67.7	169	0	0	0	110.3	G1117 L1123 C1124 L1125 V1154 L1173 L1176 V1180	G1117-I1121 WeakPolarHBondContact O-CB 3.34Å; G1117-I1121 WeakPolarHBondContact O-CG1 3.26Å; G1117-I1121 PolarHBondContact O-N 2.01Å; I1121-L1123 VanDerWaalsContact C-N 3.28Å; I1121-L1123 PolarHBondContact O-N 3.14Å; I1121-C1124 PolarHBondContact O-N 3.12Å; I1121-C1124 VanDerWaalsContact O-N 3.15Å; I1121-L1125 HydrophobicContact CG2-CD1 4.17Å; I1121-L1125 WeakPolarHBondContact O-CG 3.4Å; I1121-L1125 PolarHBondContact O-N 2.81Å; I1121-V1154 HydrophobicContact CG2-CG1 4.25Å; I1121-L1173 HydrophobicContact CD1-CD1 4.33Å; I1121-L1173 HydrophobicContact CG1-CD1 4.32Å; I1121-L1176 HydrophobicContact CD1-CB 4.29Å; I1121-L1176 HydrophobicContact CD1-CD1 4.43Å; I1121-V1180 HydrophobicContact CG2-CG2 4.47Å
1122	S	87.6	Confident	86.8	Confident	73 Å²	73	46 Å²	46	51%	0.51	24%	0.241	S	C	.	.	H	α-helix	trans	-60.5	-41	177.5	-57.6	0	0	0	0	111.7	L1118 F1119 C1124 L1125 L1126	L1118-S1122 VanDerWaalsContact O-CB 3.28Å; L1118-S1122 WeakPolarHBondContact O-CB 3.49Å; L1118-S1122 PolarHBondContact O-N 3.5Å; L1118-S1122 PolarHBondContact O-OG 3.3Å; F1119-S1122 PolarHBondContact O-N 3.32Å; S1122-C1124 VanDerWaalsContact C-N 3.33Å; S1122-L1125 PolarHBondContact O-N 3.4Å; S1122-L1126 PolarHBondContact O-N 2.99Å
1123	L	85.2	Confident	86.5	Confident	35 Å²	35	43.7 Å²	43.7	18%	0.183	23%	0.227	C	C	.	.	H	α-helix	trans	-66.5	-34.7	177.4	-173.3	70.4	0	0	0	112.2	L762 L766 F1119 N1120 I1121 P1127	L762-L1123 HydrophobicContact CB-CD2 3.95Å; L762-L1123 HydrophobicContact CB-CG 4.26Å; L766-L1123 HydrophobicContact CD1-CD2 3.24Å; L766-L1123 HydrophobicContact CG-CD2 4.49Å; F1119-L1123 HydrophobicContact CE1-CD2 4.46Å; F1119-L1123 VanDerWaalsContact O-CB 3.28Å; F1119-L1123 WeakPolarHBondContact O-CB 2.98Å; F1119-L1123 PolarHBondContact O-N 3Å; N1120-L1123 PolarHBondContact O-N 2.81Å; I1121-L1123 VanDerWaalsContact C-N 3.28Å; I1121-L1123 PolarHBondContact O-N 3.14Å; L1123-P1127 WeakPolarHBondContact O-CD 3.08Å
1124	C	85.3	Confident	86.2	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-71.2	-31	174.7	-98	0	0	0	0	113.6	C759 N1120 I1121 S1122 P1127 T1128 V1180	C759-C1124 VanDerWaalsContact C-SG 3.58Å; C759-C1124 HydrophobicContact CB-CB 3.97Å; C759-C1124 WeakPolarHBondContact CB-SG 3.49Å; C759-C1124 PolarHBondContact O-SG 3.07Å; C759-C1124 WeakPolarHBondContact SG-CB 3.5Å; C759-C1124 CovalentContact SG-SG 2.06Å; C759-C1124 PolarHBondContact SG-SG 3.47Å; N1120-C1124 PolarHBondContact O-N 2.71Å; I1121-C1124 PolarHBondContact O-N 3.12Å; I1121-C1124 VanDerWaalsContact O-N 3.15Å; S1122-C1124 VanDerWaalsContact C-N 3.33Å; C1124-P1127 WeakPolarHBondContact O-CD 3.01Å; C1124-T1128 WeakPolarHBondContact O-CG2 3.46Å; C1124-V1180 HydrophobicContact CB-CG1 4.37Å
1125	L	87.8	Confident	85.7	Confident	21 Å²	21	47 Å²	47	11%	0.11	24%	0.242	C	C	.	.	H	α-helix	trans	-72.9	-26.2	177.9	-70.5	170.8	0	0	0	113.4	I1121 S1122 T1128 F1129 L1147 I1150 I1151 V1180	I1121-L1125 HydrophobicContact CG2-CD1 4.17Å; I1121-L1125 WeakPolarHBondContact O-CG 3.4Å; I1121-L1125 PolarHBondContact O-N 2.81Å; S1122-L1125 PolarHBondContact O-N 3.4Å; L1125-T1128 WeakPolarHBondContact CA-OG1 3.23Å; L1125-T1128 PolarHBondContact O-OG1 3.02Å; L1125-F1129 PolarHBondContact O-N 3.49Å; L1125-F1129 VanDerWaalsContact O-N 3.17Å; L1125-L1147 HydrophobicContact CB-CD1 3.89Å; L1125-L1147 HydrophobicContact CD2-CD1 4.11Å; L1125-L1147 HydrophobicContact CG-CD1 4.44Å; L1125-I1150 HydrophobicContact CD2-CB 4.29Å; L1125-I1150 HydrophobicContact CD2-CG2 3.55Å; L1125-I1151 HydrophobicContact CD1-CD1 4.44Å; L1125-I1151 HydrophobicContact CD1-CG1 3.77Å; L1125-I1151 HydrophobicContact CD2-CG1 4.45Å; L1125-V1180 HydrophobicContact CD2-CG1 4.02Å; L1125-V1180 HydrophobicContact CD2-CG2 4.49Å
1126	L	85.8	Confident	85.1	Confident	104 Å²	104	39.5 Å²	39.5	55%	0.545	21%	0.209	S	C	.	.	H	α-helix	trans	-68	-50.7	-178.9	176.6	70.7	0	0	0	112.7	S1122 T1128 F1129 V1130	S1122-L1126 PolarHBondContact O-N 2.99Å; L1126-T1128 VanDerWaalsContact C-N 3.34Å; L1126-T1128 PolarHBondContact O-N 3.26Å; L1126-F1129 WeakPolarHBondContact O-CB 3.49Å; L1126-F1129 PolarHBondContact O-N 2.86Å; L1126-V1130 HydrophobicContact CD1-CG2 4.31Å; L1126-V1130 WeakPolarHBondContact O-CG2 3.44Å; L1126-V1130 PolarHBondContact O-N 3.49Å
1127	P	83.3	Confident	84.4	Confident	12 Å²	12	37.5 Å²	37.5	8%	0.078	20%	0.202	C	C	.	.	H	α-helix	trans	-60.9	-38.9	174.8	-20.9	27.4	0	0	0	113.3	V758 L762 L1123 C1124 F1129 V1130 V1131	V758-P1127 HydrophobicContact CB-CB 4.3Å; V758-P1127 HydrophobicContact CG1-CB 3.61Å; V758-P1127 HydrophobicContact CG1-CG 3.9Å; L762-P1127 HydrophobicContact CD1-CB 4.48Å; L762-P1127 HydrophobicContact CD1-CG 3.34Å; L1123-P1127 WeakPolarHBondContact O-CD 3.08Å; C1124-P1127 WeakPolarHBondContact O-CD 3.01Å; P1127-F1129 VanDerWaalsContact C-N 3.29Å; P1127-F1129 PolarHBondContact O-N 2.74Å; P1127-V1130 PolarHBondContact O-N 3.44Å; P1127-V1131 VanDerWaalsContact O-CB 3.27Å; P1127-V1131 WeakPolarHBondContact O-CB 3.34Å; P1127-V1131 VanDerWaalsContact O-CG2 3.23Å; P1127-V1131 WeakPolarHBondContact O-CG2 3.05Å; P1127-V1131 PolarHBondContact O-N 3.09Å
1128	T	83.8	Confident	83.8	Confident	3 Å²	3	42.4 Å²	42.4	2%	0.018	23%	0.228	C	C	.	.	H	α-helix	trans	-62.3	-41.6	178.5	57.4	0	0	0	0	110.4	C1124 L1125 L1126 C1132 V1180 V1184	C1124-T1128 WeakPolarHBondContact O-CG2 3.46Å; L1125-T1128 WeakPolarHBondContact CA-OG1 3.23Å; L1125-T1128 PolarHBondContact O-OG1 3.02Å; L1126-T1128 VanDerWaalsContact C-N 3.34Å; L1126-T1128 PolarHBondContact O-N 3.26Å; T1128-C1132 WeakPolarHBondContact O-CB 3.45Å; T1128-C1132 PolarHBondContact O-N 2.89Å; T1128-C1132 PolarHBondContact O-SG 3.34Å; T1128-V1180 HydrophobicContact CG2-CG1 4.43Å; T1128-V1184 HydrophobicContact CG2-CG2 3.74Å
1129	F	87.8	Confident	83.4	Confident	50 Å²	50	39.5 Å²	39.5	22%	0.219	21%	0.213	C	C	.	.	H	α-helix	trans	-61.8	-50.2	171.5	174.8	-103	0	0	0	112.5	L1125 L1126 P1127 C1132 C1133 L1140 L1144 L1147	L1125-F1129 PolarHBondContact O-N 3.49Å; L1125-F1129 VanDerWaalsContact O-N 3.17Å; L1126-F1129 WeakPolarHBondContact O-CB 3.49Å; L1126-F1129 PolarHBondContact O-N 2.86Å; P1127-F1129 VanDerWaalsContact C-N 3.29Å; P1127-F1129 PolarHBondContact O-N 2.74Å; F1129-C1132 PolarHBondContact O-N 3.22Å; F1129-C1133 VanDerWaalsContact CE2-SG 3.59Å; F1129-C1133 WeakPolarHBondContact O-CB 3.39Å; F1129-C1133 PolarHBondContact O-N 3.41Å; F1129-C1133 PolarHBondContact O-SG 3.42Å; F1129-L1140 HydrophobicContact CZ-CD2 4.17Å; F1129-L1144 HydrophobicContact CE2-CB 4.43Å; F1129-L1147 HydrophobicContact CB-CD2 4.31Å; F1129-L1147 HydrophobicContact CD2-CB 4.23Å; F1129-L1147 HydrophobicContact CD2-CD2 4Å; F1129-L1147 HydrophobicContact CG-CD2 4.25Å
1130	V	87.1	Confident	83.1	Confident	63 Å²	63	39.4 Å²	39.4	38%	0.382	22%	0.217	S	C	.	.	H	α-helix	trans	-62.7	-48.7	-177.5	171.5	0	0	0	0	111.5	L1126 P1127 C1133 L1134	L1126-V1130 HydrophobicContact CD1-CG2 4.31Å; L1126-V1130 WeakPolarHBondContact O-CG2 3.44Å; L1126-V1130 PolarHBondContact O-N 3.49Å; P1127-V1130 PolarHBondContact O-N 3.44Å; V1130-C1133 PolarHBondContact O-N 3.44Å; V1130-L1134 HydrophobicContact CG1-CD1 3.8Å; V1130-L1134 HydrophobicContact CG1-CG 4.38Å; V1130-L1134 WeakPolarHBondContact O-CB 3.5Å; V1130-L1134 VanDerWaalsContact O-CG 3.3Å; V1130-L1134 WeakPolarHBondContact O-CG 3.32Å; V1130-L1134 PolarHBondContact O-N 3.31Å
1131	V	85.6	Confident	83.1	Confident	17 Å²	17	44.3 Å²	44.3	10%	0.103	24%	0.235	C	C	.	.	H	α-helix	trans	-63.8	-43.7	179.5	173.8	0	0	0	0	110.4	L751 L754 P1127 C1133 L1134 L1135	L751-V1131 HydrophobicContact CG-CG1 4.4Å; L754-V1131 HydrophobicContact CD2-CG1 4.24Å; L754-V1131 HydrophobicContact CD2-CG2 4.5Å; P1127-V1131 VanDerWaalsContact O-CB 3.27Å; P1127-V1131 WeakPolarHBondContact O-CB 3.34Å; P1127-V1131 VanDerWaalsContact O-CG2 3.23Å; P1127-V1131 WeakPolarHBondContact O-CG2 3.05Å; P1127-V1131 PolarHBondContact O-N 3.09Å; V1131-C1133 PolarHBondContact O-N 3.43Å; V1131-L1134 PolarHBondContact O-N 3.02Å; V1131-L1135 HydrophobicContact CG1-CD1 3.61Å; V1131-L1135 HydrophobicContact CG1-CG 4.32Å; V1131-L1135 WeakPolarHBondContact O-CB 3.37Å; V1131-L1135 WeakPolarHBondContact O-CG 3.42Å; V1131-L1135 PolarHBondContact O-N 3.47Å
1132	C	83.1	Confident	82.9	Confident	3 Å²	3	43.4 Å²	43.4	2%	0.02	23%	0.23	C	C	.	.	H	α-helix	trans	-59.5	-47.6	174.3	-76.1	0	0	0	0	111.8	T1128 F1129 L1136	T1128-C1132 WeakPolarHBondContact O-CB 3.45Å; T1128-C1132 PolarHBondContact O-N 2.89Å; T1128-C1132 PolarHBondContact O-SG 3.34Å; F1129-C1132 PolarHBondContact O-N 3.22Å; C1132-L1136 WeakPolarHBondContact O-CB 3.4Å; C1132-L1136 VanDerWaalsContact O-CG 3.23Å; C1132-L1136 WeakPolarHBondContact O-CG 3.01Å; C1132-L1136 PolarHBondContact O-N 3.03Å
1133	C	83.6	Confident	82.9	Confident	9 Å²	9	39.9 Å²	39.9	6%	0.061	21%	0.206	C	C	.	.	H	α-helix	trans	-63.1	-43.9	179.9	-78.7	0	0	0	0	112.2	F1129 V1130 V1131 G1137 L1138	F1129-C1133 VanDerWaalsContact CE2-SG 3.59Å; F1129-C1133 WeakPolarHBondContact O-CB 3.39Å; F1129-C1133 PolarHBondContact O-N 3.41Å; F1129-C1133 PolarHBondContact O-SG 3.42Å; V1130-C1133 PolarHBondContact O-N 3.44Å; V1131-C1133 PolarHBondContact O-N 3.43Å; C1133-G1137 PolarHBondContact O-N 3.34Å; C1133-L1138 VanDerWaalsContact O-CA 3.25Å; C1133-L1138 WeakPolarHBondContact O-CA 3.43Å; C1133-L1138 PolarHBondContact O-N 2.87Å
1134	L	82.9	Confident	83.1	Confident	106 Å²	106	42.6 Å²	42.6	56%	0.555	22%	0.22	S	C	*	.	H	α-helix	trans	-66.4	-48.5	-180	-70.2	173.8	0	0	0	111.6	V1130 V1131 G1137 L1138	V1130-L1134 HydrophobicContact CG1-CD1 3.8Å; V1130-L1134 HydrophobicContact CG1-CG 4.38Å; V1130-L1134 WeakPolarHBondContact O-CB 3.5Å; V1130-L1134 VanDerWaalsContact O-CG 3.3Å; V1130-L1134 WeakPolarHBondContact O-CG 3.32Å; V1130-L1134 PolarHBondContact O-N 3.31Å; V1131-L1134 PolarHBondContact O-N 3.02Å; L1134-G1137 PolarHBondContact O-N 3.35Å; L1134-L1138 HydrophobicContact CD2-CD2 4.05Å
1135	L	79.4	Confident	83.3	Confident	31 Å²	31	43.1 Å²	43.1	16%	0.162	22%	0.223	C	C	.	.	H	α-helix	trans	-77.1	-24.8	-174.8	-66.4	177.8	0	0	0	113.7	M339 L751 V1131 G1137	M339-L1135 HydrophobicContact CE-CD2 4.28Å; M339-L1135 HydrophobicContact SD-CD2 3.69Å; L751-L1135 HydrophobicContact CB-CD1 3.6Å; L751-L1135 HydrophobicContact CD1-CB 4.02Å; L751-L1135 HydrophobicContact CD1-CD1 4.44Å; L751-L1135 HydrophobicContact CG-CB 4.43Å; L751-L1135 HydrophobicContact CG-CD1 3.96Å; V1131-L1135 HydrophobicContact CG1-CD1 3.61Å; V1131-L1135 HydrophobicContact CG1-CG 4.32Å; V1131-L1135 WeakPolarHBondContact O-CB 3.37Å; V1131-L1135 WeakPolarHBondContact O-CG 3.42Å; V1131-L1135 PolarHBondContact O-N 3.47Å; L1135-G1137 PolarHBondContact O-N 3.05Å
1136	L	75.4	Confident	83.4	Confident	5 Å²	5	42.2 Å²	42.2	3%	0.026	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.5	3.8	170.3	-63.6	173.1	0	0	0	113.1	S332 L751 C1132 T1191 R1192	S332-L1136 PolarHBondContact OG-O 3.34Å; L751-L1136 HydrophobicContact CD1-CG 4.31Å; C1132-L1136 WeakPolarHBondContact O-CB 3.4Å; C1132-L1136 VanDerWaalsContact O-CG 3.23Å; C1132-L1136 WeakPolarHBondContact O-CG 3.01Å; C1132-L1136 PolarHBondContact O-N 3.03Å; L1136-T1191 HydrophobicContact CD1-CG2 4.41Å; L1136-R1192 HydrophobicContact CD2-CB 3.79Å; L1136-R1192 HydrophobicContact CD2-CG 3.82Å
1137	G	72.6	Confident	83.7	Confident	6 Å²	6	39.2 Å²	39.2	6%	0.062	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	83.8	46.3	173.3	0	0	0	0	0	114.3	S332 C1133 L1134 L1135 D1139	S332-G1137 VanDerWaalsContact CB-O 3.26Å; S332-G1137 WeakPolarHBondContact CB-O 3.4Å; C1133-G1137 PolarHBondContact O-N 3.34Å; L1134-G1137 PolarHBondContact O-N 3.35Å; L1135-G1137 PolarHBondContact O-N 3.05Å; G1137-D1139 VanDerWaalsContact C-N 3.26Å; G1137-D1139 PolarHBondContact O-N 3.45Å
1138	L	74.8	Confident	84.1	Confident	103 Å²	103	42.1 Å²	42.1	54%	0.539	22%	0.216	S	C	.	.	S	Bend	trans	62.7	23.6	179.4	-59.9	169.6	0	0	0	115	C1133 L1134 L1140	C1133-L1138 VanDerWaalsContact O-CA 3.25Å; C1133-L1138 WeakPolarHBondContact O-CA 3.43Å; C1133-L1138 PolarHBondContact O-N 2.87Å; L1134-L1138 HydrophobicContact CD2-CD2 4.05Å; L1138-L1140 PolarHBondContact O-N 3.48Å
1139	D	79.5	Confident	84.6	Confident	44 Å²	44	42 Å²	42	24%	0.235	22%	0.215	C	C	.	.			trans	-78.5	87.6	171.3	-173.7	10	0	0	0	111.2	G1137 R1141 S1142 G1143 P1272	G1137-D1139 VanDerWaalsContact C-N 3.26Å; G1137-D1139 PolarHBondContact O-N 3.45Å; D1139-R1141 PolarHBondContact O-N 2.87Å; D1139-R1141 WeakPolarHBondContact OD1-CB 3.19Å; D1139-R1141 PolarHBondContact OD1-N 3.32Å; D1139-R1141 VanDerWaalsContact OD1-N 3.11Å; D1139-S1142 PolarHBondContact O-N 2.61Å; D1139-S1142 PolarHBondContact OD1-N 2.83Å; D1139-S1142 VanDerWaalsContact OD2-CB 3.27Å; D1139-S1142 WeakPolarHBondContact OD2-CB 3.48Å; D1139-S1142 PolarHBondContact OD2-OG 3.38Å; D1139-G1143 PolarHBondContact O-N 3.22Å; D1139-P1272 WeakPolarHBondContact OD2-CB 3.37Å
1140	L	81.7	Confident	84.9	Confident	117 Å²	117	39.7 Å²	39.7	61%	0.613	21%	0.206	S	C	*	.	H	α-helix	trans	-55.7	-29.6	176	-70.3	167.4	0	0	0	112.7	F1129 L1138 L1144	F1129-L1140 HydrophobicContact CZ-CD2 4.17Å; L1138-L1140 PolarHBondContact O-N 3.48Å; L1140-L1144 VanDerWaalsContact O-CB 3.27Å; L1140-L1144 WeakPolarHBondContact O-CB 3.43Å; L1140-L1144 PolarHBondContact O-N 3.33Å
1141	R	85.1	Confident	85.2	Confident	109 Å²	109	40 Å²	40	41%	0.411	21%	0.205	S	C	.	.	H	α-helix	trans	-72.7	-45.3	-177.1	-171.1	173.7	178.1	146.5	9.7	111.2	D1139 L1144 L1145 F1270	D1139-R1141 PolarHBondContact O-N 2.87Å; D1139-R1141 WeakPolarHBondContact OD1-CB 3.19Å; D1139-R1141 PolarHBondContact OD1-N 3.32Å; D1139-R1141 VanDerWaalsContact OD1-N 3.11Å; R1141-L1144 PolarHBondContact O-N 3.02Å; R1141-L1145 VanDerWaalsContact O-CG 3.31Å; R1141-L1145 WeakPolarHBondContact O-CG 3.31Å; R1141-L1145 PolarHBondContact O-N 2.78Å; R1141-F1270 PolarHBondContact NE-O 2.97Å; R1141-F1270 PolarHBondContact NH2-O 3.28Å
1142	S	84.7	Confident	85.6	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-65	-41.6	175.9	-68.1	0	0	0	0	111.8	D1139 L1144 L1145 N1146 P1272	D1139-S1142 PolarHBondContact O-N 2.61Å; D1139-S1142 PolarHBondContact OD1-N 2.83Å; D1139-S1142 VanDerWaalsContact OD2-CB 3.27Å; D1139-S1142 WeakPolarHBondContact OD2-CB 3.48Å; D1139-S1142 PolarHBondContact OD2-OG 3.38Å; S1142-L1144 PolarHBondContact O-N 3.29Å; S1142-L1145 PolarHBondContact O-N 3.39Å; S1142-N1146 VanDerWaalsContact O-CG 3.32Å; S1142-N1146 PolarHBondContact O-N 3.08Å; S1142-N1146 PolarHBondContact O-OD1 3.1Å; S1142-P1272 WeakPolarHBondContact OG-CG 3.44Å
1143	G	86.3	Confident	86.2	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-60.7	-43	174.6	0	0	0	0	0	113.2	D1139 N1146 L1147	D1139-G1143 PolarHBondContact O-N 3.22Å; G1143-N1146 PolarHBondContact O-N 2.59Å; G1143-L1147 WeakPolarHBondContact O-CB 3.47Å; G1143-L1147 PolarHBondContact O-N 3.31Å
