A0A077YYY2_TRITR Loading...

Phosphoinositide phospholipase C AlphaSync Fragmented

AlphaFold DB , UniProt , Accession A0A077YYY2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 3,359 aa.

						>A0A077YYY2_TRITR|A0A077YYY2
MPALSPGDGDHCSLDERKARDILFKRTEKALKNGEDIFVLKLIARLKSQQARHDWQQLHEPYDETGTSFIDSGSQRRLTTKSLQTCLDYCFRLAVVYQRKEVVELLLKSGLHPDHLINCDCFDDSKEGGHERALVDASALQEEQAHVSLRQSSLNGQLPSSLLATLTSPSCIDCRPLILAVETKNVDIVSLLCRYNASVDITDSQSASASFFRATFEQKGGVAHVDLAKLFVEIFSSIQAALIDLAIRQNASFQNRTALLAAVQLSPLPLAIVEILLEHGARIGPSRWSSAAPVDLMPELFRMQKTLIKDLVHKAILLWKANGLEKSPPDQDEKSQPTMRITNRYSESESVKHSPSKQSGRTGQALFYVTSGSPKTSRPSGLQSQSPSGFACKEESDGVIKSLKCLVNNPECLQYVADALLQEEGNILLKSHHNADNCELDERISQLLEEILAVALKEYEGACLQSGGRKEAASISNSKVHDLFKSIVRFCLLLLTKGGSCSRFTAFHVLNQVIDICICKGFLAWPKVKFLSTELLSMQCPPGVARPRERRSLGECPKSRTNQQPKRKNDSVTIDQTSNWRKEALCDILEPLSNLEPNVLVMLLHNALTMEKRSGDVKYGCLPSRRSRRCAHCSLILCARILLFLCHQQEIRKQLADPQNVRLLVQMLDVTLEPQFLCYLLQIVATLALDRKTRCILRDLRVDELLVQMLLPGDEWYYTNQTMIFPKVVKHHAARILIYIGRGHMVGNRVNLFTCPNVANLVDSSTNSSESPLIKELHNEVEDRYILKTCLSPQFVETAGGTTLYSVEGLLMKLLNTVGDIPEDANSKISQSFLSWTIALVDPLLLLRLLLHKFSWDVGFLQYRGRSSSGHSFGVPAGQVQKSKSFDRQLPKTLHGESDTNSMLRSGSMRTDNVKLPRPRCGRGSLTASETCSEGIRTKSNFSKYIQNLFRTKRAKMNSIASTQSNQNSDTESLLEFQKKLQNLPPRCSMDEDDVNYFSSLPLKVVGQKDGQSICFYPNDSECSVCVENSAGQTRSDANTENAGNACQSLAVPQIQIEIRRASVLSQFSVGQGLSSSAVEYLPLLTAPTNVSRRSSATTTTPYSCTSQLSSQRSSVVSSLVFSNSSSPLPTSDHVPFVFNVTTPNRRASSVISIMPRISVRSLADRPILSADMSTLKIILECIINIFGRANDGINDVLKETKNLFGKIMAVTEDMQVKEWCAVMMQFMTIKEVMEESEVYNPDRLGDEYFELQDQIASGSLPCSKEEAALLASIQSLIEEKWPSSKRQLSRLLSYRRLREISQKISTLTWDSENANPPLLIRPLLFSMNKEKARNSFKEQSQKNVFNRLLCKTLSLSINAEALEHCLPANYRESKQIIKLIQVWKRKLFHSNFYDSEKGLKHLYVQTCKRLPAFGCKLFHVKELYRGKLIRKSRRILCLGAAYISLLRPSTKTLIRKQKTVSLLRWHVGSGSTDRSLTLDFGTTKWYFIGNVREVDGFLAKTIGMTLWELVQINTPKTVQKAFSSKLEEAEPPSAAFHLTGADGLPVMFHGLFVSESLSGFLEESATLYSLELERLQSVFYFPEEVAFQLSAIEYDLVYSISPMDYVTYVICDLNQVRLNLNPSQVRMLIKRFAEVSTRRVSSWVTHLILSQPSHEDRRNMLCFIVRAAETCWNIGNFNGATEILYGLSRKFSHCNWLCFSSEKLQPFWLSLSADNKRKFMNLSEILLSQEPSTELRKATQRALSCGSFRPIPFFGTFLKDLYTIFQSVPSLVPGEKAEDRDATKVEKTSASIDSSLPDHSSSFFSEHIGVTSFLNSQKIELIQTVLDNLETFHSHSRSRHSNEKGDEGDQTDSSRTLEIIQPLTEMPSPTLMSLRRIDADLMQRLQHGCSVIYYECETARSAFCHLHLDTTCSYIKWQKSNFSSWLTTTVGKGGADNLDPLSTVGSECKEASSSSELDARKVRATSGQPPVLSSSSTSADDFSKRIKLLSGIPAYRSMEDGLIVLTYVKSVEICNNPDFDILAVYQRHCTDTTVPPKCFSVVYGGTLTDNYTVYFVAPEMTASVLTDGLAQILNELKAQYCHHDRRLFWLRKLYLDLLSADQNFLVAANPSTALQAFGGRAFWTDQLSAFGSPSEHSSPTFKKTKSVRYPSQRGYLPTAKLKKLSVTGDQGFPSRVRLSIRNSFRLSPGSSQDSGSRVNSILASSKMTSEAKAQSSGESKKSTLASLVSPSTMHKKSIGDIQENPLNFLEFTELFKLFSIRMRKDLRDLFKEQVRRYQEQEKQQQPHSFLKSDSKSSICDIHLLPSHSAETSDKKNASAGKDADPFMNDAFIDKLMPDQLMRQISTSKRIADKQMKIYDALATASIAQNSAGVDTSRSMWLTAAAVKSFMRIHQMEPISDAQAVELIARHEPDAVMRSKQRMSFEGFARFLLDSSNFAYLNEDNKMNKKDMDYPLSYYFIASSHNTYLTGHQLKGESSVELYRQILMTGCRCIEFDCWDGDDGQPVIYHGHTLTTKINFRQVVEIVRRSAFEVSSLPVIISIENHCSLPLQAKMAQTFKSVFGERLVSQFLFENDLSDNPKLPSPLQLKGKVLIKNKKLSFEPPPPLGDRSSKVDGHKPQKGSLMEWSMEEEEDEETQYDFDDNDEDDDEVNRETKVADAGVNKLSPSSKLQSNKLYKSKDDSASSDTSSTKNDPAMLATTHGNLVTPPQYGSELTASSEELYKASGKKSGGPVPQVAPELSDLVIYCQAVKFKGFAISGDVELTQKRAATSSVKKTGNSGQPVPASPAMDFASSENVQTHAYRPPCFQVSCYQLPSMNETTAKKLIRKHPLELVAFTKDHILRTYPSAVRIDSSNFNPLMFWTFGIQMVALNYQTQDIPMAINAAMFEQNGNCGYMLKPRVMWDEAHPLYGIFNPWAHDLRKISGIRLILNIISGQFVCPGQADASPYVEVELMGIEADSWKERTKTVQRNGLNPIWLQTFQFQVNFLDLCFLRLAVIESGNNKCTAQRVVPLKALRAGYRHVRLRSPNNSPLEYSSIFIYSRMEEEEFIYVDGDSTENKLQTLPQNGEIPIFKQQIYVLKIYGVCPDGSSTTVQAQSTTVAREVIDMALKNCGHEADLLDDYVLMEDLWIPEASTTCQVQVSRRVLEPDELIMNAVANWNGANGRFVLRKKGSDPSSRAWMNTIIRSSKEKLPKQSCKASERSEITFLVCVHNVSEDQDYAILRVPVNSTASDIVSQVLIKARRTEQSSAFVLVEETEEPVGAMDTSSGGGKTFIASSSGATSSKAARKKTRRILSNDTNVFALQMGWKTPSRFLLEKRTNINEAQKVEKPKSNSLNVLRSLNLRKKPPPAPTAQS
					

Structure and PAE viewers are unavailable as this is a multi-fragment structure.

Download 11 Fragment Structures AlphaSync Parameters PDBs Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.1	Very low	36.4	Very low	160 Å²	160	117.1 Å²	117.1	79%	0.788	72%	0.717	S	S	*	*				0	111	0	-91.4	-66.5	177.6	0	0	107.5	A3	M1-A3 VanDerWaalsContact C-N 3.28Å; M1-A3 PolarHBondContact O-N 3.17Å; M1-A3 VanDerWaalsContact O-N 3.17Å
2	P	35.9	Very low	36.3	Very low	126 Å²	126	117.8 Å²	117.8	82%	0.818	73%	0.728	S	S	*	*			trans	-67.2	-14.6	-163.6	-25.7	36.4	0	0	0	117.3	L4	P2-L4 PolarHBondContact O-N 2.9Å
3	A	39.1	Very low	37.1	Very low	78 Å²	78	116.5 Å²	116.5	65%	0.645	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.8	37.3	-177.4	0	0	0	0	0	114.3	M1	M1-A3 VanDerWaalsContact C-N 3.28Å; M1-A3 PolarHBondContact O-N 3.17Å; M1-A3 VanDerWaalsContact O-N 3.17Å
4	L	40.2	Very low	37.7	Very low	131 Å²	131	116.1 Å²	116.1	69%	0.686	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-138	15.6	-178	-70.9	174.9	0	0	0	113	P2	P2-L4 PolarHBondContact O-N 2.9Å
5	S	39.3	Very low	38.9	Very low	92 Å²	92	114.3 Å²	114.3	64%	0.643	70%	0.7	S	S	*	*			trans	-71.5	135.1	175.9	-160.5	0	0	0	0	111.1	R76	S5-R76 PolarHBondContact O-NH1 2.91Å
6	P	32.5	Very low	40.1	Very low	110 Å²	110	111.8 Å²	111.8	71%	0.714	68%	0.678	S	S	*	*			trans	-70.3	158.4	162.7	32.8	-33.7	0	0	0	110
7	G	36.2	Very low	41.3	Very low	42 Å²	42	113.8 Å²	113.8	43%	0.433	67%	0.67	S	S	.	*			trans	170	111.9	-178.3	0	0	0	0	0	109.7	R76	G7-R76 PolarHBondContact O-NH1 3.48Å; G7-R76 PolarHBondContact O-NH2 3.22Å
8	D	37	Very low	42.9	Very low	168 Å²	168	113.7 Å²	113.7	90%	0.898	66%	0.66	S	S	*	*			trans	-28.6	165.3	-173.7	-44.2	-39.2	0	0	0	120.4
9	G	35.7	Very low	44	Very low	69 Å²	69	109.9 Å²	109.9	71%	0.711	64%	0.644	S	S	*	*			trans	118.9	125.9	166.4	0	0	0	0	0	114.8
10	D	33.2	Very low	45.2	Very low	150 Å²	150	106.8 Å²	106.8	80%	0.802	62%	0.62	S	S	*	*			trans	-65.3	146.2	-179.2	-59.8	-72.5	0	0	0	114.5
11	H	37.7	Very low	46.5	Very low	162 Å²	162	105.3 Å²	105.3	75%	0.75	61%	0.61	S	S	*	*			trans	160.1	103.8	134.3	-84.1	-56.6	0	0	0	111.2
12	C	35.2	Very low	48.6	Very low	126 Å²	126	103.3 Å²	103.3	85%	0.851	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68	158.3	179.6	-68.1	0	0	0	0	113.7	L14	C12-L14 PolarHBondContact O-N 2.77Å
13	S	46	Very low	50.4	Low	100 Å²	100	98.6 Å²	98.6	70%	0.699	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	76.7	-53.5	-179.1	77.9	0	0	0	0	117.7	D15 E16	S13-D15 VanDerWaalsContact C-N 3.26Å; S13-D15 PolarHBondContact O-N 3.42Å; S13-E16 PolarHBondContact O-N 2.7Å
14	L	45.2	Very low	52.3	Low	112 Å²	112	96.1 Å²	96.1	59%	0.586	54%	0.544	S	S	*	.	H	α-helix	trans	-64.9	-28.1	-173.5	-82.8	166	0	0	0	113.9	C12 K18	C12-L14 PolarHBondContact O-N 2.77Å; L14-K18 PolarHBondContact O-N 2.98Å
15	D	56.5	Low	54.2	Low	88 Å²	88	96.9 Å²	96.9	47%	0.471	54%	0.542	S	S	.	.	H	α-helix	trans	-76.7	-23.2	-177.1	-100.8	25.2	0	0	0	114.4	S13 K18 A19	S13-D15 VanDerWaalsContact C-N 3.26Å; S13-D15 PolarHBondContact O-N 3.42Å; D15-K18 WeakPolarHBondContact OD1-CD 3.26Å; D15-K18 IonicContact OD1-NZ 3.27Å; D15-K18 PolarHBondContact OD1-NZ 3.46Å; D15-A19 WeakPolarHBondContact O-CB 3.19Å; D15-A19 PolarHBondContact O-N 3.06Å
16	E	57.4	Low	56.2	Low	75 Å²	75	96.9 Å²	96.9	35%	0.35	53%	0.528	S	S	.	.	H	α-helix	trans	-66.6	-38.4	173.8	-82.9	-141.5	131.7	0	0	111.7	S13 A19 R20	S13-E16 PolarHBondContact O-N 2.7Å; E16-A19 PolarHBondContact O-N 3.5Å; E16-R20 WeakPolarHBondContact O-CB 3.5Å; E16-R20 PolarHBondContact O-N 2.87Å
17	R	61.6	Low	58.4	Low	146 Å²	146	91.7 Å²	91.7	55%	0.551	49%	0.494	S	S	*	.	H	α-helix	trans	-64.8	-48.4	176	-66.9	-173.8	-179	-168.9	-2.7	110.7	A19 R20 D21 D124	R17-A19 PolarHBondContact O-N 3.48Å; R17-R20 WeakPolarHBondContact O-CB 3.28Å; R17-R20 PolarHBondContact O-N 3.28Å; R17-D21 VanDerWaalsContact O-CG 3.32Å; R17-D21 PolarHBondContact O-N 3.43Å; R17-D124 IonicContact CZ-OD2 2.66Å; R17-D124 IonicContact NH1-OD2 3.19Å; R17-D124 IonicContact NH2-OD1 3.86Å; R17-D124 IonicContact NH2-OD2 3.62Å; R17-D124 PolarHBondContact NH2-OD2 3.05Å
18	K	69.2	Low	60.5	Low	112 Å²	112	91.7 Å²	91.7	49%	0.487	48%	0.483	S	S	.	.	H	α-helix	trans	-59.1	-45.4	174.9	-61.8	177.2	-158.9	152.6	0	112.6	L14 D15 R20 D21 I22	L14-K18 PolarHBondContact O-N 2.98Å; D15-K18 WeakPolarHBondContact OD1-CD 3.26Å; D15-K18 IonicContact OD1-NZ 3.27Å; D15-K18 PolarHBondContact OD1-NZ 3.46Å; K18-R20 VanDerWaalsContact C-N 3.31Å; K18-R20 PolarHBondContact O-N 2.9Å; K18-D21 PolarHBondContact O-N 3.04Å; K18-I22 WeakPolarHBondContact O-CB 3.27Å; K18-I22 WeakPolarHBondContact O-CD1 3.2Å; K18-I22 VanDerWaalsContact O-CG1 3.23Å; K18-I22 WeakPolarHBondContact O-CG1 3.38Å; K18-I22 PolarHBondContact O-N 3.01Å
19	A	64.5	Low	62.7	Low	42 Å²	42	90 Å²	90	35%	0.347	47%	0.467	S	S	.	.	H	α-helix	trans	-63.4	-38.4	179.4	0	0	0	0	0	111.7	D15 E16 R17 L23 L78	D15-A19 WeakPolarHBondContact O-CB 3.19Å; D15-A19 PolarHBondContact O-N 3.06Å; E16-A19 PolarHBondContact O-N 3.5Å; R17-A19 PolarHBondContact O-N 3.48Å; A19-L23 VanDerWaalsContact O-CB 3.29Å; A19-L23 WeakPolarHBondContact O-CB 3.29Å; A19-L23 PolarHBondContact O-N 3.04Å; A19-L78 HydrophobicContact CB-CD2 4.42Å
20	R	68.3	Low	64.9	Low	46 Å²	46	86.8 Å²	86.8	17%	0.174	43%	0.434	C	S	.	.	H	α-helix	trans	-65	-46.3	173.5	-174.3	-166.6	-61.4	-158.7	-9.5	111.9	E16 R17 K18 I22 L23 F24 D120	E16-R20 WeakPolarHBondContact O-CB 3.5Å; E16-R20 PolarHBondContact O-N 2.87Å; R17-R20 WeakPolarHBondContact O-CB 3.28Å; R17-R20 PolarHBondContact O-N 3.28Å; K18-R20 VanDerWaalsContact C-N 3.31Å; K18-R20 PolarHBondContact O-N 2.9Å; R20-I22 VanDerWaalsContact C-N 3.35Å; R20-I22 PolarHBondContact O-N 3.2Å; R20-L23 CarbonylContact O-C 3.59Å; R20-L23 WeakPolarHBondContact O-CA 3.49Å; R20-L23 WeakPolarHBondContact O-CB 3.38Å; R20-L23 PolarHBondContact O-N 2.8Å; R20-L23 VanDerWaalsContact O-N 3.08Å; R20-F24 HydrophobicContact CG-CD1 4.26Å; R20-F24 HydrophobicContact CG-CD2 4.31Å; R20-F24 HydrophobicContact CG-CE1 3.72Å; R20-F24 HydrophobicContact CG-CE2 3.8Å; R20-F24 HydrophobicContact CG-CZ 3.49Å; R20-F24 VanDerWaalsContact CG-CZ 3.49Å; R20-F24 WeakPolarHBondContact O-CD1 3.37Å; R20-F24 WeakPolarHBondContact O-CG 3.24Å; R20-F24 PolarHBondContact O-N 2.87Å; R20-D120 IonicContact CZ-OD2 3.74Å; R20-D120 VanDerWaalsContact NH1-CG 3.28Å; R20-D120 IonicContact NH1-OD2 2.71Å; R20-D120 PolarHBondContact NH1-OD2 2.92Å; R20-D120 IonicContact NH2-OD2 2.86Å; R20-D120 PolarHBondContact NH2-OD2 3.31Å
21	D	72.1	Confident	67.1	Low	77 Å²	77	79.7 Å²	79.7	41%	0.412	40%	0.396	S	S	.	.	H	α-helix	trans	-64.1	-38.9	177.8	-67.4	-24.7	0	0	0	112.4	R17 K18 L23 F24 K25	R17-D21 VanDerWaalsContact O-CG 3.32Å; R17-D21 PolarHBondContact O-N 3.43Å; K18-D21 PolarHBondContact O-N 3.04Å; D21-L23 VanDerWaalsContact C-N 3.32Å; D21-F24 PolarHBondContact O-N 3.27Å; D21-K25 WeakPolarHBondContact O-CB 3.4Å; D21-K25 WeakPolarHBondContact O-CG 3.44Å; D21-K25 PolarHBondContact O-N 2.89Å
22	I	76.9	Confident	69.1	Low	118 Å²	118	76.9 Å²	76.9	61%	0.605	38%	0.382	S	S	*	.	H	α-helix	trans	-64.2	-39.5	172.4	-69.4	164.5	0	0	0	110.3	K18 R20 R26	K18-I22 WeakPolarHBondContact O-CB 3.27Å; K18-I22 WeakPolarHBondContact O-CD1 3.2Å; K18-I22 VanDerWaalsContact O-CG1 3.23Å; K18-I22 WeakPolarHBondContact O-CG1 3.38Å; K18-I22 PolarHBondContact O-N 3.01Å; R20-I22 VanDerWaalsContact C-N 3.35Å; R20-I22 PolarHBondContact O-N 3.2Å; I22-R26 WeakPolarHBondContact O-CB 3.23Å; I22-R26 PolarHBondContact O-N 3.47Å
23	L	75.7	Confident	71.3	Confident	27 Å²	27	75.4 Å²	75.4	14%	0.141	37%	0.365	C	S	.	.	H	α-helix	trans	-68.3	-41	177.2	-169.1	66	0	0	0	111.8	A19 R20 D21 R26 T27 F38 L78 L83 C86	A19-L23 VanDerWaalsContact O-CB 3.29Å; A19-L23 WeakPolarHBondContact O-CB 3.29Å; A19-L23 PolarHBondContact O-N 3.04Å; R20-L23 CarbonylContact O-C 3.59Å; R20-L23 WeakPolarHBondContact O-CA 3.49Å; R20-L23 WeakPolarHBondContact O-CB 3.38Å; R20-L23 PolarHBondContact O-N 2.8Å; R20-L23 VanDerWaalsContact O-N 3.08Å; D21-L23 VanDerWaalsContact C-N 3.32Å; L23-R26 CarbonylContact O-C 3.49Å; L23-R26 WeakPolarHBondContact O-CB 3.44Å; L23-R26 PolarHBondContact O-N 3.48Å; L23-T27 PolarHBondContact O-N 3.29Å; L23-T27 PolarHBondContact O-OG1 2.98Å; L23-F38 HydrophobicContact CD1-CZ 4.24Å; L23-L78 HydrophobicContact CD2-CD1 4.14Å; L23-L83 HydrophobicContact CD2-CD2 4.26Å; L23-C86 HydrophobicContact CD2-CB 3.97Å; L23-C86 WeakPolarHBondContact CD2-SG 3.44Å; L23-C86 VanDerWaalsContact CG-SG 3.57Å
24	F	78	Confident	72.8	Confident	25 Å²	25	72.1 Å²	72.1	11%	0.11	35%	0.347	C	S	.	.	H	α-helix	trans	-64.3	-49.3	175.4	-70.7	-5.3	0	0	0	112.1	R20 D21 R26 T27 E28 T85 C86 Y89	R20-F24 HydrophobicContact CG-CD1 4.26Å; R20-F24 HydrophobicContact CG-CD2 4.31Å; R20-F24 HydrophobicContact CG-CE1 3.72Å; R20-F24 HydrophobicContact CG-CE2 3.8Å; R20-F24 HydrophobicContact CG-CZ 3.49Å; R20-F24 VanDerWaalsContact CG-CZ 3.49Å; R20-F24 WeakPolarHBondContact O-CD1 3.37Å; R20-F24 WeakPolarHBondContact O-CG 3.24Å; R20-F24 PolarHBondContact O-N 2.87Å; D21-F24 PolarHBondContact O-N 3.27Å; F24-R26 PolarHBondContact O-N 3.18Å; F24-T27 WeakPolarHBondContact CA-OG1 3.27Å; F24-T27 PolarHBondContact O-N 3.24Å; F24-T27 PolarHBondContact O-OG1 3.03Å; F24-E28 WeakPolarHBondContact O-CB 3.17Å; F24-E28 PolarHBondContact O-N 2.96Å; F24-T85 HydrophobicContact CZ-CG2 4.48Å; F24-C86 HydrophobicContact CD1-CB 4.49Å; F24-C86 HydrophobicContact CE1-CB 4.03Å; F24-Y89 HydrophobicContact CB-CD1 4.05Å; F24-Y89 HydrophobicContact CB-CE1 3.73Å; F24-Y89 AromaticContact CD1-CD1 3.77Å; F24-Y89 HydrophobicContact CD1-CD1 3.77Å; F24-Y89 HydrophobicContact CD1-CE1 4.35Å; F24-Y89 HydrophobicContact CD1-CG 4.43Å; F24-Y89 HydrophobicContact CD2-CD1 4.47Å; F24-Y89 HydrophobicContact CE1-CD1 4.31Å; F24-Y89 AromaticContact CG-CD1 3.85Å; F24-Y89 HydrophobicContact CG-CD1 3.85Å; F24-Y89 AromaticContact CG-CE1 3.99Å; F24-Y89 HydrophobicContact CG-CE1 3.99Å
25	K	80.2	Confident	74.5	Confident	147 Å²	147	70.5 Å²	70.5	64%	0.639	34%	0.337	S	S	*	.	H	α-helix	trans	-60.7	-27.7	173.8	-71.1	170.1	-178.6	173.5	0	111.8	D21 K29	D21-K25 WeakPolarHBondContact O-CB 3.4Å; D21-K25 WeakPolarHBondContact O-CG 3.44Å; D21-K25 PolarHBondContact O-N 2.89Å; K25-K29 WeakPolarHBondContact O-CB 3.49Å; K25-K29 PolarHBondContact O-N 3.46Å; K25-K29 VanDerWaalsContact O-N 3.11Å
26	R	80.6	Confident	75.5	Confident	92 Å²	92	68.8 Å²	68.8	35%	0.347	33%	0.328	S	S	.	.	H	α-helix	trans	-80.3	-39.6	175.6	-169.3	174	-174.6	125.2	13.4	113.6	I22 L23 F24 E28 A30 F38	I22-R26 WeakPolarHBondContact O-CB 3.23Å; I22-R26 PolarHBondContact O-N 3.47Å; L23-R26 CarbonylContact O-C 3.49Å; L23-R26 WeakPolarHBondContact O-CB 3.44Å; L23-R26 PolarHBondContact O-N 3.48Å; F24-R26 PolarHBondContact O-N 3.18Å; R26-E28 VanDerWaalsContact C-N 3.33Å; R26-A30 VanDerWaalsContact O-CB 3.24Å; R26-A30 WeakPolarHBondContact O-CB 3.42Å; R26-A30 PolarHBondContact O-N 2.92Å; R26-F38 HydrophobicContact CB-CZ 4.35Å; R26-F38 HydrophobicContact CG-CE1 4.1Å; R26-F38 HydrophobicContact CG-CE2 4.13Å; R26-F38 HydrophobicContact CG-CZ 3.67Å
27	T	79.6	Confident	76.7	Confident	1 Å²	1	70.6 Å²	70.6	1%	0.006	34%	0.338	C	S	.	.	H	α-helix	trans	-63.8	-42.3	171.5	48	0	0	0	0	110.3	L23 F24 A30 L31 F38 L42 C90	L23-T27 PolarHBondContact O-N 3.29Å; L23-T27 PolarHBondContact O-OG1 2.98Å; F24-T27 WeakPolarHBondContact CA-OG1 3.27Å; F24-T27 PolarHBondContact O-N 3.24Å; F24-T27 PolarHBondContact O-OG1 3.03Å; T27-A30 PolarHBondContact O-N 3.35Å; T27-L31 WeakPolarHBondContact O-CB 3.29Å; T27-L31 VanDerWaalsContact O-CG 3.29Å; T27-L31 WeakPolarHBondContact O-CG 3.5Å; T27-L31 PolarHBondContact O-N 2.6Å; T27-F38 HydrophobicContact CG2-CE1 3.79Å; T27-L42 HydrophobicContact CG2-CD2 4.17Å; T27-C90 HydrophobicContact CG2-CB 4.47Å
28	E	79.8	Confident	77.6	Confident	43 Å²	43	65.3 Å²	65.3	20%	0.201	32%	0.32	C	S	.	.	H	α-helix	trans	-58.3	-50.3	175.3	-164.2	-154.8	163.1	0	0	111.9	F24 R26 A30 L31 K32 L93 Y97	F24-E28 WeakPolarHBondContact O-CB 3.17Å; F24-E28 PolarHBondContact O-N 2.96Å; R26-E28 VanDerWaalsContact C-N 3.33Å; E28-A30 PolarHBondContact O-N 2.96Å; E28-L31 PolarHBondContact O-N 3.44Å; E28-K32 HydrophobicContact CG-CD 4.43Å; E28-K32 WeakPolarHBondContact O-CB 3.21Å; E28-K32 WeakPolarHBondContact O-CG 3.36Å; E28-K32 PolarHBondContact O-N 3.02Å; E28-K32 IonicContact OE1-NZ 2.63Å; E28-K32 PolarHBondContact OE1-NZ 3.43Å; E28-L93 HydrophobicContact CB-CD1 3.88Å; E28-L93 HydrophobicContact CG-CD1 4.09Å; E28-Y97 HydrophobicContact CG-CE2 4.21Å; E28-Y97 WeakPolarHBondContact CG-OH 3.17Å; E28-Y97 PolarHBondContact OE1-OH 2.74Å
29	K	82.9	Confident	77.9	Confident	132 Å²	132	60.1 Å²	60.1	57%	0.574	30%	0.297	S	S	*	.	H	α-helix	trans	-62.3	-41.2	175.6	-173.3	170.5	-177.5	172.3	0	112.4	K25 K32 N33	K25-K29 WeakPolarHBondContact O-CB 3.49Å; K25-K29 PolarHBondContact O-N 3.46Å; K25-K29 VanDerWaalsContact O-N 3.11Å; K29-K32 PolarHBondContact O-N 2.97Å; K29-N33 VanDerWaalsContact O-CB 3.28Å; K29-N33 WeakPolarHBondContact O-CB 3.42Å; K29-N33 PolarHBondContact O-N 3.2Å; K29-N33 PolarHBondContact O-OD1 2.98Å
30	A	81.9	Confident	78.6	Confident	2 Å²	2	62.1 Å²	62.1	2%	0.017	30%	0.302	C	S	.	.	H	α-helix	trans	-62.8	-43.6	178.4	0	0	0	0	0	112.2	R26 T27 E28 N33 G34 E35 F38	R26-A30 VanDerWaalsContact O-CB 3.24Å; R26-A30 WeakPolarHBondContact O-CB 3.42Å; R26-A30 PolarHBondContact O-N 2.92Å; T27-A30 PolarHBondContact O-N 3.35Å; E28-A30 PolarHBondContact O-N 2.96Å; A30-N33 CarbonylContact O-C 3.24Å; A30-N33 PolarHBondContact O-N 2.93Å; A30-G34 PolarHBondContact O-N 2.91Å; A30-E35 HydrophobicContact CB-CB 4.01Å; A30-E35 PolarHBondContact O-N 3.45Å; A30-F38 HydrophobicContact CB-CB 4.06Å; A30-F38 HydrophobicContact CB-CD1 3.56Å; A30-F38 HydrophobicContact CB-CE1 4.34Å; A30-F38 HydrophobicContact CB-CG 4.03Å
31	L	81	Confident	79.2	Confident	1 Å²	1	66 Å²	66	1%	0.005	32%	0.32	C	S	.	.	H	α-helix	trans	-72.6	-35.1	179.4	-65.6	171	0	0	0	112.6	T27 E28 G34 V39 L93 Y97 R99 V102	T27-L31 WeakPolarHBondContact O-CB 3.29Å; T27-L31 VanDerWaalsContact O-CG 3.29Å; T27-L31 WeakPolarHBondContact O-CG 3.5Å; T27-L31 PolarHBondContact O-N 2.6Å; E28-L31 PolarHBondContact O-N 3.44Å; L31-G34 PolarHBondContact O-N 3.41Å; L31-V39 HydrophobicContact CD2-CG2 4Å; L31-L93 HydrophobicContact CD1-CB 3.38Å; L31-L93 HydrophobicContact CD1-CD1 4.21Å; L31-L93 HydrophobicContact CD1-CG 4.49Å; L31-Y97 HydrophobicContact CB-CD2 3.68Å; L31-Y97 HydrophobicContact CB-CE2 4.16Å; L31-R99 PolarHBondContact O-NE 2.98Å; L31-R99 PolarHBondContact O-NH2 2.87Å; L31-V102 HydrophobicContact CD2-CB 4.43Å; L31-V102 HydrophobicContact CD2-CG1 3.83Å; L31-V102 HydrophobicContact CD2-CG2 4.19Å
32	K	79.6	Confident	79.5	Confident	103 Å²	103	62.9 Å²	62.9	45%	0.448	30%	0.303	S	S	.	.	H	α-helix	trans	-58.3	-47.5	166.7	-82.7	170	159.6	159.7	0	111.1	E28 K29 G34 Y97 R99	E28-K32 HydrophobicContact CG-CD 4.43Å; E28-K32 WeakPolarHBondContact O-CB 3.21Å; E28-K32 WeakPolarHBondContact O-CG 3.36Å; E28-K32 PolarHBondContact O-N 3.02Å; E28-K32 IonicContact OE1-NZ 2.63Å; E28-K32 PolarHBondContact OE1-NZ 3.43Å; K29-K32 PolarHBondContact O-N 2.97Å; K32-G34 PolarHBondContact O-N 3.11Å; K32-Y97 HydrophobicContact CD-CE1 4.46Å; K32-Y97 WeakPolarHBondContact CE-OH 3.39Å; K32-Y97 HydrophobicContact CG-CD1 4.46Å; K32-Y97 HydrophobicContact CG-CE1 3.9Å; K32-Y97 HydrophobicContact CG-CE2 4.1Å; K32-Y97 PolarHBondContact NZ-OH 2.91Å; K32-R99 PolarHBondContact O-NH2 3.37Å
33	N	80	Confident	79.5	Confident	94 Å²	94	58.1 Å²	58.1	50%	0.503	28%	0.278	S	S	.	.	H	α-helix	trans	-72.3	-23.6	-179.6	-72.7	-1	0	0	0	114.9	K29 A30 E35	K29-N33 VanDerWaalsContact O-CB 3.28Å; K29-N33 WeakPolarHBondContact O-CB 3.42Å; K29-N33 PolarHBondContact O-N 3.2Å; K29-N33 PolarHBondContact O-OD1 2.98Å; A30-N33 CarbonylContact O-C 3.24Å; A30-N33 PolarHBondContact O-N 2.93Å; N33-E35 HydrophobicContact CB-CG 3.91Å; N33-E35 PolarHBondContact ND2-OE1 2.92Å
34	G	78.4	Confident	79.7	Confident	31 Å²	31	59.7 Å²	59.7	32%	0.32	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	80	30	-169.5	0	0	0	0	0	113.6	A30 L31 K32 D36	A30-G34 PolarHBondContact O-N 2.91Å; L31-G34 PolarHBondContact O-N 3.41Å; K32-G34 PolarHBondContact O-N 3.11Å; G34-D36 VanDerWaalsContact C-N 3.25Å; G34-D36 PolarHBondContact O-N 2.63Å
35	E	80.2	Confident	79.6	Confident	79 Å²	79	62.8 Å²	62.8	37%	0.369	31%	0.306	S	S	.	.			trans	-81.2	60.8	178.1	-70.2	177.3	-131.1	0	0	111.7	A30 N33 I37 F38	A30-E35 HydrophobicContact CB-CB 4.01Å; A30-E35 PolarHBondContact O-N 3.45Å; N33-E35 HydrophobicContact CB-CG 3.91Å; N33-E35 PolarHBondContact ND2-OE1 2.92Å; E35-I37 PolarHBondContact O-N 2.8Å; E35-F38 HydrophobicContact CB-CB 4.33Å; E35-F38 WeakPolarHBondContact O-CA 3.47Å; E35-F38 WeakPolarHBondContact O-CB 3.34Å; E35-F38 PolarHBondContact O-N 3.27Å
36	D	78.6	Confident	79.2	Confident	52 Å²	52	57.2 Å²	57.2	28%	0.278	28%	0.283	S	S	.	.	H	α-helix	trans	-56.2	-29.8	-175.3	-56.9	-17.6	0	0	0	113.1	G34 F38 V39 L40 V102	G34-D36 VanDerWaalsContact C-N 3.25Å; G34-D36 PolarHBondContact O-N 2.63Å; D36-F38 PolarHBondContact O-N 3.05Å; D36-V39 PolarHBondContact O-N 3.36Å; D36-L40 PolarHBondContact O-N 2.91Å; D36-V102 HydrophobicContact CB-CG2 4.49Å; D36-V102 VanDerWaalsContact OD1-CG2 3.26Å; D36-V102 WeakPolarHBondContact OD1-CG2 3.42Å
37	I	81.1	Confident	78.9	Confident	112 Å²	112	58.1 Å²	58.1	57%	0.574	29%	0.29	S	S	*	.	H	α-helix	trans	-57.6	-28.4	173.3	-59.8	174.4	0	0	0	112	E35 K41	E35-I37 PolarHBondContact O-N 2.8Å; I37-K41 HydrophobicContact CG2-CD 4.2Å; I37-K41 WeakPolarHBondContact O-CD 3.29Å; I37-K41 VanDerWaalsContact O-CG 3.27Å; I37-K41 WeakPolarHBondContact O-CG 3.46Å; I37-K41 PolarHBondContact O-N 3.22Å
38	F	81.4	Confident	78.7	Confident	36 Å²	36	60.8 Å²	60.8	16%	0.158	31%	0.309	C	S	.	.	H	α-helix	trans	-69.6	-41.4	173.7	-175.2	-108.5	0	0	0	111.6	L23 R26 T27 A30 E35 D36 K41 L42	L23-F38 HydrophobicContact CD1-CZ 4.24Å; R26-F38 HydrophobicContact CB-CZ 4.35Å; R26-F38 HydrophobicContact CG-CE1 4.1Å; R26-F38 HydrophobicContact CG-CE2 4.13Å; R26-F38 HydrophobicContact CG-CZ 3.67Å; T27-F38 HydrophobicContact CG2-CE1 3.79Å; A30-F38 HydrophobicContact CB-CB 4.06Å; A30-F38 HydrophobicContact CB-CD1 3.56Å; A30-F38 HydrophobicContact CB-CE1 4.34Å; A30-F38 HydrophobicContact CB-CG 4.03Å; E35-F38 HydrophobicContact CB-CB 4.33Å; E35-F38 WeakPolarHBondContact O-CA 3.47Å; E35-F38 WeakPolarHBondContact O-CB 3.34Å; E35-F38 PolarHBondContact O-N 3.27Å; D36-F38 PolarHBondContact O-N 3.05Å; F38-K41 PolarHBondContact O-N 2.94Å; F38-L42 PolarHBondContact O-N 3.24Å
39	V	75.7	Confident	78.2	Confident	3 Å²	3	60.1 Å²	60.1	2%	0.018	31%	0.305	C	S	.	.	H	α-helix	trans	-66.9	-43.3	177.2	-170.6	0	0	0	0	110.6	L31 D36 K41 L42 I43 V102 L106	L31-V39 HydrophobicContact CD2-CG2 4Å; D36-V39 PolarHBondContact O-N 3.36Å; V39-K41 VanDerWaalsContact C-N 3.26Å; V39-K41 PolarHBondContact O-N 3.49Å; V39-L42 WeakPolarHBondContact O-CB 3.4Å; V39-L42 PolarHBondContact O-N 2.92Å; V39-I43 HydrophobicContact CG1-CD1 4.02Å; V39-I43 HydrophobicContact CG1-CG1 4.46Å; V39-I43 WeakPolarHBondContact O-CG1 3.48Å; V39-I43 PolarHBondContact O-N 3.19Å; V39-V102 HydrophobicContact CB-CG1 4.46Å; V39-V102 HydrophobicContact CG1-CG1 4.11Å; V39-V102 HydrophobicContact CG2-CG1 4.03Å; V39-L106 HydrophobicContact CG1-CD2 3.99Å; V39-L106 HydrophobicContact CG1-CG 4.26Å
40	L	78.2	Confident	77.5	Confident	83 Å²	83	58.2 Å²	58.2	44%	0.435	30%	0.299	S	S	.	.	H	α-helix	trans	-56.5	-39.1	172.9	-70.5	173.5	0	0	0	112.3	D36 A44 L105	D36-L40 PolarHBondContact O-N 2.91Å; L40-A44 VanDerWaalsContact O-CB 3.29Å; L40-A44 WeakPolarHBondContact O-CB 3.33Å; L40-A44 PolarHBondContact O-N 3.04Å; L40-L105 HydrophobicContact CD2-CD1 4.1Å; L40-L105 HydrophobicContact CD2-CD2 4.07Å; L40-L105 HydrophobicContact CG-CD1 4.41Å
41	K	81	Confident	76.7	Confident	129 Å²	129	60.2 Å²	60.2	56%	0.561	32%	0.315	S	S	*	.	H	α-helix	trans	-70.7	-32.7	175.6	-74.2	165.7	-176	167.3	0	112.9	I37 F38 V39 R45	I37-K41 HydrophobicContact CG2-CD 4.2Å; I37-K41 WeakPolarHBondContact O-CD 3.29Å; I37-K41 VanDerWaalsContact O-CG 3.27Å; I37-K41 WeakPolarHBondContact O-CG 3.46Å; I37-K41 PolarHBondContact O-N 3.22Å; F38-K41 PolarHBondContact O-N 2.94Å; V39-K41 VanDerWaalsContact C-N 3.26Å; V39-K41 PolarHBondContact O-N 3.49Å; K41-R45 WeakPolarHBondContact O-CB 3.47Å; K41-R45 PolarHBondContact O-N 3.01Å
42	L	78.9	Confident	75.7	Confident	11 Å²	11	66.9 Å²	66.9	6%	0.058	34%	0.34	C	S	.	.	H	α-helix	trans	-67.8	-48.1	174.3	-170.3	65.7	0	0	0	111	T27 F38 V39 A44 R45 L46 L83 L87	T27-L42 HydrophobicContact CG2-CD2 4.17Å; F38-L42 PolarHBondContact O-N 3.24Å; V39-L42 WeakPolarHBondContact O-CB 3.4Å; V39-L42 PolarHBondContact O-N 2.92Å; L42-A44 PolarHBondContact O-N 2.79Å; L42-R45 PolarHBondContact O-N 3.28Å; L42-L46 PolarHBondContact O-N 3.38Å; L42-L83 HydrophobicContact CD1-CD2 4.04Å; L42-L87 HydrophobicContact CB-CD2 4.5Å; L42-L87 HydrophobicContact CD2-CD2 3.74Å; L42-L87 HydrophobicContact CD2-CG 4.12Å; L42-L87 HydrophobicContact CG-CD2 3.94Å; L42-L87 HydrophobicContact CG-CG 4.26Å
43	I	77	Confident	74.7	Confident	17 Å²	17	66.4 Å²	66.4	9%	0.087	34%	0.339	C	S	.	.	H	α-helix	trans	-58.8	-47.5	175	-65.6	164.1	0	0	0	110.9	V39 R45 L46 K47 L87 L106	V39-I43 HydrophobicContact CG1-CD1 4.02Å; V39-I43 HydrophobicContact CG1-CG1 4.46Å; V39-I43 WeakPolarHBondContact O-CG1 3.48Å; V39-I43 PolarHBondContact O-N 3.19Å; I43-R45 VanDerWaalsContact C-N 3.29Å; I43-R45 PolarHBondContact O-N 2.99Å; I43-L46 PolarHBondContact O-N 3.19Å; I43-K47 HydrophobicContact CG2-CD 4.35Å; I43-K47 PolarHBondContact O-N 3.46Å; I43-L87 HydrophobicContact CG1-CD2 3.94Å; I43-L106 HydrophobicContact CD1-CD2 4Å; I43-L106 HydrophobicContact CG1-CD2 4.23Å
44	A	78.8	Confident	73.5	Confident	60 Å²	60	65.8 Å²	65.8	50%	0.496	34%	0.336	S	S	.	.	H	α-helix	trans	-61.1	-38.1	177.5	0	0	0	0	0	112.1	L40 L42 S48	L40-A44 VanDerWaalsContact O-CB 3.29Å; L40-A44 WeakPolarHBondContact O-CB 3.33Å; L40-A44 PolarHBondContact O-N 3.04Å; L42-A44 PolarHBondContact O-N 2.79Å; A44-S48 WeakPolarHBondContact O-CB 3.19Å; A44-S48 PolarHBondContact O-N 2.9Å; A44-S48 PolarHBondContact O-OG 3.3Å
45	R	77.7	Confident	72.2	Confident	91 Å²	91	72.6 Å²	72.6	34%	0.343	35%	0.352	S	S	.	.	H	α-helix	trans	-65.2	-45.1	175.9	-169	175.9	-177.1	158.1	2.7	111.8	K41 L42 I43 S48 Q49 L83	K41-R45 WeakPolarHBondContact O-CB 3.47Å; K41-R45 PolarHBondContact O-N 3.01Å; L42-R45 PolarHBondContact O-N 3.28Å; I43-R45 VanDerWaalsContact C-N 3.29Å; I43-R45 PolarHBondContact O-N 2.99Å; R45-S48 PolarHBondContact O-N 3.32Å; R45-S48 PolarHBondContact O-OG 2.99Å; R45-Q49 PolarHBondContact O-N 3.08Å; R45-L83 HydrophobicContact CB-CD1 4.44Å; R45-L83 HydrophobicContact CG-CD1 3.96Å
46	L	71.1	Confident	70.9	Confident	29 Å²	29	73.8 Å²	73.8	15%	0.152	36%	0.358	C	S	.	.	H	α-helix	trans	-57.4	-53.5	174.8	-171.9	90.2	0	0	0	110.6	L42 I43 S48 Q49 Q50 L83 L87	L42-L46 PolarHBondContact O-N 3.38Å; I43-L46 PolarHBondContact O-N 3.19Å; L46-S48 PolarHBondContact O-N 3.22Å; L46-Q49 PolarHBondContact O-N 2.95Å; L46-Q50 PolarHBondContact O-N 3.45Å; L46-L83 HydrophobicContact CD1-CB 3.61Å; L46-L83 HydrophobicContact CD1-CD1 4.5Å; L46-L87 HydrophobicContact CB-CD1 4.01Å; L46-L87 HydrophobicContact CD1-CD1 4.12Å; L46-L87 HydrophobicContact CD2-CD1 3.66Å; L46-L87 HydrophobicContact CG-CD1 4.12Å
47	K	75	Confident	69.6	Low	111 Å²	111	78.7 Å²	78.7	48%	0.483	38%	0.379	S	S	.	.	H	α-helix	trans	-58.9	-35.4	-179.5	-67.4	-170.7	177.6	-164.4	0	112.5	I43 A51 S109	I43-K47 HydrophobicContact CG2-CD 4.35Å; I43-K47 PolarHBondContact O-N 3.46Å; K47-A51 WeakPolarHBondContact O-CB 3.44Å; K47-A51 PolarHBondContact O-N 2.94Å; K47-S109 WeakPolarHBondContact CE-O 3.46Å; K47-S109 PolarHBondContact NZ-O 3.26Å
48	S	74	Confident	67.9	Low	58 Å²	58	79.7 Å²	79.7	41%	0.406	39%	0.385	S	S	.	.	H	α-helix	trans	-70.9	-29.4	174.4	78.3	0	0	0	0	114.5	A44 R45 L46 R52	A44-S48 WeakPolarHBondContact O-CB 3.19Å; A44-S48 PolarHBondContact O-N 2.9Å; A44-S48 PolarHBondContact O-OG 3.3Å; R45-S48 PolarHBondContact O-N 3.32Å; R45-S48 PolarHBondContact O-OG 2.99Å; L46-S48 PolarHBondContact O-N 3.22Å; S48-R52 WeakPolarHBondContact O-CG 3.45Å; S48-R52 PolarHBondContact O-N 3.45Å
49	Q	69.5	Low	66.3	Low	28 Å²	28	84.4 Å²	84.4	13%	0.131	41%	0.407	C	S	.	.	H	α-helix	trans	-79.9	-41.9	174.5	-78.6	-166.9	-30.4	0	0	111.7	R45 L46 R52 H53 L78 T80	R45-Q49 PolarHBondContact O-N 3.08Å; L46-Q49 PolarHBondContact O-N 2.95Å; Q49-R52 PolarHBondContact O-N 3.49Å; Q49-R52 VanDerWaalsContact O-N 3.17Å; Q49-H53 PolarHBondContact O-N 3.18Å; Q49-L78 PolarHBondContact NE2-O 3.46Å; Q49-L78 PolarHBondContact OE1-O 3.35Å; Q49-T80 HydrophobicContact CB-CG2 3.98Å
50	Q	67.5	Low	64.5	Low	92 Å²	92	91.9 Å²	91.9	43%	0.43	44%	0.442	S	S	.	.	H	α-helix	trans	-57.1	-53.2	177.9	-159.8	71.2	11.7	0	0	110.4	L46 R52 H53 D54	L46-Q50 PolarHBondContact O-N 3.45Å; Q50-R52 VanDerWaalsContact C-N 3.28Å; Q50-R52 PolarHBondContact O-N 2.86Å; Q50-H53 WeakPolarHBondContact O-CA 3.35Å; Q50-H53 WeakPolarHBondContact O-CB 3.43Å; Q50-H53 PolarHBondContact O-N 2.86Å; Q50-D54 VanDerWaalsContact O-CG 3.3Å; Q50-D54 PolarHBondContact O-N 2.97Å
51	A	65.4	Low	62.7	Low	44 Å²	44	93.1 Å²	93.1	36%	0.364	46%	0.455	S	S	.	.	H	α-helix	trans	-56.5	-40	176.4	0	0	0	0	0	112.6	K47 H53 D54 W55	K47-A51 WeakPolarHBondContact O-CB 3.44Å; K47-A51 PolarHBondContact O-N 2.94Å; A51-H53 VanDerWaalsContact C-N 3.34Å; A51-H53 PolarHBondContact O-N 3.02Å; A51-D54 PolarHBondContact O-N 2.93Å; A51-W55 WeakPolarHBondContact O-CB 3.49Å; A51-W55 PolarHBondContact O-N 3.24Å
52	R	60.7	Low	60.6	Low	141 Å²	141	97.3 Å²	97.3	53%	0.532	47%	0.469	S	S	.	.	H	α-helix	trans	-65.2	-36.4	175.1	-79.3	176.9	174.9	-179.3	-1.2	112.7	S48 Q49 Q50 W55 Q56	S48-R52 WeakPolarHBondContact O-CG 3.45Å; S48-R52 PolarHBondContact O-N 3.45Å; Q49-R52 PolarHBondContact O-N 3.49Å; Q49-R52 VanDerWaalsContact O-N 3.17Å; Q50-R52 VanDerWaalsContact C-N 3.28Å; Q50-R52 PolarHBondContact O-N 2.86Å; R52-W55 PolarHBondContact O-N 3.42Å; R52-Q56 WeakPolarHBondContact O-CB 3.38Å; R52-Q56 VanDerWaalsContact O-CG 3.3Å; R52-Q56 WeakPolarHBondContact O-CG 3.3Å; R52-Q56 PolarHBondContact O-N 3.49Å
53	H	58.3	Low	58.7	Low	93 Å²	93	103.9 Å²	103.9	43%	0.431	50%	0.504	S	S	.	.	H	α-helix	trans	-66.1	-42.5	177.2	-134.7	-63.3	0	0	0	111.4	Q49 Q50 A51 Q56 Q57	Q49-H53 PolarHBondContact O-N 3.18Å; Q50-H53 WeakPolarHBondContact O-CA 3.35Å; Q50-H53 WeakPolarHBondContact O-CB 3.43Å; Q50-H53 PolarHBondContact O-N 2.86Å; A51-H53 VanDerWaalsContact C-N 3.34Å; A51-H53 PolarHBondContact O-N 3.02Å; H53-Q56 PolarHBondContact O-N 3.24Å; H53-Q57 WeakPolarHBondContact O-CG 3.44Å; H53-Q57 PolarHBondContact O-N 3.46Å; H53-Q57 VanDerWaalsContact O-N 3.15Å
54	D	54.2	Low	56.8	Low	82 Å²	82	111.5 Å²	111.5	44%	0.439	54%	0.539	S	S	.	.	H	α-helix	trans	-64.1	-45	175.5	-54.9	-33	0	0	0	111.1	Q50 A51 L58	Q50-D54 VanDerWaalsContact O-CG 3.3Å; Q50-D54 PolarHBondContact O-N 2.97Å; A51-D54 PolarHBondContact O-N 2.93Å; D54-L58 WeakPolarHBondContact O-CG 3.32Å
55	W	51.7	Low	55	Low	174 Å²	174	114.7 Å²	114.7	66%	0.659	55%	0.553	S	S	*	*	H	α-helix	trans	-65.8	-38.1	177.1	-88.1	99.1	0	0	0	113.3	A51 R52 L58	A51-W55 WeakPolarHBondContact O-CB 3.49Å; A51-W55 PolarHBondContact O-N 3.24Å; R52-W55 PolarHBondContact O-N 3.42Å; W55-L58 PolarHBondContact O-N 3.17Å
56	Q	52.7	Low	52.9	Low	103 Å²	103	114.1 Å²	114.1	48%	0.481	58%	0.576	S	S	.	*	H	α-helix	trans	-70.8	-36.3	179.1	-74.8	-174.2	-106.8	0	0	112.1	R52 H53 L58 H59	R52-Q56 WeakPolarHBondContact O-CB 3.38Å; R52-Q56 VanDerWaalsContact O-CG 3.3Å; R52-Q56 WeakPolarHBondContact O-CG 3.3Å; R52-Q56 PolarHBondContact O-N 3.49Å; H53-Q56 PolarHBondContact O-N 3.24Å; Q56-L58 PolarHBondContact O-N 3.43Å; Q56-H59 PolarHBondContact O-N 3.49Å
57	Q	51	Low	51.6	Low	155 Å²	155	119.2 Å²	119.2	72%	0.724	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67	-12.7	174.6	-74.9	-173.3	-10.3	0	0	114.3	H53	H53-Q57 WeakPolarHBondContact O-CG 3.44Å; H53-Q57 PolarHBondContact O-N 3.46Å; H53-Q57 VanDerWaalsContact O-N 3.15Å
58	L	46.2	Very low	49.5	Very low	133 Å²	133	119.1 Å²	119.1	70%	0.696	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.1	-7.2	-180	-75.6	167.6	0	0	0	114.5	D54 W55 Q56	D54-L58 WeakPolarHBondContact O-CG 3.32Å; W55-L58 PolarHBondContact O-N 3.17Å; Q56-L58 PolarHBondContact O-N 3.43Å
59	H	48.7	Very low	47.6	Very low	136 Å²	136	126.3 Å²	126.3	63%	0.63	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-137.5	-1.9	-161.6	-96.6	-70.1	0	0	0	118.6	Q56	Q56-H59 PolarHBondContact O-N 3.49Å
60	E	36.5	Very low	46.1	Very low	159 Å²	159	132.3 Å²	132.3	74%	0.743	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-83.2	124.1	172.3	-78	-177.7	166.9	0	0	111.9
61	P	40.9	Very low	44.6	Very low	110 Å²	110	134.7 Å²	134.7	71%	0.714	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-77.8	146	172.1	32.6	-33.4	0	0	0	111.2	D63	P61-D63 PolarHBondContact O-N 2.94Å
62	Y	36.1	Very low	43.1	Very low	216 Å²	216	137.9 Å²	137.9	85%	0.847	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-75	116.7	169.3	-89.4	-105.8	0	0	0	110.4
63	D	39.2	Very low	41.7	Very low	149 Å²	149	134.5 Å²	134.5	80%	0.797	72%	0.722	S	S	*	*			trans	-128.4	111.8	158.3	-92.3	-49.5	0	0	0	109.9	P61 T65	P61-D63 PolarHBondContact O-N 2.94Å; D63-T65 PolarHBondContact O-N 3.49Å
64	E	37	Very low	40.4	Very low	177 Å²	177	136.3 Å²	136.3	83%	0.827	74%	0.744	S	S	*	*			trans	-85	81.9	178.4	-66.9	-177	152.5	0	0	110.4
65	T	42.8	Very low	39.7	Very low	127 Å²	127	138.4 Å²	138.4	78%	0.779	75%	0.752	S	S	*	*			trans	-158.8	128.1	159.9	-3.9	0	0	0	0	112.7	D63 T67	D63-T65 PolarHBondContact O-N 3.49Å; T65-T67 PolarHBondContact O-N 2.85Å
66	G	33.2	Very low	39.3	Very low	80 Å²	80	137.7 Å²	137.7	83%	0.825	75%	0.749	S	S	*	*			trans	-78.6	110.8	176.9	0	0	0	0	0	112.2
67	T	42.9	Very low	39.1	Very low	135 Å²	135	138.9 Å²	138.9	83%	0.828	75%	0.749	S	S	*	*			trans	-138.5	134.4	150.7	23.9	0	0	0	0	109.7	T65 F69	T65-T67 PolarHBondContact O-N 2.85Å; T67-F69 PolarHBondContact O-N 3.38Å
68	S	32	Very low	39.4	Very low	110 Å²	110	132.9 Å²	132.9	77%	0.769	72%	0.721	S	S	*	*			trans	-74.3	120.9	179	54.4	0	0	0	0	111
69	F	33.3	Very low	40.2	Very low	208 Å²	208	129.6 Å²	129.6	91%	0.912	71%	0.707	S	S	*	*			trans	-129.6	120.3	155.2	-119.7	-90.3	0	0	0	110.1	T67	T67-F69 PolarHBondContact O-N 3.38Å
70	I	36.9	Very low	41.1	Very low	155 Å²	155	124.8 Å²	124.8	80%	0.795	69%	0.688	S	S	*	*			trans	-92.4	125.1	177.1	-61.8	167.3	0	0	0	106.8
71	D	37.9	Very low	42.6	Very low	142 Å²	142	125 Å²	125	76%	0.759	69%	0.686	S	S	*	*			trans	-151.5	137.8	150.1	-142	-21.5	0	0	0	115.1
72	S	33.3	Very low	43.8	Very low	111 Å²	111	119.9 Å²	119.9	78%	0.776	65%	0.653	S	S	*	*			trans	28.5	103.1	153.8	-64.3	0	0	0	0	120.7
73	G	31.5	Very low	45.4	Very low	70 Å²	70	109.6 Å²	109.6	72%	0.722	61%	0.612	S	S	*	*			trans	-171.1	21.5	170.2	0	0	0	0	0	119.2	Q75	G73-Q75 PolarHBondContact O-N 2.82Å
74	S	30.9	Very low	47	Very low	130 Å²	130	104.9 Å²	104.9	91%	0.909	59%	0.586	S	S	*	*			trans	-61.3	101	-169.7	-168.8	0	0	0	0	114.1
75	Q	39.4	Very low	48.6	Very low	126 Å²	126	97.4 Å²	97.4	59%	0.589	55%	0.552	S	S	*	*			trans	-127.4	109.3	174.5	-73.5	-169.9	-6.2	0	0	111.3	G73 R77	G73-Q75 PolarHBondContact O-N 2.82Å; Q75-R77 HydrophobicContact CB-CG 4.38Å; Q75-R77 PolarHBondContact O-N 3.22Å
76	R	43	Very low	50.1	Low	160 Å²	160	91.3 Å²	91.3	60%	0.604	52%	0.515	S	S	*	.			trans	-58.2	100.6	171.1	-66.9	173.7	168.1	157	-3.1	110.6	S5 G7	S5-R76 PolarHBondContact O-NH1 2.91Å; G7-R76 PolarHBondContact O-NH1 3.48Å; G7-R76 PolarHBondContact O-NH2 3.22Å
77	R	48.2	Very low	52.2	Low	128 Å²	128	87.6 Å²	87.6	48%	0.483	48%	0.476	S	S	.	.			trans	-118.2	115.6	-179.2	-70.9	-178.8	-175.6	-174.6	7.7	111.3	Q75	Q75-R77 HydrophobicContact CB-CG 4.38Å; Q75-R77 PolarHBondContact O-N 3.22Å
78	L	57.2	Low	53.6	Low	28 Å²	28	81.8 Å²	81.8	15%	0.147	44%	0.44	C	S	.	.			trans	-55.2	137.9	160.3	-76.2	161.3	0	0	0	110	A19 L23 Q49 L83	A19-L78 HydrophobicContact CB-CD2 4.42Å; L23-L78 HydrophobicContact CD2-CD1 4.14Å; Q49-L78 PolarHBondContact NE2-O 3.46Å; Q49-L78 PolarHBondContact OE1-O 3.35Å; L78-L83 HydrophobicContact CB-CD2 4.35Å; L78-L83 HydrophobicContact CB-CG 4.45Å; L78-L83 HydrophobicContact CD1-CD2 3.91Å
79	T	64.4	Low	55.7	Low	64 Å²	64	77.4 Å²	77.4	39%	0.393	41%	0.407	S	S	.	.			trans	-67.4	152.5	173.6	55.9	0	0	0	0	112.2	K81 S82 L83	T79-K81 VanDerWaalsContact C-N 3.27Å; T79-K81 PolarHBondContact O-N 3.31Å; T79-S82 PolarHBondContact N-OG 2.76Å; T79-S82 PolarHBondContact O-N 2.66Å; T79-S82 PolarHBondContact O-OG 2.83Å; T79-S82 WeakPolarHBondContact OG1-CB 3.23Å; T79-S82 PolarHBondContact OG1-N 3.49Å; T79-S82 PolarHBondContact OG1-OG 3.08Å; T79-L83 PolarHBondContact O-N 3.23Å
80	T	67.4	Low	58	Low	36 Å²	36	67.5 Å²	67.5	22%	0.221	36%	0.363	C	S	.	.	H	α-helix	trans	-55.5	-42.1	176.2	44.6	0	0	0	0	112.1	Q49 S82 L83 Q84	Q49-T80 HydrophobicContact CB-CG2 3.98Å; T80-S82 PolarHBondContact O-N 3.12Å; T80-L83 PolarHBondContact O-N 3.45Å; T80-Q84 PolarHBondContact O-N 3.3Å
81	K	67.3	Low	60.1	Low	163 Å²	163	60.5 Å²	60.5	71%	0.709	33%	0.327	S	S	*	.	H	α-helix	trans	-53	-52.1	171.8	-70.5	-170.2	174.7	-170.4	0	112.1	T79 L83 Q84 T85	T79-K81 VanDerWaalsContact C-N 3.27Å; T79-K81 PolarHBondContact O-N 3.31Å; K81-L83 VanDerWaalsContact C-N 3.26Å; K81-L83 PolarHBondContact O-N 2.9Å; K81-Q84 WeakPolarHBondContact O-CA 3.5Å; K81-Q84 WeakPolarHBondContact O-CB 3.38Å; K81-Q84 PolarHBondContact O-N 3.02Å; K81-T85 PolarHBondContact O-N 3.07Å; K81-T85 PolarHBondContact O-OG1 3.25Å
82	S	66.4	Low	62	Low	2 Å²	2	54.2 Å²	54.2	1%	0.014	29%	0.292	C	S	.	.	H	α-helix	trans	-63	-28.7	-177.8	72.6	0	0	0	0	114	T79 T80 C86	T79-S82 PolarHBondContact N-OG 2.76Å; T79-S82 PolarHBondContact O-N 2.66Å; T79-S82 PolarHBondContact O-OG 2.83Å; T79-S82 WeakPolarHBondContact OG1-CB 3.23Å; T79-S82 PolarHBondContact OG1-N 3.49Å; T79-S82 PolarHBondContact OG1-OG 3.08Å; T80-S82 PolarHBondContact O-N 3.12Å; S82-C86 WeakPolarHBondContact O-CB 3.47Å; S82-C86 PolarHBondContact O-N 3.34Å
83	L	69.7	Low	64.3	Low	1 Å²	1	48.9 Å²	48.9	1%	0.005	26%	0.255	C	S	.	.	H	α-helix	trans	-75.2	-34.3	171.3	-70.5	-169.5	0	0	0	112.5	L23 L42 R45 L46 L78 T79 T80 K81 C86 L87	L23-L83 HydrophobicContact CD2-CD2 4.26Å; L42-L83 HydrophobicContact CD1-CD2 4.04Å; R45-L83 HydrophobicContact CB-CD1 4.44Å; R45-L83 HydrophobicContact CG-CD1 3.96Å; L46-L83 HydrophobicContact CD1-CB 3.61Å; L46-L83 HydrophobicContact CD1-CD1 4.5Å; L78-L83 HydrophobicContact CB-CD2 4.35Å; L78-L83 HydrophobicContact CB-CG 4.45Å; L78-L83 HydrophobicContact CD1-CD2 3.91Å; T79-L83 PolarHBondContact O-N 3.23Å; T80-L83 PolarHBondContact O-N 3.45Å; K81-L83 VanDerWaalsContact C-N 3.26Å; K81-L83 PolarHBondContact O-N 2.9Å; L83-C86 PolarHBondContact O-N 3.45Å; L83-L87 WeakPolarHBondContact O-CG 3.24Å; L83-L87 PolarHBondContact O-N 3.46Å
84	Q	72.2	Confident	66.8	Low	50 Å²	50	45.6 Å²	45.6	23%	0.234	22%	0.221	C	C	.	.	H	α-helix	trans	-65	-52.6	174.7	-175.1	57.1	45.2	0	0	111	T80 K81 C86 L87 D88 L111	T80-Q84 PolarHBondContact O-N 3.3Å; K81-Q84 WeakPolarHBondContact O-CA 3.5Å; K81-Q84 WeakPolarHBondContact O-CB 3.38Å; K81-Q84 PolarHBondContact O-N 3.02Å; Q84-C86 PolarHBondContact O-N 3.17Å; Q84-L87 WeakPolarHBondContact O-CA 3.48Å; Q84-L87 WeakPolarHBondContact O-CB 3.36Å; Q84-L87 PolarHBondContact O-N 3.02Å; Q84-D88 PolarHBondContact NE2-OD1 2.85Å; Q84-D88 PolarHBondContact NE2-OD2 3.19Å; Q84-D88 PolarHBondContact O-N 3.44Å; Q84-D88 VanDerWaalsContact O-OD2 3.1Å; Q84-L111 VanDerWaalsContact NE2-CD2 3.3Å
85	T	71.1	Confident	69.3	Low	19 Å²	19	39.4 Å²	39.4	12%	0.117	18%	0.178	C	C	.	.	H	α-helix	trans	-54.2	-33.1	175	-40.8	0	0	0	0	111.9	F24 K81 Y89 D120	F24-T85 HydrophobicContact CZ-CG2 4.48Å; K81-T85 PolarHBondContact O-N 3.07Å; K81-T85 PolarHBondContact O-OG1 3.25Å; T85-Y89 WeakPolarHBondContact O-CB 3.36Å; T85-Y89 PolarHBondContact O-N 3.36Å; T85-D120 PolarHBondContact OG1-OD1 3.32Å
86	C	74.6	Confident	71.3	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-73.4	-34.6	175.2	-173.1	0	0	0	0	113.9	L23 F24 S82 L83 Q84 C90	L23-C86 HydrophobicContact CD2-CB 3.97Å; L23-C86 WeakPolarHBondContact CD2-SG 3.44Å; L23-C86 VanDerWaalsContact CG-SG 3.57Å; F24-C86 HydrophobicContact CD1-CB 4.49Å; F24-C86 HydrophobicContact CE1-CB 4.03Å; S82-C86 WeakPolarHBondContact O-CB 3.47Å; S82-C86 PolarHBondContact O-N 3.34Å; L83-C86 PolarHBondContact O-N 3.45Å; Q84-C86 PolarHBondContact O-N 3.17Å; C86-C90 WeakPolarHBondContact O-CB 3.41Å; C86-C90 PolarHBondContact O-N 3.03Å
87	L	76.2	Confident	73.3	Confident	2 Å²	2	27.7 Å²	27.7	1%	0.01	13%	0.129	C	C	.	.	H	α-helix	trans	-70.4	-37.4	172	-75.9	164.7	0	0	0	111.7	L42 I43 L46 L83 Q84 C90 F91 L106 L111	L42-L87 HydrophobicContact CB-CD2 4.5Å; L42-L87 HydrophobicContact CD2-CD2 3.74Å; L42-L87 HydrophobicContact CD2-CG 4.12Å; L42-L87 HydrophobicContact CG-CD2 3.94Å; L42-L87 HydrophobicContact CG-CG 4.26Å; I43-L87 HydrophobicContact CG1-CD2 3.94Å; L46-L87 HydrophobicContact CB-CD1 4.01Å; L46-L87 HydrophobicContact CD1-CD1 4.12Å; L46-L87 HydrophobicContact CD2-CD1 3.66Å; L46-L87 HydrophobicContact CG-CD1 4.12Å; L83-L87 WeakPolarHBondContact O-CG 3.24Å; L83-L87 PolarHBondContact O-N 3.46Å; Q84-L87 WeakPolarHBondContact O-CA 3.48Å; Q84-L87 WeakPolarHBondContact O-CB 3.36Å; Q84-L87 PolarHBondContact O-N 3.02Å; L87-C90 CarbonylContact O-C 3.5Å; L87-C90 WeakPolarHBondContact O-CB 3.27Å; L87-C90 PolarHBondContact O-N 2.84Å; L87-F91 WeakPolarHBondContact O-CB 3.25Å; L87-F91 PolarHBondContact O-N 3Å; L87-L106 HydrophobicContact CD2-CD2 3.77Å; L87-L111 HydrophobicContact CB-CD1 4.5Å
88	D	73.6	Confident	75	Confident	13 Å²	13	25.1 Å²	25.1	7%	0.07	12%	0.122	C	C	.	.	H	α-helix	trans	-66	-42.5	175.7	-57.1	-39.5	0	0	0	111.1	Q84 F91 R92 H115	Q84-D88 PolarHBondContact NE2-OD1 2.85Å; Q84-D88 PolarHBondContact NE2-OD2 3.19Å; Q84-D88 PolarHBondContact O-N 3.44Å; Q84-D88 VanDerWaalsContact O-OD2 3.1Å; D88-F91 PolarHBondContact O-N 3.34Å; D88-R92 PolarHBondContact O-N 3.35Å; D88-H115 IonicContact OD1-CD2 2.78Å
89	Y	76.3	Confident	76.3	Confident	18 Å²	18	27.5 Å²	27.5	7%	0.071	13%	0.129	C	C	.	.	H	α-helix	trans	-64.4	-39.2	170.5	-176.5	-115.2	0	0	0	112.4	F24 T85 F91 R92 L93 T167 P169	F24-Y89 HydrophobicContact CB-CD1 4.05Å; F24-Y89 HydrophobicContact CB-CE1 3.73Å; F24-Y89 AromaticContact CD1-CD1 3.77Å; F24-Y89 HydrophobicContact CD1-CD1 3.77Å; F24-Y89 HydrophobicContact CD1-CE1 4.35Å; F24-Y89 HydrophobicContact CD1-CG 4.43Å; F24-Y89 HydrophobicContact CD2-CD1 4.47Å; F24-Y89 HydrophobicContact CE1-CD1 4.31Å; F24-Y89 AromaticContact CG-CD1 3.85Å; F24-Y89 HydrophobicContact CG-CD1 3.85Å; F24-Y89 AromaticContact CG-CE1 3.99Å; F24-Y89 HydrophobicContact CG-CE1 3.99Å; T85-Y89 WeakPolarHBondContact O-CB 3.36Å; T85-Y89 PolarHBondContact O-N 3.36Å; Y89-F91 VanDerWaalsContact C-N 3.32Å; Y89-F91 PolarHBondContact O-N 3.49Å; Y89-R92 PolarHBondContact O-N 2.91Å; Y89-L93 HydrophobicContact CD1-CD1 3.95Å; Y89-L93 HydrophobicContact CD1-CG 4.49Å; Y89-L93 HydrophobicContact CE1-CD1 3.38Å; Y89-L93 HydrophobicContact CE1-CG 4.11Å; Y89-L93 HydrophobicContact CE2-CD1 4.29Å; Y89-L93 HydrophobicContact CE2-CD2 4.37Å; Y89-L93 HydrophobicContact CE2-CG 4.16Å; Y89-L93 WeakPolarHBondContact O-CB 3.3Å; Y89-L93 WeakPolarHBondContact O-CG 3.41Å; Y89-L93 PolarHBondContact O-N 3.46Å; Y89-T167 PolarHBondContact OH-O 3.11Å; Y89-P169 HydrophobicContact CE2-CB 4.42Å
90	C	81.3	Confident	77.3	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-62.6	-38.2	174.3	-172	0	0	0	0	111.8	T27 C86 L87 L93 A94	T27-C90 HydrophobicContact CG2-CB 4.47Å; C86-C90 WeakPolarHBondContact O-CB 3.41Å; C86-C90 PolarHBondContact O-N 3.03Å; L87-C90 CarbonylContact O-C 3.5Å; L87-C90 WeakPolarHBondContact O-CB 3.27Å; L87-C90 PolarHBondContact O-N 2.84Å; C90-L93 PolarHBondContact O-N 2.88Å; C90-A94 VanDerWaalsContact O-CB 3.3Å; C90-A94 WeakPolarHBondContact O-CB 3.49Å; C90-A94 PolarHBondContact O-N 3.49Å
91	F	81.2	Confident	78.2	Confident	7 Å²	7	31 Å²	31	3%	0.031	14%	0.138	C	C	.	.	H	α-helix	trans	-67	-46.3	176.1	-167.2	-122	0	0	0	111.8	L87 D88 Y89 L93 A94 V95 V103 L106 L107 P176 L192	L87-F91 WeakPolarHBondContact O-CB 3.25Å; L87-F91 PolarHBondContact O-N 3Å; D88-F91 PolarHBondContact O-N 3.34Å; Y89-F91 VanDerWaalsContact C-N 3.32Å; Y89-F91 PolarHBondContact O-N 3.49Å; F91-L93 PolarHBondContact O-N 3.47Å; F91-A94 PolarHBondContact O-N 2.96Å; F91-V95 PolarHBondContact O-N 2.9Å; F91-V103 HydrophobicContact CE2-CB 4.47Å; F91-V103 HydrophobicContact CE2-CG1 3.71Å; F91-V103 HydrophobicContact CZ-CG1 4.25Å; F91-L106 HydrophobicContact CB-CD1 4.13Å; F91-L106 HydrophobicContact CD2-CB 3.78Å; F91-L106 HydrophobicContact CD2-CD1 3.79Å; F91-L106 HydrophobicContact CD2-CG 4.41Å; F91-L106 HydrophobicContact CE2-CB 4.16Å; F91-L106 HydrophobicContact CG-CD1 4.47Å; F91-L107 HydrophobicContact CE2-CD2 4.14Å; F91-L107 HydrophobicContact CE2-CG 3.99Å; F91-L107 HydrophobicContact CZ-CD1 4.47Å; F91-L107 HydrophobicContact CZ-CD2 3.81Å; F91-L107 HydrophobicContact CZ-CG 4.09Å; F91-P176 HydrophobicContact CD1-CB 4.22Å; F91-P176 HydrophobicContact CD1-CG 3.89Å; F91-P176 HydrophobicContact CE1-CB 3.62Å; F91-P176 HydrophobicContact CE1-CG 3.58Å; F91-P176 HydrophobicContact CZ-CB 4.46Å; F91-L192 HydrophobicContact CE1-CD2 4.39Å; F91-L192 HydrophobicContact CZ-CD2 3.78Å
92	R	77.4	Confident	79	Confident	10 Å²	10	23.2 Å²	23.2	4%	0.038	10%	0.104	C	C	.	.	H	α-helix	trans	-54.3	-50.5	171.4	177.2	169.6	161.8	-175.5	-12.6	111.5	D88 Y89 A94 V95 V96 I117 L166 S168 L179	D88-R92 PolarHBondContact O-N 3.35Å; Y89-R92 PolarHBondContact O-N 2.91Å; R92-A94 VanDerWaalsContact C-N 3.35Å; R92-A94 PolarHBondContact O-N 3.43Å; R92-V95 PolarHBondContact O-N 3.05Å; R92-V96 VanDerWaalsContact O-CG2 3.31Å; R92-V96 WeakPolarHBondContact O-CG2 3.19Å; R92-V96 PolarHBondContact O-N 2.63Å; R92-I117 HydrophobicContact CB-CD1 3.78Å; R92-I117 HydrophobicContact CB-CG1 4.25Å; R92-I117 HydrophobicContact CB-CG2 3.98Å; R92-I117 HydrophobicContact CG-CD1 4.19Å; R92-L166 PolarHBondContact NE-O 3Å; R92-L166 VanDerWaalsContact NE-O 3.07Å; R92-L166 PolarHBondContact NH2-O 3.41Å; R92-S168 PolarHBondContact NH2-O 2.84Å; R92-L179 HydrophobicContact CG-CD1 4.06Å
93	L	81.2	Confident	79.9	Confident	0 Å²	0	23.1 Å²	23.1	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-66.4	-33.6	178.8	-71.6	-176.9	0	0	0	113	E28 L31 Y89 C90 F91 V95 V96 Y97 T167	E28-L93 HydrophobicContact CB-CD1 3.88Å; E28-L93 HydrophobicContact CG-CD1 4.09Å; L31-L93 HydrophobicContact CD1-CB 3.38Å; L31-L93 HydrophobicContact CD1-CD1 4.21Å; L31-L93 HydrophobicContact CD1-CG 4.49Å; Y89-L93 HydrophobicContact CD1-CD1 3.95Å; Y89-L93 HydrophobicContact CD1-CG 4.49Å; Y89-L93 HydrophobicContact CE1-CD1 3.38Å; Y89-L93 HydrophobicContact CE1-CG 4.11Å; Y89-L93 HydrophobicContact CE2-CD1 4.29Å; Y89-L93 HydrophobicContact CE2-CD2 4.37Å; Y89-L93 HydrophobicContact CE2-CG 4.16Å; Y89-L93 WeakPolarHBondContact O-CB 3.3Å; Y89-L93 WeakPolarHBondContact O-CG 3.41Å; Y89-L93 PolarHBondContact O-N 3.46Å; C90-L93 PolarHBondContact O-N 2.88Å; F91-L93 PolarHBondContact O-N 3.47Å; L93-V95 VanDerWaalsContact C-N 3.35Å; L93-V96 PolarHBondContact O-N 3.19Å; L93-Y97 HydrophobicContact CB-CD2 4.11Å; L93-Y97 HydrophobicContact CB-CE2 4.08Å; L93-Y97 HydrophobicContact CD1-CE2 4.39Å; L93-Y97 HydrophobicContact CD2-CE2 3.92Å; L93-Y97 HydrophobicContact CG-CE2 4.37Å; L93-Y97 WeakPolarHBondContact O-CB 3.39Å; L93-Y97 WeakPolarHBondContact O-CD2 3.33Å; L93-Y97 PolarHBondContact O-N 2.98Å; L93-T167 HydrophobicContact CD2-CG2 4Å