1144	L	89.2	Confident	86.7	Confident	91 Å²	91	39.7 Å²	39.7	48%	0.476	20%	0.202	S	C	.	.	H	α-helix	trans	-68.4	-36.9	178.9	-172.8	130.4	0	0	0	112.5	F1129 L1140 R1141 S1142 L1147 I1148	F1129-L1144 HydrophobicContact CE2-CB 4.43Å; L1140-L1144 VanDerWaalsContact O-CB 3.27Å; L1140-L1144 WeakPolarHBondContact O-CB 3.43Å; L1140-L1144 PolarHBondContact O-N 3.33Å; R1141-L1144 PolarHBondContact O-N 3.02Å; S1142-L1144 PolarHBondContact O-N 3.29Å; L1144-L1147 PolarHBondContact O-N 3.43Å; L1144-I1148 HydrophobicContact CD2-CD1 3.55Å; L1144-I1148 HydrophobicContact CD2-CG1 4.49Å; L1144-I1148 HydrophobicContact CG-CD1 4.2Å; L1144-I1148 VanDerWaalsContact O-CG1 3.3Å; L1144-I1148 WeakPolarHBondContact O-CG1 3.27Å; L1144-I1148 PolarHBondContact O-N 3.38Å
1145	L	90.7	Very high	87.2	Confident	11 Å²	11	35.7 Å²	35.7	6%	0.058	18%	0.181	C	C	.	.	H	α-helix	trans	-64.1	-43.8	173.6	-68.8	174.8	0	0	0	111.4	R1141 S1142 L1147 I1148 T1149 L1266 L1267 F1270	R1141-L1145 VanDerWaalsContact O-CG 3.31Å; R1141-L1145 WeakPolarHBondContact O-CG 3.31Å; R1141-L1145 PolarHBondContact O-N 2.78Å; S1142-L1145 PolarHBondContact O-N 3.39Å; L1145-L1147 VanDerWaalsContact C-N 3.35Å; L1145-L1147 PolarHBondContact O-N 2.84Å; L1145-I1148 PolarHBondContact O-N 2.92Å; L1145-T1149 PolarHBondContact O-N 2.77Å; L1145-T1149 PolarHBondContact O-OG1 3.3Å; L1145-T1149 VanDerWaalsContact O-OG1 3.11Å; L1145-L1266 HydrophobicContact CD2-CD2 3.85Å; L1145-L1266 HydrophobicContact CD2-CG 4.03Å; L1145-L1267 HydrophobicContact CD1-CD2 3.88Å; L1145-F1270 HydrophobicContact CD2-CB 4.09Å
1146	N	89.8	Confident	88	Confident	3 Å²	3	34.3 Å²	34.3	2%	0.016	17%	0.174	C	C	.	.	H	α-helix	trans	-59.7	-47.6	175.5	-70.3	-3.5	0	0	0	111.3	S1142 G1143 I1148 T1149 I1150 V1187 T1191	S1142-N1146 VanDerWaalsContact O-CG 3.32Å; S1142-N1146 PolarHBondContact O-N 3.08Å; S1142-N1146 PolarHBondContact O-OD1 3.1Å; G1143-N1146 PolarHBondContact O-N 2.59Å; N1146-I1148 PolarHBondContact O-N 3.09Å; N1146-T1149 PolarHBondContact O-N 3.04Å; N1146-I1150 VanDerWaalsContact O-CG1 3.27Å; N1146-I1150 WeakPolarHBondContact O-CG1 3.39Å; N1146-I1150 PolarHBondContact O-N 3.5Å; N1146-V1187 HydrophobicContact CB-CG1 3.69Å; N1146-V1187 VanDerWaalsContact OD1-CG1 3.27Å; N1146-V1187 WeakPolarHBondContact OD1-CG1 3.5Å; N1146-T1191 WeakPolarHBondContact OD1-CB 3.39Å; N1146-T1191 WeakPolarHBondContact OD1-CG2 3.47Å; N1146-T1191 PolarHBondContact OD1-OG1 2.89Å
1147	L	91.6	Very high	88.9	Confident	40 Å²	40	34 Å²	34	21%	0.209	17%	0.173	C	C	.	.	H	α-helix	trans	-59	-46.4	179.2	178.9	62.8	0	0	0	111.9	L1125 F1129 G1143 L1144 L1145 T1149 I1150 I1151	L1125-L1147 HydrophobicContact CB-CD1 3.89Å; L1125-L1147 HydrophobicContact CD2-CD1 4.11Å; L1125-L1147 HydrophobicContact CG-CD1 4.44Å; F1129-L1147 HydrophobicContact CB-CD2 4.31Å; F1129-L1147 HydrophobicContact CD2-CB 4.23Å; F1129-L1147 HydrophobicContact CD2-CD2 4Å; F1129-L1147 HydrophobicContact CG-CD2 4.25Å; G1143-L1147 WeakPolarHBondContact O-CB 3.47Å; G1143-L1147 PolarHBondContact O-N 3.31Å; L1144-L1147 PolarHBondContact O-N 3.43Å; L1145-L1147 VanDerWaalsContact C-N 3.35Å; L1145-L1147 PolarHBondContact O-N 2.84Å; L1147-T1149 PolarHBondContact O-N 2.71Å; L1147-I1150 PolarHBondContact O-N 2.92Å; L1147-I1151 HydrophobicContact CD1-CD1 4Å; L1147-I1151 HydrophobicContact CD1-CG1 4.33Å; L1147-I1151 HydrophobicContact CG-CD1 3.88Å; L1147-I1151 VanDerWaalsContact O-CG1 3.27Å; L1147-I1151 WeakPolarHBondContact O-CG1 3.3Å; L1147-I1151 PolarHBondContact O-N 3.25Å
1148	I	92.2	Very high	89.9	Confident	73 Å²	73	34.3 Å²	34.3	37%	0.374	17%	0.173	S	C	.	.	H	α-helix	trans	-60.8	-45.4	177.7	-71.4	168.8	0	0	0	110.8	L1144 L1145 N1146 I1150 I1151 M1152	L1144-I1148 HydrophobicContact CD2-CD1 3.55Å; L1144-I1148 HydrophobicContact CD2-CG1 4.49Å; L1144-I1148 HydrophobicContact CG-CD1 4.2Å; L1144-I1148 VanDerWaalsContact O-CG1 3.3Å; L1144-I1148 WeakPolarHBondContact O-CG1 3.27Å; L1144-I1148 PolarHBondContact O-N 3.38Å; L1145-I1148 PolarHBondContact O-N 2.92Å; N1146-I1148 PolarHBondContact O-N 3.09Å; I1148-I1150 PolarHBondContact O-N 3.05Å; I1148-I1151 PolarHBondContact O-N 3.2Å; I1148-M1152 HydrophobicContact CG2-CG 4.46Å; I1148-M1152 HydrophobicContact CG2-SD 4.1Å; I1148-M1152 VanDerWaalsContact O-CG 3.32Å; I1148-M1152 WeakPolarHBondContact O-CG 3.43Å; I1148-M1152 PolarHBondContact O-N 3.29Å
1149	T	93	Very high	90.8	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-63.3	-41.8	179.2	-57.9	0	0	0	0	111.7	L1145 N1146 L1147 M1152 I1153 V1187 H1258 F1262	L1145-T1149 PolarHBondContact O-N 2.77Å; L1145-T1149 PolarHBondContact O-OG1 3.3Å; L1145-T1149 VanDerWaalsContact O-OG1 3.11Å; N1146-T1149 PolarHBondContact O-N 3.04Å; L1147-T1149 PolarHBondContact O-N 2.71Å; T1149-M1152 PolarHBondContact O-N 3.46Å; T1149-I1153 HydrophobicContact CG2-CD1 4.25Å; T1149-I1153 WeakPolarHBondContact O-CG1 3.48Å; T1149-I1153 PolarHBondContact O-N 2.83Å; T1149-V1187 HydrophobicContact CG2-CG2 3.76Å; T1149-H1258 HydrophobicContact CG2-CB 4.05Å; T1149-F1262 HydrophobicContact CG2-CD1 4.28Å
1150	I	93.7	Very high	91.5	Very high	3 Å²	3	29.2 Å²	29.2	2%	0.015	15%	0.148	C	C	.	.	H	α-helix	trans	-65.1	-42.1	176.6	-62.5	164	0	0	0	110.8	L1125 N1146 L1147 I1148 M1152 I1153 V1154 V1180 V1184 V1187	L1125-I1150 HydrophobicContact CD2-CB 4.29Å; L1125-I1150 HydrophobicContact CD2-CG2 3.55Å; N1146-I1150 VanDerWaalsContact O-CG1 3.27Å; N1146-I1150 WeakPolarHBondContact O-CG1 3.39Å; N1146-I1150 PolarHBondContact O-N 3.5Å; L1147-I1150 PolarHBondContact O-N 2.92Å; I1148-I1150 PolarHBondContact O-N 3.05Å; I1150-M1152 VanDerWaalsContact C-N 3.31Å; I1150-M1152 PolarHBondContact O-N 3.36Å; I1150-I1153 PolarHBondContact O-N 3.05Å; I1150-V1154 WeakPolarHBondContact O-CG2 3.49Å; I1150-V1154 PolarHBondContact O-N 3.31Å; I1150-V1180 HydrophobicContact CG2-CG1 4.2Å; I1150-V1184 HydrophobicContact CD1-CG2 3.88Å; I1150-V1187 HydrophobicContact CG1-CG2 4.4Å
1151	I	94	Very high	92.1	Very high	70 Å²	70	23.7 Å²	23.7	36%	0.359	12%	0.119	S	C	.	.	H	α-helix	trans	-59.1	-44	174.7	-70.9	166.8	0	0	0	110.6	L1125 L1147 I1148 I1153 V1154 V1155	L1125-I1151 HydrophobicContact CD1-CD1 4.44Å; L1125-I1151 HydrophobicContact CD1-CG1 3.77Å; L1125-I1151 HydrophobicContact CD2-CG1 4.45Å; L1147-I1151 HydrophobicContact CD1-CD1 4Å; L1147-I1151 HydrophobicContact CD1-CG1 4.33Å; L1147-I1151 HydrophobicContact CG-CD1 3.88Å; L1147-I1151 VanDerWaalsContact O-CG1 3.27Å; L1147-I1151 WeakPolarHBondContact O-CG1 3.3Å; L1147-I1151 PolarHBondContact O-N 3.25Å; I1148-I1151 PolarHBondContact O-N 3.2Å; I1151-I1153 PolarHBondContact O-N 3.48Å; I1151-V1154 PolarHBondContact O-N 2.76Å; I1151-V1155 HydrophobicContact CG2-CG2 4.21Å; I1151-V1155 WeakPolarHBondContact O-CB 3.32Å; I1151-V1155 VanDerWaalsContact O-CG2 3.24Å; I1151-V1155 WeakPolarHBondContact O-CG2 3.39Å; I1151-V1155 PolarHBondContact O-N 2.95Å
1152	M	94.6	Very high	92.4	Very high	12 Å²	12	20 Å²	20	6%	0.059	11%	0.108	C	C	.	.	H	α-helix	trans	-61.1	-43.8	176.7	-70	177.5	71	0	0	111.9	F856 L860 I1148 T1149 I1150 V1154 V1155 D1156 F1262	F856-M1152 HydrophobicContact CB-CE 4.33Å; L860-M1152 HydrophobicContact CB-CE 4.29Å; L860-M1152 HydrophobicContact CD1-CG 4.14Å; L860-M1152 HydrophobicContact CD2-CE 4.27Å; L860-M1152 HydrophobicContact CD2-CG 4.26Å; I1148-M1152 HydrophobicContact CG2-CG 4.46Å; I1148-M1152 HydrophobicContact CG2-SD 4.1Å; I1148-M1152 VanDerWaalsContact O-CG 3.32Å; I1148-M1152 WeakPolarHBondContact O-CG 3.43Å; I1148-M1152 PolarHBondContact O-N 3.29Å; T1149-M1152 PolarHBondContact O-N 3.46Å; I1150-M1152 VanDerWaalsContact C-N 3.31Å; I1150-M1152 PolarHBondContact O-N 3.36Å; M1152-V1154 PolarHBondContact O-N 3.35Å; M1152-V1155 PolarHBondContact O-N 3.33Å; M1152-D1156 WeakPolarHBondContact O-CB 3.37Å; M1152-D1156 VanDerWaalsContact O-CG 3.24Å; M1152-D1156 PolarHBondContact O-N 3Å; M1152-F1262 HydrophobicContact CE-CE1 3.9Å; M1152-F1262 HydrophobicContact CE-CE2 4.21Å; M1152-F1262 HydrophobicContact CE-CZ 3.69Å; M1152-F1262 HydrophobicContact SD-CD1 4.44Å; M1152-F1262 HydrophobicContact SD-CE1 3.46Å; M1152-F1262 WeakPolarHBondContact SD-CE1 3.4Å; M1152-F1262 HydrophobicContact SD-CZ 3.57Å; M1152-F1262 VanDerWaalsContact SD-CZ 3.57Å
1153	I	95	Very high	92.8	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-59.6	-46.1	177	-65.7	161.9	0	0	0	111.1	T1149 I1150 I1151 D1156 T1157 S1183 V1187 L1254 H1258	T1149-I1153 HydrophobicContact CG2-CD1 4.25Å; T1149-I1153 WeakPolarHBondContact O-CG1 3.48Å; T1149-I1153 PolarHBondContact O-N 2.83Å; I1150-I1153 PolarHBondContact O-N 3.05Å; I1151-I1153 PolarHBondContact O-N 3.48Å; I1153-D1156 PolarHBondContact O-N 2.99Å; I1153-T1157 WeakPolarHBondContact O-CB 3.26Å; I1153-T1157 PolarHBondContact O-N 3.05Å; I1153-T1157 PolarHBondContact O-OG1 3.06Å; I1153-S1183 WeakPolarHBondContact CG2-OG 3.43Å; I1153-V1187 HydrophobicContact CD1-CG2 4.32Å; I1153-L1254 HydrophobicContact CG2-CB 4.48Å; I1153-H1258 HydrophobicContact CD1-CB 3.69Å; I1153-H1258 HydrophobicContact CG1-CB 3.44Å; I1153-H1258 VanDerWaalsContact CG1-CB 3.44Å; I1153-H1258 VanDerWaalsContact CG1-CG 3.47Å
1154	V	93.8	Very high	93.1	Very high	10 Å²	10	30.2 Å²	30.2	6%	0.061	16%	0.155	C	C	.	.	H	α-helix	trans	-65.3	-45.5	-179.8	175.2	0	0	0	0	111	I1121 I1150 I1151 M1152 D1156 T1157 V1158 V1180	I1121-V1154 HydrophobicContact CG2-CG1 4.25Å; I1150-V1154 WeakPolarHBondContact O-CG2 3.49Å; I1150-V1154 PolarHBondContact O-N 3.31Å; I1151-V1154 PolarHBondContact O-N 2.76Å; M1152-V1154 PolarHBondContact O-N 3.35Å; V1154-D1156 PolarHBondContact O-N 3.38Å; V1154-T1157 WeakPolarHBondContact O-CB 3.12Å; V1154-T1157 PolarHBondContact O-N 3.28Å; V1154-V1158 WeakPolarHBondContact O-CG2 3.47Å; V1154-V1158 PolarHBondContact O-N 3.16Å; V1154-V1180 HydrophobicContact CG2-CG2 3.69Å
1155	V	94.6	Very high	93.1	Very high	22 Å²	22	30.4 Å²	30.4	13%	0.133	16%	0.164	C	C	.	.	H	α-helix	trans	-61.8	-44.7	178.2	171.8	0	0	0	0	111.1	L860 I864 M867 I1151 M1152 T1157 V1158 G1159	L860-V1155 HydrophobicContact CD1-CB 4.15Å; L860-V1155 HydrophobicContact CD1-CG1 3.8Å; I864-V1155 HydrophobicContact CG1-CG1 3.78Å; M867-V1155 HydrophobicContact CE-CB 4.04Å; M867-V1155 HydrophobicContact CE-CG1 3.89Å; M867-V1155 HydrophobicContact CE-CG2 3.98Å; I1151-V1155 HydrophobicContact CG2-CG2 4.21Å; I1151-V1155 WeakPolarHBondContact O-CB 3.32Å; I1151-V1155 VanDerWaalsContact O-CG2 3.24Å; I1151-V1155 WeakPolarHBondContact O-CG2 3.39Å; I1151-V1155 PolarHBondContact O-N 2.95Å; M1152-V1155 PolarHBondContact O-N 3.33Å; V1155-T1157 VanDerWaalsContact C-N 3.33Å; V1155-T1157 PolarHBondContact O-N 2.04Å; V1155-V1158 PolarHBondContact O-N 3.33Å; V1155-G1159 PolarHBondContact O-N 3.17Å
1156	D	95.3	Very high	93.1	Very high	1 Å²	1	30 Å²	30	1%	0.005	16%	0.162	C	C	.	.	H	α-helix	trans	-65.3	-37.2	177.4	-71.2	-24.7	0	0	0	112.1	S863 M1152 I1153 V1154 V1158 G1159 V1160 L1254 H1258	S863-D1156 WeakPolarHBondContact CB-OD1 3.39Å; S863-D1156 WeakPolarHBondContact OG-CA 3.39Å; S863-D1156 PolarHBondContact OG-OD1 3.08Å; M1152-D1156 WeakPolarHBondContact O-CB 3.37Å; M1152-D1156 VanDerWaalsContact O-CG 3.24Å; M1152-D1156 PolarHBondContact O-N 3Å; I1153-D1156 PolarHBondContact O-N 2.99Å; V1154-D1156 PolarHBondContact O-N 3.38Å; D1156-V1158 PolarHBondContact O-N 3.32Å; D1156-G1159 PolarHBondContact O-N 2.76Å; D1156-V1160 WeakPolarHBondContact O-CG2 3.39Å; D1156-V1160 PolarHBondContact O-N 3.17Å; D1156-L1254 HydrophobicContact CB-CD1 3.86Å; D1156-L1254 HydrophobicContact CB-CD2 4.39Å; D1156-H1258 IonicContact OD2-CD2 2.89Å; D1156-H1258 IonicContact OD2-CE1 2.61Å; D1156-H1258 PolarHBondContact OD2-CE1 3.3Å; D1156-H1258 VanDerWaalsContact OD2-CE1 3.25Å; D1156-H1258 IonicContact OD2-NE2 3.49Å; D1156-H1258 PolarHBondContact OD2-NE2 3.22Å
1157	T	94.6	Very high	93.2	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-60.3	-47.8	175.2	-58.3	0	0	0	0	110.5	I1153 V1154 V1155 G1159 V1160 M1161 L1176 L1247 V1250 I1251	I1153-T1157 WeakPolarHBondContact O-CB 3.26Å; I1153-T1157 PolarHBondContact O-N 3.05Å; I1153-T1157 PolarHBondContact O-OG1 3.06Å; V1154-T1157 WeakPolarHBondContact O-CB 3.12Å; V1154-T1157 PolarHBondContact O-N 3.28Å; V1155-T1157 VanDerWaalsContact C-N 3.33Å; V1155-T1157 PolarHBondContact O-N 2.04Å; T1157-G1159 VanDerWaalsContact C-N 3.34Å; T1157-G1159 PolarHBondContact O-N 3.23Å; T1157-V1160 PolarHBondContact O-N 2.74Å; T1157-M1161 VanDerWaalsContact O-CG 3.29Å; T1157-M1161 WeakPolarHBondContact O-CG 3.46Å; T1157-M1161 PolarHBondContact O-N 3.19Å; T1157-L1176 HydrophobicContact CG2-CD2 3.8Å; T1157-L1247 HydrophobicContact CG2-CD1 3.87Å; T1157-V1250 HydrophobicContact CG2-CG1 4.22Å; T1157-I1251 HydrophobicContact CG2-CG1 3.79Å
1158	V	94.1	Very high	93.2	Very high	12 Å²	12	29.8 Å²	29.8	7%	0.073	16%	0.16	C	C	.	.	H	α-helix	trans	-66.8	-34.7	177.2	179.9	0	0	0	0	112	M867 V1154 V1155 D1156 M1161 T1162 L1176	M867-V1158 HydrophobicContact CB-CG1 4.06Å; M867-V1158 HydrophobicContact CE-CB 3.68Å; M867-V1158 HydrophobicContact CE-CG1 3.86Å; M867-V1158 HydrophobicContact CE-CG2 4.17Å; M867-V1158 HydrophobicContact CG-CG1 3.74Å; V1154-V1158 WeakPolarHBondContact O-CG2 3.47Å; V1154-V1158 PolarHBondContact O-N 3.16Å; V1155-V1158 PolarHBondContact O-N 3.33Å; D1156-V1158 PolarHBondContact O-N 3.32Å; V1158-M1161 HydrophobicContact CG2-SD 4.29Å; V1158-M1161 WeakPolarHBondContact O-CB 3.3Å; V1158-M1161 PolarHBondContact O-N 3.12Å; V1158-T1162 PolarHBondContact O-N 3.26Å; V1158-T1162 PolarHBondContact O-OG1 2.9Å; V1158-L1176 HydrophobicContact CG2-CD1 3.96Å; V1158-L1176 HydrophobicContact CG2-CD2 3.84Å
1159	G	94	Very high	93.2	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-60.8	-47.1	172.5	0	0	0	0	0	112.3	V1155 D1156 T1157 T1162 L1163	V1155-G1159 PolarHBondContact O-N 3.17Å; D1156-G1159 PolarHBondContact O-N 2.76Å; T1157-G1159 VanDerWaalsContact C-N 3.34Å; T1157-G1159 PolarHBondContact O-N 3.23Å; G1159-T1162 WeakPolarHBondContact O-CB 3.42Å; G1159-T1162 PolarHBondContact O-N 2.96Å; G1159-L1163 PolarHBondContact O-N 2.84Å
1160	V	94	Very high	92.8	Very high	39 Å²	39	26.5 Å²	26.5	24%	0.236	14%	0.143	C	C	.	.	H	α-helix	trans	-69.1	-32.3	177.6	175.9	0	0	0	0	112.2	D1156 T1157 T1162 L1163 W1164 V1250 L1254	D1156-V1160 WeakPolarHBondContact O-CG2 3.39Å; D1156-V1160 PolarHBondContact O-N 3.17Å; T1157-V1160 PolarHBondContact O-N 2.74Å; V1160-T1162 PolarHBondContact O-N 3.35Å; V1160-L1163 PolarHBondContact O-N 3.08Å; V1160-W1164 PolarHBondContact O-N 3.15Å; V1160-V1250 HydrophobicContact CB-CG1 3.89Å; V1160-V1250 HydrophobicContact CG1-CB 4.4Å; V1160-V1250 HydrophobicContact CG1-CG1 3.76Å; V1160-V1250 HydrophobicContact CG1-CG2 3.64Å; V1160-V1250 HydrophobicContact CG2-CG1 4.46Å; V1160-L1254 HydrophobicContact CG2-CD1 4.37Å