94	A	84.4	Confident	80.6	Confident	0 Å²	0	26 Å²	26	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-65.1	-38.1	175.9	0	0	0	0	0	111.9	C90 F91 R92 Q98 R99 V102 V103 L106	C90-A94 VanDerWaalsContact O-CB 3.3Å; C90-A94 WeakPolarHBondContact O-CB 3.49Å; C90-A94 PolarHBondContact O-N 3.49Å; F91-A94 PolarHBondContact O-N 2.96Å; R92-A94 VanDerWaalsContact C-N 3.35Å; R92-A94 PolarHBondContact O-N 3.43Å; A94-Q98 PolarHBondContact O-N 2.87Å; A94-Q98 VanDerWaalsContact O-N 3.17Å; A94-R99 HydrophobicContact CB-CB 4.48Å; A94-R99 PolarHBondContact O-N 3.23Å; A94-V102 HydrophobicContact CB-CB 4.11Å; A94-V102 HydrophobicContact CB-CG1 3.77Å; A94-V103 HydrophobicContact CB-CG2 3.75Å; A94-L106 HydrophobicContact CB-CD1 4.36Å
95	V	82.9	Confident	81.1	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-66.2	-48.6	171.1	175.9	0	0	0	0	110.9	F91 R92 L93 Y97 Q98 V103 L179 A180 I188	F91-V95 PolarHBondContact O-N 2.9Å; R92-V95 PolarHBondContact O-N 3.05Å; L93-V95 VanDerWaalsContact C-N 3.35Å; V95-Y97 PolarHBondContact O-N 3.09Å; V95-Q98 PolarHBondContact O-N 3.1Å; V95-V103 HydrophobicContact CG2-CG2 4.06Å; V95-L179 HydrophobicContact CG1-CB 3.92Å; V95-A180 HydrophobicContact CG1-CB 4.12Å; V95-I188 HydrophobicContact CG1-CG2 4.32Å; V95-I188 HydrophobicContact CG2-CG2 4.19Å
96	V	81.7	Confident	81.7	Confident	4 Å²	4	25.5 Å²	25.5	2%	0.024	11%	0.114	C	C	.	.	H	α-helix	trans	-63.3	-39.9	-178.3	172.1	0	0	0	0	112.8	R92 L93 Q98 L163 L166 T167	R92-V96 VanDerWaalsContact O-CG2 3.31Å; R92-V96 WeakPolarHBondContact O-CG2 3.19Å; R92-V96 PolarHBondContact O-N 2.63Å; L93-V96 PolarHBondContact O-N 3.19Å; V96-Q98 VanDerWaalsContact C-N 3.25Å; V96-Q98 PolarHBondContact O-N 2.81Å; V96-L163 HydrophobicContact CG1-CD1 4.21Å; V96-L166 HydrophobicContact CG1-CB 3.88Å; V96-L166 HydrophobicContact CG2-CB 3.9Å; V96-T167 HydrophobicContact CG1-CG2 4.22Å
97	Y	83.8	Confident	82.1	Confident	37 Å²	37	26 Å²	26	15%	0.145	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	8.1	174.1	-62.3	-50.3	0	0	0	113.9	E28 L31 K32 L93 V95 R99 T167	E28-Y97 HydrophobicContact CG-CE2 4.21Å; E28-Y97 WeakPolarHBondContact CG-OH 3.17Å; E28-Y97 PolarHBondContact OE1-OH 2.74Å; L31-Y97 HydrophobicContact CB-CD2 3.68Å; L31-Y97 HydrophobicContact CB-CE2 4.16Å; K32-Y97 HydrophobicContact CD-CE1 4.46Å; K32-Y97 WeakPolarHBondContact CE-OH 3.39Å; K32-Y97 HydrophobicContact CG-CD1 4.46Å; K32-Y97 HydrophobicContact CG-CE1 3.9Å; K32-Y97 HydrophobicContact CG-CE2 4.1Å; K32-Y97 PolarHBondContact NZ-OH 2.91Å; L93-Y97 HydrophobicContact CB-CD2 4.11Å; L93-Y97 HydrophobicContact CB-CE2 4.08Å; L93-Y97 HydrophobicContact CD1-CE2 4.39Å; L93-Y97 HydrophobicContact CD2-CE2 3.92Å; L93-Y97 HydrophobicContact CG-CE2 4.37Å; L93-Y97 WeakPolarHBondContact O-CB 3.39Å; L93-Y97 WeakPolarHBondContact O-CD2 3.33Å; L93-Y97 PolarHBondContact O-N 2.98Å; V95-Y97 PolarHBondContact O-N 3.09Å; Y97-R99 PolarHBondContact O-N 2.87Å; Y97-T167 HydrophobicContact CE1-CG2 4.06Å; Y97-T167 WeakPolarHBondContact OH-CG2 3.48Å
98	Q	84.6	Confident	82.5	Confident	73 Å²	73	32 Å²	32	34%	0.341	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.7	33.7	176.2	-53.7	-168.8	15.3	0	0	114.4	A94 V95 V96 K100 T183 N185 I188	A94-Q98 PolarHBondContact O-N 2.87Å; A94-Q98 VanDerWaalsContact O-N 3.17Å; V95-Q98 PolarHBondContact O-N 3.1Å; V96-Q98 VanDerWaalsContact C-N 3.25Å; V96-Q98 PolarHBondContact O-N 2.81Å; Q98-K100 PolarHBondContact O-N 3.31Å; Q98-K100 VanDerWaalsContact O-N 3.08Å; Q98-T183 PolarHBondContact NE2-O 3.46Å; Q98-N185 HydrophobicContact CG-CB 4.31Å; Q98-N185 PolarHBondContact OE1-ND2 3.2Å; Q98-I188 HydrophobicContact CB-CD1 4.23Å
99	R	85.6	Confident	82.4	Confident	78 Å²	78	32.4 Å²	32.4	29%	0.294	15%	0.147	S	C	.	.			trans	-83.8	74.7	-179.2	-63.2	-60.7	-166.7	-179.3	0.3	111	L31 K32 A94 Y97 E101 V102 V103	L31-R99 PolarHBondContact O-NE 2.98Å; L31-R99 PolarHBondContact O-NH2 2.87Å; K32-R99 PolarHBondContact O-NH2 3.37Å; A94-R99 HydrophobicContact CB-CB 4.48Å; A94-R99 PolarHBondContact O-N 3.23Å; Y97-R99 PolarHBondContact O-N 2.87Å; R99-E101 VanDerWaalsContact C-N 3.26Å; R99-E101 PolarHBondContact O-N 3.06Å; R99-V102 HydrophobicContact CB-CB 3.91Å; R99-V102 HydrophobicContact CB-CG2 3.91Å; R99-V102 PolarHBondContact O-N 3.27Å; R99-V103 PolarHBondContact O-N 2.78Å
100	K	85.5	Confident	82.2	Confident	68 Å²	68	34.4 Å²	34.4	30%	0.296	17%	0.173	S	C	.	.	H	α-helix	trans	-46.6	-46.6	-178.1	-175.6	-174.5	-178.6	175.6	0	113.1	Q98 V102 V103 E104 D187 I188 L191	Q98-K100 PolarHBondContact O-N 3.31Å; Q98-K100 VanDerWaalsContact O-N 3.08Å; K100-V102 VanDerWaalsContact C-N 3.33Å; K100-V102 PolarHBondContact O-N 3.25Å; K100-V103 PolarHBondContact O-N 3.31Å; K100-E104 WeakPolarHBondContact O-CB 3.21Å; K100-E104 PolarHBondContact O-N 3.23Å; K100-D187 HydrophobicContact CD-CB 4.01Å; K100-D187 WeakPolarHBondContact CE-OD1 3.26Å; K100-D187 IonicContact NZ-OD1 3.57Å; K100-D187 PolarHBondContact NZ-OD1 3.2Å; K100-I188 HydrophobicContact CB-CG1 4.42Å; K100-L191 HydrophobicContact CG-CD1 3.66Å
101	E	85.7	Confident	81.7	Confident	106 Å²	106	35.5 Å²	35.5	50%	0.495	18%	0.179	S	C	.	.	H	α-helix	trans	-63.7	-39.3	-177.7	-60.3	67.1	-146.8	0	0	111.3	R99 E104 L105	R99-E101 VanDerWaalsContact C-N 3.26Å; R99-E101 PolarHBondContact O-N 3.06Å; E101-E104 PolarHBondContact O-N 3.06Å; E101-L105 WeakPolarHBondContact O-CB 3.4Å; E101-L105 VanDerWaalsContact O-CG 3.27Å; E101-L105 WeakPolarHBondContact O-CG 3.17Å; E101-L105 PolarHBondContact O-N 2.99Å
102	V	84.1	Confident	81.1	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-71.6	-41.5	177.5	179.7	0	0	0	0	111	L31 D36 V39 A94 R99 K100 E104 L105 L106	L31-V102 HydrophobicContact CD2-CB 4.43Å; L31-V102 HydrophobicContact CD2-CG1 3.83Å; L31-V102 HydrophobicContact CD2-CG2 4.19Å; D36-V102 HydrophobicContact CB-CG2 4.49Å; D36-V102 VanDerWaalsContact OD1-CG2 3.26Å; D36-V102 WeakPolarHBondContact OD1-CG2 3.42Å; V39-V102 HydrophobicContact CB-CG1 4.46Å; V39-V102 HydrophobicContact CG1-CG1 4.11Å; V39-V102 HydrophobicContact CG2-CG1 4.03Å; A94-V102 HydrophobicContact CB-CB 4.11Å; A94-V102 HydrophobicContact CB-CG1 3.77Å; R99-V102 HydrophobicContact CB-CB 3.91Å; R99-V102 HydrophobicContact CB-CG2 3.91Å; R99-V102 PolarHBondContact O-N 3.27Å; K100-V102 VanDerWaalsContact C-N 3.33Å; K100-V102 PolarHBondContact O-N 3.25Å; V102-E104 VanDerWaalsContact C-N 3.29Å; V102-E104 PolarHBondContact O-N 3.47Å; V102-L105 PolarHBondContact O-N 3.28Å; V102-L106 HydrophobicContact CG1-CD1 3.82Å; V102-L106 HydrophobicContact CG1-CG 4.38Å; V102-L106 WeakPolarHBondContact O-CB 3.47Å; V102-L106 VanDerWaalsContact O-CG 3.27Å; V102-L106 WeakPolarHBondContact O-CG 3.42Å; V102-L106 PolarHBondContact O-N 2.72Å
103	V	84.3	Confident	80.8	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-59.5	-43.1	173	179.2	0	0	0	0	110	F91 A94 V95 R99 K100 L106 L107 I188 L191 L192	F91-V103 HydrophobicContact CE2-CB 4.47Å; F91-V103 HydrophobicContact CE2-CG1 3.71Å; F91-V103 HydrophobicContact CZ-CG1 4.25Å; A94-V103 HydrophobicContact CB-CG2 3.75Å; V95-V103 HydrophobicContact CG2-CG2 4.06Å; R99-V103 PolarHBondContact O-N 2.78Å; K100-V103 PolarHBondContact O-N 3.31Å; V103-L106 PolarHBondContact O-N 3.38Å; V103-L107 HydrophobicContact CG1-CD1 4.06Å; V103-L107 WeakPolarHBondContact O-CG 3.43Å; V103-L107 PolarHBondContact O-N 3.06Å; V103-I188 HydrophobicContact CG2-CD1 4.49Å; V103-L191 HydrophobicContact CG1-CD2 3.9Å; V103-L192 HydrophobicContact CG1-CD2 4.44Å
104	E	85.1	Confident	80.1	Confident	62 Å²	62	43.4 Å²	43.4	29%	0.29	22%	0.218	S	C	.	.	H	α-helix	trans	-64.9	-43.2	177.3	-152.2	-173.8	139.5	0	0	112.7	K100 E101 V102 L106 L107 K108 L191 Y195	K100-E104 WeakPolarHBondContact O-CB 3.21Å; K100-E104 PolarHBondContact O-N 3.23Å; E101-E104 PolarHBondContact O-N 3.06Å; V102-E104 VanDerWaalsContact C-N 3.29Å; V102-E104 PolarHBondContact O-N 3.47Å; E104-L106 VanDerWaalsContact C-N 3.33Å; E104-L106 PolarHBondContact O-N 3.31Å; E104-L107 PolarHBondContact O-N 3Å; E104-K108 HydrophobicContact CG-CD 4.26Å; E104-K108 VanDerWaalsContact O-CB 3.24Å; E104-K108 WeakPolarHBondContact O-CB 3.38Å; E104-K108 VanDerWaalsContact O-CG 3.25Å; E104-K108 WeakPolarHBondContact O-CG 3.43Å; E104-K108 PolarHBondContact O-N 2.95Å; E104-K108 VanDerWaalsContact OE1-CE 3.23Å; E104-K108 WeakPolarHBondContact OE1-CE 3.49Å; E104-K108 IonicContact OE1-NZ 2.6Å; E104-K108 PolarHBondContact OE1-NZ 2.94Å; E104-L191 HydrophobicContact CB-CD1 3.99Å; E104-L191 HydrophobicContact CG-CD1 4.09Å; E104-Y195 HydrophobicContact CG-CE2 4.31Å
105	L	83.3	Confident	79.2	Confident	57 Å²	57	47.4 Å²	47.4	30%	0.298	24%	0.237	S	C	.	.	H	α-helix	trans	-63.3	-37.7	175.1	-76.2	172	0	0	0	112.4	L40 E101 V102 S109	L40-L105 HydrophobicContact CD2-CD1 4.1Å; L40-L105 HydrophobicContact CD2-CD2 4.07Å; L40-L105 HydrophobicContact CG-CD1 4.41Å; E101-L105 WeakPolarHBondContact O-CB 3.4Å; E101-L105 VanDerWaalsContact O-CG 3.27Å; E101-L105 WeakPolarHBondContact O-CG 3.17Å; E101-L105 PolarHBondContact O-N 2.99Å; V102-L105 PolarHBondContact O-N 3.28Å; L105-S109 WeakPolarHBondContact O-CB 3.2Å; L105-S109 PolarHBondContact O-N 3.32Å
106	L	83.4	Confident	78.1	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-68.8	-44.8	177.9	-76.1	167.7	0	0	0	111.3	V39 I43 L87 F91 A94 V102 V103 E104 S109 L111	V39-L106 HydrophobicContact CG1-CD2 3.99Å; V39-L106 HydrophobicContact CG1-CG 4.26Å; I43-L106 HydrophobicContact CD1-CD2 4Å; I43-L106 HydrophobicContact CG1-CD2 4.23Å; L87-L106 HydrophobicContact CD2-CD2 3.77Å; F91-L106 HydrophobicContact CB-CD1 4.13Å; F91-L106 HydrophobicContact CD2-CB 3.78Å; F91-L106 HydrophobicContact CD2-CD1 3.79Å; F91-L106 HydrophobicContact CD2-CG 4.41Å; F91-L106 HydrophobicContact CE2-CB 4.16Å; F91-L106 HydrophobicContact CG-CD1 4.47Å; A94-L106 HydrophobicContact CB-CD1 4.36Å; V102-L106 HydrophobicContact CG1-CD1 3.82Å; V102-L106 HydrophobicContact CG1-CG 4.38Å; V102-L106 WeakPolarHBondContact O-CB 3.47Å; V102-L106 VanDerWaalsContact O-CG 3.27Å; V102-L106 WeakPolarHBondContact O-CG 3.42Å; V102-L106 PolarHBondContact O-N 2.72Å; V103-L106 PolarHBondContact O-N 3.38Å; E104-L106 VanDerWaalsContact C-N 3.33Å; E104-L106 PolarHBondContact O-N 3.31Å; L106-S109 WeakPolarHBondContact O-CB 3.43Å; L106-S109 PolarHBondContact O-N 3.49Å; L106-S109 VanDerWaalsContact O-N 3.1Å; L106-S109 PolarHBondContact O-OG 3.37Å; L106-L111 HydrophobicContact CB-CD1 3.83Å; L106-L111 HydrophobicContact CD2-CD1 3.62Å; L106-L111 HydrophobicContact CG-CD1 4.29Å
107	L	83.3	Confident	77	Confident	10 Å²	10	51.3 Å²	51.3	5%	0.052	26%	0.257	C	S	.	.	H	α-helix	trans	-65	-45.8	174.2	-67.4	167.8	0	0	0	111.7	F91 V103 E104 S109 G110 L111 P113 L191 L192 Y195	F91-L107 HydrophobicContact CE2-CD2 4.14Å; F91-L107 HydrophobicContact CE2-CG 3.99Å; F91-L107 HydrophobicContact CZ-CD1 4.47Å; F91-L107 HydrophobicContact CZ-CD2 3.81Å; F91-L107 HydrophobicContact CZ-CG 4.09Å; V103-L107 HydrophobicContact CG1-CD1 4.06Å; V103-L107 WeakPolarHBondContact O-CG 3.43Å; V103-L107 PolarHBondContact O-N 3.06Å; E104-L107 PolarHBondContact O-N 3Å; L107-S109 PolarHBondContact O-N 3.15Å; L107-S109 VanDerWaalsContact O-N 3.09Å; L107-G110 PolarHBondContact O-N 3.35Å; L107-L111 WeakPolarHBondContact CD2-O 3.44Å; L107-P113 HydrophobicContact CD2-CB 3.98Å; L107-L191 HydrophobicContact CD1-CD2 3.48Å; L107-L191 VanDerWaalsContact CD1-CD2 3.48Å; L107-L192 HydrophobicContact CD1-CD2 4.2Å; L107-Y195 HydrophobicContact CB-CD1 4.05Å; L107-Y195 HydrophobicContact CB-CD2 4.11Å; L107-Y195 HydrophobicContact CB-CE1 4.15Å; L107-Y195 HydrophobicContact CB-CE2 4.22Å; L107-Y195 HydrophobicContact CB-CG 4.04Å; L107-Y195 HydrophobicContact CD1-CD2 3.54Å; L107-Y195 HydrophobicContact CD1-CE2 4.15Å; L107-Y195 HydrophobicContact CD1-CG 3.88Å; L107-Y195 HydrophobicContact CG-CD2 4.42Å; L107-Y195 HydrophobicContact CG-CG 4.42Å
108	K	83	Confident	75.3	Confident	129 Å²	129	54.2 Å²	54.2	56%	0.561	28%	0.275	S	S	*	.	H	α-helix	trans	-58.8	-20.4	171.4	-76.5	173	165.6	170.2	0	113.5	E104 G110 Y195	E104-K108 HydrophobicContact CG-CD 4.26Å; E104-K108 VanDerWaalsContact O-CB 3.24Å; E104-K108 WeakPolarHBondContact O-CB 3.38Å; E104-K108 VanDerWaalsContact O-CG 3.25Å; E104-K108 WeakPolarHBondContact O-CG 3.43Å; E104-K108 PolarHBondContact O-N 2.95Å; E104-K108 VanDerWaalsContact OE1-CE 3.23Å; E104-K108 WeakPolarHBondContact OE1-CE 3.49Å; E104-K108 IonicContact OE1-NZ 2.6Å; E104-K108 PolarHBondContact OE1-NZ 2.94Å; K108-G110 VanDerWaalsContact C-N 3.34Å; K108-Y195 WeakPolarHBondContact CE-OH 3.31Å; K108-Y195 WeakPolarHBondContact CG-OH 3.5Å
109	S	73.3	Confident	73.6	Confident	21 Å²	21	52.5 Å²	52.5	15%	0.147	27%	0.271	C	S	.	.	H	α-helix	trans	-76.6	-20.9	177.5	84.5	0	0	0	0	113.5	K47 L105 L106 L107	K47-S109 WeakPolarHBondContact CE-O 3.46Å; K47-S109 PolarHBondContact NZ-O 3.26Å; L105-S109 WeakPolarHBondContact O-CB 3.2Å; L105-S109 PolarHBondContact O-N 3.32Å; L106-S109 WeakPolarHBondContact O-CB 3.43Å; L106-S109 PolarHBondContact O-N 3.49Å; L106-S109 VanDerWaalsContact O-N 3.1Å; L106-S109 PolarHBondContact O-OG 3.37Å; L107-S109 PolarHBondContact O-N 3.15Å; L107-S109 VanDerWaalsContact O-N 3.09Å
110	G	70.4	Confident	71.8	Confident	61 Å²	61	51.8 Å²	51.8	63%	0.629	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	118.4	7.4	-177.4	0	0	0	0	0	115.2	L107 K108	L107-G110 PolarHBondContact O-N 3.35Å; K108-G110 VanDerWaalsContact C-N 3.34Å
111	L	72.6	Confident	70	Confident	22 Å²	22	52.1 Å²	52.1	12%	0.115	28%	0.283	C	S	.	.			trans	-74.5	130.6	175.7	-70	162.5	0	0	0	110.5	Q84 L87 L106 L107	Q84-L111 VanDerWaalsContact NE2-CD2 3.3Å; L87-L111 HydrophobicContact CB-CD1 4.5Å; L106-L111 HydrophobicContact CB-CD1 3.83Å; L106-L111 HydrophobicContact CD2-CD1 3.62Å; L106-L111 HydrophobicContact CG-CD1 4.29Å; L107-L111 WeakPolarHBondContact CD2-O 3.44Å
112	H	68	Low	67.5	Low	130 Å²	130	54.5 Å²	54.5	60%	0.602	29%	0.292	S	S	*	.			trans	-72.3	136	174.1	-72.7	-78.1	0	0	0	110.5	D114 H115	H112-D114 PolarHBondContact O-N 3.18Å; H112-H115 PolarHBondContact O-N 3.45Å
113	P	70.7	Confident	65.4	Low	12 Å²	12	60.3 Å²	60.3	8%	0.078	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-23.5	-177.2	28.4	-36.9	0	0	0	113.7	L107 P176 L192 A197	L107-P113 HydrophobicContact CD2-CB 3.98Å; P113-P176 WeakPolarHBondContact O-CG 3.35Å; P113-L192 HydrophobicContact CB-CD2 4.25Å; P113-A197 HydrophobicContact CB-CB 3.91Å; P113-A197 HydrophobicContact CG-CB 4.21Å
114	D	66.5	Low	63.3	Low	41 Å²	41	66.5 Å²	66.5	22%	0.219	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.7	7.9	-178	-63.3	-29.7	0	0	0	113.8	H112 L116 A197 S198 I201	H112-D114 PolarHBondContact O-N 3.18Å; D114-L116 PolarHBondContact O-N 3.33Å; D114-A197 WeakPolarHBondContact OD1-CA 3.41Å; D114-S198 PolarHBondContact OD1-N 3.4Å; D114-S198 WeakPolarHBondContact OD2-CB 3.48Å; D114-S198 PolarHBondContact OD2-N 2.94Å; D114-S198 VanDerWaalsContact OD2-N 3.12Å; D114-S198 PolarHBondContact OD2-OG 2.87Å; D114-I201 HydrophobicContact CB-CD1 4.14Å
115	H	65.5	Low	60.9	Low	85 Å²	85	67.5 Å²	67.5	39%	0.394	37%	0.37	S	S	.	.			trans	-58.4	134.2	177.3	-119.3	47.6	0	0	0	110.9	D88 H112 I117	D88-H115 IonicContact OD1-CD2 2.78Å; H112-H115 PolarHBondContact O-N 3.45Å; H115-I117 PolarHBondContact O-N 3.04Å
116	L	59.6	Low	58.4	Low	67 Å²	67	73.4 Å²	73.4	35%	0.351	39%	0.393	S	S	.	.			trans	-65.6	132.8	166.1	-94.6	73.9	0	0	0	108.2	D114 N118	D114-L116 PolarHBondContact O-N 3.33Å; L116-N118 PolarHBondContact O-N 3.22Å
117	I	58.2	Low	55.9	Low	18 Å²	18	82.4 Å²	82.4	9%	0.092	44%	0.435	C	S	.	.			trans	-77.6	76.6	171.8	-61.8	148.5	0	0	0	107	R92 H115 C119 P176 L179	R92-I117 HydrophobicContact CB-CD1 3.78Å; R92-I117 HydrophobicContact CB-CG1 4.25Å; R92-I117 HydrophobicContact CB-CG2 3.98Å; R92-I117 HydrophobicContact CG-CD1 4.19Å; H115-I117 PolarHBondContact O-N 3.04Å; I117-C119 PolarHBondContact O-N 2.89Å; I117-P176 HydrophobicContact CD1-CG 4.03Å; I117-P176 HydrophobicContact CG1-CG 4.47Å; I117-L179 HydrophobicContact CD1-CD1 3.87Å
118	N	49.6	Very low	53.3	Low	98 Å²	98	85.3 Å²	85.3	52%	0.524	47%	0.468	S	S	.	.			trans	-72.8	119.4	-167	-140.9	52.1	0	0	0	110.3	L116	L116-N118 PolarHBondContact O-N 3.22Å
119	C	49	Very low	50.5	Low	37 Å²	37	82.8 Å²	82.8	25%	0.25	48%	0.479	C	S	.	.			trans	-85.1	128.9	167.3	-174.8	0	0	0	0	109.4	I117 C121	I117-C119 PolarHBondContact O-N 2.89Å; C119-C121 HydrophobicContact CB-CB 4.4Å; C119-C121 WeakPolarHBondContact CB-SG 3.49Å; C119-C121 PolarHBondContact O-N 3.14Å; C119-C121 WeakPolarHBondContact SG-CB 3.47Å; C119-C121 PolarHBondContact SG-N 2.99Å; C119-C121 VanDerWaalsContact SG-N 3.38Å; C119-C121 CovalentContact SG-SG 2.05Å; C119-C121 PolarHBondContact SG-SG 3.37Å
120	D	46.7	Very low	48.5	Very low	63 Å²	63	90.1 Å²	90.1	34%	0.337	51%	0.51	S	S	.	.	S	Bend	trans	-59.5	-6.5	171.1	-68	20.9	0	0	0	113.5	R20 T85 F122 D123	R20-D120 IonicContact CZ-OD2 3.74Å; R20-D120 VanDerWaalsContact NH1-CG 3.28Å; R20-D120 IonicContact NH1-OD2 2.71Å; R20-D120 PolarHBondContact NH1-OD2 2.92Å; R20-D120 IonicContact NH2-OD2 2.86Å; R20-D120 PolarHBondContact NH2-OD2 3.31Å; T85-D120 PolarHBondContact OG1-OD1 3.32Å; D120-F122 PolarHBondContact O-N 3.33Å; D120-D123 PolarHBondContact O-N 3.44Å
121	C	46.7	Very low	46.5	Very low	75 Å²	75	96.7 Å²	96.7	51%	0.507	52%	0.524	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	23.9	-173.4	51.8	0	0	0	0	116.1	C119 C171	C119-C121 HydrophobicContact CB-CB 4.4Å; C119-C121 WeakPolarHBondContact CB-SG 3.49Å; C119-C121 PolarHBondContact O-N 3.14Å; C119-C121 WeakPolarHBondContact SG-CB 3.47Å; C119-C121 PolarHBondContact SG-N 2.99Å; C119-C121 VanDerWaalsContact SG-N 3.38Å; C119-C121 CovalentContact SG-SG 2.05Å; C119-C121 PolarHBondContact SG-SG 3.37Å; C121-C171 PolarHBondContact SG-SG 3.41Å
122	F	34.9	Very low	44.5	Very low	157 Å²	157	106.5 Å²	106.5	69%	0.689	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-135.7	-7.3	173.4	-98.1	-81.7	0	0	0	115.2	D120	D120-F122 PolarHBondContact O-N 3.33Å
123	D	39.3	Very low	42.7	Very low	121 Å²	121	104.5 Å²	104.5	65%	0.647	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.6	-8.6	-169.9	-134.3	1.3	0	0	0	114	D120	D120-D123 PolarHBondContact O-N 3.44Å
124	D	39.8	Very low	40.8	Very low	130 Å²	130	111.8 Å²	111.8	70%	0.695	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.6	-12.9	178.4	-84.9	-8.9	0	0	0	113.6	R17 K126	R17-D124 IonicContact CZ-OD2 2.66Å; R17-D124 IonicContact NH1-OD2 3.19Å; R17-D124 IonicContact NH2-OD1 3.86Å; R17-D124 IonicContact NH2-OD2 3.62Å; R17-D124 PolarHBondContact NH2-OD2 3.05Å; D124-K126 PolarHBondContact O-N 3.32Å
125	S	34	Very low	39.4	Very low	84 Å²	84	115.3 Å²	115.3	59%	0.587	63%	0.627	S	S	*	*			trans	-104.2	50.1	-167.6	67.5	0	0	0	0	114.8	E127	S125-E127 VanDerWaalsContact C-N 3.3Å; S125-E127 PolarHBondContact O-N 3.24Å
126	K	31.8	Very low	37.8	Very low	181 Å²	181	118.4 Å²	118.4	79%	0.787	65%	0.646	S	S	*	*	S	Bend	trans	-88.6	30.6	173.1	-86.1	-172.3	-173.9	168.6	0	114.7	D124	D124-K126 PolarHBondContact O-N 3.32Å
127	E	31.7	Very low	36.6	Very low	188 Å²	188	119.6 Å²	119.6	88%	0.879	67%	0.666	S	S	*	*	S	Bend	trans	-165.3	134	166.3	-113.4	164.5	-137.9	0	0	110	S125	S125-E127 VanDerWaalsContact C-N 3.3Å; S125-E127 PolarHBondContact O-N 3.24Å
128	G	26.9	Very low	35.5	Very low	72 Å²	72	124.3 Å²	124.3	74%	0.742	70%	0.7	S	S	*	*			trans	73.9	128.9	174.7	0	0	0	0	0	116
129	G	25.5	Very low	34.7	Very low	76 Å²	76	123.7 Å²	123.7	78%	0.784	71%	0.708	S	S	*	*			trans	-88.9	147.2	178.6	0	0	0	0	0	113.7
130	H	30.3	Very low	33.9	Very low	174 Å²	174	130.2 Å²	130.2	81%	0.806	74%	0.74	S	S	*	*			trans	-137.7	93.6	173.4	-98.3	-85.6	0	0	0	113.1	R132	H130-R132 PolarHBondContact O-N 2.88Å
131	E	28.9	Very low	33	Very low	199 Å²	199	136.2 Å²	136.2	93%	0.93	77%	0.766	S	S	*	*	S	Bend	trans	-85.2	23.7	179.2	-156.6	-175.7	161.8	0	0	113
132	R	31.3	Very low	32.1	Very low	228 Å²	228	141.8 Å²	141.8	86%	0.86	79%	0.785	S	S	*	*			trans	-143.7	15.5	-155.9	-80.8	-171.3	173.2	170.6	-1.5	118.3	H130	H130-R132 PolarHBondContact O-N 2.88Å
133	A	30.6	Very low	31.8	Very low	89 Å²	89	143.2 Å²	143.2	74%	0.736	79%	0.793	S	S	*	*			trans	-109.8	16.1	-168.3	0	0	0	0	0	116.7
134	L	30.8	Very low	31.5	Very low	164 Å²	164	146 Å²	146	86%	0.859	80%	0.802	S	S	*	*			trans	-135.3	69	-172.2	-102.8	164.8	0	0	0	113.1
135	V	37.1	Very low	31	Very low	116 Å²	116	144.3 Å²	144.3	70%	0.703	81%	0.807	S	S	*	*	S	Bend	trans	-130.7	-39	172.7	178.6	0	0	0	0	112.1	A137	V135-A137 PolarHBondContact O-N 2.75Å
136	D	32.1	Very low	30.7	Very low	149 Å²	149	149.4 Å²	149.4	80%	0.797	82%	0.821	S	S	*	*			trans	-91.1	21.2	-160.8	-51.4	-48	0	0	0	116.2
137	A	33.8	Very low	30.7	Very low	93 Å²	93	147.7 Å²	147.7	77%	0.769	83%	0.825	S	S	*	*			trans	-86.7	-0.9	-174.2	0	0	0	0	0	115.1	V135 A139	V135-A137 PolarHBondContact O-N 2.75Å; A137-A139 PolarHBondContact O-N 2.97Å
138	S	34.5	Very low	30.4	Very low	117 Å²	117	143.9 Å²	143.9	82%	0.818	82%	0.819	S	S	*	*			trans	-95.1	22.3	-167.9	58	0	0	0	0	115.4
139	A	32.5	Very low	30.6	Very low	84 Å²	84	148.5 Å²	148.5	69%	0.694	83%	0.826	S	S	*	*	S	Bend	trans	-119.4	8.4	-163.4	0	0	0	0	0	116.4	A137	A137-A139 PolarHBondContact O-N 2.97Å
140	L	33.4	Very low	30.6	Very low	174 Å²	174	156.2 Å²	156.2	91%	0.911	83%	0.832	S	S	*	*			trans	-135.2	73.3	-177.3	-69.7	175.2	0	0	0	112.3
141	Q	27.7	Very low	30.7	Very low	190 Å²	190	157.2 Å²	157.2	89%	0.888	84%	0.837	S	S	*	*			trans	-145.2	52	176.4	-158.8	-174.7	-3.4	0	0	113.8
142	E	27.8	Very low	30.5	Very low	192 Å²	192	153.7 Å²	153.7	90%	0.897	83%	0.834	S	S	*	*			trans	-157.2	87.8	169.1	-126.1	166.6	-138.1	0	0	111.8
143	E	27.9	Very low	30.4	Very low	187 Å²	187	148.2 Å²	148.2	87%	0.874	83%	0.831	S	S	*	*			trans	176.2	171	145.2	-101.9	-160.8	119.6	0	0	112.1
144	Q	32.8	Very low	30.2	Very low	178 Å²	178	151.6 Å²	151.6	83%	0.832	84%	0.836	S	S	*	*			trans	71.9	73.4	170.9	-55.2	-165	8	0	0	118.9
145	A	29.5	Very low	30.2	Very low	96 Å²	96	151 Å²	151	79%	0.793	83%	0.833	S	S	*	*				78	115	119	0	0	0	0	0	120.9
146	H	27	Very low	29.8	Very low	191 Å²	191	149.3 Å²	149.3	88%	0.884	84%	0.839	S	S	*	*			trans	-55.3	133.8	158.7	-60.8	-111.8	0	0	0	112.8
147	V	31.8	Very low	30.2	Very low	145 Å²	145	151 Å²	151	88%	0.879	84%	0.842	S	S	*	*			trans	-134.2	134	141	-178.9	0	0	0	0	108.4
148	S	26.5	Very low	30.6	Very low	107 Å²	107	148.2 Å²	148.2	75%	0.748	81%	0.814	S	S	*	*			trans	-78.3	147.3	179.7	-66.8	0	0	0	0	112.2
149	L	30.3	Very low	30.9	Very low	170 Å²	170	146.3 Å²	146.3	89%	0.89	80%	0.799	S	S	*	*			trans	-153	123.5	136.8	-113	167.1	0	0	0	111
150	R	25.3	Very low	31	Very low	237 Å²	237	147.3 Å²	147.3	89%	0.894	80%	0.801	S	S	*	*			trans	-84	130.4	173.3	-65	171.7	174.2	167.5	-3.9	108.9
151	Q	32.6	Very low	31.3	Very low	196 Å²	196	142.6 Å²	142.6	92%	0.916	78%	0.783	S	S	*	*			trans	-153.7	104.4	147.5	-117.4	166.6	20.9	0	0	111.5
152	S	25.2	Very low	32	Very low	124 Å²	124	135.9 Å²	135.9	87%	0.867	75%	0.753	S	S	*	*			trans	-78.5	122.8	171.4	51.8	0	0	0	0	110.4
153	S	28.7	Very low	33	Very low	114 Å²	114	129.5 Å²	129.5	80%	0.797	72%	0.724	S	S	*	*			trans	-146.2	148.4	155.7	-169.6	0	0	0	0	109	N155	S153-N155 PolarHBondContact O-N 3.31Å
154	L	26.8	Very low	34	Very low	160 Å²	160	123.2 Å²	123.2	84%	0.838	70%	0.704	S	S	*	*			trans	-74.3	118.7	-176.8	-59.2	90.8	0	0	0	109.6
155	N	30	Very low	34.8	Very low	151 Å²	151	116.7 Å²	116.7	81%	0.807	68%	0.677	S	S	*	*	S	Bend	trans	-179.6	107.4	150.9	-95.2	-21.5	0	0	0	112.2	S153 Q157	S153-N155 PolarHBondContact O-N 3.31Å; N155-Q157 VanDerWaalsContact C-N 3.29Å; N155-Q157 PolarHBondContact O-N 2.9Å
156	G	30.7	Very low	35.9	Very low	80 Å²	80	112.6 Å²	112.6	83%	0.825	64%	0.641	S	S	*	*			trans	53.5	0.3	142.8	0	0	0	0	0	123.3	L158	G156-L158 PolarHBondContact O-N 3.48Å
157	Q	38.6	Very low	37.3	Very low	186 Å²	186	104.4 Å²	104.4	87%	0.869	61%	0.605	S	S	*	*	P	Polyproline II helix	trans	-65.7	135.3	-172.2	-72.1	-178.4	-0.7	0	0	113.2	N155	N155-Q157 VanDerWaalsContact C-N 3.29Å; N155-Q157 PolarHBondContact O-N 2.9Å
158	L	42.4	Very low	38.5	Very low	33 Å²	33	99.3 Å²	99.3	17%	0.173	58%	0.575	C	S	.	*	P	Polyproline II helix	trans	-61.9	153.7	171.6	-80.2	75.4	0	0	0	110.5	G156 S160 L162 L166 T183	G156-L158 PolarHBondContact O-N 3.48Å; L158-S160 PolarHBondContact O-N 3.31Å; L158-L162 HydrophobicContact CB-CB 4.46Å; L158-L162 HydrophobicContact CD2-CB 4.45Å; L158-L162 HydrophobicContact CD2-CD2 4.43Å; L158-L166 HydrophobicContact CD2-CD1 3.63Å; L158-T183 HydrophobicContact CD2-CG2 4.27Å
159	P	40.9	Very low	39.7	Very low	77 Å²	77	97.6 Å²	97.6	50%	0.5	56%	0.562	S	S	.	*	P	Polyproline II helix	trans	-52.1	139.6	170.2	-24	33.4	0	0	0	111.2	S161 L162 L163	P159-S161 PolarHBondContact O-N 3.07Å; P159-S161 VanDerWaalsContact O-N 3.16Å; P159-L162 HydrophobicContact CB-CB 4.31Å; P159-L162 HydrophobicContact CG-CD1 4.3Å; P159-L162 WeakPolarHBondContact O-CA 3.31Å; P159-L162 VanDerWaalsContact O-CB 3.32Å; P159-L162 WeakPolarHBondContact O-CB 3.48Å; P159-L162 PolarHBondContact O-N 2.74Å; P159-L163 PolarHBondContact O-N 2.83Å
160	S	35	Very low	40.6	Very low	106 Å²	106	92.7 Å²	92.7	74%	0.741	54%	0.542	S	S	*	.	H	α-helix	trans	-59.4	-30.1	-174.5	47.3	0	0	0	0	113.7	L158 A164	L158-S160 PolarHBondContact O-N 3.31Å; S160-A164 WeakPolarHBondContact O-CB 3.35Å; S160-A164 PolarHBondContact O-N 3.25Å
161	S	39.2	Very low	41.8	Very low	75 Å²	75	83.4 Å²	83.4	52%	0.524	51%	0.513	S	S	.	.	H	α-helix	trans	-64.7	-42.5	170.8	49.6	0	0	0	0	113.1	P159 A164 T165	P159-S161 PolarHBondContact O-N 3.07Å; P159-S161 VanDerWaalsContact O-N 3.16Å; S161-A164 PolarHBondContact O-N 3.16Å; S161-T165 PolarHBondContact O-N 3.21Å; S161-T165 VanDerWaalsContact O-N 3.11Å; S161-T165 PolarHBondContact O-OG1 3.2Å
162	L	42.6	Very low	42.7	Very low	49 Å²	49	75.5 Å²	75.5	26%	0.257	48%	0.476	S	S	.	.	H	α-helix	trans	-68.6	-38.3	176.7	-119.6	169.4	0	0	0	111.3	L158 P159 T165 L166 F212	L158-L162 HydrophobicContact CB-CB 4.46Å; L158-L162 HydrophobicContact CD2-CB 4.45Å; L158-L162 HydrophobicContact CD2-CD2 4.43Å; P159-L162 HydrophobicContact CB-CB 4.31Å; P159-L162 HydrophobicContact CG-CD1 4.3Å; P159-L162 WeakPolarHBondContact O-CA 3.31Å; P159-L162 VanDerWaalsContact O-CB 3.32Å; P159-L162 WeakPolarHBondContact O-CB 3.48Å; P159-L162 PolarHBondContact O-N 2.74Å; L162-T165 PolarHBondContact O-OG1 3.17Å; L162-T165 VanDerWaalsContact O-OG1 3.12Å; L162-L166 HydrophobicContact CD2-CD1 3.95Å; L162-L166 HydrophobicContact CD2-CG 4.22Å; L162-L166 WeakPolarHBondContact O-CB 3.4Å; L162-L166 WeakPolarHBondContact O-CD1 3.42Å; L162-L166 WeakPolarHBondContact O-CG 3.24Å; L162-L166 PolarHBondContact O-N 3.22Å; L162-L166 VanDerWaalsContact O-N 3.09Å; L162-F212 HydrophobicContact CD2-CE1 4.27Å; L162-F212 HydrophobicContact CD2-CZ 3.89Å; L162-F212 HydrophobicContact CG-CE1 4.15Å; L162-F212 HydrophobicContact CG-CZ 4.26Å
163	L	48.6	Very low	44.2	Very low	58 Å²	58	72.3 Å²	72.3	30%	0.304	45%	0.45	S	S	.	.	H	α-helix	trans	-62.4	-45.2	173.2	-158.2	79.3	0	0	0	110.6	V96 P159 L166 T167	V96-L163 HydrophobicContact CG1-CD1 4.21Å; P159-L163 PolarHBondContact O-N 2.83Å; L163-L166 PolarHBondContact O-N 3.44Å; L163-T167 WeakPolarHBondContact O-CB 3.13Å; L163-T167 VanDerWaalsContact O-CG2 3.26Å; L163-T167 WeakPolarHBondContact O-CG2 3.4Å; L163-T167 PolarHBondContact O-N 2.91Å; L163-T167 PolarHBondContact O-OG1 2.95Å
164	A	48.6	Very low	45.8	Very low	55 Å²	55	67.3 Å²	67.3	46%	0.455	42%	0.415	S	S	.	.	H	α-helix	trans	-59.5	-50.1	179.1	0	0	0	0	0	112.5	S160 S161 L166 T167 S168	S160-A164 WeakPolarHBondContact O-CB 3.35Å; S160-A164 PolarHBondContact O-N 3.25Å; S161-A164 PolarHBondContact O-N 3.16Å; A164-L166 PolarHBondContact O-N 2.88Å; A164-T167 PolarHBondContact O-N 3.09Å; A164-T167 PolarHBondContact O-OG1 3.37Å; A164-S168 PolarHBondContact O-N 3.01Å; A164-S168 VanDerWaalsContact O-N 3.09Å
165	T	51.1	Low	48	Very low	40 Å²	40	61.4 Å²	61.4	25%	0.245	38%	0.381	C	S	.	.	H	α-helix	trans	-62.8	-42.3	178.5	53.6	0	0	0	0	112.2	S161 L162 T167 S168 F211	S161-T165 PolarHBondContact O-N 3.21Å; S161-T165 VanDerWaalsContact O-N 3.11Å; S161-T165 PolarHBondContact O-OG1 3.2Å; L162-T165 PolarHBondContact O-OG1 3.17Å; L162-T165 VanDerWaalsContact O-OG1 3.12Å; T165-T167 VanDerWaalsContact C-N 3.33Å; T165-T167 PolarHBondContact O-N 3.47Å; T165-S168 WeakPolarHBondContact O-CB 3.4Å; T165-S168 PolarHBondContact O-N 2.96Å; T165-F211 HydrophobicContact CG2-CD1 4.27Å; T165-F211 HydrophobicContact CG2-CE1 3.75Å
166	L	52.7	Low	50.2	Low	11 Å²	11	54.3 Å²	54.3	6%	0.058	34%	0.343	C	S	.	.	H	α-helix	trans	-65.5	-33	177.6	-71.5	173.3	0	0	0	113.1	R92 V96 L158 L162 L163 A164 L179	R92-L166 PolarHBondContact NE-O 3Å; R92-L166 VanDerWaalsContact NE-O 3.07Å; R92-L166 PolarHBondContact NH2-O 3.41Å; V96-L166 HydrophobicContact CG1-CB 3.88Å; V96-L166 HydrophobicContact CG2-CB 3.9Å; L158-L166 HydrophobicContact CD2-CD1 3.63Å; L162-L166 HydrophobicContact CD2-CD1 3.95Å; L162-L166 HydrophobicContact CD2-CG 4.22Å; L162-L166 WeakPolarHBondContact O-CB 3.4Å; L162-L166 WeakPolarHBondContact O-CD1 3.42Å; L162-L166 WeakPolarHBondContact O-CG 3.24Å; L162-L166 PolarHBondContact O-N 3.22Å; L162-L166 VanDerWaalsContact O-N 3.09Å; L163-L166 PolarHBondContact O-N 3.44Å; A164-L166 PolarHBondContact O-N 2.88Å; L166-L179 HydrophobicContact CD2-CD2 3.8Å
167	T	56.5	Low	52.7	Low	18 Å²	18	50.9 Å²	50.9	11%	0.11	31%	0.306	C	S	.	.	H	α-helix	trans	-79.5	-19.6	176.1	56.2	0	0	0	0	114.8	Y89 L93 V96 Y97 L163 A164 T165	Y89-T167 PolarHBondContact OH-O 3.11Å; L93-T167 HydrophobicContact CD2-CG2 4Å; V96-T167 HydrophobicContact CG1-CG2 4.22Å; Y97-T167 HydrophobicContact CE1-CG2 4.06Å; Y97-T167 WeakPolarHBondContact OH-CG2 3.48Å; L163-T167 WeakPolarHBondContact O-CB 3.13Å; L163-T167 VanDerWaalsContact O-CG2 3.26Å; L163-T167 WeakPolarHBondContact O-CG2 3.4Å; L163-T167 PolarHBondContact O-N 2.91Å; L163-T167 PolarHBondContact O-OG1 2.95Å; A164-T167 PolarHBondContact O-N 3.09Å; A164-T167 PolarHBondContact O-OG1 3.37Å; T165-T167 VanDerWaalsContact C-N 3.33Å; T165-T167 PolarHBondContact O-N 3.47Å
168	S	55.8	Low	54.6	Low	38 Å²	38	42.1 Å²	42.1	27%	0.266	27%	0.265	S	S	.	.			trans	-60	134.7	-176.6	-174.7	0	0	0	0	112.2	R92 A164 T165 S170	R92-S168 PolarHBondContact NH2-O 2.84Å; A164-S168 PolarHBondContact O-N 3.01Å; A164-S168 VanDerWaalsContact O-N 3.09Å; T165-S168 WeakPolarHBondContact O-CB 3.4Å; T165-S168 PolarHBondContact O-N 2.96Å; S168-S170 PolarHBondContact O-N 3.12Å; S168-S170 PolarHBondContact OG-N 3.01Å; S168-S170 PolarHBondContact OG-OG 3.39Å
169	P	51.5	Low	56.5	Low	71 Å²	71	40.6 Å²	40.6	46%	0.461	26%	0.257	S	S	.	.	S	Bend	trans	-72.1	-7.3	175.1	31.3	-36.2	0	0	0	113.7	Y89	Y89-P169 HydrophobicContact CE2-CB 4.42Å
170	S	50.8	Low	58.5	Low	67 Å²	67	37 Å²	37	47%	0.469	23%	0.234	S	C	.	.	S	Bend	trans	-65.7	148.3	174.5	57.5	0	0	0	0	112.4	S168 I172	S168-S170 PolarHBondContact O-N 3.12Å; S168-S170 PolarHBondContact OG-N 3.01Å; S168-S170 PolarHBondContact OG-OG 3.39Å; S170-I172 PolarHBondContact O-N 3.42Å
171	C	49	Very low	60.9	Low	42 Å²	42	31.9 Å²	31.9	28%	0.284	20%	0.198	S	C	.	.			trans	-44.1	116.5	-176.6	-97	0	0	0	0	114.4	C121	C121-C171 PolarHBondContact SG-SG 3.41Å
172	I	53	Low	62.9	Low	30 Å²	30	30.8 Å²	30.8	15%	0.154	19%	0.185	C	C	.	.			trans	-140.8	105.1	159.4	-52.2	-177.6	0	0	0	106.9	S170 C174	S170-I172 PolarHBondContact O-N 3.42Å; I172-C174 HydrophobicContact CG2-CB 3.88Å; I172-C174 WeakPolarHBondContact CG2-SG 3.35Å; I172-C174 PolarHBondContact O-N 2.83Å
173	D	55.3	Low	64.8	Low	58 Å²	58	28.8 Å²	28.8	31%	0.31	18%	0.175	S	C	.	.			trans	-73.3	36.9	177	-79.9	10.4	0	0	0	113.1	R175 S204	D173-R175 PolarHBondContact O-N 3.07Å; D173-S204 VanDerWaalsContact CB-OG 3.24Å; D173-S204 WeakPolarHBondContact CB-OG 3.4Å; D173-S204 PolarHBondContact OD2-OG 3.28Å
174	C	61.9	Low	66.4	Low	9 Å²	9	29.6 Å²	29.6	6%	0.061	18%	0.176	C	C	.	.			trans	-79.6	121.4	176.3	-78	0	0	0	0	109.8	I172 L179	I172-C174 HydrophobicContact CG2-CB 3.88Å; I172-C174 WeakPolarHBondContact CG2-SG 3.35Å; I172-C174 PolarHBondContact O-N 2.83Å; C174-L179 HydrophobicContact CB-CD1 4.26Å; C174-L179 HydrophobicContact CB-CD2 3.51Å; C174-L179 HydrophobicContact CB-CG 3.71Å
175	R	73.7	Confident	68.2	Low	36 Å²	36	28 Å²	28	14%	0.136	16%	0.16	C	C	.	.			trans	-64.6	148.5	176.9	-75.7	-173.8	-175.8	74.2	6.4	111.4	D173 L177 I178 L179 T202	D173-R175 PolarHBondContact O-N 3.07Å; R175-L177 PolarHBondContact O-N 3.29Å; R175-L177 VanDerWaalsContact O-N 3.11Å; R175-I178 HydrophobicContact CB-CD1 4.45Å; R175-I178 HydrophobicContact CB-CG1 4.46Å; R175-I178 PolarHBondContact O-N 3.09Å; R175-L179 PolarHBondContact O-N 2.91Å; R175-T202 VanDerWaalsContact NH1-C 3.25Å; R175-T202 PolarHBondContact NH1-O 3.42Å
176	P	76.8	Confident	69.9	Low	2 Å²	2	28.9 Å²	28.9	1%	0.013	17%	0.165	C	C	.	.	H	α-helix	trans	-50.3	-38.9	179.7	-29.5	36.2	0	0	0	114.2	F91 P113 I117 L179 A180 L192	F91-P176 HydrophobicContact CD1-CB 4.22Å; F91-P176 HydrophobicContact CD1-CG 3.89Å; F91-P176 HydrophobicContact CE1-CB 3.62Å; F91-P176 HydrophobicContact CE1-CG 3.58Å; F91-P176 HydrophobicContact CZ-CB 4.46Å; P113-P176 WeakPolarHBondContact O-CG 3.35Å; I117-P176 HydrophobicContact CD1-CG 4.03Å; I117-P176 HydrophobicContact CG1-CG 4.47Å; P176-L179 PolarHBondContact O-N 2.81Å; P176-A180 WeakPolarHBondContact O-CB 3.32Å; P176-A180 PolarHBondContact O-N 3.04Å; P176-L192 HydrophobicContact CB-CD1 4.37Å; P176-L192 HydrophobicContact CB-CD2 4.33Å
177	L	82.2	Confident	71.5	Confident	7 Å²	7	32.1 Å²	32.1	4%	0.037	18%	0.182	C	C	.	.	H	α-helix	trans	-67.3	-40.9	176.9	-173.6	63.4	0	0	0	113	R175 A180 V181 V189 L192 A197 V199 A258 L276	R175-L177 PolarHBondContact O-N 3.29Å; R175-L177 VanDerWaalsContact O-N 3.11Å; L177-A180 PolarHBondContact O-N 3.28Å; L177-V181 WeakPolarHBondContact O-CG2 3.43Å; L177-V181 PolarHBondContact O-N 3.35Å; L177-V189 HydrophobicContact CD1-CG1 4.18Å; L177-L192 HydrophobicContact CD1-CB 4.17Å; L177-L192 HydrophobicContact CD1-CD1 4.36Å; L177-A197 HydrophobicContact CD2-CB 4.3Å; L177-V199 HydrophobicContact CD2-CB 4.4Å; L177-V199 HydrophobicContact CD2-CG1 4.39Å; L177-V199 HydrophobicContact CD2-CG2 4.31Å; L177-A258 HydrophobicContact CD2-CB 3.9Å; L177-A258 HydrophobicContact CG-CB 4.06Å; L177-L276 HydrophobicContact CD1-CD2 4.44Å; L177-L276 HydrophobicContact CD2-CD2 4.38Å
178	I	79.3	Confident	72.9	Confident	2 Å²	2	31.3 Å²	31.3	1%	0.01	18%	0.177	C	C	.	.	H	α-helix	trans	-67.9	-39.4	177.3	-60.1	176.3	0	0	0	109.8	R175 A180 V181 E182 D203 A258 A261	R175-I178 HydrophobicContact CB-CD1 4.45Å; R175-I178 HydrophobicContact CB-CG1 4.46Å; R175-I178 PolarHBondContact O-N 3.09Å; I178-A180 VanDerWaalsContact C-N 3.35Å; I178-A180 PolarHBondContact O-N 3.37Å; I178-V181 PolarHBondContact O-N 2.86Å; I178-E182 HydrophobicContact CG2-CG 4.44Å; I178-E182 WeakPolarHBondContact O-CG 3.33Å; I178-E182 PolarHBondContact O-N 2.99Å; I178-D203 HydrophobicContact CD1-CB 3.98Å; I178-A258 HydrophobicContact CG1-CB 4.36Å; I178-A261 HydrophobicContact CG2-CB 4.32Å
179	L	81.3	Confident	74.3	Confident	2 Å²	2	29.5 Å²	29.5	1%	0.01	16%	0.164	C	C	.	.	H	α-helix	trans	-62.3	-38.5	172.7	-67.5	174.6	0	0	0	112.7	R92 V95 I117 L166 C174 R175 P176 V181 E182 T183	R92-L179 HydrophobicContact CG-CD1 4.06Å; V95-L179 HydrophobicContact CG1-CB 3.92Å; I117-L179 HydrophobicContact CD1-CD1 3.87Å; L166-L179 HydrophobicContact CD2-CD2 3.8Å; C174-L179 HydrophobicContact CB-CD1 4.26Å; C174-L179 HydrophobicContact CB-CD2 3.51Å; C174-L179 HydrophobicContact CB-CG 3.71Å; R175-L179 PolarHBondContact O-N 2.91Å; P176-L179 PolarHBondContact O-N 2.81Å; L179-V181 VanDerWaalsContact C-N 3.35Å; L179-E182 PolarHBondContact O-N 3.16Å; L179-T183 WeakPolarHBondContact O-CB 3.5Å; L179-T183 WeakPolarHBondContact O-CG2 3.32Å; L179-T183 PolarHBondContact O-N 2.88Å; L179-T183 PolarHBondContact O-OG1 3.43Å
180	A	84.7	Confident	75.9	Confident	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-67.1	-35.3	175.6	0	0	0	0	0	112.4	V95 P176 L177 I178 T183 K184 N185 I188 V189 L192	V95-A180 HydrophobicContact CG1-CB 4.12Å; P176-A180 WeakPolarHBondContact O-CB 3.32Å; P176-A180 PolarHBondContact O-N 3.04Å; L177-A180 PolarHBondContact O-N 3.28Å; I178-A180 VanDerWaalsContact C-N 3.35Å; I178-A180 PolarHBondContact O-N 3.37Å; A180-T183 WeakPolarHBondContact CA-OG1 3.45Å; A180-T183 PolarHBondContact O-OG1 2.69Å; A180-K184 PolarHBondContact O-N 2.77Å; A180-N185 PolarHBondContact O-N 2.87Å; A180-I188 HydrophobicContact CB-CB 4.49Å; A180-I188 HydrophobicContact CB-CG2 3.82Å; A180-V189 HydrophobicContact CB-CG2 3.63Å; A180-L192 HydrophobicContact CB-CD1 3.69Å
181	V	84.2	Confident	77.6	Confident	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-67.6	-49.6	172.2	170.7	0	0	0	0	111.1	L177 I178 L179 T183 K184 V189 A261 A262 L265 I272 L276	L177-V181 WeakPolarHBondContact O-CG2 3.43Å; L177-V181 PolarHBondContact O-N 3.35Å; I178-V181 PolarHBondContact O-N 2.86Å; L179-V181 VanDerWaalsContact C-N 3.35Å; V181-T183 VanDerWaalsContact C-N 3.33Å; V181-T183 PolarHBondContact O-N 2.68Å; V181-K184 WeakPolarHBondContact O-CA 3.31Å; V181-K184 PolarHBondContact O-N 3.02Å; V181-V189 HydrophobicContact CG2-CG2 4.07Å; V181-A261 HydrophobicContact CG1-CB 4.26Å; V181-A262 HydrophobicContact CG1-CB 3.76Å; V181-L265 HydrophobicContact CG1-CD1 3.81Å; V181-L265 WeakPolarHBondContact O-CD1 3.38Å; V181-I272 HydrophobicContact CG1-CG2 4.41Å; V181-I272 HydrophobicContact CG2-CG2 3.89Å; V181-L276 HydrophobicContact CG2-CD1 4.18Å
182	E	81.6	Confident	79.3	Confident	52 Å²	52	22.4 Å²	22.4	24%	0.243	12%	0.116	C	C	.	.	H	α-helix	trans	-65.6	-32.1	-179.5	-72.4	-178.1	166.7	0	0	112.9	I178 L179 K184 R256	I178-E182 HydrophobicContact CG2-CG 4.44Å; I178-E182 WeakPolarHBondContact O-CG 3.33Å; I178-E182 PolarHBondContact O-N 2.99Å; L179-E182 PolarHBondContact O-N 3.16Å; E182-K184 PolarHBondContact O-N 3.33Å; E182-R256 IonicContact OE1-CZ 3.81Å; E182-R256 VanDerWaalsContact OE1-CZ 3.27Å; E182-R256 IonicContact OE1-NH1 3.69Å; E182-R256 PolarHBondContact OE1-NH1 3.24Å; E182-R256 IonicContact OE1-NH2 3Å; E182-R256 PolarHBondContact OE1-NH2 3.29Å
183	T	81.5	Confident	80.8	Confident	7 Å²	7	21 Å²	21	4%	0.043	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-4.1	170.4	53.1	0	0	0	0	114.1	Q98 L158 L179 A180 V181 N185	Q98-T183 PolarHBondContact NE2-O 3.46Å; L158-T183 HydrophobicContact CD2-CG2 4.27Å; L179-T183 WeakPolarHBondContact O-CB 3.5Å; L179-T183 WeakPolarHBondContact O-CG2 3.32Å; L179-T183 PolarHBondContact O-N 2.88Å; L179-T183 PolarHBondContact O-OG1 3.43Å; A180-T183 WeakPolarHBondContact CA-OG1 3.45Å; A180-T183 PolarHBondContact O-OG1 2.69Å; V181-T183 VanDerWaalsContact C-N 3.33Å; V181-T183 PolarHBondContact O-N 2.68Å; T183-N185 PolarHBondContact O-N 3.05Å
184	K	84.2	Confident	82.1	Confident	74 Å²	74	27.5 Å²	27.5	32%	0.322	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.1	23.7	179.3	-54.9	-170	-178.8	-164.1	0	115	A180 V181 E182 V186 L265 S266 P267	A180-K184 PolarHBondContact O-N 2.77Å; V181-K184 WeakPolarHBondContact O-CA 3.31Å; V181-K184 PolarHBondContact O-N 3.02Å; E182-K184 PolarHBondContact O-N 3.33Å; K184-V186 PolarHBondContact O-N 3.02Å; K184-L265 HydrophobicContact CG-CD1 4.24Å; K184-S266 VanDerWaalsContact NZ-C 3.26Å; K184-S266 PolarHBondContact NZ-O 3.45Å; K184-P267 PolarHBondContact NZ-O 3.44Å; K184-P267 VanDerWaalsContact NZ-O 3.1Å
185	N	85.1	Confident	83	Confident	23 Å²	23	31.2 Å²	31.2	12%	0.123	14%	0.143	C	C	.	.			trans	-89.1	99.7	-177.3	-171.2	-70.6	0	0	0	111.3	Q98 A180 T183 D187 I188 V189	Q98-N185 HydrophobicContact CG-CB 4.31Å; Q98-N185 PolarHBondContact OE1-ND2 3.2Å; A180-N185 PolarHBondContact O-N 2.87Å; T183-N185 PolarHBondContact O-N 3.05Å; N185-D187 VanDerWaalsContact C-N 3.32Å; N185-D187 PolarHBondContact O-N 3.49Å; N185-D187 WeakPolarHBondContact OD1-CB 3.2Å; N185-D187 PolarHBondContact OD1-N 2.86Å; N185-I188 HydrophobicContact CB-CB 4.35Å; N185-I188 HydrophobicContact CB-CD1 4.43Å; N185-I188 PolarHBondContact O-N 2.78Å; N185-I188 WeakPolarHBondContact OD1-CB 3.49Å; N185-I188 VanDerWaalsContact OD1-CG1 3.32Å; N185-I188 WeakPolarHBondContact OD1-CG1 3.46Å; N185-I188 PolarHBondContact OD1-N 3.2Å; N185-V189 WeakPolarHBondContact O-CG2 3.48Å; N185-V189 PolarHBondContact O-N 3.1Å; N185-V189 VanDerWaalsContact O-N 3.07Å
186	V	86.1	Confident	83	Confident	58 Å²	58	35.5 Å²	35.5	35%	0.352	17%	0.168	S	C	.	.	H	α-helix	trans	-57.5	-42.2	-178.3	-171.2	0	0	0	0	112	K184 V189 S190 A271 I272 I275	K184-V186 PolarHBondContact O-N 3.02Å; V186-V189 PolarHBondContact O-N 2.76Å; V186-S190 WeakPolarHBondContact O-CB 3.49Å; V186-S190 PolarHBondContact O-N 3.48Å; V186-A271 HydrophobicContact CG1-CB 4.23Å; V186-A271 HydrophobicContact CG2-CB 4.43Å; V186-I272 HydrophobicContact CG2-CD1 4.48Å; V186-I272 HydrophobicContact CG2-CG1 4.08Å; V186-I275 HydrophobicContact CG1-CD1 3.55Å
187	D	87.3	Confident	83.1	Confident	79 Å²	79	35.8 Å²	35.8	42%	0.422	17%	0.171	S	C	.	.	H	α-helix	trans	-58.8	-49.4	178.7	-84.9	-81.5	0	0	0	112.2	K100 N185 S190 L191	K100-D187 HydrophobicContact CD-CB 4.01Å; K100-D187 WeakPolarHBondContact CE-OD1 3.26Å; K100-D187 IonicContact NZ-OD1 3.57Å; K100-D187 PolarHBondContact NZ-OD1 3.2Å; N185-D187 VanDerWaalsContact C-N 3.32Å; N185-D187 PolarHBondContact O-N 3.49Å; N185-D187 WeakPolarHBondContact OD1-CB 3.2Å; N185-D187 PolarHBondContact OD1-N 2.86Å; D187-S190 PolarHBondContact O-N 3.43Å; D187-S190 PolarHBondContact O-OG 3.35Å; D187-L191 VanDerWaalsContact O-CB 3.24Å; D187-L191 WeakPolarHBondContact O-CB 3.33Å; D187-L191 PolarHBondContact O-N 3.05Å
188	I	86.1	Confident	82.8	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-71.6	-36.5	-177.2	-68.1	171.6	0	0	0	111.3	V95 Q98 K100 V103 A180 N185 L191 L192	V95-I188 HydrophobicContact CG1-CG2 4.32Å; V95-I188 HydrophobicContact CG2-CG2 4.19Å; Q98-I188 HydrophobicContact CB-CD1 4.23Å; K100-I188 HydrophobicContact CB-CG1 4.42Å; V103-I188 HydrophobicContact CG2-CD1 4.49Å; A180-I188 HydrophobicContact CB-CB 4.49Å; A180-I188 HydrophobicContact CB-CG2 3.82Å; N185-I188 HydrophobicContact CB-CB 4.35Å; N185-I188 HydrophobicContact CB-CD1 4.43Å; N185-I188 PolarHBondContact O-N 2.78Å; N185-I188 WeakPolarHBondContact OD1-CB 3.49Å; N185-I188 VanDerWaalsContact OD1-CG1 3.32Å; N185-I188 WeakPolarHBondContact OD1-CG1 3.46Å; N185-I188 PolarHBondContact OD1-N 3.2Å; I188-L191 PolarHBondContact O-N 3.26Å; I188-L192 HydrophobicContact CG2-CD1 3.99Å; I188-L192 HydrophobicContact CG2-CG 4.34Å; I188-L192 WeakPolarHBondContact O-CB 3.43Å; I188-L192 WeakPolarHBondContact O-CG 3.44Å; I188-L192 PolarHBondContact O-N 3Å
189	V	85.6	Confident	82.8	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-59.5	-50.8	169.4	174.5	0	0	0	0	110	L177 A180 V181 N185 V186 L191 L192 C193 I272 I275 L276	L177-V189 HydrophobicContact CD1-CG1 4.18Å; A180-V189 HydrophobicContact CB-CG2 3.63Å; V181-V189 HydrophobicContact CG2-CG2 4.07Å; N185-V189 WeakPolarHBondContact O-CG2 3.48Å; N185-V189 PolarHBondContact O-N 3.1Å; N185-V189 VanDerWaalsContact O-N 3.07Å; V186-V189 PolarHBondContact O-N 2.76Å; V189-L191 PolarHBondContact O-N 3.49Å; V189-L192 PolarHBondContact O-N 3.48Å; V189-C193 WeakPolarHBondContact O-CB 3.26Å; V189-C193 PolarHBondContact O-N 2.89Å; V189-C193 PolarHBondContact O-SG 3.34Å; V189-C193 VanDerWaalsContact O-SG 3.35Å; V189-I272 HydrophobicContact CG1-CG2 4.37Å; V189-I272 HydrophobicContact CG2-CD1 4.26Å; V189-I272 HydrophobicContact CG2-CG1 4.49Å; V189-I272 HydrophobicContact CG2-CG2 4.41Å; V189-I275 HydrophobicContact CG1-CG2 4.02Å; V189-L276 HydrophobicContact CG1-CD2 4.28Å
190	S	85.2	Confident	82.4	Confident	22 Å²	22	40.3 Å²	40.3	15%	0.154	20%	0.2	C	C	.	.	H	α-helix	trans	-59.6	-35.1	178.8	83.3	0	0	0	0	112.4	V186 D187 R194	V186-S190 WeakPolarHBondContact O-CB 3.49Å; V186-S190 PolarHBondContact O-N 3.48Å; D187-S190 PolarHBondContact O-N 3.43Å; D187-S190 PolarHBondContact O-OG 3.35Å; S190-R194 WeakPolarHBondContact O-CB 3.43Å; S190-R194 WeakPolarHBondContact O-CD 3.06Å; S190-R194 WeakPolarHBondContact O-CG 3.3Å; S190-R194 PolarHBondContact O-N 3.46Å
191	L	86.4	Confident	81.9	Confident	9 Å²	9	43 Å²	43	5%	0.047	21%	0.214	C	C	.	.	H	α-helix	trans	-73.1	-47.9	-179.4	-167	156.4	0	0	0	110.9	K100 V103 E104 L107 D187 I188 V189 C193 R194 Y195	K100-L191 HydrophobicContact CG-CD1 3.66Å; V103-L191 HydrophobicContact CG1-CD2 3.9Å; E104-L191 HydrophobicContact CB-CD1 3.99Å; E104-L191 HydrophobicContact CG-CD1 4.09Å; L107-L191 HydrophobicContact CD1-CD2 3.48Å; L107-L191 VanDerWaalsContact CD1-CD2 3.48Å; D187-L191 VanDerWaalsContact O-CB 3.24Å; D187-L191 WeakPolarHBondContact O-CB 3.33Å; D187-L191 PolarHBondContact O-N 3.05Å; I188-L191 PolarHBondContact O-N 3.26Å; V189-L191 PolarHBondContact O-N 3.49Å; L191-C193 VanDerWaalsContact C-N 3.34Å; L191-C193 PolarHBondContact O-N 3.09Å; L191-R194 WeakPolarHBondContact O-CB 3.33Å; L191-R194 PolarHBondContact O-N 3.03Å; L191-Y195 HydrophobicContact CD2-CD2 3.96Å; L191-Y195 HydrophobicContact CD2-CE2 4Å; L191-Y195 HydrophobicContact CG-CE2 4.44Å; L191-Y195 WeakPolarHBondContact O-CD2 3.42Å; L191-Y195 PolarHBondContact O-N 3.08Å
192	L	84.4	Confident	81.3	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-58.1	-46.3	174.2	-72.3	168	0	0	0	111.3	F91 V103 L107 P113 P176 L177 A180 I188 V189 R194 Y195 A197	F91-L192 HydrophobicContact CE1-CD2 4.39Å; F91-L192 HydrophobicContact CZ-CD2 3.78Å; V103-L192 HydrophobicContact CG1-CD2 4.44Å; L107-L192 HydrophobicContact CD1-CD2 4.2Å; P113-L192 HydrophobicContact CB-CD2 4.25Å; P176-L192 HydrophobicContact CB-CD1 4.37Å; P176-L192 HydrophobicContact CB-CD2 4.33Å; L177-L192 HydrophobicContact CD1-CB 4.17Å; L177-L192 HydrophobicContact CD1-CD1 4.36Å; A180-L192 HydrophobicContact CB-CD1 3.69Å; I188-L192 HydrophobicContact CG2-CD1 3.99Å; I188-L192 HydrophobicContact CG2-CG 4.34Å; I188-L192 WeakPolarHBondContact O-CB 3.43Å; I188-L192 WeakPolarHBondContact O-CG 3.44Å; I188-L192 PolarHBondContact O-N 3Å; V189-L192 PolarHBondContact O-N 3.48Å; L192-R194 PolarHBondContact O-N 2.97Å; L192-Y195 PolarHBondContact O-N 3.02Å; L192-Y195 VanDerWaalsContact O-N 3.13Å; L192-A197 HydrophobicContact CB-CB 4.04Å; L192-A197 VanDerWaalsContact O-CB 3.26Å; L192-A197 WeakPolarHBondContact O-CB 3.49Å; L192-A197 PolarHBondContact O-N 3.35Å; L192-A197 VanDerWaalsContact O-N 3.09Å
193	C	83.2	Confident	80.7	Confident	2 Å²	2	41.7 Å²	41.7	1%	0.014	21%	0.209	C	C	.	.	H	α-helix	trans	-61.5	-40	176.4	-71	0	0	0	0	112.7	V189 L191 Y195 N196 I275 H279	V189-C193 WeakPolarHBondContact O-CB 3.26Å; V189-C193 PolarHBondContact O-N 2.89Å; V189-C193 PolarHBondContact O-SG 3.34Å; V189-C193 VanDerWaalsContact O-SG 3.35Å; L191-C193 VanDerWaalsContact C-N 3.34Å; L191-C193 PolarHBondContact O-N 3.09Å; C193-Y195 PolarHBondContact O-N 3.24Å; C193-N196 PolarHBondContact O-N 3.31Å; C193-I275 HydrophobicContact CB-CG2 4.5Å; C193-H279 HydrophobicContact CB-CB 4.46Å
194	R	83	Confident	79.6	Confident	194 Å²	194	43.9 Å²	43.9	73%	0.732	23%	0.225	S	C	*	.	H	α-helix	trans	-63.1	-22.3	173.7	-78.7	167.7	-178.7	-158.5	0.7	114.6	S190 L191 L192 N196	S190-R194 WeakPolarHBondContact O-CB 3.43Å; S190-R194 WeakPolarHBondContact O-CD 3.06Å; S190-R194 WeakPolarHBondContact O-CG 3.3Å; S190-R194 PolarHBondContact O-N 3.46Å; L191-R194 WeakPolarHBondContact O-CB 3.33Å; L191-R194 PolarHBondContact O-N 3.03Å; L192-R194 PolarHBondContact O-N 2.97Å; R194-N196 VanDerWaalsContact C-N 3.34Å