1161	M	93.6	Very high	92.5	Very high	1 Å²	1	26.7 Å²	26.7	1%	0.005	15%	0.145	C	C	.	.	H	α-helix	trans	-53.2	-40.9	171.7	-75.7	169.9	64.1	0	0	111.4	T1157 V1158 W1164 S1165 I1166 Y1168 A1172 L1176 L1247	T1157-M1161 VanDerWaalsContact O-CG 3.29Å; T1157-M1161 WeakPolarHBondContact O-CG 3.46Å; T1157-M1161 PolarHBondContact O-N 3.19Å; V1158-M1161 HydrophobicContact CG2-SD 4.29Å; V1158-M1161 WeakPolarHBondContact O-CB 3.3Å; V1158-M1161 PolarHBondContact O-N 3.12Å; M1161-W1164 PolarHBondContact O-N 2.95Å; M1161-S1165 PolarHBondContact O-N 3Å; M1161-S1165 VanDerWaalsContact O-N 3.17Å; M1161-I1166 HydrophobicContact CB-CB 4.08Å; M1161-I1166 HydrophobicContact CE-CG2 4.09Å; M1161-I1166 HydrophobicContact CG-CB 4.23Å; M1161-I1166 HydrophobicContact CG-CD1 4.42Å; M1161-I1166 HydrophobicContact CG-CG2 4.39Å; M1161-I1166 PolarHBondContact O-N 3.5Å; M1161-Y1168 HydrophobicContact CE-CD2 4.28Å; M1161-A1172 HydrophobicContact CE-CB 3.8Å; M1161-L1176 HydrophobicContact SD-CD1 4.25Å; M1161-L1176 HydrophobicContact SD-CD2 4.07Å; M1161-L1176 HydrophobicContact SD-CG 4.39Å; M1161-L1247 HydrophobicContact CG-CD1 3.55Å; M1161-L1247 HydrophobicContact SD-CD1 3.8Å
1162	T	92	Very high	92.4	Very high	32 Å²	32	23.4 Å²	23.4	20%	0.196	13%	0.128	C	C	.	.	H	α-helix	trans	-68.2	-39.3	177.4	-53.1	0	0	0	0	112	L866 N869 V1158 G1159 V1160 W1164 S1165	L866-T1162 HydrophobicContact CD2-CG2 4.48Å; L866-T1162 PolarHBondContact O-OG1 2.84Å; L866-T1162 VanDerWaalsContact O-OG1 3.11Å; N869-T1162 HydrophobicContact CB-CG2 4.2Å; V1158-T1162 PolarHBondContact O-N 3.26Å; V1158-T1162 PolarHBondContact O-OG1 2.9Å; G1159-T1162 WeakPolarHBondContact O-CB 3.42Å; G1159-T1162 PolarHBondContact O-N 2.96Å; V1160-T1162 PolarHBondContact O-N 3.35Å; T1162-W1164 VanDerWaalsContact C-N 3.3Å; T1162-W1164 PolarHBondContact O-N 3.23Å; T1162-S1165 PolarHBondContact O-N 3.49Å
1163	L	92	Very high	92.1	Very high	116 Å²	116	22.9 Å²	22.9	61%	0.607	13%	0.125	S	C	*	.	H	α-helix	trans	-66.6	-31.9	177.4	-68.3	174.1	0	0	0	113	L866 G1159 V1160	L866-L1163 HydrophobicContact CD1-CD1 3.76Å; L866-L1163 HydrophobicContact CD1-CD2 3.87Å; L866-L1163 HydrophobicContact CD1-CG 3.69Å; L866-L1163 HydrophobicContact CD2-CD2 3.78Å; L866-L1163 HydrophobicContact CD2-CG 4.24Å; L866-L1163 HydrophobicContact CG-CD2 4.49Å; G1159-L1163 PolarHBondContact O-N 2.84Å; V1160-L1163 PolarHBondContact O-N 3.08Å
1164	W	92.9	Very high	91.7	Very high	99 Å²	99	23.5 Å²	23.5	38%	0.375	13%	0.128	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.6	13.7	-178.5	-143.2	-8.9	0	0	0	113.9	V1160 M1161 T1162 I1166 R1246 L1249 V1250	V1160-W1164 PolarHBondContact O-N 3.15Å; M1161-W1164 PolarHBondContact O-N 2.95Å; T1162-W1164 VanDerWaalsContact C-N 3.3Å; T1162-W1164 PolarHBondContact O-N 3.23Å; W1164-I1166 HydrophobicContact CB-CD1 4.42Å; W1164-I1166 HydrophobicContact CB-CG1 4.35Å; W1164-I1166 PolarHBondContact O-N 2.93Å; W1164-R1246 HydrophobicContact CD2-CB 4.23Å; W1164-R1246 HydrophobicContact CD2-CG 4.16Å; W1164-R1246 HydrophobicContact CE3-CB 3.85Å; W1164-R1246 HydrophobicContact CE3-CG 4.19Å; W1164-R1246 HydrophobicContact CH2-CB 4.23Å; W1164-R1246 HydrophobicContact CH2-CG 4Å; W1164-R1246 HydrophobicContact CZ2-CG 3.97Å; W1164-R1246 HydrophobicContact CZ3-CB 3.84Å; W1164-R1246 HydrophobicContact CZ3-CG 4.11Å; W1164-R1246 PolarHBondContact O-NH1 3.14Å; W1164-L1249 HydrophobicContact CH2-CD2 4.11Å; W1164-L1249 HydrophobicContact CZ3-CD2 4.41Å; W1164-V1250 HydrophobicContact CE3-CG2 3.81Å; W1164-V1250 HydrophobicContact CZ3-CG2 3.83Å
1165	S	89.8	Confident	91.4	Very high	94 Å²	94	23.1 Å²	23.1	66%	0.657	13%	0.126	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.9	49.4	-179.4	-55.9	0	0	0	0	113.1	M1161 T1162	M1161-S1165 PolarHBondContact O-N 3Å; M1161-S1165 VanDerWaalsContact O-N 3.17Å; T1162-S1165 PolarHBondContact O-N 3.49Å
1166	I	91.1	Very high	91.2	Very high	4 Å²	4	22 Å²	22	2%	0.021	12%	0.119	C	C	.	.			trans	-99.1	113.8	172.8	-55.2	175.9	0	0	0	107.7	M1161 W1164 I1242 F1243 R1246 L1247	M1161-I1166 HydrophobicContact CB-CB 4.08Å; M1161-I1166 HydrophobicContact CE-CG2 4.09Å; M1161-I1166 HydrophobicContact CG-CB 4.23Å; M1161-I1166 HydrophobicContact CG-CD1 4.42Å; M1161-I1166 HydrophobicContact CG-CG2 4.39Å; M1161-I1166 PolarHBondContact O-N 3.5Å; W1164-I1166 HydrophobicContact CB-CD1 4.42Å; W1164-I1166 HydrophobicContact CB-CG1 4.35Å; W1164-I1166 PolarHBondContact O-N 2.93Å; I1166-I1242 HydrophobicContact CG1-CG2 4.15Å; I1166-I1242 HydrophobicContact CG2-CG2 4.34Å; I1166-F1243 HydrophobicContact CG2-CD1 3.84Å; I1166-F1243 HydrophobicContact CG2-CE1 3.78Å; I1166-R1246 HydrophobicContact CD1-CB 3.94Å; I1166-L1247 HydrophobicContact CD1-CD1 4.5Å
1167	D	91.6	Very high	90.8	Very high	20 Å²	20	22.4 Å²	22.4	11%	0.107	12%	0.121	C	C	.	.			trans	-71.9	150	-179.4	-55.8	-46.6	0	0	0	111.9	K871 G873 N1169 F1243	K871-D1167 WeakPolarHBondContact CB-OD1 3.23Å; G873-D1167 VanDerWaalsContact O-CB 3.26Å; G873-D1167 WeakPolarHBondContact O-CB 3.46Å; D1167-N1169 PolarHBondContact O-N 3.45Å; D1167-F1243 WeakPolarHBondContact O-CE1 3.27Å
1168	Y	92.5	Very high	90.3	Very high	17 Å²	17	22.8 Å²	22.8	7%	0.067	12%	0.124	C	C	.	.	B	Isolated β-bridge	trans	-86.1	111.9	177.3	-170.1	-96.7	0	0	0	110.7	K871 V872 G873 I1113 V1114 G1117 M1161 L1176	K871-Y1168 WeakPolarHBondContact O-CB 3.43Å; K871-Y1168 PolarHBondContact O-N 3.13Å; V872-Y1168 WeakPolarHBondContact CA-O 3.31Å; G873-Y1168 PolarHBondContact N-O 2.87Å; I1113-Y1168 HydrophobicContact CD1-CE1 4.48Å; I1113-Y1168 HydrophobicContact CG1-CE1 4.06Å; I1113-Y1168 HydrophobicContact CG2-CD1 4.27Å; I1113-Y1168 HydrophobicContact CG2-CE1 4.26Å; V1114-Y1168 HydrophobicContact CG2-CD1 4.43Å; V1114-Y1168 HydrophobicContact CG2-CE1 4.44Å; G1117-Y1168 WeakPolarHBondContact CA-OH 3.21Å; M1161-Y1168 HydrophobicContact CE-CD2 4.28Å; Y1168-L1176 HydrophobicContact CD2-CD1 4.27Å; Y1168-L1176 HydrophobicContact CE2-CD1 3.64Å
1169	N	90.3	Very high	90.1	Very high	2 Å²	2	22.2 Å²	22.2	1%	0.011	12%	0.121	C	C	.	.	S	Bend	trans	-144.1	-174.7	177.9	59.7	49.3	0	0	0	111.2	L874 Y1110 I1113 D1167 V1171 A1172 L1173 F1243	L874-N1169 HydrophobicContact CB-CB 4.22Å; L874-N1169 WeakPolarHBondContact CD1-ND2 3.14Å; Y1110-N1169 HydrophobicContact CE1-CB 3.98Å; I1113-N1169 VanDerWaalsContact CD1-C 3.42Å; D1167-N1169 PolarHBondContact O-N 3.45Å; N1169-V1171 VanDerWaalsContact C-N 3.31Å; N1169-V1171 PolarHBondContact O-N 3.27Å; N1169-V1171 WeakPolarHBondContact OD1-CA 3.02Å; N1169-V1171 WeakPolarHBondContact OD1-CB 3.49Å; N1169-V1171 PolarHBondContact OD1-N 3.38Å; N1169-A1172 PolarHBondContact O-N 3Å; N1169-A1172 PolarHBondContact OD1-N 2.91Å; N1169-L1173 PolarHBondContact O-N 3.1Å; N1169-F1243 WeakPolarHBondContact ND2-CE1 3.18Å; N1169-F1243 WeakPolarHBondContact ND2-CZ 3.27Å
1170	A	86.2	Confident	89.9	Confident	2 Å²	2	22.2 Å²	22.2	2%	0.017	12%	0.121	C	C	.	.	H	α-helix	trans	-62.2	-34.8	-177.7	0	0	0	0	0	113.4	W385 M769 V772 I1113 L1173 I1174	W385-A1170 HydrophobicContact CE3-CB 4.28Å; W385-A1170 HydrophobicContact CZ3-CB 3.85Å; M769-A1170 HydrophobicContact SD-CB 3.58Å; M769-A1170 VanDerWaalsContact SD-CB 3.58Å; V772-A1170 HydrophobicContact CG2-CB 4.38Å; I1113-A1170 HydrophobicContact CD1-CB 4.44Å; A1170-L1173 PolarHBondContact O-N 3.09Å; A1170-I1174 WeakPolarHBondContact O-CG1 3.12Å; A1170-I1174 PolarHBondContact O-N 3.25Å
1171	V	87.3	Confident	89.5	Confident	8 Å²	8	20.5 Å²	20.5	5%	0.048	11%	0.111	C	C	.	.	H	α-helix	trans	-69.1	-43.2	176.2	-175.8	0	0	0	0	110.5	W385 N1169 L1173 I1174 N1175 L1239 F1243 F1244	W385-V1171 HydrophobicContact CH2-CG2 3.62Å; W385-V1171 HydrophobicContact CZ3-CG2 4.21Å; N1169-V1171 VanDerWaalsContact C-N 3.31Å; N1169-V1171 PolarHBondContact O-N 3.27Å; N1169-V1171 WeakPolarHBondContact OD1-CA 3.02Å; N1169-V1171 WeakPolarHBondContact OD1-CB 3.49Å; N1169-V1171 PolarHBondContact OD1-N 3.38Å; V1171-L1173 VanDerWaalsContact C-N 3.3Å; V1171-L1173 PolarHBondContact O-N 2.75Å; V1171-I1174 PolarHBondContact O-N 3.28Å; V1171-N1175 PolarHBondContact O-N 3.01Å; V1171-N1175 VanDerWaalsContact O-N 3.11Å; V1171-N1175 PolarHBondContact O-ND2 3.44Å; V1171-L1239 HydrophobicContact CG1-CD2 4.42Å; V1171-F1243 HydrophobicContact CG1-CB 3.75Å; V1171-F1243 HydrophobicContact CG1-CG 4.21Å; V1171-F1244 HydrophobicContact CG1-CE2 3.75Å; V1171-F1244 HydrophobicContact CG1-CZ 3.92Å
1172	A	90.3	Very high	89.2	Confident	0 Å²	0	21.4 Å²	21.4	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-61.1	-40.2	173.7	0	0	0	0	0	111.5	M1161 N1169 N1175 L1176 F1243	M1161-A1172 HydrophobicContact CE-CB 3.8Å; N1169-A1172 PolarHBondContact O-N 3Å; N1169-A1172 PolarHBondContact OD1-N 2.91Å; A1172-N1175 PolarHBondContact O-N 3.28Å; A1172-L1176 VanDerWaalsContact O-CG 3.29Å; A1172-L1176 WeakPolarHBondContact O-CG 2.99Å; A1172-L1176 PolarHBondContact O-N 3.18Å; A1172-F1243 HydrophobicContact CB-CD1 4.36Å
1173	L	88.8	Confident	89.1	Confident	2 Å²	2	19.9 Å²	19.9	1%	0.01	11%	0.106	C	C	.	.	H	α-helix	trans	-61	-44	175.2	176.8	60.1	0	0	0	112.2	I1121 N1169 A1170 V1171 N1175 L1176 V1177	I1121-L1173 HydrophobicContact CD1-CD1 4.33Å; I1121-L1173 HydrophobicContact CG1-CD1 4.32Å; N1169-L1173 PolarHBondContact O-N 3.1Å; A1170-L1173 PolarHBondContact O-N 3.09Å; V1171-L1173 VanDerWaalsContact C-N 3.3Å; V1171-L1173 PolarHBondContact O-N 2.75Å; L1173-N1175 VanDerWaalsContact C-N 3.33Å; L1173-N1175 PolarHBondContact O-N 3.43Å; L1173-L1176 PolarHBondContact O-N 2.77Å; L1173-V1177 HydrophobicContact CD1-CG2 4.34Å; L1173-V1177 WeakPolarHBondContact O-CG2 3.4Å; L1173-V1177 PolarHBondContact O-N 2.88Å
1174	I	86	Confident	89	Confident	12 Å²	12	14.4 Å²	14.4	6%	0.062	8%	0.077	C	C	.	.	H	α-helix	trans	-56.2	-49.6	174.5	-72.1	167	0	0	0	110.4	V772 F775 A1170 V1171 L1176 V1177 T1178	V772-I1174 HydrophobicContact CB-CD1 4.44Å; V772-I1174 HydrophobicContact CB-CG1 4.27Å; V772-I1174 HydrophobicContact CG1-CG1 4Å; V772-I1174 HydrophobicContact CG2-CD1 3.92Å; V772-I1174 HydrophobicContact CG2-CG1 3.86Å; F775-I1174 HydrophobicContact CD1-CG1 4.34Å; F775-I1174 HydrophobicContact CD1-CG2 3.57Å; F775-I1174 HydrophobicContact CE1-CG2 3.29Å; F775-I1174 HydrophobicContact CE2-CG2 4.29Å; F775-I1174 HydrophobicContact CG-CD1 4.5Å; F775-I1174 HydrophobicContact CG-CG2 4.2Å; F775-I1174 HydrophobicContact CZ-CG2 3.67Å; A1170-I1174 WeakPolarHBondContact O-CG1 3.12Å; A1170-I1174 PolarHBondContact O-N 3.25Å; V1171-I1174 PolarHBondContact O-N 3.28Å; I1174-L1176 VanDerWaalsContact C-N 3.32Å; I1174-L1176 PolarHBondContact O-N 3.43Å; I1174-V1177 PolarHBondContact O-N 3.44Å; I1174-T1178 PolarHBondContact O-N 2.94Å; I1174-T1178 PolarHBondContact O-OG1 3.08Å; I1174-T1178 VanDerWaalsContact O-OG1 3.11Å
1175	N	88.8	Confident	88.8	Confident	2 Å²	2	9.8 Å²	9.8	1%	0.011	6%	0.06	C	C	.	.	H	α-helix	trans	-66.7	-32.1	-179.4	-74.6	-47.3	0	0	0	112.7	V1171 A1172 L1173 T1178 A1179 F1243 L1247	V1171-N1175 PolarHBondContact O-N 3.01Å; V1171-N1175 VanDerWaalsContact O-N 3.11Å; V1171-N1175 PolarHBondContact O-ND2 3.44Å; A1172-N1175 PolarHBondContact O-N 3.28Å; L1173-N1175 VanDerWaalsContact C-N 3.33Å; L1173-N1175 PolarHBondContact O-N 3.43Å; N1175-T1178 PolarHBondContact O-N 2.73Å; N1175-A1179 WeakPolarHBondContact O-CB 3.5Å; N1175-A1179 PolarHBondContact O-N 3.14Å; N1175-F1243 PolarHBondContact ND2-O 2.95Å; N1175-L1247 HydrophobicContact CB-CD2 3.36Å; N1175-L1247 HydrophobicContact CB-CG 4.1Å
1176	L	90.3	Very high	88.8	Confident	0 Å²	0	5.3 Å²	5.3	0%	0	3%	0.029	C	C	.	.	H	α-helix	trans	-68.9	-36.6	172.7	-72	170.7	0	0	0	112.5	I1121 T1157 V1158 M1161 Y1168 A1172 L1173 I1174 A1179 V1180	I1121-L1176 HydrophobicContact CD1-CB 4.29Å; I1121-L1176 HydrophobicContact CD1-CD1 4.43Å; T1157-L1176 HydrophobicContact CG2-CD2 3.8Å; V1158-L1176 HydrophobicContact CG2-CD1 3.96Å; V1158-L1176 HydrophobicContact CG2-CD2 3.84Å; M1161-L1176 HydrophobicContact SD-CD1 4.25Å; M1161-L1176 HydrophobicContact SD-CD2 4.07Å; M1161-L1176 HydrophobicContact SD-CG 4.39Å; Y1168-L1176 HydrophobicContact CD2-CD1 4.27Å; Y1168-L1176 HydrophobicContact CE2-CD1 3.64Å; A1172-L1176 VanDerWaalsContact O-CG 3.29Å; A1172-L1176 WeakPolarHBondContact O-CG 2.99Å; A1172-L1176 PolarHBondContact O-N 3.18Å; L1173-L1176 PolarHBondContact O-N 2.77Å; I1174-L1176 VanDerWaalsContact C-N 3.32Å; I1174-L1176 PolarHBondContact O-N 3.43Å; L1176-A1179 VanDerWaalsContact O-CB 3.32Å; L1176-A1179 WeakPolarHBondContact O-CB 3.43Å; L1176-A1179 PolarHBondContact O-N 2.96Å; L1176-V1180 PolarHBondContact O-N 3.17Å; L1176-V1180 VanDerWaalsContact O-N 3.16Å
1177	V	86.3	Confident	88.8	Confident	8 Å²	8	5.1 Å²	5.1	5%	0.048	3%	0.028	C	C	.	.	H	α-helix	trans	-64.9	-44	171.8	172.2	0	0	0	0	110.3	F760 A763 L1173 I1174 A1179 V1180 G1181	F760-V1177 HydrophobicContact CD1-CG1 4.09Å; F760-V1177 HydrophobicContact CE1-CG1 3.98Å; A763-V1177 HydrophobicContact CB-CG1 4.31Å; L1173-V1177 HydrophobicContact CD1-CG2 4.34Å; L1173-V1177 WeakPolarHBondContact O-CG2 3.4Å; L1173-V1177 PolarHBondContact O-N 2.88Å; I1174-V1177 PolarHBondContact O-N 3.44Å; V1177-A1179 VanDerWaalsContact C-N 3.27Å; V1177-A1179 PolarHBondContact O-N 3.13Å; V1177-V1180 WeakPolarHBondContact O-CB 3.3Å; V1177-V1180 PolarHBondContact O-N 3.2Å; V1177-V1180 VanDerWaalsContact O-N 3.16Å; V1177-G1181 PolarHBondContact O-N 3.47Å
1178	T	85.4	Confident	88.6	Confident	9 Å²	9	4.3 Å²	4.3	6%	0.055	2%	0.024	C	C	.	.	H	α-helix	trans	-59.9	-37.6	172.4	-58.2	0	0	0	0	112	L707 I1174 N1175 V1180 G1181 I1182	L707-T1178 HydrophobicContact CD1-CG2 3.51Å; L707-T1178 WeakPolarHBondContact CD1-OG1 3.44Å; L707-T1178 HydrophobicContact CG-CG2 4.09Å; I1174-T1178 PolarHBondContact O-N 2.94Å; I1174-T1178 PolarHBondContact O-OG1 3.08Å; I1174-T1178 VanDerWaalsContact O-OG1 3.11Å; N1175-T1178 PolarHBondContact O-N 2.73Å; T1178-V1180 VanDerWaalsContact C-N 3.3Å; T1178-V1180 PolarHBondContact O-N 3.3Å; T1178-G1181 PolarHBondContact O-N 2.95Å; T1178-G1181 VanDerWaalsContact O-N 3.11Å; T1178-I1182 HydrophobicContact CG2-CD1 3.77Å; T1178-I1182 HydrophobicContact CG2-CG1 4.22Å; T1178-I1182 PolarHBondContact O-N 2.78Å
1179	A	90.1	Very high	88.3	Confident	0 Å²	0	3.5 Å²	3.5	0%	0	2%	0.02	C	C	.	.	H	α-helix	trans	-60.7	-38.5	176.2	0	0	0	0	0	112.2	N1175 L1176 V1177 G1181 S1183 I1251	N1175-A1179 WeakPolarHBondContact O-CB 3.5Å; N1175-A1179 PolarHBondContact O-N 3.14Å; L1176-A1179 VanDerWaalsContact O-CB 3.32Å; L1176-A1179 WeakPolarHBondContact O-CB 3.43Å; L1176-A1179 PolarHBondContact O-N 2.96Å; V1177-A1179 VanDerWaalsContact C-N 3.27Å; V1177-A1179 PolarHBondContact O-N 3.13Å; A1179-G1181 VanDerWaalsContact C-N 3.32Å; A1179-G1181 PolarHBondContact O-N 3.32Å; A1179-S1183 WeakPolarHBondContact O-CB 3.33Å; A1179-S1183 PolarHBondContact O-N 2.88Å; A1179-S1183 PolarHBondContact O-OG 3.37Å; A1179-I1251 HydrophobicContact CB-CB 4.35Å; A1179-I1251 HydrophobicContact CB-CD1 3.62Å; A1179-I1251 HydrophobicContact CB-CG1 3.66Å; A1179-I1251 HydrophobicContact CB-CG2 3.72Å
1180	V	89.1	Confident	88.3	Confident	0 Å²	0	3.4 Å²	3.4	0%	0	2%	0.02	C	C	.	.	H	α-helix	trans	-60.1	-45.1	174.2	175.3	0	0	0	0	110.2	I1121 C1124 L1125 T1128 I1150 V1154 L1176 V1177 T1178 S1183 V1184	I1121-V1180 HydrophobicContact CG2-CG2 4.47Å; C1124-V1180 HydrophobicContact CB-CG1 4.37Å; L1125-V1180 HydrophobicContact CD2-CG1 4.02Å; L1125-V1180 HydrophobicContact CD2-CG2 4.49Å; T1128-V1180 HydrophobicContact CG2-CG1 4.43Å; I1150-V1180 HydrophobicContact CG2-CG1 4.2Å; V1154-V1180 HydrophobicContact CG2-CG2 3.69Å; L1176-V1180 PolarHBondContact O-N 3.17Å; L1176-V1180 VanDerWaalsContact O-N 3.16Å; V1177-V1180 WeakPolarHBondContact O-CB 3.3Å; V1177-V1180 PolarHBondContact O-N 3.2Å; V1177-V1180 VanDerWaalsContact O-N 3.16Å; T1178-V1180 VanDerWaalsContact C-N 3.3Å; T1178-V1180 PolarHBondContact O-N 3.3Å; V1180-S1183 PolarHBondContact O-N 3.24Å; V1180-V1184 WeakPolarHBondContact O-CG2 3.33Å; V1180-V1184 PolarHBondContact O-N 2.99Å
1181	G	85.6	Confident	88.4	Confident	3 Å²	3	3.3 Å²	3.3	3%	0.031	2%	0.019	C	C	.	.	H	α-helix	trans	-60.4	-59.2	177	0	0	0	0	0	112.6	V1177 T1178 A1179 S1183 V1184	V1177-G1181 PolarHBondContact O-N 3.47Å; T1178-G1181 PolarHBondContact O-N 2.95Å; T1178-G1181 VanDerWaalsContact O-N 3.11Å; A1179-G1181 VanDerWaalsContact C-N 3.32Å; A1179-G1181 PolarHBondContact O-N 3.32Å; G1181-S1183 PolarHBondContact O-N 3.47Å; G1181-S1183 VanDerWaalsContact O-N 3.12Å; G1181-V1184 VanDerWaalsContact O-CB 3.3Å; G1181-V1184 WeakPolarHBondContact O-CB 3.33Å; G1181-V1184 PolarHBondContact O-N 2.88Å
1182	I	86.3	Confident	88.4	Confident	19 Å²	19	4.4 Å²	4.4	10%	0.097	2%	0.022	C	C	.	.	H	α-helix	trans	-56.9	-34	179.5	-64.1	174.1	0	0	0	111.6	T1178 V1184 E1185 F1186	T1178-I1182 HydrophobicContact CG2-CD1 3.77Å; T1178-I1182 HydrophobicContact CG2-CG1 4.22Å; T1178-I1182 PolarHBondContact O-N 2.78Å; I1182-V1184 VanDerWaalsContact C-N 3.27Å; I1182-V1184 PolarHBondContact O-N 2.98Å; I1182-E1185 WeakPolarHBondContact O-CB 3.47Å; I1182-E1185 PolarHBondContact O-N 2.99Å; I1182-F1186 HydrophobicContact CG2-CD2 4.17Å; I1182-F1186 HydrophobicContact CG2-CE2 3.74Å; I1182-F1186 WeakPolarHBondContact O-CD2 3.03Å; I1182-F1186 PolarHBondContact O-N 3.4Å
1183	S	91.1	Very high	88.2	Confident	0 Å²	0	5.5 Å²	5.5	0%	0	3%	0.03	C	C	.	.	H	α-helix	trans	-64.9	-29.5	176.4	-62.4	0	0	0	0	113.2	I1153 A1179 V1180 G1181 E1185 F1186 V1187	I1153-S1183 WeakPolarHBondContact CG2-OG 3.43Å; A1179-S1183 WeakPolarHBondContact O-CB 3.33Å; A1179-S1183 PolarHBondContact O-N 2.88Å; A1179-S1183 PolarHBondContact O-OG 3.37Å; V1180-S1183 PolarHBondContact O-N 3.24Å; G1181-S1183 PolarHBondContact O-N 3.47Å; G1181-S1183 VanDerWaalsContact O-N 3.12Å; S1183-E1185 VanDerWaalsContact C-N 3.31Å; S1183-F1186 PolarHBondContact O-N 3.43Å; S1183-V1187 WeakPolarHBondContact O-CB 3.44Å; S1183-V1187 VanDerWaalsContact O-CG2 3.31Å; S1183-V1187 WeakPolarHBondContact O-CG2 3.3Å; S1183-V1187 PolarHBondContact O-N 2.97Å
1184	V	89.1	Confident	88.2	Confident	1 Å²	1	5.4 Å²	5.4	1%	0.006	3%	0.03	C	C	.	.	H	α-helix	trans	-64.8	-37.3	175.7	177.7	0	0	0	0	110.7	L751 T1128 I1150 V1180 G1181 I1182 V1187 S1188	L751-V1184 HydrophobicContact CD2-CG1 4.2Å; T1128-V1184 HydrophobicContact CG2-CG2 3.74Å; I1150-V1184 HydrophobicContact CD1-CG2 3.88Å; V1180-V1184 WeakPolarHBondContact O-CG2 3.33Å; V1180-V1184 PolarHBondContact O-N 2.99Å; G1181-V1184 VanDerWaalsContact O-CB 3.3Å; G1181-V1184 WeakPolarHBondContact O-CB 3.33Å; G1181-V1184 PolarHBondContact O-N 2.88Å; I1182-V1184 VanDerWaalsContact C-N 3.27Å; I1182-V1184 PolarHBondContact O-N 2.98Å; V1184-V1187 PolarHBondContact O-N 3.1Å; V1184-S1188 WeakPolarHBondContact O-CB 3.45Å; V1184-S1188 PolarHBondContact O-N 2.89Å; V1184-S1188 PolarHBondContact O-OG 2.71Å
1185	E	88.2	Confident	88.1	Confident	2 Å²	2	5.8 Å²	5.8	1%	0.009	4%	0.035	C	C	.	.	H	α-helix	trans	-61.5	-45	176.1	-69.9	-68.9	173.5	0	0	111.4	C752 I1182 S1183 V1187 H1189 V1221	C752-E1185 WeakPolarHBondContact CB-OE1 3.42Å; C752-E1185 VanDerWaalsContact SG-CD 3.58Å; C752-E1185 PolarHBondContact SG-OE2 2.99Å; I1182-E1185 WeakPolarHBondContact O-CB 3.47Å; I1182-E1185 PolarHBondContact O-N 2.99Å; S1183-E1185 VanDerWaalsContact C-N 3.31Å; E1185-V1187 VanDerWaalsContact C-N 3.32Å; E1185-V1187 PolarHBondContact O-N 2.95Å; E1185-H1189 PolarHBondContact O-CD2 2.99Å; E1185-H1189 VanDerWaalsContact O-CD2 3.24Å; E1185-H1189 IonicContact OE2-CD2 3.85Å; E1185-H1189 PolarHBondContact OE2-CD2 2.93Å; E1185-H1189 VanDerWaalsContact OE2-CD2 3.29Å; E1185-H1189 IonicContact OE2-CE1 3.83Å; E1185-H1189 IonicContact OE2-NE2 2.8Å; E1185-H1189 PolarHBondContact OE2-NE2 2.95Å; E1185-V1221 HydrophobicContact CB-CG1 4.34Å; E1185-V1221 HydrophobicContact CB-CG2 4.23Å
1186	F	89.6	Confident	87.7	Confident	0 Å²	0	8.6 Å²	8.6	0%	0	5%	0.049	C	C	.	.	H	α-helix	trans	-65	-33.9	178.1	-73.8	-70.1	0	0	0	113.7	I1182 S1183 V1217 V1221 A1222 T1252 M1256	I1182-F1186 HydrophobicContact CG2-CD2 4.17Å; I1182-F1186 HydrophobicContact CG2-CE2 3.74Å; I1182-F1186 WeakPolarHBondContact O-CD2 3.03Å; I1182-F1186 PolarHBondContact O-N 3.4Å; S1183-F1186 PolarHBondContact O-N 3.43Å; F1186-V1217 HydrophobicContact CD1-CG1 3.75Å; F1186-V1217 HydrophobicContact CE1-CG1 4.3Å; F1186-V1221 HydrophobicContact CD1-CB 4.38Å; F1186-V1221 HydrophobicContact CD1-CG1 4.12Å; F1186-V1221 HydrophobicContact CD2-CG1 4.08Å; F1186-V1221 HydrophobicContact CE1-CB 3.83Å; F1186-V1221 HydrophobicContact CE1-CG1 3.58Å; F1186-V1221 HydrophobicContact CE2-CG1 3.55Å; F1186-V1221 HydrophobicContact CG-CG1 4.35Å; F1186-V1221 HydrophobicContact CZ-CB 4Å; F1186-V1221 HydrophobicContact CZ-CG1 3.27Å; F1186-A1222 HydrophobicContact CE1-CB 4.36Å; F1186-T1252 HydrophobicContact CZ-CG2 4.45Å; F1186-M1256 HydrophobicContact CE1-CB 4.3Å
1187	V	91.3	Very high	87.5	Confident	0 Å²	0	9.1 Å²	9.1	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-97.3	-44.4	-168.7	173.2	0	0	0	0	112.7	N1146 T1149 I1150 I1153 S1183 V1184 E1185 M1190 T1191 L1263	N1146-V1187 HydrophobicContact CB-CG1 3.69Å; N1146-V1187 VanDerWaalsContact OD1-CG1 3.27Å; N1146-V1187 WeakPolarHBondContact OD1-CG1 3.5Å; T1149-V1187 HydrophobicContact CG2-CG2 3.76Å; I1150-V1187 HydrophobicContact CG1-CG2 4.4Å; I1153-V1187 HydrophobicContact CD1-CG2 4.32Å; S1183-V1187 WeakPolarHBondContact O-CB 3.44Å; S1183-V1187 VanDerWaalsContact O-CG2 3.31Å; S1183-V1187 WeakPolarHBondContact O-CG2 3.3Å; S1183-V1187 PolarHBondContact O-N 2.97Å; V1184-V1187 PolarHBondContact O-N 3.1Å; E1185-V1187 VanDerWaalsContact C-N 3.32Å; E1185-V1187 PolarHBondContact O-N 2.95Å; V1187-M1190 PolarHBondContact O-N 3.18Å; V1187-T1191 PolarHBondContact O-N 3.22Å; V1187-T1191 PolarHBondContact O-OG1 3.49Å; V1187-L1263 HydrophobicContact CB-CD2 4.14Å; V1187-L1263 HydrophobicContact CG1-CD1 4.46Å; V1187-L1263 HydrophobicContact CG1-CD2 3.86Å; V1187-L1263 HydrophobicContact CG2-CD2 4.29Å
1188	S	88.3	Confident	87.3	Confident	3 Å²	3	12.5 Å²	12.5	2%	0.021	7%	0.074	C	C	.	.	H	α-helix	trans	-69.8	-42.7	-169.3	68.8	0	0	0	0	113.2	C752 V1184 M1190 T1191 R1192	C752-S1188 PolarHBondContact SG-OG 3.24Å; V1184-S1188 WeakPolarHBondContact O-CB 3.45Å; V1184-S1188 PolarHBondContact O-N 2.89Å; V1184-S1188 PolarHBondContact O-OG 2.71Å; S1188-M1190 VanDerWaalsContact C-N 3.34Å; S1188-M1190 PolarHBondContact O-N 3.09Å; S1188-T1191 PolarHBondContact O-N 3.3Å; S1188-R1192 WeakPolarHBondContact O-CB 3.45Å; S1188-R1192 PolarHBondContact O-N 3.42Å
1189	H	86.8	Confident	87.2	Confident	0 Å²	0	16.4 Å²	16.4	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-60.4	-44.5	176.8	-71.8	-61.2	0	0	0	111.4	I718 S748 C752 E1185 S1193 M1213 V1217	I718-H1189 WeakPolarHBondContact CD1-NE2 3.41Å; S748-H1189 WeakPolarHBondContact CB-CE1 3.42Å; S748-H1189 WeakPolarHBondContact CB-ND1 3.42Å; C752-H1189 PolarHBondContact SG-NE2 2.53Å; E1185-H1189 PolarHBondContact O-CD2 2.99Å; E1185-H1189 VanDerWaalsContact O-CD2 3.24Å; E1185-H1189 IonicContact OE2-CD2 3.85Å; E1185-H1189 PolarHBondContact OE2-CD2 2.93Å; E1185-H1189 VanDerWaalsContact OE2-CD2 3.29Å; E1185-H1189 IonicContact OE2-CE1 3.83Å; E1185-H1189 IonicContact OE2-NE2 2.8Å; E1185-H1189 PolarHBondContact OE2-NE2 2.95Å; H1189-S1193 WeakPolarHBondContact O-CB 3.48Å; H1189-S1193 PolarHBondContact O-N 2.97Å; H1189-M1213 HydrophobicContact CB-CG 3.86Å; H1189-M1213 HydrophobicContact CB-SD 3.93Å; H1189-V1217 HydrophobicContact CB-CG2 3.99Å
1190	M	88.9	Confident	86.7	Confident	1 Å²	1	24.8 Å²	24.8	1%	0.005	13%	0.131	C	C	.	.	H	α-helix	trans	-64	-48.7	179.1	-172.2	64	65.3	0	0	111.5	V1187 S1188 S1193 F1194 A1209 G1214 L1260 L1263 L1267	V1187-M1190 PolarHBondContact O-N 3.18Å; S1188-M1190 VanDerWaalsContact C-N 3.34Å; S1188-M1190 PolarHBondContact O-N 3.09Å; M1190-S1193 PolarHBondContact O-N 3.17Å; M1190-F1194 PolarHBondContact O-N 3.04Å; M1190-A1209 HydrophobicContact SD-CB 4.15Å; M1190-G1214 VanDerWaalsContact CE-CA 3.45Å; M1190-L1260 HydrophobicContact CE-CD2 3.86Å; M1190-L1263 HydrophobicContact CB-CD2 3.79Å; M1190-L1263 HydrophobicContact CG-CD2 3.9Å; M1190-L1263 HydrophobicContact CG-CG 4.41Å; M1190-L1267 HydrophobicContact CG-CD1 4.48Å
1191	T	89.2	Confident	86.5	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-65.5	-40.1	179.8	-64.8	0	0	0	0	111.9	L1136 N1146 V1187 S1188 F1194 A1195	L1136-T1191 HydrophobicContact CD1-CG2 4.41Å; N1146-T1191 WeakPolarHBondContact OD1-CB 3.39Å; N1146-T1191 WeakPolarHBondContact OD1-CG2 3.47Å; N1146-T1191 PolarHBondContact OD1-OG1 2.89Å; V1187-T1191 PolarHBondContact O-N 3.22Å; V1187-T1191 PolarHBondContact O-OG1 3.49Å; S1188-T1191 PolarHBondContact O-N 3.3Å; T1191-F1194 PolarHBondContact O-N 3.39Å; T1191-A1195 WeakPolarHBondContact O-CB 3.44Å; T1191-A1195 PolarHBondContact O-N 3.26Å
1192	R	86.4	Confident	86.5	Confident	30 Å²	30	32.3 Å²	32.3	11%	0.113	17%	0.167	C	C	.	.	H	α-helix	trans	-63	-45.8	174.9	-176.2	170.2	170.5	-90.5	-4.1	111.5	Q744 S748 L1136 S1188 F1194 A1195 L1196	Q744-R1192 PolarHBondContact O-NH1 3.38Å; Q744-R1192 PolarHBondContact O-NH2 2.87Å; S748-R1192 VanDerWaalsContact OG-CD 3.32Å; S748-R1192 WeakPolarHBondContact OG-CD 3.01Å; S748-R1192 PolarHBondContact OG-NH1 3.05Å; L1136-R1192 HydrophobicContact CD2-CB 3.79Å; L1136-R1192 HydrophobicContact CD2-CG 3.82Å; S1188-R1192 WeakPolarHBondContact O-CB 3.45Å; S1188-R1192 PolarHBondContact O-N 3.42Å; R1192-F1194 VanDerWaalsContact C-N 3.26Å; R1192-F1194 PolarHBondContact O-N 3.31Å; R1192-A1195 PolarHBondContact O-N 3.46Å; R1192-L1196 HydrophobicContact CG-CD1 3.81Å; R1192-L1196 HydrophobicContact CG-CG 4.39Å; R1192-L1196 WeakPolarHBondContact O-CG 3.3Å; R1192-L1196 PolarHBondContact O-N 3.13Å
1193	S	87.1	Confident	86.6	Confident	23 Å²	23	33.2 Å²	33.2	16%	0.161	17%	0.174	C	C	.	.	H	α-helix	trans	-61.2	-36.1	177.2	-173.5	0	0	0	0	112.1	H1189 M1190 S1197	H1189-S1193 WeakPolarHBondContact O-CB 3.48Å; H1189-S1193 PolarHBondContact O-N 2.97Å; M1190-S1193 PolarHBondContact O-N 3.17Å; S1193-S1197 PolarHBondContact O-N 3.02Å
1194	F	88.4	Confident	86.5	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-68.5	-43.7	174.5	178.7	-89.3	0	0	0	112.6	M1190 T1191 R1192 L1196 S1197 R1202 R1205 A1206 A1209 L1267 P1272	M1190-F1194 PolarHBondContact O-N 3.04Å; T1191-F1194 PolarHBondContact O-N 3.39Å; R1192-F1194 VanDerWaalsContact C-N 3.26Å; R1192-F1194 PolarHBondContact O-N 3.31Å; F1194-L1196 VanDerWaalsContact C-N 3.32Å; F1194-L1196 PolarHBondContact O-N 3.04Å; F1194-S1197 PolarHBondContact O-N 2.94Å; F1194-R1202 WeakPolarHBondContact CE2-O 3.24Å; F1194-R1202 HydrophobicContact CZ-CB 4.3Å; F1194-R1202 HydrophobicContact CZ-CG 4.44Å; F1194-R1205 HydrophobicContact CD2-CB 3.88Å; F1194-R1205 HydrophobicContact CE2-CB 3.69Å; F1194-R1205 HydrophobicContact CZ-CB 4.32Å; F1194-A1206 HydrophobicContact CD2-CB 4.18Å; F1194-A1206 HydrophobicContact CE2-CB 3.93Å; F1194-A1209 HydrophobicContact CB-CB 4.16Å; F1194-L1267 HydrophobicContact CB-CD1 3.95Å; F1194-L1267 HydrophobicContact CD1-CB 4.42Å; F1194-L1267 HydrophobicContact CD1-CD2 4.02Å; F1194-L1267 HydrophobicContact CD2-CB 4.06Å; F1194-L1267 HydrophobicContact CD2-CD1 4.34Å; F1194-L1267 HydrophobicContact CE1-CB 4.4Å; F1194-L1267 HydrophobicContact CE1-CD2 4.35Å; F1194-L1267 HydrophobicContact CE2-CB 4Å; F1194-L1267 HydrophobicContact CG-CB 4.26Å; F1194-L1267 HydrophobicContact CG-CD1 4.02Å; F1194-L1267 HydrophobicContact CG-CD2 4.36Å; F1194-L1267 HydrophobicContact CG-CG 4.46Å; F1194-L1267 HydrophobicContact CZ-CB 4.17Å; F1194-L1267 WeakPolarHBondContact CZ-O 3.1Å; F1194-P1272 HydrophobicContact CD1-CG 4.27Å; F1194-P1272 HydrophobicContact CE1-CG 4.05Å
1195	A	83.7	Confident	86.5	Confident	21 Å²	21	37.3 Å²	37.3	17%	0.174	19%	0.192	C	C	.	.	H	α-helix	trans	-65.2	-35.5	-178.2	0	0	0	0	0	112.4	T1191 R1192	T1191-A1195 WeakPolarHBondContact O-CB 3.44Å; T1191-A1195 PolarHBondContact O-N 3.26Å; R1192-A1195 PolarHBondContact O-N 3.46Å
1196	L	81.1	Confident	86.7	Confident	60 Å²	60	37.3 Å²	37.3	31%	0.314	19%	0.193	S	C	.	.	H	α-helix	trans	-83.4	-11.2	-179.8	-69.1	175.5	0	0	0	114.6	R1192 F1194	R1192-L1196 HydrophobicContact CG-CD1 3.81Å; R1192-L1196 HydrophobicContact CG-CG 4.39Å; R1192-L1196 WeakPolarHBondContact O-CG 3.3Å; R1192-L1196 PolarHBondContact O-N 3.13Å; F1194-L1196 VanDerWaalsContact C-N 3.32Å; F1194-L1196 PolarHBondContact O-N 3.04Å
1197	S	84.6	Confident	86.7	Confident	12 Å²	12	40.1 Å²	40.1	8%	0.084	21%	0.205	C	C	.	.			trans	-70.3	137.8	-178.5	172.5	0	0	0	0	112.2	S1193 F1194 K1199 R1205 E1208	S1193-S1197 PolarHBondContact O-N 3.02Å; F1194-S1197 PolarHBondContact O-N 2.94Å; S1197-K1199 PolarHBondContact OG-N 3.12Å; S1197-R1205 WeakPolarHBondContact O-CD 3.47Å; S1197-R1205 WeakPolarHBondContact OG-CG 3.01Å; S1197-E1208 WeakPolarHBondContact CB-OE2 3.23Å; S1197-E1208 PolarHBondContact OG-OE2 3.09Å
1198	T	83.1	Confident	86.7	Confident	78 Å²	78	43.2 Å²	43.2	48%	0.479	22%	0.22	S	C	.	.			trans	-90.7	1.2	-178.3	55.6	0	0	0	0	114	V1278	T1198-V1278 HydrophobicContact CG2-CG1 3.66Å
1199	K	84	Confident	86.8	Confident	92 Å²	92	43.1 Å²	43.1	40%	0.4	22%	0.219	S	C	.	.			trans	-66.6	144.2	179.8	-49	-72	-179.4	178.5	0	111.2	S1197 T1201 E1204 R1205 E1208 V1274	S1197-K1199 PolarHBondContact OG-N 3.12Å; K1199-T1201 PolarHBondContact O-N 3.15Å; K1199-E1204 HydrophobicContact CB-CB 4.03Å; K1199-E1204 HydrophobicContact CG-CB 4.42Å; K1199-R1205 HydrophobicContact CB-CG 3.63Å; K1199-R1205 HydrophobicContact CG-CG 4.35Å; K1199-R1205 VanDerWaalsContact O-CD 3.29Å; K1199-R1205 WeakPolarHBondContact O-CD 3.45Å; K1199-R1205 VanDerWaalsContact O-CG 3.29Å; K1199-R1205 WeakPolarHBondContact O-CG 3.38Å; K1199-E1208 VanDerWaalsContact CE-CD 3.44Å; K1199-E1208 WeakPolarHBondContact CE-OE1 3.4Å; K1199-E1208 WeakPolarHBondContact CE-OE2 3.33Å; K1199-E1208 WeakPolarHBondContact CG-OE2 3.37Å; K1199-E1208 IonicContact NZ-OE1 3.48Å; K1199-V1274 WeakPolarHBondContact O-CG2 3.42Å