195	Y	80.6	Confident	78	Confident	86 Å²	86	43.6 Å²	43.6	34%	0.337	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95	17.8	172.3	-77.8	-84.7	0	0	0	112.9	E104 L107 K108 L191 L192 C193	E104-Y195 HydrophobicContact CG-CE2 4.31Å; L107-Y195 HydrophobicContact CB-CD1 4.05Å; L107-Y195 HydrophobicContact CB-CD2 4.11Å; L107-Y195 HydrophobicContact CB-CE1 4.15Å; L107-Y195 HydrophobicContact CB-CE2 4.22Å; L107-Y195 HydrophobicContact CB-CG 4.04Å; L107-Y195 HydrophobicContact CD1-CD2 3.54Å; L107-Y195 HydrophobicContact CD1-CE2 4.15Å; L107-Y195 HydrophobicContact CD1-CG 3.88Å; L107-Y195 HydrophobicContact CG-CD2 4.42Å; L107-Y195 HydrophobicContact CG-CG 4.42Å; K108-Y195 WeakPolarHBondContact CE-OH 3.31Å; K108-Y195 WeakPolarHBondContact CG-OH 3.5Å; L191-Y195 HydrophobicContact CD2-CD2 3.96Å; L191-Y195 HydrophobicContact CD2-CE2 4Å; L191-Y195 HydrophobicContact CG-CE2 4.44Å; L191-Y195 WeakPolarHBondContact O-CD2 3.42Å; L191-Y195 PolarHBondContact O-N 3.08Å; L192-Y195 PolarHBondContact O-N 3.02Å; L192-Y195 VanDerWaalsContact O-N 3.13Å; C193-Y195 PolarHBondContact O-N 3.24Å
196	N	75.3	Confident	75.6	Confident	127 Å²	127	48.4 Å²	48.4	68%	0.679	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.8	43.6	-178.7	-61.3	-6.2	0	0	0	114.6	C193 R194 S198	C193-N196 PolarHBondContact O-N 3.31Å; R194-N196 VanDerWaalsContact C-N 3.34Å; N196-S198 PolarHBondContact O-N 3.43Å
197	A	78.3	Confident	73.3	Confident	8 Å²	8	48.4 Å²	48.4	7%	0.066	27%	0.266	C	S	.	.			trans	-61.1	131.8	164.3	0	0	0	0	0	111.4	P113 D114 L177 L192 V199	P113-A197 HydrophobicContact CB-CB 3.91Å; P113-A197 HydrophobicContact CG-CB 4.21Å; D114-A197 WeakPolarHBondContact OD1-CA 3.41Å; L177-A197 HydrophobicContact CD2-CB 4.3Å; L192-A197 HydrophobicContact CB-CB 4.04Å; L192-A197 VanDerWaalsContact O-CB 3.26Å; L192-A197 WeakPolarHBondContact O-CB 3.49Å; L192-A197 PolarHBondContact O-N 3.35Å; L192-A197 VanDerWaalsContact O-N 3.09Å; A197-V199 PolarHBondContact O-N 2.93Å
198	S	76.5	Confident	70.9	Confident	57 Å²	57	46.9 Å²	46.9	40%	0.399	26%	0.261	S	S	.	.			trans	-79.6	107.1	-176.1	-62.3	0	0	0	0	111.5	D114 N196 D200	D114-S198 PolarHBondContact OD1-N 3.4Å; D114-S198 WeakPolarHBondContact OD2-CB 3.48Å; D114-S198 PolarHBondContact OD2-N 2.94Å; D114-S198 VanDerWaalsContact OD2-N 3.12Å; D114-S198 PolarHBondContact OD2-OG 2.87Å; N196-S198 PolarHBondContact O-N 3.43Å; S198-D200 VanDerWaalsContact C-N 3.32Å; S198-D200 PolarHBondContact O-N 3.48Å
199	V	77.6	Confident	68.7	Low	10 Å²	10	50.3 Å²	50.3	6%	0.061	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-27.6	-169.7	-168.3	0	0	0	0	114.3	L177 A197 A258 L276 H279 A281	L177-V199 HydrophobicContact CD2-CB 4.4Å; L177-V199 HydrophobicContact CD2-CG1 4.39Å; L177-V199 HydrophobicContact CD2-CG2 4.31Å; A197-V199 PolarHBondContact O-N 2.93Å; V199-A258 HydrophobicContact CG1-CB 4.25Å; V199-L276 HydrophobicContact CG1-CB 4.24Å; V199-L276 HydrophobicContact CG1-CD2 3.58Å; V199-L276 HydrophobicContact CG1-CG 4.46Å; V199-H279 HydrophobicContact CG2-CB 4.02Å; V199-A281 HydrophobicContact CB-CB 4.4Å; V199-A281 HydrophobicContact CG1-CB 3.63Å
200	D	74.1	Confident	66.3	Low	39 Å²	39	54.5 Å²	54.5	21%	0.209	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-7.3	-174.1	-69.6	-27.8	0	0	0	115.1	S198 T202 R282	S198-D200 VanDerWaalsContact C-N 3.32Å; S198-D200 PolarHBondContact O-N 3.48Å; D200-T202 PolarHBondContact O-N 3.2Å; D200-R282 WeakPolarHBondContact OD1-CG 3.4Å; D200-R282 PolarHBondContact OD1-N 2.84Å; D200-R282 IonicContact OD1-NE 2.68Å; D200-R282 IonicContact OD2-CZ 2.78Å; D200-R282 IonicContact OD2-NE 2.67Å; D200-R282 PolarHBondContact OD2-NE 3.49Å; D200-R282 IonicContact OD2-NH2 3.68Å; D200-R282 PolarHBondContact OD2-NH2 2.62Å
201	I	74.4	Confident	63.9	Low	57 Å²	57	59.2 Å²	59.2	29%	0.292	34%	0.337	S	S	.	.	P	Polyproline II helix	trans	-77.3	127.2	-172.3	-36	171.1	0	0	0	111.8	D114	D114-I201 HydrophobicContact CB-CD1 4.14Å
202	T	71.7	Confident	61.5	Low	17 Å²	17	63.8 Å²	63.8	10%	0.104	36%	0.357	C	S	.	.	P	Polyproline II helix	trans	-90.5	139.6	-172.6	53.9	0	0	0	0	114.9	R175 D200 N255 R256 T257 W288	R175-T202 VanDerWaalsContact NH1-C 3.25Å; R175-T202 PolarHBondContact NH1-O 3.42Å; D200-T202 PolarHBondContact O-N 3.2Å; T202-N255 HydrophobicContact CG2-CB 4.12Å; T202-N255 VanDerWaalsContact CG2-O 3.23Å; T202-N255 WeakPolarHBondContact CG2-O 3.27Å; T202-R256 VanDerWaalsContact CA-O 3.26Å; T202-R256 WeakPolarHBondContact CA-O 3.39Å; T202-T257 HydrophobicContact CG2-CG2 3.62Å; T202-W288 HydrophobicContact CG2-CB 4.13Å
203	D	68	Low	59.2	Low	7 Å²	7	71.1 Å²	71.1	4%	0.037	38%	0.384	C	S	.	.	P	Polyproline II helix	trans	-58.8	142.7	178.2	64.4	8.1	0	0	0	114.6	I178 N255 R256	I178-D203 HydrophobicContact CD1-CB 3.98Å; D203-N255 WeakPolarHBondContact O-CA 3.28Å; D203-N255 PolarHBondContact O-OD1 2.98Å; D203-R256 PolarHBondContact N-O 3.18Å; D203-R256 VanDerWaalsContact N-O 3.08Å; D203-R256 PolarHBondContact OD1-N 3.12Å; D203-R256 IonicContact OD2-CZ 3.62Å; D203-R256 VanDerWaalsContact OD2-CZ 3.24Å; D203-R256 IonicContact OD2-NE 3.2Å; D203-R256 PolarHBondContact OD2-NE 3.27Å; D203-R256 IonicContact OD2-NH2 2.7Å; D203-R256 PolarHBondContact OD2-NH2 3.07Å
204	S	59.1	Low	56.9	Low	53 Å²	53	74 Å²	74	37%	0.371	41%	0.408	S	S	.	.			trans	-90.3	111.1	173.4	27.5	0	0	0	0	109.7	D173	D173-S204 VanDerWaalsContact CB-OG 3.24Å; D173-S204 WeakPolarHBondContact CB-OG 3.4Å; D173-S204 PolarHBondContact OD2-OG 3.28Å
205	Q	49.4	Very low	55	Low	67 Å²	67	68.5 Å²	68.5	31%	0.313	40%	0.396	S	S	.	.			trans	-91.6	134.9	-176.2	-72.7	-171.4	12.7	0	0	113.9	F253	Q205-F253 PolarHBondContact NE2-O 3.13Å
206	S	34.3	Very low	52.9	Low	125 Å²	125	73.3 Å²	73.3	87%	0.874	42%	0.419	S	S	*	.	S	Bend	trans	-149.6	-27.7	157.8	-170.3	0	0	0	0	113.3
207	A	38.7	Very low	51	Low	57 Å²	57	73.4 Å²	73.4	47%	0.471	42%	0.416	S	S	.	.	S	Bend	trans	-114.1	-41.2	-171.4	0	0	0	0	0	116.7	A209 S210	A207-A209 VanDerWaalsContact C-N 3.33Å; A207-A209 PolarHBondContact O-N 3.29Å; A207-S210 PolarHBondContact O-OG 3.46Å
208	S	37.8	Very low	48.9	Very low	47 Å²	47	81.1 Å²	81.1	33%	0.329	45%	0.45	S	S	.	.	H	α-helix	trans	-67.6	-24.7	-164.1	-51	0	0	0	0	115.7	S210	S208-S210 PolarHBondContact O-N 3.09Å
209	A	38.9	Very low	46.9	Very low	72 Å²	72	88.4 Å²	88.4	60%	0.595	48%	0.475	S	S	*	.	H	α-helix	trans	-74.1	-24.5	-172	0	0	0	0	0	114.6	A207	A207-A209 VanDerWaalsContact C-N 3.33Å; A207-A209 PolarHBondContact O-N 3.29Å
210	S	36	Very low	44.6	Very low	88 Å²	88	92.2 Å²	92.2	62%	0.615	52%	0.516	S	S	*	.	H	α-helix	trans	-85.6	-36.4	179.7	54.4	0	0	0	0	112.9	A207 S208 R213	A207-S210 PolarHBondContact O-OG 3.46Å; S208-S210 PolarHBondContact O-N 3.09Å; S210-R213 PolarHBondContact O-N 2.96Å
211	F	34.3	Very low	42.7	Very low	122 Å²	122	93.8 Å²	93.8	54%	0.535	54%	0.542	S	S	.	.	H	α-helix	trans	-74.9	-38.1	-170.7	-166.1	-97.5	0	0	0	114.1	T165 R213 A214 T215	T165-F211 HydrophobicContact CG2-CD1 4.27Å; T165-F211 HydrophobicContact CG2-CE1 3.75Å; F211-R213 PolarHBondContact O-N 3.46Å; F211-A214 PolarHBondContact O-N 2.94Å; F211-T215 HydrophobicContact CE1-CG2 4.33Å; F211-T215 PolarHBondContact O-OG1 3.47Å
212	F	36.4	Very low	40.8	Very low	104 Å²	104	98.2 Å²	98.2	46%	0.456	57%	0.571	S	S	.	*	H	α-helix	trans	-66.6	-22.2	177.3	-84.5	-75.5	0	0	0	113.5	L162 T215	L162-F212 HydrophobicContact CD2-CE1 4.27Å; L162-F212 HydrophobicContact CD2-CZ 3.89Å; L162-F212 HydrophobicContact CG-CE1 4.15Å; L162-F212 HydrophobicContact CG-CZ 4.26Å; F212-T215 PolarHBondContact O-OG1 2.99Å
213	R	35.9	Very low	38.9	Very low	154 Å²	154	101.3 Å²	101.3	58%	0.581	60%	0.598	S	S	*	*	H	α-helix	trans	-69	-47.4	176.9	-168.5	171.9	-172.9	152.6	2.5	111.9	S210 F211 T215 F216 E217	S210-R213 PolarHBondContact O-N 2.96Å; F211-R213 PolarHBondContact O-N 3.46Å; R213-T215 PolarHBondContact O-N 3.11Å; R213-F216 PolarHBondContact O-N 3.24Å; R213-E217 WeakPolarHBondContact CG-OE1 3.36Å; R213-E217 IonicContact NE-OE1 3.98Å; R213-E217 PolarHBondContact NE-OE1 3.29Å; R213-E217 VanDerWaalsContact NE-OE1 3.14Å; R213-E217 IonicContact NH2-OE1 2.84Å
214	A	35.3	Very low	37.6	Very low	63 Å²	63	108.8 Å²	108.8	52%	0.521	63%	0.633	S	S	.	*	H	α-helix	trans	-63.9	-24.7	-178.5	0	0	0	0	0	114.1	F211	F211-A214 PolarHBondContact O-N 2.94Å
215	T	42.2	Very low	36.4	Very low	78 Å²	78	111.6 Å²	111.6	48%	0.479	65%	0.648	S	S	.	*	T	Hydrogen-bonded Turn	trans	-86.9	-7.5	-175.2	42.7	0	0	0	0	114.9	F211 F212 R213	F211-T215 HydrophobicContact CE1-CG2 4.33Å; F211-T215 PolarHBondContact O-OG1 3.47Å; F212-T215 PolarHBondContact O-OG1 2.99Å; R213-T215 PolarHBondContact O-N 3.11Å
216	F	36.6	Very low	36	Very low	187 Å²	187	114.8 Å²	114.8	82%	0.82	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.4	-16.4	176.2	-93.2	-88.4	0	0	0	114.9	R213 Q218	R213-F216 PolarHBondContact O-N 3.24Å; F216-Q218 VanDerWaalsContact C-N 3.3Å; F216-Q218 PolarHBondContact O-N 3.46Å
217	E	35.5	Very low	36.2	Very low	129 Å²	129	116.8 Å²	116.8	60%	0.603	67%	0.667	S	S	*	*	S	Bend	trans	-78.2	-4.1	-177.9	-73.4	174.1	165.2	0	0	114.1	R213	R213-E217 WeakPolarHBondContact CG-OE1 3.36Å; R213-E217 IonicContact NE-OE1 3.98Å; R213-E217 PolarHBondContact NE-OE1 3.29Å; R213-E217 VanDerWaalsContact NE-OE1 3.14Å; R213-E217 IonicContact NH2-OE1 2.84Å
218	Q	33.6	Very low	36.3	Very low	170 Å²	170	118.2 Å²	118.2	79%	0.794	68%	0.679	S	S	*	*			trans	-111.3	84.3	-179.2	-68.5	-165	3.1	0	0	115.2	F216	F216-Q218 VanDerWaalsContact C-N 3.3Å; F216-Q218 PolarHBondContact O-N 3.46Å
219	K	35.4	Very low	36.5	Very low	211 Å²	211	120.2 Å²	120.2	92%	0.917	68%	0.681	S	S	*	*			trans	178.8	58.6	140.9	-99.3	158.3	-173.7	171.9	0	113.5	G221	K219-G221 PolarHBondContact O-N 2.86Å
220	G	29.2	Very low	36.5	Very low	90 Å²	90	123.1 Å²	123.1	93%	0.928	69%	0.686	S	S	*	*			trans	-81	107	161.6	0	0	0	0	0	110.6
221	G	34.1	Very low	36.8	Very low	72 Å²	72	127.5 Å²	127.5	74%	0.742	69%	0.694	S	S	*	*			trans	-152.3	145.3	179.8	0	0	0	0	0	111.3	K219	K219-G221 PolarHBondContact O-N 2.86Å
222	V	34.3	Very low	37.5	Very low	149 Å²	149	125.9 Å²	125.9	90%	0.903	69%	0.694	S	S	*	*			trans	-112.3	162.8	-156.1	-174.9	0	0	0	0	113.2
223	A	32.9	Very low	37.8	Very low	82 Å²	82	125.1 Å²	125.1	68%	0.678	69%	0.692	S	S	*	*			trans	75.5	115.8	171.5	0	0	0	0	0	115.5
224	H	38.9	Very low	38.4	Very low	164 Å²	164	122.6 Å²	122.6	76%	0.759	69%	0.689	S	S	*	*				-138.2	-179.2	55.8	-110.8	-106.5	0	0	0	115.1	K229	H224-K229 PolarHBondContact O-NZ 3.4Å
225	V	34.2	Very low	38.9	Very low	113 Å²	113	126.7 Å²	126.7	69%	0.685	70%	0.696	S	S	*	*			trans	-114.9	135.8	-175.3	176.7	0	0	0	0	110.4
226	D	41.3	Very low	39.3	Very low	134 Å²	134	125.7 Å²	125.7	72%	0.717	69%	0.692	S	S	*	*			trans	-151	152.2	158.3	-114.6	-42.2	0	0	0	110.5	A228 K229	D226-A228 VanDerWaalsContact C-N 3.28Å; D226-A228 PolarHBondContact O-N 3.46Å; D226-K229 PolarHBondContact O-N 3.36Å
227	L	38.5	Very low	39.9	Very low	167 Å²	167	120.4 Å²	120.4	87%	0.874	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.2	-1.5	-151.4	-74	165.4	0	0	0	117.4	K229	L227-K229 PolarHBondContact O-N 3.18Å
228	A	41.3	Very low	40.5	Very low	87 Å²	87	119 Å²	119	72%	0.719	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.8	-11.2	172.9	0	0	0	0	0	113.8	D226 L230	D226-A228 VanDerWaalsContact C-N 3.28Å; D226-A228 PolarHBondContact O-N 3.46Å; A228-L230 PolarHBondContact O-N 3.22Å
229	K	42	Very low	41.2	Very low	88 Å²	88	116.1 Å²	116.1	38%	0.383	66%	0.66	S	S	.	*	H	α-helix	trans	-63	-41.2	-166.7	-102.1	174.9	158.1	-168.1	0	116	H224 D226 L227 F231 V232 E233	H224-K229 PolarHBondContact O-NZ 3.4Å; D226-K229 PolarHBondContact O-N 3.36Å; L227-K229 PolarHBondContact O-N 3.18Å; K229-F231 VanDerWaalsContact C-N 3.3Å; K229-F231 PolarHBondContact O-N 3.41Å; K229-F231 VanDerWaalsContact O-N 3.13Å; K229-V232 CarbonylContact O-C 3.53Å; K229-V232 PolarHBondContact O-N 2.05Å; K229-E233 HydrophobicContact CB-CG 4.27Å; K229-E233 WeakPolarHBondContact CD-OE1 3.5Å; K229-E233 VanDerWaalsContact CE-OE1 3.3Å; K229-E233 WeakPolarHBondContact CE-OE1 3.38Å; K229-E233 HydrophobicContact CG-CG 4.33Å; K229-E233 WeakPolarHBondContact CG-OE1 3.23Å; K229-E233 IonicContact NZ-OE1 2.59Å; K229-E233 WeakPolarHBondContact O-CB 3.38Å; K229-E233 WeakPolarHBondContact O-CG 3.41Å; K229-E233 PolarHBondContact O-N 2.93Å
230	L	38.6	Very low	41.6	Very low	133 Å²	133	108.6 Å²	108.6	70%	0.696	64%	0.637	S	S	*	*	H	α-helix	trans	-57.4	-36.8	-167.6	-112.1	113.7	0	0	0	114.7	A228 I234	A228-L230 PolarHBondContact O-N 3.22Å; L230-I234 WeakPolarHBondContact O-CG1 3.26Å; L230-I234 PolarHBondContact O-N 2.87Å
231	F	42.2	Very low	42.4	Very low	180 Å²	180	106.8 Å²	106.8	79%	0.789	61%	0.614	S	S	*	*	H	α-helix	trans	-75.6	-30.5	179.5	-127.9	-89.7	0	0	0	112.6	K229	K229-F231 VanDerWaalsContact C-N 3.3Å; K229-F231 PolarHBondContact O-N 3.41Å; K229-F231 VanDerWaalsContact O-N 3.13Å
232	V	50.1	Low	43	Very low	89 Å²	89	108.7 Å²	108.7	54%	0.539	61%	0.606	S	S	.	*	H	α-helix	trans	-78.8	-41.3	174.9	-178.6	0	0	0	0	110.4	K229 I234 F235 S236	K229-V232 CarbonylContact O-C 3.53Å; K229-V232 PolarHBondContact O-N 2.05Å; V232-I234 VanDerWaalsContact C-N 3.34Å; V232-I234 PolarHBondContact O-N 3.31Å; V232-F235 PolarHBondContact O-N 3.4Å; V232-F235 VanDerWaalsContact O-N 3.15Å; V232-S236 VanDerWaalsContact O-CB 3.32Å; V232-S236 WeakPolarHBondContact O-CB 3.45Å; V232-S236 PolarHBondContact O-N 3.38Å; V232-S236 PolarHBondContact O-OG 2.78Å
233	E	42.7	Very low	43.8	Very low	88 Å²	88	106 Å²	106	41%	0.411	59%	0.585	S	S	.	*	H	α-helix	trans	-66.6	-31.4	-178	-74.9	175.6	164.7	0	0	112.6	K229 S237	K229-E233 HydrophobicContact CB-CG 4.27Å; K229-E233 WeakPolarHBondContact CD-OE1 3.5Å; K229-E233 VanDerWaalsContact CE-OE1 3.3Å; K229-E233 WeakPolarHBondContact CE-OE1 3.38Å; K229-E233 HydrophobicContact CG-CG 4.33Å; K229-E233 WeakPolarHBondContact CG-OE1 3.23Å; K229-E233 IonicContact NZ-OE1 2.59Å; K229-E233 WeakPolarHBondContact O-CB 3.38Å; K229-E233 WeakPolarHBondContact O-CG 3.41Å; K229-E233 PolarHBondContact O-N 2.93Å; E233-S237 WeakPolarHBondContact O-CB 3.45Å; E233-S237 PolarHBondContact O-N 3.13Å; E233-S237 PolarHBondContact O-OG 3.23Å
234	I	48	Very low	44.2	Very low	100 Å²	100	105.1 Å²	105.1	51%	0.513	57%	0.569	S	S	.	*	H	α-helix	trans	-66.4	-47.6	170.1	-67.6	167.4	0	0	0	110.5	L230 V232 S237 I238	L230-I234 WeakPolarHBondContact O-CG1 3.26Å; L230-I234 PolarHBondContact O-N 2.87Å; V232-I234 VanDerWaalsContact C-N 3.34Å; V232-I234 PolarHBondContact O-N 3.31Å; I234-S237 PolarHBondContact O-N 3.46Å; I234-I238 HydrophobicContact CG2-CD1 4.05Å; I234-I238 WeakPolarHBondContact O-CG1 3.47Å; I234-I238 PolarHBondContact O-N 2.74Å
235	F	46	Very low	44.4	Very low	150 Å²	150	102.2 Å²	102.2	66%	0.658	56%	0.559	S	S	*	*	H	α-helix	trans	-65.4	-44.3	179.9	-130	-88.8	0	0	0	111.7	V232 I238 Q239	V232-F235 PolarHBondContact O-N 3.4Å; V232-F235 VanDerWaalsContact O-N 3.15Å; F235-I238 PolarHBondContact O-N 2.95Å; F235-Q239 WeakPolarHBondContact O-CB 3.45Å; F235-Q239 PolarHBondContact O-N 2.98Å
236	S	50.1	Low	44.8	Very low	57 Å²	57	98.8 Å²	98.8	40%	0.399	54%	0.543	S	S	.	.	H	α-helix	trans	-69.1	-28.2	175.1	-65.6	0	0	0	0	113.2	V232 A240	V232-S236 VanDerWaalsContact O-CB 3.32Å; V232-S236 WeakPolarHBondContact O-CB 3.45Å; V232-S236 PolarHBondContact O-N 3.38Å; V232-S236 PolarHBondContact O-OG 2.78Å; S236-A240 WeakPolarHBondContact O-CA 3.48Å; S236-A240 WeakPolarHBondContact O-CB 3.49Å; S236-A240 PolarHBondContact O-N 2.78Å
237	S	48.7	Very low	45	Very low	76 Å²	76	97 Å²	97	53%	0.531	53%	0.532	S	S	.	.	H	α-helix	trans	-73.1	-39.8	171.9	-64.1	0	0	0	0	111.8	E233 I234 A240 A241	E233-S237 WeakPolarHBondContact O-CB 3.45Å; E233-S237 PolarHBondContact O-N 3.13Å; E233-S237 PolarHBondContact O-OG 3.23Å; I234-S237 PolarHBondContact O-N 3.46Å; S237-A240 PolarHBondContact O-N 2.79Å; S237-A241 VanDerWaalsContact O-CB 3.23Å; S237-A241 WeakPolarHBondContact O-CB 3.48Å; S237-A241 PolarHBondContact O-N 3.41Å
238	I	48.6	Very low	45.1	Very low	99 Å²	99	97.3 Å²	97.3	51%	0.508	52%	0.522	S	S	.	.	H	α-helix	trans	-65	-43.9	173.2	-67.1	166.2	0	0	0	110	I234 F235 A241 L242	I234-I238 HydrophobicContact CG2-CD1 4.05Å; I234-I238 WeakPolarHBondContact O-CG1 3.47Å; I234-I238 PolarHBondContact O-N 2.74Å; F235-I238 PolarHBondContact O-N 2.95Å; I238-A241 PolarHBondContact O-N 2.8Å; I238-L242 HydrophobicContact CG2-CD1 4.14Å; I238-L242 WeakPolarHBondContact O-CB 3.35Å; I238-L242 WeakPolarHBondContact O-CG 3.47Å; I238-L242 PolarHBondContact O-N 3.33Å
239	Q	47.1	Very low	45.1	Very low	110 Å²	110	98.1 Å²	98.1	51%	0.514	51%	0.511	S	S	.	.	H	α-helix	trans	-68.3	-37.9	178	-166.2	170.6	6.2	0	0	112.1	F235 L242 I243	F235-Q239 WeakPolarHBondContact O-CB 3.45Å; F235-Q239 PolarHBondContact O-N 2.98Å; Q239-L242 PolarHBondContact O-N 3Å; Q239-I243 HydrophobicContact CG-CD1 4.14Å; Q239-I243 WeakPolarHBondContact O-CB 3.44Å; Q239-I243 WeakPolarHBondContact O-CD1 3.13Å; Q239-I243 WeakPolarHBondContact O-CG1 3.08Å; Q239-I243 PolarHBondContact O-N 2.7Å
240	A	44.6	Very low	45.1	Very low	53 Å²	53	98 Å²	98	44%	0.438	51%	0.514	S	S	.	.	H	α-helix	trans	-69.9	-35.8	173.5	0	0	0	0	0	112.4	S236 S237 I243 D244	S236-A240 WeakPolarHBondContact O-CA 3.48Å; S236-A240 WeakPolarHBondContact O-CB 3.49Å; S236-A240 PolarHBondContact O-N 2.78Å; S237-A240 PolarHBondContact O-N 2.79Å; A240-I243 PolarHBondContact O-N 3.23Å; A240-D244 VanDerWaalsContact O-CB 3.31Å; A240-D244 WeakPolarHBondContact O-CB 3.18Å; A240-D244 PolarHBondContact O-N 3.26Å
241	A	46.5	Very low	45.2	Very low	52 Å²	52	95 Å²	95	43%	0.43	51%	0.509	S	S	.	.	H	α-helix	trans	-67.4	-39.1	173.2	0	0	0	0	0	111.8	S237 I238 D244 L245	S237-A241 VanDerWaalsContact O-CB 3.23Å; S237-A241 WeakPolarHBondContact O-CB 3.48Å; S237-A241 PolarHBondContact O-N 3.41Å; I238-A241 PolarHBondContact O-N 2.8Å; A241-D244 PolarHBondContact O-N 3Å; A241-L245 WeakPolarHBondContact O-CB 3.37Å; A241-L245 VanDerWaalsContact O-CG 3.28Å; A241-L245 WeakPolarHBondContact O-CG 3.32Å; A241-L245 PolarHBondContact O-N 2.84Å
242	L	47	Very low	45.2	Very low	112 Å²	112	90.1 Å²	90.1	59%	0.586	50%	0.497	S	S	*	.	H	α-helix	trans	-64.6	-39.4	170.8	-76.6	165.4	0	0	0	112	I238 Q239 A246	I238-L242 HydrophobicContact CG2-CD1 4.14Å; I238-L242 WeakPolarHBondContact O-CB 3.35Å; I238-L242 WeakPolarHBondContact O-CG 3.47Å; I238-L242 PolarHBondContact O-N 3.33Å; Q239-L242 PolarHBondContact O-N 3Å; L242-A246 WeakPolarHBondContact O-CB 3.17Å; L242-A246 PolarHBondContact O-N 3.48Å
243	I	50.1	Low	45.3	Very low	91 Å²	91	87.2 Å²	87.2	47%	0.467	48%	0.477	S	S	.	.	H	α-helix	trans	-68.2	-41.7	175.5	-74.1	164.5	0	0	0	111.4	Q239 A240 A246 I247	Q239-I243 HydrophobicContact CG-CD1 4.14Å; Q239-I243 WeakPolarHBondContact O-CB 3.44Å; Q239-I243 WeakPolarHBondContact O-CD1 3.13Å; Q239-I243 WeakPolarHBondContact O-CG1 3.08Å; Q239-I243 PolarHBondContact O-N 2.7Å; A240-I243 PolarHBondContact O-N 3.23Å; I243-A246 CarbonylContact O-C 3.54Å; I243-A246 PolarHBondContact O-N 3.29Å; I243-I247 HydrophobicContact CG2-CD1 3.62Å; I243-I247 HydrophobicContact CG2-CG1 4.29Å; I243-I247 WeakPolarHBondContact O-CB 3.41Å; I243-I247 VanDerWaalsContact O-CG1 3.22Å; I243-I247 WeakPolarHBondContact O-CG1 3.34Å; I243-I247 PolarHBondContact O-N 2.91Å
244	D	41.8	Very low	45.9	Very low	64 Å²	64	88.9 Å²	88.9	34%	0.342	49%	0.485	S	S	.	.	H	α-helix	trans	-68.7	-36.7	177	-177.9	39.6	0	0	0	111.5	A240 A241 I247 R248	A240-D244 VanDerWaalsContact O-CB 3.31Å; A240-D244 WeakPolarHBondContact O-CB 3.18Å; A240-D244 PolarHBondContact O-N 3.26Å; A241-D244 PolarHBondContact O-N 3Å; D244-I247 PolarHBondContact O-N 2.83Å; D244-R248 WeakPolarHBondContact O-CB 3.35Å; D244-R248 WeakPolarHBondContact O-CD 3.32Å; D244-R248 WeakPolarHBondContact O-CG 3.41Å; D244-R248 PolarHBondContact O-N 3.28Å; D244-R248 IonicContact OD1-CZ 3.57Å; D244-R248 IonicContact OD1-NE 2.74Å; D244-R248 PolarHBondContact OD1-NE 3.07Å; D244-R248 IonicContact OD1-NH2 3.16Å; D244-R248 IonicContact OD2-CZ 3.56Å; D244-R248 IonicContact OD2-NE 2.77Å; D244-R248 PolarHBondContact OD2-NE 3.41Å; D244-R248 IonicContact OD2-NH2 3.53Å; D244-R248 PolarHBondContact OD2-NH2 3.33Å
245	L	42.8	Very low	46.6	Very low	103 Å²	103	86.5 Å²	86.5	54%	0.539	47%	0.473	S	S	.	.	H	α-helix	trans	-61.6	-44	168	-76.4	166.9	0	0	0	111.9	A241 R248 Q249	A241-L245 WeakPolarHBondContact O-CB 3.37Å; A241-L245 VanDerWaalsContact O-CG 3.28Å; A241-L245 WeakPolarHBondContact O-CG 3.32Å; A241-L245 PolarHBondContact O-N 2.84Å; L245-R248 PolarHBondContact O-N 3Å; L245-Q249 WeakPolarHBondContact O-CG 3.08Å; L245-Q249 PolarHBondContact O-N 2.9Å
246	A	42.5	Very low	47.8	Very low	42 Å²	42	81.2 Å²	81.2	35%	0.347	45%	0.449	S	S	.	.	H	α-helix	trans	-65.7	-39.9	176.4	0	0	0	0	0	112.6	L242 I243 Q249 N250	L242-A246 WeakPolarHBondContact O-CB 3.17Å; L242-A246 PolarHBondContact O-N 3.48Å; I243-A246 CarbonylContact O-C 3.54Å; I243-A246 PolarHBondContact O-N 3.29Å; A246-Q249 PolarHBondContact O-N 3.18Å; A246-N250 VanDerWaalsContact O-CB 3.26Å; A246-N250 WeakPolarHBondContact O-CB 3.33Å; A246-N250 PolarHBondContact O-N 2.83Å; A246-N250 PolarHBondContact O-ND2 3.16Å
247	I	45.4	Very low	49.3	Very low	96 Å²	96	79 Å²	79	49%	0.492	43%	0.433	S	S	.	.	H	α-helix	trans	-64.4	-43.9	175.5	-72.5	166.4	0	0	0	110.6	I243 D244 Q249 N250	I243-I247 HydrophobicContact CG2-CD1 3.62Å; I243-I247 HydrophobicContact CG2-CG1 4.29Å; I243-I247 WeakPolarHBondContact O-CB 3.41Å; I243-I247 VanDerWaalsContact O-CG1 3.22Å; I243-I247 WeakPolarHBondContact O-CG1 3.34Å; I243-I247 PolarHBondContact O-N 2.91Å; D244-I247 PolarHBondContact O-N 2.83Å; I247-Q249 VanDerWaalsContact C-N 3.31Å; I247-Q249 PolarHBondContact O-N 3.49Å; I247-N250 PolarHBondContact O-N 3.07Å
248	R	41	Very low	50.8	Low	174 Å²	174	75.4 Å²	75.4	66%	0.657	41%	0.408	S	S	*	.	H	α-helix	trans	-64.7	-31.8	177.1	-71.7	169.8	-165.9	-142.4	8	112.9	D244 L245	D244-R248 WeakPolarHBondContact O-CB 3.35Å; D244-R248 WeakPolarHBondContact O-CD 3.32Å; D244-R248 WeakPolarHBondContact O-CG 3.41Å; D244-R248 PolarHBondContact O-N 3.28Å; D244-R248 IonicContact OD1-CZ 3.57Å; D244-R248 IonicContact OD1-NE 2.74Å; D244-R248 PolarHBondContact OD1-NE 3.07Å; D244-R248 IonicContact OD1-NH2 3.16Å; D244-R248 IonicContact OD2-CZ 3.56Å; D244-R248 IonicContact OD2-NE 2.77Å; D244-R248 PolarHBondContact OD2-NE 3.41Å; D244-R248 IonicContact OD2-NH2 3.53Å; D244-R248 PolarHBondContact OD2-NH2 3.33Å; L245-R248 PolarHBondContact O-N 3Å
249	Q	41	Very low	52.5	Low	104 Å²	104	70.8 Å²	70.8	49%	0.486	38%	0.384	S	S	.	.	H	α-helix	trans	-78.6	-44	174.2	-71.6	-176.1	-3.6	0	0	112.6	L245 A246 I247 A251 S252 F253	L245-Q249 WeakPolarHBondContact O-CG 3.08Å; L245-Q249 PolarHBondContact O-N 2.9Å; A246-Q249 PolarHBondContact O-N 3.18Å; I247-Q249 VanDerWaalsContact C-N 3.31Å; I247-Q249 PolarHBondContact O-N 3.49Å; Q249-A251 PolarHBondContact O-N 2.83Å; Q249-S252 PolarHBondContact O-N 3.35Å; Q249-S252 PolarHBondContact O-OG 3.26Å; Q249-S252 VanDerWaalsContact O-OG 3.07Å; Q249-F253 HydrophobicContact CB-CE2 4.19Å; Q249-F253 HydrophobicContact CB-CZ 4.45Å; Q249-F253 WeakPolarHBondContact O-CE2 3.41Å
250	N	42.5	Very low	54.2	Low	85 Å²	85	65.5 Å²	65.5	46%	0.455	36%	0.36	S	S	.	.	H	α-helix	trans	-59.7	-17.7	-176.9	-80.4	-22.1	0	0	0	114.7	A246 I247 S252	A246-N250 VanDerWaalsContact O-CB 3.26Å; A246-N250 WeakPolarHBondContact O-CB 3.33Å; A246-N250 PolarHBondContact O-N 2.83Å; A246-N250 PolarHBondContact O-ND2 3.16Å; I247-N250 PolarHBondContact O-N 3.07Å; N250-S252 PolarHBondContact O-N 3.06Å
251	A	40.9	Very low	55.9	Low	71 Å²	71	63.1 Å²	63.1	59%	0.587	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-2.3	-179.4	0	0	0	0	0	115.7	Q249	Q249-A251 PolarHBondContact O-N 2.83Å
252	S	43	Very low	57.7	Low	77 Å²	77	60.7 Å²	60.7	54%	0.538	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.5	-8.6	-169.3	65.9	0	0	0	0	116.2	Q249 N250 Q254	Q249-S252 PolarHBondContact O-N 3.35Å; Q249-S252 PolarHBondContact O-OG 3.26Å; Q249-S252 VanDerWaalsContact O-OG 3.07Å; N250-S252 PolarHBondContact O-N 3.06Å; S252-Q254 PolarHBondContact O-N 2.94Å; S252-Q254 VanDerWaalsContact O-N 3.15Å
253	F	50.5	Low	59.4	Low	27 Å²	27	56.4 Å²	56.4	12%	0.118	30%	0.298	C	S	.	.			trans	-90.5	83.3	-170.1	-57.8	-53.8	0	0	0	112.5	Q205 Q249 A291	Q205-F253 PolarHBondContact NE2-O 3.13Å; Q249-F253 HydrophobicContact CB-CE2 4.19Å; Q249-F253 HydrophobicContact CB-CZ 4.45Å; Q249-F253 WeakPolarHBondContact O-CE2 3.41Å; F253-A291 HydrophobicContact CD1-CB 3.94Å; F253-A291 HydrophobicContact CE1-CB 3.63Å; F253-A291 HydrophobicContact CZ-CB 4.28Å
254	Q	56.9	Low	60.9	Low	124 Å²	124	54.4 Å²	54.4	58%	0.579	29%	0.287	S	S	*	.			trans	-66.2	153.4	160.5	-67.1	176.6	-4.7	0	0	110.4	S252	S252-Q254 PolarHBondContact O-N 2.94Å; S252-Q254 VanDerWaalsContact O-N 3.15Å
255	N	62.5	Low	62.7	Low	49 Å²	49	53 Å²	53	26%	0.262	28%	0.279	S	S	.	.	S	Bend	trans	59.2	63.5	174.2	-52.5	-30.7	0	0	0	113.7	T202 D203 W288 S289	T202-N255 HydrophobicContact CG2-CB 4.12Å; T202-N255 VanDerWaalsContact CG2-O 3.23Å; T202-N255 WeakPolarHBondContact CG2-O 3.27Å; D203-N255 WeakPolarHBondContact O-CA 3.28Å; D203-N255 PolarHBondContact O-OD1 2.98Å; N255-W288 HydrophobicContact CB-CB 4.21Å; N255-W288 WeakPolarHBondContact CB-O 3.49Å; N255-W288 PolarHBondContact ND2-O 3.28Å; N255-S289 VanDerWaalsContact O-CB 3.3Å; N255-S289 WeakPolarHBondContact O-CB 3.14Å; N255-S289 PolarHBondContact O-OG 3.23Å; N255-S289 VanDerWaalsContact O-OG 3.12Å
256	R	71.4	Confident	64.3	Low	39 Å²	39	53.4 Å²	53.4	15%	0.147	29%	0.291	C	S	.	.			trans	-77.4	130.1	176.4	-55.5	-179.7	-62.8	152.3	6.9	111	E182 T202 D203 L260	E182-R256 IonicContact OE1-CZ 3.81Å; E182-R256 VanDerWaalsContact OE1-CZ 3.27Å; E182-R256 IonicContact OE1-NH1 3.69Å; E182-R256 PolarHBondContact OE1-NH1 3.24Å; E182-R256 IonicContact OE1-NH2 3Å; E182-R256 PolarHBondContact OE1-NH2 3.29Å; T202-R256 VanDerWaalsContact CA-O 3.26Å; T202-R256 WeakPolarHBondContact CA-O 3.39Å; D203-R256 PolarHBondContact N-O 3.18Å; D203-R256 VanDerWaalsContact N-O 3.08Å; D203-R256 PolarHBondContact OD1-N 3.12Å; D203-R256 IonicContact OD2-CZ 3.62Å; D203-R256 VanDerWaalsContact OD2-CZ 3.24Å; D203-R256 IonicContact OD2-NE 3.2Å; D203-R256 PolarHBondContact OD2-NE 3.27Å; D203-R256 IonicContact OD2-NH2 2.7Å; D203-R256 PolarHBondContact OD2-NH2 3.07Å; R256-L260 HydrophobicContact CB-CD2 4.31Å; R256-L260 HydrophobicContact CG-CD2 4.33Å
257	T	80	Confident	66.1	Low	10 Å²	10	56.3 Å²	56.3	6%	0.061	31%	0.306	C	S	.	.			trans	-77	163.8	166.4	62	0	0	0	0	110.7	T202 L259 L260 A261	T202-T257 HydrophobicContact CG2-CG2 3.62Å; T257-L259 PolarHBondContact O-N 3.32Å; T257-L260 PolarHBondContact O-N 3.31Å; T257-L260 WeakPolarHBondContact OG1-CB 3.46Å; T257-L260 PolarHBondContact OG1-N 2.85Å; T257-L260 VanDerWaalsContact OG1-N 3.15Å; T257-A261 PolarHBondContact O-N 3.36Å
258	A	81.7	Confident	67.9	Low	2 Å²	2	54.6 Å²	54.6	2%	0.017	30%	0.297	C	S	.	.	H	α-helix	trans	-59.4	-35.3	175.7	0	0	0	0	0	112.7	L177 I178 V199 A262 L276	L177-A258 HydrophobicContact CD2-CB 3.9Å; L177-A258 HydrophobicContact CG-CB 4.06Å; I178-A258 HydrophobicContact CG1-CB 4.36Å; V199-A258 HydrophobicContact CG1-CB 4.25Å; A258-A262 WeakPolarHBondContact O-CB 3.45Å; A258-A262 PolarHBondContact O-N 3.2Å; A258-L276 HydrophobicContact CB-CD2 4.14Å
259	L	83.6	Confident	69.9	Low	1 Å²	1	47.3 Å²	47.3	1%	0.005	27%	0.273	C	S	.	.	H	α-helix	trans	-69.6	-41.7	174.6	-173.5	64.7	0	0	0	112.2	T257 A261 A262 V263 V273 L276 L277 A281 R282 I283 P293 L300	T257-L259 PolarHBondContact O-N 3.32Å; L259-A261 VanDerWaalsContact C-N 3.34Å; L259-A261 PolarHBondContact O-N 3.03Å; L259-A262 PolarHBondContact O-N 3.37Å; L259-V263 VanDerWaalsContact O-CG2 3.29Å; L259-V263 WeakPolarHBondContact O-CG2 3.43Å; L259-V263 PolarHBondContact O-N 3.49Å; L259-V273 HydrophobicContact CD1-CG1 4.14Å; L259-L276 HydrophobicContact CD1-CB 4.27Å; L259-L276 HydrophobicContact CD1-CD1 4.36Å; L259-L277 HydrophobicContact CD2-CD2 4.24Å; L259-A281 HydrophobicContact CB-CB 4.16Å; L259-A281 HydrophobicContact CD2-CB 3.98Å; L259-R282 WeakPolarHBondContact CD2-O 3.27Å; L259-I283 HydrophobicContact CD2-CG1 4.28Å; L259-I283 HydrophobicContact CD2-CG2 4.21Å; L259-P293 HydrophobicContact CB-CG 4.43Å; L259-P293 HydrophobicContact CD2-CB 3.95Å; L259-P293 HydrophobicContact CD2-CG 4.1Å; L259-P293 HydrophobicContact CG-CB 4.12Å; L259-P293 HydrophobicContact CG-CG 4.23Å; L259-L300 HydrophobicContact CD1-CD2 4.41Å
260	L	82.1	Confident	72	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-62.8	-42.4	176.2	-166.8	72.7	0	0	0	111.1	R256 T257 A262 V263 Q264 P293 L296	R256-L260 HydrophobicContact CB-CD2 4.31Å; R256-L260 HydrophobicContact CG-CD2 4.33Å; T257-L260 PolarHBondContact O-N 3.31Å; T257-L260 WeakPolarHBondContact OG1-CB 3.46Å; T257-L260 PolarHBondContact OG1-N 2.85Å; T257-L260 VanDerWaalsContact OG1-N 3.15Å; L260-A262 PolarHBondContact O-N 3.15Å; L260-V263 PolarHBondContact O-N 2.98Å; L260-Q264 WeakPolarHBondContact O-CG 3.46Å; L260-Q264 PolarHBondContact O-N 3.41Å; L260-P293 HydrophobicContact CB-CG 4.32Å; L260-P293 HydrophobicContact CD1-CG 4.16Å; L260-L296 HydrophobicContact CD1-CD1 3.73Å
261	A	80.5	Confident	74.1	Confident	3 Å²	3	44.7 Å²	44.7	3%	0.025	27%	0.267	C	S	.	.	H	α-helix	trans	-61.2	-42	173.8	0	0	0	0	0	111.9	I178 V181 T257 L259 V263 Q264 L265	I178-A261 HydrophobicContact CG2-CB 4.32Å; V181-A261 HydrophobicContact CG1-CB 4.26Å; T257-A261 PolarHBondContact O-N 3.36Å; L259-A261 VanDerWaalsContact C-N 3.34Å; L259-A261 PolarHBondContact O-N 3.03Å; A261-V263 PolarHBondContact O-N 3.38Å; A261-Q264 PolarHBondContact O-N 2.92Å; A261-L265 WeakPolarHBondContact O-CG 3.5Å; A261-L265 PolarHBondContact O-N 3.36Å
262	A	84.3	Confident	76.3	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-62.4	-41	176.7	0	0	0	0	0	112.6	V181 A258 L259 L260 Q264 L265 P269 I272 V273 L276	V181-A262 HydrophobicContact CG1-CB 3.76Å; A258-A262 WeakPolarHBondContact O-CB 3.45Å; A258-A262 PolarHBondContact O-N 3.2Å; L259-A262 PolarHBondContact O-N 3.37Å; L260-A262 PolarHBondContact O-N 3.15Å; A262-Q264 VanDerWaalsContact C-N 3.34Å; A262-L265 PolarHBondContact O-N 3.47Å; A262-P269 WeakPolarHBondContact O-CD 3.46Å; A262-I272 HydrophobicContact CB-CG2 4.16Å; A262-V273 HydrophobicContact CB-CG2 4.1Å; A262-L276 HydrophobicContact CB-CD1 3.82Å
263	V	83.9	Confident	78.3	Confident	22 Å²	22	37.7 Å²	37.7	13%	0.133	21%	0.214	C	C	.	.	H	α-helix	trans	-68.8	-31	178.2	174	0	0	0	0	112.3	L259 L260 A261 L265 L296 M297 L300	L259-V263 VanDerWaalsContact O-CG2 3.29Å; L259-V263 WeakPolarHBondContact O-CG2 3.43Å; L259-V263 PolarHBondContact O-N 3.49Å; L260-V263 PolarHBondContact O-N 2.98Å; A261-V263 PolarHBondContact O-N 3.38Å; V263-L265 VanDerWaalsContact C-N 3.3Å; V263-L265 PolarHBondContact O-N 3.36Å; V263-L296 HydrophobicContact CG1-CB 3.78Å; V263-L296 HydrophobicContact CG1-CD1 4.4Å; V263-M297 HydrophobicContact CG1-CB 3.92Å; V263-L300 HydrophobicContact CG2-CD1 3.91Å; V263-L300 HydrophobicContact CG2-CD2 4.5Å
264	Q	79.7	Confident	80	Confident	49 Å²	49	41.1 Å²	41.1	23%	0.229	23%	0.231	C	C	.	.	H	α-helix	trans	-74.9	-12.3	176.6	-74.7	172.6	-17.5	0	0	114.2	L260 A261 A262 L296	L260-Q264 WeakPolarHBondContact O-CG 3.46Å; L260-Q264 PolarHBondContact O-N 3.41Å; A261-Q264 PolarHBondContact O-N 2.92Å; A262-Q264 VanDerWaalsContact C-N 3.34Å; Q264-L296 HydrophobicContact CG-CD1 4.24Å
265	L	80.9	Confident	81.3	Confident	36 Å²	36	36.5 Å²	36.5	19%	0.188	21%	0.209	C	C	.	.	S	Bend	trans	-81.3	132.2	-177.8	-72.9	168.7	0	0	0	112.6	V181 K184 A261 A262 V263 P267 L268 P269	V181-L265 HydrophobicContact CG1-CD1 3.81Å; V181-L265 WeakPolarHBondContact O-CD1 3.38Å; K184-L265 HydrophobicContact CG-CD1 4.24Å; A261-L265 WeakPolarHBondContact O-CG 3.5Å; A261-L265 PolarHBondContact O-N 3.36Å; A262-L265 PolarHBondContact O-N 3.47Å; V263-L265 VanDerWaalsContact C-N 3.3Å; V263-L265 PolarHBondContact O-N 3.36Å; L265-P267 CarbonylContact O-C 3.58Å; L265-L268 VanDerWaalsContact O-CA 3.27Å; L265-L268 WeakPolarHBondContact O-CA 3.5Å; L265-L268 PolarHBondContact O-N 3.36Å; L265-P269 HydrophobicContact CB-CG 4.48Å; L265-P269 HydrophobicContact CD1-CG 4.22Å
266	S	76.5	Confident	82.4	Confident	111 Å²	111	34.1 Å²	34.1	78%	0.776	20%	0.197	S	C	*	.	S	Bend	trans	-109.2	132.7	170.2	-174.7	0	0	0	0	111.3	K184	K184-S266 VanDerWaalsContact NZ-C 3.26Å; K184-S266 PolarHBondContact NZ-O 3.45Å
267	P	80.3	Confident	83	Confident	102 Å²	102	32.3 Å²	32.3	66%	0.662	19%	0.19	S	C	*	.	S	Bend	cis	-60.6	154.7	-19.4	29.7	-36.8	0	0	0	111.5	K184 L265 P269	K184-P267 PolarHBondContact NZ-O 3.44Å; K184-P267 VanDerWaalsContact NZ-O 3.1Å; L265-P267 CarbonylContact O-C 3.58Å; P267-P269 WeakPolarHBondContact O-CD 3.43Å
268	L	82.4	Confident	83.2	Confident	61 Å²	61	34.6 Å²	34.6	32%	0.319	20%	0.2	S	C	.	.			trans	-65	119.1	-179.3	-179.1	72.6	0	0	0	110.7	L265 L270 V273 M297	L265-L268 VanDerWaalsContact O-CA 3.27Å; L265-L268 WeakPolarHBondContact O-CA 3.5Å; L265-L268 PolarHBondContact O-N 3.36Å; L268-L270 HydrophobicContact CD2-CD2 3.71Å; L268-L270 HydrophobicContact CD2-CG 4.32Å; L268-L270 HydrophobicContact CG-CD2 4.37Å; L268-L270 PolarHBondContact O-N 3.42Å; L268-V273 HydrophobicContact CD1-CG2 4.19Å; L268-M297 HydrophobicContact CD2-CE 3.72Å; L268-M297 HydrophobicContact CD2-SD 3.82Å
269	P	84.1	Confident	83.1	Confident	21 Å²	21	36.6 Å²	36.6	14%	0.136	21%	0.209	C	C	.	.			trans	-81.8	80.1	180	33.7	-34.4	0	0	0	110.6	A262 L265 P267 A271 I272 V273	A262-P269 WeakPolarHBondContact O-CD 3.46Å; L265-P269 HydrophobicContact CB-CG 4.48Å; L265-P269 HydrophobicContact CD1-CG 4.22Å; P267-P269 WeakPolarHBondContact O-CD 3.43Å; P269-A271 VanDerWaalsContact C-N 3.29Å; P269-A271 PolarHBondContact O-N 3.35Å; P269-I272 HydrophobicContact CB-CB 3.98Å; P269-I272 HydrophobicContact CB-CD1 3.89Å; P269-I272 HydrophobicContact CB-CG1 4.04Å; P269-I272 HydrophobicContact CG-CB 4.07Å; P269-I272 HydrophobicContact CG-CD1 4.21Å; P269-I272 WeakPolarHBondContact O-CA 3.47Å; P269-I272 WeakPolarHBondContact O-CB 3.26Å; P269-I272 PolarHBondContact O-N 3.12Å; P269-V273 PolarHBondContact O-N 3.02Å
270	L	84.7	Confident	82.9	Confident	90 Å²	90	36.8 Å²	36.8	47%	0.471	21%	0.211	S	C	.	.	H	α-helix	trans	-49.9	-44.5	-177.1	-73.8	170.3	0	0	0	113.5	L268 I272 V273 E274	L268-L270 HydrophobicContact CD2-CD2 3.71Å; L268-L270 HydrophobicContact CD2-CG 4.32Å; L268-L270 HydrophobicContact CG-CD2 4.37Å; L268-L270 PolarHBondContact O-N 3.42Å; L270-I272 VanDerWaalsContact C-N 3.27Å; L270-I272 PolarHBondContact O-N 3.28Å; L270-V273 CarbonylContact O-C 3.59Å; L270-V273 WeakPolarHBondContact O-CA 3.17Å; L270-V273 WeakPolarHBondContact O-CB 3.44Å; L270-V273 PolarHBondContact O-N 3.14Å; L270-E274 WeakPolarHBondContact O-CG 3.35Å; L270-E274 PolarHBondContact O-N 2.85Å
271	A	86.8	Confident	82.9	Confident	43 Å²	43	36.9 Å²	36.9	36%	0.355	21%	0.212	S	C	.	.	H	α-helix	trans	-61.8	-31	177.3	0	0	0	0	0	113.7	V186 P269 I275	V186-A271 HydrophobicContact CG1-CB 4.23Å; V186-A271 HydrophobicContact CG2-CB 4.43Å; P269-A271 VanDerWaalsContact C-N 3.29Å; P269-A271 PolarHBondContact O-N 3.35Å; A271-I275 WeakPolarHBondContact O-CD1 3.39Å; A271-I275 VanDerWaalsContact O-CG1 3.28Å; A271-I275 WeakPolarHBondContact O-CG1 3.34Å; A271-I275 PolarHBondContact O-N 2.91Å; A271-I275 VanDerWaalsContact O-N 3.09Å
272	I	86	Confident	82.8	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-73	-42.5	173.2	-67.2	-178.1	0	0	0	109.8	V181 V186 V189 A262 P269 L270 E274 I275 L276	V181-I272 HydrophobicContact CG1-CG2 4.41Å; V181-I272 HydrophobicContact CG2-CG2 3.89Å; V186-I272 HydrophobicContact CG2-CD1 4.48Å; V186-I272 HydrophobicContact CG2-CG1 4.08Å; V189-I272 HydrophobicContact CG1-CG2 4.37Å; V189-I272 HydrophobicContact CG2-CD1 4.26Å; V189-I272 HydrophobicContact CG2-CG1 4.49Å; V189-I272 HydrophobicContact CG2-CG2 4.41Å; A262-I272 HydrophobicContact CB-CG2 4.16Å; P269-I272 HydrophobicContact CB-CB 3.98Å; P269-I272 HydrophobicContact CB-CD1 3.89Å; P269-I272 HydrophobicContact CB-CG1 4.04Å; P269-I272 HydrophobicContact CG-CB 4.07Å; P269-I272 HydrophobicContact CG-CD1 4.21Å; P269-I272 WeakPolarHBondContact O-CA 3.47Å; P269-I272 WeakPolarHBondContact O-CB 3.26Å; P269-I272 PolarHBondContact O-N 3.12Å; L270-I272 VanDerWaalsContact C-N 3.27Å; L270-I272 PolarHBondContact O-N 3.28Å; I272-E274 VanDerWaalsContact C-N 3.34Å; I272-E274 PolarHBondContact O-N 2.79Å; I272-I275 PolarHBondContact O-N 3.13Å; I272-L276 HydrophobicContact CG2-CD1 3.73Å; I272-L276 HydrophobicContact CG2-CG 4.24Å; I272-L276 WeakPolarHBondContact O-CB 3.46Å; I272-L276 WeakPolarHBondContact O-CG 3.46Å; I272-L276 PolarHBondContact O-N 3.09Å
273	V	85.9	Confident	82.6	Confident	1 Å²	1	41.3 Å²	41.3	1%	0.006	23%	0.228	C	C	.	.	H	α-helix	trans	-59.4	-44.7	175	174.7	0	0	0	0	111	L259 A262 L268 P269 L270 L276 L277 L300 M303	L259-V273 HydrophobicContact CD1-CG1 4.14Å; A262-V273 HydrophobicContact CB-CG2 4.1Å; L268-V273 HydrophobicContact CD1-CG2 4.19Å; P269-V273 PolarHBondContact O-N 3.02Å; L270-V273 CarbonylContact O-C 3.59Å; L270-V273 WeakPolarHBondContact O-CA 3.17Å; L270-V273 WeakPolarHBondContact O-CB 3.44Å; L270-V273 PolarHBondContact O-N 3.14Å; V273-L276 PolarHBondContact O-N 3.37Å; V273-L277 HydrophobicContact CG1-CD1 4.05Å; V273-L277 WeakPolarHBondContact O-CB 3.22Å; V273-L277 VanDerWaalsContact O-CG 3.26Å; V273-L277 WeakPolarHBondContact O-CG 3.42Å; V273-L277 PolarHBondContact O-N 3.22Å; V273-L300 HydrophobicContact CG1-CD2 3.48Å; V273-L300 VanDerWaalsContact CG1-CD2 3.48Å; V273-M303 HydrophobicContact CG1-CE 3.99Å
274	E	85.4	Confident	82	Confident	100 Å²	100	40.9 Å²	40.9	47%	0.467	23%	0.228	S	C	.	.	H	α-helix	trans	-59.7	-51.2	175.2	-72.2	170	167.2	0	0	111.6	L270 I272 L276 L277 E278	L270-E274 WeakPolarHBondContact O-CG 3.35Å; L270-E274 PolarHBondContact O-N 2.85Å; I272-E274 VanDerWaalsContact C-N 3.34Å; I272-E274 PolarHBondContact O-N 2.79Å; E274-L276 VanDerWaalsContact C-N 3.34Å; E274-L276 PolarHBondContact O-N 3.44Å; E274-L277 PolarHBondContact O-N 2.84Å; E274-L277 VanDerWaalsContact O-N 3.15Å; E274-E278 WeakPolarHBondContact O-CG 3.2Å; E274-E278 PolarHBondContact O-N 3.21Å
275	I	84.7	Confident	81.3	Confident	26 Å²	26	43.8 Å²	43.8	13%	0.133	25%	0.251	C	S	.	.	H	α-helix	trans	-59.8	-41.9	177.8	-72.6	161.8	0	0	0	112	V186 V189 C193 A271 I272 L277 E278 H279	V186-I275 HydrophobicContact CG1-CD1 3.55Å; V189-I275 HydrophobicContact CG1-CG2 4.02Å; C193-I275 HydrophobicContact CB-CG2 4.5Å; A271-I275 WeakPolarHBondContact O-CD1 3.39Å; A271-I275 VanDerWaalsContact O-CG1 3.28Å; A271-I275 WeakPolarHBondContact O-CG1 3.34Å; A271-I275 PolarHBondContact O-N 2.91Å; A271-I275 VanDerWaalsContact O-N 3.09Å; I272-I275 PolarHBondContact O-N 3.13Å; I275-L277 VanDerWaalsContact C-N 3.32Å; I275-L277 PolarHBondContact O-N 3.28Å; I275-E278 PolarHBondContact O-N 3.42Å; I275-H279 PolarHBondContact O-N 3.45Å; I275-H279 VanDerWaalsContact O-N 3.13Å; I275-H279 PolarHBondContact O-ND1 3.29Å
276	L	85.1	Confident	80.3	Confident	0 Å²	0	43 Å²	43	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-65.5	-37.1	178	-66.5	168.4	0	0	0	111.3	L177 V181 V189 V199 A258 L259 A262 I272 V273 E274 H279 G280 A281	L177-L276 HydrophobicContact CD1-CD2 4.44Å; L177-L276 HydrophobicContact CD2-CD2 4.38Å; V181-L276 HydrophobicContact CG2-CD1 4.18Å; V189-L276 HydrophobicContact CG1-CD2 4.28Å; V199-L276 HydrophobicContact CG1-CB 4.24Å; V199-L276 HydrophobicContact CG1-CD2 3.58Å; V199-L276 HydrophobicContact CG1-CG 4.46Å; A258-L276 HydrophobicContact CB-CD2 4.14Å; L259-L276 HydrophobicContact CD1-CB 4.27Å; L259-L276 HydrophobicContact CD1-CD1 4.36Å; A262-L276 HydrophobicContact CB-CD1 3.82Å; I272-L276 HydrophobicContact CG2-CD1 3.73Å; I272-L276 HydrophobicContact CG2-CG 4.24Å; I272-L276 WeakPolarHBondContact O-CB 3.46Å; I272-L276 WeakPolarHBondContact O-CG 3.46Å; I272-L276 PolarHBondContact O-N 3.09Å; V273-L276 PolarHBondContact O-N 3.37Å; E274-L276 VanDerWaalsContact C-N 3.34Å; E274-L276 PolarHBondContact O-N 3.44Å; L276-H279 PolarHBondContact O-N 2.67Å; L276-G280 PolarHBondContact O-N 3Å; L276-A281 HydrophobicContact CB-CB 4.33Å; L276-A281 WeakPolarHBondContact O-CB 3.45Å; L276-A281 PolarHBondContact O-N 3.49Å; L276-A281 VanDerWaalsContact O-N 3.09Å
277	L	84.7	Confident	79.3	Confident	1 Å²	1	46.8 Å²	46.8	1%	0.005	25%	0.246	C	C	.	.	H	α-helix	trans	-68.9	-41.2	173.7	-70.6	173.6	0	0	0	112.4	L259 V273 E274 I275 H279 G280 I283 L300 M303 Q304 L307 L406	L259-L277 HydrophobicContact CD2-CD2 4.24Å; V273-L277 HydrophobicContact CG1-CD1 4.05Å; V273-L277 WeakPolarHBondContact O-CB 3.22Å; V273-L277 VanDerWaalsContact O-CG 3.26Å; V273-L277 WeakPolarHBondContact O-CG 3.42Å; V273-L277 PolarHBondContact O-N 3.22Å; E274-L277 PolarHBondContact O-N 2.84Å; E274-L277 VanDerWaalsContact O-N 3.15Å; I275-L277 VanDerWaalsContact C-N 3.32Å; I275-L277 PolarHBondContact O-N 3.28Å; L277-H279 PolarHBondContact O-N 3.49Å; L277-G280 PolarHBondContact O-N 3.41Å; L277-I283 HydrophobicContact CD2-CD1 3.53Å; L277-I283 HydrophobicContact CD2-CG1 3.94Å; L277-L300 HydrophobicContact CD1-CD2 4.29Å; L277-M303 HydrophobicContact CD1-CB 4.43Å; L277-Q304 HydrophobicContact CD2-CB 4.48Å; L277-L307 HydrophobicContact CB-CD1 4.15Å; L277-L406 WeakPolarHBondContact O-CD2 3.33Å
278	E	83.5	Confident	78	Confident	58 Å²	58	49 Å²	49	27%	0.271	24%	0.241	S	C	.	.	H	α-helix	trans	-59.2	-32.2	173.9	-71.6	-166.7	148	0	0	112.7	E274 I275 G280 L307 S402	E274-E278 WeakPolarHBondContact O-CG 3.2Å; E274-E278 PolarHBondContact O-N 3.21Å; I275-E278 PolarHBondContact O-N 3.42Å; E278-G280 VanDerWaalsContact C-N 3.3Å; E278-L307 HydrophobicContact CG-CD1 3.87Å; E278-L307 HydrophobicContact CG-CD2 4.36Å; E278-L307 HydrophobicContact CG-CG 4.43Å; E278-S402 WeakPolarHBondContact O-CA 3.4Å
279	H	81	Confident	76.7	Confident	43 Å²	43	46.6 Å²	46.6	20%	0.199	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.5	14.7	176.5	-63.5	81.1	0	0	0	113.2	C193 V199 I275 L276 L277	C193-H279 HydrophobicContact CB-CB 4.46Å; V199-H279 HydrophobicContact CG2-CB 4.02Å; I275-H279 PolarHBondContact O-N 3.45Å; I275-H279 VanDerWaalsContact O-N 3.13Å; I275-H279 PolarHBondContact O-ND1 3.29Å; L276-H279 PolarHBondContact O-N 2.67Å; L277-H279 PolarHBondContact O-N 3.49Å
280	G	78.2	Confident	75.4	Confident	6 Å²	6	50.1 Å²	50.1	6%	0.062	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	89.1	13.7	164.3	0	0	0	0	0	116.7	L276 L277 E278 R282 N409	L276-G280 PolarHBondContact O-N 3Å; L277-G280 PolarHBondContact O-N 3.41Å; E278-G280 VanDerWaalsContact C-N 3.3Å; G280-R282 PolarHBondContact O-N 3.3Å; G280-N409 WeakPolarHBondContact O-CB 3.35Å; G280-N409 PolarHBondContact O-ND2 2.79Å
281	A	81.7	Confident	74.4	Confident	1 Å²	1	46.2 Å²	46.2	1%	0.008	24%	0.236	C	C	.	.			trans	-47.7	134.2	-179.5	0	0	0	0	0	113.7	V199 L259 L276 N409	V199-A281 HydrophobicContact CB-CB 4.4Å; V199-A281 HydrophobicContact CG1-CB 3.63Å; L259-A281 HydrophobicContact CB-CB 4.16Å; L259-A281 HydrophobicContact CD2-CB 3.98Å; L276-A281 HydrophobicContact CB-CB 4.33Å; L276-A281 WeakPolarHBondContact O-CB 3.45Å; L276-A281 PolarHBondContact O-N 3.49Å; L276-A281 VanDerWaalsContact O-N 3.09Å; A281-N409 PolarHBondContact O-ND2 3.17Å
282	R	79.3	Confident	73.7	Confident	93 Å²	93	44.3 Å²	44.3	35%	0.351	22%	0.22	S	C	.	.			trans	-69.1	139.9	171.9	-67.7	174.3	-151.1	-112	-11.5	111.6	D200 L259 G280	D200-R282 WeakPolarHBondContact OD1-CG 3.4Å; D200-R282 PolarHBondContact OD1-N 2.84Å; D200-R282 IonicContact OD1-NE 2.68Å; D200-R282 IonicContact OD2-CZ 2.78Å; D200-R282 IonicContact OD2-NE 2.67Å; D200-R282 PolarHBondContact OD2-NE 3.49Å; D200-R282 IonicContact OD2-NH2 3.68Å; D200-R282 PolarHBondContact OD2-NH2 2.62Å; L259-R282 WeakPolarHBondContact CD2-O 3.27Å; G280-R282 PolarHBondContact O-N 3.3Å
283	I	80.2	Confident	73.2	Confident	4 Å²	4	44.6 Å²	44.6	2%	0.021	22%	0.222	C	C	.	.			trans	-113	-24.1	178.3	-27.5	-176.5	0	0	0	111	L259 L277 A292 P293 V294 L300 Q304 E411	L259-I283 HydrophobicContact CD2-CG1 4.28Å; L259-I283 HydrophobicContact CD2-CG2 4.21Å; L277-I283 HydrophobicContact CD2-CD1 3.53Å; L277-I283 HydrophobicContact CD2-CG1 3.94Å; I283-A292 WeakPolarHBondContact O-CB 3.16Å; I283-P293 HydrophobicContact CG2-CB 3.96Å; I283-P293 VanDerWaalsContact O-CD 3.32Å; I283-P293 WeakPolarHBondContact O-CD 3.36Å; I283-V294 HydrophobicContact CB-CG2 3.91Å; I283-V294 HydrophobicContact CG2-CB 4.44Å; I283-V294 HydrophobicContact CG2-CG2 3.44Å; I283-V294 VanDerWaalsContact CG2-CG2 3.44Å; I283-V294 WeakPolarHBondContact O-CG2 3.18Å; I283-V294 PolarHBondContact O-N 3.49Å; I283-L300 HydrophobicContact CD1-CB 4.27Å; I283-L300 HydrophobicContact CG2-CB 3.57Å; I283-L300 HydrophobicContact CG2-CD1 3.66Å; I283-L300 HydrophobicContact CG2-CG 4.19Å; I283-Q304 HydrophobicContact CD1-CB 3.62Å; I283-Q304 HydrophobicContact CD1-CG 3.94Å; I283-E411 PolarHBondContact N-OE2 2.95Å
284	G	71.5	Confident	72.7	Confident	13 Å²	13	46.7 Å²	46.7	13%	0.134	23%	0.234	C	C	.	.	S	Bend	trans	-75.5	-177.4	170.8	0	0	0	0	0	113.8	S286 E411	G284-S286 PolarHBondContact O-N 3.12Å; G284-E411 WeakPolarHBondContact CA-OE1 3.4Å; G284-E411 PolarHBondContact N-OE1 3.31Å; G284-E411 PolarHBondContact N-OE2 3.14Å; G284-E411 VanDerWaalsContact N-OE2 3.15Å
285	P	63.9	Low	72.4	Confident	109 Å²	109	47.3 Å²	47.3	71%	0.708	24%	0.241	S	C	*	.			trans	-68.2	114.7	-174.3	26.6	-34.2	0	0	0	111.8	A292	P285-A292 HydrophobicContact CB-CB 4.37Å
286	S	60.3	Low	72	Confident	19 Å²	19	49 Å²	49	13%	0.133	25%	0.25	C	S	.	.			trans	-69.2	148.2	171.6	178.5	0	0	0	0	110.9	G284 W288 S289	G284-S286 PolarHBondContact O-N 3.12Å; S286-W288 PolarHBondContact O-N 2.85Å; S286-W288 PolarHBondContact OG-N 3.44Å; S286-S289 PolarHBondContact O-N 2.89Å
287	R	54.9	Low	71.8	Confident	191 Å²	191	50.6 Å²	50.6	72%	0.721	26%	0.258	S	S	*	.	S	Bend	trans	-56.4	-22.7	175.3	177.9	172.7	178	137.8	-0.3	113.3
288	W	52.8	Low	71.6	Confident	148 Å²	148	54.8 Å²	54.8	56%	0.561	29%	0.285	S	S	*	.	S	Bend	trans	-110.3	-19.3	-172.2	-55.1	-73.5	0	0	0	114.1	T202 N255 S286	T202-W288 HydrophobicContact CG2-CB 4.13Å; N255-W288 HydrophobicContact CB-CB 4.21Å; N255-W288 WeakPolarHBondContact CB-O 3.49Å; N255-W288 PolarHBondContact ND2-O 3.28Å; S286-W288 PolarHBondContact O-N 2.85Å; S286-W288 PolarHBondContact OG-N 3.44Å
289	S	55.9	Low	71.5	Confident	11 Å²	11	56.2 Å²	56.2	8%	0.077	29%	0.292	C	S	.	.			trans	-106.2	136.3	-177.8	-159	0	0	0	0	111.2	N255 S286 A291	N255-S289 VanDerWaalsContact O-CB 3.3Å; N255-S289 WeakPolarHBondContact O-CB 3.14Å; N255-S289 PolarHBondContact O-OG 3.23Å; N255-S289 VanDerWaalsContact O-OG 3.12Å; S286-S289 PolarHBondContact O-N 2.89Å; S289-A291 VanDerWaalsContact C-N 3.33Å; S289-A291 PolarHBondContact OG-O 2.74Å
290	S	57	Low	71.6	Confident	95 Å²	95	54.1 Å²	54.1	66%	0.664	28%	0.282	S	S	*	.	S	Bend	trans	-78	-15	-179.9	51.2	0	0	0	0	114.3
291	A	64	Low	71.8	Confident	9 Å²	9	58.4 Å²	58.4	7%	0.074	30%	0.299	C	S	.	.	S	Bend	trans	-118.8	137.2	174	0	0	0	0	0	110.5	F253 S289	F253-A291 HydrophobicContact CD1-CB 3.94Å; F253-A291 HydrophobicContact CE1-CB 3.63Å; F253-A291 HydrophobicContact CZ-CB 4.28Å; S289-A291 VanDerWaalsContact C-N 3.33Å; S289-A291 PolarHBondContact OG-O 2.74Å
292	A	71.5	Confident	71.9	Confident	3 Å²	3	64.7 Å²	64.7	3%	0.025	32%	0.323	C	S	.	.			trans	-83.3	142.2	167.1	0	0	0	0	0	109.2	I283 P285 V294 D295	I283-A292 WeakPolarHBondContact O-CB 3.16Å; P285-A292 HydrophobicContact CB-CB 4.37Å; A292-V294 PolarHBondContact O-N 2.98Å; A292-V294 VanDerWaalsContact O-N 3.13Å; A292-D295 WeakPolarHBondContact CB-OD2 3.37Å; A292-D295 PolarHBondContact N-OD2 3.15Å; A292-D295 WeakPolarHBondContact O-CB 3.24Å; A292-D295 PolarHBondContact O-N 3.48Å