1200	M	78.4	Confident	87	Confident	176 Å²	176	43.2 Å²	43.2	87%	0.867	22%	0.219	S	C	*	.	S	Bend	trans	-69.9	-29.6	-172.4	-63.5	-167.7	-174.8	0	0	114.9
1201	T	85.8	Confident	87	Confident	74 Å²	74	43.4 Å²	43.4	45%	0.454	22%	0.221	S	C	.	.	S	Bend	trans	-109	146.6	-177.5	74.2	0	0	0	0	111.7	K1199 V1203 E1204 R1205	K1199-T1201 PolarHBondContact O-N 3.15Å; T1201-V1203 PolarHBondContact O-N 3.23Å; T1201-E1204 PolarHBondContact O-N 2.84Å; T1201-E1204 WeakPolarHBondContact OG1-CB 3.43Å; T1201-E1204 VanDerWaalsContact OG1-CG 3.3Å; T1201-E1204 WeakPolarHBondContact OG1-CG 3.44Å; T1201-E1204 PolarHBondContact OG1-N 2.76Å; T1201-R1205 WeakPolarHBondContact O-CG 3.4Å; T1201-R1205 PolarHBondContact O-N 3.12Å; T1201-R1205 VanDerWaalsContact O-N 3.08Å
1202	R	85.6	Confident	86.9	Confident	87 Å²	87	46 Å²	46	33%	0.328	24%	0.237	S	C	.	.	H	α-helix	trans	-56.8	-36.5	175.5	-67.7	-176	-178.7	152.1	6.7	112.6	F1194 A1206 S1268 Y1269 G1271	F1194-R1202 WeakPolarHBondContact CE2-O 3.24Å; F1194-R1202 HydrophobicContact CZ-CB 4.3Å; F1194-R1202 HydrophobicContact CZ-CG 4.44Å; R1202-A1206 WeakPolarHBondContact O-CB 3.44Å; R1202-A1206 PolarHBondContact O-N 2.02Å; R1202-S1268 WeakPolarHBondContact CB-O 3.14Å; R1202-Y1269 PolarHBondContact NH1-O 3.05Å; R1202-G1271 VanDerWaalsContact CZ-O 3.25Å; R1202-G1271 PolarHBondContact NE-O 3.23Å; R1202-G1271 PolarHBondContact NH2-O 2.92Å
1203	V	88.8	Confident	87	Confident	38 Å²	38	45.9 Å²	45.9	23%	0.23	24%	0.238	C	C	.	.	H	α-helix	trans	-68.8	-43.9	-178.9	-179.7	0	0	0	0	111.2	L844 T1201 A1206 K1207	L844-V1203 HydrophobicContact CB-CG1 4.38Å; T1201-V1203 PolarHBondContact O-N 3.23Å; V1203-A1206 PolarHBondContact O-N 3.19Å; V1203-K1207 WeakPolarHBondContact O-CG 3.36Å; V1203-K1207 PolarHBondContact O-N 3.12Å
1204	E	89	Confident	87	Confident	84 Å²	84	44.8 Å²	44.8	39%	0.393	23%	0.231	S	C	.	.	H	α-helix	trans	-69.2	-35.3	178.5	-67.5	-56.6	136.8	0	0	112.2	K1199 T1201 K1207 E1208	K1199-E1204 HydrophobicContact CB-CB 4.03Å; K1199-E1204 HydrophobicContact CG-CB 4.42Å; T1201-E1204 PolarHBondContact O-N 2.84Å; T1201-E1204 WeakPolarHBondContact OG1-CB 3.43Å; T1201-E1204 VanDerWaalsContact OG1-CG 3.3Å; T1201-E1204 WeakPolarHBondContact OG1-CG 3.44Å; T1201-E1204 PolarHBondContact OG1-N 2.76Å; E1204-K1207 PolarHBondContact O-N 2.8Å; E1204-K1207 IonicContact OE1-NZ 3.6Å; E1204-K1207 PolarHBondContact OE1-NZ 2.97Å; E1204-K1207 IonicContact OE2-NZ 3.85Å; E1204-E1208 PolarHBondContact O-N 2.9Å
1205	R	89.4	Confident	87	Confident	2 Å²	2	44.9 Å²	44.9	1%	0.008	23%	0.231	C	C	.	.	H	α-helix	trans	-63.5	-43.2	171.2	-68.1	-164.1	-70.9	166	1.6	112.3	F1194 S1197 K1199 T1201 K1207 E1208 A1209 P1272 G1273	F1194-R1205 HydrophobicContact CD2-CB 3.88Å; F1194-R1205 HydrophobicContact CE2-CB 3.69Å; F1194-R1205 HydrophobicContact CZ-CB 4.32Å; S1197-R1205 WeakPolarHBondContact O-CD 3.47Å; S1197-R1205 WeakPolarHBondContact OG-CG 3.01Å; K1199-R1205 HydrophobicContact CB-CG 3.63Å; K1199-R1205 HydrophobicContact CG-CG 4.35Å; K1199-R1205 VanDerWaalsContact O-CD 3.29Å; K1199-R1205 WeakPolarHBondContact O-CD 3.45Å; K1199-R1205 VanDerWaalsContact O-CG 3.29Å; K1199-R1205 WeakPolarHBondContact O-CG 3.38Å; T1201-R1205 WeakPolarHBondContact O-CG 3.4Å; T1201-R1205 PolarHBondContact O-N 3.12Å; T1201-R1205 VanDerWaalsContact O-N 3.08Å; R1205-K1207 VanDerWaalsContact C-N 3.33Å; R1205-K1207 PolarHBondContact O-N 3.43Å; R1205-E1208 PolarHBondContact O-N 3.23Å; R1205-A1209 WeakPolarHBondContact O-CB 3.47Å; R1205-A1209 PolarHBondContact O-N 3.48Å; R1205-P1272 PolarHBondContact NH2-O 3.38Å; R1205-G1273 PolarHBondContact NH1-O 3.19Å; R1205-G1273 VanDerWaalsContact NH2-C 3.33Å; R1205-G1273 PolarHBondContact NH2-O 3.19Å
1206	A	90.4	Very high	87.2	Confident	2 Å²	2	44 Å²	44	2%	0.017	22%	0.224	C	C	.	.	H	α-helix	trans	-61.9	-41.7	175.4	0	0	0	0	0	111.3	L844 F1194 R1202 V1203 T1210	L844-A1206 HydrophobicContact CD1-CB 3.72Å; L844-A1206 HydrophobicContact CD2-CB 4.09Å; F1194-A1206 HydrophobicContact CD2-CB 4.18Å; F1194-A1206 HydrophobicContact CE2-CB 3.93Å; R1202-A1206 WeakPolarHBondContact O-CB 3.44Å; R1202-A1206 PolarHBondContact O-N 2.02Å; V1203-A1206 PolarHBondContact O-N 3.19Å; A1206-T1210 VanDerWaalsContact O-CB 3.29Å; A1206-T1210 WeakPolarHBondContact O-CB 3.24Å; A1206-T1210 PolarHBondContact O-N 2.9Å; A1206-T1210 PolarHBondContact O-OG1 3.3Å
1207	K	91.3	Very high	87.5	Confident	60 Å²	60	41.1 Å²	41.1	26%	0.261	21%	0.209	S	C	.	.	H	α-helix	trans	-61.5	-45.3	176.1	-75.4	177.2	-174.5	169	0	112.2	L844 V1203 E1204 R1205 A1211	L844-K1207 HydrophobicContact CB-CG 4.24Å; L844-K1207 HydrophobicContact CD1-CB 4.06Å; L844-K1207 HydrophobicContact CD1-CG 3.4Å; L844-K1207 VanDerWaalsContact CD1-N 3.31Å; L844-K1207 HydrophobicContact CG-CG 4.44Å; V1203-K1207 WeakPolarHBondContact O-CG 3.36Å; V1203-K1207 PolarHBondContact O-N 3.12Å; E1204-K1207 PolarHBondContact O-N 2.8Å; E1204-K1207 IonicContact OE1-NZ 3.6Å; E1204-K1207 PolarHBondContact OE1-NZ 2.97Å; E1204-K1207 IonicContact OE2-NZ 3.85Å; R1205-K1207 VanDerWaalsContact C-N 3.33Å; R1205-K1207 PolarHBondContact O-N 3.43Å; K1207-A1211 WeakPolarHBondContact O-CB 3.32Å; K1207-A1211 PolarHBondContact O-N 2.76Å
1208	E	89.8	Confident	87.7	Confident	65 Å²	65	43.2 Å²	43.2	30%	0.304	22%	0.217	S	C	.	.	H	α-helix	trans	-63.1	-52.2	179	-177.8	170.8	-120.8	0	0	111.3	S1197 K1199 E1204 R1205 T1210 A1211 T1212	S1197-E1208 WeakPolarHBondContact CB-OE2 3.23Å; S1197-E1208 PolarHBondContact OG-OE2 3.09Å; K1199-E1208 VanDerWaalsContact CE-CD 3.44Å; K1199-E1208 WeakPolarHBondContact CE-OE1 3.4Å; K1199-E1208 WeakPolarHBondContact CE-OE2 3.33Å; K1199-E1208 WeakPolarHBondContact CG-OE2 3.37Å; K1199-E1208 IonicContact NZ-OE1 3.48Å; E1204-E1208 PolarHBondContact O-N 2.9Å; R1205-E1208 PolarHBondContact O-N 3.23Å; E1208-T1210 VanDerWaalsContact C-N 3.32Å; E1208-T1210 PolarHBondContact O-N 2.9Å; E1208-A1211 PolarHBondContact O-N 3.08Å; E1208-A1211 VanDerWaalsContact O-N 3.11Å; E1208-T1212 PolarHBondContact O-N 3.24Å; E1208-T1212 PolarHBondContact O-OG1 2.97Å; E1208-T1212 VanDerWaalsContact O-OG1 3.05Å
1209	A	90.6	Very high	87.8	Confident	1 Å²	1	39.7 Å²	39.7	1%	0.008	20%	0.195	C	C	.	.	H	α-helix	trans	-59.3	-41.9	178.5	0	0	0	0	0	112.3	M1190 F1194 R1205 A1211 M1213 G1214	M1190-A1209 HydrophobicContact SD-CB 4.15Å; F1194-A1209 HydrophobicContact CB-CB 4.16Å; R1205-A1209 WeakPolarHBondContact O-CB 3.47Å; R1205-A1209 PolarHBondContact O-N 3.48Å; A1209-A1211 VanDerWaalsContact C-N 3.32Å; A1209-A1211 PolarHBondContact O-N 3.41Å; A1209-M1213 WeakPolarHBondContact O-CA 3.34Å; A1209-M1213 WeakPolarHBondContact O-CB 3.47Å; A1209-M1213 PolarHBondContact O-N 3.46Å; A1209-G1214 PolarHBondContact O-N 3.07Å; A1209-G1214 VanDerWaalsContact O-N 3.14Å
1210	T	92.1	Very high	87.7	Confident	1 Å²	1	35.3 Å²	35.3	1%	0.006	18%	0.176	C	C	.	.	H	α-helix	trans	-65.1	-36.6	177.2	-51.8	0	0	0	0	111.6	Y839 A840 L843 A1206 E1208 G1214 P1264	Y839-T1210 HydrophobicContact CD1-CG2 4.05Å; Y839-T1210 HydrophobicContact CE1-CG2 4.01Å; A840-T1210 HydrophobicContact CB-CG2 4.24Å; L843-T1210 HydrophobicContact CD2-CG2 4.48Å; A1206-T1210 VanDerWaalsContact O-CB 3.29Å; A1206-T1210 WeakPolarHBondContact O-CB 3.24Å; A1206-T1210 PolarHBondContact O-N 2.9Å; A1206-T1210 PolarHBondContact O-OG1 3.3Å; E1208-T1210 VanDerWaalsContact C-N 3.32Å; E1208-T1210 PolarHBondContact O-N 2.9Å; T1210-G1214 WeakPolarHBondContact O-CA 3.33Å; T1210-G1214 PolarHBondContact O-N 2.81Å; T1210-P1264 HydrophobicContact CG2-CG 4.38Å; T1210-P1264 WeakPolarHBondContact OG1-CB 3.1Å
1211	A	89.1	Confident	87.9	Confident	6 Å²	6	26.9 Å²	26.9	5%	0.05	14%	0.135	C	C	.	.	H	α-helix	trans	-72.6	-51.9	179.8	0	0	0	0	0	112	L832 R836 K1207 E1208 A1209 S1215	L832-A1211 VanDerWaalsContact CD1-O 3.29Å; L832-A1211 WeakPolarHBondContact CD1-O 3.24Å; R836-A1211 HydrophobicContact CB-CB 3.99Å; R836-A1211 HydrophobicContact CG-CB 4.38Å; K1207-A1211 WeakPolarHBondContact O-CB 3.32Å; K1207-A1211 PolarHBondContact O-N 2.76Å; E1208-A1211 PolarHBondContact O-N 3.08Å; E1208-A1211 VanDerWaalsContact O-N 3.11Å; A1209-A1211 VanDerWaalsContact C-N 3.32Å; A1209-A1211 PolarHBondContact O-N 3.41Å; A1211-S1215 WeakPolarHBondContact O-CB 3.24Å; A1211-S1215 PolarHBondContact O-OG 2.68Å
1212	T	86.6	Confident	87.8	Confident	55 Å²	55	23.4 Å²	23.4	34%	0.337	11%	0.113	S	C	.	.	H	α-helix	trans	-77.8	-57.4	-173.9	55.5	0	0	0	0	111.8	R725 L832 E1208 S1215	R725-T1212 PolarHBondContact NH1-O 3.37Å; L832-T1212 HydrophobicContact CD1-CG2 4.43Å; E1208-T1212 PolarHBondContact O-N 3.24Å; E1208-T1212 PolarHBondContact O-OG1 2.97Å; E1208-T1212 VanDerWaalsContact O-OG1 3.05Å; T1212-S1215 PolarHBondContact O-OG 3.15Å
1213	M	88.1	Confident	87.9	Confident	26 Å²	26	22.2 Å²	22.2	13%	0.128	11%	0.113	C	C	.	.	H	α-helix	trans	-80.6	-37.9	-176.3	-166.9	58.6	72.6	0	0	111.5	H1189 A1209 S1215 A1216 V1217	H1189-M1213 HydrophobicContact CB-CG 3.86Å; H1189-M1213 HydrophobicContact CB-SD 3.93Å; A1209-M1213 WeakPolarHBondContact O-CA 3.34Å; A1209-M1213 WeakPolarHBondContact O-CB 3.47Å; A1209-M1213 PolarHBondContact O-N 3.46Å; M1213-S1215 VanDerWaalsContact C-N 3.3Å; M1213-S1215 PolarHBondContact O-N 3.12Å; M1213-A1216 WeakPolarHBondContact O-CB 3.48Å; M1213-A1216 PolarHBondContact O-N 3.37Å; M1213-A1216 HydrophobicContact SD-CB 4.35Å; M1213-V1217 HydrophobicContact CG-CG2 4.09Å; M1213-V1217 WeakPolarHBondContact O-CG2 3.03Å; M1213-V1217 PolarHBondContact O-N 2.02Å; M1213-V1217 HydrophobicContact SD-CG2 4.38Å
1214	G	88.1	Confident	87.7	Confident	1 Å²	1	20.5 Å²	20.5	1%	0.01	10%	0.102	C	C	.	.	H	α-helix	trans	-61.4	-35	177.4	0	0	0	0	0	113.9	M1190 A1209 T1210 F1218	M1190-G1214 VanDerWaalsContact CE-CA 3.45Å; A1209-G1214 PolarHBondContact O-N 3.07Å; A1209-G1214 VanDerWaalsContact O-N 3.14Å; T1210-G1214 WeakPolarHBondContact O-CA 3.33Å; T1210-G1214 PolarHBondContact O-N 2.81Å; G1214-F1218 VanDerWaalsContact O-CB 3.24Å; G1214-F1218 WeakPolarHBondContact O-CB 3.49Å; G1214-F1218 PolarHBondContact O-N 3.49Å
1215	S	87.9	Confident	87.5	Confident	1 Å²	1	16.9 Å²	16.9	1%	0.007	9%	0.085	C	C	.	.	H	α-helix	trans	-69	-33.6	172.9	58.3	0	0	0	0	113	R725 A1211 T1212 M1213 A1219	R725-S1215 PolarHBondContact NH2-OG 3Å; A1211-S1215 WeakPolarHBondContact O-CB 3.24Å; A1211-S1215 PolarHBondContact O-OG 2.68Å; T1212-S1215 PolarHBondContact O-OG 3.15Å; M1213-S1215 VanDerWaalsContact C-N 3.3Å; M1213-S1215 PolarHBondContact O-N 3.12Å; S1215-A1219 WeakPolarHBondContact O-CB 3.37Å; S1215-A1219 PolarHBondContact O-N 2.66Å
1216	A	86.8	Confident	87.5	Confident	2 Å²	2	18.3 Å²	18.3	2%	0.017	9%	0.093	C	C	.	.	H	α-helix	trans	-71.1	-46.6	175.9	0	0	0	0	0	111.6	L721 M1213 F1218 A1219 G1220	L721-A1216 HydrophobicContact CD2-CB 3.7Å; M1213-A1216 WeakPolarHBondContact O-CB 3.48Å; M1213-A1216 PolarHBondContact O-N 3.37Å; M1213-A1216 HydrophobicContact SD-CB 4.35Å; A1216-F1218 PolarHBondContact O-N 3.45Å; A1216-A1219 PolarHBondContact O-N 3.07Å; A1216-G1220 PolarHBondContact O-N 2.8Å
1217	V	88.1	Confident	87.3	Confident	0 Å²	0	19.5 Å²	19.5	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-65.2	-37.9	178.2	173.2	0	0	0	0	111.6	F1186 H1189 M1213 V1221 A1222 L1260	F1186-V1217 HydrophobicContact CD1-CG1 3.75Å; F1186-V1217 HydrophobicContact CE1-CG1 4.3Å; H1189-V1217 HydrophobicContact CB-CG2 3.99Å; M1213-V1217 HydrophobicContact CG-CG2 4.09Å; M1213-V1217 WeakPolarHBondContact O-CG2 3.03Å; M1213-V1217 PolarHBondContact O-N 2.02Å; M1213-V1217 HydrophobicContact SD-CG2 4.38Å; V1217-V1221 HydrophobicContact CG1-CB 4.38Å; V1217-V1221 HydrophobicContact CG1-CG2 4.05Å; V1217-V1221 WeakPolarHBondContact O-CB 3.2Å; V1217-V1221 PolarHBondContact O-N 3.03Å; V1217-A1222 PolarHBondContact O-N 2.82Å; V1217-L1260 HydrophobicContact CB-CD2 4.43Å; V1217-L1260 HydrophobicContact CG1-CD2 4.29Å
1218	F	89.6	Confident	87	Confident	56 Å²	56	16.6 Å²	16.6	25%	0.246	9%	0.088	C	C	.	.	I	π-helix	trans	-65.6	-45.2	175.4	-179.5	-101.2	0	0	0	112.3	L831 M835 G1214 A1216 A1222 M1223 M1256 L1260	L831-F1218 HydrophobicContact CD2-CD1 3.96Å; L831-F1218 HydrophobicContact CD2-CE1 4.24Å; M835-F1218 HydrophobicContact CE-CB 4.44Å; M835-F1218 HydrophobicContact CE-CG 4.42Å; G1214-F1218 VanDerWaalsContact O-CB 3.24Å; G1214-F1218 WeakPolarHBondContact O-CB 3.49Å; G1214-F1218 PolarHBondContact O-N 3.49Å; A1216-F1218 PolarHBondContact O-N 3.45Å; F1218-A1222 HydrophobicContact CD2-CB 4.19Å; F1218-A1222 WeakPolarHBondContact O-CB 3.4Å; F1218-A1222 PolarHBondContact O-N 2.84Å; F1218-M1223 HydrophobicContact CD1-CG 4.44Å; F1218-M1223 HydrophobicContact CE1-CG 4.07Å; F1218-M1223 HydrophobicContact CE1-SD 4.47Å; F1218-M1223 HydrophobicContact CZ-CG 4.28Å; F1218-M1223 HydrophobicContact CZ-SD 4.23Å; F1218-M1223 WeakPolarHBondContact O-CG 3.44Å; F1218-M1223 PolarHBondContact O-N 3.5Å; F1218-M1256 HydrophobicContact CD2-SD 4.07Å; F1218-M1256 HydrophobicContact CE2-SD 3.79Å; F1218-L1260 HydrophobicContact CB-CD1 3.85Å; F1218-L1260 HydrophobicContact CD2-CD1 3.79Å; F1218-L1260 HydrophobicContact CG-CD1 4.28Å
1219	A	85.4	Confident	87	Confident	4 Å²	4	13.7 Å²	13.7	3%	0.033	7%	0.074	C	C	.	.	I	π-helix	trans	-78.7	-32	-177.2	0	0	0	0	0	113.8	Y648 F717 L831 S1215 A1216	Y648-A1219 PolarHBondContact OH-O 3.18Å; F717-A1219 HydrophobicContact CE1-CB 3.58Å; F717-A1219 HydrophobicContact CZ-CB 3.92Å; L831-A1219 HydrophobicContact CD1-CB 3.93Å; S1215-A1219 WeakPolarHBondContact O-CB 3.37Å; S1215-A1219 PolarHBondContact O-N 2.66Å; A1216-A1219 PolarHBondContact O-N 3.07Å
1220	G	81.4	Confident	87	Confident	0 Å²	0	18 Å²	18	0%	0	10%	0.097	C	C	.	.	I	π-helix	trans	-74.2	-97.4	166	0	0	0	0	0	108.8	A1216 A1222 M1223 T1224	A1216-G1220 PolarHBondContact O-N 2.8Å; G1220-A1222 PolarHBondContact O-N 3.32Å; G1220-A1222 VanDerWaalsContact O-N 3.15Å; G1220-M1223 PolarHBondContact O-N 3Å; G1220-T1224 WeakPolarHBondContact O-CB 3Å; G1220-T1224 VanDerWaalsContact O-CG2 3.27Å; G1220-T1224 WeakPolarHBondContact O-CG2 3.41Å; G1220-T1224 PolarHBondContact O-N 3.18Å; G1220-T1224 PolarHBondContact O-OG1 3.18Å
1221	V	82	Confident	86.9	Confident	0 Å²	0	19 Å²	19	0%	0	10%	0.103	C	C	.	.	I	π-helix	trans	-46.3	-49.6	-168.2	-164.3	0	0	0	0	116	D714 E1185 F1186 V1217 T1224 N1225	D714-V1221 HydrophobicContact CB-CG2 4.15Å; D714-V1221 VanDerWaalsContact CG-CA 3.48Å; D714-V1221 VanDerWaalsContact OD1-CA 3.28Å; D714-V1221 WeakPolarHBondContact OD1-CA 3.41Å; D714-V1221 PolarHBondContact OD1-N 3.25Å; D714-V1221 VanDerWaalsContact OD2-CA 3.29Å; D714-V1221 WeakPolarHBondContact OD2-CA 3.34Å; D714-V1221 WeakPolarHBondContact OD2-CG1 3.38Å; D714-V1221 WeakPolarHBondContact OD2-CG2 3.35Å; E1185-V1221 HydrophobicContact CB-CG1 4.34Å; E1185-V1221 HydrophobicContact CB-CG2 4.23Å; F1186-V1221 HydrophobicContact CD1-CB 4.38Å; F1186-V1221 HydrophobicContact CD1-CG1 4.12Å; F1186-V1221 HydrophobicContact CD2-CG1 4.08Å; F1186-V1221 HydrophobicContact CE1-CB 3.83Å; F1186-V1221 HydrophobicContact CE1-CG1 3.58Å; F1186-V1221 HydrophobicContact CE2-CG1 3.55Å; F1186-V1221 HydrophobicContact CG-CG1 4.35Å; F1186-V1221 HydrophobicContact CZ-CB 4Å; F1186-V1221 HydrophobicContact CZ-CG1 3.27Å; V1217-V1221 HydrophobicContact CG1-CB 4.38Å; V1217-V1221 HydrophobicContact CG1-CG2 4.05Å; V1217-V1221 WeakPolarHBondContact O-CB 3.2Å; V1217-V1221 PolarHBondContact O-N 3.03Å; V1221-T1224 PolarHBondContact O-OG1 2.9Å; V1221-N1225 WeakPolarHBondContact O-CB 2.96Å; V1221-N1225 PolarHBondContact O-ND2 2.65Å
1222	A	84.6	Confident	86.9	Confident	0 Å²	0	18.7 Å²	18.7	0%	0	10%	0.1	C	C	.	.	I	π-helix	trans	-75.5	-44.6	-174.5	0	0	0	0	0	112.2	F1186 V1217 F1218 G1220 L1226 M1256	F1186-A1222 HydrophobicContact CE1-CB 4.36Å; V1217-A1222 PolarHBondContact O-N 2.82Å; F1218-A1222 HydrophobicContact CD2-CB 4.19Å; F1218-A1222 WeakPolarHBondContact O-CB 3.4Å; F1218-A1222 PolarHBondContact O-N 2.84Å; G1220-A1222 PolarHBondContact O-N 3.32Å; G1220-A1222 VanDerWaalsContact O-N 3.15Å; A1222-L1226 WeakPolarHBondContact O-CB 3.39Å; A1222-L1226 WeakPolarHBondContact O-CD1 3.28Å; A1222-L1226 WeakPolarHBondContact O-CG 3.33Å; A1222-L1226 PolarHBondContact O-N 3.44Å; A1222-L1226 VanDerWaalsContact O-N 3.1Å; A1222-M1256 HydrophobicContact CB-CG 4.46Å; A1222-M1256 HydrophobicContact CB-SD 4.12Å
1223	M	86.2	Confident	87	Confident	63 Å²	63	17.7 Å²	17.7	31%	0.31	10%	0.098	S	C	.	.	H	α-helix	trans	-86.2	-17.4	-172.4	-68.9	-62.7	-57.2	0	0	113.9	Y648 F1218 G1220 L1226 P1227	Y648-M1223 HydrophobicContact CE1-CB 4.11Å; Y648-M1223 HydrophobicContact CE2-CB 4.03Å; Y648-M1223 HydrophobicContact CE2-CE 4.41Å; Y648-M1223 VanDerWaalsContact CZ-CB 3.48Å; Y648-M1223 WeakPolarHBondContact OH-CB 3.37Å; F1218-M1223 HydrophobicContact CD1-CG 4.44Å; F1218-M1223 HydrophobicContact CE1-CG 4.07Å; F1218-M1223 HydrophobicContact CE1-SD 4.47Å; F1218-M1223 HydrophobicContact CZ-CG 4.28Å; F1218-M1223 HydrophobicContact CZ-SD 4.23Å; F1218-M1223 WeakPolarHBondContact O-CG 3.44Å; F1218-M1223 PolarHBondContact O-N 3.5Å; G1220-M1223 PolarHBondContact O-N 3Å; M1223-L1226 HydrophobicContact SD-CD1 4.46Å; M1223-P1227 WeakPolarHBondContact O-CD 3.26Å; M1223-P1227 VanDerWaalsContact O-CG 3.23Å; M1223-P1227 WeakPolarHBondContact O-CG 3.43Å
1224	T	85.5	Confident	87.1	Confident	2 Å²	2	24 Å²	24	1%	0.012	13%	0.125	C	C	.	.	H	α-helix	trans	-72.3	-44.5	167.1	52.5	0	0	0	0	111	Y648 A713 D714 G1220 V1221	Y648-T1224 HydrophobicContact CD1-CG2 4.04Å; Y648-T1224 HydrophobicContact CE1-CG2 3.76Å; A713-T1224 HydrophobicContact CB-CG2 4.47Å; D714-T1224 PolarHBondContact OD1-OG1 2.74Å; G1220-T1224 WeakPolarHBondContact O-CB 3Å; G1220-T1224 VanDerWaalsContact O-CG2 3.27Å; G1220-T1224 WeakPolarHBondContact O-CG2 3.41Å; G1220-T1224 PolarHBondContact O-N 3.18Å; G1220-T1224 PolarHBondContact O-OG1 3.18Å; V1221-T1224 PolarHBondContact O-OG1 2.9Å
1225	N	84.9	Confident	87	Confident	7 Å²	7	24 Å²	24	4%	0.037	13%	0.125	C	C	.	.	H	α-helix	trans	-76.6	-42	-174.5	-72	-38.5	0	0	0	113.6	A710 V1221 G1228 I1229 T1252	A710-N1225 WeakPolarHBondContact CB-OD1 3.19Å; V1221-N1225 WeakPolarHBondContact O-CB 2.96Å; V1221-N1225 PolarHBondContact O-ND2 2.65Å; N1225-G1228 PolarHBondContact O-N 3.08Å; N1225-I1229 HydrophobicContact CB-CD1 4.25Å; N1225-I1229 VanDerWaalsContact O-CG1 3.26Å; N1225-I1229 WeakPolarHBondContact O-CG1 3.41Å; N1225-I1229 PolarHBondContact O-N 3.04Å; N1225-T1252 HydrophobicContact CB-CG2 4.1Å
1226	L	89.1	Confident	86.8	Confident	32 Å²	32	30.1 Å²	30.1	17%	0.168	15%	0.151	C	C	.	.	H	α-helix	trans	-57	-50.8	-175.2	-80.9	168.5	0	0	0	114	A1222 M1223 G1228 I1229 L1230 L1249 T1252 L1253	A1222-L1226 WeakPolarHBondContact O-CB 3.39Å; A1222-L1226 WeakPolarHBondContact O-CD1 3.28Å; A1222-L1226 WeakPolarHBondContact O-CG 3.33Å; A1222-L1226 PolarHBondContact O-N 3.44Å; A1222-L1226 VanDerWaalsContact O-N 3.1Å; M1223-L1226 HydrophobicContact SD-CD1 4.46Å; L1226-G1228 VanDerWaalsContact C-N 3.32Å; L1226-G1228 PolarHBondContact O-N 2.95Å; L1226-I1229 PolarHBondContact O-N 2.79Å; L1226-L1230 WeakPolarHBondContact O-CB 2.9Å; L1226-L1230 VanDerWaalsContact O-CG 3.25Å; L1226-L1230 WeakPolarHBondContact O-CG 3.18Å; L1226-L1230 PolarHBondContact O-N 3.37Å; L1226-L1249 HydrophobicContact CD2-CD1 3.89Å; L1226-T1252 HydrophobicContact CD2-CG2 4.44Å; L1226-T1252 HydrophobicContact CG-CG2 4.25Å; L1226-L1253 HydrophobicContact CD2-CD2 4.25Å
1227	P	86.6	Confident	86.6	Confident	27 Å²	27	30.3 Å²	30.3	18%	0.175	15%	0.153	C	C	.	.	H	α-helix	trans	-61.1	-40.6	179.3	-23	34.5	0	0	0	112.5	V644 M1223 L1230 V1231	V644-P1227 HydrophobicContact CG1-CB 3.68Å; M1223-P1227 WeakPolarHBondContact O-CD 3.26Å; M1223-P1227 VanDerWaalsContact O-CG 3.23Å; M1223-P1227 WeakPolarHBondContact O-CG 3.43Å; P1227-L1230 PolarHBondContact O-N 3.15Å; P1227-V1231 WeakPolarHBondContact O-CG2 3.41Å; P1227-V1231 PolarHBondContact O-N 2.88Å
1228	G	84.7	Confident	86.5	Confident	0 Å²	0	32 Å²	32	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-61.6	-45.8	178.3	0	0	0	0	0	112.4	S641 N1225 L1226	S641-G1228 WeakPolarHBondContact OG-CA 3.43Å; S641-G1228 PolarHBondContact OG-O 3.02Å; N1225-G1228 PolarHBondContact O-N 3.08Å; L1226-G1228 VanDerWaalsContact C-N 3.32Å; L1226-G1228 PolarHBondContact O-N 2.95Å
1229	I	89.6	Confident	86.3	Confident	3 Å²	3	31.2 Å²	31.2	2%	0.015	16%	0.159	C	C	.	.	H	α-helix	trans	-66.7	-42.3	178.2	-63.8	165.1	0	0	0	110.9	F706 N1225 L1226 V1231 L1232 F1245 N1248 L1249 T1252	F706-I1229 HydrophobicContact CE1-CG1 4.46Å; F706-I1229 HydrophobicContact CZ-CG1 3.84Å; N1225-I1229 HydrophobicContact CB-CD1 4.25Å; N1225-I1229 VanDerWaalsContact O-CG1 3.26Å; N1225-I1229 WeakPolarHBondContact O-CG1 3.41Å; N1225-I1229 PolarHBondContact O-N 3.04Å; L1226-I1229 PolarHBondContact O-N 2.79Å; I1229-V1231 PolarHBondContact O-N 3.46Å; I1229-L1232 VanDerWaalsContact O-CB 3.3Å; I1229-L1232 WeakPolarHBondContact O-CB 2.87Å; I1229-L1232 PolarHBondContact O-N 3.06Å; I1229-F1245 HydrophobicContact CG2-CD2 3.9Å; I1229-F1245 HydrophobicContact CG2-CE2 4.38Å; I1229-F1245 VanDerWaalsContact O-CD2 3.27Å; I1229-F1245 WeakPolarHBondContact O-CD2 3.12Å; I1229-N1248 HydrophobicContact CD1-CB 3.88Å; I1229-N1248 HydrophobicContact CG1-CB 4.15Å; I1229-N1248 HydrophobicContact CG2-CB 4.46Å; I1229-L1249 HydrophobicContact CG2-CB 3.97Å; I1229-T1252 VanDerWaalsContact CD1-OG1 3.29Å; I1229-T1252 WeakPolarHBondContact CD1-OG1 3.42Å
1230	L	91.1	Very high	86.3	Confident	92 Å²	92	31.4 Å²	31.4	48%	0.482	16%	0.16	S	C	.	.	H	α-helix	trans	-61.4	-31.7	-178.8	-74.5	172.5	0	0	0	113.1	L1226 P1227 L1232 A1233 F1245	L1226-L1230 WeakPolarHBondContact O-CB 2.9Å; L1226-L1230 VanDerWaalsContact O-CG 3.25Å; L1226-L1230 WeakPolarHBondContact O-CG 3.18Å; L1226-L1230 PolarHBondContact O-N 3.37Å; P1227-L1230 PolarHBondContact O-N 3.15Å; L1230-L1232 VanDerWaalsContact C-N 3.29Å; L1230-L1232 PolarHBondContact O-N 3.13Å; L1230-A1233 WeakPolarHBondContact O-CB 3.37Å; L1230-A1233 PolarHBondContact O-N 2.99Å; L1230-F1245 HydrophobicContact CD2-CE2 4.43Å
1231	V	90.3	Very high	86.6	Confident	21 Å²	21	33 Å²	33	13%	0.127	17%	0.167	C	C	.	.	H	α-helix	trans	-65.8	-33.4	174.4	175.5	0	0	0	0	111.6	I637 I640 V644 P1227 I1229 A1233 F1234	I637-V1231 HydrophobicContact CG2-CG1 4.1Å; I640-V1231 HydrophobicContact CB-CG1 4.33Å; I640-V1231 HydrophobicContact CG2-CG1 4Å; V644-V1231 HydrophobicContact CB-CG2 4.48Å; V644-V1231 HydrophobicContact CG2-CG2 4.14Å; P1227-V1231 WeakPolarHBondContact O-CG2 3.41Å; P1227-V1231 PolarHBondContact O-N 2.88Å; I1229-V1231 PolarHBondContact O-N 3.46Å; V1231-A1233 PolarHBondContact O-N 3.09Å; V1231-A1233 VanDerWaalsContact O-N 3.14Å; V1231-F1234 PolarHBondContact O-N 3.44Å; V1231-F1234 VanDerWaalsContact O-N 3.12Å
1232	L	87.4	Confident	86.9	Confident	1 Å²	1	34.1 Å²	34.1	1%	0.005	17%	0.173	C	C	.	.	H	α-helix	trans	-65.6	-15.2	177.6	-56	178.4	0	0	0	113	F638 F706 I1229 L1230 F1234 A1235 F1245	F638-L1232 HydrophobicContact CD1-CD2 3.79Å; F638-L1232 HydrophobicContact CE1-CD1 4.49Å; F638-L1232 HydrophobicContact CE1-CD2 3.56Å; F638-L1232 HydrophobicContact CG-CD2 4.47Å; F638-L1232 HydrophobicContact CZ-CD2 4.07Å; F706-L1232 HydrophobicContact CE2-CD1 4.39Å; F706-L1232 HydrophobicContact CZ-CD1 4.25Å; I1229-L1232 VanDerWaalsContact O-CB 3.3Å; I1229-L1232 WeakPolarHBondContact O-CB 2.87Å; I1229-L1232 PolarHBondContact O-N 3.06Å; L1230-L1232 VanDerWaalsContact C-N 3.29Å; L1230-L1232 PolarHBondContact O-N 3.13Å; L1232-F1234 PolarHBondContact O-N 2.82Å; L1232-F1234 VanDerWaalsContact O-N 3.16Å; L1232-A1235 VanDerWaalsContact O-CB 3.27Å; L1232-A1235 WeakPolarHBondContact O-CB 3.03Å; L1232-A1235 PolarHBondContact O-N 3.43Å; L1232-A1235 VanDerWaalsContact O-N 3.11Å; L1232-F1245 HydrophobicContact CB-CB 4.08Å
1233	A	89.8	Confident	87.1	Confident	34 Å²	34	34.2 Å²	34.2	28%	0.281	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-24.3	172.3	0	0	0	0	0	112.7	L1230 V1231 F1245	L1230-A1233 WeakPolarHBondContact O-CB 3.37Å; L1230-A1233 PolarHBondContact O-N 2.99Å; V1231-A1233 PolarHBondContact O-N 3.09Å; V1231-A1233 VanDerWaalsContact O-N 3.14Å; A1233-F1245 HydrophobicContact CB-CD1 4.22Å; A1233-F1245 HydrophobicContact CB-CD2 3.94Å; A1233-F1245 HydrophobicContact CB-CE1 3.93Å; A1233-F1245 HydrophobicContact CB-CE2 3.64Å; A1233-F1245 HydrophobicContact CB-CG 4.22Å; A1233-F1245 HydrophobicContact CB-CZ 3.63Å
1234	F	90	Very high	87.2	Confident	158 Å²	158	31.9 Å²	31.9	69%	0.693	16%	0.161	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.6	0.7	179.8	-59.2	-72.5	0	0	0	114.1	V1231 L1232	V1231-F1234 PolarHBondContact O-N 3.44Å; V1231-F1234 VanDerWaalsContact O-N 3.12Å; L1232-F1234 PolarHBondContact O-N 2.82Å; L1232-F1234 VanDerWaalsContact O-N 3.16Å
1235	A	85.9	Confident	87.5	Confident	2 Å²	2	33.3 Å²	33.3	2%	0.017	17%	0.167	C	C	.	.			trans	-55.7	146.8	176.4	0	0	0	0	0	111.7	L1232 I1240 Q1241	L1232-A1235 VanDerWaalsContact O-CB 3.27Å; L1232-A1235 WeakPolarHBondContact O-CB 3.03Å; L1232-A1235 PolarHBondContact O-N 3.43Å; L1232-A1235 VanDerWaalsContact O-N 3.11Å; A1235-I1240 HydrophobicContact CB-CB 4.02Å; A1235-I1240 HydrophobicContact CB-CG2 3.67Å; A1235-Q1241 HydrophobicContact CB-CG 4.32Å; A1235-Q1241 WeakPolarHBondContact O-CG 3.3Å; A1235-Q1241 PolarHBondContact O-NE2 3.28Å
1236	K	83.9	Confident	87.9	Confident	128 Å²	128	36.4 Å²	36.4	56%	0.557	18%	0.178	S	C	*	.	S	Bend	trans	-85.2	-31.3	179.5	-65.4	-64.7	-174.6	177.1	0	112.2	D634	D634-K1236 PolarHBondContact OD1-N 3.47Å
1237	A	82.1	Confident	88	Confident	7 Å²	7	34.9 Å²	34.9	6%	0.058	17%	0.17	C	C	.	.	B	Isolated β-bridge	trans	-64.9	130.7	174.8	0	0	0	0	0	112.7	T630 D634 L1239 I1240 Q1241	T630-A1237 HydrophobicContact CG2-CB 3.44Å; T630-A1237 VanDerWaalsContact CG2-CB 3.44Å; D634-A1237 WeakPolarHBondContact OD2-CB 3.36Å; D634-A1237 PolarHBondContact OD2-N 3.36Å; A1237-L1239 VanDerWaalsContact C-N 3.31Å; A1237-L1239 PolarHBondContact O-N 2.98Å; A1237-I1240 HydrophobicContact CB-CB 4.04Å; A1237-I1240 HydrophobicContact CB-CD1 4.07Å; A1237-I1240 HydrophobicContact CB-CG1 3.86Å; A1237-I1240 PolarHBondContact O-N 2.89Å; A1237-Q1241 WeakPolarHBondContact O-CG 3.32Å; A1237-Q1241 PolarHBondContact O-N 2.77Å; A1237-Q1241 VanDerWaalsContact O-N 3.1Å
1238	Q	85.4	Confident	88.2	Confident	36 Å²	36	34.1 Å²	34.1	17%	0.168	17%	0.165	C	C	.	.	H	α-helix	trans	-63.2	-39.9	170.1	-63.7	-167.7	-4.2	0	0	111.6	L878 K882 I1240 Q1241 I1242	L878-Q1238 WeakPolarHBondContact O-CB 3.42Å; K882-Q1238 HydrophobicContact CD-CG 4.39Å; K882-Q1238 HydrophobicContact CG-CG 3.71Å; Q1238-I1240 VanDerWaalsContact C-N 3.32Å; Q1238-I1240 PolarHBondContact O-N 3.03Å; Q1238-Q1241 PolarHBondContact O-N 3.34Å; Q1238-I1242 WeakPolarHBondContact O-CB 3.49Å; Q1238-I1242 WeakPolarHBondContact O-CG1 3Å; Q1238-I1242 PolarHBondContact O-N 2.83Å
1239	L	85.4	Confident	88.5	Confident	38 Å²	38	35.3 Å²	35.3	20%	0.199	17%	0.171	C	C	.	.	H	α-helix	trans	-55.4	-45.6	176.9	-167.1	156.7	0	0	0	111.8	L878 V1171 A1237 F1243 F1244	L878-L1239 PolarHBondContact O-N 2.93Å; V1171-L1239 HydrophobicContact CG1-CD2 4.42Å; A1237-L1239 VanDerWaalsContact C-N 3.31Å; A1237-L1239 PolarHBondContact O-N 2.98Å; L1239-F1243 HydrophobicContact CG-CD2 4.03Å; L1239-F1243 WeakPolarHBondContact O-CB 3.49Å; L1239-F1243 WeakPolarHBondContact O-CD2 3.46Å; L1239-F1243 PolarHBondContact O-N 2.78Å; L1239-F1244 HydrophobicContact CD2-CD2 4.18Å; L1239-F1244 HydrophobicContact CD2-CE2 3.78Å
1240	I	85.8	Confident	88.7	Confident	9 Å²	9	35.8 Å²	35.8	5%	0.046	17%	0.174	C	C	.	.	I	π-helix	trans	-70.1	-44.6	178.5	-60.9	-179.8	0	0	0	111.3	D634 F638 A1235 A1237 Q1238 I1242 F1244 F1245	D634-I1240 HydrophobicContact CB-CD1 4.05Å; D634-I1240 WeakPolarHBondContact OD2-CD1 3.49Å; F638-I1240 HydrophobicContact CE2-CD1 3.83Å; F638-I1240 HydrophobicContact CZ-CD1 4.09Å; F638-I1240 HydrophobicContact CZ-CG2 4.34Å; A1235-I1240 HydrophobicContact CB-CB 4.02Å; A1235-I1240 HydrophobicContact CB-CG2 3.67Å; A1237-I1240 HydrophobicContact CB-CB 4.04Å; A1237-I1240 HydrophobicContact CB-CD1 4.07Å; A1237-I1240 HydrophobicContact CB-CG1 3.86Å; A1237-I1240 PolarHBondContact O-N 2.89Å; Q1238-I1240 VanDerWaalsContact C-N 3.32Å; Q1238-I1240 PolarHBondContact O-N 3.03Å; I1240-I1242 VanDerWaalsContact C-N 3.33Å; I1240-I1242 PolarHBondContact O-N 3.2Å; I1240-F1244 HydrophobicContact CG1-CD2 4.42Å; I1240-F1244 HydrophobicContact CG2-CB 4.19Å; I1240-F1244 WeakPolarHBondContact O-CA 3.09Å; I1240-F1244 WeakPolarHBondContact O-CB 3.35Å; I1240-F1244 PolarHBondContact O-N 2.97Å; I1240-F1245 PolarHBondContact O-N 2.8Å
1241	Q	88.1	Confident	88.8	Confident	34 Å²	34	31.4 Å²	31.4	16%	0.159	15%	0.151	C	C	.	.	I	π-helix	trans	-59.9	-41.5	178.4	-73.8	-172.9	-8.5	0	0	112.8	A1235 A1237 Q1238 F1245 R1246	A1235-Q1241 HydrophobicContact CB-CG 4.32Å; A1235-Q1241 WeakPolarHBondContact O-CG 3.3Å; A1235-Q1241 PolarHBondContact O-NE2 3.28Å; A1237-Q1241 WeakPolarHBondContact O-CG 3.32Å; A1237-Q1241 PolarHBondContact O-N 2.77Å; A1237-Q1241 VanDerWaalsContact O-N 3.1Å; Q1238-Q1241 PolarHBondContact O-N 3.34Å; Q1241-F1245 WeakPolarHBondContact O-CB 3.19Å; Q1241-R1246 WeakPolarHBondContact O-CG 3.37Å; Q1241-R1246 PolarHBondContact O-N 3.16Å
1242	I	88.9	Confident	88.9	Confident	23 Å²	23	30.5 Å²	30.5	12%	0.118	15%	0.146	C	C	.	.	I	π-helix	trans	-84.4	-55.5	-175.4	-61.8	172.7	0	0	0	110.6	L878 I1166 Q1238 I1240 R1246	L878-I1242 HydrophobicContact CD2-CD1 3.8Å; I1166-I1242 HydrophobicContact CG1-CG2 4.15Å; I1166-I1242 HydrophobicContact CG2-CG2 4.34Å; Q1238-I1242 WeakPolarHBondContact O-CB 3.49Å; Q1238-I1242 WeakPolarHBondContact O-CG1 3Å; Q1238-I1242 PolarHBondContact O-N 2.83Å; I1240-I1242 VanDerWaalsContact C-N 3.33Å; I1240-I1242 PolarHBondContact O-N 3.2Å; I1242-R1246 WeakPolarHBondContact O-CB 3.49Å