293	P	75.4	Confident	72	Confident	5 Å²	5	61.7 Å²	61.7	3%	0.032	31%	0.313	C	S	.	.	H	α-helix	trans	-53.7	-30.3	172.7	-29.7	35.7	0	0	0	114.3	L259 L260 I283 D295 L296 M297 L300	L259-P293 HydrophobicContact CB-CG 4.43Å; L259-P293 HydrophobicContact CD2-CB 3.95Å; L259-P293 HydrophobicContact CD2-CG 4.1Å; L259-P293 HydrophobicContact CG-CB 4.12Å; L259-P293 HydrophobicContact CG-CG 4.23Å; L260-P293 HydrophobicContact CB-CG 4.32Å; L260-P293 HydrophobicContact CD1-CG 4.16Å; I283-P293 HydrophobicContact CG2-CB 3.96Å; I283-P293 VanDerWaalsContact O-CD 3.32Å; I283-P293 WeakPolarHBondContact O-CD 3.36Å; P293-D295 VanDerWaalsContact C-N 3.25Å; P293-D295 PolarHBondContact O-N 2.71Å; P293-L296 PolarHBondContact O-N 2.89Å; P293-M297 PolarHBondContact O-N 3.39Å; P293-L300 HydrophobicContact CB-CD1 3.74Å; P293-L300 WeakPolarHBondContact O-CD1 3.42Å
294	V	76.2	Confident	72.2	Confident	45 Å²	45	61.9 Å²	61.9	27%	0.273	31%	0.314	S	S	.	.	H	α-helix	trans	-55.8	-37.8	171.4	170.8	0	0	0	0	112.3	I283 A292 L296 M297 P298	I283-V294 HydrophobicContact CB-CG2 3.91Å; I283-V294 HydrophobicContact CG2-CB 4.44Å; I283-V294 HydrophobicContact CG2-CG2 3.44Å; I283-V294 VanDerWaalsContact CG2-CG2 3.44Å; I283-V294 WeakPolarHBondContact O-CG2 3.18Å; I283-V294 PolarHBondContact O-N 3.49Å; A292-V294 PolarHBondContact O-N 2.98Å; A292-V294 VanDerWaalsContact O-N 3.13Å; V294-L296 VanDerWaalsContact C-N 3.25Å; V294-L296 PolarHBondContact O-N 3.37Å; V294-M297 CarbonylContact O-C 3.41Å; V294-M297 VanDerWaalsContact O-C 3.24Å; V294-M297 PolarHBondContact O-N 3.29Å; V294-P298 WeakPolarHBondContact O-CA 3.37Å; V294-P298 VanDerWaalsContact O-N 3.12Å
295	D	78	Confident	72.8	Confident	113 Å²	113	65.3 Å²	65.3	60%	0.604	33%	0.325	S	S	*	.	H	α-helix	trans	-66.9	-29.1	-174	-54.6	-33.6	0	0	0	111.9	A292 P293	A292-D295 WeakPolarHBondContact CB-OD2 3.37Å; A292-D295 PolarHBondContact N-OD2 3.15Å; A292-D295 WeakPolarHBondContact O-CB 3.24Å; A292-D295 PolarHBondContact O-N 3.48Å; P293-D295 VanDerWaalsContact C-N 3.25Å; P293-D295 PolarHBondContact O-N 2.71Å
296	L	76.7	Confident	73.8	Confident	63 Å²	63	62.8 Å²	62.8	33%	0.33	31%	0.308	S	S	.	.	H	α-helix	trans	-90.8	-30.7	175.4	-61.2	-176.9	0	0	0	112.8	L260 V263 Q264 P293 V294	L260-L296 HydrophobicContact CD1-CD1 3.73Å; V263-L296 HydrophobicContact CG1-CB 3.78Å; V263-L296 HydrophobicContact CG1-CD1 4.4Å; Q264-L296 HydrophobicContact CG-CD1 4.24Å; P293-L296 PolarHBondContact O-N 2.89Å; V294-L296 VanDerWaalsContact C-N 3.25Å; V294-L296 PolarHBondContact O-N 3.37Å
297	M	81.9	Confident	75	Confident	32 Å²	32	63 Å²	63	16%	0.158	31%	0.307	C	S	.	.			trans	-142.7	86.4	-179	-173.2	-175.7	-178.2	0	0	111.2	V263 L268 P293 V294 E299 L300 M303	V263-M297 HydrophobicContact CG1-CB 3.92Å; L268-M297 HydrophobicContact CD2-CE 3.72Å; L268-M297 HydrophobicContact CD2-SD 3.82Å; P293-M297 PolarHBondContact O-N 3.39Å; V294-M297 CarbonylContact O-C 3.41Å; V294-M297 VanDerWaalsContact O-C 3.24Å; V294-M297 PolarHBondContact O-N 3.29Å; M297-E299 HydrophobicContact CE-CB 4.06Å; M297-E299 HydrophobicContact CG-CB 4.32Å; M297-E299 PolarHBondContact O-N 3.39Å; M297-E299 VanDerWaalsContact O-N 3.13Å; M297-L300 HydrophobicContact CB-CD1 3.82Å; M297-L300 HydrophobicContact CB-CG 3.95Å; M297-L300 HydrophobicContact CG-CD1 4.38Å; M297-L300 HydrophobicContact CG-CG 3.94Å; M297-L300 VanDerWaalsContact O-CB 3.3Å; M297-L300 WeakPolarHBondContact O-CB 3.4Å; M297-L300 WeakPolarHBondContact O-CD1 3.21Å; M297-L300 VanDerWaalsContact O-CG 3.27Å; M297-L300 WeakPolarHBondContact O-CG 3.3Å; M297-L300 PolarHBondContact O-N 3.02Å; M297-L300 HydrophobicContact SD-CD1 4.49Å; M297-L300 HydrophobicContact SD-CD2 4.03Å; M297-L300 HydrophobicContact SD-CG 3.88Å; M297-M303 HydrophobicContact CE-CE 3.49Å; M297-M303 VanDerWaalsContact CE-CE 3.49Å; M297-M303 HydrophobicContact CE-SD 4.25Å; M297-M303 HydrophobicContact SD-CE 4.17Å
298	P	80.2	Confident	76.4	Confident	90 Å²	90	53.9 Å²	53.9	58%	0.584	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-23	-177.4	23.1	-33.8	0	0	0	113.5	V294 L300 F301	V294-P298 WeakPolarHBondContact O-CA 3.37Å; V294-P298 VanDerWaalsContact O-N 3.12Å; P298-L300 PolarHBondContact O-N 3.32Å; P298-F301 WeakPolarHBondContact O-CB 3.15Å; P298-F301 PolarHBondContact O-N 2.82Å
299	E	81.8	Confident	77.9	Confident	87 Å²	87	50.7 Å²	50.7	41%	0.407	26%	0.263	S	S	.	.	H	α-helix	trans	-59.2	-23.3	172.8	-76	-66.2	110.2	0	0	113.5	M297 F301 R302 M303	M297-E299 HydrophobicContact CE-CB 4.06Å; M297-E299 HydrophobicContact CG-CB 4.32Å; M297-E299 PolarHBondContact O-N 3.39Å; M297-E299 VanDerWaalsContact O-N 3.13Å; E299-F301 PolarHBondContact O-N 2.85Å; E299-R302 PolarHBondContact O-N 2.7Å; E299-R302 IonicContact OE1-NE 2.84Å; E299-R302 IonicContact OE2-CZ 3.24Å; E299-R302 IonicContact OE2-NE 2.79Å; E299-R302 PolarHBondContact OE2-NE 3.03Å; E299-R302 IonicContact OE2-NH2 3.27Å; E299-R302 PolarHBondContact OE2-NH2 3.38Å; E299-M303 WeakPolarHBondContact O-CG 3.35Å; E299-M303 PolarHBondContact O-N 3.35Å
300	L	82.6	Confident	79.3	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-54.1	-37	174.3	-71.1	165.8	0	0	0	112.3	L259 V263 V273 L277 I283 P293 M297 P298 M303 Q304	L259-L300 HydrophobicContact CD1-CD2 4.41Å; V263-L300 HydrophobicContact CG2-CD1 3.91Å; V263-L300 HydrophobicContact CG2-CD2 4.5Å; V273-L300 HydrophobicContact CG1-CD2 3.48Å; V273-L300 VanDerWaalsContact CG1-CD2 3.48Å; L277-L300 HydrophobicContact CD1-CD2 4.29Å; I283-L300 HydrophobicContact CD1-CB 4.27Å; I283-L300 HydrophobicContact CG2-CB 3.57Å; I283-L300 HydrophobicContact CG2-CD1 3.66Å; I283-L300 HydrophobicContact CG2-CG 4.19Å; P293-L300 HydrophobicContact CB-CD1 3.74Å; P293-L300 WeakPolarHBondContact O-CD1 3.42Å; M297-L300 HydrophobicContact CB-CD1 3.82Å; M297-L300 HydrophobicContact CB-CG 3.95Å; M297-L300 HydrophobicContact CG-CD1 4.38Å; M297-L300 HydrophobicContact CG-CG 3.94Å; M297-L300 VanDerWaalsContact O-CB 3.3Å; M297-L300 WeakPolarHBondContact O-CB 3.4Å; M297-L300 WeakPolarHBondContact O-CD1 3.21Å; M297-L300 VanDerWaalsContact O-CG 3.27Å; M297-L300 WeakPolarHBondContact O-CG 3.3Å; M297-L300 PolarHBondContact O-N 3.02Å; M297-L300 HydrophobicContact SD-CD1 4.49Å; M297-L300 HydrophobicContact SD-CD2 4.03Å; M297-L300 HydrophobicContact SD-CG 3.88Å; P298-L300 PolarHBondContact O-N 3.32Å; L300-M303 HydrophobicContact CD2-CE 3.71Å; L300-M303 HydrophobicContact CG-CE 4.32Å; L300-M303 PolarHBondContact O-N 3.26Å; L300-Q304 WeakPolarHBondContact O-CB 3.44Å; L300-Q304 PolarHBondContact O-N 2.75Å
301	F	81.3	Confident	80.6	Confident	95 Å²	95	50.1 Å²	50.1	42%	0.417	25%	0.251	S	S	.	.	H	α-helix	trans	-64.1	-41	176.9	-177.2	-98	0	0	0	112	P298 E299 K305 Y415	P298-F301 WeakPolarHBondContact O-CB 3.15Å; P298-F301 PolarHBondContact O-N 2.82Å; E299-F301 PolarHBondContact O-N 2.85Å; F301-K305 WeakPolarHBondContact O-CB 3.01Å; F301-K305 PolarHBondContact O-N 2.78Å; F301-K305 VanDerWaalsContact O-N 3.12Å; F301-Y415 HydrophobicContact CE2-CE2 4.19Å; F301-Y415 AromaticContact CE2-CZ 3.86Å; F301-Y415 WeakPolarHBondContact CE2-OH 3.43Å; F301-Y415 HydrophobicContact CZ-CE1 4.36Å; F301-Y415 AromaticContact CZ-CZ 3.88Å; F301-Y415 WeakPolarHBondContact CZ-OH 3.18Å
302	R	83.7	Confident	81.4	Confident	133 Å²	133	49.8 Å²	49.8	50%	0.502	25%	0.249	S	C	.	.	H	α-helix	trans	-70.4	-40.2	176.4	-168.7	-177.9	65	73.9	3.3	111.3	E299 K305 T306	E299-R302 PolarHBondContact O-N 2.7Å; E299-R302 IonicContact OE1-NE 2.84Å; E299-R302 IonicContact OE2-CZ 3.24Å; E299-R302 IonicContact OE2-NE 2.79Å; E299-R302 PolarHBondContact OE2-NE 3.03Å; E299-R302 IonicContact OE2-NH2 3.27Å; E299-R302 PolarHBondContact OE2-NH2 3.38Å; R302-K305 PolarHBondContact O-N 3.09Å; R302-T306 PolarHBondContact O-N 3.36Å; R302-T306 PolarHBondContact O-OG1 2.97Å
303	M	83.2	Confident	82	Confident	31 Å²	31	52.7 Å²	52.7	15%	0.153	26%	0.262	C	S	.	.	H	α-helix	trans	-65.2	-47.3	177.3	-66.3	-168.7	-52.2	0	0	111.5	V273 L277 M297 E299 L300 K305 T306 L307	V273-M303 HydrophobicContact CG1-CE 3.99Å; L277-M303 HydrophobicContact CD1-CB 4.43Å; M297-M303 HydrophobicContact CE-CE 3.49Å; M297-M303 VanDerWaalsContact CE-CE 3.49Å; M297-M303 HydrophobicContact CE-SD 4.25Å; M297-M303 HydrophobicContact SD-CE 4.17Å; E299-M303 WeakPolarHBondContact O-CG 3.35Å; E299-M303 PolarHBondContact O-N 3.35Å; L300-M303 HydrophobicContact CD2-CE 3.71Å; L300-M303 HydrophobicContact CG-CE 4.32Å; L300-M303 PolarHBondContact O-N 3.26Å; M303-K305 VanDerWaalsContact C-N 3.33Å; M303-K305 PolarHBondContact O-N 3.36Å; M303-T306 WeakPolarHBondContact CA-OG1 3.45Å; M303-T306 PolarHBondContact O-N 2.97Å; M303-T306 PolarHBondContact O-OG1 2.67Å; M303-L307 WeakPolarHBondContact O-CB 3.43Å; M303-L307 PolarHBondContact O-N 3.47Å
304	Q	84.4	Confident	82.3	Confident	7 Å²	7	57.5 Å²	57.5	3%	0.033	28%	0.282	C	S	.	.	H	α-helix	trans	-59.6	-43	174.7	-170.8	-171	55.4	0	0	111.7	L277 I283 L300 T306 L307 I308 C412	L277-Q304 HydrophobicContact CD2-CB 4.48Å; I283-Q304 HydrophobicContact CD1-CB 3.62Å; I283-Q304 HydrophobicContact CD1-CG 3.94Å; L300-Q304 WeakPolarHBondContact O-CB 3.44Å; L300-Q304 PolarHBondContact O-N 2.75Å; Q304-T306 VanDerWaalsContact C-N 3.35Å; Q304-T306 PolarHBondContact O-N 2.84Å; Q304-L307 PolarHBondContact O-N 2.87Å; Q304-I308 HydrophobicContact CG-CD1 3.94Å; Q304-I308 HydrophobicContact CG-CG1 4.49Å; Q304-I308 WeakPolarHBondContact O-CB 3.27Å; Q304-I308 VanDerWaalsContact O-CG1 3.31Å; Q304-I308 WeakPolarHBondContact O-CG1 3.41Å; Q304-I308 PolarHBondContact O-N 2.75Å; Q304-C412 PolarHBondContact NE2-SG 3.14Å
305	K	83.7	Confident	82.4	Confident	85 Å²	85	55.4 Å²	55.4	37%	0.37	27%	0.269	S	S	.	.	H	α-helix	trans	-67.9	-30.6	179.5	-171.4	167.7	-174.5	167.5	0	113.7	F301 R302 M303 K309	F301-K305 WeakPolarHBondContact O-CB 3.01Å; F301-K305 PolarHBondContact O-N 2.78Å; F301-K305 VanDerWaalsContact O-N 3.12Å; R302-K305 PolarHBondContact O-N 3.09Å; M303-K305 VanDerWaalsContact C-N 3.33Å; M303-K305 PolarHBondContact O-N 3.36Å; K305-K309 WeakPolarHBondContact O-CG 3.43Å
306	T	85.3	Confident	82.3	Confident	57 Å²	57	50.2 Å²	50.2	35%	0.35	24%	0.242	S	C	.	.	H	α-helix	trans	-76.7	-45.8	172.2	40.4	0	0	0	0	111	R302 M303 Q304 I308 K309 D310	R302-T306 PolarHBondContact O-N 3.36Å; R302-T306 PolarHBondContact O-OG1 2.97Å; M303-T306 WeakPolarHBondContact CA-OG1 3.45Å; M303-T306 PolarHBondContact O-N 2.97Å; M303-T306 PolarHBondContact O-OG1 2.67Å; Q304-T306 VanDerWaalsContact C-N 3.35Å; Q304-T306 PolarHBondContact O-N 2.84Å; T306-I308 PolarHBondContact O-N 3.49Å; T306-K309 WeakPolarHBondContact O-CB 3.29Å; T306-K309 PolarHBondContact O-N 3.42Å; T306-K309 VanDerWaalsContact O-N 3.08Å; T306-D310 PolarHBondContact O-N 3.12Å
307	L	84.9	Confident	82.2	Confident	22 Å²	22	50.9 Å²	50.9	12%	0.115	25%	0.245	C	C	.	.	H	α-helix	trans	-57.6	-42.3	176.7	-177.1	147.3	0	0	0	113.1	L277 E278 M303 Q304 D310 L311 L406	L277-L307 HydrophobicContact CB-CD1 4.15Å; E278-L307 HydrophobicContact CG-CD1 3.87Å; E278-L307 HydrophobicContact CG-CD2 4.36Å; E278-L307 HydrophobicContact CG-CG 4.43Å; M303-L307 WeakPolarHBondContact O-CB 3.43Å; M303-L307 PolarHBondContact O-N 3.47Å; Q304-L307 PolarHBondContact O-N 2.87Å; L307-D310 PolarHBondContact O-N 3.05Å; L307-L311 HydrophobicContact CD2-CD1 3.6Å; L307-L311 HydrophobicContact CD2-CG 4.47Å; L307-L311 HydrophobicContact CG-CD1 4.21Å; L307-L311 WeakPolarHBondContact O-CB 3.29Å; L307-L311 VanDerWaalsContact O-CG 3.32Å; L307-L311 WeakPolarHBondContact O-CG 3.4Å; L307-L311 PolarHBondContact O-N 3.45Å; L307-L406 HydrophobicContact CD2-CD1 3.93Å; L307-L406 HydrophobicContact CD2-CD2 4.47Å
308	I	83.7	Confident	81.5	Confident	1 Å²	1	51 Å²	51	1%	0.005	25%	0.246	C	C	.	.	H	α-helix	trans	-61.2	-45.8	173.8	-72.8	168.6	0	0	0	111.1	Q304 T306 V312 L406 C412 V416 A419	Q304-I308 HydrophobicContact CG-CD1 3.94Å; Q304-I308 HydrophobicContact CG-CG1 4.49Å; Q304-I308 WeakPolarHBondContact O-CB 3.27Å; Q304-I308 VanDerWaalsContact O-CG1 3.31Å; Q304-I308 WeakPolarHBondContact O-CG1 3.41Å; Q304-I308 PolarHBondContact O-N 2.75Å; T306-I308 PolarHBondContact O-N 3.49Å; I308-V312 WeakPolarHBondContact O-CB 3.17Å; I308-V312 VanDerWaalsContact O-CG2 3.29Å; I308-V312 WeakPolarHBondContact O-CG2 3.4Å; I308-V312 PolarHBondContact O-N 2.82Å; I308-L406 HydrophobicContact CG1-CD1 4.22Å; I308-L406 HydrophobicContact CG1-CD2 4.19Å; I308-C412 HydrophobicContact CD1-CB 4.02Å; I308-V416 HydrophobicContact CG2-CG2 3.88Å; I308-A419 HydrophobicContact CG2-CB 4.22Å
309	K	84.7	Confident	81	Confident	80 Å²	80	47.8 Å²	47.8	35%	0.348	22%	0.223	S	C	.	.	H	α-helix	trans	-62.1	-47.8	176.9	-74.2	-179	171.2	-152.2	0	111.6	K305 T306 L311 V312 H313 A419	K305-K309 WeakPolarHBondContact O-CG 3.43Å; T306-K309 WeakPolarHBondContact O-CB 3.29Å; T306-K309 PolarHBondContact O-N 3.42Å; T306-K309 VanDerWaalsContact O-N 3.08Å; K309-L311 VanDerWaalsContact C-N 3.34Å; K309-L311 PolarHBondContact O-N 3.24Å; K309-V312 PolarHBondContact O-N 3.28Å; K309-H313 VanDerWaalsContact O-CB 3.3Å; K309-H313 WeakPolarHBondContact O-CB 3.4Å; K309-H313 PolarHBondContact O-N 2.97Å; K309-A419 HydrophobicContact CG-CB 4.34Å
310	D	84.9	Confident	79.9	Confident	90 Å²	90	50.3 Å²	50.3	48%	0.481	23%	0.232	S	C	.	.	H	α-helix	trans	-65.9	-37.2	-176.9	-67.8	-13.5	0	0	0	111.2	T306 L307 K314	T306-D310 PolarHBondContact O-N 3.12Å; L307-D310 PolarHBondContact O-N 3.05Å; D310-K314 WeakPolarHBondContact O-CB 3.35Å; D310-K314 WeakPolarHBondContact O-CD 3.41Å; D310-K314 WeakPolarHBondContact O-CG 3.22Å; D310-K314 PolarHBondContact O-N 3.45Å
311	L	83.6	Confident	78.7	Confident	4 Å²	4	53.1 Å²	53.1	2%	0.021	26%	0.255	C	S	.	.	H	α-helix	trans	-69.8	-40.9	173.6	-73	174.3	0	0	0	112.6	L307 K309 K314 A315 V399 L403 L406	L307-L311 HydrophobicContact CD2-CD1 3.6Å; L307-L311 HydrophobicContact CD2-CG 4.47Å; L307-L311 HydrophobicContact CG-CD1 4.21Å; L307-L311 WeakPolarHBondContact O-CB 3.29Å; L307-L311 VanDerWaalsContact O-CG 3.32Å; L307-L311 WeakPolarHBondContact O-CG 3.4Å; L307-L311 PolarHBondContact O-N 3.45Å; K309-L311 VanDerWaalsContact C-N 3.34Å; K309-L311 PolarHBondContact O-N 3.24Å; L311-K314 PolarHBondContact O-N 2.9Å; L311-A315 WeakPolarHBondContact O-CB 3.32Å; L311-A315 PolarHBondContact O-N 3.42Å; L311-V399 HydrophobicContact CD2-CG1 4.19Å; L311-V399 HydrophobicContact CD2-CG2 4.46Å; L311-L403 HydrophobicContact CB-CD2 3.86Å; L311-L403 HydrophobicContact CB-CG 4.21Å; L311-L406 HydrophobicContact CD1-CD1 3.53Å
312	V	82.1	Confident	77.2	Confident	3 Å²	3	51.3 Å²	51.3	2%	0.018	25%	0.25	C	S	.	.	H	α-helix	trans	-64.1	-44.7	174.7	169.7	0	0	0	0	110.7	I308 K309 A315 I316 L403 A419 L420 E423	I308-V312 WeakPolarHBondContact O-CB 3.17Å; I308-V312 VanDerWaalsContact O-CG2 3.29Å; I308-V312 WeakPolarHBondContact O-CG2 3.4Å; I308-V312 PolarHBondContact O-N 2.82Å; K309-V312 PolarHBondContact O-N 3.28Å; V312-A315 PolarHBondContact O-N 2.85Å; V312-I316 HydrophobicContact CG1-CD1 3.7Å; V312-I316 WeakPolarHBondContact O-CD1 3.29Å; V312-I316 VanDerWaalsContact O-CG1 3.29Å; V312-I316 WeakPolarHBondContact O-CG1 3.5Å; V312-I316 PolarHBondContact O-N 3.36Å; V312-L403 HydrophobicContact CG2-CD2 3.83Å; V312-A419 HydrophobicContact CB-CB 4.3Å; V312-A419 HydrophobicContact CG1-CB 4.32Å; V312-A419 HydrophobicContact CG2-CB 4.16Å; V312-L420 HydrophobicContact CG1-CD2 3.93Å; V312-L420 HydrophobicContact CG1-CG 4.4Å; V312-E423 HydrophobicContact CG1-CG 4.27Å
313	H	82.9	Confident	75.5	Confident	64 Å²	64	47.1 Å²	47.1	30%	0.296	25%	0.248	S	C	.	.	H	α-helix	trans	-63.1	-47.5	175.6	-169.1	91.7	0	0	0	111.5	K309 A315 I316 L317 E423	K309-H313 VanDerWaalsContact O-CB 3.3Å; K309-H313 WeakPolarHBondContact O-CB 3.4Å; K309-H313 PolarHBondContact O-N 2.97Å; H313-A315 VanDerWaalsContact C-N 3.34Å; H313-A315 PolarHBondContact O-N 3.08Å; H313-I316 PolarHBondContact O-N 2.88Å; H313-L317 WeakPolarHBondContact NE2-CD1 3.09Å; H313-L317 WeakPolarHBondContact O-CG 3.46Å; H313-L317 PolarHBondContact O-N 3.4Å; H313-E423 IonicContact CE1-OE1 2.86Å; H313-E423 IonicContact CE1-OE2 2.88Å; H313-E423 IonicContact CG-OE1 3.06Å; H313-E423 IonicContact ND1-OE1 2.64Å; H313-E423 PolarHBondContact ND1-OE1 3.07Å; H313-E423 IonicContact ND1-OE2 2.64Å; H313-E423 PolarHBondContact ND1-OE2 3.16Å; H313-E423 VanDerWaalsContact ND1-OE2 3.14Å
314	K	82.7	Confident	73.6	Confident	105 Å²	105	53.3 Å²	53.3	46%	0.457	28%	0.281	S	S	.	.	H	α-helix	trans	-57.9	-42.1	173.7	-77.5	166.6	-174.9	173.4	0	111.8	D310 L311 L317 L318 V399	D310-K314 WeakPolarHBondContact O-CB 3.35Å; D310-K314 WeakPolarHBondContact O-CD 3.41Å; D310-K314 WeakPolarHBondContact O-CG 3.22Å; D310-K314 PolarHBondContact O-N 3.45Å; L311-K314 PolarHBondContact O-N 2.9Å; K314-L317 PolarHBondContact O-N 2.85Å; K314-L318 WeakPolarHBondContact O-CB 3.08Å; K314-L318 VanDerWaalsContact O-CG 3.31Å; K314-L318 WeakPolarHBondContact O-CG 3.05Å; K314-L318 PolarHBondContact O-N 3.39Å; K314-V399 HydrophobicContact CB-CG1 4.39Å
315	A	78.4	Confident	71.4	Confident	1 Å²	1	61 Å²	61	1%	0.008	32%	0.317	C	S	.	.	H	α-helix	trans	-61.2	-50	175.9	0	0	0	0	0	111.3	L311 V312 H313 L317 L318 W319 V399 L403	L311-A315 WeakPolarHBondContact O-CB 3.32Å; L311-A315 PolarHBondContact O-N 3.42Å; V312-A315 PolarHBondContact O-N 2.85Å; H313-A315 VanDerWaalsContact C-N 3.34Å; H313-A315 PolarHBondContact O-N 3.08Å; A315-L317 PolarHBondContact O-N 2.85Å; A315-L318 PolarHBondContact O-N 3.26Å; A315-W319 HydrophobicContact CB-CD2 4.29Å; A315-W319 HydrophobicContact CB-CE3 4.28Å; A315-W319 HydrophobicContact CB-CH2 4Å; A315-W319 HydrophobicContact CB-CZ2 3.91Å; A315-W319 HydrophobicContact CB-CZ3 4.16Å; A315-W319 VanDerWaalsContact O-CB 3.32Å; A315-W319 WeakPolarHBondContact O-CB 3.31Å; A315-W319 PolarHBondContact O-N 3.22Å; A315-V399 HydrophobicContact CB-CG1 3.91Å; A315-L403 HydrophobicContact CB-CD1 3.61Å
316	I	75	Confident	69	Low	4 Å²	4	65.5 Å²	65.5	2%	0.021	34%	0.336	C	S	.	.	H	α-helix	trans	-63.9	-24.9	178.9	-66.4	161.9	0	0	0	112.2	V312 H313 W319 E423 N426 I427 K430	V312-I316 HydrophobicContact CG1-CD1 3.7Å; V312-I316 WeakPolarHBondContact O-CD1 3.29Å; V312-I316 VanDerWaalsContact O-CG1 3.29Å; V312-I316 WeakPolarHBondContact O-CG1 3.5Å; V312-I316 PolarHBondContact O-N 3.36Å; H313-I316 PolarHBondContact O-N 2.88Å; I316-W319 HydrophobicContact CG1-CE3 4.28Å; I316-W319 HydrophobicContact CG1-CZ3 4.3Å; I316-E423 HydrophobicContact CD1-CB 3.61Å; I316-E423 HydrophobicContact CD1-CG 4.01Å; I316-N426 HydrophobicContact CG2-CB 3.9Å; I316-I427 HydrophobicContact CD1-CD1 3.81Å; I316-I427 HydrophobicContact CD1-CG1 3.72Å; I316-I427 HydrophobicContact CG1-CG1 4.16Å; I316-I427 HydrophobicContact CG2-CG1 4.22Å; I316-K430 PolarHBondContact O-NZ 3.15Å
317	L	75	Confident	66.4	Low	77 Å²	77	68 Å²	68	40%	0.403	36%	0.357	S	S	.	.	H	α-helix	trans	-82.6	-42.5	170.6	-71.6	-175.2	0	0	0	113.7	H313 K314 A315 W319 K320	H313-L317 WeakPolarHBondContact NE2-CD1 3.09Å; H313-L317 WeakPolarHBondContact O-CG 3.46Å; H313-L317 PolarHBondContact O-N 3.4Å; K314-L317 PolarHBondContact O-N 2.85Å; A315-L317 PolarHBondContact O-N 2.85Å; L317-W319 VanDerWaalsContact C-N 3.33Å; L317-W319 PolarHBondContact O-N 2.78Å; L317-K320 WeakPolarHBondContact O-CA 3.45Å; L317-K320 WeakPolarHBondContact O-CB 3.13Å; L317-K320 PolarHBondContact O-N 3.32Å
318	L	68.1	Low	64.1	Low	35 Å²	35	72.4 Å²	72.4	18%	0.183	39%	0.386	C	S	.	.	H	α-helix	trans	-66.7	-37.5	177.4	-72.2	167.9	0	0	0	111.1	K314 A315 K320 A321 V399	K314-L318 WeakPolarHBondContact O-CB 3.08Å; K314-L318 VanDerWaalsContact O-CG 3.31Å; K314-L318 WeakPolarHBondContact O-CG 3.05Å; K314-L318 PolarHBondContact O-N 3.39Å; A315-L318 PolarHBondContact O-N 3.26Å; L318-K320 PolarHBondContact O-N 2.77Å; L318-A321 PolarHBondContact O-N 3.49Å; L318-V399 HydrophobicContact CD1-CB 4.13Å; L318-V399 HydrophobicContact CD1-CG2 3.7Å
319	W	69	Low	62	Low	23 Å²	23	78.1 Å²	78.1	9%	0.087	42%	0.423	C	S	.	.	H	α-helix	trans	-66.2	-12.6	171.5	-56.7	-21.4	0	0	0	113.4	A315 I316 L317 I400 L440 R443 I444	A315-W319 HydrophobicContact CB-CD2 4.29Å; A315-W319 HydrophobicContact CB-CE3 4.28Å; A315-W319 HydrophobicContact CB-CH2 4Å; A315-W319 HydrophobicContact CB-CZ2 3.91Å; A315-W319 HydrophobicContact CB-CZ3 4.16Å; A315-W319 VanDerWaalsContact O-CB 3.32Å; A315-W319 WeakPolarHBondContact O-CB 3.31Å; A315-W319 PolarHBondContact O-N 3.22Å; I316-W319 HydrophobicContact CG1-CE3 4.28Å; I316-W319 HydrophobicContact CG1-CZ3 4.3Å; L317-W319 VanDerWaalsContact C-N 3.33Å; L317-W319 PolarHBondContact O-N 2.78Å; W319-I400 HydrophobicContact CZ2-CD1 4.46Å; W319-I400 HydrophobicContact CZ2-CG1 4.12Å; W319-L440 HydrophobicContact CB-CD1 3.82Å; W319-L440 HydrophobicContact CD2-CD1 3.83Å; W319-L440 HydrophobicContact CE3-CD1 3.21Å; W319-L440 HydrophobicContact CG-CD1 4.14Å; W319-L440 HydrophobicContact CZ3-CD1 3.98Å; W319-R443 HydrophobicContact CH2-CB 4.32Å; W319-R443 HydrophobicContact CZ2-CB 3.95Å; W319-I444 HydrophobicContact CZ3-CG1 3.92Å
320	K	59.7	Low	59.7	Low	139 Å²	139	82 Å²	82	60%	0.604	45%	0.448	S	S	*	.	H	α-helix	trans	-75.4	-30.4	169.3	-168.9	-169	175.9	-173.4	0	112.3	L317 L318 K430	L317-K320 WeakPolarHBondContact O-CA 3.45Å; L317-K320 WeakPolarHBondContact O-CB 3.13Å; L317-K320 PolarHBondContact O-N 3.32Å; L318-K320 PolarHBondContact O-N 2.77Å; K320-K430 HydrophobicContact CB-CD 4.39Å; K320-K430 HydrophobicContact CG-CD 4.24Å
321	A	56.4	Low	57.5	Low	59 Å²	59	85.8 Å²	85.8	49%	0.488	46%	0.463	S	S	.	.	H	α-helix	trans	-83.5	-45.2	-170	0	0	0	0	0	112.7	L318 G323	L318-A321 PolarHBondContact O-N 3.49Å; A321-G323 PolarHBondContact O-N 3.01Å
322	N	49.9	Very low	55.2	Low	58 Å²	58	92.3 Å²	92.3	31%	0.31	50%	0.497	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-8.2	-170.4	-67	-2.1	0	0	0	115	S396	N322-S396 PolarHBondContact ND2-OG 3.27Å
323	G	48.4	Very low	52.9	Low	44 Å²	44	99.2 Å²	99.2	45%	0.454	53%	0.529	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-5.1	-176.2	0	0	0	0	0	116.2	A321	A321-G323 PolarHBondContact O-N 3.01Å
324	L	42.8	Very low	50.7	Low	161 Å²	161	104.4 Å²	104.4	84%	0.843	55%	0.551	S	S	*	*	S	Bend	trans	-105.3	-5.8	-166.6	-133	76.4	0	0	0	116.2
325	E	37.4	Very low	48.6	Very low	169 Å²	169	104.7 Å²	104.7	79%	0.79	57%	0.567	S	S	*	*			trans	-109.2	37.1	-164.8	-61.7	-164.5	135.3	0	0	115.6
326	K	34.8	Very low	46.5	Very low	179 Å²	179	113.7 Å²	113.7	78%	0.778	61%	0.608	S	S	*	*			trans	-133.4	67.6	178.3	-70.1	179.3	-173.2	159.2	0	113.9	E439	K326-E439 IonicContact NZ-OE1 2.82Å
327	S	31.1	Very low	44.5	Very low	111 Å²	111	119.4 Å²	119.4	78%	0.776	65%	0.646	S	S	*	*	P	Polyproline II helix	trans	-98.7	125	154.9	49.8	0	0	0	0	109.1
328	P	36.3	Very low	42.6	Very low	113 Å²	113	122.9 Å²	122.9	73%	0.734	67%	0.67	S	S	*	*	P	Polyproline II helix	trans	-75.2	136.5	174.3	30.6	-32.7	0	0	0	110.1
329	P	38.2	Very low	40.7	Very low	121 Å²	121	129.8 Å²	129.8	79%	0.786	70%	0.704	S	S	*	*	P	Polyproline II helix	trans	-83.6	128	170	32	-31.2	0	0	0	110.6
330	D	36.6	Very low	39.1	Very low	161 Å²	161	139.7 Å²	139.7	86%	0.861	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-72.9	142.5	178.3	-71.3	-50	0	0	0	113.3
331	Q	38.2	Very low	37.9	Very low	171 Å²	171	139.7 Å²	139.7	80%	0.799	75%	0.746	S	S	*	*			trans	-138.6	137.5	164.1	-68.7	179.8	-8.8	0	0	105.5
332	D	35.7	Very low	36.9	Very low	140 Å²	140	142 Å²	142	75%	0.749	75%	0.754	S	S	*	*			cis	-142.6	161.4	7.5	-83.2	-59.6	0	0	0	110.3
333	E	34.9	Very low	36.1	Very low	148 Å²	148	145.7 Å²	145.7	69%	0.692	77%	0.774	S	S	*	*				167.8	122.5	116.1	-82.7	-123.9	93.9	0	0	113.6
334	K	37.3	Very low	35.4	Very low	174 Å²	174	155.6 Å²	155.6	76%	0.757	80%	0.798	S	S	*	*			trans	6.6	123.4	146.9	-53.1	152.2	-162.5	145.8	0	117.7
335	S	36.7	Very low	35	Very low	111 Å²	111	157.4 Å²	157.4	78%	0.776	80%	0.795	S	S	*	*				175.6	143.1	98.4	46	0	0	0	0	116
336	Q	35.3	Very low	34.9	Very low	190 Å²	190	154.9 Å²	154.9	89%	0.888	80%	0.796	S	S	*	*			trans	58.1	124.5	156.1	-65.2	-177.2	6.1	0	0	121.3
337	P	32.1	Very low	34.8	Very low	124 Å²	124	154.6 Å²	154.6	81%	0.805	80%	0.798	S	S	*	*			trans	-101.8	154.5	173.2	38.6	-33	0	0	0	113.9
338	T	35.8	Very low	34.9	Very low	150 Å²	150	154.9 Å²	154.9	92%	0.92	80%	0.799	S	S	*	*			trans	-143.5	149.1	158.1	28.1	0	0	0	0	111.4
339	M	28.9	Very low	34.8	Very low	180 Å²	180	158.3 Å²	158.3	89%	0.887	81%	0.806	S	S	*	*			trans	-88.6	167.1	-175.4	-51.8	176	89.2	0	0	113.1
340	R	34.4	Very low	34.7	Very low	231 Å²	231	157.1 Å²	157.1	87%	0.872	80%	0.8	S	S	*	*			trans	130.3	146.6	150.2	-72.9	169.3	-179.7	-176	0.9	112.9
341	I	35.9	Very low	34.7	Very low	138 Å²	138	155 Å²	155	71%	0.708	79%	0.792	S	S	*	*			cis	-157.9	146.4	-17.6	-118	169.8	0	0	0	110
342	T	34.1	Very low	34.6	Very low	107 Å²	107	154.9 Å²	154.9	66%	0.656	79%	0.79	S	S	*	*			trans	10.9	137.5	164.4	70.5	0	0	0	0	125.1
343	N	33.6	Very low	34.6	Very low	136 Å²	136	156.4 Å²	156.4	73%	0.727	79%	0.792	S	S	*	*				42.8	140.5	127	-54.9	0.2	0	0	0	123.3
344	R	33.6	Very low	34.3	Very low	253 Å²	253	154.4 Å²	154.4	96%	0.955	79%	0.794	S	S	*	*				-162.2	158.2	111.7	-105.9	167	-166.6	-152.2	1.5	114.4
345	Y	33.3	Very low	34.4	Very low	198 Å²	198	151 Å²	151	78%	0.776	79%	0.79	S	S	*	*			trans	-104.6	160.3	-179	-84.6	-118.2	0	0	0	112.3
346	S	35.2	Very low	34.1	Very low	117 Å²	117	150.7 Å²	150.7	82%	0.818	79%	0.788	S	S	*	*			trans	179.3	114.3	147.5	-67.4	0	0	0	0	106.3
347	E	33.2	Very low	34.1	Very low	173 Å²	173	150.4 Å²	150.4	81%	0.808	78%	0.783	S	S	*	*				67.8	112.5	50.6	-66	-164.6	134	0	0	115.7
348	S	34.1	Very low	34.3	Very low	116 Å²	116	152.6 Å²	152.6	81%	0.811	78%	0.783	S	S	*	*			trans	174.2	122.1	135.1	-75.1	0	0	0	0	112.8
349	E	34.1	Very low	34.3	Very low	186 Å²	186	151.9 Å²	151.9	87%	0.869	78%	0.784	S	S	*	*				37	153.2	129.9	-61.8	-172.5	172.1	0	0	123.7
350	S	35.2	Very low	34.5	Very low	95 Å²	95	146.7 Å²	146.7	66%	0.664	78%	0.777	S	S	*	*			cis	-168.8	148.7	-20.6	63	0	0	0	0	113.7
351	V	37.6	Very low	34.6	Very low	116 Å²	116	146.8 Å²	146.8	70%	0.703	78%	0.777	S	S	*	*				70.4	123.7	129.5	167.7	0	0	0	0	123.6
352	K	34.9	Very low	34.5	Very low	170 Å²	170	146.6 Å²	146.6	74%	0.739	78%	0.783	S	S	*	*			trans	107.4	122.3	142.4	-86.5	166.6	-167.9	170.2	0	125.3
353	H	36.8	Very low	34.5	Very low	171 Å²	171	145 Å²	145	79%	0.792	79%	0.788	S	S	*	*			trans	82.3	159.7	139.2	-66.3	-46.1	0	0	0	123.7
354	S	28	Very low	34.5	Very low	106 Å²	106	147.8 Å²	147.8	74%	0.741	80%	0.796	S	S	*	*			trans	-157.3	-167.3	-166.9	64.6	0	0	0	0	108.1
355	P	40.3	Very low	34.2	Very low	104 Å²	104	140 Å²	140	68%	0.675	79%	0.786	S	S	*	*			cis	-138.8	-177.4	-10.2	42.1	-24.4	0	0	0	116.4
356	S	30.3	Very low	34.1	Very low	104 Å²	104	138.1 Å²	138.1	73%	0.727	79%	0.788	S	S	*	*			trans	83.7	158.9	143.9	80.8	0	0	0	0	122.9
357	K	35	Very low	34	Very low	183 Å²	183	141.2 Å²	141.2	80%	0.796	79%	0.787	S	S	*	*			trans	84	144.1	177.4	-64.1	-178.4	-179.5	177.5	0	117.4
358	Q	36.8	Very low	33.7	Very low	171 Å²	171	143.3 Å²	143.3	80%	0.799	79%	0.789	S	S	*	*			cis	-173.6	150.4	-27.2	-129.4	172.8	-16	0	0	110.5
359	S	34.9	Very low	33.6	Very low	135 Å²	135	143.6 Å²	143.6	94%	0.944	79%	0.786	S	S	*	*			trans	69.8	153.3	164.2	-155.1	0	0	0	0	119
360	G	33.4	Very low	33.4	Very low	71 Å²	71	140.1 Å²	140.1	73%	0.732	78%	0.778	S	S	*	*			trans	-179.2	-31.9	-179	0	0	0	0	0	121.2
361	R	35.9	Very low	33.2	Very low	232 Å²	232	141.6 Å²	141.6	88%	0.875	79%	0.788	S	S	*	*			trans	69.8	135.2	174.4	-108.2	-175.9	174.6	170.1	-2.7	119.9
362	T	34.5	Very low	32.9	Very low	135 Å²	135	139.7 Å²	139.7	83%	0.828	79%	0.792	S	S	*	*			trans	44.1	130	148.1	52.7	0	0	0	0	120.5
363	G	32.9	Very low	32.5	Very low	74 Å²	74	137.1 Å²	137.1	76%	0.763	80%	0.796	S	S	*	*			cis	161.2	170.9	6.6	0	0	0	0	0	108.7
364	Q	35.2	Very low	32.4	Very low	194 Å²	194	133.2 Å²	133.2	91%	0.907	79%	0.785	S	S	*	*			cis	-138.6	-177.5	4.3	-50.7	-176.6	32.6	0	0	109.6
365	A	26.8	Very low	32.6	Very low	88 Å²	88	137.2 Å²	137.2	73%	0.727	79%	0.789	S	S	*	*			trans	-156.9	151.2	176.6	0	0	0	0	0	113.3
366	L	31.8	Very low	32.3	Very low	159 Å²	159	138.2 Å²	138.2	83%	0.832	79%	0.794	S	S	*	*			trans	-158.1	141.5	163.6	-82.6	116.7	0	0	0	109.2
367	F	31.9	Very low	32.5	Very low	183 Å²	183	139 Å²	139	80%	0.803	80%	0.8	S	S	*	*			cis	-156.1	158.9	-21.2	-138.1	-91.7	0	0	0	109.2
368	Y	27.7	Very low	32.2	Very low	216 Å²	216	141.6 Å²	141.6	85%	0.847	80%	0.804	S	S	*	*			trans	-115.9	140.8	-178.7	-118.1	-90	0	0	0	111.2
369	V	32.3	Very low	32.1	Very low	123 Å²	123	139.4 Å²	139.4	75%	0.745	81%	0.805	S	S	*	*			trans	-148.2	90.2	170.2	-177.2	0	0	0	0	108.1
370	T	28.8	Very low	31.9	Very low	112 Å²	112	138.5 Å²	138.5	69%	0.687	80%	0.798	S	S	*	*				47.1	126.3	99.9	66.1	0	0	0	0	113.8
371	S	32.3	Very low	31.8	Very low	126 Å²	126	138.5 Å²	138.5	88%	0.881	80%	0.798	S	S	*	*			cis	-176.9	174.6	35.3	49.5	0	0	0	0	108
372	G	31.1	Very low	31.7	Very low	77 Å²	77	136.1 Å²	136.1	79%	0.794	80%	0.802	S	S	*	*			cis	-173.9	-179.4	1.1	0	0	0	0	0	111.5
373	S	25.9	Very low	31.4	Very low	116 Å²	116	139 Å²	139	81%	0.811	81%	0.806	S	S	*	*			trans	-121.1	-176.8	172	70.2	0	0	0	0	108.2
374	P	35.2	Very low	31.3	Very low	89 Å²	89	141.4 Å²	141.4	58%	0.578	81%	0.811	S	S	*	*			cis	-149.4	-176.2	19.8	46.5	-27.3	0	0	0	118
375	K	31.8	Very low	31.2	Very low	190 Å²	190	141.1 Å²	141.1	83%	0.826	81%	0.81	S	S	*	*			trans	62.6	150.9	155.2	-68	158.1	-164.7	174.2	0	116.7
376	T	33.5	Very low	31.1	Very low	124 Å²	124	142.2 Å²	142.2	76%	0.761	81%	0.812	S	S	*	*			cis	-155.8	144.3	-7.2	29.6	0	0	0	0	105.9
377	S	35	Very low	30.9	Very low	122 Å²	122	139.3 Å²	139.3	85%	0.853	80%	0.803	S	S	*	*				178.5	170.1	74.9	48	0	0	0	0	110.6
378	R	28.2	Very low	30.7	Very low	236 Å²	236	136.6 Å²	136.6	89%	0.891	81%	0.807	S	S	*	*			trans	-102.8	155.9	-178.8	-119.5	176.8	-172.4	177.1	1.7	109.9
379	P	35.4	Very low	30.7	Very low	125 Å²	125	128.3 Å²	128.3	81%	0.812	79%	0.787	S	S	*	*				-141.8	166.6	80.8	34.9	-16.7	0	0	0	117.2
380	S	29.8	Very low	30.5	Very low	116 Å²	116	129.4 Å²	129.4	81%	0.811	78%	0.782	S	S	*	*			trans	-52.8	148.8	-179.4	46.7	0	0	0	0	118.3
381	G	31.9	Very low	30.5	Very low	71 Å²	71	127.4 Å²	127.4	73%	0.732	78%	0.777	S	S	*	*			trans	-164	94	164.5	0	0	0	0	0	114.8
382	L	34	Very low	30.6	Very low	182 Å²	182	124.9 Å²	124.9	95%	0.953	76%	0.759	S	S	*	*			trans	64.3	161.6	163.6	-71.5	158	0	0	0	119.3
383	Q	28.6	Very low	31	Very low	195 Å²	195	127.1 Å²	127.1	91%	0.911	75%	0.747	S	S	*	*			trans	-107.7	143.4	-171.1	-63	162.6	-52.7	0	0	111.5
384	S	31	Very low	32.1	Very low	125 Å²	125	129 Å²	129	87%	0.874	74%	0.742	S	S	*	*			trans	-150.9	153.1	149.9	-166.8	0	0	0	0	109.8
385	Q	31.7	Very low	33.3	Very low	189 Å²	189	130.4 Å²	130.4	88%	0.883	74%	0.741	S	S	*	*			trans	-84.1	147.2	-163.5	-64.8	164.4	-9.2	0	0	113
386	S	24.7	Very low	34.8	Very low	110 Å²	110	121.5 Å²	121.5	77%	0.769	70%	0.703	S	S	*	*			trans	-106.7	122	-179.9	56.8	0	0	0	0	112.6
387	P	28.8	Very low	36.4	Very low	99 Å²	99	119.1 Å²	119.1	64%	0.643	69%	0.686	S	S	*	*			trans	-90.9	99.5	169.6	33.3	-29.7	0	0	0	110.7	G389	P387-G389 PolarHBondContact O-N 3.4Å
388	S	28.1	Very low	38.2	Very low	125 Å²	125	114.7 Å²	114.7	87%	0.874	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.5	16.7	-174.5	55.6	0	0	0	0	115.9
389	G	27.3	Very low	40.6	Very low	43 Å²	43	104.5 Å²	104.5	44%	0.443	62%	0.623	S	S	.	*	T	Hydrogen-bonded Turn	trans	-104.1	12.5	-173.3	0	0	0	0	0	116.4	P387	P387-G389 PolarHBondContact O-N 3.4Å
390	F	27.4	Very low	42.5	Very low	145 Å²	145	100 Å²	100	64%	0.636	59%	0.592	S	S	*	*	S	Bend	trans	-97.2	-35.8	-177.1	-89.2	-89.7	0	0	0	114.9	C392 K393	F390-C392 PolarHBondContact O-N 2.93Å; F390-K393 PolarHBondContact O-N 2.92Å
391	A	29.7	Very low	44.6	Very low	70 Å²	70	100.5 Å²	100.5	58%	0.579	58%	0.58	S	S	*	*	H	α-helix	trans	-58.6	-46.8	-168	0	0	0	0	0	114.4	K393 E394	A391-K393 PolarHBondContact O-N 3.43Å; A391-K393 VanDerWaalsContact O-N 3.12Å; A391-E394 PolarHBondContact O-N 2.05Å
392	C	32.7	Very low	46.6	Very low	74 Å²	74	98 Å²	98	50%	0.5	55%	0.55	S	S	.	*	H	α-helix	trans	-65.8	-18	-175.4	-59.9	0	0	0	0	114.3	F390 S396	F390-C392 PolarHBondContact O-N 2.93Å; C392-S396 WeakPolarHBondContact O-CB 3.14Å; C392-S396 PolarHBondContact O-N 2.95Å
393	K	40.7	Very low	48.7	Very low	124 Å²	124	89.5 Å²	89.5	54%	0.539	51%	0.506	S	S	.	.	H	α-helix	trans	-73.1	-46	177.7	-71.7	175.8	-179.2	164.2	0	111.3	F390 A391 E395 S396 D397	F390-K393 PolarHBondContact O-N 2.92Å; A391-K393 PolarHBondContact O-N 3.43Å; A391-K393 VanDerWaalsContact O-N 3.12Å; K393-E395 PolarHBondContact O-N 3.21Å; K393-S396 PolarHBondContact O-N 3.32Å; K393-S396 VanDerWaalsContact O-N 3.14Å; K393-S396 PolarHBondContact O-OG 2.99Å; K393-D397 PolarHBondContact O-N 3.28Å
394	E	49.3	Very low	51	Low	154 Å²	154	82.8 Å²	82.8	72%	0.72	47%	0.474	S	S	*	.	H	α-helix	trans	-62.3	-40.9	-178.7	-61.7	-167.5	157.3	0	0	112	A391 G398	A391-E394 PolarHBondContact O-N 2.05Å; E394-G398 PolarHBondContact O-N 3.05Å
395	E	60.1	Low	53.2	Low	120 Å²	120	78.8 Å²	78.8	56%	0.561	45%	0.445	S	S	*	.	H	α-helix	trans	-61.9	-43.6	173.4	-64.8	-172.9	153.6	0	0	112	K393 D397 G398 V399	K393-E395 PolarHBondContact O-N 3.21Å; E395-D397 PolarHBondContact O-N 3.31Å; E395-G398 PolarHBondContact O-N 3.33Å; E395-V399 PolarHBondContact O-N 2.85Å
396	S	62.7	Low	55.3	Low	2 Å²	2	69.8 Å²	69.8	1%	0.014	40%	0.403	C	S	.	.	H	α-helix	trans	-67.4	-36	-178.6	79.9	0	0	0	0	113.2	N322 C392 K393 I400	N322-S396 PolarHBondContact ND2-OG 3.27Å; C392-S396 WeakPolarHBondContact O-CB 3.14Å; C392-S396 PolarHBondContact O-N 2.95Å; K393-S396 PolarHBondContact O-N 3.32Å; K393-S396 VanDerWaalsContact O-N 3.14Å; K393-S396 PolarHBondContact O-OG 2.99Å; S396-I400 WeakPolarHBondContact O-CD1 3.39Å; S396-I400 VanDerWaalsContact O-CG1 3.27Å; S396-I400 WeakPolarHBondContact O-CG1 3.42Å; S396-I400 PolarHBondContact O-N 3.47Å
397	D	67	Low	57.8	Low	75 Å²	75	64.5 Å²	64.5	40%	0.401	37%	0.367	S	S	.	.	H	α-helix	trans	-75.7	-31.2	173.9	-78.1	-3.6	0	0	0	111.9	K393 E395 K401	K393-D397 PolarHBondContact O-N 3.28Å; E395-D397 PolarHBondContact O-N 3.31Å; D397-K401 WeakPolarHBondContact O-CD 3.41Å; D397-K401 VanDerWaalsContact O-CG 3.23Å; D397-K401 WeakPolarHBondContact O-CG 3.4Å; D397-K401 PolarHBondContact O-N 3Å
398	G	73.9	Confident	60.1	Low	29 Å²	29	64.7 Å²	64.7	30%	0.299	36%	0.362	S	S	.	.	H	α-helix	trans	-60.5	-55.3	173.4	0	0	0	0	0	112.1	E394 E395 I400 K401 S402	E394-G398 PolarHBondContact O-N 3.05Å; E395-G398 PolarHBondContact O-N 3.33Å; G398-I400 VanDerWaalsContact C-N 3.28Å; G398-I400 PolarHBondContact O-N 3.34Å; G398-K401 WeakPolarHBondContact O-CB 3.32Å; G398-K401 PolarHBondContact O-N 3.29Å; G398-K401 VanDerWaalsContact O-N 3.08Å; G398-S402 PolarHBondContact O-N 2.85Å; G398-S402 PolarHBondContact O-OG 3.03Å
399	V	77.9	Confident	62.3	Low	21 Å²	21	59.1 Å²	59.1	13%	0.127	32%	0.322	C	S	.	.	H	α-helix	trans	-61.4	-36.4	179.5	174.6	0	0	0	0	111.9	L311 K314 A315 L318 E395 L403	L311-V399 HydrophobicContact CD2-CG1 4.19Å; L311-V399 HydrophobicContact CD2-CG2 4.46Å; K314-V399 HydrophobicContact CB-CG1 4.39Å; A315-V399 HydrophobicContact CB-CG1 3.91Å; L318-V399 HydrophobicContact CD1-CB 4.13Å; L318-V399 HydrophobicContact CD1-CG2 3.7Å; E395-V399 PolarHBondContact O-N 2.85Å; V399-L403 HydrophobicContact CG1-CD1 4.24Å; V399-L403 WeakPolarHBondContact O-CB 3.4Å; V399-L403 WeakPolarHBondContact O-CG 3.45Å; V399-L403 PolarHBondContact O-N 3.45Å
400	I	74.6	Confident	64.4	Low	32 Å²	32	58.3 Å²	58.3	16%	0.164	31%	0.309	C	S	.	.	H	α-helix	trans	-64.1	-44.9	173.9	-70.1	168.9	0	0	0	111	W319 S396 G398 L403 K404 R443	W319-I400 HydrophobicContact CZ2-CD1 4.46Å; W319-I400 HydrophobicContact CZ2-CG1 4.12Å; S396-I400 WeakPolarHBondContact O-CD1 3.39Å; S396-I400 VanDerWaalsContact O-CG1 3.27Å; S396-I400 WeakPolarHBondContact O-CG1 3.42Å; S396-I400 PolarHBondContact O-N 3.47Å; G398-I400 VanDerWaalsContact C-N 3.28Å; G398-I400 PolarHBondContact O-N 3.34Å; I400-L403 PolarHBondContact O-N 3.49Å; I400-K404 HydrophobicContact CG2-CD 4.39Å; I400-K404 HydrophobicContact CG2-CG 4.38Å; I400-K404 WeakPolarHBondContact O-CG 3.29Å; I400-K404 PolarHBondContact O-N 3.12Å; I400-R443 VanDerWaalsContact CD1-NH1 3.32Å
401	K	74.6	Confident	66.6	Low	126.5 Å²	126.5	54.2 Å²	54.2	55%	0.55	29%	0.292	S	S	*	.	H	α-helix	trans	-60.5	-45.9	177.8	-73.1	160	-168.8	162.9	0	111.4	D397 G398 L403 K404 C405	D397-K401 WeakPolarHBondContact O-CD 3.41Å; D397-K401 VanDerWaalsContact O-CG 3.23Å; D397-K401 WeakPolarHBondContact O-CG 3.4Å; D397-K401 PolarHBondContact O-N 3Å; G398-K401 WeakPolarHBondContact O-CB 3.32Å; G398-K401 PolarHBondContact O-N 3.29Å; G398-K401 VanDerWaalsContact O-N 3.08Å; K401-L403 VanDerWaalsContact C-N 3.35Å; K401-L403 PolarHBondContact O-N 3.01Å; K401-K404 PolarHBondContact O-N 2.82Å; K401-K404 VanDerWaalsContact O-N 3.14Å; K401-C405 PolarHBondContact O-N 3.13Å; K401-C405 PolarHBondContact O-SG 3.07Å; K401-C405 VanDerWaalsContact O-SG 3.35Å
402	S	74.1	Confident	68.8	Low	16.5 Å²	16.5	50.8 Å²	50.8	12%	0.115	26%	0.264	C	S	.	.	H	α-helix	trans	-61.3	-43.3	175.9	-51.7	0	0	0	0	112.1	E278 G398 K404 C405 L406	E278-S402 WeakPolarHBondContact O-CA 3.4Å; G398-S402 PolarHBondContact O-N 2.85Å; G398-S402 PolarHBondContact O-OG 3.03Å; S402-K404 VanDerWaalsContact C-N 3.34Å; S402-K404 PolarHBondContact O-N 2.96Å; S402-C405 PolarHBondContact O-N 3.42Å; S402-L406 WeakPolarHBondContact O-CB 3.42Å; S402-L406 WeakPolarHBondContact O-CG 3.38Å; S402-L406 PolarHBondContact O-N 3.08Å
403	L	77.1	Confident	71.1	Confident	4 Å²	4	47.5 Å²	47.5	2%	0.021	24%	0.242	C	C	.	.	H	α-helix	trans	-62.3	-38.7	174.6	-76.3	173.4	0	0	0	112.8	L311 V312 A315 V399 I400 K401 L406 V407 L447	L311-L403 HydrophobicContact CB-CD2 3.86Å; L311-L403 HydrophobicContact CB-CG 4.21Å; V312-L403 HydrophobicContact CG2-CD2 3.83Å; A315-L403 HydrophobicContact CB-CD1 3.61Å; V399-L403 HydrophobicContact CG1-CD1 4.24Å; V399-L403 WeakPolarHBondContact O-CB 3.4Å; V399-L403 WeakPolarHBondContact O-CG 3.45Å; V399-L403 PolarHBondContact O-N 3.45Å; I400-L403 PolarHBondContact O-N 3.49Å; K401-L403 VanDerWaalsContact C-N 3.35Å; K401-L403 PolarHBondContact O-N 3.01Å; L403-L406 PolarHBondContact O-N 3.21Å; L403-V407 WeakPolarHBondContact O-CB 3.44Å; L403-V407 WeakPolarHBondContact O-CG2 3.49Å; L403-V407 PolarHBondContact O-N 3.45Å; L403-L447 HydrophobicContact CB-CD1 4.47Å
404	K	78	Confident	72.9	Confident	54 Å²	54	43.9 Å²	43.9	24%	0.235	23%	0.227	C	C	.	.	H	α-helix	trans	-68.4	-37.6	174.1	-67.6	-163.3	174.9	-156.6	0	112.2	I400 K401 S402 V407 N408 E450	I400-K404 HydrophobicContact CG2-CD 4.39Å; I400-K404 HydrophobicContact CG2-CG 4.38Å; I400-K404 WeakPolarHBondContact O-CG 3.29Å; I400-K404 PolarHBondContact O-N 3.12Å; K401-K404 PolarHBondContact O-N 2.82Å; K401-K404 VanDerWaalsContact O-N 3.14Å; S402-K404 VanDerWaalsContact C-N 3.34Å; S402-K404 PolarHBondContact O-N 2.96Å; K404-V407 PolarHBondContact O-N 2.86Å; K404-N408 PolarHBondContact O-N 3.39Å; K404-N408 VanDerWaalsContact O-N 3.07Å; K404-N408 PolarHBondContact O-ND2 3.1Å; K404-E450 WeakPolarHBondContact CD-OE2 3.31Å; K404-E450 WeakPolarHBondContact CE-OE1 3.39Å; K404-E450 WeakPolarHBondContact CE-OE2 3.29Å; K404-E450 VanDerWaalsContact CG-OE2 3.27Å; K404-E450 WeakPolarHBondContact CG-OE2 3.43Å; K404-E450 IonicContact NZ-OE1 3.23Å; K404-E450 PolarHBondContact NZ-OE1 3.37Å; K404-E450 IonicContact NZ-OE2 2.79Å; K404-E450 PolarHBondContact NZ-OE2 2.92Å
405	C	76.2	Confident	74.2	Confident	41 Å²	41	39.7 Å²	39.7	28%	0.277	21%	0.205	S	C	.	.	H	α-helix	trans	-62.5	-43.4	172.7	-67.5	0	0	0	0	111.6	K401 S402 N408	K401-C405 PolarHBondContact O-N 3.13Å; K401-C405 PolarHBondContact O-SG 3.07Å; K401-C405 VanDerWaalsContact O-SG 3.35Å; S402-C405 PolarHBondContact O-N 3.42Å; C405-N408 PolarHBondContact O-N 3.33Å
406	L	77.1	Confident	75.1	Confident	0 Å²	0	34 Å²	34	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-63.3	-43.7	174.6	-75.3	161.9	0	0	0	112.6	L277 L307 I308 L311 S402 L403 N408 N409 C412	L277-L406 WeakPolarHBondContact O-CD2 3.33Å; L307-L406 HydrophobicContact CD2-CD1 3.93Å; L307-L406 HydrophobicContact CD2-CD2 4.47Å; I308-L406 HydrophobicContact CG1-CD1 4.22Å; I308-L406 HydrophobicContact CG1-CD2 4.19Å; L311-L406 HydrophobicContact CD1-CD1 3.53Å; S402-L406 WeakPolarHBondContact O-CB 3.42Å; S402-L406 WeakPolarHBondContact O-CG 3.38Å; S402-L406 PolarHBondContact O-N 3.08Å; L403-L406 PolarHBondContact O-N 3.21Å; L406-N408 VanDerWaalsContact C-N 3.26Å; L406-N408 PolarHBondContact O-N 3.25Å; L406-N409 WeakPolarHBondContact O-CB 3.36Å; L406-N409 PolarHBondContact O-N 3.12Å; L406-C412 VanDerWaalsContact O-CB 3.29Å; L406-C412 WeakPolarHBondContact O-CB 3.39Å; L406-C412 PolarHBondContact O-SG 2.62Å
407	V	77.1	Confident	75.9	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-64	-27.2	177.1	163.6	0	0	0	0	112.7	L403 K404 N409 L413 V416 L447 E450 I451 V454	L403-V407 WeakPolarHBondContact O-CB 3.44Å; L403-V407 WeakPolarHBondContact O-CG2 3.49Å; L403-V407 PolarHBondContact O-N 3.45Å; K404-V407 PolarHBondContact O-N 2.86Å; V407-N409 PolarHBondContact O-N 3.37Å; V407-L413 HydrophobicContact CG1-CD2 4.11Å; V407-L413 VanDerWaalsContact O-CD2 3.28Å; V407-L413 WeakPolarHBondContact O-CD2 3.4Å; V407-V416 HydrophobicContact CG2-CG1 4.24Å; V407-V416 HydrophobicContact CG2-CG2 4.39Å; V407-L447 HydrophobicContact CG2-CD1 3.81Å; V407-E450 HydrophobicContact CG1-CB 4.04Å; V407-I451 HydrophobicContact CB-CG1 4.39Å; V407-I451 HydrophobicContact CG1-CB 4.44Å; V407-I451 HydrophobicContact CG1-CG1 3.66Å; V407-I451 HydrophobicContact CG2-CD1 4.19Å; V407-I451 HydrophobicContact CG2-CG1 3.75Å; V407-V454 HydrophobicContact CG1-CG2 4.47Å
408	N	77.2	Confident	76.5	Confident	103 Å²	103	32.6 Å²	32.6	55%	0.551	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69	-10.3	172.7	-81.9	-77.6	0	0	0	113.9	K404 C405 L406	K404-N408 PolarHBondContact O-N 3.39Å; K404-N408 VanDerWaalsContact O-N 3.07Å; K404-N408 PolarHBondContact O-ND2 3.1Å; C405-N408 PolarHBondContact O-N 3.33Å; L406-N408 VanDerWaalsContact C-N 3.26Å; L406-N408 PolarHBondContact O-N 3.25Å
409	N	74.4	Confident	76.6	Confident	7 Å²	7	31.4 Å²	31.4	4%	0.037	16%	0.158	C	C	.	.	S	Bend	trans	-96.5	122.2	171.7	-131.9	-16.2	0	0	0	111.6	G280 A281 L406 V407 E411 C412	G280-N409 WeakPolarHBondContact O-CB 3.35Å; G280-N409 PolarHBondContact O-ND2 2.79Å; A281-N409 PolarHBondContact O-ND2 3.17Å; L406-N409 WeakPolarHBondContact O-CB 3.36Å; L406-N409 PolarHBondContact O-N 3.12Å; V407-N409 PolarHBondContact O-N 3.37Å; N409-E411 VanDerWaalsContact C-N 3.26Å; N409-E411 PolarHBondContact O-N 3.17Å; N409-E411 VanDerWaalsContact O-N 3.14Å; N409-E411 WeakPolarHBondContact OD1-CB 3.42Å; N409-E411 WeakPolarHBondContact OD1-CG 3.48Å; N409-E411 PolarHBondContact OD1-N 3.48Å; N409-C412 HydrophobicContact CB-CB 4.37Å; N409-C412 WeakPolarHBondContact O-CB 3.2Å; N409-C412 PolarHBondContact O-N 3Å; N409-C412 VanDerWaalsContact O-N 3.12Å
410	P	71.3	Confident	76.7	Confident	26.5 Å²	26.5	30.6 Å²	30.6	17%	0.172	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-30.4	179.4	25	-33.9	0	0	0	113.2	C412 L413 E458	P410-C412 PolarHBondContact O-N 3.16Å; P410-L413 PolarHBondContact O-N 3.5Å; P410-E458 HydrophobicContact CB-CG 4.39Å; P410-E458 VanDerWaalsContact CB-OE1 3.25Å; P410-E458 WeakPolarHBondContact CB-OE1 3.49Å; P410-E458 WeakPolarHBondContact CB-OE2 3.26Å
411	E	74	Confident	76.7	Confident	58 Å²	58	30.5 Å²	30.5	27%	0.271	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-27.8	176.6	-63.7	173.7	-178.9	0	0	112.6	I283 G284 N409 Y415	I283-E411 PolarHBondContact N-OE2 2.95Å; G284-E411 WeakPolarHBondContact CA-OE1 3.4Å; G284-E411 PolarHBondContact N-OE1 3.31Å; G284-E411 PolarHBondContact N-OE2 3.14Å; G284-E411 VanDerWaalsContact N-OE2 3.15Å; N409-E411 VanDerWaalsContact C-N 3.26Å; N409-E411 PolarHBondContact O-N 3.17Å; N409-E411 VanDerWaalsContact O-N 3.14Å; N409-E411 WeakPolarHBondContact OD1-CB 3.42Å; N409-E411 WeakPolarHBondContact OD1-CG 3.48Å; N409-E411 PolarHBondContact OD1-N 3.48Å; E411-Y415 VanDerWaalsContact O-CD2 3.3Å; E411-Y415 WeakPolarHBondContact O-CD2 3.27Å; E411-Y415 VanDerWaalsContact O-CE2 3.29Å; E411-Y415 WeakPolarHBondContact O-CE2 3.4Å
412	C	75.9	Confident	76.7	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-23.6	-176.5	-62.5	0	0	0	0	113.8	Q304 I308 L406 N409 P410 Q414 Y415 V416	Q304-C412 PolarHBondContact NE2-SG 3.14Å; I308-C412 HydrophobicContact CD1-CB 4.02Å; L406-C412 VanDerWaalsContact O-CB 3.29Å; L406-C412 WeakPolarHBondContact O-CB 3.39Å; L406-C412 PolarHBondContact O-SG 2.62Å; N409-C412 HydrophobicContact CB-CB 4.37Å; N409-C412 WeakPolarHBondContact O-CB 3.2Å; N409-C412 PolarHBondContact O-N 3Å; N409-C412 VanDerWaalsContact O-N 3.12Å; P410-C412 PolarHBondContact O-N 3.16Å; C412-Q414 PolarHBondContact O-N 3.03Å; C412-Y415 PolarHBondContact O-N 3.19Å; C412-V416 HydrophobicContact CB-CG2 4.48Å; C412-V416 WeakPolarHBondContact O-CG2 3.42Å; C412-V416 PolarHBondContact O-N 3.25Å
413	L	80.3	Confident	76.4	Confident	4 Å²	4	30.6 Å²	30.6	2%	0.021	15%	0.154	C	C	.	.	H	α-helix	trans	-55.5	-47.9	-165	-66.4	177	0	0	0	113.4	V407 P410 Y415 V416 A417 I451 V454 A455 L483	V407-L413 HydrophobicContact CG1-CD2 4.11Å; V407-L413 VanDerWaalsContact O-CD2 3.28Å; V407-L413 WeakPolarHBondContact O-CD2 3.4Å; P410-L413 PolarHBondContact O-N 3.5Å; L413-Y415 PolarHBondContact O-N 3.02Å; L413-V416 PolarHBondContact O-N 3.03Å; L413-A417 PolarHBondContact O-N 3.45Å; L413-I451 HydrophobicContact CD2-CB 4.36Å; L413-I451 HydrophobicContact CD2-CG1 4.11Å; L413-I451 HydrophobicContact CD2-CG2 4.23Å; L413-V454 HydrophobicContact CD1-CB 4.42Å; L413-V454 HydrophobicContact CD1-CG1 4.12Å; L413-V454 HydrophobicContact CD2-CB 4.4Å; L413-V454 HydrophobicContact CD2-CG1 4.44Å; L413-A455 HydrophobicContact CD1-CB 4.14Å; L413-L483 HydrophobicContact CB-CD1 4.15Å; L413-L483 HydrophobicContact CB-CD2 3.96Å; L413-L483 HydrophobicContact CD1-CD2 4.05Å
414	Q	77.4	Confident	76	Confident	48.5 Å²	48.5	33.1 Å²	33.1	23%	0.227	17%	0.165	C	C	.	.	H	α-helix	trans	-63.6	-41.4	178.6	-174.1	62	39.8	0	0	111.5	C412 V416 A417 D418 L483 S486	C412-Q414 PolarHBondContact O-N 3.03Å; Q414-V416 VanDerWaalsContact C-N 3.35Å; Q414-V416 PolarHBondContact O-N 3.07Å; Q414-A417 PolarHBondContact O-N 3.26Å; Q414-D418 WeakPolarHBondContact CG-OD2 3.43Å; Q414-D418 VanDerWaalsContact NE2-CG 3.28Å; Q414-D418 PolarHBondContact NE2-OD1 2.87Å; Q414-D418 PolarHBondContact NE2-OD2 3.27Å; Q414-D418 WeakPolarHBondContact O-CB 3.41Å; Q414-D418 VanDerWaalsContact O-CG 3.25Å; Q414-D418 PolarHBondContact O-N 3.13Å; Q414-L483 VanDerWaalsContact OE1-CA 3.24Å; Q414-L483 VanDerWaalsContact OE1-N 3.16Å; Q414-S486 PolarHBondContact NE2-OG 3.16Å
415	Y	77.1	Confident	75.2	Confident	65 Å²	65	32.7 Å²	32.7	26%	0.255	18%	0.176	S	C	.	.	H	α-helix	trans	-69.6	-31.6	-179.8	-55.6	-53.3	0	0	0	112.7	F301 E411 C412 L413 A419	F301-Y415 HydrophobicContact CE2-CE2 4.19Å; F301-Y415 AromaticContact CE2-CZ 3.86Å; F301-Y415 WeakPolarHBondContact CE2-OH 3.43Å; F301-Y415 HydrophobicContact CZ-CE1 4.36Å; F301-Y415 AromaticContact CZ-CZ 3.88Å; F301-Y415 WeakPolarHBondContact CZ-OH 3.18Å; E411-Y415 VanDerWaalsContact O-CD2 3.3Å; E411-Y415 WeakPolarHBondContact O-CD2 3.27Å; E411-Y415 VanDerWaalsContact O-CE2 3.29Å; E411-Y415 WeakPolarHBondContact O-CE2 3.4Å; C412-Y415 PolarHBondContact O-N 3.19Å; L413-Y415 PolarHBondContact O-N 3.02Å; Y415-A419 WeakPolarHBondContact O-CB 3.45Å; Y415-A419 PolarHBondContact O-N 2.8Å
416	V	80.1	Confident	74.6	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-68.1	-45.4	171.4	176.8	0	0	0	0	110.6	I308 V407 C412 L413 Q414 D418 A419 L420 I451	I308-V416 HydrophobicContact CG2-CG2 3.88Å; V407-V416 HydrophobicContact CG2-CG1 4.24Å; V407-V416 HydrophobicContact CG2-CG2 4.39Å; C412-V416 HydrophobicContact CB-CG2 4.48Å; C412-V416 WeakPolarHBondContact O-CG2 3.42Å; C412-V416 PolarHBondContact O-N 3.25Å; L413-V416 PolarHBondContact O-N 3.03Å; Q414-V416 VanDerWaalsContact C-N 3.35Å; Q414-V416 PolarHBondContact O-N 3.07Å; V416-D418 PolarHBondContact O-N 2.9Å; V416-A419 PolarHBondContact O-N 3.05Å; V416-L420 HydrophobicContact CG1-CD1 4.27Å; V416-L420 WeakPolarHBondContact O-CG 3.36Å; V416-L420 PolarHBondContact O-N 3.28Å; V416-I451 HydrophobicContact CG1-CD1 3.91Å
417	A	78.6	Confident	73.9	Confident	5 Å²	5	34.2 Å²	34.2	4%	0.041	18%	0.182	C	C	.	.	H	α-helix	trans	-62.4	-43.6	176.5	0	0	0	0	0	112.4	L413 Q414 A419 L420 L421 L483	L413-A417 PolarHBondContact O-N 3.45Å; Q414-A417 PolarHBondContact O-N 3.26Å; A417-A419 VanDerWaalsContact C-N 3.34Å; A417-A419 PolarHBondContact O-N 2.96Å; A417-L420 PolarHBondContact O-N 2.87Å; A417-L421 PolarHBondContact O-N 3.15Å; A417-L421 VanDerWaalsContact O-N 3.13Å; A417-L483 HydrophobicContact CB-CD1 3.81Å
418	D	78.8	Confident	73.1	Confident	44.5 Å²	44.5	34.9 Å²	34.9	24%	0.238	19%	0.185	C	C	.	.	H	α-helix	trans	-69.1	-29.9	177.2	-68.8	-19.3	0	0	0	112.4	Q414 V416 Q422 S486	Q414-D418 WeakPolarHBondContact CG-OD2 3.43Å; Q414-D418 VanDerWaalsContact NE2-CG 3.28Å; Q414-D418 PolarHBondContact NE2-OD1 2.87Å; Q414-D418 PolarHBondContact NE2-OD2 3.27Å; Q414-D418 WeakPolarHBondContact O-CB 3.41Å; Q414-D418 VanDerWaalsContact O-CG 3.25Å; Q414-D418 PolarHBondContact O-N 3.13Å; V416-D418 PolarHBondContact O-N 2.9Å; D418-Q422 WeakPolarHBondContact O-CG 3.29Å; D418-Q422 PolarHBondContact O-N 3.29Å; D418-Q422 VanDerWaalsContact O-N 3.1Å; D418-Q422 PolarHBondContact O-NE2 3.29Å; D418-S486 WeakPolarHBondContact OD1-CB 3.39Å; D418-S486 PolarHBondContact OD1-OG 2.92Å
419	A	77.6	Confident	72.1	Confident	3 Å²	3	36.8 Å²	36.8	3%	0.025	19%	0.194	C	C	.	.	H	α-helix	trans	-71.3	-40.2	173	0	0	0	0	0	111.9	I308 K309 V312 Y415 V416 A417 L421 Q422 E423	I308-A419 HydrophobicContact CG2-CB 4.22Å; K309-A419 HydrophobicContact CG-CB 4.34Å; V312-A419 HydrophobicContact CB-CB 4.3Å; V312-A419 HydrophobicContact CG1-CB 4.32Å; V312-A419 HydrophobicContact CG2-CB 4.16Å; Y415-A419 WeakPolarHBondContact O-CB 3.45Å; Y415-A419 PolarHBondContact O-N 2.8Å; V416-A419 PolarHBondContact O-N 3.05Å; A417-A419 VanDerWaalsContact C-N 3.34Å; A417-A419 PolarHBondContact O-N 2.96Å; A419-L421 VanDerWaalsContact C-N 3.28Å; A419-L421 PolarHBondContact O-N 3.05Å; A419-Q422 PolarHBondContact O-N 3.35Å; A419-Q422 VanDerWaalsContact O-N 3.16Å; A419-E423 PolarHBondContact O-N 3.24Å; A419-E423 VanDerWaalsContact O-N 3.07Å
420	L	78.5	Confident	71.1	Confident	5 Å²	5	38.2 Å²	38.2	3%	0.026	20%	0.2	C	C	.	.	H	α-helix	trans	-62.3	-34.9	173.4	-71.6	168.1	0	0	0	112.2	V312 V416 A417 I427 L447 L448 F490	V312-L420 HydrophobicContact CG1-CD2 3.93Å; V312-L420 HydrophobicContact CG1-CG 4.4Å; V416-L420 HydrophobicContact CG1-CD1 4.27Å; V416-L420 WeakPolarHBondContact O-CG 3.36Å; V416-L420 PolarHBondContact O-N 3.28Å; A417-L420 PolarHBondContact O-N 2.87Å; L420-I427 HydrophobicContact CD2-CD1 4.49Å; L420-L447 HydrophobicContact CD1-CD2 4.27Å; L420-L448 HydrophobicContact CD1-CD2 4.43Å; L420-F490 HydrophobicContact CB-CD2 4.23Å; L420-F490 HydrophobicContact CB-CE2 4.03Å; L420-F490 HydrophobicContact CB-CZ 4.42Å; L420-F490 WeakPolarHBondContact O-CE2 3.42Å
421	L	76	Confident	70.3	Confident	29 Å²	29	37.6 Å²	37.6	15%	0.152	20%	0.197	C	C	.	.	H	α-helix	trans	-67.3	-43.8	170.3	-74.2	168.3	0	0	0	112.2	A417 A419 E423 E424 R489 F490 L493	A417-L421 PolarHBondContact O-N 3.15Å; A417-L421 VanDerWaalsContact O-N 3.13Å; A419-L421 VanDerWaalsContact C-N 3.28Å; A419-L421 PolarHBondContact O-N 3.05Å; L421-E423 VanDerWaalsContact C-N 3.26Å; L421-E423 PolarHBondContact O-N 2.97Å; L421-E424 VanDerWaalsContact O-CB 3.32Å; L421-E424 WeakPolarHBondContact O-CB 3.37Å; L421-E424 VanDerWaalsContact O-CG 3.29Å; L421-E424 WeakPolarHBondContact O-CG 3.34Å; L421-E424 PolarHBondContact O-N 3.22Å; L421-E424 VanDerWaalsContact O-N 3.15Å; L421-R489 HydrophobicContact CD2-CB 4.19Å; L421-F490 HydrophobicContact CD2-CB 3.81Å; L421-F490 HydrophobicContact CD2-CD2 4.29Å; L421-F490 HydrophobicContact CG-CB 4.35Å; L421-L493 HydrophobicContact CD2-CD1 3.75Å
422	Q	73.2	Confident	69.3	Low	112 Å²	112	40.6 Å²	40.6	52%	0.523	21%	0.211	S	C	.	.	H	α-helix	trans	-65.2	-27.4	179.1	-78.4	160.5	77.2	0	0	113.4	D418 A419 E424	D418-Q422 WeakPolarHBondContact O-CG 3.29Å; D418-Q422 PolarHBondContact O-N 3.29Å; D418-Q422 VanDerWaalsContact O-N 3.1Å; D418-Q422 PolarHBondContact O-NE2 3.29Å; A419-Q422 PolarHBondContact O-N 3.35Å; A419-Q422 VanDerWaalsContact O-N 3.16Å; Q422-E424 VanDerWaalsContact C-N 3.32Å; Q422-E424 PolarHBondContact O-N 3.33Å
423	E	69.4	Low	68	Low	33.5 Å²	33.5	46.8 Å²	46.8	16%	0.157	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.2	11.4	175.7	-72.2	-64.4	149.2	0	0	114.5	V312 H313 I316 A419 L421 G425 N426 I427	V312-E423 HydrophobicContact CG1-CG 4.27Å; H313-E423 IonicContact CE1-OE1 2.86Å; H313-E423 IonicContact CE1-OE2 2.88Å; H313-E423 IonicContact CG-OE1 3.06Å; H313-E423 IonicContact ND1-OE1 2.64Å; H313-E423 PolarHBondContact ND1-OE1 3.07Å; H313-E423 IonicContact ND1-OE2 2.64Å; H313-E423 PolarHBondContact ND1-OE2 3.16Å; H313-E423 VanDerWaalsContact ND1-OE2 3.14Å; I316-E423 HydrophobicContact CD1-CB 3.61Å; I316-E423 HydrophobicContact CD1-CG 4.01Å; A419-E423 PolarHBondContact O-N 3.24Å; A419-E423 VanDerWaalsContact O-N 3.07Å; L421-E423 VanDerWaalsContact C-N 3.26Å; L421-E423 PolarHBondContact O-N 2.97Å; E423-G425 VanDerWaalsContact C-N 3.27Å; E423-G425 PolarHBondContact O-N 3.02Å; E423-G425 VanDerWaalsContact O-N 3.08Å; E423-N426 PolarHBondContact O-N 3.23Å; E423-N426 WeakPolarHBondContact OE2-CB 3.41Å; E423-N426 PolarHBondContact OE2-ND2 2.93Å; E423-I427 HydrophobicContact CB-CD1 4.34Å; E423-I427 PolarHBondContact O-N 2.92Å
424	E	66.7	Low	66.6	Low	56.5 Å²	56.5	52.9 Å²	52.9	26%	0.264	27%	0.272	S	S	.	.	H	α-helix	trans	-34.7	-55.4	176.1	-105.3	-175.9	-115.6	0	0	113.2	L421 Q422 N426 I427 L428 L493 K497	L421-E424 VanDerWaalsContact O-CB 3.32Å; L421-E424 WeakPolarHBondContact O-CB 3.37Å; L421-E424 VanDerWaalsContact O-CG 3.29Å; L421-E424 WeakPolarHBondContact O-CG 3.34Å; L421-E424 PolarHBondContact O-N 3.22Å; L421-E424 VanDerWaalsContact O-N 3.15Å; Q422-E424 VanDerWaalsContact C-N 3.32Å; Q422-E424 PolarHBondContact O-N 3.33Å; E424-N426 PolarHBondContact O-N 2.93Å; E424-I427 PolarHBondContact O-N 3.37Å; E424-L428 HydrophobicContact CB-CD1 4.38Å; E424-L428 HydrophobicContact CG-CD1 4.41Å; E424-L428 VanDerWaalsContact O-CB 3.31Å; E424-L428 WeakPolarHBondContact O-CB 3.4Å; E424-L428 WeakPolarHBondContact O-CD1 3.4Å; E424-L428 WeakPolarHBondContact O-CG 3.38Å; E424-L428 PolarHBondContact O-N 2.91Å; E424-L493 VanDerWaalsContact CD-CD1 3.42Å; E424-L493 HydrophobicContact CG-CD1 3.83Å; E424-L493 WeakPolarHBondContact OE1-CD1 3.35Å; E424-L493 VanDerWaalsContact OE2-CD2 3.29Å; E424-L493 WeakPolarHBondContact OE2-CD2 3.31Å; E424-K497 IonicContact OE2-NZ 3.22Å; E424-K497 PolarHBondContact OE2-NZ 3.1Å
425	G	61.8	Low	65.3	Low	45.5 Å²	45.5	54.2 Å²	54.2	47%	0.469	29%	0.291	S	S	.	.	H	α-helix	trans	-61.3	-40.1	-175.2	0	0	0	0	0	113.7	E423 L429	E423-G425 VanDerWaalsContact C-N 3.27Å; E423-G425 PolarHBondContact O-N 3.02Å; E423-G425 VanDerWaalsContact O-N 3.08Å; G425-L429 WeakPolarHBondContact O-CB 3.34Å; G425-L429 PolarHBondContact O-N 3.24Å; G425-L429 VanDerWaalsContact O-N 3.12Å
426	N	63.5	Low	64	Low	65.5 Å²	65.5	56.8 Å²	56.8	35%	0.35	31%	0.309	S	S	.	.	H	α-helix	trans	-78.4	-21.5	-175.9	-78.5	-41	0	0	0	113.8	I316 E423 E424 K430	I316-N426 HydrophobicContact CG2-CB 3.9Å; E423-N426 PolarHBondContact O-N 3.23Å; E423-N426 WeakPolarHBondContact OE2-CB 3.41Å; E423-N426 PolarHBondContact OE2-ND2 2.93Å; E424-N426 PolarHBondContact O-N 2.93Å; N426-K430 WeakPolarHBondContact O-CD 3.17Å; N426-K430 WeakPolarHBondContact O-CE 3.39Å; N426-K430 PolarHBondContact O-NZ 3.13Å
427	I	63.1	Low	62.9	Low	6.5 Å²	6.5	58.8 Å²	58.8	3%	0.033	32%	0.32	C	S	.	.	H	α-helix	trans	-81	-49.4	172.4	-61.9	166.9	0	0	0	109.1	I316 L420 E423 E424 K430 S431 I444 F490 L494	I316-I427 HydrophobicContact CD1-CD1 3.81Å; I316-I427 HydrophobicContact CD1-CG1 3.72Å; I316-I427 HydrophobicContact CG1-CG1 4.16Å; I316-I427 HydrophobicContact CG2-CG1 4.22Å; L420-I427 HydrophobicContact CD2-CD1 4.49Å; E423-I427 HydrophobicContact CB-CD1 4.34Å; E423-I427 PolarHBondContact O-N 2.92Å; E424-I427 PolarHBondContact O-N 3.37Å; I427-K430 PolarHBondContact O-N 3.06Å; I427-S431 PolarHBondContact O-N 3.05Å; I427-I444 HydrophobicContact CG2-CD1 4.38Å; I427-F490 HydrophobicContact CD1-CE2 3.77Å; I427-F490 HydrophobicContact CD1-CZ 3.97Å; I427-L494 HydrophobicContact CG2-CD2 4.04Å
428	L	60.4	Low	62.3	Low	15.5 Å²	15.5	59.9 Å²	59.9	8%	0.081	33%	0.327	C	S	.	.	H	α-helix	trans	-70.6	-38.1	-172.3	-66.2	170.2	0	0	0	113.4	E424 K430 S431 L494 K497	E424-L428 HydrophobicContact CB-CD1 4.38Å; E424-L428 HydrophobicContact CG-CD1 4.41Å; E424-L428 VanDerWaalsContact O-CB 3.31Å; E424-L428 WeakPolarHBondContact O-CB 3.4Å; E424-L428 WeakPolarHBondContact O-CD1 3.4Å; E424-L428 WeakPolarHBondContact O-CG 3.38Å; E424-L428 PolarHBondContact O-N 2.91Å; L428-K430 PolarHBondContact O-N 3.14Å; L428-K430 VanDerWaalsContact O-N 3.1Å; L428-S431 PolarHBondContact O-N 3.37Å; L428-S431 PolarHBondContact O-OG 2.85Å; L428-L494 HydrophobicContact CD2-CD2 4.04Å; L428-K497 HydrophobicContact CD1-CB 3.79Å; L428-K497 HydrophobicContact CD1-CD 3.45Å; L428-K497 VanDerWaalsContact CD1-CD 3.45Å; L428-K497 HydrophobicContact CD1-CG 4.29Å; L428-K497 HydrophobicContact CD2-CB 3.72Å; L428-K497 HydrophobicContact CG-CB 4.24Å
429	L	56.3	Low	61.8	Low	141.5 Å²	141.5	63.1 Å²	63.1	74%	0.741	34%	0.341	S	S	*	.	H	α-helix	trans	-56.9	-28.3	177.6	-120.4	80	0	0	0	113.5	G425	G425-L429 WeakPolarHBondContact O-CB 3.34Å; G425-L429 PolarHBondContact O-N 3.24Å; G425-L429 VanDerWaalsContact O-N 3.12Å
430	K	52.8	Low	61.5	Low	37.5 Å²	37.5	63.7 Å²	63.7	16%	0.163	34%	0.343	C	S	.	.	H	α-helix	trans	-94.7	-36.8	-175.8	-59.5	172.5	-166.6	141.5	0	112.3	I316 K320 N426 I427 L428 H432 H433 N437	I316-K430 PolarHBondContact O-NZ 3.15Å; K320-K430 HydrophobicContact CB-CD 4.39Å; K320-K430 HydrophobicContact CG-CD 4.24Å; N426-K430 WeakPolarHBondContact O-CD 3.17Å; N426-K430 WeakPolarHBondContact O-CE 3.39Å; N426-K430 PolarHBondContact O-NZ 3.13Å; I427-K430 PolarHBondContact O-N 3.06Å; L428-K430 PolarHBondContact O-N 3.14Å; L428-K430 VanDerWaalsContact O-N 3.1Å; K430-H432 PolarHBondContact O-N 3.21Å; K430-H433 PolarHBondContact O-N 3.15Å; K430-H433 VanDerWaalsContact O-N 3.12Å; K430-N437 PolarHBondContact O-ND2 2.97Å
431	S	55	Low	61.4	Low	14.5 Å²	14.5	63.8 Å²	63.8	10%	0.101	34%	0.344	C	S	.	.	H	α-helix	trans	-60.7	-17.1	-178.8	72.7	0	0	0	0	114	I427 L428 H433 G499	I427-S431 PolarHBondContact O-N 3.05Å; L428-S431 PolarHBondContact O-N 3.37Å; L428-S431 PolarHBondContact O-OG 2.85Å; S431-H433 VanDerWaalsContact C-N 3.31Å; S431-H433 PolarHBondContact O-N 3.46Å; S431-G499 VanDerWaalsContact O-CA 3.28Å; S431-G499 WeakPolarHBondContact O-CA 3.3Å; S431-G499 PolarHBondContact O-N 3.15Å
432	H	52.8	Low	61.4	Low	120 Å²	120	66 Å²	66	56%	0.556	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-14	177.9	-97.1	-72.7	0	0	0	115.7	K430 K497	K430-H432 PolarHBondContact O-N 3.21Å; H432-K497 PolarHBondContact CD2-O 2.82Å; H432-K497 PolarHBondContact NE2-O 3.2Å; H432-K497 VanDerWaalsContact NE2-O 3.09Å
433	H	49	Very low	61.5	Low	131 Å²	131	63.5 Å²	63.5	61%	0.606	34%	0.339	S	S	*	.	S	Bend	trans	-121.9	121.1	-175.4	-75.5	-60	0	0	0	114.5	K430 S431 N437	K430-H433 PolarHBondContact O-N 3.15Å; K430-H433 VanDerWaalsContact O-N 3.12Å; S431-H433 VanDerWaalsContact C-N 3.31Å; S431-H433 PolarHBondContact O-N 3.46Å; H433-N437 PolarHBondContact O-ND2 3.33Å
434	N	49.9	Very low	62.1	Low	130.5 Å²	130.5	62.1 Å²	62.1	70%	0.698	33%	0.332	S	S	*	.			trans	60.1	163.1	160.7	-61.4	-3.3	0	0	0	118.3	D436	N434-D436 VanDerWaalsContact C-N 3.31Å; N434-D436 WeakPolarHBondContact CB-OD2 3.42Å; N434-D436 PolarHBondContact O-N 3.25Å
435	A	51.2	Low	62.7	Low	76 Å²	76	59.4 Å²	59.4	63%	0.628	32%	0.32	S	S	*	.	G	3₁₀ helix	trans	-72.7	-18.2	-169.3	0	0	0	0	0	113.9	N437 C438	A435-N437 VanDerWaalsContact C-N 3.29Å; A435-N437 PolarHBondContact O-N 3.29Å; A435-C438 WeakPolarHBondContact O-CB 3.42Å; A435-C438 PolarHBondContact O-N 3.08Å
436	D	48.8	Very low	63.7	Low	119.5 Å²	119.5	60.9 Å²	60.9	64%	0.639	32%	0.315	S	S	*	.	G	3₁₀ helix	trans	-70.1	-22.7	-173.4	-46.1	-77.1	0	0	0	112.6	N434 C438	N434-D436 VanDerWaalsContact C-N 3.31Å; N434-D436 WeakPolarHBondContact CB-OD2 3.42Å; N434-D436 PolarHBondContact O-N 3.25Å; D436-C438 PolarHBondContact O-N 3.23Å
437	N	57.3	Low	64.7	Low	43.5 Å²	43.5	58.3 Å²	58.3	23%	0.233	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-71.9	-1.2	177	-80.8	-59.2	0	0	0	114.7	K430 H433 A435 E439 L440 D441	K430-N437 PolarHBondContact O-ND2 2.97Å; H433-N437 PolarHBondContact O-ND2 3.33Å; A435-N437 VanDerWaalsContact C-N 3.29Å; A435-N437 PolarHBondContact O-N 3.29Å; N437-E439 PolarHBondContact O-N 3.4Å; N437-L440 WeakPolarHBondContact O-CB 3.24Å; N437-L440 PolarHBondContact O-N 3.29Å; N437-L440 VanDerWaalsContact O-N 3.1Å; N437-D441 PolarHBondContact O-N 2.94Å
438	C	66.1	Low	65.7	Low	27 Å²	27	58.2 Å²	58.2	18%	0.182	30%	0.3	C	S	.	.	H	α-helix	trans	-64.7	-22.1	-178.4	-123.7	0	0	0	0	113.8	A435 D436 E442 C501	A435-C438 WeakPolarHBondContact O-CB 3.42Å; A435-C438 PolarHBondContact O-N 3.08Å; D436-C438 PolarHBondContact O-N 3.23Å; C438-E442 WeakPolarHBondContact O-CB 3.42Å; C438-E442 PolarHBondContact O-N 2.99Å; C438-C501 VanDerWaalsContact CA-SG 3.58Å; C438-C501 HydrophobicContact CB-CB 4.08Å; C438-C501 WeakPolarHBondContact CB-SG 3.36Å; C438-C501 WeakPolarHBondContact SG-CB 3.37Å; C438-C501 CovalentContact SG-SG 2.05Å; C438-C501 PolarHBondContact SG-SG 3Å
439	E	69.2	Low	66.8	Low	112 Å²	112	60.3 Å²	60.3	52%	0.523	31%	0.31	S	S	.	.	H	α-helix	trans	-67.2	-35.6	172.2	-72.6	-165.5	-159.8	0	0	112.9	K326 N437 E442 R443	K326-E439 IonicContact NZ-OE1 2.82Å; N437-E439 PolarHBondContact O-N 3.4Å; E439-E442 PolarHBondContact O-N 2.86Å; E439-R443 WeakPolarHBondContact O-CG 3.41Å; E439-R443 PolarHBondContact O-N 3.04Å; E439-R443 VanDerWaalsContact O-N 3.12Å; E439-R443 IonicContact OE2-CZ 2.74Å; E439-R443 IonicContact OE2-NE 3.49Å; E439-R443 IonicContact OE2-NH2 2.76Å; E439-R443 PolarHBondContact OE2-NH2 2.91Å
440	L	71.5	Confident	68.1	Low	15.5 Å²	15.5	56.5 Å²	56.5	8%	0.081	29%	0.288	C	S	.	.	H	α-helix	trans	-65	-49.3	175.8	162	62.3	0	0	0	110.1	W319 N437 E442 R443 I444	W319-L440 HydrophobicContact CB-CD1 3.82Å; W319-L440 HydrophobicContact CD2-CD1 3.83Å; W319-L440 HydrophobicContact CE3-CD1 3.21Å; W319-L440 HydrophobicContact CG-CD1 4.14Å; W319-L440 HydrophobicContact CZ3-CD1 3.98Å; N437-L440 WeakPolarHBondContact O-CB 3.24Å; N437-L440 PolarHBondContact O-N 3.29Å; N437-L440 VanDerWaalsContact O-N 3.1Å; L440-E442 VanDerWaalsContact C-N 3.27Å; L440-E442 PolarHBondContact O-N 3.01Å; L440-R443 PolarHBondContact O-N 3.13Å; L440-I444 HydrophobicContact CD1-CD1 3.64Å; L440-I444 HydrophobicContact CD1-CG1 4.14Å; L440-I444 HydrophobicContact CG-CD1 4Å; L440-I444 WeakPolarHBondContact O-CG1 3.32Å; L440-I444 PolarHBondContact O-N 3.18Å
441	D	74.7	Confident	69.6	Low	6.5 Å²	6.5	54.7 Å²	54.7	4%	0.035	28%	0.28	C	S	.	.	H	α-helix	trans	-61.6	-32.9	176.4	-86	-50.9	0	0	0	113	N437 S445 C501 S502 T505 R628	N437-D441 PolarHBondContact O-N 2.94Å; D441-S445 PolarHBondContact O-N 3.22Å; D441-S445 PolarHBondContact O-OG 3.04Å; D441-C501 HydrophobicContact CB-CB 3.98Å; D441-C501 VanDerWaalsContact OD2-C 3.25Å; D441-C501 WeakPolarHBondContact OD2-CB 3.41Å; D441-S502 VanDerWaalsContact CG-CA 3.46Å; D441-S502 WeakPolarHBondContact OD1-CA 3.27Å; D441-S502 WeakPolarHBondContact OD1-CB 3.41Å; D441-S502 WeakPolarHBondContact OD2-CA 3.4Å; D441-S502 PolarHBondContact OD2-N 3.13Å; D441-T505 PolarHBondContact O-OG1 3.14Å; D441-T505 PolarHBondContact OD1-OG1 3.06Å; D441-R628 PolarHBondContact O-NH1 3.07Å
442	E	77.4	Confident	71	Confident	76.5 Å²	76.5	54.2 Å²	54.2	36%	0.357	28%	0.276	S	S	.	.	H	α-helix	trans	-67.9	-46.3	174.2	-172.8	158.6	-177.8	0	0	112.4	C438 E439 L440 I444 S445 Q446	C438-E442 WeakPolarHBondContact O-CB 3.42Å; C438-E442 PolarHBondContact O-N 2.99Å; E439-E442 PolarHBondContact O-N 2.86Å; L440-E442 VanDerWaalsContact C-N 3.27Å; L440-E442 PolarHBondContact O-N 3.01Å; E442-I444 VanDerWaalsContact C-N 3.33Å; E442-I444 PolarHBondContact O-N 3.23Å; E442-S445 PolarHBondContact O-N 3.38Å; E442-Q446 WeakPolarHBondContact O-CG 3.18Å; E442-Q446 PolarHBondContact O-N 3.03Å
443	R	75.7	Confident	72.4	Confident	60 Å²	60	51.2 Å²	51.2	23%	0.226	27%	0.272	C	S	.	.	H	α-helix	trans	-61.3	-40.1	174.1	-67.6	169.2	-170.7	-135.9	-2.9	111.8	W319 I400 E439 L440 Q446 L447	W319-R443 HydrophobicContact CH2-CB 4.32Å; W319-R443 HydrophobicContact CZ2-CB 3.95Å; I400-R443 VanDerWaalsContact CD1-NH1 3.32Å; E439-R443 WeakPolarHBondContact O-CG 3.41Å; E439-R443 PolarHBondContact O-N 3.04Å; E439-R443 VanDerWaalsContact O-N 3.12Å; E439-R443 IonicContact OE2-CZ 2.74Å; E439-R443 IonicContact OE2-NE 3.49Å; E439-R443 IonicContact OE2-NH2 2.76Å; E439-R443 PolarHBondContact OE2-NH2 2.91Å; L440-R443 PolarHBondContact O-N 3.13Å; R443-Q446 PolarHBondContact O-N 3.46Å; R443-L447 PolarHBondContact O-N 3.15Å; R443-L447 VanDerWaalsContact O-N 3.09Å
444	I	80.5	Confident	74	Confident	2.5 Å²	2.5	46 Å²	46	1%	0.013	25%	0.25	C	C	.	.	H	α-helix	trans	-63.3	-44.2	176	-71.6	168.3	0	0	0	111.7	W319 I427 L440 E442 L447 L448 F490 T505	W319-I444 HydrophobicContact CZ3-CG1 3.92Å; I427-I444 HydrophobicContact CG2-CD1 4.38Å; L440-I444 HydrophobicContact CD1-CD1 3.64Å; L440-I444 HydrophobicContact CD1-CG1 4.14Å; L440-I444 HydrophobicContact CG-CD1 4Å; L440-I444 WeakPolarHBondContact O-CG1 3.32Å; L440-I444 PolarHBondContact O-N 3.18Å; E442-I444 VanDerWaalsContact C-N 3.33Å; E442-I444 PolarHBondContact O-N 3.23Å; I444-L447 WeakPolarHBondContact O-CB 3.45Å; I444-L447 PolarHBondContact O-N 2.95Å; I444-L448 HydrophobicContact CG2-CD1 3.98Å; I444-L448 WeakPolarHBondContact O-CG 3.35Å; I444-L448 PolarHBondContact O-N 2.86Å; I444-F490 HydrophobicContact CG2-CE1 4.15Å; I444-F490 HydrophobicContact CG2-CZ 4.48Å; I444-T505 HydrophobicContact CG2-CG2 4.17Å
445	S	80.7	Confident	75.5	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-70.8	-37.4	179.3	-28.6	0	0	0	0	112.3	D441 E442 L447 L448 E449 T505 R628	D441-S445 PolarHBondContact O-N 3.22Å; D441-S445 PolarHBondContact O-OG 3.04Å; E442-S445 PolarHBondContact O-N 3.38Å; S445-L447 VanDerWaalsContact C-N 3.27Å; S445-L447 PolarHBondContact O-N 3.06Å; S445-L448 PolarHBondContact O-N 3Å; S445-L448 VanDerWaalsContact O-N 3.11Å; S445-E449 WeakPolarHBondContact CB-OE1 3.43Å; S445-E449 VanDerWaalsContact O-CB 3.27Å; S445-E449 WeakPolarHBondContact O-CB 3.44Å; S445-E449 VanDerWaalsContact O-CG 3.24Å; S445-E449 WeakPolarHBondContact O-CG 3.38Å; S445-E449 PolarHBondContact O-N 3.31Å; S445-T505 VanDerWaalsContact OG-CG2 3.23Å; S445-T505 WeakPolarHBondContact OG-CG2 3.42Å; S445-T505 PolarHBondContact OG-OG1 2.96Å; S445-T505 VanDerWaalsContact OG-OG1 3.11Å; S445-R628 VanDerWaalsContact OG-CZ 3.3Å; S445-R628 PolarHBondContact OG-NH1 3.36Å; S445-R628 PolarHBondContact OG-NH2 3.07Å
446	Q	82.7	Confident	76.8	Confident	78 Å²	78	37.9 Å²	37.9	36%	0.364	20%	0.196	S	C	.	.	H	α-helix	trans	-57.7	-41.9	173.1	-71.8	178.3	17.2	0	0	111.3	E442 R443 E449 E450	E442-Q446 WeakPolarHBondContact O-CG 3.18Å; E442-Q446 PolarHBondContact O-N 3.03Å; R443-Q446 PolarHBondContact O-N 3.46Å; Q446-E449 PolarHBondContact O-N 3.2Å; Q446-E450 WeakPolarHBondContact O-CB 3.35Å; Q446-E450 WeakPolarHBondContact O-CG 3.3Å; Q446-E450 PolarHBondContact O-N 3.38Å
447	L	83.2	Confident	78.3	Confident	11 Å²	11	39.9 Å²	39.9	6%	0.058	20%	0.199	C	C	.	.	H	α-helix	trans	-63.4	-43.2	175.7	-170.6	71	0	0	0	112.1	L403 V407 L420 R443 I444 S445 E450 I451	L403-L447 HydrophobicContact CB-CD1 4.47Å; V407-L447 HydrophobicContact CG2-CD1 3.81Å; L420-L447 HydrophobicContact CD1-CD2 4.27Å; R443-L447 PolarHBondContact O-N 3.15Å; R443-L447 VanDerWaalsContact O-N 3.09Å; I444-L447 WeakPolarHBondContact O-CB 3.45Å; I444-L447 PolarHBondContact O-N 2.95Å; S445-L447 VanDerWaalsContact C-N 3.27Å; S445-L447 PolarHBondContact O-N 3.06Å; L447-E450 PolarHBondContact O-N 3.34Å; L447-I451 HydrophobicContact CG-CD1 4.24Å; L447-I451 WeakPolarHBondContact O-CB 3.2Å; L447-I451 WeakPolarHBondContact O-CD1 3.35Å; L447-I451 VanDerWaalsContact O-CG1 3.23Å; L447-I451 WeakPolarHBondContact O-CG1 3.38Å; L447-I451 PolarHBondContact O-N 2.98Å
448	L	84.3	Confident	79.1	Confident	3 Å²	3	41.2 Å²	41.2	2%	0.016	20%	0.204	C	C	.	.	H	α-helix	trans	-68.5	-37.9	177.2	-68.9	169.6	0	0	0	112.5	L420 I444 S445 I451 L452 I487 F490 V509	L420-L448 HydrophobicContact CD1-CD2 4.43Å; I444-L448 HydrophobicContact CG2-CD1 3.98Å; I444-L448 WeakPolarHBondContact O-CG 3.35Å; I444-L448 PolarHBondContact O-N 2.86Å; S445-L448 PolarHBondContact O-N 3Å; S445-L448 VanDerWaalsContact O-N 3.11Å; L448-I451 HydrophobicContact CD2-CD1 4.47Å; L448-I451 PolarHBondContact O-N 3.17Å; L448-L452 WeakPolarHBondContact O-CG 3.47Å; L448-L452 PolarHBondContact O-N 3.32Å; L448-I487 HydrophobicContact CD2-CG1 4.48Å; L448-I487 HydrophobicContact CD2-CG2 4.42Å; L448-F490 HydrophobicContact CD1-CD1 4.22Å; L448-F490 HydrophobicContact CD1-CE1 4.08Å; L448-V509 HydrophobicContact CB-CG1 4.37Å; L448-V509 HydrophobicContact CB-CG2 4.01Å; L448-V509 HydrophobicContact CD1-CG1 4.42Å; L448-V509 HydrophobicContact CD1-CG2 3.99Å
449	E	84.2	Confident	79.3	Confident	61 Å²	61	41.5 Å²	41.5	29%	0.285	20%	0.201	S	C	.	.	H	α-helix	trans	-65.5	-39.8	175.4	-74.3	166.1	-140.6	0	0	111.1	S445 Q446 L452 A453 H508	S445-E449 WeakPolarHBondContact CB-OE1 3.43Å; S445-E449 VanDerWaalsContact O-CB 3.27Å; S445-E449 WeakPolarHBondContact O-CB 3.44Å; S445-E449 VanDerWaalsContact O-CG 3.24Å; S445-E449 WeakPolarHBondContact O-CG 3.38Å; S445-E449 PolarHBondContact O-N 3.31Å; Q446-E449 PolarHBondContact O-N 3.2Å; E449-L452 PolarHBondContact O-N 3.47Å; E449-A453 WeakPolarHBondContact O-CB 3.27Å; E449-A453 PolarHBondContact O-N 3.29Å; E449-H508 IonicContact OE1-CE1 2.91Å; E449-H508 PolarHBondContact OE1-CE1 3.31Å; E449-H508 IonicContact OE1-ND1 3.2Å; E449-H508 PolarHBondContact OE1-ND1 3.18Å; E449-H508 VanDerWaalsContact OE1-ND1 3.09Å
450	E	83.2	Confident	79.5	Confident	60 Å²	60	40.3 Å²	40.3	28%	0.28	20%	0.195	S	C	.	.	H	α-helix	trans	-66.6	-42.9	172.3	-75.1	169.9	-172.9	0	0	112.1	K404 V407 Q446 L447 L452 A453 V454	K404-E450 WeakPolarHBondContact CD-OE2 3.31Å; K404-E450 WeakPolarHBondContact CE-OE1 3.39Å; K404-E450 WeakPolarHBondContact CE-OE2 3.29Å; K404-E450 VanDerWaalsContact CG-OE2 3.27Å; K404-E450 WeakPolarHBondContact CG-OE2 3.43Å; K404-E450 IonicContact NZ-OE1 3.23Å; K404-E450 PolarHBondContact NZ-OE1 3.37Å; K404-E450 IonicContact NZ-OE2 2.79Å; K404-E450 PolarHBondContact NZ-OE2 2.92Å; V407-E450 HydrophobicContact CG1-CB 4.04Å; Q446-E450 WeakPolarHBondContact O-CB 3.35Å; Q446-E450 WeakPolarHBondContact O-CG 3.3Å; Q446-E450 PolarHBondContact O-N 3.38Å; L447-E450 PolarHBondContact O-N 3.34Å; E450-L452 PolarHBondContact O-N 2.86Å; E450-A453 PolarHBondContact O-N 3.17Å; E450-V454 WeakPolarHBondContact O-CG2 3.35Å; E450-V454 PolarHBondContact O-N 3.27Å
451	I	84.3	Confident	79.2	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-57.1	-47.2	173.5	-74.5	164.8	0	0	0	111.2	V407 L413 V416 L447 L448 V454 A455 L483 I487	V407-I451 HydrophobicContact CB-CG1 4.39Å; V407-I451 HydrophobicContact CG1-CB 4.44Å; V407-I451 HydrophobicContact CG1-CG1 3.66Å; V407-I451 HydrophobicContact CG2-CD1 4.19Å; V407-I451 HydrophobicContact CG2-CG1 3.75Å; L413-I451 HydrophobicContact CD2-CB 4.36Å; L413-I451 HydrophobicContact CD2-CG1 4.11Å; L413-I451 HydrophobicContact CD2-CG2 4.23Å; V416-I451 HydrophobicContact CG1-CD1 3.91Å; L447-I451 HydrophobicContact CG-CD1 4.24Å; L447-I451 WeakPolarHBondContact O-CB 3.2Å; L447-I451 WeakPolarHBondContact O-CD1 3.35Å; L447-I451 VanDerWaalsContact O-CG1 3.23Å; L447-I451 WeakPolarHBondContact O-CG1 3.38Å; L447-I451 PolarHBondContact O-N 2.98Å; L448-I451 HydrophobicContact CD2-CD1 4.47Å; L448-I451 PolarHBondContact O-N 3.17Å; I451-V454 PolarHBondContact O-N 3.27Å; I451-A455 WeakPolarHBondContact O-CB 3.33Å; I451-A455 PolarHBondContact O-N 3.41Å; I451-L483 HydrophobicContact CG2-CD1 4.2Å; I451-L483 HydrophobicContact CG2-CD2 4.2Å; I451-L483 HydrophobicContact CG2-CG 4.49Å; I451-I487 HydrophobicContact CG2-CD1 3.76Å
452	L	83.7	Confident	78.6	Confident	4.5 Å²	4.5	41.6 Å²	41.6	2%	0.024	21%	0.212	C	C	.	.	H	α-helix	trans	-64.8	-40.1	177.8	-70.6	176.1	0	0	0	112	L448 E449 E450 L456 F484 I487 V509 Q512 V513 I516	L448-L452 WeakPolarHBondContact O-CG 3.47Å; L448-L452 PolarHBondContact O-N 3.32Å; E449-L452 PolarHBondContact O-N 3.47Å; E450-L452 PolarHBondContact O-N 2.86Å; L452-L456 WeakPolarHBondContact O-CB 3.48Å; L452-L456 WeakPolarHBondContact O-CG 3.34Å; L452-L456 PolarHBondContact O-N 3.2Å; L452-F484 HydrophobicContact CD2-CD1 3.93Å; L452-F484 HydrophobicContact CD2-CE1 3.55Å; L452-F484 HydrophobicContact CD2-CZ 4.37Å; L452-I487 HydrophobicContact CD2-CD1 3.83Å; L452-I487 HydrophobicContact CG-CD1 4.45Å; L452-V509 HydrophobicContact CD1-CG1 4.18Å; L452-Q512 HydrophobicContact CD1-CB 4.28Å; L452-V513 HydrophobicContact CD1-CG2 3.99Å; L452-V513 HydrophobicContact CD2-CG2 3.93Å; L452-I516 HydrophobicContact CB-CD1 4.34Å; L452-I516 HydrophobicContact CD1-CD1 4.35Å; L452-I516 HydrophobicContact CD2-CD1 4.45Å
453	A	83.9	Confident	77.7	Confident	56.5 Å²	56.5	40.5 Å²	40.5	47%	0.467	21%	0.212	S	C	.	.	H	α-helix	trans	-66.2	-40.4	178.4	0	0	0	0	0	112.8	E449 E450 K457	E449-A453 WeakPolarHBondContact O-CB 3.27Å; E449-A453 PolarHBondContact O-N 3.29Å; E450-A453 PolarHBondContact O-N 3.17Å; A453-K457 WeakPolarHBondContact O-CB 3.34Å; A453-K457 PolarHBondContact O-N 3.39Å; A453-K457 VanDerWaalsContact O-N 3.09Å
454	V	81.5	Confident	76.9	Confident	22 Å²	22	44.9 Å²	44.9	13%	0.133	24%	0.239	C	C	.	.	H	α-helix	trans	-69.8	-42.8	176.6	179	0	0	0	0	110.8	V407 L413 E450 I451 L456 K457 E458	V407-V454 HydrophobicContact CG1-CG2 4.47Å; L413-V454 HydrophobicContact CD1-CB 4.42Å; L413-V454 HydrophobicContact CD1-CG1 4.12Å; L413-V454 HydrophobicContact CD2-CB 4.4Å; L413-V454 HydrophobicContact CD2-CG1 4.44Å; E450-V454 WeakPolarHBondContact O-CG2 3.35Å; E450-V454 PolarHBondContact O-N 3.27Å; I451-V454 PolarHBondContact O-N 3.27Å; V454-L456 VanDerWaalsContact C-N 3.35Å; V454-L456 PolarHBondContact O-N 3.02Å; V454-K457 PolarHBondContact O-N 3.15Å; V454-K457 VanDerWaalsContact O-N 3.14Å; V454-E458 PolarHBondContact O-N 3.39Å
455	A	80.6	Confident	75.7	Confident	1 Å²	1	50.6 Å²	50.6	1%	0.008	27%	0.266	C	S	.	.	H	α-helix	trans	-59.8	-42.8	175.9	0	0	0	0	0	112.6	L413 I451 K457 E458 Y459 L483 F484	L413-A455 HydrophobicContact CD1-CB 4.14Å; I451-A455 WeakPolarHBondContact O-CB 3.33Å; I451-A455 PolarHBondContact O-N 3.41Å; A455-K457 PolarHBondContact O-N 2.96Å; A455-E458 PolarHBondContact O-N 3.41Å; A455-Y459 WeakPolarHBondContact O-CB 3.36Å; A455-Y459 PolarHBondContact O-N 3.24Å; A455-L483 HydrophobicContact CB-CD2 3.67Å; A455-F484 HydrophobicContact CB-CE1 4.43Å
456	L	79.6	Confident	74.3	Confident	36 Å²	36	52 Å²	52	19%	0.188	28%	0.276	C	S	.	.	H	α-helix	trans	-60.8	-43.5	173.1	-81.2	172.6	0	0	0	112.5	L452 V454 Y459 E460 I516 K520	L452-L456 WeakPolarHBondContact O-CB 3.48Å; L452-L456 WeakPolarHBondContact O-CG 3.34Å; L452-L456 PolarHBondContact O-N 3.2Å; V454-L456 VanDerWaalsContact C-N 3.35Å; V454-L456 PolarHBondContact O-N 3.02Å; L456-Y459 WeakPolarHBondContact O-CB 3.38Å; L456-Y459 PolarHBondContact O-N 3.05Å; L456-E460 WeakPolarHBondContact O-CG 3.32Å; L456-E460 PolarHBondContact O-N 2.84Å; L456-I516 HydrophobicContact CD1-CD1 3.84Å; L456-I516 HydrophobicContact CD1-CG1 4.05Å; L456-I516 HydrophobicContact CD2-CG1 4.43Å; L456-I516 HydrophobicContact CD2-CG2 3.78Å; L456-I516 HydrophobicContact CG-CD1 4.4Å; L456-I516 HydrophobicContact CG-CG2 4.48Å; L456-K520 HydrophobicContact CD2-CG 4.13Å
457	K	79.5	Confident	72.2	Confident	160.5 Å²	160.5	52.4 Å²	52.4	70%	0.698	30%	0.301	S	S	*	.	H	α-helix	trans	-67.4	-36	-179.4	-171.9	177.7	-180	-178.5	0	112.3	A453 V454 A455 G461	A453-K457 WeakPolarHBondContact O-CB 3.34Å; A453-K457 PolarHBondContact O-N 3.39Å; A453-K457 VanDerWaalsContact O-N 3.09Å; V454-K457 PolarHBondContact O-N 3.15Å; V454-K457 VanDerWaalsContact O-N 3.14Å; A455-K457 PolarHBondContact O-N 2.96Å; K457-G461 PolarHBondContact O-N 3.4Å; K457-G461 VanDerWaalsContact O-N 3.1Å
458	E	73.9	Confident	70.4	Confident	71.5 Å²	71.5	54.9 Å²	54.9	33%	0.334	33%	0.329	S	S	.	.	H	α-helix	trans	-65.4	-46.5	169.9	-174.5	179.5	-157.3	0	0	111.1	P410 V454 A455 E460 G461 A462	P410-E458 HydrophobicContact CB-CG 4.39Å; P410-E458 VanDerWaalsContact CB-OE1 3.25Å; P410-E458 WeakPolarHBondContact CB-OE1 3.49Å; P410-E458 WeakPolarHBondContact CB-OE2 3.26Å; V454-E458 PolarHBondContact O-N 3.39Å; A455-E458 PolarHBondContact O-N 3.41Å; E458-E460 PolarHBondContact O-N 3.16Å; E458-G461 CarbonylContact O-C 3.51Å; E458-G461 PolarHBondContact O-N 2.91Å; E458-A462 WeakPolarHBondContact O-CB 3.32Å; E458-A462 PolarHBondContact O-N 2.88Å
459	Y	71	Confident	68.5	Low	33 Å²	33	64.4 Å²	64.4	13%	0.129	37%	0.365	C	S	.	.	H	α-helix	trans	-59	-49.4	179.4	179	-111.9	0	0	0	112.8	A455 L456 G461 A462 C463 N477 K520 F522	A455-Y459 WeakPolarHBondContact O-CB 3.36Å; A455-Y459 PolarHBondContact O-N 3.24Å; L456-Y459 WeakPolarHBondContact O-CB 3.38Å; L456-Y459 PolarHBondContact O-N 3.05Å; Y459-G461 VanDerWaalsContact C-N 3.34Å; Y459-G461 PolarHBondContact O-N 2.99Å; Y459-A462 PolarHBondContact O-N 3.3Å; Y459-C463 WeakPolarHBondContact CE2-SG 3.36Å; Y459-C463 PolarHBondContact O-N 3.05Å; Y459-C463 PolarHBondContact O-SG 3.3Å; Y459-N477 WeakPolarHBondContact CE2-OD1 3.38Å; Y459-K520 HydrophobicContact CE1-CB 4.29Å; Y459-K520 HydrophobicContact CE1-CD 4.38Å; Y459-K520 HydrophobicContact CE1-CG 4.35Å; Y459-F522 HydrophobicContact CD1-CE1 4.31Å; Y459-F522 HydrophobicContact CD1-CE2 4.37Å; Y459-F522 AromaticContact CD1-CZ 3.6Å; Y459-F522 HydrophobicContact CD1-CZ 3.6Å; Y459-F522 AromaticContact CD2-CE1 3.86Å; Y459-F522 HydrophobicContact CD2-CE1 3.95Å; Y459-F522 AromaticContact CD2-CZ 3.88Å; Y459-F522 HydrophobicContact CD2-CZ 3.88Å; Y459-F522 AromaticContact CE1-CE1 3.93Å; Y459-F522 HydrophobicContact CE1-CE1 3.93Å; Y459-F522 HydrophobicContact CE1-CE2 4.27Å; Y459-F522 AromaticContact CE1-CZ 3.53Å; Y459-F522 HydrophobicContact CE1-CZ 3.53Å; Y459-F522 VanDerWaalsContact CE1-CZ 3.47Å; Y459-F522 AromaticContact CE2-CE1 3.57Å; Y459-F522 HydrophobicContact CE2-CE1 3.57Å; Y459-F522 VanDerWaalsContact CE2-CE1 3.44Å; Y459-F522 AromaticContact CE2-CZ 3.85Å; Y459-F522 HydrophobicContact CE2-CZ 3.85Å; Y459-F522 HydrophobicContact CG-CE1 4.3Å; Y459-F522 AromaticContact CG-CZ 3.75Å; Y459-F522 HydrophobicContact CG-CZ 3.75Å; Y459-F522 AromaticContact CZ-CE1 3.54Å; Y459-F522 VanDerWaalsContact CZ-CE1 3.48Å; Y459-F522 AromaticContact CZ-CZ 3.66Å
460	E	72.5	Confident	67	Low	86.5 Å²	86.5	69.4 Å²	69.4	40%	0.404	39%	0.386	S	S	.	.	H	α-helix	trans	-61.3	-42.8	175.4	-71.2	-179.3	171.4	0	0	111.5	L456 E458 A462 C463 L464 K520	L456-E460 WeakPolarHBondContact O-CG 3.32Å; L456-E460 PolarHBondContact O-N 2.84Å; E458-E460 PolarHBondContact O-N 3.16Å; E460-A462 VanDerWaalsContact C-N 3.32Å; E460-A462 PolarHBondContact O-N 3.25Å; E460-C463 PolarHBondContact O-N 2.98Å; E460-L464 WeakPolarHBondContact O-CB 3.39Å; E460-L464 VanDerWaalsContact O-CG 3.3Å; E460-L464 WeakPolarHBondContact O-CG 3.47Å; E460-L464 PolarHBondContact O-N 3.28Å; E460-K520 WeakPolarHBondContact OE1-CE 3.26Å; E460-K520 IonicContact OE1-NZ 3.34Å; E460-K520 PolarHBondContact OE1-NZ 2.95Å
461	G	67	Low	65.5	Low	25 Å²	25	73.7 Å²	73.7	26%	0.258	41%	0.406	S	S	.	.	H	α-helix	trans	-61	-38.7	175.1	0	0	0	0	0	113.3	K457 E458 Y459 Q465	K457-G461 PolarHBondContact O-N 3.4Å; K457-G461 VanDerWaalsContact O-N 3.1Å; E458-G461 CarbonylContact O-C 3.51Å; E458-G461 PolarHBondContact O-N 2.91Å; Y459-G461 VanDerWaalsContact C-N 3.34Å; Y459-G461 PolarHBondContact O-N 2.99Å; G461-Q465 WeakPolarHBondContact O-CB 3.23Å; G461-Q465 VanDerWaalsContact O-CG 3.32Å; G461-Q465 WeakPolarHBondContact O-CG 3.32Å; G461-Q465 PolarHBondContact O-N 3.27Å; G461-Q465 PolarHBondContact O-NE2 3.24Å
462	A	60.7	Low	63.6	Low	25 Å²	25	76.4 Å²	76.4	21%	0.207	43%	0.428	C	S	.	.	H	α-helix	trans	-70.1	-42.7	176.5	0	0	0	0	0	111.8	E458 Y459 E460 Q465 S466	E458-A462 WeakPolarHBondContact O-CB 3.32Å; E458-A462 PolarHBondContact O-N 2.88Å; Y459-A462 PolarHBondContact O-N 3.3Å; E460-A462 VanDerWaalsContact C-N 3.32Å; E460-A462 PolarHBondContact O-N 3.25Å; A462-Q465 PolarHBondContact O-N 3.11Å; A462-S466 WeakPolarHBondContact O-CB 3.49Å; A462-S466 PolarHBondContact O-N 3.16Å; A462-S466 VanDerWaalsContact O-N 3.16Å
463	C	58.9	Low	62.3	Low	52.5 Å²	52.5	77.2 Å²	77.2	36%	0.355	44%	0.436	S	S	.	.	H	α-helix	trans	-62	-45.3	175.8	-72.3	0	0	0	0	112.2	Y459 E460 Q465 S466	Y459-C463 WeakPolarHBondContact CE2-SG 3.36Å; Y459-C463 PolarHBondContact O-N 3.05Å; Y459-C463 PolarHBondContact O-SG 3.3Å; E460-C463 PolarHBondContact O-N 2.98Å; C463-Q465 VanDerWaalsContact C-N 3.3Å; C463-Q465 PolarHBondContact O-N 3.15Å; C463-S466 PolarHBondContact O-N 3.16Å; C463-S466 VanDerWaalsContact O-N 3.14Å
464	L	59.2	Low	61.1	Low	152.5 Å²	152.5	77.7 Å²	77.7	80%	0.798	44%	0.436	S	S	*	.	H	α-helix	trans	-66.1	-29.3	178.6	-71.8	169	0	0	0	113.2	E460	E460-L464 WeakPolarHBondContact O-CB 3.39Å; E460-L464 VanDerWaalsContact O-CG 3.3Å; E460-L464 WeakPolarHBondContact O-CG 3.47Å; E460-L464 PolarHBondContact O-N 3.28Å
465	Q	55	Low	60.1	Low	124 Å²	124	81.8 Å²	81.8	58%	0.579	46%	0.456	S	S	*	.	H	α-helix	trans	-80.6	-23	174.7	-74.1	171.1	103	0	0	112.9	G461 A462 C463 G467	G461-Q465 WeakPolarHBondContact O-CB 3.23Å; G461-Q465 VanDerWaalsContact O-CG 3.32Å; G461-Q465 WeakPolarHBondContact O-CG 3.32Å; G461-Q465 PolarHBondContact O-N 3.27Å; G461-Q465 PolarHBondContact O-NE2 3.24Å; A462-Q465 PolarHBondContact O-N 3.11Å; C463-Q465 VanDerWaalsContact C-N 3.3Å; C463-Q465 PolarHBondContact O-N 3.15Å; Q465-G467 VanDerWaalsContact C-N 3.26Å; Q465-G467 PolarHBondContact O-N 3.09Å; Q465-G467 VanDerWaalsContact O-N 3.09Å
466	S	51.5	Low	59.1	Low	28.5 Å²	28.5	82.5 Å²	82.5	20%	0.199	46%	0.46	C	S	.	.			trans	-84.4	72.6	178.6	-167.3	0	0	0	0	112.4	A462 C463 G468 R469	A462-S466 WeakPolarHBondContact O-CB 3.49Å; A462-S466 PolarHBondContact O-N 3.16Å; A462-S466 VanDerWaalsContact O-N 3.16Å; C463-S466 PolarHBondContact O-N 3.16Å; C463-S466 VanDerWaalsContact O-N 3.14Å; S466-G468 PolarHBondContact O-N 2.96Å; S466-R469 VanDerWaalsContact OG-C 3.26Å; S466-R469 WeakPolarHBondContact OG-CA 3.33Å; S466-R469 PolarHBondContact OG-N 3.14Å; S466-R469 VanDerWaalsContact OG-N 3.15Å; S466-R469 PolarHBondContact OG-O 3.02Å
467	G	38.2	Very low	58.5	Low	86.5 Å²	86.5	83 Å²	83	89%	0.892	46%	0.463	S	S	*	.	S	Bend	trans	-68	50.8	167.1	0	0	0	0	0	113.7	Q465	Q465-G467 VanDerWaalsContact C-N 3.26Å; Q465-G467 PolarHBondContact O-N 3.09Å; Q465-G467 VanDerWaalsContact O-N 3.09Å
468	G	45.4	Very low	58.1	Low	64 Å²	64	78.3 Å²	78.3	66%	0.66	45%	0.451	S	S	*	.	S	Bend	trans	118.3	-10.5	173.7	0	0	0	0	0	116.7	S466 K470	S466-G468 PolarHBondContact O-N 2.96Å; G468-K470 PolarHBondContact O-N 3.15Å
469	R	45.5	Very low	57.9	Low	201 Å²	201	81 Å²	81	76%	0.758	46%	0.462	S	S	*	.			trans	-87.9	88.2	-178.5	-69.7	-168.6	-175.5	-175.9	2.6	112.1	S466 E471 A472	S466-R469 VanDerWaalsContact OG-C 3.26Å; S466-R469 WeakPolarHBondContact OG-CA 3.33Å; S466-R469 PolarHBondContact OG-N 3.14Å; S466-R469 VanDerWaalsContact OG-N 3.15Å; S466-R469 PolarHBondContact OG-O 3.02Å; R469-E471 PolarHBondContact O-N 3.48Å; R469-E471 VanDerWaalsContact O-N 3.1Å; R469-A472 PolarHBondContact O-N 3.23Å
470	K	51.7	Low	58.2	Low	167.5 Å²	167.5	79.7 Å²	79.7	73%	0.728	46%	0.457	S	S	*	.	H	α-helix	trans	-52.7	-30.9	-176.9	-64.6	178.3	-179.3	175.8	0	114.4	G468 A473 S474	G468-K470 PolarHBondContact O-N 3.15Å; K470-A473 PolarHBondContact O-N 3.02Å; K470-S474 PolarHBondContact O-N 3.42Å; K470-S474 PolarHBondContact O-OG 2.91Å
471	E	51.2	Low	58.3	Low	149 Å²	149	76.5 Å²	76.5	70%	0.696	44%	0.442	S	S	*	.	H	α-helix	trans	-66.1	-43.4	-177.5	-67.4	161.2	171.1	0	0	113.3	R469 A473 S474 I475	R469-E471 PolarHBondContact O-N 3.48Å; R469-E471 VanDerWaalsContact O-N 3.1Å; E471-A473 VanDerWaalsContact C-N 3.29Å; E471-A473 PolarHBondContact O-N 3.1Å; E471-S474 VanDerWaalsContact CA-OG 3.3Å; E471-S474 WeakPolarHBondContact CA-OG 3.32Å; E471-S474 PolarHBondContact O-N 3.14Å; E471-S474 PolarHBondContact O-OG 3.24Å; E471-I475 WeakPolarHBondContact O-CG1 3.46Å; E471-I475 PolarHBondContact O-N 3.37Å; E471-I475 VanDerWaalsContact O-N 3.12Å
472	A	46	Very low	58.8	Low	57 Å²	57	79.2 Å²	79.2	47%	0.471	45%	0.451	S	S	.	.	H	α-helix	trans	-62.5	-40.1	178	0	0	0	0	0	111.2	R469 I475 S476	R469-A472 PolarHBondContact O-N 3.23Å; A472-I475 PolarHBondContact O-N 3.03Å; A472-S476 PolarHBondContact O-N 2.99Å; A472-S476 VanDerWaalsContact O-N 3.12Å; A472-S476 PolarHBondContact O-OG 3.38Å
473	A	55.7	Low	59.7	Low	22.5 Å²	22.5	78.3 Å²	78.3	19%	0.186	44%	0.442	C	S	.	.	H	α-helix	trans	-67.1	-36.1	175.9	0	0	0	0	0	112.4	K470 E471 S476 N477	K470-A473 PolarHBondContact O-N 3.02Å; E471-A473 VanDerWaalsContact C-N 3.29Å; E471-A473 PolarHBondContact O-N 3.1Å; A473-S476 WeakPolarHBondContact CA-OG 3.04Å; A473-S476 PolarHBondContact O-OG 2.94Å; A473-S476 VanDerWaalsContact O-OG 3.14Å; A473-N477 WeakPolarHBondContact O-CB 3.38Å; A473-N477 PolarHBondContact O-N 3.04Å; A473-N477 PolarHBondContact O-ND2 3.19Å
474	S	58.7	Low	60.8	Low	67 Å²	67	75.9 Å²	75.9	47%	0.469	43%	0.425	S	S	.	.	H	α-helix	trans	-67.2	-34.8	175	43.7	0	0	0	0	113.3	K470 E471 N477 S478	K470-S474 PolarHBondContact O-N 3.42Å; K470-S474 PolarHBondContact O-OG 2.91Å; E471-S474 VanDerWaalsContact CA-OG 3.3Å; E471-S474 WeakPolarHBondContact CA-OG 3.32Å; E471-S474 PolarHBondContact O-N 3.14Å; E471-S474 PolarHBondContact O-OG 3.24Å; S474-N477 PolarHBondContact O-N 3.07Å; S474-S478 PolarHBondContact O-N 3.38Å; S474-S478 VanDerWaalsContact O-N 3.1Å
475	I	59.9	Low	61.9	Low	107.5 Å²	107.5	69.8 Å²	69.8	55%	0.551	39%	0.393	S	S	*	.	H	α-helix	trans	-72.5	-38.8	178.5	-63.7	164.4	0	0	0	111.2	E471 A472 S478 K479	E471-I475 WeakPolarHBondContact O-CG1 3.46Å; E471-I475 PolarHBondContact O-N 3.37Å; E471-I475 VanDerWaalsContact O-N 3.12Å; A472-I475 PolarHBondContact O-N 3.03Å; I475-S478 PolarHBondContact O-N 3.17Å; I475-S478 PolarHBondContact O-OG 3.26Å; I475-K479 PolarHBondContact O-N 2.93Å
476	S	59.8	Low	63.2	Low	15.5 Å²	15.5	64.2 Å²	64.2	11%	0.108	37%	0.367	C	S	.	.	H	α-helix	trans	-68	-37.1	172.1	57	0	0	0	0	112.3	A472 A473 S478 K479 V480	A472-S476 PolarHBondContact O-N 2.99Å; A472-S476 VanDerWaalsContact O-N 3.12Å; A472-S476 PolarHBondContact O-OG 3.38Å; A473-S476 WeakPolarHBondContact CA-OG 3.04Å; A473-S476 PolarHBondContact O-OG 2.94Å; A473-S476 VanDerWaalsContact O-OG 3.14Å; S476-S478 VanDerWaalsContact C-N 3.35Å; S476-S478 PolarHBondContact O-N 3.3Å; S476-K479 PolarHBondContact O-N 3.23Å; S476-V480 WeakPolarHBondContact O-CG2 3.42Å; S476-V480 PolarHBondContact O-N 3.25Å
477	N	67.4	Low	64.8	Low	45.5 Å²	45.5	62.9 Å²	62.9	24%	0.243	36%	0.358	C	S	.	.	H	α-helix	trans	-58.1	-49.1	174.3	-86.4	-49.2	0	0	0	111.7	Y459 A473 S474 K479 V480 H481	Y459-N477 WeakPolarHBondContact CE2-OD1 3.38Å; A473-N477 WeakPolarHBondContact O-CB 3.38Å; A473-N477 PolarHBondContact O-N 3.04Å; A473-N477 PolarHBondContact O-ND2 3.19Å; S474-N477 PolarHBondContact O-N 3.07Å; N477-K479 PolarHBondContact O-N 3.16Å; N477-V480 PolarHBondContact O-N 2.97Å; N477-H481 WeakPolarHBondContact O-CB 3.2Å; N477-H481 PolarHBondContact O-N 3.18Å
478	S	70.1	Confident	67	Low	62.5 Å²	62.5	58.8 Å²	58.8	44%	0.437	32%	0.316	S	S	.	.	H	α-helix	trans	-59.9	-46.6	-176.5	133.7	0	0	0	0	112.3	S474 I475 S476 V480 H481 D482	S474-S478 PolarHBondContact O-N 3.38Å; S474-S478 VanDerWaalsContact O-N 3.1Å; I475-S478 PolarHBondContact O-N 3.17Å; I475-S478 PolarHBondContact O-OG 3.26Å; S476-S478 VanDerWaalsContact C-N 3.35Å; S476-S478 PolarHBondContact O-N 3.3Å; S478-V480 VanDerWaalsContact C-N 3.32Å; S478-V480 PolarHBondContact O-N 3.1Å; S478-H481 WeakPolarHBondContact O-CA 3.25Å; S478-H481 WeakPolarHBondContact O-CB 3.23Å; S478-H481 PolarHBondContact O-N 3.15Å; S478-H481 VanDerWaalsContact O-N 3.09Å; S478-D482 PolarHBondContact O-N 3.13Å
479	K	71.5	Confident	68.8	Low	129.5 Å²	129.5	61.5 Å²	61.5	56%	0.563	31%	0.306	S	S	*	.	H	α-helix	trans	-59.3	-41	178.6	-69	-174.3	177.3	-172.2	0	112.9	I475 S476 N477 H481 D482 L483	I475-K479 PolarHBondContact O-N 2.93Å; S476-K479 PolarHBondContact O-N 3.23Å; N477-K479 PolarHBondContact O-N 3.16Å; K479-H481 VanDerWaalsContact C-N 3.35Å; K479-D482 PolarHBondContact O-N 3.21Å; K479-L483 WeakPolarHBondContact O-CB 3.4Å; K479-L483 PolarHBondContact O-N 3.34Å; K479-L483 VanDerWaalsContact O-N 3.11Å
480	V	75.8	Confident	70.6	Confident	5 Å²	5	52.2 Å²	52.2	3%	0.03	27%	0.271	C	S	.	.	H	α-helix	trans	-70.4	-35.2	176.9	176.3	0	0	0	0	111	S476 N477 S478 F484 F522	S476-V480 WeakPolarHBondContact O-CG2 3.42Å; S476-V480 PolarHBondContact O-N 3.25Å; N477-V480 PolarHBondContact O-N 2.97Å; S478-V480 VanDerWaalsContact C-N 3.32Å; S478-V480 PolarHBondContact O-N 3.1Å; V480-F484 HydrophobicContact CG1-CD1 4.26Å; V480-F484 HydrophobicContact CG1-CD2 4.18Å; V480-F484 HydrophobicContact CG1-CE1 3.83Å; V480-F484 HydrophobicContact CG1-CE2 3.73Å; V480-F484 HydrophobicContact CG1-CG 4.43Å; V480-F484 HydrophobicContact CG1-CZ 3.53Å; V480-F484 WeakPolarHBondContact O-CB 3.41Å; V480-F484 VanDerWaalsContact O-CG 3.32Å; V480-F484 WeakPolarHBondContact O-CG 3.26Å; V480-F484 PolarHBondContact O-N 3.06Å; V480-F522 HydrophobicContact CG1-CE1 4.31Å; V480-F522 HydrophobicContact CG1-CE2 4.39Å; V480-F522 HydrophobicContact CG1-CZ 3.93Å
481	H	75.2	Confident	72.2	Confident	18.5 Å²	18.5	44.2 Å²	44.2	9%	0.086	24%	0.236	C	C	.	.	H	α-helix	trans	-57.8	-51.4	172.2	-128.3	-120.5	0	0	0	111.7	N477 S478 K479 F484 K485 A584 I588	N477-H481 WeakPolarHBondContact O-CB 3.2Å; N477-H481 PolarHBondContact O-N 3.18Å; S478-H481 WeakPolarHBondContact O-CA 3.25Å; S478-H481 WeakPolarHBondContact O-CB 3.23Å; S478-H481 PolarHBondContact O-N 3.15Å; S478-H481 VanDerWaalsContact O-N 3.09Å; K479-H481 VanDerWaalsContact C-N 3.35Å; H481-F484 PolarHBondContact O-N 3.24Å; H481-K485 VanDerWaalsContact O-CB 3.3Å; H481-K485 WeakPolarHBondContact O-CB 3.35Å; H481-K485 PolarHBondContact O-N 2.75Å; H481-A584 PolarHBondContact CE1-O 3.11Å; H481-I588 VanDerWaalsContact CD2-CG1 3.45Å; H481-I588 WeakPolarHBondContact CD2-CG1 3.35Å; H481-I588 VanDerWaalsContact NE2-CG1 3.33Å; H481-I588 WeakPolarHBondContact NE2-CG1 3.43Å
482	D	76.6	Confident	73.6	Confident	83 Å²	83	38.1 Å²	38.1	44%	0.444	21%	0.208	S	C	.	.	H	α-helix	trans	-64.5	-41.5	-178.9	-67.9	-43.5	0	0	0	111.7	S478 K479 K485 S486	S478-D482 PolarHBondContact O-N 3.13Å; K479-D482 PolarHBondContact O-N 3.21Å; D482-K485 WeakPolarHBondContact O-CB 3.49Å; D482-K485 PolarHBondContact O-N 3Å; D482-K485 VanDerWaalsContact O-N 3.17Å; D482-S486 WeakPolarHBondContact O-CB 3.35Å; D482-S486 PolarHBondContact O-N 3.04Å; D482-S486 PolarHBondContact O-OG 3.33Å
483	L	80.9	Confident	75.3	Confident	6 Å²	6	37 Å²	37	3%	0.031	19%	0.194	C	C	.	.	H	α-helix	trans	-61.2	-48.1	174.8	-179.7	64.1	0	0	0	111.5	L413 Q414 A417 I451 A455 K479 K485 S486 I487	L413-L483 HydrophobicContact CB-CD1 4.15Å; L413-L483 HydrophobicContact CB-CD2 3.96Å; L413-L483 HydrophobicContact CD1-CD2 4.05Å; Q414-L483 VanDerWaalsContact OE1-CA 3.24Å; Q414-L483 VanDerWaalsContact OE1-N 3.16Å; A417-L483 HydrophobicContact CB-CD1 3.81Å; I451-L483 HydrophobicContact CG2-CD1 4.2Å; I451-L483 HydrophobicContact CG2-CD2 4.2Å; I451-L483 HydrophobicContact CG2-CG 4.49Å; A455-L483 HydrophobicContact CB-CD2 3.67Å; K479-L483 WeakPolarHBondContact O-CB 3.4Å; K479-L483 PolarHBondContact O-N 3.34Å; K479-L483 VanDerWaalsContact O-N 3.11Å; L483-K485 VanDerWaalsContact C-N 3.31Å; L483-K485 PolarHBondContact O-N 3.4Å; L483-S486 WeakPolarHBondContact O-CB 3.23Å; L483-S486 PolarHBondContact O-N 3.32Å; L483-S486 VanDerWaalsContact O-N 3.15Å; L483-I487 HydrophobicContact CD1-CD1 4.16Å; L483-I487 HydrophobicContact CD1-CG1 4.48Å; L483-I487 HydrophobicContact CG-CD1 3.96Å; L483-I487 VanDerWaalsContact O-CG1 3.31Å; L483-I487 WeakPolarHBondContact O-CG1 3.34Å; L483-I487 PolarHBondContact O-N 3.22Å
484	F	82.7	Confident	76.5	Confident	0.5 Å²	0.5	36 Å²	36	0%	0.002	19%	0.186	C	C	.	.	H	α-helix	trans	-64.1	-38.7	176.6	-70	-0.6	0	0	0	111.5	L452 A455 V480 H481 S486 I487 V488 V513 I516 F522 I588	L452-F484 HydrophobicContact CD2-CD1 3.93Å; L452-F484 HydrophobicContact CD2-CE1 3.55Å; L452-F484 HydrophobicContact CD2-CZ 4.37Å; A455-F484 HydrophobicContact CB-CE1 4.43Å; V480-F484 HydrophobicContact CG1-CD1 4.26Å; V480-F484 HydrophobicContact CG1-CD2 4.18Å; V480-F484 HydrophobicContact CG1-CE1 3.83Å; V480-F484 HydrophobicContact CG1-CE2 3.73Å; V480-F484 HydrophobicContact CG1-CG 4.43Å; V480-F484 HydrophobicContact CG1-CZ 3.53Å; V480-F484 WeakPolarHBondContact O-CB 3.41Å; V480-F484 VanDerWaalsContact O-CG 3.32Å; V480-F484 WeakPolarHBondContact O-CG 3.26Å; V480-F484 PolarHBondContact O-N 3.06Å; H481-F484 PolarHBondContact O-N 3.24Å; F484-S486 PolarHBondContact O-N 3.09Å; F484-I487 PolarHBondContact O-N 3.18Å; F484-V488 WeakPolarHBondContact O-CB 3.27Å; F484-V488 VanDerWaalsContact O-CG2 3.23Å; F484-V488 WeakPolarHBondContact O-CG2 3.23Å; F484-V488 PolarHBondContact O-N 3.15Å; F484-V513 HydrophobicContact CD2-CG1 4.46Å; F484-I516 HydrophobicContact CE2-CG2 3.77Å; F484-I516 HydrophobicContact CZ-CG2 3.79Å; F484-F522 HydrophobicContact CE2-CD2 4.12Å; F484-F522 AromaticContact CE2-CE2 3.98Å; F484-F522 HydrophobicContact CE2-CE2 3.99Å; F484-F522 HydrophobicContact CZ-CE2 4.48Å; F484-I588 HydrophobicContact CB-CG2 3.86Å; F484-I588 HydrophobicContact CD2-CD1 4.4Å; F484-I588 HydrophobicContact CD2-CG2 4.44Å
485	K	82.1	Confident	77.5	Confident	25.5 Å²	25.5	33 Å²	33	11%	0.111	17%	0.165	C	C	.	.	H	α-helix	trans	-61.9	-36.5	175.4	-158.7	166.3	-168.4	167.8	0	111.8	H481 D482 L483 R489 D587 E590 P591	H481-K485 VanDerWaalsContact O-CB 3.3Å; H481-K485 WeakPolarHBondContact O-CB 3.35Å; H481-K485 PolarHBondContact O-N 2.75Å; D482-K485 WeakPolarHBondContact O-CB 3.49Å; D482-K485 PolarHBondContact O-N 3Å; D482-K485 VanDerWaalsContact O-N 3.17Å; L483-K485 VanDerWaalsContact C-N 3.31Å; L483-K485 PolarHBondContact O-N 3.4Å; K485-R489 WeakPolarHBondContact O-CD 3.4Å; K485-R489 VanDerWaalsContact O-CG 3.24Å; K485-R489 WeakPolarHBondContact O-CG 3.43Å; K485-R489 PolarHBondContact O-N 2.75Å; K485-D587 HydrophobicContact CD-CB 4.49Å; K485-D587 WeakPolarHBondContact CE-O 3.42Å; K485-D587 PolarHBondContact NZ-O 3.5Å; K485-D587 IonicContact NZ-OD2 2.63Å; K485-D587 PolarHBondContact NZ-OD2 2.73Å; K485-E590 WeakPolarHBondContact CE-OE2 3.34Å; K485-E590 IonicContact NZ-OE2 3.33Å; K485-E590 PolarHBondContact NZ-OE2 3.45Å; K485-P591 HydrophobicContact CG-CG 3.95Å