1243	F	89.4	Confident	89.2	Confident	1 Å²	1	34 Å²	34	0%	0.004	16%	0.164	C	C	.	.	I	π-helix	trans	-86.3	-25.6	-169.8	-62.2	-74.6	0	0	0	114.3	L874 I1166 D1167 N1169 V1171 A1172 N1175 L1239 L1247	L874-F1243 HydrophobicContact CD1-CE2 3.5Å; L874-F1243 VanDerWaalsContact CD1-CE2 3.5Å; L874-F1243 HydrophobicContact CD1-CZ 3.56Å; I1166-F1243 HydrophobicContact CG2-CD1 3.84Å; I1166-F1243 HydrophobicContact CG2-CE1 3.78Å; D1167-F1243 WeakPolarHBondContact O-CE1 3.27Å; N1169-F1243 WeakPolarHBondContact ND2-CE1 3.18Å; N1169-F1243 WeakPolarHBondContact ND2-CZ 3.27Å; V1171-F1243 HydrophobicContact CG1-CB 3.75Å; V1171-F1243 HydrophobicContact CG1-CG 4.21Å; A1172-F1243 HydrophobicContact CB-CD1 4.36Å; N1175-F1243 PolarHBondContact ND2-O 2.95Å; L1239-F1243 HydrophobicContact CG-CD2 4.03Å; L1239-F1243 WeakPolarHBondContact O-CB 3.49Å; L1239-F1243 WeakPolarHBondContact O-CD2 3.46Å; L1239-F1243 PolarHBondContact O-N 2.78Å; F1243-L1247 WeakPolarHBondContact O-CB 3.3Å
1244	F	87.9	Confident	89.4	Confident	14 Å²	14	33.4 Å²	33.4	6%	0.061	16%	0.156	C	C	.	.	I	π-helix	trans	-102.3	-51.9	179.5	-71	-85	0	0	0	111.8	V703 V1171 L1239 I1240 N1248	V703-F1244 HydrophobicContact CB-CE1 4.14Å; V703-F1244 HydrophobicContact CG1-CD1 4.38Å; V703-F1244 HydrophobicContact CG1-CE1 3.61Å; V703-F1244 HydrophobicContact CG1-CZ 4.41Å; V703-F1244 HydrophobicContact CG2-CD1 4.15Å; V703-F1244 HydrophobicContact CG2-CE1 3.32Å; V703-F1244 HydrophobicContact CG2-CE2 4.38Å; V703-F1244 HydrophobicContact CG2-CZ 3.45Å; V703-F1244 VanDerWaalsContact CG2-CZ 3.45Å; V1171-F1244 HydrophobicContact CG1-CE2 3.75Å; V1171-F1244 HydrophobicContact CG1-CZ 3.92Å; L1239-F1244 HydrophobicContact CD2-CD2 4.18Å; L1239-F1244 HydrophobicContact CD2-CE2 3.78Å; I1240-F1244 HydrophobicContact CG1-CD2 4.42Å; I1240-F1244 HydrophobicContact CG2-CB 4.19Å; I1240-F1244 WeakPolarHBondContact O-CA 3.09Å; I1240-F1244 WeakPolarHBondContact O-CB 3.35Å; I1240-F1244 PolarHBondContact O-N 2.97Å; F1244-N1248 WeakPolarHBondContact O-CB 3.39Å; F1244-N1248 PolarHBondContact O-N 3.3Å; F1244-N1248 VanDerWaalsContact O-N 3.09Å; F1244-N1248 PolarHBondContact O-ND2 2.87Å; F1244-N1248 VanDerWaalsContact O-ND2 3.08Å
1245	F	91.1	Very high	89.6	Confident	32 Å²	32	25.9 Å²	25.9	14%	0.14	12%	0.123	C	C	.	.	I	π-helix	trans	-66	-61.2	-179.5	163.6	-112.4	0	0	0	112.4	I1229 L1230 L1232 A1233 I1240 Q1241 L1247 L1249	I1229-F1245 HydrophobicContact CG2-CD2 3.9Å; I1229-F1245 HydrophobicContact CG2-CE2 4.38Å; I1229-F1245 VanDerWaalsContact O-CD2 3.27Å; I1229-F1245 WeakPolarHBondContact O-CD2 3.12Å; L1230-F1245 HydrophobicContact CD2-CE2 4.43Å; L1232-F1245 HydrophobicContact CB-CB 4.08Å; A1233-F1245 HydrophobicContact CB-CD1 4.22Å; A1233-F1245 HydrophobicContact CB-CD2 3.94Å; A1233-F1245 HydrophobicContact CB-CE1 3.93Å; A1233-F1245 HydrophobicContact CB-CE2 3.64Å; A1233-F1245 HydrophobicContact CB-CG 4.22Å; A1233-F1245 HydrophobicContact CB-CZ 3.63Å; I1240-F1245 PolarHBondContact O-N 2.8Å; Q1241-F1245 WeakPolarHBondContact O-CB 3.19Å; F1245-L1247 PolarHBondContact O-N 2.85Å; F1245-L1249 HydrophobicContact CE2-CD2 4.21Å; F1245-L1249 HydrophobicContact CZ-CD2 4.14Å; F1245-L1249 WeakPolarHBondContact O-CB 3.29Å; F1245-L1249 PolarHBondContact O-N 2.9Å
1246	R	92.6	Very high	89.9	Confident	72 Å²	72	28 Å²	28	27%	0.272	13%	0.133	S	C	.	.	I	π-helix	trans	-62.6	-45.3	-176.4	-63.9	176.2	-174.3	-175.6	2.6	111.8	W1164 I1166 Q1241 I1242 L1249 V1250	W1164-R1246 HydrophobicContact CD2-CB 4.23Å; W1164-R1246 HydrophobicContact CD2-CG 4.16Å; W1164-R1246 HydrophobicContact CE3-CB 3.85Å; W1164-R1246 HydrophobicContact CE3-CG 4.19Å; W1164-R1246 HydrophobicContact CH2-CB 4.23Å; W1164-R1246 HydrophobicContact CH2-CG 4Å; W1164-R1246 HydrophobicContact CZ2-CG 3.97Å; W1164-R1246 HydrophobicContact CZ3-CB 3.84Å; W1164-R1246 HydrophobicContact CZ3-CG 4.11Å; W1164-R1246 PolarHBondContact O-NH1 3.14Å; I1166-R1246 HydrophobicContact CD1-CB 3.94Å; Q1241-R1246 WeakPolarHBondContact O-CG 3.37Å; Q1241-R1246 PolarHBondContact O-N 3.16Å; I1242-R1246 WeakPolarHBondContact O-CB 3.49Å; R1246-L1249 PolarHBondContact O-N 2.9Å; R1246-V1250 VanDerWaalsContact O-CG2 3.29Å; R1246-V1250 WeakPolarHBondContact O-CG2 3.31Å; R1246-V1250 PolarHBondContact O-N 2.88Å
1247	L	91.9	Very high	90.4	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-68.5	-46.9	-175.5	-166.7	54.8	0	0	0	112.2	T1157 M1161 I1166 N1175 F1243 F1245 L1249 V1250 I1251	T1157-L1247 HydrophobicContact CG2-CD1 3.87Å; M1161-L1247 HydrophobicContact CG-CD1 3.55Å; M1161-L1247 HydrophobicContact SD-CD1 3.8Å; I1166-L1247 HydrophobicContact CD1-CD1 4.5Å; N1175-L1247 HydrophobicContact CB-CD2 3.36Å; N1175-L1247 HydrophobicContact CB-CG 4.1Å; F1243-L1247 WeakPolarHBondContact O-CB 3.3Å; F1245-L1247 PolarHBondContact O-N 2.85Å; L1247-L1249 VanDerWaalsContact C-N 3.28Å; L1247-L1249 PolarHBondContact O-N 3.48Å; L1247-V1250 PolarHBondContact O-N 2.94Å; L1247-I1251 HydrophobicContact CG-CD1 4.02Å; L1247-I1251 WeakPolarHBondContact O-CD1 3.46Å; L1247-I1251 VanDerWaalsContact O-CG1 3.25Å; L1247-I1251 WeakPolarHBondContact O-CG1 3.35Å; L1247-I1251 PolarHBondContact O-N 3.06Å
1248	N	90	Very high	91	Very high	12 Å²	12	23 Å²	23	6%	0.064	12%	0.115	C	C	.	.	H	α-helix	trans	-67.1	-31.5	178	-65.8	-28.9	0	0	0	112.1	I1229 F1244 I1251 T1252	I1229-N1248 HydrophobicContact CD1-CB 3.88Å; I1229-N1248 HydrophobicContact CG1-CB 4.15Å; I1229-N1248 HydrophobicContact CG2-CB 4.46Å; F1244-N1248 WeakPolarHBondContact O-CB 3.39Å; F1244-N1248 PolarHBondContact O-N 3.3Å; F1244-N1248 VanDerWaalsContact O-N 3.09Å; F1244-N1248 PolarHBondContact O-ND2 2.87Å; F1244-N1248 VanDerWaalsContact O-ND2 3.08Å; N1248-I1251 PolarHBondContact O-N 2.94Å; N1248-T1252 WeakPolarHBondContact O-CB 3.3Å; N1248-T1252 PolarHBondContact O-N 2.87Å; N1248-T1252 PolarHBondContact O-OG1 2.93Å
1249	L	92.7	Very high	91.3	Very high	25 Å²	25	21.2 Å²	21.2	13%	0.131	11%	0.107	C	C	.	.	H	α-helix	trans	-62.1	-47.3	171.7	-177.8	67	0	0	0	111	W1164 L1226 I1229 F1245 R1246 L1247 T1252 L1253	W1164-L1249 HydrophobicContact CH2-CD2 4.11Å; W1164-L1249 HydrophobicContact CZ3-CD2 4.41Å; L1226-L1249 HydrophobicContact CD2-CD1 3.89Å; I1229-L1249 HydrophobicContact CG2-CB 3.97Å; F1245-L1249 HydrophobicContact CE2-CD2 4.21Å; F1245-L1249 HydrophobicContact CZ-CD2 4.14Å; F1245-L1249 WeakPolarHBondContact O-CB 3.29Å; F1245-L1249 PolarHBondContact O-N 2.9Å; R1246-L1249 PolarHBondContact O-N 2.9Å; L1247-L1249 VanDerWaalsContact C-N 3.28Å; L1247-L1249 PolarHBondContact O-N 3.48Å; L1249-T1252 PolarHBondContact O-N 2.79Å; L1249-L1253 HydrophobicContact CD1-CD1 4.09Å; L1249-L1253 HydrophobicContact CD1-CG 4.32Å; L1249-L1253 HydrophobicContact CG-CD1 3.99Å; L1249-L1253 WeakPolarHBondContact O-CB 3.25Å; L1249-L1253 VanDerWaalsContact O-CG 3.26Å; L1249-L1253 WeakPolarHBondContact O-CG 3.48Å; L1249-L1253 PolarHBondContact O-N 2.86Å
1250	V	94.1	Very high	91.7	Very high	12 Å²	12	19.7 Å²	19.7	7%	0.073	10%	0.099	C	C	.	.	H	α-helix	trans	-60.7	-47.7	176.4	169.9	0	0	0	0	111	T1157 V1160 W1164 R1246 L1247 T1252 L1253 L1254	T1157-V1250 HydrophobicContact CG2-CG1 4.22Å; V1160-V1250 HydrophobicContact CB-CG1 3.89Å; V1160-V1250 HydrophobicContact CG1-CB 4.4Å; V1160-V1250 HydrophobicContact CG1-CG1 3.76Å; V1160-V1250 HydrophobicContact CG1-CG2 3.64Å; V1160-V1250 HydrophobicContact CG2-CG1 4.46Å; W1164-V1250 HydrophobicContact CE3-CG2 3.81Å; W1164-V1250 HydrophobicContact CZ3-CG2 3.83Å; R1246-V1250 VanDerWaalsContact O-CG2 3.29Å; R1246-V1250 WeakPolarHBondContact O-CG2 3.31Å; R1246-V1250 PolarHBondContact O-N 2.88Å; L1247-V1250 PolarHBondContact O-N 2.94Å; V1250-T1252 VanDerWaalsContact C-N 3.33Å; V1250-T1252 PolarHBondContact O-N 2.94Å; V1250-L1253 PolarHBondContact O-N 3.38Å; V1250-L1254 HydrophobicContact CG1-CD1 3.6Å; V1250-L1254 HydrophobicContact CG1-CG 4.17Å; V1250-L1254 WeakPolarHBondContact O-CB 3.42Å; V1250-L1254 WeakPolarHBondContact O-CG 3.46Å; V1250-L1254 PolarHBondContact O-N 3.39Å
1251	I	92.7	Very high	92.1	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-56.6	-47.7	178.5	-68.8	161.6	0	0	0	110.7	T1157 A1179 L1247 N1248 G1255	T1157-I1251 HydrophobicContact CG2-CG1 3.79Å; A1179-I1251 HydrophobicContact CB-CB 4.35Å; A1179-I1251 HydrophobicContact CB-CD1 3.62Å; A1179-I1251 HydrophobicContact CB-CG1 3.66Å; A1179-I1251 HydrophobicContact CB-CG2 3.72Å; L1247-I1251 HydrophobicContact CG-CD1 4.02Å; L1247-I1251 WeakPolarHBondContact O-CD1 3.46Å; L1247-I1251 VanDerWaalsContact O-CG1 3.25Å; L1247-I1251 WeakPolarHBondContact O-CG1 3.35Å; L1247-I1251 PolarHBondContact O-N 3.06Å; N1248-I1251 PolarHBondContact O-N 2.94Å; I1251-G1255 WeakPolarHBondContact O-CA 3.39Å; I1251-G1255 PolarHBondContact O-N 2.79Å
1252	T	91.9	Very high	92.4	Very high	3 Å²	3	19.8 Å²	19.8	2%	0.018	10%	0.102	C	C	.	.	H	α-helix	trans	-67.5	-42.8	-177.7	-53.5	0	0	0	0	111.6	F1186 N1225 L1226 I1229 N1248 L1249 V1250 M1256	F1186-T1252 HydrophobicContact CZ-CG2 4.45Å; N1225-T1252 HydrophobicContact CB-CG2 4.1Å; L1226-T1252 HydrophobicContact CD2-CG2 4.44Å; L1226-T1252 HydrophobicContact CG-CG2 4.25Å; I1229-T1252 VanDerWaalsContact CD1-OG1 3.29Å; I1229-T1252 WeakPolarHBondContact CD1-OG1 3.42Å; N1248-T1252 WeakPolarHBondContact O-CB 3.3Å; N1248-T1252 PolarHBondContact O-N 2.87Å; N1248-T1252 PolarHBondContact O-OG1 2.93Å; L1249-T1252 PolarHBondContact O-N 2.79Å; V1250-T1252 VanDerWaalsContact C-N 3.33Å; V1250-T1252 PolarHBondContact O-N 2.94Å; T1252-M1256 VanDerWaalsContact O-CB 3.31Å; T1252-M1256 WeakPolarHBondContact O-CB 3.32Å; T1252-M1256 PolarHBondContact O-N 2.92Å
1253	L	93.9	Very high	92.6	Very high	75 Å²	75	18.7 Å²	18.7	39%	0.393	10%	0.096	S	C	.	.	H	α-helix	trans	-68.6	-42.6	179.5	-69.4	176.4	0	0	0	112.3	L1226 L1249 V1250 M1256 A1257	L1226-L1253 HydrophobicContact CD2-CD2 4.25Å; L1249-L1253 HydrophobicContact CD1-CD1 4.09Å; L1249-L1253 HydrophobicContact CD1-CG 4.32Å; L1249-L1253 HydrophobicContact CG-CD1 3.99Å; L1249-L1253 WeakPolarHBondContact O-CB 3.25Å; L1249-L1253 VanDerWaalsContact O-CG 3.26Å; L1249-L1253 WeakPolarHBondContact O-CG 3.48Å; L1249-L1253 PolarHBondContact O-N 2.86Å; V1250-L1253 PolarHBondContact O-N 3.38Å; L1253-M1256 HydrophobicContact CD2-CE 3.86Å; L1253-M1256 PolarHBondContact O-N 3.06Å; L1253-A1257 WeakPolarHBondContact O-CB 3.29Å; L1253-A1257 PolarHBondContact O-N 2.98Å
1254	L	94.6	Very high	92.8	Very high	21 Å²	21	18.7 Å²	18.7	11%	0.11	10%	0.096	C	C	.	.	H	α-helix	trans	-68.3	-42.3	175.5	-70.9	178.8	0	0	0	111.2	M859 I1153 D1156 V1160 V1250 M1256 A1257 H1258	M859-L1254 HydrophobicContact SD-CD2 4.43Å; I1153-L1254 HydrophobicContact CG2-CB 4.48Å; D1156-L1254 HydrophobicContact CB-CD1 3.86Å; D1156-L1254 HydrophobicContact CB-CD2 4.39Å; V1160-L1254 HydrophobicContact CG2-CD1 4.37Å; V1250-L1254 HydrophobicContact CG1-CD1 3.6Å; V1250-L1254 HydrophobicContact CG1-CG 4.17Å; V1250-L1254 WeakPolarHBondContact O-CB 3.42Å; V1250-L1254 WeakPolarHBondContact O-CG 3.46Å; V1250-L1254 PolarHBondContact O-N 3.39Å; L1254-M1256 VanDerWaalsContact C-N 3.32Å; L1254-M1256 PolarHBondContact O-N 3.1Å; L1254-A1257 PolarHBondContact O-N 3.13Å; L1254-H1258 WeakPolarHBondContact O-CB 3.5Å; L1254-H1258 PolarHBondContact O-CD2 2.88Å; L1254-H1258 VanDerWaalsContact O-CD2 3.25Å; L1254-H1258 PolarHBondContact O-N 2.98Å
1255	G	93	Very high	93.1	Very high	0 Å²	0	18 Å²	18	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-56.8	-45	173.8	0	0	0	0	0	112	I1251 G1259	I1251-G1255 WeakPolarHBondContact O-CA 3.39Å; I1251-G1255 PolarHBondContact O-N 2.79Å; G1255-G1259 WeakPolarHBondContact O-CA 3.5Å; G1255-G1259 PolarHBondContact O-N 2.95Å
1256	M	92.5	Very high	93.1	Very high	46 Å²	46	17 Å²	17	23%	0.227	9%	0.09	C	C	.	.	H	α-helix	trans	-63	-46.3	174.4	-178.9	-177	57	0	0	112.3	F1186 F1218 A1222 T1252 L1253 L1254 L1260	F1186-M1256 HydrophobicContact CE1-CB 4.3Å; F1218-M1256 HydrophobicContact CD2-SD 4.07Å; F1218-M1256 HydrophobicContact CE2-SD 3.79Å; A1222-M1256 HydrophobicContact CB-CG 4.46Å; A1222-M1256 HydrophobicContact CB-SD 4.12Å; T1252-M1256 VanDerWaalsContact O-CB 3.31Å; T1252-M1256 WeakPolarHBondContact O-CB 3.32Å; T1252-M1256 PolarHBondContact O-N 2.92Å; L1253-M1256 HydrophobicContact CD2-CE 3.86Å; L1253-M1256 PolarHBondContact O-N 3.06Å; L1254-M1256 VanDerWaalsContact C-N 3.32Å; L1254-M1256 PolarHBondContact O-N 3.1Å; M1256-L1260 HydrophobicContact CG-CD1 3.85Å; M1256-L1260 WeakPolarHBondContact O-CB 3.22Å; M1256-L1260 PolarHBondContact O-N 3.09Å
1257	A	94.6	Very high	93	Very high	29 Å²	29	13.7 Å²	13.7	24%	0.24	8%	0.077	C	C	.	.	H	α-helix	trans	-62.9	-46.2	179.4	0	0	0	0	0	111.5	F856 L1253 L1254 V1261 F1262	F856-A1257 HydrophobicContact CZ-CB 4.25Å; L1253-A1257 WeakPolarHBondContact O-CB 3.29Å; L1253-A1257 PolarHBondContact O-N 2.98Å; L1254-A1257 PolarHBondContact O-N 3.13Å; A1257-V1261 WeakPolarHBondContact O-CA 3.34Å; A1257-V1261 WeakPolarHBondContact O-CB 3.22Å; A1257-V1261 PolarHBondContact O-N 2.63Å; A1257-F1262 PolarHBondContact O-N 3.4Å
1258	H	94.8	Very high	93	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	8%	0.08	C	C	.	.	I	π-helix	trans	-69.9	-43.4	179.1	-81.6	-82.7	0	0	0	112.5	F856 T1149 I1153 D1156 L1254 F1262 L1263	F856-H1258 AromaticContact CD1-CE1 3.47Å; F856-H1258 VanDerWaalsContact CD1-CE1 3.47Å; F856-H1258 WeakPolarHBondContact CD1-CE1 3.34Å; F856-H1258 AromaticContact CD1-ND1 3.74Å; F856-H1258 AromaticContact CD1-NE2 3.99Å; F856-H1258 AromaticContact CE1-CE1 3.65Å; F856-H1258 AromaticContact CE1-CG 3.92Å; F856-H1258 AromaticContact CE1-ND1 3.67Å; F856-H1258 AromaticContact CE1-NE2 3.85Å; T1149-H1258 HydrophobicContact CG2-CB 4.05Å; I1153-H1258 HydrophobicContact CD1-CB 3.69Å; I1153-H1258 HydrophobicContact CG1-CB 3.44Å; I1153-H1258 VanDerWaalsContact CG1-CB 3.44Å; I1153-H1258 VanDerWaalsContact CG1-CG 3.47Å; D1156-H1258 IonicContact OD2-CD2 2.89Å; D1156-H1258 IonicContact OD2-CE1 2.61Å; D1156-H1258 PolarHBondContact OD2-CE1 3.3Å; D1156-H1258 VanDerWaalsContact OD2-CE1 3.25Å; D1156-H1258 IonicContact OD2-NE2 3.49Å; D1156-H1258 PolarHBondContact OD2-NE2 3.22Å; L1254-H1258 WeakPolarHBondContact O-CB 3.5Å; L1254-H1258 PolarHBondContact O-CD2 2.88Å; L1254-H1258 VanDerWaalsContact O-CD2 3.25Å; L1254-H1258 PolarHBondContact O-N 2.98Å; H1258-F1262 AromaticContact ND1-CD1 3.78Å; H1258-F1262 WeakPolarHBondContact O-CB 3.32Å; H1258-F1262 PolarHBondContact O-N 2.8Å; H1258-L1263 VanDerWaalsContact O-CB 3.3Å; H1258-L1263 WeakPolarHBondContact O-CB 3.5Å; H1258-L1263 PolarHBondContact O-N 2.93Å
1259	G	92.4	Very high	92.9	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	8%	0.082	C	C	.	.	I	π-helix	trans	-72.7	-39.6	-177.6	0	0	0	0	0	114.6	G1255 P1264	G1255-G1259 WeakPolarHBondContact O-CA 3.5Å; G1255-G1259 PolarHBondContact O-N 2.95Å; G1259-P1264 WeakPolarHBondContact O-CD 3.33Å
1260	L	92.4	Very high	92.6	Very high	5 Å²	5	16.3 Å²	16.3	3%	0.026	9%	0.088	C	C	.	.	I	π-helix	trans	-100.4	-22	-174.6	-58.4	-179.3	0	0	0	114.2	Y839 L843 M1190 V1217 F1218 M1256 P1264	Y839-L1260 PolarHBondContact OH-O 3.26Å; L843-L1260 WeakPolarHBondContact CD2-O 3.43Å; M1190-L1260 HydrophobicContact CE-CD2 3.86Å; V1217-L1260 HydrophobicContact CB-CD2 4.43Å; V1217-L1260 HydrophobicContact CG1-CD2 4.29Å; F1218-L1260 HydrophobicContact CB-CD1 3.85Å; F1218-L1260 HydrophobicContact CD2-CD1 3.79Å; F1218-L1260 HydrophobicContact CG-CD1 4.28Å; M1256-L1260 HydrophobicContact CG-CD1 3.85Å; M1256-L1260 WeakPolarHBondContact O-CB 3.22Å; M1256-L1260 PolarHBondContact O-N 3.09Å; L1260-P1264 WeakPolarHBondContact O-CG 2.98Å
1261	V	94.6	Very high	92	Very high	40 Å²	40	15.8 Å²	15.8	24%	0.242	8%	0.084	C	C	.	.	I	π-helix	trans	-107.4	-57.8	-179.7	-171	0	0	0	0	111.2	Y839 L843 V852 F856 A1257 V1265	Y839-V1261 WeakPolarHBondContact OH-CG2 3.36Å; L843-V1261 HydrophobicContact CD1-CG1 3.68Å; V852-V1261 HydrophobicContact CG1-CG1 4.05Å; V852-V1261 HydrophobicContact CG2-CG1 4.15Å; F856-V1261 HydrophobicContact CE2-CB 4.4Å; F856-V1261 HydrophobicContact CE2-CG1 4.13Å; F856-V1261 HydrophobicContact CZ-CB 4.4Å; A1257-V1261 WeakPolarHBondContact O-CA 3.34Å; A1257-V1261 WeakPolarHBondContact O-CB 3.22Å; A1257-V1261 PolarHBondContact O-N 2.63Å; V1261-V1265 WeakPolarHBondContact O-CG2 3.28Å
1262	F	94.9	Very high	91.3	Very high	5 Å²	5	16.3 Å²	16.3	2%	0.022	9%	0.088	C	C	.	.	I	π-helix	trans	-73.2	-49.4	-172.9	177.4	-112.8	0	0	0	112.8	M853 F856 T1149 M1152 A1257 H1258 V1265 L1266	M853-F1262 HydrophobicContact CE-CE2 4.15Å; M853-F1262 HydrophobicContact SD-CD2 4.32Å; M853-F1262 HydrophobicContact SD-CE2 3.74Å; F856-F1262 HydrophobicContact CB-CD2 3.63Å; F856-F1262 HydrophobicContact CB-CE2 3.85Å; F856-F1262 HydrophobicContact CB-CG 4.41Å; F856-F1262 HydrophobicContact CD1-CB 3.9Å; F856-F1262 HydrophobicContact CD1-CD2 4.06Å; F856-F1262 HydrophobicContact CD1-CG 4Å; F856-F1262 HydrophobicContact CD2-CB 4.08Å; F856-F1262 AromaticContact CD2-CD2 3.96Å; F856-F1262 HydrophobicContact CD2-CD2 3.96Å; F856-F1262 HydrophobicContact CD2-CG 4.39Å; F856-F1262 HydrophobicContact CE1-CB 3.75Å; F856-F1262 HydrophobicContact CE1-CG 4.35Å; F856-F1262 HydrophobicContact CE2-CB 3.95Å; F856-F1262 HydrophobicContact CG-CB 4.05Å; F856-F1262 AromaticContact CG-CD2 3.61Å; F856-F1262 HydrophobicContact CG-CD2 3.61Å; F856-F1262 HydrophobicContact CG-CE2 4.33Å; F856-F1262 HydrophobicContact CG-CG 4.02Å; F856-F1262 HydrophobicContact CZ-CB 3.77Å; T1149-F1262 HydrophobicContact CG2-CD1 4.28Å; M1152-F1262 HydrophobicContact CE-CE1 3.9Å; M1152-F1262 HydrophobicContact CE-CE2 4.21Å; M1152-F1262 HydrophobicContact CE-CZ 3.69Å; M1152-F1262 HydrophobicContact SD-CD1 4.44Å; M1152-F1262 HydrophobicContact SD-CE1 3.46Å; M1152-F1262 WeakPolarHBondContact SD-CE1 3.4Å; M1152-F1262 HydrophobicContact SD-CZ 3.57Å; M1152-F1262 VanDerWaalsContact SD-CZ 3.57Å; A1257-F1262 PolarHBondContact O-N 3.4Å; H1258-F1262 AromaticContact ND1-CD1 3.78Å; H1258-F1262 WeakPolarHBondContact O-CB 3.32Å; H1258-F1262 PolarHBondContact O-N 2.8Å; F1262-V1265 WeakPolarHBondContact O-CB 3.33Å; F1262-V1265 PolarHBondContact O-N 3.47Å; F1262-V1265 VanDerWaalsContact O-N 3.13Å; F1262-L1266 HydrophobicContact CE1-CD2 3.91Å; F1262-L1266 HydrophobicContact CZ-CD1 4.03Å; F1262-L1266 HydrophobicContact CZ-CD2 4.23Å; F1262-L1266 WeakPolarHBondContact O-CB 3.38Å; F1262-L1266 PolarHBondContact O-N 3.43Å
1263	L	93.4	Very high	90.3	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-60.3	-43.6	-174.5	-179.4	66.8	0	0	0	113.3	V1187 M1190 H1258 V1265 L1266 L1267	V1187-L1263 HydrophobicContact CB-CD2 4.14Å; V1187-L1263 HydrophobicContact CG1-CD1 4.46Å; V1187-L1263 HydrophobicContact CG1-CD2 3.86Å; V1187-L1263 HydrophobicContact CG2-CD2 4.29Å; M1190-L1263 HydrophobicContact CB-CD2 3.79Å; M1190-L1263 HydrophobicContact CG-CD2 3.9Å; M1190-L1263 HydrophobicContact CG-CG 4.41Å; H1258-L1263 VanDerWaalsContact O-CB 3.3Å; H1258-L1263 WeakPolarHBondContact O-CB 3.5Å; H1258-L1263 PolarHBondContact O-N 2.93Å; L1263-V1265 VanDerWaalsContact C-N 3.3Å; L1263-V1265 PolarHBondContact O-N 3.15Å; L1263-L1266 PolarHBondContact O-N 3.13Å; L1263-L1267 HydrophobicContact CD1-CD1 4.15Å; L1263-L1267 HydrophobicContact CD1-CG 4.1Å; L1263-L1267 HydrophobicContact CG-CD1 3.92Å; L1263-L1267 HydrophobicContact CG-CG 4.32Å; L1263-L1267 WeakPolarHBondContact O-CB 3.4Å; L1263-L1267 VanDerWaalsContact O-CG 3.3Å; L1263-L1267 WeakPolarHBondContact O-CG 3.38Å; L1263-L1267 PolarHBondContact O-N 2.97Å
1264	P	93.7	Very high	89.2	Confident	1 Å²	1	16.2 Å²	16.2	1%	0.006	10%	0.1	C	C	.	.	H	α-helix	trans	-60.4	-38.1	174.6	-28	38	0	0	0	113.5	L843 T1210 G1259 L1260 S1268	L843-P1264 HydrophobicContact CD2-CB 4.25Å; L843-P1264 HydrophobicContact CD2-CG 4.39Å; T1210-P1264 HydrophobicContact CG2-CG 4.38Å; T1210-P1264 WeakPolarHBondContact OG1-CB 3.1Å; G1259-P1264 WeakPolarHBondContact O-CD 3.33Å; L1260-P1264 WeakPolarHBondContact O-CG 2.98Å; P1264-S1268 WeakPolarHBondContact O-CB 3.21Å; P1264-S1268 PolarHBondContact O-N 3.37Å
1265	V	93.5	Very high	87.8	Confident	0 Å²	0	16.4 Å²	16.4	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-68	-44.9	177	176.6	0	0	0	0	110.2	L843 R849 V852 M853 V1261 F1262 L1263 S1268 Y1269	L843-V1265 HydrophobicContact CD1-CG2 4.13Å; L843-V1265 HydrophobicContact CG-CG2 4.24Å; R849-V1265 HydrophobicContact CB-CG1 3.84Å; R849-V1265 HydrophobicContact CG-CG1 3.98Å; R849-V1265 HydrophobicContact CG-CG2 4.13Å; V852-V1265 HydrophobicContact CB-CG2 4.3Å; V852-V1265 HydrophobicContact CG1-CB 4.28Å; V852-V1265 HydrophobicContact CG1-CG1 4.46Å; V852-V1265 HydrophobicContact CG1-CG2 4Å; M853-V1265 HydrophobicContact CG-CG1 3.92Å; M853-V1265 HydrophobicContact SD-CG1 4.15Å; V1261-V1265 WeakPolarHBondContact O-CG2 3.28Å; F1262-V1265 WeakPolarHBondContact O-CB 3.33Å; F1262-V1265 PolarHBondContact O-N 3.47Å; F1262-V1265 VanDerWaalsContact O-N 3.13Å; L1263-V1265 VanDerWaalsContact C-N 3.3Å; L1263-V1265 PolarHBondContact O-N 3.15Å; V1265-S1268 WeakPolarHBondContact O-CB 3.48Å; V1265-S1268 PolarHBondContact O-N 2.81Å; V1265-S1268 VanDerWaalsContact O-N 3.15Å; V1265-S1268 PolarHBondContact O-OG 2.65Å; V1265-Y1269 HydrophobicContact CG1-CD2 4.17Å; V1265-Y1269 HydrophobicContact CG1-CE2 4.02Å; V1265-Y1269 WeakPolarHBondContact O-CD2 3.47Å; V1265-Y1269 PolarHBondContact O-N 3.18Å
1266	L	91.7	Very high	86.4	Confident	12 Å²	12	20.4 Å²	20.4	6%	0.063	12%	0.118	C	C	.	.	H	α-helix	trans	-59.9	-47	176.9	-170.2	72.4	0	0	0	111.5	M853 L1145 F1262 L1263 S1268 Y1269 F1270	M853-L1266 HydrophobicContact CE-CD1 4.25Å; M853-L1266 HydrophobicContact SD-CD1 4.42Å; L1145-L1266 HydrophobicContact CD2-CD2 3.85Å; L1145-L1266 HydrophobicContact CD2-CG 4.03Å; F1262-L1266 HydrophobicContact CE1-CD2 3.91Å; F1262-L1266 HydrophobicContact CZ-CD1 4.03Å; F1262-L1266 HydrophobicContact CZ-CD2 4.23Å; F1262-L1266 WeakPolarHBondContact O-CB 3.38Å; F1262-L1266 PolarHBondContact O-N 3.43Å; L1263-L1266 PolarHBondContact O-N 3.13Å; L1266-S1268 VanDerWaalsContact C-N 3.29Å; L1266-S1268 PolarHBondContact O-N 3.35Å; L1266-Y1269 PolarHBondContact O-N 2.64Å; L1266-F1270 HydrophobicContact CD1-CD2 3.8Å; L1266-F1270 HydrophobicContact CD1-CE2 4.34Å; L1266-F1270 PolarHBondContact O-N 3.39Å
1267	L	90.1	Very high	84.7	Confident	2 Å²	2	19.4 Å²	19.4	1%	0.01	12%	0.117	C	C	.	.	H	α-helix	trans	-62.7	-33.7	175.2	-71	170.2	0	0	0	112.2	L1145 M1190 F1194 L1263 Y1269 G1271	L1145-L1267 HydrophobicContact CD1-CD2 3.88Å; M1190-L1267 HydrophobicContact CG-CD1 4.48Å; F1194-L1267 HydrophobicContact CB-CD1 3.95Å; F1194-L1267 HydrophobicContact CD1-CB 4.42Å; F1194-L1267 HydrophobicContact CD1-CD2 4.02Å; F1194-L1267 HydrophobicContact CD2-CB 4.06Å; F1194-L1267 HydrophobicContact CD2-CD1 4.34Å; F1194-L1267 HydrophobicContact CE1-CB 4.4Å; F1194-L1267 HydrophobicContact CE1-CD2 4.35Å; F1194-L1267 HydrophobicContact CE2-CB 4Å; F1194-L1267 HydrophobicContact CG-CB 4.26Å; F1194-L1267 HydrophobicContact CG-CD1 4.02Å; F1194-L1267 HydrophobicContact CG-CD2 4.36Å; F1194-L1267 HydrophobicContact CG-CG 4.46Å; F1194-L1267 HydrophobicContact CZ-CB 4.17Å; F1194-L1267 WeakPolarHBondContact CZ-O 3.1Å; L1263-L1267 HydrophobicContact CD1-CD1 4.15Å; L1263-L1267 HydrophobicContact CD1-CG 4.1Å; L1263-L1267 HydrophobicContact CG-CD1 3.92Å; L1263-L1267 HydrophobicContact CG-CG 4.32Å; L1263-L1267 WeakPolarHBondContact O-CB 3.4Å; L1263-L1267 VanDerWaalsContact O-CG 3.3Å; L1263-L1267 WeakPolarHBondContact O-CG 3.38Å; L1263-L1267 PolarHBondContact O-N 2.97Å; L1267-Y1269 VanDerWaalsContact C-N 3.31Å; L1267-Y1269 PolarHBondContact O-N 3.42Å; L1267-G1271 WeakPolarHBondContact O-CA 3.21Å; L1267-G1271 PolarHBondContact O-N 3.48Å
1268	S	90.8	Very high	82.9	Confident	8 Å²	8	20.6 Å²	20.6	6%	0.056	12%	0.121	C	C	.	.	H	α-helix	trans	-65.1	-33.1	177	87.7	0	0	0	0	113.1	R1202 P1264 V1265 L1266	R1202-S1268 WeakPolarHBondContact CB-O 3.14Å; P1264-S1268 WeakPolarHBondContact O-CB 3.21Å; P1264-S1268 PolarHBondContact O-N 3.37Å; V1265-S1268 WeakPolarHBondContact O-CB 3.48Å; V1265-S1268 PolarHBondContact O-N 2.81Å; V1265-S1268 VanDerWaalsContact O-N 3.15Å; V1265-S1268 PolarHBondContact O-OG 2.65Å; L1266-S1268 VanDerWaalsContact C-N 3.29Å; L1266-S1268 PolarHBondContact O-N 3.35Å
1269	Y	87.9	Confident	80.9	Confident	26 Å²	26	27.6 Å²	27.6	10%	0.102	16%	0.158	C	C	.	.	H	α-helix	trans	-87.6	-55.9	176.7	-77.3	-72.4	0	0	0	111.9	Y302 L303 R849 M853 R1202 V1265 L1266 L1267	Y302-Y1269 HydrophobicContact CE1-CD1 4.15Å; L303-Y1269 HydrophobicContact CD2-CE1 3.89Å; R849-Y1269 HydrophobicContact CB-CE2 3.98Å; M853-Y1269 HydrophobicContact CG-CE2 4.28Å; R1202-Y1269 PolarHBondContact NH1-O 3.05Å; V1265-Y1269 HydrophobicContact CG1-CD2 4.17Å; V1265-Y1269 HydrophobicContact CG1-CE2 4.02Å; V1265-Y1269 WeakPolarHBondContact O-CD2 3.47Å; V1265-Y1269 PolarHBondContact O-N 3.18Å; L1266-Y1269 PolarHBondContact O-N 2.64Å; L1267-Y1269 VanDerWaalsContact C-N 3.31Å; L1267-Y1269 PolarHBondContact O-N 3.42Å
1270	F	86.5	Confident	80.3	Confident	58 Å²	58	29 Å²	29	25%	0.254	17%	0.166	S	C	.	.	H	α-helix	trans	-109.5	3.1	-166.7	-59.2	-73	0	0	0	114.1	Y302 R1141 L1145 L1266	Y302-F1270 HydrophobicContact CD1-CE1 4.42Å; Y302-F1270 HydrophobicContact CD1-CZ 4.07Å; Y302-F1270 HydrophobicContact CD2-CE1 4.33Å; Y302-F1270 AromaticContact CE1-CE1 3.84Å; Y302-F1270 HydrophobicContact CE1-CE1 3.84Å; Y302-F1270 AromaticContact CE1-CZ 3.7Å; Y302-F1270 HydrophobicContact CE1-CZ 3.7Å; Y302-F1270 AromaticContact CE2-CE1 3.75Å; Y302-F1270 HydrophobicContact CE2-CE1 3.75Å; Y302-F1270 HydrophobicContact CE2-CZ 4.34Å; Y302-F1270 AromaticContact CZ-CE1 3.46Å; Y302-F1270 VanDerWaalsContact CZ-CE1 3.46Å; Y302-F1270 AromaticContact CZ-CZ 3.85Å; R1141-F1270 PolarHBondContact NE-O 2.97Å; R1141-F1270 PolarHBondContact NH2-O 3.28Å; L1145-F1270 HydrophobicContact CD2-CB 4.09Å; L1266-F1270 HydrophobicContact CD1-CD2 3.8Å; L1266-F1270 HydrophobicContact CD1-CE2 4.34Å; L1266-F1270 PolarHBondContact O-N 3.39Å
1271	G	81.3	Confident	79.6	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	17%	0.173	C	C	.	.			trans	-61.4	160.5	179.5	0	0	0	0	0	114	R1202 L1267	R1202-G1271 VanDerWaalsContact CZ-O 3.25Å; R1202-G1271 PolarHBondContact NE-O 3.23Å; R1202-G1271 PolarHBondContact NH2-O 2.92Å; L1267-G1271 WeakPolarHBondContact O-CA 3.21Å; L1267-G1271 PolarHBondContact O-N 3.48Å
1272	P	77.9	Confident	78.8	Confident	12 Å²	12	29.7 Å²	29.7	8%	0.078	17%	0.169	C	C	.	.			trans	-57.1	164	176.4	27.2	-39	0	0	0	112.6	D1139 S1142 F1194 R1205	D1139-P1272 WeakPolarHBondContact OD2-CB 3.37Å; S1142-P1272 WeakPolarHBondContact OG-CG 3.44Å; F1194-P1272 HydrophobicContact CD1-CG 4.27Å; F1194-P1272 HydrophobicContact CE1-CG 4.05Å; R1205-P1272 PolarHBondContact NH2-O 3.38Å
1273	G	71.1	Confident	77.9	Confident	46 Å²	46	31.1 Å²	31.1	47%	0.474	18%	0.178	S	C	.	.			trans	-66.5	177.6	169.9	0	0	0	0	0	112.1	R1205 N1275	R1205-G1273 PolarHBondContact NH1-O 3.19Å; R1205-G1273 VanDerWaalsContact NH2-C 3.33Å; R1205-G1273 PolarHBondContact NH2-O 3.19Å; G1273-N1275 PolarHBondContact O-N 2.97Å
1274	V	71	Confident	76.9	Confident	30 Å²	30	33.1 Å²	33.1	18%	0.182	19%	0.189	C	C	.	.			trans	-70.9	129.1	166.9	-177	0	0	0	0	107.4	K1199 K1276 L1279	K1199-V1274 WeakPolarHBondContact O-CG2 3.42Å; V1274-K1276 PolarHBondContact O-N 3.5Å; V1274-L1279 HydrophobicContact CB-CD1 4.2Å; V1274-L1279 HydrophobicContact CG1-CD1 3.5Å; V1274-L1279 HydrophobicContact CG1-CG 3.84Å
1275	N	65.5	Low	75.8	Confident	25 Å²	25	35.2 Å²	35.2	13%	0.134	20%	0.201	C	C	.	.			trans	-64.5	109.8	171.8	-177.7	-16.5	0	0	0	107.5	D329 G1273 A1277 V1278	D329-N1275 WeakPolarHBondContact CB-OD1 3.31Å; G1273-N1275 PolarHBondContact O-N 2.97Å; N1275-A1277 PolarHBondContact O-N 3.45Å; N1275-A1277 WeakPolarHBondContact OD1-CB 3.38Å; N1275-A1277 PolarHBondContact OD1-N 2.96Å; N1275-V1278 HydrophobicContact CB-CG2 3.74Å; N1275-V1278 WeakPolarHBondContact O-CB 3.5Å; N1275-V1278 PolarHBondContact O-N 3.14Å; N1275-V1278 VanDerWaalsContact O-N 3.08Å
1276	K	63.9	Low	74.5	Confident	83 Å²	83	37.7 Å²	37.7	36%	0.361	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-11.1	-173	-66.7	178.9	-174.3	164.5	0	113.4	K323 V1274	K323-K1276 PolarHBondContact O-NZ 3.47Å; V1274-K1276 PolarHBondContact O-N 3.5Å
1277	A	56.5	Low	73.2	Confident	26 Å²	26	39.7 Å²	39.7	22%	0.215	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-19.4	172	0	0	0	0	0	112.2	V325 D329 M333 N1275	V325-A1277 HydrophobicContact CG1-CB 4.01Å; D329-A1277 HydrophobicContact CB-CB 4.4Å; M333-A1277 HydrophobicContact CB-CB 4.44Å; M333-A1277 VanDerWaalsContact CE-C 3.48Å; M333-A1277 HydrophobicContact CE-CB 4.04Å; M333-A1277 WeakPolarHBondContact CE-O 3.35Å; M333-A1277 HydrophobicContact CG-CB 3.77Å; M333-A1277 HydrophobicContact SD-CB 4.39Å; N1275-A1277 PolarHBondContact O-N 3.45Å; N1275-A1277 WeakPolarHBondContact OD1-CB 3.38Å; N1275-A1277 PolarHBondContact OD1-N 2.96Å
1278	V	57.1	Low	71.8	Confident	53 Å²	53	42.8 Å²	42.8	32%	0.321	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-28	175.4	-171.7	0	0	0	0	111.9	M333 T1198 N1275	M333-V1278 HydrophobicContact CG-CG2 4Å; M333-V1278 HydrophobicContact SD-CB 4.08Å; M333-V1278 HydrophobicContact SD-CG2 3.39Å; M333-V1278 WeakPolarHBondContact SD-CG2 3.26Å; T1198-V1278 HydrophobicContact CG2-CG1 3.66Å; N1275-V1278 HydrophobicContact CB-CG2 3.74Å; N1275-V1278 WeakPolarHBondContact O-CB 3.5Å; N1275-V1278 PolarHBondContact O-N 3.14Å; N1275-V1278 VanDerWaalsContact O-N 3.08Å
1279	L	51.7	Low	70.1	Confident	147 Å²	147	46 Å²	46	77%	0.77	26%	0.263	S	S	*	.			trans	-76.7	0	172.7	-79.4	165.5	0	0	0	110.8	V1274	V1274-L1279 HydrophobicContact CB-CD1 4.2Å; V1274-L1279 HydrophobicContact CG1-CD1 3.5Å; V1274-L1279 HydrophobicContact CG1-CG 3.84Å

Retrieved 1,279 of 1,279 residues in 5153.9 ms (Link to these results)

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