486	S	81.7	Confident	78.3	Confident	5.5 Å²	5.5	31.6 Å²	31.6	4%	0.038	16%	0.161	C	C	.	.	H	α-helix	trans	-72.1	-44.5	174.5	-66	0	0	0	0	112.6	Q414 D418 D482 L483 F484 V488 R489 F490	Q414-S486 PolarHBondContact NE2-OG 3.16Å; D418-S486 WeakPolarHBondContact OD1-CB 3.39Å; D418-S486 PolarHBondContact OD1-OG 2.92Å; D482-S486 WeakPolarHBondContact O-CB 3.35Å; D482-S486 PolarHBondContact O-N 3.04Å; D482-S486 PolarHBondContact O-OG 3.33Å; L483-S486 WeakPolarHBondContact O-CB 3.23Å; L483-S486 PolarHBondContact O-N 3.32Å; L483-S486 VanDerWaalsContact O-N 3.15Å; F484-S486 PolarHBondContact O-N 3.09Å; S486-V488 PolarHBondContact O-N 2.93Å; S486-R489 PolarHBondContact O-N 3.29Å; S486-F490 PolarHBondContact O-N 3.46Å
487	I	84.5	Confident	78.9	Confident	2.5 Å²	2.5	35.3 Å²	35.3	1%	0.013	18%	0.175	C	C	.	.	H	α-helix	trans	-61.7	-44	175.9	-67.7	166.5	0	0	0	111.2	L448 I451 L452 L483 F484 R489 F490 C491 V509 V513	L448-I487 HydrophobicContact CD2-CG1 4.48Å; L448-I487 HydrophobicContact CD2-CG2 4.42Å; I451-I487 HydrophobicContact CG2-CD1 3.76Å; L452-I487 HydrophobicContact CD2-CD1 3.83Å; L452-I487 HydrophobicContact CG-CD1 4.45Å; L483-I487 HydrophobicContact CD1-CD1 4.16Å; L483-I487 HydrophobicContact CD1-CG1 4.48Å; L483-I487 HydrophobicContact CG-CD1 3.96Å; L483-I487 VanDerWaalsContact O-CG1 3.31Å; L483-I487 WeakPolarHBondContact O-CG1 3.34Å; L483-I487 PolarHBondContact O-N 3.22Å; F484-I487 PolarHBondContact O-N 3.18Å; I487-R489 PolarHBondContact O-N 3.42Å; I487-F490 WeakPolarHBondContact O-CB 3.46Å; I487-F490 PolarHBondContact O-N 2.91Å; I487-C491 PolarHBondContact O-N 2.98Å; I487-C491 PolarHBondContact O-SG 3.25Å; I487-C491 VanDerWaalsContact O-SG 3.38Å; I487-V509 HydrophobicContact CG2-CG1 3.75Å; I487-V513 HydrophobicContact CG2-CG2 4.33Å
488	V	84.4	Confident	79.1	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-61.9	-45	177.7	169.1	0	0	0	0	110.9	F484 S486 F490 C491 L492 L510 V513 P591 L592	F484-V488 WeakPolarHBondContact O-CB 3.27Å; F484-V488 VanDerWaalsContact O-CG2 3.23Å; F484-V488 WeakPolarHBondContact O-CG2 3.23Å; F484-V488 PolarHBondContact O-N 3.15Å; S486-V488 PolarHBondContact O-N 2.93Å; V488-F490 VanDerWaalsContact C-N 3.34Å; V488-F490 PolarHBondContact O-N 3.05Å; V488-C491 PolarHBondContact O-N 3.22Å; V488-L492 HydrophobicContact CG1-CD1 3.93Å; V488-L492 HydrophobicContact CG1-CG 4.41Å; V488-L492 VanDerWaalsContact O-CG 3.28Å; V488-L492 WeakPolarHBondContact O-CG 3.41Å; V488-L492 PolarHBondContact O-N 2.95Å; V488-L510 HydrophobicContact CB-CD2 4.37Å; V488-L510 HydrophobicContact CG1-CD2 4.16Å; V488-L510 HydrophobicContact CG2-CD2 4.06Å; V488-V513 HydrophobicContact CG2-CG1 4.02Å; V488-P591 HydrophobicContact CG1-CB 3.97Å; V488-P591 HydrophobicContact CG1-CG 4.32Å; V488-L592 HydrophobicContact CG1-CD1 3.69Å; V488-L592 HydrophobicContact CG1-CD2 4.47Å; V488-L592 HydrophobicContact CG1-CG 3.63Å; V488-L592 HydrophobicContact CG2-CD1 4.21Å
489	R	83.6	Confident	79.2	Confident	119.5 Å²	119.5	30.7 Å²	30.7	45%	0.451	15%	0.148	S	C	.	.	H	α-helix	trans	-55.7	-48.1	173.6	-75.9	165.7	175.3	158.1	-3.7	111.6	L421 K485 S486 I487 C491 L492 L493 P591	L421-R489 HydrophobicContact CD2-CB 4.19Å; K485-R489 WeakPolarHBondContact O-CD 3.4Å; K485-R489 VanDerWaalsContact O-CG 3.24Å; K485-R489 WeakPolarHBondContact O-CG 3.43Å; K485-R489 PolarHBondContact O-N 2.75Å; S486-R489 PolarHBondContact O-N 3.29Å; I487-R489 PolarHBondContact O-N 3.42Å; R489-C491 VanDerWaalsContact C-N 3.34Å; R489-C491 PolarHBondContact O-N 3.26Å; R489-L492 PolarHBondContact O-N 3.02Å; R489-L493 WeakPolarHBondContact O-CD1 3.42Å; R489-L493 WeakPolarHBondContact O-CG 3.34Å; R489-L493 PolarHBondContact O-N 3.34Å; R489-L493 VanDerWaalsContact O-N 3.09Å; R489-P591 HydrophobicContact CG-CB 4.41Å; R489-P591 HydrophobicContact CG-CG 4.47Å
490	F	83.1	Confident	79.3	Confident	6.5 Å²	6.5	28.9 Å²	28.9	3%	0.029	15%	0.151	C	C	.	.	H	α-helix	trans	-59.3	-43.6	178.1	-178.5	-104.3	0	0	0	112	L420 L421 I427 I444 L448 S486 I487 V488 L492 L493 L494	L420-F490 HydrophobicContact CB-CD2 4.23Å; L420-F490 HydrophobicContact CB-CE2 4.03Å; L420-F490 HydrophobicContact CB-CZ 4.42Å; L420-F490 WeakPolarHBondContact O-CE2 3.42Å; L421-F490 HydrophobicContact CD2-CB 3.81Å; L421-F490 HydrophobicContact CD2-CD2 4.29Å; L421-F490 HydrophobicContact CG-CB 4.35Å; I427-F490 HydrophobicContact CD1-CE2 3.77Å; I427-F490 HydrophobicContact CD1-CZ 3.97Å; I444-F490 HydrophobicContact CG2-CE1 4.15Å; I444-F490 HydrophobicContact CG2-CZ 4.48Å; L448-F490 HydrophobicContact CD1-CD1 4.22Å; L448-F490 HydrophobicContact CD1-CE1 4.08Å; S486-F490 PolarHBondContact O-N 3.46Å; I487-F490 WeakPolarHBondContact O-CB 3.46Å; I487-F490 PolarHBondContact O-N 2.91Å; V488-F490 VanDerWaalsContact C-N 3.34Å; V488-F490 PolarHBondContact O-N 3.05Å; F490-L492 PolarHBondContact O-N 3.21Å; F490-L493 WeakPolarHBondContact O-CB 3.28Å; F490-L493 PolarHBondContact O-N 3.17Å; F490-L494 HydrophobicContact CD1-CD1 4.09Å; F490-L494 HydrophobicContact CD1-CG 4.47Å; F490-L494 HydrophobicContact CE1-CD1 3.57Å; F490-L494 HydrophobicContact CE1-CG 4.16Å; F490-L494 HydrophobicContact CZ-CD1 4.04Å; F490-L494 HydrophobicContact CZ-CD2 4.38Å; F490-L494 HydrophobicContact CZ-CG 4.3Å; F490-L494 PolarHBondContact O-N 3.22Å; F490-L494 VanDerWaalsContact O-N 3.09Å
491	C	84.4	Confident	79.2	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-64.2	-39.6	175.9	-64.6	0	0	0	0	112.8	I487 V488 R489 L493 L494 L495 A506 L510	I487-C491 PolarHBondContact O-N 2.98Å; I487-C491 PolarHBondContact O-SG 3.25Å; I487-C491 VanDerWaalsContact O-SG 3.38Å; V488-C491 PolarHBondContact O-N 3.22Å; R489-C491 VanDerWaalsContact C-N 3.34Å; R489-C491 PolarHBondContact O-N 3.26Å; C491-L493 VanDerWaalsContact C-N 3.28Å; C491-L493 PolarHBondContact O-N 3.13Å; C491-L494 PolarHBondContact O-N 3.12Å; C491-L495 WeakPolarHBondContact O-CG 3.34Å; C491-L495 PolarHBondContact O-N 3.11Å; C491-A506 HydrophobicContact CB-CB 4.06Å; C491-A506 WeakPolarHBondContact O-CB 3.32Å; C491-L510 HydrophobicContact CB-CD1 3.83Å; C491-L510 HydrophobicContact CB-CD2 3.79Å; C491-L510 HydrophobicContact CB-CG 3.58Å
492	L	82.6	Confident	79.4	Confident	21.5 Å²	21.5	28.6 Å²	28.6	11%	0.113	15%	0.152	C	C	.	.	H	α-helix	trans	-63.3	-34.4	176.5	-68.8	166.7	0	0	0	112.4	V488 R489 F490 L495 T496 P591 L592 L595	V488-L492 HydrophobicContact CG1-CD1 3.93Å; V488-L492 HydrophobicContact CG1-CG 4.41Å; V488-L492 VanDerWaalsContact O-CG 3.28Å; V488-L492 WeakPolarHBondContact O-CG 3.41Å; V488-L492 PolarHBondContact O-N 2.95Å; R489-L492 PolarHBondContact O-N 3.02Å; F490-L492 PolarHBondContact O-N 3.21Å; L492-L495 PolarHBondContact O-N 2.86Å; L492-T496 WeakPolarHBondContact O-CG2 3.41Å; L492-T496 PolarHBondContact O-N 3.28Å; L492-T496 VanDerWaalsContact O-N 3.09Å; L492-T496 PolarHBondContact O-OG1 3.13Å; L492-P591 HydrophobicContact CD1-CB 3.75Å; L492-P591 VanDerWaalsContact CD1-O 3.25Å; L492-P591 WeakPolarHBondContact CD1-O 3.31Å; L492-L592 HydrophobicContact CD2-CD2 4.11Å; L492-L595 HydrophobicContact CD2-CB 4.09Å; L492-L595 HydrophobicContact CD2-CD1 4.3Å; L492-L595 HydrophobicContact CD2-CD2 3.73Å; L492-L595 HydrophobicContact CD2-CG 4.25Å
493	L	81	Confident	79.6	Confident	32.5 Å²	32.5	28.9 Å²	28.9	17%	0.17	15%	0.147	C	C	.	.	H	α-helix	trans	-68.5	-42.9	174	-69.7	157.5	0	0	0	111.8	L421 E424 R489 F490 C491 L495 T496 K497	L421-L493 HydrophobicContact CD2-CD1 3.75Å; E424-L493 VanDerWaalsContact CD-CD1 3.42Å; E424-L493 HydrophobicContact CG-CD1 3.83Å; E424-L493 WeakPolarHBondContact OE1-CD1 3.35Å; E424-L493 VanDerWaalsContact OE2-CD2 3.29Å; E424-L493 WeakPolarHBondContact OE2-CD2 3.31Å; R489-L493 WeakPolarHBondContact O-CD1 3.42Å; R489-L493 WeakPolarHBondContact O-CG 3.34Å; R489-L493 PolarHBondContact O-N 3.34Å; R489-L493 VanDerWaalsContact O-N 3.09Å; F490-L493 WeakPolarHBondContact O-CB 3.28Å; F490-L493 PolarHBondContact O-N 3.17Å; C491-L493 VanDerWaalsContact C-N 3.28Å; C491-L493 PolarHBondContact O-N 3.13Å; L493-L495 VanDerWaalsContact C-N 3.32Å; L493-L495 PolarHBondContact O-N 3.34Å; L493-T496 PolarHBondContact O-N 3.24Å; L493-T496 PolarHBondContact O-OG1 3.12Å; L493-K497 HydrophobicContact CD2-CD 4.47Å; L493-K497 WeakPolarHBondContact O-CB 3.37Å; L493-K497 PolarHBondContact O-N 3.28Å
494	L	80.7	Confident	79.8	Confident	2.5 Å²	2.5	29 Å²	29	1%	0.013	15%	0.147	C	C	.	.	H	α-helix	trans	-64	-32.4	172.3	-68.2	-176.4	0	0	0	113.1	I427 L428 F490 C491 G498 T505 A506	I427-L494 HydrophobicContact CG2-CD2 4.04Å; L428-L494 HydrophobicContact CD2-CD2 4.04Å; F490-L494 HydrophobicContact CD1-CD1 4.09Å; F490-L494 HydrophobicContact CD1-CG 4.47Å; F490-L494 HydrophobicContact CE1-CD1 3.57Å; F490-L494 HydrophobicContact CE1-CG 4.16Å; F490-L494 HydrophobicContact CZ-CD1 4.04Å; F490-L494 HydrophobicContact CZ-CD2 4.38Å; F490-L494 HydrophobicContact CZ-CG 4.3Å; F490-L494 PolarHBondContact O-N 3.22Å; F490-L494 VanDerWaalsContact O-N 3.09Å; C491-L494 PolarHBondContact O-N 3.12Å; L494-G498 VanDerWaalsContact O-CA 3.24Å; L494-G498 WeakPolarHBondContact O-CA 3.41Å; L494-G498 PolarHBondContact O-N 2.88Å; L494-G498 VanDerWaalsContact O-N 3.15Å; L494-T505 HydrophobicContact CD1-CG2 4.29Å; L494-A506 HydrophobicContact CB-CB 3.87Å
495	L	79.7	Confident	79.9	Confident	4.5 Å²	4.5	29 Å²	29	2%	0.024	15%	0.147	C	C	.	.	H	α-helix	trans	-70.2	-41.8	175	-72.5	-177.1	0	0	0	113	C491 L492 L493 R503 A506 F507 L510 L600 L603	C491-L495 WeakPolarHBondContact O-CG 3.34Å; C491-L495 PolarHBondContact O-N 3.11Å; L492-L495 PolarHBondContact O-N 2.86Å; L493-L495 VanDerWaalsContact C-N 3.32Å; L493-L495 PolarHBondContact O-N 3.34Å; L495-R503 HydrophobicContact CD2-CB 4.33Å; L495-R503 HydrophobicContact CD2-CG 4.32Å; L495-A506 HydrophobicContact CD2-CB 3.7Å; L495-A506 HydrophobicContact CG-CB 3.78Å; L495-F507 HydrophobicContact CD1-CD1 4.04Å; L495-F507 HydrophobicContact CD1-CE1 3.73Å; L495-F507 HydrophobicContact CD1-CZ 4.47Å; L495-F507 HydrophobicContact CD2-CD1 3.59Å; L495-F507 HydrophobicContact CD2-CD2 4.02Å; L495-F507 HydrophobicContact CD2-CE1 3.39Å; L495-F507 VanDerWaalsContact CD2-CE1 3.4Å; L495-F507 HydrophobicContact CD2-CE2 3.83Å; L495-F507 HydrophobicContact CD2-CG 3.91Å; L495-F507 HydrophobicContact CD2-CZ 3.51Å; L495-F507 HydrophobicContact CG-CD1 4.46Å; L495-F507 HydrophobicContact CG-CE1 4.22Å; L495-L510 HydrophobicContact CD1-CD1 3.76Å; L495-L600 HydrophobicContact CD1-CD2 4.48Å; L495-L603 HydrophobicContact CB-CD1 4.45Å
496	T	75.9	Confident	80.1	Confident	76.5 Å²	76.5	27.7 Å²	27.7	47%	0.469	14%	0.141	S	C	.	.	H	α-helix	trans	-82.8	-35	-174.3	48	0	0	0	0	113.5	L492 L493 V599	L492-T496 WeakPolarHBondContact O-CG2 3.41Å; L492-T496 PolarHBondContact O-N 3.28Å; L492-T496 VanDerWaalsContact O-N 3.09Å; L492-T496 PolarHBondContact O-OG1 3.13Å; L493-T496 PolarHBondContact O-N 3.24Å; L493-T496 PolarHBondContact O-OG1 3.12Å; T496-V599 HydrophobicContact CG2-CG1 4.48Å
497	K	73.5	Confident	80.4	Confident	94.5 Å²	94.5	27.9 Å²	27.9	41%	0.411	14%	0.142	S	C	.	.	H	α-helix	trans	-117.6	2	-173.3	-57.7	171.8	-172	171.5	0	113.9	E424 L428 H432 L493	E424-K497 IonicContact OE2-NZ 3.22Å; E424-K497 PolarHBondContact OE2-NZ 3.1Å; L428-K497 HydrophobicContact CD1-CB 3.79Å; L428-K497 HydrophobicContact CD1-CD 3.45Å; L428-K497 VanDerWaalsContact CD1-CD 3.45Å; L428-K497 HydrophobicContact CD1-CG 4.29Å; L428-K497 HydrophobicContact CD2-CB 3.72Å; L428-K497 HydrophobicContact CG-CB 4.24Å; H432-K497 PolarHBondContact CD2-O 2.82Å; H432-K497 PolarHBondContact NE2-O 3.2Å; H432-K497 VanDerWaalsContact NE2-O 3.09Å; L493-K497 HydrophobicContact CD2-CD 4.47Å; L493-K497 WeakPolarHBondContact O-CB 3.37Å; L493-K497 PolarHBondContact O-N 3.28Å
498	G	70.8	Confident	80.6	Confident	0.5 Å²	0.5	29.9 Å²	29.9	1%	0.005	15%	0.151	C	C	.	.			trans	-102	164.9	-173.1	0	0	0	0	0	116	L494 S502 R503	L494-G498 VanDerWaalsContact O-CA 3.24Å; L494-G498 WeakPolarHBondContact O-CA 3.41Å; L494-G498 PolarHBondContact O-N 2.88Å; L494-G498 VanDerWaalsContact O-N 3.15Å; G498-S502 VanDerWaalsContact CA-OG 3.27Å; G498-S502 WeakPolarHBondContact CA-OG 3.43Å; G498-R503 PolarHBondContact O-NE 3.14Å; G498-R503 PolarHBondContact O-NH2 3.35Å
499	G	73.4	Confident	80.7	Confident	10.5 Å²	10.5	29.9 Å²	29.9	11%	0.108	15%	0.151	C	C	.	.			trans	-78.2	-168.1	172.2	0	0	0	0	0	115.1	S431 S502 R503	S431-G499 VanDerWaalsContact O-CA 3.28Å; S431-G499 WeakPolarHBondContact O-CA 3.3Å; S431-G499 PolarHBondContact O-N 3.15Å; G499-S502 PolarHBondContact N-OG 3.25Å; G499-S502 VanDerWaalsContact N-OG 3.1Å; G499-S502 PolarHBondContact O-OG 3.01Å; G499-R503 WeakPolarHBondContact O-CB 3.37Å; G499-R503 WeakPolarHBondContact O-CD 3.29Å; G499-R503 VanDerWaalsContact O-CG 3.27Å; G499-R503 WeakPolarHBondContact O-CG 3.34Å; G499-R503 PolarHBondContact O-N 3.27Å; G499-R503 PolarHBondContact O-NE 3.19Å
500	S	72.8	Confident	80.9	Confident	90.5 Å²	90.5	24.3 Å²	24.3	63%	0.633	13%	0.13	S	C	*	.	H	α-helix	trans	-68.6	-46.5	-174.5	48.3	0	0	0	0	113.7	S502 R503 F504	S500-S502 PolarHBondContact O-N 2.91Å; S500-R503 PolarHBondContact O-N 3.29Å; S500-F504 PolarHBondContact O-N 3.09Å; S500-F504 VanDerWaalsContact O-N 3.07Å
501	C	74.3	Confident	81.1	Confident	18.5 Å²	18.5	24.3 Å²	24.3	13%	0.125	13%	0.13	C	C	.	.	H	α-helix	trans	-62	-43.2	176.9	-67.5	0	0	0	0	111.3	C438 D441 R503 F504 T505	C438-C501 VanDerWaalsContact CA-SG 3.58Å; C438-C501 HydrophobicContact CB-CB 4.08Å; C438-C501 WeakPolarHBondContact CB-SG 3.36Å; C438-C501 WeakPolarHBondContact SG-CB 3.37Å; C438-C501 CovalentContact SG-SG 2.05Å; C438-C501 PolarHBondContact SG-SG 3Å; D441-C501 HydrophobicContact CB-CB 3.98Å; D441-C501 VanDerWaalsContact OD2-C 3.25Å; D441-C501 WeakPolarHBondContact OD2-CB 3.41Å; C501-R503 PolarHBondContact O-N 3.26Å; C501-F504 WeakPolarHBondContact O-CB 3.3Å; C501-F504 PolarHBondContact O-N 2.92Å; C501-F504 VanDerWaalsContact O-N 3.14Å; C501-T505 PolarHBondContact O-N 2.98Å; C501-T505 VanDerWaalsContact O-N 3.08Å; C501-T505 PolarHBondContact O-OG1 3.39Å
502	S	77.9	Confident	81.2	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-72.3	-29.9	-179.3	70	0	0	0	0	113.8	D441 G498 G499 S500 T505 A506	D441-S502 VanDerWaalsContact CG-CA 3.46Å; D441-S502 WeakPolarHBondContact OD1-CA 3.27Å; D441-S502 WeakPolarHBondContact OD1-CB 3.41Å; D441-S502 WeakPolarHBondContact OD2-CA 3.4Å; D441-S502 PolarHBondContact OD2-N 3.13Å; G498-S502 VanDerWaalsContact CA-OG 3.27Å; G498-S502 WeakPolarHBondContact CA-OG 3.43Å; G499-S502 PolarHBondContact N-OG 3.25Å; G499-S502 VanDerWaalsContact N-OG 3.1Å; G499-S502 PolarHBondContact O-OG 3.01Å; S500-S502 PolarHBondContact O-N 2.91Å; S502-T505 WeakPolarHBondContact O-CB 3.4Å; S502-T505 PolarHBondContact O-N 3.12Å; S502-A506 WeakPolarHBondContact O-CB 3.29Å; S502-A506 PolarHBondContact O-N 2.89Å
503	R	81.7	Confident	81.4	Confident	88.5 Å²	88.5	25.9 Å²	25.9	33%	0.334	14%	0.137	S	C	.	.	H	α-helix	trans	-64.7	-38.9	168.6	-73	170.6	-146.7	167	6.4	111.9	L495 G498 G499 S500 C501 A506 F507	L495-R503 HydrophobicContact CD2-CB 4.33Å; L495-R503 HydrophobicContact CD2-CG 4.32Å; G498-R503 PolarHBondContact O-NE 3.14Å; G498-R503 PolarHBondContact O-NH2 3.35Å; G499-R503 WeakPolarHBondContact O-CB 3.37Å; G499-R503 WeakPolarHBondContact O-CD 3.29Å; G499-R503 VanDerWaalsContact O-CG 3.27Å; G499-R503 WeakPolarHBondContact O-CG 3.34Å; G499-R503 PolarHBondContact O-N 3.27Å; G499-R503 PolarHBondContact O-NE 3.19Å; S500-R503 PolarHBondContact O-N 3.29Å; C501-R503 PolarHBondContact O-N 3.26Å; R503-A506 PolarHBondContact O-N 3.05Å; R503-F507 HydrophobicContact CB-CD2 4.46Å; R503-F507 HydrophobicContact CB-CE2 4.29Å; R503-F507 WeakPolarHBondContact O-CB 3.39Å; R503-F507 WeakPolarHBondContact O-CD2 3.37Å; R503-F507 WeakPolarHBondContact O-CG 3.29Å; R503-F507 PolarHBondContact O-N 3.3Å
504	F	85	Confident	81.5	Confident	8 Å²	8	24.9 Å²	24.9	4%	0.035	13%	0.132	C	C	.	.	H	α-helix	trans	-60.7	-49.2	171.7	-178.9	-76.6	0	0	0	110.6	S500 C501 A506 F507 H508 R626 S627 R628 C633 L637	S500-F504 PolarHBondContact O-N 3.09Å; S500-F504 VanDerWaalsContact O-N 3.07Å; C501-F504 WeakPolarHBondContact O-CB 3.3Å; C501-F504 PolarHBondContact O-N 2.92Å; C501-F504 VanDerWaalsContact O-N 3.14Å; F504-A506 VanDerWaalsContact C-N 3.34Å; F504-A506 PolarHBondContact O-N 3.46Å; F504-F507 PolarHBondContact O-N 2.86Å; F504-H508 HydrophobicContact CD1-CB 4.4Å; F504-H508 HydrophobicContact CE1-CB 4.13Å; F504-H508 VanDerWaalsContact O-CB 3.3Å; F504-H508 WeakPolarHBondContact O-CB 3.18Å; F504-H508 PolarHBondContact O-N 2.89Å; F504-R626 HydrophobicContact CE2-CB 4.4Å; F504-R626 HydrophobicContact CZ-CB 4.26Å; F504-S627 VanDerWaalsContact CE2-C 3.47Å; F504-S627 WeakPolarHBondContact CE2-O 3.32Å; F504-R628 HydrophobicContact CD1-CB 4.29Å; F504-R628 HydrophobicContact CD1-CG 3.6Å; F504-R628 HydrophobicContact CE1-CB 4.44Å; F504-R628 HydrophobicContact CE1-CG 3.62Å; F504-R628 HydrophobicContact CG-CG 4.28Å; F504-R628 HydrophobicContact CZ-CG 4.28Å; F504-C633 HydrophobicContact CD2-CB 4.37Å; F504-C633 HydrophobicContact CE2-CB 3.72Å; F504-L637 HydrophobicContact CD2-CD1 4.27Å; F504-L637 HydrophobicContact CE2-CD1 3.9Å; F504-L637 HydrophobicContact CZ-CD1 4.12Å
505	T	84.2	Confident	81.6	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-51.9	-51.4	176.1	-66.9	0	0	0	0	111.5	D441 I444 S445 L494 C501 S502 H508 V509 R628	D441-T505 PolarHBondContact O-OG1 3.14Å; D441-T505 PolarHBondContact OD1-OG1 3.06Å; I444-T505 HydrophobicContact CG2-CG2 4.17Å; S445-T505 VanDerWaalsContact OG-CG2 3.23Å; S445-T505 WeakPolarHBondContact OG-CG2 3.42Å; S445-T505 PolarHBondContact OG-OG1 2.96Å; S445-T505 VanDerWaalsContact OG-OG1 3.11Å; L494-T505 HydrophobicContact CD1-CG2 4.29Å; C501-T505 PolarHBondContact O-N 2.98Å; C501-T505 VanDerWaalsContact O-N 3.08Å; C501-T505 PolarHBondContact O-OG1 3.39Å; S502-T505 WeakPolarHBondContact O-CB 3.4Å; S502-T505 PolarHBondContact O-N 3.12Å; T505-H508 PolarHBondContact O-N 3.02Å; T505-V509 WeakPolarHBondContact O-CG2 3.46Å; T505-V509 PolarHBondContact O-N 3.23Å; T505-R628 PolarHBondContact OG1-NH1 3.27Å; T505-R628 VanDerWaalsContact OG1-NH1 3.1Å
506	A	86.3	Confident	81.7	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-64	-46.2	-179.8	0	0	0	0	0	112.9	C491 L494 L495 S502 R503 F504 H508 L510	C491-A506 HydrophobicContact CB-CB 4.06Å; C491-A506 WeakPolarHBondContact O-CB 3.32Å; L494-A506 HydrophobicContact CB-CB 3.87Å; L495-A506 HydrophobicContact CD2-CB 3.7Å; L495-A506 HydrophobicContact CG-CB 3.78Å; S502-A506 WeakPolarHBondContact O-CB 3.29Å; S502-A506 PolarHBondContact O-N 2.89Å; R503-A506 PolarHBondContact O-N 3.05Å; F504-A506 VanDerWaalsContact C-N 3.34Å; F504-A506 PolarHBondContact O-N 3.46Å; A506-H508 VanDerWaalsContact C-N 3.32Å; A506-H508 PolarHBondContact O-N 3.37Å; A506-L510 VanDerWaalsContact O-CB 3.28Å; A506-L510 WeakPolarHBondContact O-CB 3.37Å; A506-L510 VanDerWaalsContact O-CG 3.22Å; A506-L510 WeakPolarHBondContact O-CG 3.21Å; A506-L510 PolarHBondContact O-N 3.23Å
507	F	88.1	Confident	81.8	Confident	9 Å²	9	24.8 Å²	24.8	4%	0.039	13%	0.128	C	C	.	.	H	α-helix	trans	-65.2	-33.3	176.5	-69	-48.8	0	0	0	112.6	L495 R503 F504 N511 L600 L637 C638 I641	L495-F507 HydrophobicContact CD1-CD1 4.04Å; L495-F507 HydrophobicContact CD1-CE1 3.73Å; L495-F507 HydrophobicContact CD1-CZ 4.47Å; L495-F507 HydrophobicContact CD2-CD1 3.59Å; L495-F507 HydrophobicContact CD2-CD2 4.02Å; L495-F507 HydrophobicContact CD2-CE1 3.39Å; L495-F507 VanDerWaalsContact CD2-CE1 3.4Å; L495-F507 HydrophobicContact CD2-CE2 3.83Å; L495-F507 HydrophobicContact CD2-CG 3.91Å; L495-F507 HydrophobicContact CD2-CZ 3.51Å; L495-F507 HydrophobicContact CG-CD1 4.46Å; L495-F507 HydrophobicContact CG-CE1 4.22Å; R503-F507 HydrophobicContact CB-CD2 4.46Å; R503-F507 HydrophobicContact CB-CE2 4.29Å; R503-F507 WeakPolarHBondContact O-CB 3.39Å; R503-F507 WeakPolarHBondContact O-CD2 3.37Å; R503-F507 WeakPolarHBondContact O-CG 3.29Å; R503-F507 PolarHBondContact O-N 3.3Å; F504-F507 PolarHBondContact O-N 2.86Å; F507-N511 WeakPolarHBondContact O-CB 3.46Å; F507-N511 PolarHBondContact O-N 3.08Å; F507-N511 VanDerWaalsContact O-N 3.11Å; F507-N511 PolarHBondContact O-ND2 3.33Å; F507-L600 HydrophobicContact CE1-CD2 4.18Å; F507-L637 HydrophobicContact CB-CB 3.76Å; F507-C638 HydrophobicContact CD1-CB 4.18Å; F507-C638 HydrophobicContact CD2-CB 4.22Å; F507-C638 HydrophobicContact CE1-CB 3.74Å; F507-C638 HydrophobicContact CE2-CB 3.8Å; F507-C638 HydrophobicContact CG-CB 4.41Å; F507-C638 HydrophobicContact CZ-CB 3.54Å; F507-C638 VanDerWaalsContact CZ-SG 3.5Å; F507-C638 WeakPolarHBondContact CZ-SG 3.36Å; F507-I641 HydrophobicContact CB-CD1 4.4Å; F507-I641 HydrophobicContact CD1-CD1 3.77Å
508	H	88.4	Confident	81.8	Confident	45 Å²	45	24.1 Å²	24.1	21%	0.208	13%	0.128	C	C	.	.	H	α-helix	trans	-65	-54.5	176.3	-172.7	-116.4	0	0	0	111.2	E449 F504 T505 A506 L510 N511 Q512 L637	E449-H508 IonicContact OE1-CE1 2.91Å; E449-H508 PolarHBondContact OE1-CE1 3.31Å; E449-H508 IonicContact OE1-ND1 3.2Å; E449-H508 PolarHBondContact OE1-ND1 3.18Å; E449-H508 VanDerWaalsContact OE1-ND1 3.09Å; F504-H508 HydrophobicContact CD1-CB 4.4Å; F504-H508 HydrophobicContact CE1-CB 4.13Å; F504-H508 VanDerWaalsContact O-CB 3.3Å; F504-H508 WeakPolarHBondContact O-CB 3.18Å; F504-H508 PolarHBondContact O-N 2.89Å; T505-H508 PolarHBondContact O-N 3.02Å; A506-H508 VanDerWaalsContact C-N 3.32Å; A506-H508 PolarHBondContact O-N 3.37Å; H508-L510 PolarHBondContact O-N 3.26Å; H508-N511 WeakPolarHBondContact O-CB 3.32Å; H508-N511 PolarHBondContact O-N 3.48Å; H508-Q512 PolarHBondContact CE1-NE2 3.22Å; H508-Q512 VanDerWaalsContact CE1-NE2 3.26Å; H508-Q512 PolarHBondContact O-N 2.98Å; H508-L637 HydrophobicContact CB-CD1 4.42Å
509	V	87	Confident	82	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-65	-39.6	-178.9	175.7	0	0	0	0	111.2	L448 L452 I487 T505 N511 Q512 V513	L448-V509 HydrophobicContact CB-CG1 4.37Å; L448-V509 HydrophobicContact CB-CG2 4.01Å; L448-V509 HydrophobicContact CD1-CG1 4.42Å; L448-V509 HydrophobicContact CD1-CG2 3.99Å; L452-V509 HydrophobicContact CD1-CG1 4.18Å; I487-V509 HydrophobicContact CG2-CG1 3.75Å; T505-V509 WeakPolarHBondContact O-CG2 3.46Å; T505-V509 PolarHBondContact O-N 3.23Å; V509-N511 VanDerWaalsContact C-N 3.35Å; V509-N511 PolarHBondContact O-N 3.27Å; V509-Q512 PolarHBondContact O-N 3.12Å; V509-V513 HydrophobicContact CG1-CG2 4.39Å; V509-V513 WeakPolarHBondContact O-CG2 3.37Å; V509-V513 PolarHBondContact O-N 2.96Å
510	L	87.6	Confident	81.9	Confident	1.5 Å²	1.5	32.3 Å²	32.3	1%	0.008	17%	0.173	C	C	.	.	H	α-helix	trans	-63	-38.8	174.5	-73.6	171.8	0	0	0	112.8	V488 C491 L495 A506 H508 V513 I514 L592 I641	V488-L510 HydrophobicContact CB-CD2 4.37Å; V488-L510 HydrophobicContact CG1-CD2 4.16Å; V488-L510 HydrophobicContact CG2-CD2 4.06Å; C491-L510 HydrophobicContact CB-CD1 3.83Å; C491-L510 HydrophobicContact CB-CD2 3.79Å; C491-L510 HydrophobicContact CB-CG 3.58Å; L495-L510 HydrophobicContact CD1-CD1 3.76Å; A506-L510 VanDerWaalsContact O-CB 3.28Å; A506-L510 WeakPolarHBondContact O-CB 3.37Å; A506-L510 VanDerWaalsContact O-CG 3.22Å; A506-L510 WeakPolarHBondContact O-CG 3.21Å; A506-L510 PolarHBondContact O-N 3.23Å; H508-L510 PolarHBondContact O-N 3.26Å; L510-V513 PolarHBondContact O-N 3.13Å; L510-I514 WeakPolarHBondContact O-CB 3.25Å; L510-I514 WeakPolarHBondContact O-CD1 3.25Å; L510-I514 VanDerWaalsContact O-CG1 3.27Å; L510-I514 WeakPolarHBondContact O-CG1 3.37Å; L510-I514 PolarHBondContact O-N 2.95Å; L510-L592 HydrophobicContact CD1-CD2 4.41Å; L510-L592 HydrophobicContact CD2-CD1 4.25Å; L510-L592 HydrophobicContact CD2-CD2 4.19Å; L510-I641 HydrophobicContact CB-CD1 3.8Å; L510-I641 HydrophobicContact CD1-CD1 4.46Å
511	N	87.9	Confident	81.5	Confident	6.5 Å²	6.5	30.3 Å²	30.3	4%	0.035	17%	0.167	C	C	.	.	H	α-helix	trans	-62.4	-44.2	173.2	-90.7	-91.3	0	0	0	111.2	F507 H508 V509 I514 D515 L637 R640 I641	F507-N511 WeakPolarHBondContact O-CB 3.46Å; F507-N511 PolarHBondContact O-N 3.08Å; F507-N511 VanDerWaalsContact O-N 3.11Å; F507-N511 PolarHBondContact O-ND2 3.33Å; H508-N511 WeakPolarHBondContact O-CB 3.32Å; H508-N511 PolarHBondContact O-N 3.48Å; V509-N511 VanDerWaalsContact C-N 3.35Å; V509-N511 PolarHBondContact O-N 3.27Å; N511-I514 PolarHBondContact O-N 2.97Å; N511-D515 WeakPolarHBondContact O-CB 3.35Å; N511-D515 PolarHBondContact O-N 3.23Å; N511-L637 HydrophobicContact CB-CD2 4.26Å; N511-L637 PolarHBondContact ND2-O 2.75Å; N511-R640 WeakPolarHBondContact OD1-CD 3.41Å; N511-R640 WeakPolarHBondContact OD1-CG 3.36Å; N511-R640 PolarHBondContact OD1-NH1 3Å; N511-I641 VanDerWaalsContact ND2-CD1 3.34Å; N511-I641 WeakPolarHBondContact ND2-CD1 3.4Å; N511-I641 WeakPolarHBondContact ND2-CG1 3.4Å
512	Q	86.9	Confident	81.1	Confident	52 Å²	52	29.9 Å²	29.9	24%	0.243	16%	0.163	C	C	.	.	H	α-helix	trans	-62.1	-45	176.2	-69.7	176.1	-26.1	0	0	112.4	L452 H508 V509 I514 D515 I516	L452-Q512 HydrophobicContact CD1-CB 4.28Å; H508-Q512 PolarHBondContact CE1-NE2 3.22Å; H508-Q512 VanDerWaalsContact CE1-NE2 3.26Å; H508-Q512 PolarHBondContact O-N 2.98Å; V509-Q512 PolarHBondContact O-N 3.12Å; Q512-I514 VanDerWaalsContact C-N 3.35Å; Q512-I514 PolarHBondContact O-N 3.12Å; Q512-D515 PolarHBondContact O-N 2.92Å; Q512-I516 WeakPolarHBondContact O-CB 3.39Å; Q512-I516 WeakPolarHBondContact O-CD1 3.34Å; Q512-I516 VanDerWaalsContact O-CG1 3.22Å; Q512-I516 WeakPolarHBondContact O-CG1 3.27Å; Q512-I516 PolarHBondContact O-N 3.3Å
513	V	85.5	Confident	80.2	Confident	3.5 Å²	3.5	30.8 Å²	30.8	2%	0.021	17%	0.167	C	C	.	.	H	α-helix	trans	-61.6	-43.1	177.2	172.6	0	0	0	0	111	L452 F484 I487 V488 V509 L510 I516 C517	L452-V513 HydrophobicContact CD1-CG2 3.99Å; L452-V513 HydrophobicContact CD2-CG2 3.93Å; F484-V513 HydrophobicContact CD2-CG1 4.46Å; I487-V513 HydrophobicContact CG2-CG2 4.33Å; V488-V513 HydrophobicContact CG2-CG1 4.02Å; V509-V513 HydrophobicContact CG1-CG2 4.39Å; V509-V513 WeakPolarHBondContact O-CG2 3.37Å; V509-V513 PolarHBondContact O-N 2.96Å; L510-V513 PolarHBondContact O-N 3.13Å; V513-I516 PolarHBondContact O-N 3.13Å; V513-C517 VanDerWaalsContact O-CB 3.31Å; V513-C517 WeakPolarHBondContact O-CB 3.46Å; V513-C517 PolarHBondContact O-N 3.06Å; V513-C517 PolarHBondContact O-SG 3.25Å
514	I	83.6	Confident	78.5	Confident	10 Å²	10	28.7 Å²	28.7	5%	0.051	17%	0.169	C	C	.	.	H	α-helix	trans	-61.9	-47.6	175.5	-71	164.3	0	0	0	110.8	L510 N511 Q512 I516 C517 I518 I641 F644	L510-I514 WeakPolarHBondContact O-CB 3.25Å; L510-I514 WeakPolarHBondContact O-CD1 3.25Å; L510-I514 VanDerWaalsContact O-CG1 3.27Å; L510-I514 WeakPolarHBondContact O-CG1 3.37Å; L510-I514 PolarHBondContact O-N 2.95Å; N511-I514 PolarHBondContact O-N 2.97Å; Q512-I514 VanDerWaalsContact C-N 3.35Å; Q512-I514 PolarHBondContact O-N 3.12Å; I514-I516 VanDerWaalsContact C-N 3.33Å; I514-I516 PolarHBondContact O-N 3.08Å; I514-C517 PolarHBondContact O-N 2.88Å; I514-I518 HydrophobicContact CG2-CD1 3.75Å; I514-I518 VanDerWaalsContact O-CG1 3.31Å; I514-I518 WeakPolarHBondContact O-CG1 3.33Å; I514-I518 PolarHBondContact O-N 2.95Å; I514-I641 HydrophobicContact CD1-CG1 4.06Å; I514-I641 HydrophobicContact CD1-CG2 4.49Å; I514-F644 HydrophobicContact CD1-CD1 4.01Å; I514-F644 HydrophobicContact CD1-CE1 4.36Å; I514-F644 HydrophobicContact CG1-CD1 4.37Å; I514-F644 HydrophobicContact CG1-CE1 4.26Å; I514-F644 HydrophobicContact CG2-CD1 4.08Å; I514-F644 HydrophobicContact CG2-CD2 3.96Å; I514-F644 HydrophobicContact CG2-CE1 4.08Å; I514-F644 HydrophobicContact CG2-CE2 3.96Å; I514-F644 HydrophobicContact CG2-CG 4.02Å; I514-F644 HydrophobicContact CG2-CZ 4.02Å
515	D	82.9	Confident	76.7	Confident	56 Å²	56	34.7 Å²	34.7	30%	0.299	19%	0.191	S	C	.	.	H	α-helix	trans	-61.8	-39.6	178.8	-74.9	-34	0	0	0	112	N511 Q512 I518 C519 R640	N511-D515 WeakPolarHBondContact O-CB 3.35Å; N511-D515 PolarHBondContact O-N 3.23Å; Q512-D515 PolarHBondContact O-N 2.92Å; D515-I518 PolarHBondContact O-N 3.3Å; D515-C519 VanDerWaalsContact O-CB 3.24Å; D515-C519 WeakPolarHBondContact O-CB 3.46Å; D515-C519 PolarHBondContact O-N 3.07Å; D515-C519 PolarHBondContact O-SG 3.14Å; D515-R640 IonicContact OD1-CZ 2.89Å; D515-R640 IonicContact OD1-NH1 3.18Å; D515-R640 IonicContact OD1-NH2 2.99Å; D515-R640 PolarHBondContact OD1-NH2 3.27Å; D515-R640 IonicContact OD2-CZ 3.57Å; D515-R640 VanDerWaalsContact OD2-CZ 3.29Å; D515-R640 IonicContact OD2-NH1 2.83Å; D515-R640 PolarHBondContact OD2-NH1 3.41Å; D515-R640 IonicContact OD2-NH2 3.15Å; D515-R640 PolarHBondContact OD2-NH2 3.08Å
516	I	80.9	Confident	74.4	Confident	23.5 Å²	23.5	37 Å²	37	12%	0.121	21%	0.207	C	C	.	.	H	α-helix	trans	-62.8	-48	172.9	-72.2	164	0	0	0	111.2	L452 L456 F484 Q512 V513 I514 I518 C519 K520 F522	L452-I516 HydrophobicContact CB-CD1 4.34Å; L452-I516 HydrophobicContact CD1-CD1 4.35Å; L452-I516 HydrophobicContact CD2-CD1 4.45Å; L456-I516 HydrophobicContact CD1-CD1 3.84Å; L456-I516 HydrophobicContact CD1-CG1 4.05Å; L456-I516 HydrophobicContact CD2-CG1 4.43Å; L456-I516 HydrophobicContact CD2-CG2 3.78Å; L456-I516 HydrophobicContact CG-CD1 4.4Å; L456-I516 HydrophobicContact CG-CG2 4.48Å; F484-I516 HydrophobicContact CE2-CG2 3.77Å; F484-I516 HydrophobicContact CZ-CG2 3.79Å; Q512-I516 WeakPolarHBondContact O-CB 3.39Å; Q512-I516 WeakPolarHBondContact O-CD1 3.34Å; Q512-I516 VanDerWaalsContact O-CG1 3.22Å; Q512-I516 WeakPolarHBondContact O-CG1 3.27Å; Q512-I516 PolarHBondContact O-N 3.3Å; V513-I516 PolarHBondContact O-N 3.13Å; I514-I516 VanDerWaalsContact C-N 3.33Å; I514-I516 PolarHBondContact O-N 3.08Å; I516-I518 VanDerWaalsContact C-N 3.27Å; I516-I518 PolarHBondContact O-N 3.16Å; I516-C519 PolarHBondContact O-N 3.07Å; I516-K520 HydrophobicContact CG2-CG 4.5Å; I516-K520 WeakPolarHBondContact O-CB 3.35Å; I516-K520 PolarHBondContact O-N 3.35Å; I516-F522 HydrophobicContact CG2-CD2 4.29Å; I516-F522 HydrophobicContact CG2-CE2 4.07Å
517	C	78.5	Confident	72	Confident	2 Å²	2	46.4 Å²	46.4	1%	0.014	25%	0.248	C	C	.	.	H	α-helix	trans	-62.6	-34.6	-178.3	-70.8	0	0	0	0	112.5	V513 I514 G521 F522 L523	V513-C517 VanDerWaalsContact O-CB 3.31Å; V513-C517 WeakPolarHBondContact O-CB 3.46Å; V513-C517 PolarHBondContact O-N 3.06Å; V513-C517 PolarHBondContact O-SG 3.25Å; I514-C517 PolarHBondContact O-N 2.88Å; C517-G521 PolarHBondContact O-N 3.32Å; C517-F522 PolarHBondContact O-N 2.92Å; C517-L523 HydrophobicContact CB-CD1 4.25Å; C517-L523 HydrophobicContact CB-CD2 4.27Å; C517-L523 HydrophobicContact CB-CG 3.95Å; C517-L523 PolarHBondContact O-N 3.13Å
518	I	74.5	Confident	69.6	Low	81 Å²	81	48.5 Å²	48.5	42%	0.415	26%	0.261	S	S	.	.	H	α-helix	trans	-71.3	-55.7	171.6	-64.7	164.3	0	0	0	110.5	I514 D515 I516 K520 G521 L523 F644	I514-I518 HydrophobicContact CG2-CD1 3.75Å; I514-I518 VanDerWaalsContact O-CG1 3.31Å; I514-I518 WeakPolarHBondContact O-CG1 3.33Å; I514-I518 PolarHBondContact O-N 2.95Å; D515-I518 PolarHBondContact O-N 3.3Å; I516-I518 VanDerWaalsContact C-N 3.27Å; I516-I518 PolarHBondContact O-N 3.16Å; I518-K520 VanDerWaalsContact C-N 3.32Å; I518-K520 PolarHBondContact O-N 2.91Å; I518-G521 PolarHBondContact O-N 3.14Å; I518-L523 HydrophobicContact CG1-CD1 3.95Å; I518-F644 HydrophobicContact CD1-CD2 4.26Å; I518-F644 HydrophobicContact CD1-CE2 3.86Å; I518-F644 HydrophobicContact CG1-CE2 4.31Å
519	C	74.9	Confident	67.1	Low	105.5 Å²	105.5	50.5 Å²	50.5	71%	0.713	27%	0.269	S	S	*	.	H	α-helix	trans	-66.9	-27	-171.5	-71.2	0	0	0	0	114.5	D515 I516	D515-C519 VanDerWaalsContact O-CB 3.24Å; D515-C519 WeakPolarHBondContact O-CB 3.46Å; D515-C519 PolarHBondContact O-N 3.07Å; D515-C519 PolarHBondContact O-SG 3.14Å; I516-C519 PolarHBondContact O-N 3.07Å
520	K	70.8	Confident	64.6	Low	77.5 Å²	77.5	51.4 Å²	51.4	34%	0.337	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.4	-2.9	177.9	-62.2	-54.8	-170.5	-177	0	114.1	L456 Y459 E460 I516 I518 F522	L456-K520 HydrophobicContact CD2-CG 4.13Å; Y459-K520 HydrophobicContact CE1-CB 4.29Å; Y459-K520 HydrophobicContact CE1-CD 4.38Å; Y459-K520 HydrophobicContact CE1-CG 4.35Å; E460-K520 WeakPolarHBondContact OE1-CE 3.26Å; E460-K520 IonicContact OE1-NZ 3.34Å; E460-K520 PolarHBondContact OE1-NZ 2.95Å; I516-K520 HydrophobicContact CG2-CG 4.5Å; I516-K520 WeakPolarHBondContact O-CB 3.35Å; I516-K520 PolarHBondContact O-N 3.35Å; I518-K520 VanDerWaalsContact C-N 3.32Å; I518-K520 PolarHBondContact O-N 2.91Å; K520-F522 VanDerWaalsContact C-N 3.28Å; K520-F522 HydrophobicContact CB-CD2 3.64Å; K520-F522 HydrophobicContact CB-CE2 3.54Å; K520-F522 HydrophobicContact CB-CG 4.44Å; K520-F522 HydrophobicContact CB-CZ 4.31Å; K520-F522 HydrophobicContact CG-CD2 4.49Å; K520-F522 HydrophobicContact CG-CE2 4.03Å; K520-F522 PolarHBondContact O-N 3.21Å
521	G	64.8	Low	62.6	Low	49 Å²	49	55.2 Å²	55.2	51%	0.505	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.9	21.2	179.3	0	0	0	0	0	114.6	C517 I518 L523	C517-G521 PolarHBondContact O-N 3.32Å; I518-G521 PolarHBondContact O-N 3.14Å; G521-L523 CarbonylContact O-C 3.58Å; G521-L523 PolarHBondContact O-N 3.26Å
522	F	64.6	Low	60.5	Low	9.5 Å²	9.5	57.2 Å²	57.2	4%	0.042	31%	0.307	C	S	.	.			trans	-60.3	-27.2	172.7	-69.4	-64.3	0	0	0	111.8	Y459 V480 F484 I516 C517 K520 A524 I588	Y459-F522 HydrophobicContact CD1-CE1 4.31Å; Y459-F522 HydrophobicContact CD1-CE2 4.37Å; Y459-F522 AromaticContact CD1-CZ 3.6Å; Y459-F522 HydrophobicContact CD1-CZ 3.6Å; Y459-F522 AromaticContact CD2-CE1 3.86Å; Y459-F522 HydrophobicContact CD2-CE1 3.95Å; Y459-F522 AromaticContact CD2-CZ 3.88Å; Y459-F522 HydrophobicContact CD2-CZ 3.88Å; Y459-F522 AromaticContact CE1-CE1 3.93Å; Y459-F522 HydrophobicContact CE1-CE1 3.93Å; Y459-F522 HydrophobicContact CE1-CE2 4.27Å; Y459-F522 AromaticContact CE1-CZ 3.53Å; Y459-F522 HydrophobicContact CE1-CZ 3.53Å; Y459-F522 VanDerWaalsContact CE1-CZ 3.47Å; Y459-F522 AromaticContact CE2-CE1 3.57Å; Y459-F522 HydrophobicContact CE2-CE1 3.57Å; Y459-F522 VanDerWaalsContact CE2-CE1 3.44Å; Y459-F522 AromaticContact CE2-CZ 3.85Å; Y459-F522 HydrophobicContact CE2-CZ 3.85Å; Y459-F522 HydrophobicContact CG-CE1 4.3Å; Y459-F522 AromaticContact CG-CZ 3.75Å; Y459-F522 HydrophobicContact CG-CZ 3.75Å; Y459-F522 AromaticContact CZ-CE1 3.54Å; Y459-F522 VanDerWaalsContact CZ-CE1 3.48Å; Y459-F522 AromaticContact CZ-CZ 3.66Å; V480-F522 HydrophobicContact CG1-CE1 4.31Å; V480-F522 HydrophobicContact CG1-CE2 4.39Å; V480-F522 HydrophobicContact CG1-CZ 3.93Å; F484-F522 HydrophobicContact CE2-CD2 4.12Å; F484-F522 AromaticContact CE2-CE2 3.98Å; F484-F522 HydrophobicContact CE2-CE2 3.99Å; F484-F522 HydrophobicContact CZ-CE2 4.48Å; I516-F522 HydrophobicContact CG2-CD2 4.29Å; I516-F522 HydrophobicContact CG2-CE2 4.07Å; C517-F522 PolarHBondContact O-N 2.92Å; K520-F522 VanDerWaalsContact C-N 3.28Å; K520-F522 HydrophobicContact CB-CD2 3.64Å; K520-F522 HydrophobicContact CB-CE2 3.54Å; K520-F522 HydrophobicContact CB-CG 4.44Å; K520-F522 HydrophobicContact CB-CZ 4.31Å; K520-F522 HydrophobicContact CG-CD2 4.49Å; K520-F522 HydrophobicContact CG-CE2 4.03Å; K520-F522 PolarHBondContact O-N 3.21Å; F522-A524 PolarHBondContact O-N 2.89Å; F522-A524 VanDerWaalsContact O-N 3.11Å; F522-I588 HydrophobicContact CB-CD1 3.8Å; F522-I588 HydrophobicContact CG-CD1 4.49Å
523	L	59.2	Low	58.3	Low	18.5 Å²	18.5	58.2 Å²	58.2	10%	0.097	32%	0.317	C	S	.	.			trans	-73.8	83.1	167.9	-58.8	175.3	0	0	0	110.4	C517 I518 G521 W525 L589 F644	C517-L523 HydrophobicContact CB-CD1 4.25Å; C517-L523 HydrophobicContact CB-CD2 4.27Å; C517-L523 HydrophobicContact CB-CG 3.95Å; C517-L523 PolarHBondContact O-N 3.13Å; I518-L523 HydrophobicContact CG1-CD1 3.95Å; G521-L523 CarbonylContact O-C 3.58Å; G521-L523 PolarHBondContact O-N 3.26Å; L523-W525 HydrophobicContact CB-CZ2 4.27Å; L523-W525 HydrophobicContact CD1-CH2 3.93Å; L523-W525 HydrophobicContact CD1-CZ2 4.13Å; L523-W525 PolarHBondContact O-N 3.18Å; L523-W525 VanDerWaalsContact O-N 3.16Å; L523-W525 PolarHBondContact O-NE1 3.27Å; L523-L589 HydrophobicContact CD2-CD1 3.61Å; L523-L589 HydrophobicContact CD2-CG 3.97Å; L523-F644 HydrophobicContact CD1-CE2 4.48Å; L523-F644 HydrophobicContact CD1-CZ 4.17Å
524	A	47.1	Very low	56.1	Low	44 Å²	44	62.6 Å²	62.6	36%	0.364	34%	0.337	S	S	.	.			trans	-82.3	81.5	166.4	0	0	0	0	0	109.4	F522 P526 L585	F522-A524 PolarHBondContact O-N 2.89Å; F522-A524 VanDerWaalsContact O-N 3.11Å; A524-P526 VanDerWaalsContact O-CD 3.24Å; A524-P526 WeakPolarHBondContact O-CD 3.36Å; A524-P526 VanDerWaalsContact O-N 3.12Å; A524-L585 HydrophobicContact CB-CB 3.89Å; A524-L585 HydrophobicContact CB-CD1 3.77Å; A524-L585 HydrophobicContact CB-CD2 4.26Å; A524-L585 HydrophobicContact CB-CG 4.17Å
525	W	47.2	Very low	53.9	Low	134.5 Å²	134.5	63.6 Å²	63.6	51%	0.509	34%	0.343	S	S	.	.			trans	-39.7	111.3	-178.9	-46.2	82.5	0	0	0	112.3	L523 F530	L523-W525 HydrophobicContact CB-CZ2 4.27Å; L523-W525 HydrophobicContact CD1-CH2 3.93Å; L523-W525 HydrophobicContact CD1-CZ2 4.13Å; L523-W525 PolarHBondContact O-N 3.18Å; L523-W525 VanDerWaalsContact O-N 3.16Å; L523-W525 PolarHBondContact O-NE1 3.27Å; W525-F530 AromaticContact CE3-CD2 3.73Å; W525-F530 HydrophobicContact CE3-CD2 3.73Å; W525-F530 AromaticContact CE3-CE2 3.47Å; W525-F530 HydrophobicContact CE3-CE2 3.47Å; W525-F530 VanDerWaalsContact CE3-CE2 3.47Å; W525-F530 HydrophobicContact CE3-CG 4.42Å; W525-F530 AromaticContact CE3-CZ 3.96Å; W525-F530 HydrophobicContact CE3-CZ 3.96Å; W525-F530 HydrophobicContact CZ3-CD1 4.31Å; W525-F530 AromaticContact CZ3-CD2 3.83Å; W525-F530 HydrophobicContact CZ3-CD2 3.95Å; W525-F530 AromaticContact CZ3-CE1 3.94Å; W525-F530 HydrophobicContact CZ3-CE1 3.94Å; W525-F530 AromaticContact CZ3-CE2 3.56Å; W525-F530 HydrophobicContact CZ3-CE2 3.56Å; W525-F530 VanDerWaalsContact CZ3-CE2 3.49Å; W525-F530 HydrophobicContact CZ3-CG 4.31Å; W525-F530 AromaticContact CZ3-CZ 3.53Å; W525-F530 HydrophobicContact CZ3-CZ 3.53Å
526	P	35.8	Very low	51.6	Low	49 Å²	49	62.3 Å²	62.3	32%	0.318	34%	0.336	S	S	.	.			trans	-69.8	-167.7	170.5	-15.6	30.4	0	0	0	110.3	A524 V528 C586	A524-P526 VanDerWaalsContact O-CD 3.24Å; A524-P526 WeakPolarHBondContact O-CD 3.36Å; A524-P526 VanDerWaalsContact O-N 3.12Å; P526-V528 HydrophobicContact CB-CG2 4.2Å; P526-V528 HydrophobicContact CG-CG2 4.21Å; P526-V528 PolarHBondContact O-N 3.04Å; P526-C586 HydrophobicContact CG-CB 3.98Å
527	K	36.1	Very low	49.3	Very low	197.5 Å²	197.5	65.6 Å²	65.6	86%	0.859	36%	0.36	S	S	*	.	S	Bend	trans	-69.7	36.6	166	-67.2	-170.7	175	-173	0	113.5	K529	K527-K529 PolarHBondContact O-N 3.33Å
528	V	37	Very low	47.1	Very low	53.5 Å²	53.5	69.3 Å²	69.3	32%	0.324	38%	0.379	S	S	.	.			trans	-71.8	119.5	166.8	-179.7	0	0	0	0	107.1	P526 F530	P526-V528 HydrophobicContact CB-CG2 4.2Å; P526-V528 HydrophobicContact CG-CG2 4.21Å; P526-V528 PolarHBondContact O-N 3.04Å; V528-F530 VanDerWaalsContact C-N 3.32Å; V528-F530 HydrophobicContact CB-CD2 4.16Å; V528-F530 HydrophobicContact CB-CE2 3.97Å; V528-F530 HydrophobicContact CG1-CD2 3.85Å; V528-F530 HydrophobicContact CG1-CE2 3.51Å; V528-F530 VanDerWaalsContact CG1-CE2 3.45Å; V528-F530 HydrophobicContact CG1-CZ 4.33Å; V528-F530 WeakPolarHBondContact O-CD2 3.46Å; V528-F530 PolarHBondContact O-N 3.01Å
529	K	35.7	Very low	45.1	Very low	86 Å²	86	73.9 Å²	73.9	37%	0.374	40%	0.398	S	S	.	.			trans	-74.9	74.1	-173.9	-68.9	-178.6	172	-91.8	0	112.5	K527 E534 Q649	K527-K529 PolarHBondContact O-N 3.33Å; K529-E534 WeakPolarHBondContact CE-OE1 3.47Å; K529-E534 IonicContact NZ-OE1 3.33Å; K529-E534 PolarHBondContact NZ-OE1 3.18Å; K529-E534 IonicContact NZ-OE2 2.71Å; K529-E534 PolarHBondContact NZ-OE2 2.93Å; K529-Q649 HydrophobicContact CB-CB 4.47Å; K529-Q649 WeakPolarHBondContact O-CB 3.42Å
530	F	35.6	Very low	42.8	Very low	19.5 Å²	19.5	74.3 Å²	74.3	9%	0.086	40%	0.401	C	S	.	.			trans	-70.8	129.5	158.6	-68.7	-91.2	0	0	0	108.7	W525 V528 S532 T533 H647 Q648	W525-F530 AromaticContact CE3-CD2 3.73Å; W525-F530 HydrophobicContact CE3-CD2 3.73Å; W525-F530 AromaticContact CE3-CE2 3.47Å; W525-F530 HydrophobicContact CE3-CE2 3.47Å; W525-F530 VanDerWaalsContact CE3-CE2 3.47Å; W525-F530 HydrophobicContact CE3-CG 4.42Å; W525-F530 AromaticContact CE3-CZ 3.96Å; W525-F530 HydrophobicContact CE3-CZ 3.96Å; W525-F530 HydrophobicContact CZ3-CD1 4.31Å; W525-F530 AromaticContact CZ3-CD2 3.83Å; W525-F530 HydrophobicContact CZ3-CD2 3.95Å; W525-F530 AromaticContact CZ3-CE1 3.94Å; W525-F530 HydrophobicContact CZ3-CE1 3.94Å; W525-F530 AromaticContact CZ3-CE2 3.56Å; W525-F530 HydrophobicContact CZ3-CE2 3.56Å; W525-F530 VanDerWaalsContact CZ3-CE2 3.49Å; W525-F530 HydrophobicContact CZ3-CG 4.31Å; W525-F530 AromaticContact CZ3-CZ 3.53Å; W525-F530 HydrophobicContact CZ3-CZ 3.53Å; V528-F530 VanDerWaalsContact C-N 3.32Å; V528-F530 HydrophobicContact CB-CD2 4.16Å; V528-F530 HydrophobicContact CB-CE2 3.97Å; V528-F530 HydrophobicContact CG1-CD2 3.85Å; V528-F530 HydrophobicContact CG1-CE2 3.51Å; V528-F530 VanDerWaalsContact CG1-CE2 3.45Å; V528-F530 HydrophobicContact CG1-CZ 4.33Å; V528-F530 WeakPolarHBondContact O-CD2 3.46Å; V528-F530 PolarHBondContact O-N 3.01Å; F530-S532 PolarHBondContact O-N 3.06Å; F530-S532 VanDerWaalsContact O-N 3.1Å; F530-T533 PolarHBondContact O-N 3.09Å; F530-H647 HydrophobicContact CD1-CB 3.98Å; F530-H647 WeakPolarHBondContact CD1-O 3.48Å; F530-H647 HydrophobicContact CE1-CB 4.02Å; F530-Q648 HydrophobicContact CE1-CB 4.35Å; F530-Q648 HydrophobicContact CE1-CG 3.69Å; F530-Q648 HydrophobicContact CE2-CG 4.3Å; F530-Q648 HydrophobicContact CZ-CB 4.44Å; F530-Q648 HydrophobicContact CZ-CG 3.53Å
531	L	44.4	Very low	40.9	Very low	81 Å²	81	76.1 Å²	76.1	42%	0.424	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-18.9	-179.2	-93.8	152.7	0	0	0	113.4	T533 L535 R652 L689	L531-T533 VanDerWaalsContact C-N 3.31Å; L531-T533 PolarHBondContact O-N 2.81Å; L531-L535 HydrophobicContact CB-CD1 4.27Å; L531-L535 HydrophobicContact CD2-CD1 4.08Å; L531-L535 WeakPolarHBondContact O-CB 3.21Å; L531-L535 WeakPolarHBondContact O-CD1 3.35Å; L531-L535 WeakPolarHBondContact O-CG 3.33Å; L531-R652 VanDerWaalsContact CD1-NH1 3.31Å; L531-L689 HydrophobicContact CD1-CD1 4.35Å
532	S	44.6	Very low	39.1	Very low	47.5 Å²	47.5	80.6 Å²	80.6	33%	0.332	44%	0.441	S	S	.	.	H	α-helix	trans	-75.4	-21.7	173.9	47.2	0	0	0	0	114.7	F530	F530-S532 PolarHBondContact O-N 3.06Å; F530-S532 VanDerWaalsContact O-N 3.1Å
533	T	41.3	Very low	37.5	Very low	73 Å²	73	83.5 Å²	83.5	45%	0.448	47%	0.474	S	S	.	.	H	α-helix	trans	-102.4	-36.5	-164	-36.4	0	0	0	0	113.8	F530 L531 L535	F530-T533 PolarHBondContact O-N 3.09Å; L531-T533 VanDerWaalsContact C-N 3.31Å; L531-T533 PolarHBondContact O-N 2.81Å; T533-L535 VanDerWaalsContact C-N 3.3Å; T533-L535 PolarHBondContact O-N 3.31Å
534	E	38.8	Very low	36.3	Very low	96 Å²	96	89.4 Å²	89.4	45%	0.449	51%	0.51	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-23.3	177.1	-72.5	-169.3	146.8	0	0	113.3	K529 L536	K529-E534 WeakPolarHBondContact CE-OE1 3.47Å; K529-E534 IonicContact NZ-OE1 3.33Å; K529-E534 PolarHBondContact NZ-OE1 3.18Å; K529-E534 IonicContact NZ-OE2 2.71Å; K529-E534 PolarHBondContact NZ-OE2 2.93Å; E534-L536 VanDerWaalsContact C-N 3.3Å; E534-L536 PolarHBondContact O-N 3.27Å
535	L	38.1	Very low	35.3	Very low	32 Å²	32	91.9 Å²	91.9	17%	0.168	53%	0.531	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-19.5	-174.8	-67.3	-178.7	0	0	0	114.6	L531 T533 L840 V841	L531-L535 HydrophobicContact CB-CD1 4.27Å; L531-L535 HydrophobicContact CD2-CD1 4.08Å; L531-L535 WeakPolarHBondContact O-CB 3.21Å; L531-L535 WeakPolarHBondContact O-CD1 3.35Å; L531-L535 WeakPolarHBondContact O-CG 3.33Å; T533-L535 VanDerWaalsContact C-N 3.3Å; T533-L535 PolarHBondContact O-N 3.31Å; L535-L840 HydrophobicContact CD2-CB 3.73Å; L535-L840 HydrophobicContact CD2-CD1 4.42Å; L535-L840 HydrophobicContact CD2-CD2 4.06Å; L535-L840 HydrophobicContact CD2-CG 4.28Å; L535-L840 WeakPolarHBondContact CD2-O 3.43Å; L535-V841 HydrophobicContact CD2-CG2 4.11Å
536	L	34.2	Very low	34.5	Very low	28.5 Å²	28.5	96.6 Å²	96.6	15%	0.149	55%	0.548	C	S	.	.			trans	-135.8	17.1	-155.7	-66.5	168.5	0	0	0	115.4	E534 M538 T803 Y805 L810	E534-L536 VanDerWaalsContact C-N 3.3Å; E534-L536 PolarHBondContact O-N 3.27Å; L536-M538 PolarHBondContact O-N 3.16Å; L536-T803 WeakPolarHBondContact CD1-O 3.3Å; L536-Y805 HydrophobicContact CD1-CD2 3.9Å; L536-Y805 HydrophobicContact CD1-CG 4.37Å; L536-Y805 HydrophobicContact CD2-CD2 3.68Å; L536-Y805 HydrophobicContact CD2-CE2 4.24Å; L536-Y805 HydrophobicContact CG-CD2 4.41Å; L536-L810 HydrophobicContact CD2-CD1 4.2Å
537	S	31.5	Very low	34.2	Very low	92 Å²	92	100.5 Å²	100.5	64%	0.643	57%	0.574	S	S	*	*			trans	-75.7	45.8	171.2	-174.9	0	0	0	0	112.9	Q539	S537-Q539 PolarHBondContact O-N 2.95Å; S537-Q539 VanDerWaalsContact O-N 3.15Å
538	M	33.2	Very low	33.7	Very low	81 Å²	81	101.8 Å²	101.8	40%	0.399	57%	0.573	S	S	.	*			trans	-81.5	81.5	173.8	-82.1	-63.8	-176.3	0	0	110.8	L536 C540 F833 W836 T837	L536-M538 PolarHBondContact O-N 3.16Å; M538-C540 PolarHBondContact O-N 3.24Å; M538-F833 HydrophobicContact CE-CD2 3.85Å; M538-F833 HydrophobicContact CE-CE1 4.31Å; M538-F833 HydrophobicContact CE-CE2 3.39Å; M538-F833 VanDerWaalsContact CE-CE2 3.42Å; M538-F833 HydrophobicContact CE-CZ 3.86Å; M538-F833 HydrophobicContact CG-CE2 4.28Å; M538-F833 HydrophobicContact CG-CZ 4.24Å; M538-F833 HydrophobicContact SD-CD2 4.21Å; M538-F833 HydrophobicContact SD-CE2 3.5Å; M538-F833 VanDerWaalsContact SD-CE2 3.54Å; M538-F833 WeakPolarHBondContact SD-CE2 3.4Å; M538-F833 HydrophobicContact SD-CZ 4.04Å; M538-W836 HydrophobicContact CE-CD2 4.48Å; M538-W836 HydrophobicContact CE-CE3 3.58Å; M538-W836 HydrophobicContact CE-CH2 4.18Å; M538-W836 HydrophobicContact CE-CZ3 3.45Å; M538-W836 HydrophobicContact CG-CZ3 4.33Å; M538-W836 HydrophobicContact SD-CZ3 4.48Å; M538-T837 HydrophobicContact CE-CG2 3.61Å
539	Q	31.8	Very low	33.5	Very low	176.5 Å²	176.5	108.6 Å²	108.6	83%	0.825	60%	0.602	S	S	*	*			trans	-66.6	112.7	160.8	-70.3	-177.7	-15.2	0	0	108.2	S537	S537-Q539 PolarHBondContact O-N 2.95Å; S537-Q539 VanDerWaalsContact O-N 3.15Å
540	C	27.7	Very low	33.2	Very low	115 Å²	115	115 Å²	115	78%	0.777	62%	0.623	S	S	*	*			trans	-59.5	135	176.1	-68.4	0	0	0	0	110.4	M538	M538-C540 PolarHBondContact O-N 3.24Å
541	P	29.8	Very low	33	Very low	114 Å²	114	125.5 Å²	125.5	74%	0.74	66%	0.663	S	S	*	*			trans	-59.3	138.3	170.6	1.3	0.3	0	0	0	110.3	G543	P541-G543 VanDerWaalsContact C-N 3.33Å; P541-G543 PolarHBondContact O-N 3.09Å
542	P	28.3	Very low	32.4	Very low	143.5 Å²	143.5	126.5 Å²	126.5	93%	0.932	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.8	81.4	-176.8	31	-35.4	0	0	0	111
543	G	30.2	Very low	31.8	Very low	71.5 Å²	71.5	132 Å²	132	74%	0.737	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-150.4	-5.4	-173.1	0	0	0	0	0	118.1	P541	P541-G543 VanDerWaalsContact C-N 3.33Å; P541-G543 PolarHBondContact O-N 3.09Å
544	V	33.2	Very low	31.4	Very low	142 Å²	142	132.1 Å²	132.1	86%	0.861	72%	0.716	S	S	*	*			trans	-117.8	124.8	-179.9	-174.2	0	0	0	0	110.6	R546	V544-R546 PolarHBondContact O-N 2.92Å
545	A	27.4	Very low	31.2	Very low	96 Å²	96	136.4 Å²	136.4	79%	0.793	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-74.7	129.9	-174.8	0	0	0	0	0	112.3
546	R	29.2	Very low	30.7	Very low	233 Å²	233	140.1 Å²	140.1	88%	0.879	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-84.6	141.1	163.4	-74.7	-173.4	173.4	-172.9	-2.4	110.2	V544	V544-R546 PolarHBondContact O-N 2.92Å
547	P	29.8	Very low	30.7	Very low	131 Å²	131	144.8 Å²	144.8	85%	0.851	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-59.3	153.8	169	1.1	1	0	0	0	111.8
548	R	26.8	Very low	30.6	Very low	224.5 Å²	224.5	149.7 Å²	149.7	85%	0.847	81%	0.806	S	S	*	*			trans	-120.2	80.1	-159.1	-172.8	-173.9	-174.8	177.3	3.7	112.2
549	E	31.8	Very low	30.6	Very low	197 Å²	197	151.7 Å²	151.7	92%	0.921	83%	0.828	S	S	*	*			trans	-73.2	155.7	169.1	-65	-150.1	115.1	0	0	112
550	R	28.8	Very low	30.5	Very low	219.5 Å²	219.5	154.5 Å²	154.5	83%	0.828	83%	0.83	S	S	*	*			trans	-127.3	150.7	-167.3	-64.3	178.5	176.6	-177	-0.8	111.6
551	R	32.3	Very low	30.8	Very low	242 Å²	242	155.9 Å²	155.9	91%	0.913	84%	0.836	S	S	*	*			trans	140.4	124.4	157.1	-74.6	149.6	-175	-178.3	1.6	109.6
552	S	31.9	Very low	30.8	Very low	100.5 Å²	100.5	157.3 Å²	157.3	70%	0.703	84%	0.837	S	S	*	*			cis	136	134.2	35.8	54.9	0	0	0	0	113.6
553	L	30.8	Very low	31.2	Very low	163.5 Å²	163.5	159.9 Å²	159.9	86%	0.856	84%	0.837	S	S	*	*				-76.6	140.7	73	-100.3	128	0	0	0	114.4
554	G	34.5	Very low	31.3	Very low	74.5 Å²	74.5	165 Å²	165	77%	0.768	84%	0.841	S	S	*	*			trans	-171.8	137.4	163.6	0	0	0	0	0	109.8
555	E	33	Very low	31.4	Very low	186.5 Å²	186.5	163 Å²	163	87%	0.871	83%	0.832	S	S	*	*			trans	-101.7	169.5	-154.9	-66.9	-176.1	116.5	0	0	116.5
556	C	28.1	Very low	31.5	Very low	110 Å²	110	167.7 Å²	167.7	74%	0.743	83%	0.834	S	S	*	*			trans	-82.6	-175.2	-178.9	-82.2	0	0	0	0	112.1
557	P	35.2	Very low	31.9	Very low	127.5 Å²	127.5	168.5 Å²	168.5	83%	0.828	84%	0.837	S	S	*	*				-138.5	175.7	56.6	39	-22.4	0	0	0	116.3
558	K	29	Very low	32	Very low	194.5 Å²	194.5	171.2 Å²	171.2	85%	0.846	84%	0.836	S	S	*	*			trans	-113.5	146.4	172.7	-62.4	169.6	-178.5	169.9	0	109.4
559	S	33.3	Very low	32.2	Very low	123 Å²	123	167.1 Å²	167.1	86%	0.86	83%	0.83	S	S	*	*			trans	-113.4	147.8	158.4	57.2	0	0	0	0	110.2
560	R	29.9	Very low	32.4	Very low	234.5 Å²	234.5	165 Å²	165	89%	0.885	83%	0.825	S	S	*	*			trans	-142.3	125.6	-177.8	-121.5	-179.6	178.2	-173.4	-0.8	109.4
561	T	34.2	Very low	32.4	Very low	144.5 Å²	144.5	160.1 Å²	160.1	89%	0.887	83%	0.825	S	S	*	*			trans	-147	119.6	161.2	16.1	0	0	0	0	111.1
562	N	30	Very low	32.5	Very low	144 Å²	144	155 Å²	155	77%	0.77	82%	0.82	S	S	*	*			trans	-64.7	150.6	170.2	-58.9	-30.6	0	0	0	112.7
563	Q	36.5	Very low	32.4	Very low	197.5 Å²	197.5	156.3 Å²	156.3	92%	0.923	82%	0.824	S	S	*	*				-159.9	161.6	122.9	-105	165.7	46.8	0	0	111.4
564	Q	31.6	Very low	32.4	Very low	178.5 Å²	178.5	155.4 Å²	155.4	83%	0.834	82%	0.819	S	S	*	*			trans	-121.1	-168.9	-173.6	-65.9	-169.7	-19.9	0	0	109.3
565	P	35.4	Very low	32.1	Very low	101.5 Å²	101.5	158.1 Å²	158.1	66%	0.659	82%	0.816	S	S	*	*			cis	-139.9	178.6	-35	41.1	-23.2	0	0	0	116.2
566	K	29.4	Very low	32.1	Very low	193.5 Å²	193.5	156.6 Å²	156.6	84%	0.841	81%	0.809	S	S	*	*			trans	49.4	115	147.2	-68.2	173	-179.8	176.6	0	120.4
567	R	36.7	Very low	32.3	Very low	249.5 Å²	249.5	156.3 Å²	156.3	94%	0.942	80%	0.804	S	S	*	*				-147.8	142	127	-88	178	-174.7	-162.1	1.6	108.7
568	K	33.6	Very low	32.2	Very low	189 Å²	189	153.4 Å²	153.4	82%	0.822	79%	0.786	S	S	*	*			trans	164.8	134.6	144.7	-91.3	-168.5	173.3	-172.2	0	113.1
569	N	30.8	Very low	32.2	Very low	137.5 Å²	137.5	148.5 Å²	148.5	74%	0.735	77%	0.769	S	S	*	*			trans	63.4	147.2	157	-63.8	33.3	0	0	0	116.2
570	D	35	Very low	32	Very low	152.5 Å²	152.5	151.4 Å²	151.4	82%	0.816	76%	0.761	S	S	*	*			cis	-122.4	168.4	16.4	-73.8	-55.4	0	0	0	114.1
571	S	28.6	Very low	32	Very low	118.5 Å²	118.5	149.4 Å²	149.4	83%	0.829	75%	0.754	S	S	*	*			trans	-101	116.2	-175.7	56.3	0	0	0	0	113.4
572	V	34.9	Very low	31.8	Very low	133 Å²	133	149.2 Å²	149.2	81%	0.806	74%	0.741	S	S	*	*			trans	-123.1	136.6	160.9	179.9	0	0	0	0	108.3	I574	V572-I574 PolarHBondContact O-N 3.16Å
573	T	30.4	Very low	32.2	Very low	129 Å²	129	148.6 Å²	148.6	79%	0.791	73%	0.733	S	S	*	*			trans	-74	106.9	-167.4	40.7	0	0	0	0	113.5	D575	T573-D575 VanDerWaalsContact C-N 3.25Å; T573-D575 PolarHBondContact O-N 2.79Å
574	I	30.2	Very low	32.2	Very low	145 Å²	145	141.8 Å²	141.8	74%	0.744	71%	0.711	S	S	*	*			trans	-85.5	74.1	171.7	-50.9	178.5	0	0	0	109.5	V572 T577	V572-I574 PolarHBondContact O-N 3.16Å; I574-T577 HydrophobicContact CG2-CG2 4.46Å
575	D	29.2	Very low	32.4	Very low	131 Å²	131	136.5 Å²	136.5	70%	0.701	69%	0.688	S	S	*	*			trans	-127.3	28.6	-179	-123.5	-22.3	0	0	0	113.5	T573	T573-D575 VanDerWaalsContact C-N 3.25Å; T573-D575 PolarHBondContact O-N 2.79Å
576	Q	32	Very low	32.8	Very low	155 Å²	155	134.3 Å²	134.3	72%	0.724	68%	0.675	S	S	*	*	S	Bend	trans	-113.6	-18	176.6	-67.2	-172.6	-4.6	0	0	114.4	S578 W580	Q576-S578 VanDerWaalsContact C-N 3.34Å; Q576-S578 PolarHBondContact O-N 3.11Å; Q576-W580 PolarHBondContact O-NE1 3.44Å
577	T	32.3	Very low	34.1	Very low	104 Å²	104	127.7 Å²	127.7	64%	0.638	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.8	-3	-172.7	53.4	0	0	0	0	114.7	I574	I574-T577 HydrophobicContact CG2-CG2 4.46Å
578	S	32.6	Very low	35.2	Very low	66 Å²	66	116.1 Å²	116.1	46%	0.462	61%	0.605	S	S	.	*	T	Hydrogen-bonded Turn	trans	-93.8	-22.3	-176.2	63.4	0	0	0	0	114.6	Q576	Q576-S578 VanDerWaalsContact C-N 3.34Å; Q576-S578 PolarHBondContact O-N 3.11Å
579	N	29.4	Very low	36.5	Very low	91 Å²	91	107.8 Å²	107.8	49%	0.487	57%	0.57	S	S	.	*	T	Hydrogen-bonded Turn	trans	-82.9	-43.1	-178.1	-95.3	-3.9	0	0	0	113.8	R581 K582	N579-R581 PolarHBondContact O-N 3.09Å; N579-K582 WeakPolarHBondContact O-CB 3.47Å; N579-K582 PolarHBondContact O-N 3.06Å; N579-K582 PolarHBondContact OD1-NZ 2.81Å
580	W	29.5	Very low	38.2	Very low	184 Å²	184	105.3 Å²	105.3	70%	0.697	55%	0.553	S	S	*	*	H	α-helix	trans	-54.1	-19.2	-175.8	-58.1	94.8	0	0	0	115.3	Q576 K582	Q576-W580 PolarHBondContact O-NE1 3.44Å; W580-K582 VanDerWaalsContact C-N 3.35Å
581	R	29.4	Very low	39.5	Very low	192 Å²	192	98.7 Å²	98.7	73%	0.725	52%	0.519	S	S	*	.	H	α-helix	trans	-82	-5.1	175.7	-69.6	-167.8	-177.4	159.8	8	115.4	N579 L585	N579-R581 PolarHBondContact O-N 3.09Å; R581-L585 WeakPolarHBondContact O-CD1 3.41Å
582	K	30.9	Very low	41.3	Very low	142 Å²	142	93.2 Å²	93.2	62%	0.617	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.3	-20.1	-177.9	-66.2	174.3	-170.7	157.4	0	113.8	N579 W580	N579-K582 WeakPolarHBondContact O-CB 3.47Å; N579-K582 PolarHBondContact O-N 3.06Å; N579-K582 PolarHBondContact OD1-NZ 2.81Å; W580-K582 VanDerWaalsContact C-N 3.35Å
583	E	37.2	Very low	42.7	Very low	131 Å²	131	89 Å²	89	61%	0.612	46%	0.457	S	S	*	.	H	α-helix	trans	-101.4	-55.2	-171.8	-68.8	163.7	163.4	0	0	110.8	L585 C586	E583-L585 PolarHBondContact O-N 3.36Å; E583-C586 PolarHBondContact O-N 2.91Å
584	A	37.7	Very low	44.4	Very low	55 Å²	55	88.3 Å²	88.3	46%	0.455	45%	0.448	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65	5.5	-169.9	0	0	0	0	0	117.6	H481 D587	H481-A584 PolarHBondContact CE1-O 3.11Å; A584-D587 WeakPolarHBondContact CA-OD2 3.49Å
585	L	36	Very low	46.3	Very low	65.5 Å²	65.5	82.5 Å²	82.5	34%	0.343	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.7	7.3	-173.6	-67.4	168.2	0	0	0	114	A524 R581 E583	A524-L585 HydrophobicContact CB-CB 3.89Å; A524-L585 HydrophobicContact CB-CD1 3.77Å; A524-L585 HydrophobicContact CB-CD2 4.26Å; A524-L585 HydrophobicContact CB-CG 4.17Å; R581-L585 WeakPolarHBondContact O-CD1 3.41Å; E583-L585 PolarHBondContact O-N 3.36Å
586	C	43.8	Very low	48.3	Very low	57 Å²	57	81.5 Å²	81.5	39%	0.385	41%	0.41	S	S	.	.	S	Bend	trans	-105.4	-12.7	173.4	-149.5	0	0	0	0	113.4	P526 E583 I588 L589 E590	P526-C586 HydrophobicContact CG-CB 3.98Å; E583-C586 PolarHBondContact O-N 2.91Å; C586-I588 VanDerWaalsContact C-N 3.35Å; C586-I588 PolarHBondContact O-N 3.16Å; C586-I588 VanDerWaalsContact O-N 3.17Å; C586-L589 PolarHBondContact O-N 3.08Å; C586-E590 PolarHBondContact O-N 2.9Å
587	D	56.3	Low	50.5	Low	55 Å²	55	74.3 Å²	74.3	29%	0.294	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-20.7	-158.2	-68.2	12.2	0	0	0	117	K485 A584 L589 E590	K485-D587 HydrophobicContact CD-CB 4.49Å; K485-D587 WeakPolarHBondContact CE-O 3.42Å; K485-D587 PolarHBondContact NZ-O 3.5Å; K485-D587 IonicContact NZ-OD2 2.63Å; K485-D587 PolarHBondContact NZ-OD2 2.73Å; A584-D587 WeakPolarHBondContact CA-OD2 3.49Å; D587-L589 VanDerWaalsContact C-N 3.34Å; D587-L589 PolarHBondContact O-N 2.76Å; D587-E590 WeakPolarHBondContact O-CB 3.48Å; D587-E590 PolarHBondContact O-N 2.95Å
588	I	60.1	Low	52.8	Low	4.5 Å²	4.5	71.9 Å²	71.9	2%	0.023	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-37	179.1	-46.4	174.6	0	0	0	110.5	H481 F484 F522 C586 P591	H481-I588 VanDerWaalsContact CD2-CG1 3.45Å; H481-I588 WeakPolarHBondContact CD2-CG1 3.35Å; H481-I588 VanDerWaalsContact NE2-CG1 3.33Å; H481-I588 WeakPolarHBondContact NE2-CG1 3.43Å; F484-I588 HydrophobicContact CB-CG2 3.86Å; F484-I588 HydrophobicContact CD2-CD1 4.4Å; F484-I588 HydrophobicContact CD2-CG2 4.44Å; F522-I588 HydrophobicContact CB-CD1 3.8Å; F522-I588 HydrophobicContact CG-CD1 4.49Å; C586-I588 VanDerWaalsContact C-N 3.35Å; C586-I588 PolarHBondContact O-N 3.16Å; C586-I588 VanDerWaalsContact O-N 3.17Å; I588-P591 WeakPolarHBondContact O-CD 3.41Å
589	L	61.3	Low	55.3	Low	16 Å²	16	71.1 Å²	71.1	8%	0.084	35%	0.352	C	S	.	.	S	Bend	trans	-89.1	-9.3	-180	-68.1	-179.6	0	0	0	113.2	L523 C586 D587 P591 L592 S593 F644	L523-L589 HydrophobicContact CD2-CD1 3.61Å; L523-L589 HydrophobicContact CD2-CG 3.97Å; C586-L589 PolarHBondContact O-N 3.08Å; D587-L589 VanDerWaalsContact C-N 3.34Å; D587-L589 PolarHBondContact O-N 2.76Å; L589-P591 VanDerWaalsContact C-CD 3.47Å; L589-P591 VanDerWaalsContact C-N 3.34Å; L589-L592 HydrophobicContact CD2-CB 4.4Å; L589-L592 HydrophobicContact CD2-CD1 3.73Å; L589-L592 CarbonylContact O-C 3.58Å; L589-L592 WeakPolarHBondContact O-CA 3.46Å; L589-L592 WeakPolarHBondContact O-CB 3.39Å; L589-L592 PolarHBondContact O-N 3.13Å; L589-S593 PolarHBondContact O-N 3.14Å; L589-S593 PolarHBondContact O-OG 3.05Å; L589-F644 HydrophobicContact CD1-CE1 3.91Å; L589-F644 HydrophobicContact CD1-CZ 3.96Å; L589-F644 HydrophobicContact CD2-CE1 4.06Å
590	E	66.4	Low	57.9	Low	83.5 Å²	83.5	66.9 Å²	66.9	39%	0.39	33%	0.329	S	S	.	.	H	α-helix	trans	-50.2	-46.9	177.4	-172.2	-152.1	-179.6	0	0	112.6	K485 C586 D587 L592 S593 N594	K485-E590 WeakPolarHBondContact CE-OE2 3.34Å; K485-E590 IonicContact NZ-OE2 3.33Å; K485-E590 PolarHBondContact NZ-OE2 3.45Å; C586-E590 PolarHBondContact O-N 2.9Å; D587-E590 WeakPolarHBondContact O-CB 3.48Å; D587-E590 PolarHBondContact O-N 2.95Å; E590-L592 VanDerWaalsContact C-N 3.27Å; E590-L592 PolarHBondContact O-N 2.92Å; E590-S593 WeakPolarHBondContact CA-OG 3.46Å; E590-S593 PolarHBondContact O-N 3.22Å; E590-S593 PolarHBondContact O-OG 3.14Å; E590-N594 WeakPolarHBondContact O-CB 3.37Å; E590-N594 PolarHBondContact O-N 3.47Å; E590-N594 PolarHBondContact O-ND2 3.19Å; E590-N594 PolarHBondContact O-OD1 3.05Å
591	P	61.1	Low	60.6	Low	14.5 Å²	14.5	58.1 Å²	58.1	9%	0.094	30%	0.296	C	S	.	.	H	α-helix	trans	-67.7	-27.1	177.9	-15.5	31.3	0	0	0	113.1	K485 V488 R489 L492 I588 L589 L595	K485-P591 HydrophobicContact CG-CG 3.95Å; V488-P591 HydrophobicContact CG1-CB 3.97Å; V488-P591 HydrophobicContact CG1-CG 4.32Å; R489-P591 HydrophobicContact CG-CB 4.41Å; R489-P591 HydrophobicContact CG-CG 4.47Å; L492-P591 HydrophobicContact CD1-CB 3.75Å; L492-P591 VanDerWaalsContact CD1-O 3.25Å; L492-P591 WeakPolarHBondContact CD1-O 3.31Å; I588-P591 WeakPolarHBondContact O-CD 3.41Å; L589-P591 VanDerWaalsContact C-CD 3.47Å; L589-P591 VanDerWaalsContact C-N 3.34Å; P591-L595 PolarHBondContact O-N 2.69Å
592	L	66.8	Low	63.3	Low	3.5 Å²	3.5	54.1 Å²	54.1	2%	0.018	29%	0.287	C	S	.	.	H	α-helix	trans	-81.3	-31.2	178.3	-82.1	156.4	0	0	0	112.7	V488 L492 L510 L589 E590 N594 L595	V488-L592 HydrophobicContact CG1-CD1 3.69Å; V488-L592 HydrophobicContact CG1-CD2 4.47Å; V488-L592 HydrophobicContact CG1-CG 3.63Å; V488-L592 HydrophobicContact CG2-CD1 4.21Å; L492-L592 HydrophobicContact CD2-CD2 4.11Å; L510-L592 HydrophobicContact CD1-CD2 4.41Å; L510-L592 HydrophobicContact CD2-CD1 4.25Å; L510-L592 HydrophobicContact CD2-CD2 4.19Å; L589-L592 HydrophobicContact CD2-CB 4.4Å; L589-L592 HydrophobicContact CD2-CD1 3.73Å; L589-L592 CarbonylContact O-C 3.58Å; L589-L592 WeakPolarHBondContact O-CA 3.46Å; L589-L592 WeakPolarHBondContact O-CB 3.39Å; L589-L592 PolarHBondContact O-N 3.13Å; E590-L592 VanDerWaalsContact C-N 3.27Å; E590-L592 PolarHBondContact O-N 2.92Å; L592-N594 VanDerWaalsContact C-N 3.34Å; L592-L595 PolarHBondContact O-N 3.22Å
593	S	63.4	Low	65.8	Low	43.5 Å²	43.5	48.9 Å²	48.9	30%	0.304	27%	0.265	S	S	.	.	H	α-helix	trans	-76.8	-23.1	169.7	52	0	0	0	0	112.9	L589 E590 L595	L589-S593 PolarHBondContact O-N 3.14Å; L589-S593 PolarHBondContact O-OG 3.05Å; E590-S593 WeakPolarHBondContact CA-OG 3.46Å; E590-S593 PolarHBondContact O-N 3.22Å; E590-S593 PolarHBondContact O-OG 3.14Å; S593-L595 VanDerWaalsContact C-N 3.28Å
594	N	67	Low	68.1	Low	115 Å²	115	42.7 Å²	42.7	62%	0.615	24%	0.236	S	C	*	.	S	Bend	trans	-78.6	-10.7	172.2	-67.6	-10.5	0	0	0	112.8	E590 L592 E596	E590-N594 WeakPolarHBondContact O-CB 3.37Å; E590-N594 PolarHBondContact O-N 3.47Å; E590-N594 PolarHBondContact O-ND2 3.19Å; E590-N594 PolarHBondContact O-OD1 3.05Å; L592-N594 VanDerWaalsContact C-N 3.34Å; N594-E596 PolarHBondContact O-N 2.97Å
595	L	69.8	Low	70.4	Confident	22.5 Å²	22.5	42.6 Å²	42.6	12%	0.118	23%	0.226	C	C	.	.	S	Bend	trans	-78.8	114.6	168.1	-178.6	71.4	0	0	0	109.1	L492 P591 L592 S593 V599 L600	L492-L595 HydrophobicContact CD2-CB 4.09Å; L492-L595 HydrophobicContact CD2-CD1 4.3Å; L492-L595 HydrophobicContact CD2-CD2 3.73Å; L492-L595 HydrophobicContact CD2-CG 4.25Å; P591-L595 PolarHBondContact O-N 2.69Å; L592-L595 PolarHBondContact O-N 3.22Å; S593-L595 VanDerWaalsContact C-N 3.28Å; L595-V599 HydrophobicContact CD1-CB 4.16Å; L595-V599 HydrophobicContact CD1-CG1 4.23Å; L595-V599 HydrophobicContact CD1-CG2 4.44Å; L595-L600 HydrophobicContact CD2-CD1 4.04Å; L595-L600 HydrophobicContact CD2-CD2 3.76Å; L595-L600 HydrophobicContact CD2-CG 3.71Å
596	E	71.8	Confident	72.7	Confident	112 Å²	112	43.5 Å²	43.5	52%	0.523	23%	0.232	S	C	.	.			trans	-56.2	127.8	173.4	-67.4	-172.1	-173.2	0	0	110.7	N594 N598 V599	N594-E596 PolarHBondContact O-N 2.97Å; E596-N598 HydrophobicContact CB-CB 4.19Å; E596-N598 PolarHBondContact O-N 3.18Å; E596-N598 VanDerWaalsContact O-N 3.1Å; E596-N598 PolarHBondContact OE2-ND2 3.14Å; E596-V599 HydrophobicContact CB-CG2 4.31Å; E596-V599 WeakPolarHBondContact O-CB 3.29Å; E596-V599 PolarHBondContact O-N 3.28Å
597	P	77.7	Confident	74.6	Confident	2 Å²	2	42.6 Å²	42.6	1%	0.013	23%	0.228	C	C	.	.	H	α-helix	trans	-63.9	-21.7	-179.3	27.4	-35.6	0	0	0	112.2	V599 L600 V601 I651 Q654 L655	P597-V599 PolarHBondContact O-N 3.11Å; P597-L600 PolarHBondContact O-N 3.05Å; P597-L600 VanDerWaalsContact O-N 3.08Å; P597-V601 WeakPolarHBondContact O-CG2 3.36Å; P597-V601 PolarHBondContact O-N 3.43Å; P597-I651 HydrophobicContact CB-CG2 3.85Å; P597-I651 HydrophobicContact CG-CG2 3.94Å; P597-Q654 HydrophobicContact CG-CB 3.75Å; P597-L655 HydrophobicContact CB-CD1 4.36Å; P597-L655 HydrophobicContact CB-CD2 3.91Å; P597-L655 HydrophobicContact CB-CG 3.86Å; P597-L655 HydrophobicContact CG-CD2 4.37Å; P597-L655 HydrophobicContact CG-CG 4.14Å
598	N	81.2	Confident	75.9	Confident	55 Å²	55	40.2 Å²	40.2	29%	0.294	22%	0.216	S	C	.	.	H	α-helix	trans	-45.2	-45.1	166.7	-55	-18.9	0	0	0	111.6	E596 V601 M602 N660	E596-N598 HydrophobicContact CB-CB 4.19Å; E596-N598 PolarHBondContact O-N 3.18Å; E596-N598 VanDerWaalsContact O-N 3.1Å; E596-N598 PolarHBondContact OE2-ND2 3.14Å; N598-V601 PolarHBondContact O-N 3.25Å; N598-M602 WeakPolarHBondContact O-CB 3.31Å; N598-M602 VanDerWaalsContact O-CG 3.31Å; N598-M602 WeakPolarHBondContact O-CG 3.34Å; N598-M602 PolarHBondContact O-N 3.23Å; N598-N660 PolarHBondContact OD1-ND2 3.32Å; N598-N660 PolarHBondContact OD1-OD1 3.12Å
599	V	83.6	Confident	77	Confident	48.5 Å²	48.5	42.1 Å²	42.1	29%	0.294	23%	0.227	S	C	.	.	H	α-helix	trans	-67	-41.6	-178.7	-177.8	0	0	0	0	110.8	T496 L595 E596 P597 M602 L603	T496-V599 HydrophobicContact CG2-CG1 4.48Å; L595-V599 HydrophobicContact CD1-CB 4.16Å; L595-V599 HydrophobicContact CD1-CG1 4.23Å; L595-V599 HydrophobicContact CD1-CG2 4.44Å; E596-V599 HydrophobicContact CB-CG2 4.31Å; E596-V599 WeakPolarHBondContact O-CB 3.29Å; E596-V599 PolarHBondContact O-N 3.28Å; P597-V599 PolarHBondContact O-N 3.11Å; V599-M602 PolarHBondContact O-N 3.18Å; V599-L603 HydrophobicContact CG1-CD1 4Å; V599-L603 HydrophobicContact CG1-CG 4.42Å; V599-L603 VanDerWaalsContact O-CB 3.31Å; V599-L603 WeakPolarHBondContact O-CB 3.45Å; V599-L603 VanDerWaalsContact O-CG 3.23Å; V599-L603 WeakPolarHBondContact O-CG 3.25Å; V599-L603 PolarHBondContact O-N 3.34Å
600	L	84.7	Confident	77.7	Confident	2 Å²	2	46.6 Å²	46.6	1%	0.01	25%	0.249	C	C	.	.	H	α-helix	trans	-66.8	-43.1	176	-67	178.2	0	0	0	111.8	L495 F507 L595 P597 L603 L604 I641 L642 L645	L495-L600 HydrophobicContact CD1-CD2 4.48Å; F507-L600 HydrophobicContact CE1-CD2 4.18Å; L595-L600 HydrophobicContact CD2-CD1 4.04Å; L595-L600 HydrophobicContact CD2-CD2 3.76Å; L595-L600 HydrophobicContact CD2-CG 3.71Å; P597-L600 PolarHBondContact O-N 3.05Å; P597-L600 VanDerWaalsContact O-N 3.08Å; L600-L603 PolarHBondContact O-N 3.2Å; L600-L604 VanDerWaalsContact O-CB 3.3Å; L600-L604 WeakPolarHBondContact O-CB 3.39Å; L600-L604 PolarHBondContact O-N 3.23Å; L600-I641 HydrophobicContact CD1-CG2 4.31Å; L600-L642 HydrophobicContact CB-CD1 4.3Å; L600-L642 HydrophobicContact CD1-CD1 4.36Å; L600-L645 HydrophobicContact CD1-CD1 3.62Å
601	V	86.6	Confident	78.2	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-62.1	-43.2	176.6	174.1	0	0	0	0	110.8	P597 N598 L604 H605 L642 L655 L663 L664 M667	P597-V601 WeakPolarHBondContact O-CG2 3.36Å; P597-V601 PolarHBondContact O-N 3.43Å; N598-V601 PolarHBondContact O-N 3.25Å; V601-L604 PolarHBondContact O-N 3.21Å; V601-H605 VanDerWaalsContact O-CB 3.3Å; V601-H605 WeakPolarHBondContact O-CB 3.33Å; V601-H605 PolarHBondContact O-N 3.07Å; V601-L642 HydrophobicContact CG2-CD2 4.04Å; V601-L655 HydrophobicContact CG2-CD2 3.67Å; V601-L663 HydrophobicContact CG1-CB 3.77Å; V601-L663 HydrophobicContact CG1-CD1 4.05Å; V601-L664 HydrophobicContact CG2-CD2 4.46Å; V601-L664 HydrophobicContact CG2-CG 4.49Å; V601-M667 HydrophobicContact CG1-CE 4.12Å
602	M	85.2	Confident	79	Confident	108.667 Å²	108.667	48.2 Å²	48.2	54%	0.535	25%	0.254	S	S	.	.	H	α-helix	trans	-66.7	-42	175.3	-74.4	-176.5	69.7	0	0	112.9	N598 V599 L604 H605 N606	N598-M602 WeakPolarHBondContact O-CB 3.31Å; N598-M602 VanDerWaalsContact O-CG 3.31Å; N598-M602 WeakPolarHBondContact O-CG 3.34Å; N598-M602 PolarHBondContact O-N 3.23Å; V599-M602 PolarHBondContact O-N 3.18Å; M602-L604 VanDerWaalsContact C-N 3.34Å; M602-L604 PolarHBondContact O-N 3.17Å; M602-H605 PolarHBondContact O-N 3.14Å; M602-N606 VanDerWaalsContact O-CB 3.25Å; M602-N606 WeakPolarHBondContact O-CB 3.42Å; M602-N606 PolarHBondContact O-N 2.99Å; M602-N606 PolarHBondContact O-ND2 3.31Å; M602-N606 VanDerWaalsContact O-ND2 3.16Å
603	L	83.9	Confident	79.3	Confident	31.6667 Å²	31.6667	56.8 Å²	56.8	17%	0.166	29%	0.286	C	S	.	.	H	α-helix	trans	-61.4	-43	175.2	-78.3	170.5	0	0	0	111.3	L495 V599 L600 N606 A607	L495-L603 HydrophobicContact CB-CD1 4.45Å; V599-L603 HydrophobicContact CG1-CD1 4Å; V599-L603 HydrophobicContact CG1-CG 4.42Å; V599-L603 VanDerWaalsContact O-CB 3.31Å; V599-L603 WeakPolarHBondContact O-CB 3.45Å; V599-L603 VanDerWaalsContact O-CG 3.23Å; V599-L603 WeakPolarHBondContact O-CG 3.25Å; V599-L603 PolarHBondContact O-N 3.34Å; L600-L603 PolarHBondContact O-N 3.2Å; L603-N606 PolarHBondContact O-N 3.23Å; L603-A607 VanDerWaalsContact O-CB 3.29Å; L603-A607 WeakPolarHBondContact O-CB 3.25Å; L603-A607 PolarHBondContact O-N 3.15Å
604	L	86.1	Confident	79.5	Confident	1 Å²	1	58.9 Å²	58.9	1%	0.005	30%	0.301	C	S	.	.	H	α-helix	trans	-65.5	-47.1	177.9	-162.1	101.3	0	0	0	111.3	L600 V601 M602 N606 A607 L608 L635 C638 A639 L642 M667 F676 L680	L600-L604 VanDerWaalsContact O-CB 3.3Å; L600-L604 WeakPolarHBondContact O-CB 3.39Å; L600-L604 PolarHBondContact O-N 3.23Å; V601-L604 PolarHBondContact O-N 3.21Å; M602-L604 VanDerWaalsContact C-N 3.34Å; M602-L604 PolarHBondContact O-N 3.17Å; L604-N606 VanDerWaalsContact C-N 3.34Å; L604-N606 PolarHBondContact O-N 3.29Å; L604-A607 PolarHBondContact O-N 3.2Å; L604-L608 WeakPolarHBondContact O-CB 3.39Å; L604-L608 PolarHBondContact O-N 3.1Å; L604-L635 HydrophobicContact CD1-CB 4.48Å; L604-L635 HydrophobicContact CD1-CD2 3.66Å; L604-L635 HydrophobicContact CD2-CD2 4.4Å; L604-L635 HydrophobicContact CG-CD2 4.05Å; L604-L635 WeakPolarHBondContact O-CD2 3.28Å; L604-C638 HydrophobicContact CD1-CB 3.93Å; L604-A639 HydrophobicContact CD1-CB 4.05Å; L604-L642 HydrophobicContact CD1-CD2 4.29Å; L604-L642 HydrophobicContact CD2-CD2 4.4Å; L604-M667 HydrophobicContact CB-SD 4.16Å; L604-M667 HydrophobicContact CD2-CE 3.96Å; L604-M667 HydrophobicContact CD2-SD 3.78Å; L604-M667 WeakPolarHBondContact CD2-SD 3.43Å; L604-M667 HydrophobicContact CG-SD 4.09Å; L604-F676 HydrophobicContact CD1-CE2 4.05Å; L604-F676 HydrophobicContact CD1-CZ 4.36Å; L604-F676 HydrophobicContact CD2-CE2 4Å; L604-F676 HydrophobicContact CD2-CZ 4.03Å; L604-F676 HydrophobicContact CG-CE2 4.18Å; L604-F676 HydrophobicContact CG-CZ 4.26Å; L604-L680 HydrophobicContact CD2-CD2 3.97Å
605	H	86.3	Confident	79.1	Confident	53 Å²	53	56.6 Å²	56.6	25%	0.245	30%	0.304	C	S	.	.	H	α-helix	trans	-59.9	-43.9	175.9	178.3	-86	0	0	0	112.2	V601 M602 L608 T609 M667	V601-H605 VanDerWaalsContact O-CB 3.3Å; V601-H605 WeakPolarHBondContact O-CB 3.33Å; V601-H605 PolarHBondContact O-N 3.07Å; M602-H605 PolarHBondContact O-N 3.14Å; H605-L608 PolarHBondContact O-N 2.71Å; H605-T609 VanDerWaalsContact O-CB 3.26Å; H605-T609 WeakPolarHBondContact O-CB 3.44Å; H605-T609 PolarHBondContact O-N 3.09Å; H605-T609 PolarHBondContact O-OG1 3.26Å; H605-M667 WeakPolarHBondContact CA-SD 3.32Å; H605-M667 HydrophobicContact CB-CG 4.35Å; H605-M667 HydrophobicContact CB-SD 3.7Å; H605-M667 VanDerWaalsContact CB-SD 3.56Å; H605-M667 PolarHBondContact N-SD 3.35Å; H605-M667 VanDerWaalsContact N-SD 3.42Å
606	N	84.5	Confident	78.4	Confident	84.3333 Å²	84.3333	62.2 Å²	62.2	45%	0.451	33%	0.334	S	S	.	.	H	α-helix	trans	-69.4	-40.7	179.8	-70.9	-21.5	0	0	0	112	M602 L603 L604 T609 M610	M602-N606 VanDerWaalsContact O-CB 3.25Å; M602-N606 WeakPolarHBondContact O-CB 3.42Å; M602-N606 PolarHBondContact O-N 2.99Å; M602-N606 PolarHBondContact O-ND2 3.31Å; M602-N606 VanDerWaalsContact O-ND2 3.16Å; L603-N606 PolarHBondContact O-N 3.23Å; L604-N606 VanDerWaalsContact C-N 3.34Å; L604-N606 PolarHBondContact O-N 3.29Å; N606-T609 PolarHBondContact O-N 3.1Å; N606-M610 WeakPolarHBondContact O-CG 3.35Å; N606-M610 PolarHBondContact O-N 3.29Å
607	A	81.8	Confident	77.6	Confident	38 Å²	38	60.2 Å²	60.2	31%	0.314	33%	0.33	S	S	.	.	H	α-helix	trans	-64	-44.3	174.8	0	0	0	0	0	111.7	L603 L604 T609 M610 E611 L635	L603-A607 VanDerWaalsContact O-CB 3.29Å; L603-A607 WeakPolarHBondContact O-CB 3.25Å; L603-A607 PolarHBondContact O-N 3.15Å; L604-A607 PolarHBondContact O-N 3.2Å; A607-T609 VanDerWaalsContact C-N 3.34Å; A607-T609 PolarHBondContact O-N 3.01Å; A607-M610 PolarHBondContact O-N 3.29Å; A607-M610 VanDerWaalsContact O-N 3.17Å; A607-E611 PolarHBondContact O-N 2.94Å; A607-L635 HydrophobicContact CB-CD2 3.58Å; A607-L635 HydrophobicContact CB-CG 4.19Å
608	L	85.1	Confident	76.6	Confident	5.66667 Å²	5.66667	69.3 Å²	69.3	3%	0.03	37%	0.369	C	S	.	.	H	α-helix	trans	-65.3	-38.2	176.2	-178.7	61.6	0	0	0	112	L604 H605 M610 E611 K612 L635 M667 L672 F676	L604-L608 WeakPolarHBondContact O-CB 3.39Å; L604-L608 PolarHBondContact O-N 3.1Å; H605-L608 PolarHBondContact O-N 2.71Å; L608-M610 VanDerWaalsContact C-N 3.29Å; L608-M610 PolarHBondContact O-N 3.16Å; L608-E611 PolarHBondContact O-N 3.29Å; L608-K612 HydrophobicContact CD1-CG 4.31Å; L608-K612 WeakPolarHBondContact O-CG 3.31Å; L608-K612 PolarHBondContact O-N 2.99Å; L608-L635 HydrophobicContact CB-CD1 4.29Å; L608-L635 HydrophobicContact CB-CD2 4.22Å; L608-L635 HydrophobicContact CD1-CD1 4.15Å; L608-M667 HydrophobicContact CD2-CB 3.86Å; L608-M667 HydrophobicContact CD2-CG 3.96Å; L608-M667 HydrophobicContact CD2-SD 4.45Å; L608-L672 HydrophobicContact CD1-CD2 3.65Å; L608-L672 HydrophobicContact CD2-CD2 4.26Å; L608-F676 HydrophobicContact CD1-CE1 4.1Å; L608-F676 HydrophobicContact CD2-CE1 4.18Å; L608-F676 HydrophobicContact CD2-CZ 4.43Å
609	T	82.8	Confident	75.9	Confident	43.3333 Å²	43.3333	71.7 Å²	71.7	27%	0.266	38%	0.375	S	S	.	.	H	α-helix	trans	-62.6	-35.2	174.2	-62.5	0	0	0	0	111.9	H605 N606 A607 R613	H605-T609 VanDerWaalsContact O-CB 3.26Å; H605-T609 WeakPolarHBondContact O-CB 3.44Å; H605-T609 PolarHBondContact O-N 3.09Å; H605-T609 PolarHBondContact O-OG1 3.26Å; N606-T609 PolarHBondContact O-N 3.1Å; A607-T609 VanDerWaalsContact C-N 3.34Å; A607-T609 PolarHBondContact O-N 3.01Å; T609-R613 WeakPolarHBondContact O-CD 3.34Å; T609-R613 VanDerWaalsContact O-CG 3.26Å; T609-R613 WeakPolarHBondContact O-CG 3.22Å; T609-R613 PolarHBondContact O-N 3.08Å
610	M	75.8	Confident	74.7	Confident	110.333 Å²	110.333	73.2 Å²	73.2	54%	0.544	40%	0.4	S	S	.	.	H	α-helix	trans	-74.9	-37.8	174.9	-70.1	-60.9	-65.5	0	0	112.4	N606 A607 L608 R613 S614	N606-M610 WeakPolarHBondContact O-CG 3.35Å; N606-M610 PolarHBondContact O-N 3.29Å; A607-M610 PolarHBondContact O-N 3.29Å; A607-M610 VanDerWaalsContact O-N 3.17Å; L608-M610 VanDerWaalsContact C-N 3.29Å; L608-M610 PolarHBondContact O-N 3.16Å; M610-R613 WeakPolarHBondContact O-CB 3.24Å; M610-R613 PolarHBondContact O-N 2.88Å; M610-R613 VanDerWaalsContact O-N 3.1Å; M610-R613 PolarHBondContact SD-NH1 3.46Å; M610-S614 PolarHBondContact O-N 3Å; M610-S614 PolarHBondContact O-OG 3.16Å
611	E	76.3	Confident	74.2	Confident	32 Å²	32	73.9 Å²	73.9	15%	0.15	41%	0.405	C	S	.	.	H	α-helix	trans	-63.7	-48.2	174.3	-176	169.1	-118	0	0	111.9	A607 L608 R613 S614 V617 H632 L635	A607-E611 PolarHBondContact O-N 2.94Å; L608-E611 PolarHBondContact O-N 3.29Å; E611-R613 PolarHBondContact O-N 3.45Å; E611-R613 VanDerWaalsContact O-N 3.08Å; E611-S614 WeakPolarHBondContact O-CB 3.32Å; E611-S614 PolarHBondContact O-N 3.33Å; E611-V617 HydrophobicContact CG-CG2 4.05Å; E611-H632 VanDerWaalsContact CD-ND1 3.34Å; E611-H632 WeakPolarHBondContact OE1-CA 3.31Å; E611-H632 VanDerWaalsContact OE1-CB 3.3Å; E611-H632 WeakPolarHBondContact OE1-CB 3.36Å; E611-H632 IonicContact OE1-CG 3.3Å; E611-H632 PolarHBondContact OE1-N 2.88Å; E611-H632 IonicContact OE1-ND1 2.81Å; E611-H632 PolarHBondContact OE1-ND1 3.26Å; E611-H632 IonicContact OE2-CE1 3.99Å; E611-H632 IonicContact OE2-ND1 3.38Å; E611-H632 PolarHBondContact OE2-ND1 3.38Å; E611-L635 VanDerWaalsContact OE2-CD1 3.24Å; E611-L635 WeakPolarHBondContact OE2-CD1 3.45Å
612	K	77.5	Confident	73.4	Confident	101 Å²	101	76.6 Å²	76.6	44%	0.439	42%	0.419	S	S	.	.	H	α-helix	trans	-60.7	-19.9	176.4	-70.5	-168.4	-177.3	-171.2	0	113.7	L608 D669	L608-K612 HydrophobicContact CD1-CG 4.31Å; L608-K612 WeakPolarHBondContact O-CG 3.31Å; L608-K612 PolarHBondContact O-N 2.99Å; K612-D669 IonicContact NZ-OD2 2.66Å; K612-D669 PolarHBondContact NZ-OD2 3.25Å
613	R	75.1	Confident	72.7	Confident	184 Å²	184	71.7 Å²	71.7	69%	0.694	40%	0.395	S	S	*	.	H	α-helix	trans	-83.1	-18.5	172.2	-72.8	168.6	-178.3	178.1	0.3	114	T609 M610 E611 G615	T609-R613 WeakPolarHBondContact O-CD 3.34Å; T609-R613 VanDerWaalsContact O-CG 3.26Å; T609-R613 WeakPolarHBondContact O-CG 3.22Å; T609-R613 PolarHBondContact O-N 3.08Å; M610-R613 WeakPolarHBondContact O-CB 3.24Å; M610-R613 PolarHBondContact O-N 2.88Å; M610-R613 VanDerWaalsContact O-N 3.1Å; M610-R613 PolarHBondContact SD-NH1 3.46Å; E611-R613 PolarHBondContact O-N 3.45Å; E611-R613 VanDerWaalsContact O-N 3.08Å; R613-G615 VanDerWaalsContact C-N 3.34Å
614	S	66.3	Low	72	Confident	87.6667 Å²	87.6667	72.9 Å²	72.9	61%	0.613	41%	0.407	S	S	*	.	H	α-helix	trans	-84.2	-11.9	-173.3	-61.4	0	0	0	0	114.1	M610 E611 D616	M610-S614 PolarHBondContact O-N 3Å; M610-S614 PolarHBondContact O-OG 3.16Å; E611-S614 WeakPolarHBondContact O-CB 3.32Å; E611-S614 PolarHBondContact O-N 3.33Å; S614-D616 VanDerWaalsContact C-N 3.28Å; S614-D616 PolarHBondContact O-N 3.19Å
615	G	58.3	Low	71.3	Confident	66.6667 Å²	66.6667	81.5 Å²	81.5	69%	0.687	44%	0.439	S	S	*	.			trans	76.7	-44.1	161.7	0	0	0	0	0	117.5	R613 V617	R613-G615 VanDerWaalsContact C-N 3.34Å; G615-V617 PolarHBondContact O-N 3.39Å
616	D	54.9	Low	70.9	Confident	138.333 Å²	138.333	81.5 Å²	81.5	74%	0.74	44%	0.437	S	S	*	.			trans	-119.2	89.9	-174.5	-105.3	-42.7	0	0	0	111.3	S614 K618	S614-D616 VanDerWaalsContact C-N 3.28Å; S614-D616 PolarHBondContact O-N 3.19Å; D616-K618 VanDerWaalsContact C-N 3.32Å; D616-K618 PolarHBondContact O-N 2.89Å
617	V	56.2	Low	70.3	Confident	71.6667 Å²	71.6667	80 Å²	80	43%	0.434	43%	0.433	S	S	.	.			trans	-97.7	96.2	179.3	-174.3	0	0	0	0	110.7	E611 G615 Y619	E611-V617 HydrophobicContact CG-CG2 4.05Å; G615-V617 PolarHBondContact O-N 3.39Å; V617-Y619 HydrophobicContact CB-CE1 4.46Å; V617-Y619 HydrophobicContact CG1-CD1 4.13Å; V617-Y619 HydrophobicContact CG1-CD2 4.25Å; V617-Y619 HydrophobicContact CG1-CE1 3.89Å; V617-Y619 VanDerWaalsContact CG1-CE1 3.48Å; V617-Y619 HydrophobicContact CG1-CE2 3.51Å; V617-Y619 VanDerWaalsContact CG1-OH 3.3Å; V617-Y619 WeakPolarHBondContact CG1-OH 3.29Å; V617-Y619 PolarHBondContact O-N 3.22Å
618	K	57.1	Low	69.8	Low	192 Å²	192	80.3 Å²	80.3	84%	0.835	43%	0.426	S	S	*	.			trans	-95.8	104.8	168.4	-74.9	-179.3	179.4	170.3	0	110.3	D616 G620	D616-K618 VanDerWaalsContact C-N 3.32Å; D616-K618 PolarHBondContact O-N 2.89Å; K618-G620 PolarHBondContact O-N 3.15Å; K618-G620 VanDerWaalsContact O-N 3.08Å
619	Y	64.8	Low	69	Low	105.333 Å²	105.333	90.7 Å²	90.7	41%	0.413	47%	0.465	S	S	.	.			trans	-66.1	99.5	177.2	-52.7	-67.1	0	0	0	111.3	V617 C621 E673	V617-Y619 HydrophobicContact CB-CE1 4.46Å; V617-Y619 HydrophobicContact CG1-CD1 4.13Å; V617-Y619 HydrophobicContact CG1-CD2 4.25Å; V617-Y619 HydrophobicContact CG1-CE1 3.89Å; V617-Y619 VanDerWaalsContact CG1-CE1 3.48Å; V617-Y619 HydrophobicContact CG1-CE2 3.51Å; V617-Y619 VanDerWaalsContact CG1-OH 3.3Å; V617-Y619 WeakPolarHBondContact CG1-OH 3.29Å; V617-Y619 PolarHBondContact O-N 3.22Å; Y619-C621 VanDerWaalsContact C-N 3.31Å; Y619-E673 HydrophobicContact CD1-CB 4.31Å; Y619-E673 HydrophobicContact CD1-CG 4.17Å; Y619-E673 HydrophobicContact CE1-CB 3.8Å; Y619-E673 HydrophobicContact CE1-CG 3.98Å; Y619-E673 HydrophobicContact CE2-CB 4.45Å; Y619-E673 HydrophobicContact CE2-CG 4.43Å; Y619-E673 HydrophobicContact CG-CG 4.48Å; Y619-E673 PolarHBondContact OH-N 3.1Å
620	G	60.4	Low	68.7	Low	80.6667 Å²	80.6667	89.7 Å²	89.7	83%	0.832	46%	0.459	S	S	*	.			trans	-93.4	3.3	178.6	0	0	0	0	0	115.1	K618	K618-G620 PolarHBondContact O-N 3.15Å; K618-G620 VanDerWaalsContact O-N 3.08Å
621	C	73.8	Confident	68.5	Low	17 Å²	17	87.8 Å²	87.8	12%	0.115	46%	0.46	C	S	.	.	S	Bend	trans	-106.4	144.6	180	56.3	0	0	0	0	111.4	Y619 R625 C633 Q721	Y619-C621 VanDerWaalsContact C-N 3.31Å; C621-R625 WeakPolarHBondContact CB-O 3.41Å; C621-C633 VanDerWaalsContact SG-SG 3.63Å; C621-Q721 PolarHBondContact O-NE2 2.98Å
622	L	70.1	Confident	68.6	Low	56.3333 Å²	56.3333	86.3 Å²	86.3	30%	0.295	45%	0.454	S	S	.	.			trans	-82.5	153.8	169.7	-67.6	127.9	0	0	0	109.9	S624 R625 R626 Q721 E782	L622-S624 PolarHBondContact O-N 3.08Å; L622-S624 VanDerWaalsContact O-N 3.15Å; L622-R625 HydrophobicContact CB-CB 4.29Å; L622-R625 HydrophobicContact CB-CG 4.46Å; L622-R625 HydrophobicContact CD1-CB 4.27Å; L622-R625 HydrophobicContact CD1-CG 4.41Å; L622-R625 CarbonylContact O-C 3.56Å; L622-R625 PolarHBondContact O-N 3.07Å; L622-R625 VanDerWaalsContact O-O 3.09Å; L622-R626 PolarHBondContact O-NH1 3.32Å; L622-Q721 VanDerWaalsContact CD2-CD 3.46Å; L622-Q721 HydrophobicContact CD2-CG 4.06Å; L622-E782 WeakPolarHBondContact CB-OE1 3.47Å; L622-E782 HydrophobicContact CD2-CG 3.86Å; L622-E782 VanDerWaalsContact CD2-OE2 3.31Å; L622-E782 WeakPolarHBondContact CD2-OE2 3.37Å
623	P	69	Low	69	Low	5.66667 Å²	5.66667	81.5 Å²	81.5	4%	0.037	43%	0.433	C	S	.	.	T	Hydrogen-bonded Turn	trans	-48	-38.9	168.9	-30.5	36.1	0	0	0	113.5	R626 Q721 F725 E782 Y785 I786	P623-R626 PolarHBondContact O-NH1 2.89Å; P623-R626 PolarHBondContact O-NH2 3.04Å; P623-Q721 VanDerWaalsContact CD-OE1 3.24Å; P623-F725 HydrophobicContact CG-CZ 4.46Å; P623-E782 WeakPolarHBondContact CB-OE2 3.29Å; P623-E782 WeakPolarHBondContact CD-OE2 3.44Å; P623-Y785 HydrophobicContact CB-CD1 4.29Å; P623-Y785 HydrophobicContact CB-CE1 4.27Å; P623-Y785 VanDerWaalsContact O-CE1 3.23Å; P623-Y785 WeakPolarHBondContact O-CE1 3.34Å; P623-Y785 PolarHBondContact O-OH 3.38Å; P623-I786 HydrophobicContact CB-CD1 4.28Å; P623-I786 HydrophobicContact CB-CG1 4.13Å; P623-I786 HydrophobicContact CG-CD1 4.1Å; P623-I786 HydrophobicContact CG-CG1 4.21Å
624	S	69.7	Low	69.4	Low	57 Å²	57	73.9 Å²	73.9	40%	0.399	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79	-17.4	176.7	65.5	0	0	0	0	115.4	L622 E782	L622-S624 PolarHBondContact O-N 3.08Å; L622-S624 VanDerWaalsContact O-N 3.15Å; S624-E782 VanDerWaalsContact CB-OE1 3.31Å; S624-E782 WeakPolarHBondContact CB-OE1 3.46Å; S624-E782 WeakPolarHBondContact CB-OE2 3.24Å; S624-E782 PolarHBondContact N-OE1 2.87Å; S624-E782 VanDerWaalsContact N-OE1 3.08Å; S624-E782 PolarHBondContact N-OE2 3.08Å; S624-E782 PolarHBondContact OG-OE1 3.18Å; S624-E782 PolarHBondContact OG-OE2 3.21Å
625	R	72.3	Confident	70.4	Confident	180.667 Å²	180.667	69.8 Å²	69.8	68%	0.682	38%	0.379	S	S	*	.			trans	-129.8	104.3	-170.4	-63.1	-171.9	-179.1	-167.7	-1.3	112.8	C621 L622	C621-R625 WeakPolarHBondContact CB-O 3.41Å; L622-R625 HydrophobicContact CB-CB 4.29Å; L622-R625 HydrophobicContact CB-CG 4.46Å; L622-R625 HydrophobicContact CD1-CB 4.27Å; L622-R625 HydrophobicContact CD1-CG 4.41Å; L622-R625 CarbonylContact O-C 3.56Å; L622-R625 PolarHBondContact O-N 3.07Å; L622-R625 VanDerWaalsContact O-O 3.09Å
626	R	77.1	Confident	71.8	Confident	53.6667 Å²	53.6667	66.8 Å²	66.8	20%	0.203	35%	0.347	C	S	.	.			trans	-84.7	153.7	174.8	-53.5	-51.9	171.8	-163.6	-1	112	F504 L622 P623 C633 I636 L637 Q675	F504-R626 HydrophobicContact CE2-CB 4.4Å; F504-R626 HydrophobicContact CZ-CB 4.26Å; L622-R626 PolarHBondContact O-NH1 3.32Å; P623-R626 PolarHBondContact O-NH1 2.89Å; P623-R626 PolarHBondContact O-NH2 3.04Å; R626-C633 HydrophobicContact CB-CB 4.08Å; R626-C633 VanDerWaalsContact CD-SG 3.57Å; R626-C633 HydrophobicContact CG-CB 4.49Å; R626-I636 VanDerWaalsContact NH1-CD1 3.27Å; R626-L637 HydrophobicContact CG-CD2 4.38Å; R626-Q675 VanDerWaalsContact NH2-NE2 3.16Å
627	S	72	Confident	73.4	Confident	52 Å²	52	60.8 Å²	60.8	36%	0.364	32%	0.315	S	S	.	.			trans	-141.4	137.2	179	177	0	0	0	0	111.3	F504 R629 C630	F504-S627 VanDerWaalsContact CE2-C 3.47Å; F504-S627 WeakPolarHBondContact CE2-O 3.32Å; S627-R629 PolarHBondContact O-N 3.27Å; S627-R629 VanDerWaalsContact O-N 3.15Å; S627-R629 PolarHBondContact OG-N 3.42Å; S627-C630 WeakPolarHBondContact O-CB 3.34Å; S627-C630 PolarHBondContact O-N 3.11Å
628	R	71.1	Confident	74.9	Confident	44.3333 Å²	44.3333	57.5 Å²	57.5	17%	0.167	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.3	-34.8	175.6	-61.2	168.9	-169.7	-75.7	-9.7	112.9	D441 S445 F504 T505 C630	D441-R628 PolarHBondContact O-NH1 3.07Å; S445-R628 VanDerWaalsContact OG-CZ 3.3Å; S445-R628 PolarHBondContact OG-NH1 3.36Å; S445-R628 PolarHBondContact OG-NH2 3.07Å; F504-R628 HydrophobicContact CD1-CB 4.29Å; F504-R628 HydrophobicContact CD1-CG 3.6Å; F504-R628 HydrophobicContact CE1-CB 4.44Å; F504-R628 HydrophobicContact CE1-CG 3.62Å; F504-R628 HydrophobicContact CG-CG 4.28Å; F504-R628 HydrophobicContact CZ-CG 4.28Å; T505-R628 PolarHBondContact OG1-NH1 3.27Å; T505-R628 VanDerWaalsContact OG1-NH1 3.1Å; R628-C630 VanDerWaalsContact C-N 3.28Å; R628-C630 PolarHBondContact O-N 3.12Å
629	R	69.6	Low	76.5	Confident	226 Å²	226	48.3 Å²	48.3	85%	0.853	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-6.7	-176.6	-58.9	-177.4	-173.7	170.5	3	113.2	S627	S627-R629 PolarHBondContact O-N 3.27Å; S627-R629 VanDerWaalsContact O-N 3.15Å; S627-R629 PolarHBondContact OG-N 3.42Å
630	C	74.5	Confident	77.7	Confident	21.3333 Å²	21.3333	46.5 Å²	46.5	14%	0.144	25%	0.247	C	C	.	.			trans	-103.3	105.2	176.8	-176.7	0	0	0	0	109.3	S627 R628 H632 C633	S627-C630 WeakPolarHBondContact O-CB 3.34Å; S627-C630 PolarHBondContact O-N 3.11Å; R628-C630 VanDerWaalsContact C-N 3.28Å; R628-C630 PolarHBondContact O-N 3.12Å; C630-H632 PolarHBondContact O-N 3.21Å; C630-H632 VanDerWaalsContact O-N 3.16Å; C630-C633 HydrophobicContact CB-CB 4.31Å; C630-C633 WeakPolarHBondContact O-CB 3.26Å; C630-C633 PolarHBondContact O-N 3.09Å
631	A	72.1	Confident	79	Confident	69.6667 Å²	69.6667	42.8 Å²	42.8	58%	0.576	21%	0.208	S	C	*	.	H	α-helix	trans	-51.5	-41.6	179.6	0	0	0	0	0	112.1	C633 S634	A631-C633 VanDerWaalsContact C-N 3.26Å; A631-C633 PolarHBondContact O-N 3.1Å; A631-S634 WeakPolarHBondContact O-CB 3.45Å; A631-S634 PolarHBondContact O-N 3.24Å; A631-S634 VanDerWaalsContact O-N 3.1Å; A631-S634 PolarHBondContact O-OG 3.44Å
632	H	79.2	Confident	79.7	Confident	2.33333 Å²	2.33333	42 Å²	42	1%	0.011	20%	0.203	C	C	.	.	H	α-helix	trans	-56.8	-33	176.9	-166	57.1	0	0	0	114.6	E611 C630 S634 L635 I636 E673 F676	E611-H632 VanDerWaalsContact CD-ND1 3.34Å; E611-H632 WeakPolarHBondContact OE1-CA 3.31Å; E611-H632 VanDerWaalsContact OE1-CB 3.3Å; E611-H632 WeakPolarHBondContact OE1-CB 3.36Å; E611-H632 IonicContact OE1-CG 3.3Å; E611-H632 PolarHBondContact OE1-N 2.88Å; E611-H632 IonicContact OE1-ND1 2.81Å; E611-H632 PolarHBondContact OE1-ND1 3.26Å; E611-H632 IonicContact OE2-CE1 3.99Å; E611-H632 IonicContact OE2-ND1 3.38Å; E611-H632 PolarHBondContact OE2-ND1 3.38Å; C630-H632 PolarHBondContact O-N 3.21Å; C630-H632 VanDerWaalsContact O-N 3.16Å; H632-S634 PolarHBondContact O-N 2.89Å; H632-L635 WeakPolarHBondContact O-CB 3.37Å; H632-L635 PolarHBondContact O-N 3.08Å; H632-L635 VanDerWaalsContact O-N 3.09Å; H632-I636 WeakPolarHBondContact NE2-CD1 3.35Å; H632-I636 WeakPolarHBondContact NE2-CG1 3.33Å; H632-I636 PolarHBondContact O-N 3.06Å; H632-E673 IonicContact CD2-OE2 3.2Å; H632-E673 VanDerWaalsContact CE1-CB 3.45Å; H632-E673 WeakPolarHBondContact CE1-CB 3.22Å; H632-E673 IonicContact CE1-OE2 3.89Å; H632-E673 VanDerWaalsContact NE2-CB 3.3Å; H632-E673 WeakPolarHBondContact NE2-CB 3.41Å; H632-E673 VanDerWaalsContact NE2-CG 3.3Å; H632-E673 WeakPolarHBondContact NE2-CG 3.4Å; H632-E673 IonicContact NE2-OE2 3.55Å; H632-E673 PolarHBondContact NE2-OE2 3.07Å; H632-F676 WeakPolarHBondContact CE1-CB 3.46Å; H632-F676 AromaticContact CE1-CD1 3.94Å; H632-F676 AromaticContact CE1-CG 3.85Å; H632-F676 WeakPolarHBondContact NE2-CB 3.35Å; H632-F676 AromaticContact NE2-CG 4Å
633	C	85.2	Confident	80.6	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-63.4	-29.4	179	-71.5	0	0	0	0	112.3	F504 C621 R626 C630 A631 L637	F504-C633 HydrophobicContact CD2-CB 4.37Å; F504-C633 HydrophobicContact CE2-CB 3.72Å; C621-C633 VanDerWaalsContact SG-SG 3.63Å; R626-C633 HydrophobicContact CB-CB 4.08Å; R626-C633 VanDerWaalsContact CD-SG 3.57Å; R626-C633 HydrophobicContact CG-CB 4.49Å; C630-C633 HydrophobicContact CB-CB 4.31Å; C630-C633 WeakPolarHBondContact O-CB 3.26Å; C630-C633 PolarHBondContact O-N 3.09Å; A631-C633 VanDerWaalsContact C-N 3.26Å; A631-C633 PolarHBondContact O-N 3.1Å; C633-L637 WeakPolarHBondContact O-CB 3.39Å; C633-L637 VanDerWaalsContact O-CG 3.27Å; C633-L637 WeakPolarHBondContact O-CG 3.43Å; C633-L637 PolarHBondContact O-N 3.03Å
634	S	83.2	Confident	81.4	Confident	23.3333 Å²	23.3333	41.7 Å²	41.7	16%	0.163	20%	0.2	C	C	.	.	H	α-helix	trans	-67.6	-37.2	173.7	-30.8	0	0	0	0	112.3	A631 H632 C638	A631-S634 WeakPolarHBondContact O-CB 3.45Å; A631-S634 PolarHBondContact O-N 3.24Å; A631-S634 VanDerWaalsContact O-N 3.1Å; A631-S634 PolarHBondContact O-OG 3.44Å; H632-S634 PolarHBondContact O-N 2.89Å; S634-C638 VanDerWaalsContact O-CB 3.25Å; S634-C638 WeakPolarHBondContact O-CB 3.27Å; S634-C638 PolarHBondContact O-N 3.09Å
635	L	87.4	Confident	82.1	Confident	2.66667 Å²	2.66667	39.1 Å²	39.1	1%	0.014	18%	0.181	C	C	.	.	H	α-helix	trans	-64.9	-46	174.7	-74.8	171.8	0	0	0	111.4	L604 A607 L608 E611 H632 L637 C638 A639 F676	L604-L635 HydrophobicContact CD1-CB 4.48Å; L604-L635 HydrophobicContact CD1-CD2 3.66Å; L604-L635 HydrophobicContact CD2-CD2 4.4Å; L604-L635 HydrophobicContact CG-CD2 4.05Å; L604-L635 WeakPolarHBondContact O-CD2 3.28Å; A607-L635 HydrophobicContact CB-CD2 3.58Å; A607-L635 HydrophobicContact CB-CG 4.19Å; L608-L635 HydrophobicContact CB-CD1 4.29Å; L608-L635 HydrophobicContact CB-CD2 4.22Å; L608-L635 HydrophobicContact CD1-CD1 4.15Å; E611-L635 VanDerWaalsContact OE2-CD1 3.24Å; E611-L635 WeakPolarHBondContact OE2-CD1 3.45Å; H632-L635 WeakPolarHBondContact O-CB 3.37Å; H632-L635 PolarHBondContact O-N 3.08Å; H632-L635 VanDerWaalsContact O-N 3.09Å; L635-L637 PolarHBondContact O-N 3.01Å; L635-C638 PolarHBondContact O-N 3.07Å; L635-A639 VanDerWaalsContact O-CB 3.31Å; L635-A639 WeakPolarHBondContact O-CB 3.35Å; L635-A639 PolarHBondContact O-N 3.08Å; L635-F676 HydrophobicContact CB-CD2 4.09Å; L635-F676 HydrophobicContact CB-CE2 3.96Å; L635-F676 HydrophobicContact CB-CZ 4.3Å; L635-F676 HydrophobicContact CD1-CE1 4.36Å; L635-F676 HydrophobicContact CD1-CZ 4.4Å; L635-F676 HydrophobicContact CD2-CE2 4.29Å; L635-F676 HydrophobicContact CD2-CZ 4.2Å; L635-F676 HydrophobicContact CG-CE2 4.4Å; L635-F676 HydrophobicContact CG-CZ 4.46Å
636	I	87.8	Confident	82.7	Confident	3 Å²	3	30.5 Å²	30.5	2%	0.015	15%	0.149	C	C	.	.	H	α-helix	trans	-59.3	-48.3	175.9	-67.7	177.5	0	0	0	111.4	R626 H632 C638 A639 R640 Q675 F676 Y679	R626-I636 VanDerWaalsContact NH1-CD1 3.27Å; H632-I636 WeakPolarHBondContact NE2-CD1 3.35Å; H632-I636 WeakPolarHBondContact NE2-CG1 3.33Å; H632-I636 PolarHBondContact O-N 3.06Å; I636-C638 VanDerWaalsContact C-N 3.34Å; I636-C638 PolarHBondContact O-N 3.17Å; I636-A639 PolarHBondContact O-N 3.08Å; I636-R640 WeakPolarHBondContact O-CB 3.35Å; I636-R640 PolarHBondContact O-N 3.22Å; I636-Q675 HydrophobicContact CD1-CB 4.46Å; I636-Q675 HydrophobicContact CD1-CG 4.31Å; I636-F676 HydrophobicContact CG1-CB 4.09Å; I636-Y679 HydrophobicContact CG2-CD2 4.27Å; I636-Y679 HydrophobicContact CG2-CE2 3.78Å
637	L	88.1	Confident	82.9	Confident	11.6667 Å²	11.6667	32.1 Å²	32.1	6%	0.061	16%	0.158	C	C	.	.	H	α-helix	trans	-66.5	-36.6	-178.1	-69.2	168.4	0	0	0	112.1	F504 F507 H508 N511 R626 C633 L635 I641	F504-L637 HydrophobicContact CD2-CD1 4.27Å; F504-L637 HydrophobicContact CE2-CD1 3.9Å; F504-L637 HydrophobicContact CZ-CD1 4.12Å; F507-L637 HydrophobicContact CB-CB 3.76Å; H508-L637 HydrophobicContact CB-CD1 4.42Å; N511-L637 HydrophobicContact CB-CD2 4.26Å; N511-L637 PolarHBondContact ND2-O 2.75Å; R626-L637 HydrophobicContact CG-CD2 4.38Å; C633-L637 WeakPolarHBondContact O-CB 3.39Å; C633-L637 VanDerWaalsContact O-CG 3.27Å; C633-L637 WeakPolarHBondContact O-CG 3.43Å; C633-L637 PolarHBondContact O-N 3.03Å; L635-L637 PolarHBondContact O-N 3.01Å; L637-I641 WeakPolarHBondContact O-CG1 3.43Å; L637-I641 PolarHBondContact O-N 3.07Å
638	C	89.2	Confident	83	Confident	2 Å²	2	31.3 Å²	31.3	1%	0.014	15%	0.149	C	C	.	.	H	α-helix	trans	-66.2	-45.8	172.8	-174.3	0	0	0	0	111.9	F507 L604 S634 L635 I636 R640 I641 L642	F507-C638 HydrophobicContact CD1-CB 4.18Å; F507-C638 HydrophobicContact CD2-CB 4.22Å; F507-C638 HydrophobicContact CE1-CB 3.74Å; F507-C638 HydrophobicContact CE2-CB 3.8Å; F507-C638 HydrophobicContact CG-CB 4.41Å; F507-C638 HydrophobicContact CZ-CB 3.54Å; F507-C638 VanDerWaalsContact CZ-SG 3.5Å; F507-C638 WeakPolarHBondContact CZ-SG 3.36Å; L604-C638 HydrophobicContact CD1-CB 3.93Å; S634-C638 VanDerWaalsContact O-CB 3.25Å; S634-C638 WeakPolarHBondContact O-CB 3.27Å; S634-C638 PolarHBondContact O-N 3.09Å; L635-C638 PolarHBondContact O-N 3.07Å; I636-C638 VanDerWaalsContact C-N 3.34Å; I636-C638 PolarHBondContact O-N 3.17Å; C638-R640 VanDerWaalsContact C-N 3.31Å; C638-R640 PolarHBondContact O-N 3.09Å; C638-I641 PolarHBondContact O-N 3.07Å; C638-L642 WeakPolarHBondContact O-CB 3.42Å; C638-L642 PolarHBondContact O-N 3.05Å
639	A	90.1	Very high	83.2	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-62.3	-36.7	178	0	0	0	0	0	112.4	L604 L635 I636 L642 L643 F676 Y679	L604-A639 HydrophobicContact CD1-CB 4.05Å; L635-A639 VanDerWaalsContact O-CB 3.31Å; L635-A639 WeakPolarHBondContact O-CB 3.35Å; L635-A639 PolarHBondContact O-N 3.08Å; I636-A639 PolarHBondContact O-N 3.08Å; A639-L642 PolarHBondContact O-N 3.44Å; A639-L643 VanDerWaalsContact O-CB 3.31Å; A639-L643 WeakPolarHBondContact O-CB 3.44Å; A639-L643 PolarHBondContact O-N 3.31Å; A639-F676 HydrophobicContact CB-CD2 3.93Å; A639-F676 HydrophobicContact CB-CE2 3.99Å; A639-Y679 HydrophobicContact CB-CD2 4.16Å
640	R	90.2	Very high	83.5	Confident	66.6667 Å²	66.6667	27.6 Å²	27.6	25%	0.252	14%	0.143	S	C	.	.	H	α-helix	trans	-64.6	-41.3	175.2	-173.9	167.3	179.4	-114.6	4.8	112.5	N511 D515 I636 C638 F644 Y679	N511-R640 WeakPolarHBondContact OD1-CD 3.41Å; N511-R640 WeakPolarHBondContact OD1-CG 3.36Å; N511-R640 PolarHBondContact OD1-NH1 3Å; D515-R640 IonicContact OD1-CZ 2.89Å; D515-R640 IonicContact OD1-NH1 3.18Å; D515-R640 IonicContact OD1-NH2 2.99Å; D515-R640 PolarHBondContact OD1-NH2 3.27Å; D515-R640 IonicContact OD2-CZ 3.57Å; D515-R640 VanDerWaalsContact OD2-CZ 3.29Å; D515-R640 IonicContact OD2-NH1 2.83Å; D515-R640 PolarHBondContact OD2-NH1 3.41Å; D515-R640 IonicContact OD2-NH2 3.15Å; D515-R640 PolarHBondContact OD2-NH2 3.08Å; I636-R640 WeakPolarHBondContact O-CB 3.35Å; I636-R640 PolarHBondContact O-N 3.22Å; C638-R640 VanDerWaalsContact C-N 3.31Å; C638-R640 PolarHBondContact O-N 3.09Å; R640-F644 PolarHBondContact O-N 3.3Å; R640-F644 VanDerWaalsContact O-N 3.12Å; R640-Y679 HydrophobicContact CB-CD2 4.39Å; R640-Y679 HydrophobicContact CB-CE2 4.11Å
641	I	87.6	Confident	83.7	Confident	2.66667 Å²	2.66667	26.8 Å²	26.8	1%	0.014	14%	0.137	C	C	.	.	H	α-helix	trans	-65.7	-45.6	173.4	-69.6	161.1	0	0	0	110.6	F507 L510 N511 I514 L600 L637 C638 L643 F644 L645	F507-I641 HydrophobicContact CB-CD1 4.4Å; F507-I641 HydrophobicContact CD1-CD1 3.77Å; L510-I641 HydrophobicContact CB-CD1 3.8Å; L510-I641 HydrophobicContact CD1-CD1 4.46Å; N511-I641 VanDerWaalsContact ND2-CD1 3.34Å; N511-I641 WeakPolarHBondContact ND2-CD1 3.4Å; N511-I641 WeakPolarHBondContact ND2-CG1 3.4Å; I514-I641 HydrophobicContact CD1-CG1 4.06Å; I514-I641 HydrophobicContact CD1-CG2 4.49Å; L600-I641 HydrophobicContact CD1-CG2 4.31Å; L637-I641 WeakPolarHBondContact O-CG1 3.43Å; L637-I641 PolarHBondContact O-N 3.07Å; C638-I641 PolarHBondContact O-N 3.07Å; I641-L643 VanDerWaalsContact C-N 3.32Å; I641-L643 PolarHBondContact O-N 3.25Å; I641-F644 PolarHBondContact O-N 3.26Å; I641-L645 HydrophobicContact CG2-CD1 3.83Å; I641-L645 HydrophobicContact CG2-CG 4.3Å; I641-L645 WeakPolarHBondContact O-CG 3.43Å; I641-L645 PolarHBondContact O-N 2.87Å
642	L	88.8	Confident	84.2	Confident	0 Å²	0	24.6 Å²	24.6	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-63	-37.5	179.5	-174.4	58.9	0	0	0	112.2	L600 V601 L604 C638 A639 L645 C646 L655 L664 I683	L600-L642 HydrophobicContact CB-CD1 4.3Å; L600-L642 HydrophobicContact CD1-CD1 4.36Å; V601-L642 HydrophobicContact CG2-CD2 4.04Å; L604-L642 HydrophobicContact CD1-CD2 4.29Å; L604-L642 HydrophobicContact CD2-CD2 4.4Å; C638-L642 WeakPolarHBondContact O-CB 3.42Å; C638-L642 PolarHBondContact O-N 3.05Å; A639-L642 PolarHBondContact O-N 3.44Å; L642-L645 PolarHBondContact O-N 2.8Å; L642-C646 VanDerWaalsContact O-CB 3.27Å; L642-C646 WeakPolarHBondContact O-CB 3.29Å; L642-C646 PolarHBondContact O-N 3.22Å; L642-L655 HydrophobicContact CD1-CD1 4.03Å; L642-L655 HydrophobicContact CD1-CD2 4.24Å; L642-L664 HydrophobicContact CD2-CD2 4.4Å; L642-I683 HydrophobicContact CB-CD1 4.12Å; L642-I683 HydrophobicContact CD2-CD1 4.04Å; L642-I683 HydrophobicContact CG-CD1 3.96Å
643	L	88.3	Confident	84.3	Confident	18 Å²	18	29.8 Å²	29.8	9%	0.094	14%	0.137	C	C	.	.	H	α-helix	trans	-62.9	-46.6	173	177.8	59.2	0	0	0	111.8	A639 I641 L645 C646 H647 Y679 Q682 I683	A639-L643 VanDerWaalsContact O-CB 3.31Å; A639-L643 WeakPolarHBondContact O-CB 3.44Å; A639-L643 PolarHBondContact O-N 3.31Å; I641-L643 VanDerWaalsContact C-N 3.32Å; I641-L643 PolarHBondContact O-N 3.25Å; L643-L645 VanDerWaalsContact C-N 3.35Å; L643-L645 PolarHBondContact O-N 3.09Å; L643-C646 PolarHBondContact O-N 3.24Å; L643-H647 PolarHBondContact O-CD2 3.22Å; L643-H647 PolarHBondContact O-CE1 3.29Å; L643-H647 PolarHBondContact O-ND1 2.96Å; L643-Y679 HydrophobicContact CD2-CD1 4.01Å; L643-Y679 HydrophobicContact CD2-CE1 4.45Å; L643-Q682 HydrophobicContact CD1-CB 3.83Å; L643-Q682 HydrophobicContact CD2-CB 4.11Å; L643-I683 HydrophobicContact CB-CD1 4.3Å; L643-I683 HydrophobicContact CB-CG1 3.93Å; L643-I683 HydrophobicContact CD1-CG1 3.99Å
644	F	86	Confident	84.2	Confident	39.3333 Å²	39.3333	33.9 Å²	33.9	17%	0.173	16%	0.156	C	C	.	.	H	α-helix	trans	-58.3	-48.3	175	174.9	-102.8	0	0	0	111.8	I514 I518 L523 L589 R640 I641 C646 H647	I514-F644 HydrophobicContact CD1-CD1 4.01Å; I514-F644 HydrophobicContact CD1-CE1 4.36Å; I514-F644 HydrophobicContact CG1-CD1 4.37Å; I514-F644 HydrophobicContact CG1-CE1 4.26Å; I514-F644 HydrophobicContact CG2-CD1 4.08Å; I514-F644 HydrophobicContact CG2-CD2 3.96Å; I514-F644 HydrophobicContact CG2-CE1 4.08Å; I514-F644 HydrophobicContact CG2-CE2 3.96Å; I514-F644 HydrophobicContact CG2-CG 4.02Å; I514-F644 HydrophobicContact CG2-CZ 4.02Å; I518-F644 HydrophobicContact CD1-CD2 4.26Å; I518-F644 HydrophobicContact CD1-CE2 3.86Å; I518-F644 HydrophobicContact CG1-CE2 4.31Å; L523-F644 HydrophobicContact CD1-CE2 4.48Å; L523-F644 HydrophobicContact CD1-CZ 4.17Å; L589-F644 HydrophobicContact CD1-CE1 3.91Å; L589-F644 HydrophobicContact CD1-CZ 3.96Å; L589-F644 HydrophobicContact CD2-CE1 4.06Å; R640-F644 PolarHBondContact O-N 3.3Å; R640-F644 VanDerWaalsContact O-N 3.12Å; I641-F644 PolarHBondContact O-N 3.26Å; F644-C646 VanDerWaalsContact C-N 3.34Å; F644-C646 PolarHBondContact O-N 2.91Å; F644-H647 WeakPolarHBondContact O-CB 3.49Å; F644-H647 PolarHBondContact O-N 3.22Å; F644-H647 VanDerWaalsContact O-N 3.15Å
645	L	84.5	Confident	84.3	Confident	2 Å²	2	32.8 Å²	32.8	1%	0.01	15%	0.148	C	C	.	.	H	α-helix	trans	-66.9	-35.1	180	-66.2	176.6	0	0	0	112.8	L600 I641 L642 L643 H647 Q648 I651	L600-L645 HydrophobicContact CD1-CD1 3.62Å; I641-L645 HydrophobicContact CG2-CD1 3.83Å; I641-L645 HydrophobicContact CG2-CG 4.3Å; I641-L645 WeakPolarHBondContact O-CG 3.43Å; I641-L645 PolarHBondContact O-N 2.87Å; L642-L645 PolarHBondContact O-N 2.8Å; L643-L645 VanDerWaalsContact C-N 3.35Å; L643-L645 PolarHBondContact O-N 3.09Å; L645-H647 PolarHBondContact O-N 3.17Å; L645-H647 VanDerWaalsContact O-N 3.11Å; L645-Q648 WeakPolarHBondContact O-CB 3.26Å; L645-Q648 PolarHBondContact O-N 3.22Å; L645-I651 HydrophobicContact CB-CD1 3.83Å; L645-I651 HydrophobicContact CB-CG2 4.22Å; L645-I651 HydrophobicContact CD2-CD1 3.84Å; L645-I651 HydrophobicContact CG-CD1 4.27Å
646	C	84.9	Confident	84.2	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-60.8	-19.9	177.2	-170.9	0	0	0	0	113.6	L642 L643 F644 Q648 R652 L655 T686	L642-C646 VanDerWaalsContact O-CB 3.27Å; L642-C646 WeakPolarHBondContact O-CB 3.29Å; L642-C646 PolarHBondContact O-N 3.22Å; L643-C646 PolarHBondContact O-N 3.24Å; F644-C646 VanDerWaalsContact C-N 3.34Å; F644-C646 PolarHBondContact O-N 2.91Å; C646-Q648 VanDerWaalsContact C-N 3.33Å; C646-Q648 PolarHBondContact O-N 3.5Å; C646-R652 PolarHBondContact O-NE 3.14Å; C646-L655 HydrophobicContact CB-CD1 4.02Å; C646-T686 PolarHBondContact SG-OG1 3.32Å; C646-T686 VanDerWaalsContact SG-OG1 3.37Å
647	H	80.1	Confident	84.1	Confident	86.3333 Å²	86.3333	36.5 Å²	36.5	40%	0.4	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70	-27.3	173.6	-72.7	-41.7	0	0	0	112.9	F530 L643 F644 L645 R652	F530-H647 HydrophobicContact CD1-CB 3.98Å; F530-H647 WeakPolarHBondContact CD1-O 3.48Å; F530-H647 HydrophobicContact CE1-CB 4.02Å; L643-H647 PolarHBondContact O-CD2 3.22Å; L643-H647 PolarHBondContact O-CE1 3.29Å; L643-H647 PolarHBondContact O-ND1 2.96Å; F644-H647 WeakPolarHBondContact O-CB 3.49Å; F644-H647 PolarHBondContact O-N 3.22Å; F644-H647 VanDerWaalsContact O-N 3.15Å; L645-H647 PolarHBondContact O-N 3.17Å; L645-H647 VanDerWaalsContact O-N 3.11Å; H647-R652 PolarHBondContact O-NH2 3.02Å
648	Q	76	Confident	83.9	Confident	36 Å²	36	38.3 Å²	38.3	17%	0.168	18%	0.183	C	C	.	.	S	Bend	trans	-69.6	136.3	176	-63.2	-171	-22.6	0	0	111.8	F530 L645 C646 E650 I651 R652	F530-Q648 HydrophobicContact CE1-CB 4.35Å; F530-Q648 HydrophobicContact CE1-CG 3.69Å; F530-Q648 HydrophobicContact CE2-CG 4.3Å; F530-Q648 HydrophobicContact CZ-CB 4.44Å; F530-Q648 HydrophobicContact CZ-CG 3.53Å; L645-Q648 WeakPolarHBondContact O-CB 3.26Å; L645-Q648 PolarHBondContact O-N 3.22Å; C646-Q648 VanDerWaalsContact C-N 3.33Å; C646-Q648 PolarHBondContact O-N 3.5Å; Q648-E650 PolarHBondContact O-N 3.05Å; Q648-I651 HydrophobicContact CB-CB 4.36Å; Q648-I651 HydrophobicContact CB-CD1 4.41Å; Q648-I651 HydrophobicContact CB-CG1 4.32Å; Q648-I651 HydrophobicContact CG-CD1 4.43Å; Q648-I651 VanDerWaalsContact OE1-CD1 3.22Å; Q648-R652 VanDerWaalsContact O-CB 3.29Å; Q648-R652 WeakPolarHBondContact O-CB 3.4Å; Q648-R652 PolarHBondContact O-N 3.18Å
649	Q	73.8	Confident	83.8	Confident	87.6667 Å²	87.6667	44.7 Å²	44.7	41%	0.41	21%	0.213	S	C	.	.	H	α-helix	trans	-64	-39.9	-174.6	-164.6	-179.3	22.7	0	0	113.4	K529 R652 K653	K529-Q649 HydrophobicContact CB-CB 4.47Å; K529-Q649 WeakPolarHBondContact O-CB 3.42Å; Q649-R652 PolarHBondContact O-N 3.02Å; Q649-K653 HydrophobicContact CG-CD 4.45Å; Q649-K653 WeakPolarHBondContact O-CG 3.38Å; Q649-K653 PolarHBondContact O-N 3.06Å
650	E	76.2	Confident	83.8	Confident	105.333 Å²	105.333	45.2 Å²	45.2	49%	0.492	22%	0.215	S	C	.	.	H	α-helix	trans	-71.2	-44.9	-177.8	-55.4	-42	114.3	0	0	112.4	Q648 R652 K653 Q654	Q648-E650 PolarHBondContact O-N 3.05Å; E650-R652 VanDerWaalsContact C-N 3.28Å; E650-R652 PolarHBondContact O-N 3.02Å; E650-K653 WeakPolarHBondContact O-CB 3.39Å; E650-K653 PolarHBondContact O-N 3.11Å; E650-K653 VanDerWaalsContact O-N 3.14Å; E650-K653 IonicContact OE1-NZ 3.04Å; E650-K653 PolarHBondContact OE1-NZ 3.44Å; E650-K653 WeakPolarHBondContact OE2-CD 3.45Å; E650-K653 WeakPolarHBondContact OE2-CE 3.41Å; E650-K653 IonicContact OE2-NZ 3.11Å; E650-K653 PolarHBondContact OE2-NZ 3.09Å; E650-Q654 WeakPolarHBondContact O-CG 3.3Å; E650-Q654 PolarHBondContact O-N 3.06Å; E650-Q654 VanDerWaalsContact O-N 3.1Å
651	I	78.9	Confident	83.7	Confident	4 Å²	4	42.1 Å²	42.1	2%	0.021	20%	0.204	C	C	.	.	H	α-helix	trans	-62.6	-37.4	174.2	-58.7	-175.5	0	0	0	110.4	P597 L645 Q648 K653 Q654 L655	P597-I651 HydrophobicContact CB-CG2 3.85Å; P597-I651 HydrophobicContact CG-CG2 3.94Å; L645-I651 HydrophobicContact CB-CD1 3.83Å; L645-I651 HydrophobicContact CB-CG2 4.22Å; L645-I651 HydrophobicContact CD2-CD1 3.84Å; L645-I651 HydrophobicContact CG-CD1 4.27Å; Q648-I651 HydrophobicContact CB-CB 4.36Å; Q648-I651 HydrophobicContact CB-CD1 4.41Å; Q648-I651 HydrophobicContact CB-CG1 4.32Å; Q648-I651 HydrophobicContact CG-CD1 4.43Å; Q648-I651 VanDerWaalsContact OE1-CD1 3.22Å; I651-K653 PolarHBondContact O-N 3.47Å; I651-Q654 WeakPolarHBondContact O-CB 3.35Å; I651-Q654 PolarHBondContact O-N 3Å; I651-L655 HydrophobicContact CG2-CD1 4.01Å; I651-L655 HydrophobicContact CG2-CG 4.43Å; I651-L655 WeakPolarHBondContact O-CB 3.24Å; I651-L655 PolarHBondContact O-N 3.23Å
652	R	82.8	Confident	83.7	Confident	24 Å²	24	47.8 Å²	47.8	9%	0.091	23%	0.225	C	C	.	.	H	α-helix	trans	-64.4	-39.6	175.8	-158.8	-175.8	-53.9	-178.6	15.2	112.7	L531 C646 H647 Q648 Q649 E650 Q654 L655 A656 T686 L687 D690	L531-R652 VanDerWaalsContact CD1-NH1 3.31Å; C646-R652 PolarHBondContact O-NE 3.14Å; H647-R652 PolarHBondContact O-NH2 3.02Å; Q648-R652 VanDerWaalsContact O-CB 3.29Å; Q648-R652 WeakPolarHBondContact O-CB 3.4Å; Q648-R652 PolarHBondContact O-N 3.18Å; Q649-R652 PolarHBondContact O-N 3.02Å; E650-R652 VanDerWaalsContact C-N 3.28Å; E650-R652 PolarHBondContact O-N 3.02Å; R652-Q654 VanDerWaalsContact C-N 3.3Å; R652-Q654 PolarHBondContact O-N 3.24Å; R652-L655 PolarHBondContact O-N 3.15Å; R652-A656 VanDerWaalsContact O-CB 3.28Å; R652-A656 WeakPolarHBondContact O-CB 3.37Å; R652-A656 PolarHBondContact O-N 3.15Å; R652-T686 PolarHBondContact NH1-O 3.21Å; R652-L687 HydrophobicContact CG-CD2 3.73Å; R652-D690 WeakPolarHBondContact CD-OD2 3.28Å
653	K	82.1	Confident	83.7	Confident	110.333 Å²	110.333	49.9 Å²	49.9	48%	0.48	24%	0.236	S	C	.	.	H	α-helix	trans	-60.2	-37.6	173.3	-70.6	162.8	-175.4	165.2	0	111.9	Q649 E650 I651	Q649-K653 HydrophobicContact CG-CD 4.45Å; Q649-K653 WeakPolarHBondContact O-CG 3.38Å; Q649-K653 PolarHBondContact O-N 3.06Å; E650-K653 WeakPolarHBondContact O-CB 3.39Å; E650-K653 PolarHBondContact O-N 3.11Å; E650-K653 VanDerWaalsContact O-N 3.14Å; E650-K653 IonicContact OE1-NZ 3.04Å; E650-K653 PolarHBondContact OE1-NZ 3.44Å; E650-K653 WeakPolarHBondContact OE2-CD 3.45Å; E650-K653 WeakPolarHBondContact OE2-CE 3.41Å; E650-K653 IonicContact OE2-NZ 3.11Å; E650-K653 PolarHBondContact OE2-NZ 3.09Å; I651-K653 PolarHBondContact O-N 3.47Å
654	Q	83.2	Confident	83.7	Confident	86.3333 Å²	86.3333	49.1 Å²	49.1	40%	0.403	23%	0.232	S	C	.	.	H	α-helix	trans	-72.7	-42.6	176.6	-66	168.8	-12.3	0	0	111.9	P597 E650 I651 R652 A656 D657 N660	P597-Q654 HydrophobicContact CG-CB 3.75Å; E650-Q654 WeakPolarHBondContact O-CG 3.3Å; E650-Q654 PolarHBondContact O-N 3.06Å; E650-Q654 VanDerWaalsContact O-N 3.1Å; I651-Q654 WeakPolarHBondContact O-CB 3.35Å; I651-Q654 PolarHBondContact O-N 3Å; R652-Q654 VanDerWaalsContact C-N 3.3Å; R652-Q654 PolarHBondContact O-N 3.24Å; Q654-A656 VanDerWaalsContact C-N 3.26Å; Q654-A656 PolarHBondContact O-N 3.27Å; Q654-D657 WeakPolarHBondContact O-CB 3.35Å; Q654-D657 PolarHBondContact O-N 3.41Å; Q654-N660 PolarHBondContact O-ND2 3.25Å
655	L	84.8	Confident	83.9	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-66.9	-23.7	174.6	-78.8	170.3	0	0	0	113.6	P597 V601 L642 C646 I651 R652 D657 N660 V661 L664 L687	P597-L655 HydrophobicContact CB-CD1 4.36Å; P597-L655 HydrophobicContact CB-CD2 3.91Å; P597-L655 HydrophobicContact CB-CG 3.86Å; P597-L655 HydrophobicContact CG-CD2 4.37Å; P597-L655 HydrophobicContact CG-CG 4.14Å; V601-L655 HydrophobicContact CG2-CD2 3.67Å; L642-L655 HydrophobicContact CD1-CD1 4.03Å; L642-L655 HydrophobicContact CD1-CD2 4.24Å; C646-L655 HydrophobicContact CB-CD1 4.02Å; I651-L655 HydrophobicContact CG2-CD1 4.01Å; I651-L655 HydrophobicContact CG2-CG 4.43Å; I651-L655 WeakPolarHBondContact O-CB 3.24Å; I651-L655 PolarHBondContact O-N 3.23Å; R652-L655 PolarHBondContact O-N 3.15Å; L655-D657 PolarHBondContact O-N 3.19Å; L655-N660 WeakPolarHBondContact O-CB 3.45Å; L655-V661 WeakPolarHBondContact O-CG2 3.28Å; L655-L664 HydrophobicContact CD2-CD1 4.32Å; L655-L687 HydrophobicContact CB-CD1 4.45Å; L655-L687 HydrophobicContact CB-CD2 3.74Å
656	A	84	Confident	84	Confident	16.6667 Å²	16.6667	54.2 Å²	54.2	14%	0.138	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-1.5	174.7	0	0	0	0	0	114	R652 Q654 T693 I696	R652-A656 VanDerWaalsContact O-CB 3.28Å; R652-A656 WeakPolarHBondContact O-CB 3.37Å; R652-A656 PolarHBondContact O-N 3.15Å; Q654-A656 VanDerWaalsContact C-N 3.26Å; Q654-A656 PolarHBondContact O-N 3.27Å; A656-T693 VanDerWaalsContact CB-OG1 3.31Å; A656-T693 WeakPolarHBondContact CB-OG1 3.42Å; A656-I696 WeakPolarHBondContact O-CD1 3.17Å
657	D	86.1	Confident	84	Confident	66.6667 Å²	66.6667	54.3 Å²	54.3	36%	0.357	26%	0.258	S	S	.	.	S	Bend	trans	-60.9	135.7	169.4	-179.2	85.9	0	0	0	111	Q654 L655 Q659 N660 V661	Q654-D657 WeakPolarHBondContact O-CB 3.35Å; Q654-D657 PolarHBondContact O-N 3.41Å; L655-D657 PolarHBondContact O-N 3.19Å; D657-Q659 PolarHBondContact O-N 3.06Å; D657-Q659 VanDerWaalsContact O-N 3.09Å; D657-Q659 WeakPolarHBondContact OD2-CA 3.28Å; D657-Q659 VanDerWaalsContact OD2-CB 3.27Å; D657-Q659 WeakPolarHBondContact OD2-CB 3.34Å; D657-Q659 WeakPolarHBondContact OD2-CG 3.42Å; D657-Q659 PolarHBondContact OD2-N 3.36Å; D657-N660 PolarHBondContact O-N 3.17Å; D657-N660 VanDerWaalsContact O-N 3.09Å; D657-V661 WeakPolarHBondContact O-CG2 3.36Å; D657-V661 PolarHBondContact O-N 3.09Å
658	P	85.2	Confident	84.4	Confident	51 Å²	51	50.7 Å²	50.7	33%	0.331	24%	0.242	S	C	.	.	H	α-helix	trans	-58.2	-22	-177.4	21.4	-34.6	0	0	0	115.4	R662 I696	P658-R662 VanDerWaalsContact O-CB 3.32Å; P658-R662 WeakPolarHBondContact O-CB 3.37Å; P658-R662 WeakPolarHBondContact O-CD 3.32Å; P658-R662 WeakPolarHBondContact O-CG 3.37Å; P658-R662 PolarHBondContact O-N 3.37Å; P658-R662 VanDerWaalsContact O-N 3.11Å; P658-I696 HydrophobicContact CB-CD1 4.19Å; P658-I696 HydrophobicContact CB-CG2 4.28Å
659	Q	87	Confident	84.8	Confident	135.333 Å²	135.333	51.1 Å²	51.1	63%	0.632	25%	0.245	S	C	*	.	H	α-helix	trans	-73.5	-46.7	173.5	-55.4	-171.7	39.1	0	0	111.2	D657 R662 L663	D657-Q659 PolarHBondContact O-N 3.06Å; D657-Q659 VanDerWaalsContact O-N 3.09Å; D657-Q659 WeakPolarHBondContact OD2-CA 3.28Å; D657-Q659 VanDerWaalsContact OD2-CB 3.27Å; D657-Q659 WeakPolarHBondContact OD2-CB 3.34Å; D657-Q659 WeakPolarHBondContact OD2-CG 3.42Å; D657-Q659 PolarHBondContact OD2-N 3.36Å; Q659-R662 PolarHBondContact O-N 2.84Å; Q659-L663 WeakPolarHBondContact O-CG 3.41Å; Q659-L663 PolarHBondContact O-N 3.28Å
660	N	88.4	Confident	85.2	Confident	10.3333 Å²	10.3333	47.6 Å²	47.6	6%	0.055	23%	0.23	C	C	.	.	H	α-helix	trans	-62.3	-44.9	176.4	-76.5	-34.1	0	0	0	111.6	N598 Q654 L655 D657 R662 L663 L664	N598-N660 PolarHBondContact OD1-ND2 3.32Å; N598-N660 PolarHBondContact OD1-OD1 3.12Å; Q654-N660 PolarHBondContact O-ND2 3.25Å; L655-N660 WeakPolarHBondContact O-CB 3.45Å; D657-N660 PolarHBondContact O-N 3.17Å; D657-N660 VanDerWaalsContact O-N 3.09Å; N660-R662 VanDerWaalsContact C-N 3.34Å; N660-R662 PolarHBondContact O-N 3.12Å; N660-L663 PolarHBondContact O-N 3.15Å; N660-L664 WeakPolarHBondContact O-CB 3.07Å; N660-L664 WeakPolarHBondContact O-CG 3.35Å; N660-L664 PolarHBondContact O-N 3.18Å
661	V	88.7	Confident	85.3	Confident	3 Å²	3	46.4 Å²	46.4	2%	0.018	23%	0.23	C	C	.	.	H	α-helix	trans	-61.9	-41.1	176.2	-179.5	0	0	0	0	111.1	L655 D657 L664 V665 T693 I696 L697 L700	L655-V661 WeakPolarHBondContact O-CG2 3.28Å; D657-V661 WeakPolarHBondContact O-CG2 3.36Å; D657-V661 PolarHBondContact O-N 3.09Å; V661-L664 PolarHBondContact O-N 3.06Å; V661-V665 HydrophobicContact CG1-CG2 4.49Å; V661-V665 WeakPolarHBondContact O-CB 3.38Å; V661-V665 VanDerWaalsContact O-CG2 3.29Å; V661-V665 WeakPolarHBondContact O-CG2 3.39Å; V661-V665 PolarHBondContact O-N 3.05Å; V661-T693 HydrophobicContact CG1-CG2 4.3Å; V661-T693 HydrophobicContact CG2-CG2 3.82Å; V661-I696 HydrophobicContact CB-CG2 4.05Å; V661-I696 HydrophobicContact CG1-CG2 3.79Å; V661-L697 HydrophobicContact CG1-CD2 3.62Å; V661-L697 HydrophobicContact CG1-CG 4.11Å; V661-L700 HydrophobicContact CG1-CD1 4.08Å
662	R	88.2	Confident	85.5	Confident	121.667 Å²	121.667	46.7 Å²	46.7	46%	0.459	23%	0.231	S	C	.	.	H	α-helix	trans	-62.1	-45	175.2	-106	170.3	-138	157.2	3	112.4	P658 Q659 N660 V665 Q666 L700	P658-R662 VanDerWaalsContact O-CB 3.32Å; P658-R662 WeakPolarHBondContact O-CB 3.37Å; P658-R662 WeakPolarHBondContact O-CD 3.32Å; P658-R662 WeakPolarHBondContact O-CG 3.37Å; P658-R662 PolarHBondContact O-N 3.37Å; P658-R662 VanDerWaalsContact O-N 3.11Å; Q659-R662 PolarHBondContact O-N 2.84Å; N660-R662 VanDerWaalsContact C-N 3.34Å; N660-R662 PolarHBondContact O-N 3.12Å; R662-V665 PolarHBondContact O-N 3.09Å; R662-Q666 HydrophobicContact CG-CG 4.45Å; R662-Q666 WeakPolarHBondContact O-CB 3.39Å; R662-Q666 VanDerWaalsContact O-CG 3.26Å; R662-Q666 WeakPolarHBondContact O-CG 3.41Å; R662-Q666 PolarHBondContact O-N 3.16Å; R662-L700 HydrophobicContact CB-CD1 4.23Å; R662-L700 HydrophobicContact CB-CD2 4.35Å; R662-L700 HydrophobicContact CG-CD1 3.79Å; R662-L700 HydrophobicContact CG-CD2 3.82Å; R662-L700 HydrophobicContact CG-CG 4.38Å
663	L	88.2	Confident	85.5	Confident	43 Å²	43	46.4 Å²	46.4	23%	0.225	23%	0.231	C	C	.	.	H	α-helix	trans	-63.6	-43.4	177.7	-71.5	170.9	0	0	0	111.6	V601 Q659 N660 V665 Q666 M667	V601-L663 HydrophobicContact CG1-CB 3.77Å; V601-L663 HydrophobicContact CG1-CD1 4.05Å; Q659-L663 WeakPolarHBondContact O-CG 3.41Å; Q659-L663 PolarHBondContact O-N 3.28Å; N660-L663 PolarHBondContact O-N 3.15Å; L663-V665 VanDerWaalsContact C-N 3.32Å; L663-V665 PolarHBondContact O-N 3.38Å; L663-Q666 PolarHBondContact O-N 2.94Å; L663-M667 WeakPolarHBondContact O-CG 3.4Å; L663-M667 PolarHBondContact O-N 3.06Å
664	L	89.5	Confident	85.6	Confident	2.33333 Å²	2.33333	41.5 Å²	41.5	1%	0.012	21%	0.21	C	C	.	.	H	α-helix	trans	-60.2	-42.8	175	-74.2	165.2	0	0	0	112.1	V601 L642 L655 N660 V661 M667 L668 L680 I683 V684 L687	V601-L664 HydrophobicContact CG2-CD2 4.46Å; V601-L664 HydrophobicContact CG2-CG 4.49Å; L642-L664 HydrophobicContact CD2-CD2 4.4Å; L655-L664 HydrophobicContact CD2-CD1 4.32Å; N660-L664 WeakPolarHBondContact O-CB 3.07Å; N660-L664 WeakPolarHBondContact O-CG 3.35Å; N660-L664 PolarHBondContact O-N 3.18Å; V661-L664 PolarHBondContact O-N 3.06Å; L664-M667 HydrophobicContact CD2-CE 3.88Å; L664-M667 HydrophobicContact CG-CE 4.39Å; L664-M667 PolarHBondContact O-N 3.04Å; L664-L668 PolarHBondContact O-N 3.04Å; L664-L680 HydrophobicContact CD2-CD2 4.39Å; L664-I683 HydrophobicContact CD1-CG2 4.29Å; L664-I683 HydrophobicContact CD2-CG2 4.29Å; L664-V684 HydrophobicContact CB-CG2 4.45Å; L664-L687 HydrophobicContact CD1-CD1 3.61Å
665	V	88.6	Confident	85.8	Confident	21.3333 Å²	21.3333	37.4 Å²	37.4	13%	0.129	19%	0.191	C	C	.	.	H	α-helix	trans	-64.8	-42.7	174.7	165.7	0	0	0	0	111.9	V661 R662 L663 M667 L668 L697 L700 V702	V661-V665 HydrophobicContact CG1-CG2 4.49Å; V661-V665 WeakPolarHBondContact O-CB 3.38Å; V661-V665 VanDerWaalsContact O-CG2 3.29Å; V661-V665 WeakPolarHBondContact O-CG2 3.39Å; V661-V665 PolarHBondContact O-N 3.05Å; R662-V665 PolarHBondContact O-N 3.09Å; L663-V665 VanDerWaalsContact C-N 3.32Å; L663-V665 PolarHBondContact O-N 3.38Å; V665-M667 PolarHBondContact O-N 3.17Å; V665-L668 WeakPolarHBondContact O-CB 3.43Å; V665-L668 PolarHBondContact O-N 3.02Å; V665-L668 VanDerWaalsContact O-N 3.15Å; V665-L697 HydrophobicContact CG2-CD2 3.8Å; V665-L700 HydrophobicContact CG2-CD1 4.28Å; V665-V702 HydrophobicContact CB-CG2 4.31Å; V665-V702 HydrophobicContact CG1-CG2 3.75Å; V665-V702 HydrophobicContact CG2-CG1 4.38Å; V665-V702 HydrophobicContact CG2-CG2 3.5Å; V665-V702 VanDerWaalsContact CG2-CG2 3.47Å
666	Q	86.4	Confident	86	Confident	127.667 Å²	127.667	37.4 Å²	37.4	60%	0.597	19%	0.191	S	C	*	.	H	α-helix	trans	-67.5	-21.3	178.4	-75.2	171.9	-20.1	0	0	113.6	R662 L663	R662-Q666 HydrophobicContact CG-CG 4.45Å; R662-Q666 WeakPolarHBondContact O-CB 3.39Å; R662-Q666 VanDerWaalsContact O-CG 3.26Å; R662-Q666 WeakPolarHBondContact O-CG 3.41Å; R662-Q666 PolarHBondContact O-N 3.16Å; L663-Q666 PolarHBondContact O-N 2.94Å
667	M	86.3	Confident	86.3	Confident	2 Å²	2	36.6 Å²	36.6	1%	0.01	19%	0.185	C	C	.	.	H	α-helix	trans	-81.1	-24.2	173.2	-71.8	-173	-71.5	0	0	113.4	V601 L604 H605 L608 L663 L664 V665 D669 L680	V601-M667 HydrophobicContact CG1-CE 4.12Å; L604-M667 HydrophobicContact CB-SD 4.16Å; L604-M667 HydrophobicContact CD2-CE 3.96Å; L604-M667 HydrophobicContact CD2-SD 3.78Å; L604-M667 WeakPolarHBondContact CD2-SD 3.43Å; L604-M667 HydrophobicContact CG-SD 4.09Å; H605-M667 WeakPolarHBondContact CA-SD 3.32Å; H605-M667 HydrophobicContact CB-CG 4.35Å; H605-M667 HydrophobicContact CB-SD 3.7Å; H605-M667 VanDerWaalsContact CB-SD 3.56Å; H605-M667 PolarHBondContact N-SD 3.35Å; H605-M667 VanDerWaalsContact N-SD 3.42Å; L608-M667 HydrophobicContact CD2-CB 3.86Å; L608-M667 HydrophobicContact CD2-CG 3.96Å; L608-M667 HydrophobicContact CD2-SD 4.45Å; L663-M667 WeakPolarHBondContact O-CG 3.4Å; L663-M667 PolarHBondContact O-N 3.06Å; L664-M667 HydrophobicContact CD2-CE 3.88Å; L664-M667 HydrophobicContact CG-CE 4.39Å; L664-M667 PolarHBondContact O-N 3.04Å; V665-M667 PolarHBondContact O-N 3.17Å; M667-D669 PolarHBondContact O-N 3.16Å; M667-L680 HydrophobicContact CB-CD1 4.38Å
668	L	88.1	Confident	86.5	Confident	9 Å²	9	33.4 Å²	33.4	5%	0.047	17%	0.168	C	C	.	.			trans	-65.4	126.5	176.4	-70.7	174.7	0	0	0	110.3	L664 V665 L677 L680 L681 V684 L705 M709	L664-L668 PolarHBondContact O-N 3.04Å; V665-L668 WeakPolarHBondContact O-CB 3.43Å; V665-L668 PolarHBondContact O-N 3.02Å; V665-L668 VanDerWaalsContact O-N 3.15Å; L668-L677 HydrophobicContact CD2-CD1 3.99Å; L668-L680 HydrophobicContact CD2-CB 3.72Å; L668-L680 HydrophobicContact CD2-CD1 4.25Å; L668-L681 HydrophobicContact CD1-CD2 4.35Å; L668-L681 HydrophobicContact CD2-CD2 3.92Å; L668-L681 HydrophobicContact CD2-CG 4.25Å; L668-V684 HydrophobicContact CD1-CG2 4.31Å; L668-L705 HydrophobicContact CB-CD2 3.62Å; L668-L705 WeakPolarHBondContact O-CD2 3.5Å; L668-M709 HydrophobicContact CB-CE 4.43Å
669	D	84.6	Confident	86.8	Confident	46.3333 Å²	46.3333	31.2 Å²	31.2	25%	0.248	15%	0.153	C	C	.	.			trans	-150.3	147.8	178.8	-169.5	-26.8	0	0	0	108.1	K612 M667 T671 L672	K612-D669 IonicContact NZ-OD2 2.66Å; K612-D669 PolarHBondContact NZ-OD2 3.25Å; M667-D669 PolarHBondContact O-N 3.16Å; D669-T671 VanDerWaalsContact C-N 3.3Å; D669-T671 PolarHBondContact O-N 2.9Å; D669-T671 WeakPolarHBondContact OD1-CB 3.34Å; D669-T671 PolarHBondContact OD1-N 3.18Å; D669-T671 VanDerWaalsContact OD1-N 3.12Å; D669-T671 PolarHBondContact OD1-OG1 3.19Å; D669-T671 PolarHBondContact OD2-OG1 3.38Å; D669-L672 HydrophobicContact CB-CD1 4.45Å; D669-L672 HydrophobicContact CB-CD2 4.35Å; D669-L672 HydrophobicContact CB-CG 4.01Å; D669-L672 WeakPolarHBondContact O-CG 3.28Å
670	V	81.2	Confident	87	Confident	13 Å²	13	24.8 Å²	24.8	8%	0.079	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-24.6	179.8	-178.5	0	0	0	0	111	L672 L705 Q708 M709 W716 Y717	V670-L672 VanDerWaalsContact C-N 3.3Å; V670-L672 PolarHBondContact O-N 3Å; V670-L705 HydrophobicContact CG2-CD1 4.36Å; V670-Q708 HydrophobicContact CG2-CG 4.11Å; V670-M709 HydrophobicContact CG2-CE 4.27Å; V670-M709 HydrophobicContact CG2-CG 3.99Å; V670-W716 HydrophobicContact CG1-CB 4.46Å; V670-W716 HydrophobicContact CG1-CG 4.44Å; V670-Y717 HydrophobicContact CG1-CE1 4.42Å
671	T	79.8	Confident	87.2	Confident	80.3333 Å²	80.3333	24.3 Å²	24.3	49%	0.493	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.1	8.6	-177.9	71.6	0	0	0	0	114.4	D669 W716	D669-T671 VanDerWaalsContact C-N 3.3Å; D669-T671 PolarHBondContact O-N 2.9Å; D669-T671 WeakPolarHBondContact OD1-CB 3.34Å; D669-T671 PolarHBondContact OD1-N 3.18Å; D669-T671 VanDerWaalsContact OD1-N 3.12Å; D669-T671 PolarHBondContact OD1-OG1 3.19Å; D669-T671 PolarHBondContact OD2-OG1 3.38Å; T671-W716 HydrophobicContact CG2-CE3 4.4Å; T671-W716 HydrophobicContact CG2-CZ3 4.01Å
672	L	82.7	Confident	87.3	Confident	10.6667 Å²	10.6667	25 Å²	25	6%	0.056	12%	0.123	C	C	.	.	S	Bend	trans	-73.4	154.8	176.3	-63.7	-179.8	0	0	0	111.6	L608 D669 V670 F676 L677 L680	L608-L672 HydrophobicContact CD1-CD2 3.65Å; L608-L672 HydrophobicContact CD2-CD2 4.26Å; D669-L672 HydrophobicContact CB-CD1 4.45Å; D669-L672 HydrophobicContact CB-CD2 4.35Å; D669-L672 HydrophobicContact CB-CG 4.01Å; D669-L672 WeakPolarHBondContact O-CG 3.28Å; V670-L672 VanDerWaalsContact C-N 3.3Å; V670-L672 PolarHBondContact O-N 3Å; L672-F676 HydrophobicContact CB-CD1 4.39Å; L672-F676 HydrophobicContact CD1-CD1 3.94Å; L672-F676 HydrophobicContact CD1-CE1 3.9Å; L672-F676 HydrophobicContact CD2-CD1 4.27Å; L672-F676 HydrophobicContact CD2-CE1 4.13Å; L672-F676 HydrophobicContact CG-CD1 4.43Å; L672-L677 HydrophobicContact CB-CB 4.15Å; L672-L677 HydrophobicContact CD1-CB 4.46Å; L672-L677 HydrophobicContact CD1-CD1 4.24Å; L672-L680 HydrophobicContact CD1-CD1 3.82Å
673	E	82.8	Confident	87.5	Confident	17.6667 Å²	17.6667	19.2 Å²	19.2	8%	0.083	10%	0.101	C	C	.	.			trans	-56.5	133.3	164.9	-172.7	-75.5	132.8	0	0	109.9	Y619 H632 Q675 F676 L677	Y619-E673 HydrophobicContact CD1-CB 4.31Å; Y619-E673 HydrophobicContact CD1-CG 4.17Å; Y619-E673 HydrophobicContact CE1-CB 3.8Å; Y619-E673 HydrophobicContact CE1-CG 3.98Å; Y619-E673 HydrophobicContact CE2-CB 4.45Å; Y619-E673 HydrophobicContact CE2-CG 4.43Å; Y619-E673 HydrophobicContact CG-CG 4.48Å; Y619-E673 PolarHBondContact OH-N 3.1Å; H632-E673 IonicContact CD2-OE2 3.2Å; H632-E673 VanDerWaalsContact CE1-CB 3.45Å; H632-E673 WeakPolarHBondContact CE1-CB 3.22Å; H632-E673 IonicContact CE1-OE2 3.89Å; H632-E673 VanDerWaalsContact NE2-CB 3.3Å; H632-E673 WeakPolarHBondContact NE2-CB 3.41Å; H632-E673 VanDerWaalsContact NE2-CG 3.3Å; H632-E673 WeakPolarHBondContact NE2-CG 3.4Å; H632-E673 IonicContact NE2-OE2 3.55Å; H632-E673 PolarHBondContact NE2-OE2 3.07Å; E673-Q675 VanDerWaalsContact CD-N 3.26Å; E673-Q675 PolarHBondContact O-N 3.11Å; E673-Q675 VanDerWaalsContact OE1-CB 3.27Å; E673-Q675 WeakPolarHBondContact OE1-CB 3.3Å; E673-Q675 PolarHBondContact OE1-N 3.36Å; E673-Q675 WeakPolarHBondContact OE2-CA 3.24Å; E673-Q675 VanDerWaalsContact OE2-CB 3.28Å; E673-Q675 WeakPolarHBondContact OE2-CB 3.39Å; E673-Q675 PolarHBondContact OE2-N 3.41Å; E673-Q675 VanDerWaalsContact OE2-N 3.14Å; E673-F676 PolarHBondContact O-N 3.35Å; E673-F676 PolarHBondContact OE2-N 3.1Å; E673-L677 PolarHBondContact O-N 3.24Å; E673-L677 VanDerWaalsContact O-N 3.09Å
674	P	84.7	Confident	87.6	Confident	7 Å²	7	17.3 Å²	17.3	5%	0.045	9%	0.092	C	C	.	.	H	α-helix	trans	-68.3	-29	-164.9	8.4	-13.2	0	0	0	115.1	L677 C678 T719 F725	P674-L677 PolarHBondContact O-N 3.43Å; P674-C678 WeakPolarHBondContact O-CB 3.36Å; P674-C678 PolarHBondContact O-N 3.21Å; P674-C678 PolarHBondContact O-SG 3.08Å; P674-T719 HydrophobicContact CG-CG2 4.04Å; P674-F725 HydrophobicContact CB-CB 3.64Å; P674-F725 HydrophobicContact CB-CD1 3.88Å; P674-F725 HydrophobicContact CB-CD2 3.79Å; P674-F725 HydrophobicContact CB-CE1 4.4Å; P674-F725 HydrophobicContact CB-CE2 4.4Å; P674-F725 HydrophobicContact CB-CG 3.52Å; P674-F725 VanDerWaalsContact CB-CG 3.45Å; P674-F725 HydrophobicContact CG-CB 4.2Å; P674-F725 HydrophobicContact CG-CD1 4.34Å; P674-F725 HydrophobicContact CG-CD2 3.68Å; P674-F725 VanDerWaalsContact CG-CD2 3.48Å; P674-F725 HydrophobicContact CG-CE2 3.84Å; P674-F725 HydrophobicContact CG-CG 3.93Å; P674-F725 HydrophobicContact CG-CZ 4.47Å
675	Q	86.6	Confident	87.6	Confident	0 Å²	0	17.3 Å²	17.3	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-70.2	-43.2	176.4	-179.6	156.2	31.8	0	0	112.1	R626 I636 E673 L677 C678 Y679 F725 C790	R626-Q675 VanDerWaalsContact NH2-NE2 3.16Å; I636-Q675 HydrophobicContact CD1-CB 4.46Å; I636-Q675 HydrophobicContact CD1-CG 4.31Å; E673-Q675 VanDerWaalsContact CD-N 3.26Å; E673-Q675 PolarHBondContact O-N 3.11Å; E673-Q675 VanDerWaalsContact OE1-CB 3.27Å; E673-Q675 WeakPolarHBondContact OE1-CB 3.3Å; E673-Q675 PolarHBondContact OE1-N 3.36Å; E673-Q675 WeakPolarHBondContact OE2-CA 3.24Å; E673-Q675 VanDerWaalsContact OE2-CB 3.28Å; E673-Q675 WeakPolarHBondContact OE2-CB 3.39Å; E673-Q675 PolarHBondContact OE2-N 3.41Å; E673-Q675 VanDerWaalsContact OE2-N 3.14Å; Q675-L677 VanDerWaalsContact C-N 3.34Å; Q675-C678 WeakPolarHBondContact O-CB 3.37Å; Q675-C678 PolarHBondContact O-N 3.22Å; Q675-Y679 HydrophobicContact CG-CD2 4.09Å; Q675-Y679 HydrophobicContact CG-CE1 4.42Å; Q675-Y679 HydrophobicContact CG-CE2 3.68Å; Q675-Y679 VanDerWaalsContact CG-CE2 3.45Å; Q675-Y679 PolarHBondContact NE2-OH 3.3Å; Q675-Y679 VanDerWaalsContact NE2-OH 3.08Å; Q675-Y679 WeakPolarHBondContact O-CD2 3.25Å; Q675-Y679 PolarHBondContact O-N 3.14Å; Q675-Y679 VanDerWaalsContact O-N 3.11Å; Q675-F725 HydrophobicContact CB-CE1 3.8Å; Q675-F725 HydrophobicContact CB-CZ 3.75Å; Q675-F725 HydrophobicContact CG-CE1 4.47Å; Q675-C790 PolarHBondContact NE2-SG 3Å
676	F	89	Confident	87.6	Confident	0.333333 Å²	0.333333	17.1 Å²	17.1	0%	0.001	9%	0.09	C	C	.	.	H	α-helix	trans	-61.8	-42.9	172	175	-119.6	0	0	0	111.8	L604 L608 H632 L635 I636 A639 L672 E673 C678 Y679 L680	L604-F676 HydrophobicContact CD1-CE2 4.05Å; L604-F676 HydrophobicContact CD1-CZ 4.36Å; L604-F676 HydrophobicContact CD2-CE2 4Å; L604-F676 HydrophobicContact CD2-CZ 4.03Å; L604-F676 HydrophobicContact CG-CE2 4.18Å; L604-F676 HydrophobicContact CG-CZ 4.26Å; L608-F676 HydrophobicContact CD1-CE1 4.1Å; L608-F676 HydrophobicContact CD2-CE1 4.18Å; L608-F676 HydrophobicContact CD2-CZ 4.43Å; H632-F676 WeakPolarHBondContact CE1-CB 3.46Å; H632-F676 AromaticContact CE1-CD1 3.94Å; H632-F676 AromaticContact CE1-CG 3.85Å; H632-F676 WeakPolarHBondContact NE2-CB 3.35Å; H632-F676 AromaticContact NE2-CG 4Å; L635-F676 HydrophobicContact CB-CD2 4.09Å; L635-F676 HydrophobicContact CB-CE2 3.96Å; L635-F676 HydrophobicContact CB-CZ 4.3Å; L635-F676 HydrophobicContact CD1-CE1 4.36Å; L635-F676 HydrophobicContact CD1-CZ 4.4Å; L635-F676 HydrophobicContact CD2-CE2 4.29Å; L635-F676 HydrophobicContact CD2-CZ 4.2Å; L635-F676 HydrophobicContact CG-CE2 4.4Å; L635-F676 HydrophobicContact CG-CZ 4.46Å; I636-F676 HydrophobicContact CG1-CB 4.09Å; A639-F676 HydrophobicContact CB-CD2 3.93Å; A639-F676 HydrophobicContact CB-CE2 3.99Å; L672-F676 HydrophobicContact CB-CD1 4.39Å; L672-F676 HydrophobicContact CD1-CD1 3.94Å; L672-F676 HydrophobicContact CD1-CE1 3.9Å; L672-F676 HydrophobicContact CD2-CD1 4.27Å; L672-F676 HydrophobicContact CD2-CE1 4.13Å; L672-F676 HydrophobicContact CG-CD1 4.43Å; E673-F676 PolarHBondContact O-N 3.35Å; E673-F676 PolarHBondContact OE2-N 3.1Å; F676-C678 VanDerWaalsContact C-N 3.32Å; F676-C678 PolarHBondContact O-N 3.23Å; F676-Y679 PolarHBondContact O-N 3.08Å; F676-Y679 VanDerWaalsContact O-N 3.12Å; F676-L680 HydrophobicContact CD1-CD1 4.29Å; F676-L680 HydrophobicContact CD2-CG 4.43Å; F676-L680 HydrophobicContact CE1-CD1 3.72Å; F676-L680 HydrophobicContact CE1-CG 4.43Å; F676-L680 HydrophobicContact CE2-CD1 4.22Å; F676-L680 HydrophobicContact CE2-CD2 4.17Å; F676-L680 HydrophobicContact CE2-CG 4.09Å; F676-L680 HydrophobicContact CZ-CD1 3.69Å; F676-L680 HydrophobicContact CZ-CD2 4.2Å; F676-L680 HydrophobicContact CZ-CG 4.07Å; F676-L680 PolarHBondContact O-N 3.05Å
677	L	90.1	Very high	87.7	Confident	0 Å²	0	11.1 Å²	11.1	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-59.4	-43.1	172.9	179.3	59.1	0	0	0	111.8	L668 L672 E673 P674 Q675 Y679 L680 L681 M709 Y717 V729	L668-L677 HydrophobicContact CD2-CD1 3.99Å; L672-L677 HydrophobicContact CB-CB 4.15Å; L672-L677 HydrophobicContact CD1-CB 4.46Å; L672-L677 HydrophobicContact CD1-CD1 4.24Å; E673-L677 PolarHBondContact O-N 3.24Å; E673-L677 VanDerWaalsContact O-N 3.09Å; P674-L677 PolarHBondContact O-N 3.43Å; Q675-L677 VanDerWaalsContact C-N 3.34Å; L677-Y679 VanDerWaalsContact C-N 3.32Å; L677-Y679 PolarHBondContact O-N 3.34Å; L677-L680 PolarHBondContact O-N 3.41Å; L677-L681 HydrophobicContact CD1-CD1 3.96Å; L677-L681 HydrophobicContact CD1-CG 4Å; L677-L681 HydrophobicContact CG-CD1 3.91Å; L677-L681 HydrophobicContact CG-CG 4.39Å; L677-L681 WeakPolarHBondContact O-CB 3.33Å; L677-L681 VanDerWaalsContact O-CG 3.29Å; L677-L681 WeakPolarHBondContact O-CG 3.29Å; L677-L681 PolarHBondContact O-N 2.95Å; L677-M709 HydrophobicContact CD1-CE 3.76Å; L677-M709 HydrophobicContact CD1-SD 4.28Å; L677-M709 HydrophobicContact CD2-CE 4.45Å; L677-Y717 HydrophobicContact CD2-CD1 4.36Å; L677-Y717 HydrophobicContact CD2-CE1 3.68Å; L677-V729 HydrophobicContact CD2-CG1 3.85Å; L677-V729 HydrophobicContact CD2-CG2 4.12Å; L677-V729 HydrophobicContact CG-CG1 4.44Å; L677-V729 HydrophobicContact CG-CG2 4.43Å
678	C	90.1	Very high	87.8	Confident	0 Å²	0	11 Å²	11	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-60.2	-38	174.7	-72.4	0	0	0	0	112.7	P674 Q675 F676 Q682 C790	P674-C678 WeakPolarHBondContact O-CB 3.36Å; P674-C678 PolarHBondContact O-N 3.21Å; P674-C678 PolarHBondContact O-SG 3.08Å; Q675-C678 WeakPolarHBondContact O-CB 3.37Å; Q675-C678 PolarHBondContact O-N 3.22Å; F676-C678 VanDerWaalsContact C-N 3.32Å; F676-C678 PolarHBondContact O-N 3.23Å; C678-Q682 WeakPolarHBondContact O-CB 3.44Å; C678-Q682 WeakPolarHBondContact O-CG 3.39Å; C678-Q682 PolarHBondContact O-N 2.95Å; C678-C790 HydrophobicContact CB-CB 3.91Å
679	Y	91.4	Very high	87.6	Confident	4.33333 Å²	4.33333	12.6 Å²	12.6	2%	0.017	7%	0.07	C	C	.	.	H	α-helix	trans	-71	-41.5	176.3	-65.9	-39.5	0	0	0	112.5	I636 A639 R640 L643 Q675 F676 L677 L681 Q682 I683 T789	I636-Y679 HydrophobicContact CG2-CD2 4.27Å; I636-Y679 HydrophobicContact CG2-CE2 3.78Å; A639-Y679 HydrophobicContact CB-CD2 4.16Å; R640-Y679 HydrophobicContact CB-CD2 4.39Å; R640-Y679 HydrophobicContact CB-CE2 4.11Å; L643-Y679 HydrophobicContact CD2-CD1 4.01Å; L643-Y679 HydrophobicContact CD2-CE1 4.45Å; Q675-Y679 HydrophobicContact CG-CD2 4.09Å; Q675-Y679 HydrophobicContact CG-CE1 4.42Å; Q675-Y679 HydrophobicContact CG-CE2 3.68Å; Q675-Y679 VanDerWaalsContact CG-CE2 3.45Å; Q675-Y679 PolarHBondContact NE2-OH 3.3Å; Q675-Y679 VanDerWaalsContact NE2-OH 3.08Å; Q675-Y679 WeakPolarHBondContact O-CD2 3.25Å; Q675-Y679 PolarHBondContact O-N 3.14Å; Q675-Y679 VanDerWaalsContact O-N 3.11Å; F676-Y679 PolarHBondContact O-N 3.08Å; F676-Y679 VanDerWaalsContact O-N 3.12Å; L677-Y679 VanDerWaalsContact C-N 3.32Å; L677-Y679 PolarHBondContact O-N 3.34Å; Y679-L681 PolarHBondContact O-N 3.32Å; Y679-Q682 PolarHBondContact O-N 2.99Å; Y679-I683 WeakPolarHBondContact O-CG1 3.38Å; Y679-I683 PolarHBondContact O-N 3.23Å; Y679-T789 WeakPolarHBondContact CE1-O 3.39Å; Y679-T789 WeakPolarHBondContact OH-CB 3.35Å
680	L	92	Very high	87.5	Confident	1.66667 Å²	1.66667	13 Å²	13	1%	0.009	7%	0.072	C	C	.	.	H	α-helix	trans	-60.6	-45.1	173.6	-73.1	-179.9	0	0	0	111.9	L604 L664 M667 L668 L672 F676 L677 Q682 I683 V684	L604-L680 HydrophobicContact CD2-CD2 3.97Å; L664-L680 HydrophobicContact CD2-CD2 4.39Å; M667-L680 HydrophobicContact CB-CD1 4.38Å; L668-L680 HydrophobicContact CD2-CB 3.72Å; L668-L680 HydrophobicContact CD2-CD1 4.25Å; L672-L680 HydrophobicContact CD1-CD1 3.82Å; F676-L680 HydrophobicContact CD1-CD1 4.29Å; F676-L680 HydrophobicContact CD2-CG 4.43Å; F676-L680 HydrophobicContact CE1-CD1 3.72Å; F676-L680 HydrophobicContact CE1-CG 4.43Å; F676-L680 HydrophobicContact CE2-CD1 4.22Å; F676-L680 HydrophobicContact CE2-CD2 4.17Å; F676-L680 HydrophobicContact CE2-CG 4.09Å; F676-L680 HydrophobicContact CZ-CD1 3.69Å; F676-L680 HydrophobicContact CZ-CD2 4.2Å; F676-L680 HydrophobicContact CZ-CG 4.07Å; F676-L680 PolarHBondContact O-N 3.05Å; L677-L680 PolarHBondContact O-N 3.41Å; L680-Q682 VanDerWaalsContact C-N 3.34Å; L680-Q682 PolarHBondContact O-N 3.12Å; L680-I683 PolarHBondContact O-N 3.07Å; L680-V684 WeakPolarHBondContact O-CG2 3.3Å; L680-V684 PolarHBondContact O-N 3.35Å
681	L	92.2	Very high	87.3	Confident	0 Å²	0	17.5 Å²	17.5	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-64.6	-36.3	177.2	-68.3	171	0	0	0	111.9	L668 L677 Y679 V684 A685 L706 M709 V729 H732 I736	L668-L681 HydrophobicContact CD1-CD2 4.35Å; L668-L681 HydrophobicContact CD2-CD2 3.92Å; L668-L681 HydrophobicContact CD2-CG 4.25Å; L677-L681 HydrophobicContact CD1-CD1 3.96Å; L677-L681 HydrophobicContact CD1-CG 4Å; L677-L681 HydrophobicContact CG-CD1 3.91Å; L677-L681 HydrophobicContact CG-CG 4.39Å; L677-L681 WeakPolarHBondContact O-CB 3.33Å; L677-L681 VanDerWaalsContact O-CG 3.29Å; L677-L681 WeakPolarHBondContact O-CG 3.29Å; L677-L681 PolarHBondContact O-N 2.95Å; Y679-L681 PolarHBondContact O-N 3.32Å; L681-V684 PolarHBondContact O-N 3.18Å; L681-A685 VanDerWaalsContact O-CB 3.27Å; L681-A685 WeakPolarHBondContact O-CB 3.46Å; L681-A685 PolarHBondContact O-N 3.24Å; L681-L706 HydrophobicContact CD2-CD2 3.83Å; L681-M709 HydrophobicContact CD1-SD 4.28Å; L681-M709 HydrophobicContact CD2-SD 4.13Å; L681-V729 HydrophobicContact CD1-CG1 3.96Å; L681-H732 HydrophobicContact CB-CB 3.77Å; L681-H732 HydrophobicContact CD1-CB 4.33Å; L681-I736 HydrophobicContact CB-CD1 4.26Å; L681-I736 HydrophobicContact CD2-CD1 3.68Å
682	Q	91.4	Very high	87.4	Confident	17 Å²	17	21.6 Å²	21.6	8%	0.079	10%	0.099	C	C	.	.	H	α-helix	trans	-64.3	-40.4	172.3	-78.5	-174.3	89.7	0	0	112.8	L643 C678 Y679 L680 V684 A685 T686 H732 T789 C790 S792	L643-Q682 HydrophobicContact CD1-CB 3.83Å; L643-Q682 HydrophobicContact CD2-CB 4.11Å; C678-Q682 WeakPolarHBondContact O-CB 3.44Å; C678-Q682 WeakPolarHBondContact O-CG 3.39Å; C678-Q682 PolarHBondContact O-N 2.95Å; Y679-Q682 PolarHBondContact O-N 2.99Å; L680-Q682 VanDerWaalsContact C-N 3.34Å; L680-Q682 PolarHBondContact O-N 3.12Å; Q682-V684 PolarHBondContact O-N 3.03Å; Q682-A685 PolarHBondContact O-N 3.03Å; Q682-T686 WeakPolarHBondContact O-CB 3.34Å; Q682-T686 PolarHBondContact O-N 3.37Å; Q682-T686 PolarHBondContact O-OG1 3.25Å; Q682-H732 VanDerWaalsContact CG-CE1 3.48Å; Q682-H732 WeakPolarHBondContact CG-CE1 3.38Å; Q682-H732 WeakPolarHBondContact CG-NE2 3.45Å; Q682-T789 PolarHBondContact NE2-O 2.94Å; Q682-C790 PolarHBondContact NE2-O 3.31Å; Q682-C790 VanDerWaalsContact NE2-O 3.13Å; Q682-S792 PolarHBondContact OE1-OG 3.24Å
683	I	91	Very high	87.4	Confident	0 Å²	0	21.1 Å²	21.1	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-62.1	-47.9	174.9	-67.3	160.8	0	0	0	110.3	L642 L643 L664 Y679 L680 A685 T686 L687	L642-I683 HydrophobicContact CB-CD1 4.12Å; L642-I683 HydrophobicContact CD2-CD1 4.04Å; L642-I683 HydrophobicContact CG-CD1 3.96Å; L643-I683 HydrophobicContact CB-CD1 4.3Å; L643-I683 HydrophobicContact CB-CG1 3.93Å; L643-I683 HydrophobicContact CD1-CG1 3.99Å; L664-I683 HydrophobicContact CD1-CG2 4.29Å; L664-I683 HydrophobicContact CD2-CG2 4.29Å; Y679-I683 WeakPolarHBondContact O-CG1 3.38Å; Y679-I683 PolarHBondContact O-N 3.23Å; L680-I683 PolarHBondContact O-N 3.07Å; I683-A685 VanDerWaalsContact C-N 3.34Å; I683-A685 PolarHBondContact O-N 3.24Å; I683-T686 WeakPolarHBondContact CA-OG1 3.29Å; I683-T686 WeakPolarHBondContact O-CB 3.38Å; I683-T686 PolarHBondContact O-N 3.19Å; I683-T686 VanDerWaalsContact O-N 3.14Å; I683-T686 PolarHBondContact O-OG1 3.08Å; I683-L687 HydrophobicContact CG2-CD1 4.02Å; I683-L687 WeakPolarHBondContact O-CB 3.48Å; I683-L687 WeakPolarHBondContact O-CG 3.42Å; I683-L687 PolarHBondContact O-N 3.28Å
684	V	91.9	Very high	87.6	Confident	3.66667 Å²	3.66667	20.7 Å²	20.7	2%	0.022	9%	0.094	C	C	.	.	H	α-helix	trans	-65.4	-36.9	178.6	176.4	0	0	0	0	111.7	L664 L668 L680 L681 Q682 T686 L687 A688 L697 I736	L664-V684 HydrophobicContact CB-CG2 4.45Å; L668-V684 HydrophobicContact CD1-CG2 4.31Å; L680-V684 WeakPolarHBondContact O-CG2 3.3Å; L680-V684 PolarHBondContact O-N 3.35Å; L681-V684 PolarHBondContact O-N 3.18Å; Q682-V684 PolarHBondContact O-N 3.03Å; V684-T686 PolarHBondContact O-N 3.24Å; V684-L687 PolarHBondContact O-N 3.3Å; V684-A688 VanDerWaalsContact O-CB 3.24Å; V684-A688 WeakPolarHBondContact O-CB 3.25Å; V684-A688 PolarHBondContact O-N 3.1Å; V684-L697 HydrophobicContact CG1-CD1 4.21Å; V684-L697 HydrophobicContact CG1-CD2 4.12Å; V684-I736 HydrophobicContact CB-CD1 4.13Å; V684-I736 HydrophobicContact CG1-CD1 3.97Å; V684-I736 HydrophobicContact CG1-CG1 4.34Å; V684-I736 HydrophobicContact CG1-CG2 4.05Å
685	A	89.6	Confident	87.5	Confident	1.66667 Å²	1.66667	23 Å²	23	1%	0.014	11%	0.11	C	C	.	.	H	α-helix	trans	-64.9	-39.1	173.3	0	0	0	0	0	112.6	L681 Q682 I683 L687 A688 L689 I736 Y739	L681-A685 VanDerWaalsContact O-CB 3.27Å; L681-A685 WeakPolarHBondContact O-CB 3.46Å; L681-A685 PolarHBondContact O-N 3.24Å; Q682-A685 PolarHBondContact O-N 3.03Å; I683-A685 VanDerWaalsContact C-N 3.34Å; I683-A685 PolarHBondContact O-N 3.24Å; A685-L687 VanDerWaalsContact C-N 3.34Å; A685-A688 PolarHBondContact O-N 2.92Å; A685-L689 PolarHBondContact O-N 3.09Å; A685-I736 HydrophobicContact CB-CG1 3.87Å; A685-Y739 WeakPolarHBondContact O-CE2 3.33Å
686	T	88	Confident	87.5	Confident	16 Å²	16	24.6 Å²	24.6	10%	0.098	12%	0.118	C	C	.	.	H	α-helix	trans	-68.4	-35	176.6	-28.3	0	0	0	0	112.3	C646 R652 Q682 I683 V684 L689	C646-T686 PolarHBondContact SG-OG1 3.32Å; C646-T686 VanDerWaalsContact SG-OG1 3.37Å; R652-T686 PolarHBondContact NH1-O 3.21Å; Q682-T686 WeakPolarHBondContact O-CB 3.34Å; Q682-T686 PolarHBondContact O-N 3.37Å; Q682-T686 PolarHBondContact O-OG1 3.25Å; I683-T686 WeakPolarHBondContact CA-OG1 3.29Å; I683-T686 WeakPolarHBondContact O-CB 3.38Å; I683-T686 PolarHBondContact O-N 3.19Å; I683-T686 VanDerWaalsContact O-N 3.14Å; I683-T686 PolarHBondContact O-OG1 3.08Å; V684-T686 PolarHBondContact O-N 3.24Å; T686-L689 WeakPolarHBondContact O-CB 3.36Å
687	L	89	Confident	87.5	Confident	3.33333 Å²	3.33333	24.7 Å²	24.7	2%	0.017	12%	0.119	C	C	.	.	H	α-helix	trans	-72.3	-36.6	172.5	-70	169.5	0	0	0	112.2	R652 L655 L664 I683 V684 A685 L689 D690 T693	R652-L687 HydrophobicContact CG-CD2 3.73Å; L655-L687 HydrophobicContact CB-CD1 4.45Å; L655-L687 HydrophobicContact CB-CD2 3.74Å; L664-L687 HydrophobicContact CD1-CD1 3.61Å; I683-L687 HydrophobicContact CG2-CD1 4.02Å; I683-L687 WeakPolarHBondContact O-CB 3.48Å; I683-L687 WeakPolarHBondContact O-CG 3.42Å; I683-L687 PolarHBondContact O-N 3.28Å; V684-L687 PolarHBondContact O-N 3.3Å; A685-L687 VanDerWaalsContact C-N 3.34Å; L687-L689 PolarHBondContact O-N 3.26Å; L687-L689 VanDerWaalsContact O-N 3.07Å; L687-D690 PolarHBondContact O-N 3.12Å; L687-D690 VanDerWaalsContact O-N 3.09Å; L687-T693 HydrophobicContact CB-CG2 4.01Å; L687-T693 VanDerWaalsContact O-CB 3.28Å; L687-T693 WeakPolarHBondContact O-CB 3.4Å; L687-T693 PolarHBondContact O-OG1 3.46Å
688	A	87.9	Confident	87.2	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-2.9	177.1	0	0	0	0	0	114.2	V684 A685 D690 R694 L697 I736 Y739	V684-A688 VanDerWaalsContact O-CB 3.24Å; V684-A688 WeakPolarHBondContact O-CB 3.25Å; V684-A688 PolarHBondContact O-N 3.1Å; A685-A688 PolarHBondContact O-N 2.92Å; A688-D690 VanDerWaalsContact C-N 3.31Å; A688-R694 WeakPolarHBondContact O-CD 3.35Å; A688-R694 WeakPolarHBondContact O-CG 3.39Å; A688-R694 PolarHBondContact O-NE 2.38Å; A688-R694 VanDerWaalsContact O-NE 3.11Å; A688-L697 HydrophobicContact CB-CD1 3.8Å; A688-I736 HydrophobicContact CB-CG2 4.5Å; A688-Y739 HydrophobicContact CB-CD2 3.99Å
689	L	84.5	Confident	87.1	Confident	41 Å²	41	35.6 Å²	35.6	22%	0.215	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-34.9	164.7	-66.1	172.6	0	0	0	111.5	L531 A685 T686 L687 R694 Y739 V807 L845	L531-L689 HydrophobicContact CD1-CD1 4.35Å; A685-L689 PolarHBondContact O-N 3.09Å; T686-L689 WeakPolarHBondContact O-CB 3.36Å; L687-L689 PolarHBondContact O-N 3.26Å; L687-L689 VanDerWaalsContact O-N 3.07Å; L689-R694 PolarHBondContact O-NE 3.47Å; L689-R694 PolarHBondContact O-NH2 3.18Å; L689-Y739 HydrophobicContact CD2-CD2 4.14Å; L689-Y739 HydrophobicContact CD2-CE2 3.39Å; L689-Y739 VanDerWaalsContact CD2-CE2 3.43Å; L689-Y739 HydrophobicContact CG-CE2 3.99Å; L689-V807 HydrophobicContact CD2-CG2 3.79Å; L689-L845 HydrophobicContact CD2-CD2 3.66Å
690	D	80.6	Confident	86.9	Confident	55 Å²	55	37.9 Å²	37.9	29%	0.294	18%	0.18	S	C	.	.	S	Bend	trans	-75.6	132.3	-178.2	-97.7	-42.6	0	0	0	111.6	R652 L687 A688 K692 T693 R694	R652-D690 WeakPolarHBondContact CD-OD2 3.28Å; L687-D690 PolarHBondContact O-N 3.12Å; L687-D690 VanDerWaalsContact O-N 3.09Å; A688-D690 VanDerWaalsContact C-N 3.31Å; D690-K692 VanDerWaalsContact C-N 3.28Å; D690-K692 PolarHBondContact O-N 3.14Å; D690-K692 VanDerWaalsContact O-N 3.12Å; D690-K692 PolarHBondContact OD1-N 3.26Å; D690-T693 PolarHBondContact O-N 2.93Å; D690-T693 VanDerWaalsContact O-N 3.09Å; D690-R694 WeakPolarHBondContact O-CG 3.47Å; D690-R694 PolarHBondContact O-N 2.88Å; D690-R694 VanDerWaalsContact O-N 3.13Å; D690-R694 PolarHBondContact O-NE 3.11Å; D690-R694 VanDerWaalsContact O-NE 3.12Å
691	R	78.8	Confident	86.7	Confident	107.333 Å²	107.333	45.6 Å²	45.6	41%	0.405	21%	0.209	S	C	.	.	H	α-helix	trans	-60.7	-32.4	180	-174	172.9	171.4	174.6	-2	112.8	R694 N1191	R691-R694 VanDerWaalsContact CA-NH2 3.33Å; R691-N1191 PolarHBondContact NH1-ND2 3.13Å; R691-N1191 PolarHBondContact NH1-OD1 3.2Å; R691-N1191 PolarHBondContact NH2-OD1 3.25Å; R691-N1191 VanDerWaalsContact NH2-OD1 3.08Å
692	K	80.9	Confident	86.4	Confident	167.333 Å²	167.333	45.7 Å²	45.7	73%	0.728	21%	0.21	S	C	*	.	H	α-helix	trans	-66.5	-50	175.8	-67.9	-176.7	177.6	-177	0	111.5	D690 R694 C695 I696	D690-K692 VanDerWaalsContact C-N 3.28Å; D690-K692 PolarHBondContact O-N 3.14Å; D690-K692 VanDerWaalsContact O-N 3.12Å; D690-K692 PolarHBondContact OD1-N 3.26Å; K692-R694 VanDerWaalsContact C-N 3.32Å; K692-R694 PolarHBondContact O-N 3.03Å; K692-C695 WeakPolarHBondContact O-CB 3.22Å; K692-C695 PolarHBondContact O-N 3.28Å; K692-C695 VanDerWaalsContact O-N 3.15Å; K692-I696 PolarHBondContact O-N 3.32Å
693	T	84	Confident	86.2	Confident	0.333333 Å²	0.333333	45.3 Å²	45.3	0%	0.002	21%	0.208	C	C	.	.	H	α-helix	trans	-67.5	-32	-177.2	-40.7	0	0	0	0	112.2	A656 V661 L687 D690 C695 I696 L697	A656-T693 VanDerWaalsContact CB-OG1 3.31Å; A656-T693 WeakPolarHBondContact CB-OG1 3.42Å; V661-T693 HydrophobicContact CG1-CG2 4.3Å; V661-T693 HydrophobicContact CG2-CG2 3.82Å; L687-T693 HydrophobicContact CB-CG2 4.01Å; L687-T693 VanDerWaalsContact O-CB 3.28Å; L687-T693 WeakPolarHBondContact O-CB 3.4Å; L687-T693 PolarHBondContact O-OG1 3.46Å; D690-T693 PolarHBondContact O-N 2.93Å; D690-T693 VanDerWaalsContact O-N 3.09Å; T693-C695 VanDerWaalsContact C-N 3.27Å; T693-C695 PolarHBondContact O-N 2.99Å; T693-I696 PolarHBondContact O-N 2.94Å; T693-I696 VanDerWaalsContact O-N 3.15Å; T693-L697 HydrophobicContact CG2-CD1 4.04Å; T693-L697 HydrophobicContact CG2-CG 4.17Å; T693-L697 WeakPolarHBondContact O-CB 3.3Å; T693-L697 WeakPolarHBondContact O-CG 3.35Å; T693-L697 PolarHBondContact O-N 3.1Å
694	R	85.7	Confident	86	Confident	9.66667 Å²	9.66667	49.8 Å²	49.8	4%	0.036	23%	0.229	C	C	.	.	H	α-helix	trans	-57.8	-35.4	172.3	-78	-178	-83.4	156.1	-3.2	113.5	A688 L689 D690 R691 K692 R698 Y739 I740 D842	A688-R694 WeakPolarHBondContact O-CD 3.35Å; A688-R694 WeakPolarHBondContact O-CG 3.39Å; A688-R694 PolarHBondContact O-NE 2.38Å; A688-R694 VanDerWaalsContact O-NE 3.11Å; L689-R694 PolarHBondContact O-NE 3.47Å; L689-R694 PolarHBondContact O-NH2 3.18Å; D690-R694 WeakPolarHBondContact O-CG 3.47Å; D690-R694 PolarHBondContact O-N 2.88Å; D690-R694 VanDerWaalsContact O-N 3.13Å; D690-R694 PolarHBondContact O-NE 3.11Å; D690-R694 VanDerWaalsContact O-NE 3.12Å; R691-R694 VanDerWaalsContact CA-NH2 3.33Å; K692-R694 VanDerWaalsContact C-N 3.32Å; K692-R694 PolarHBondContact O-N 3.03Å; R694-R698 WeakPolarHBondContact O-CB 3.4Å; R694-R698 PolarHBondContact O-N 3.13Å; R694-Y739 WeakPolarHBondContact CD-O 3.47Å; R694-I740 HydrophobicContact CG-CG2 4.43Å; R694-D842 IonicContact CZ-OD1 2.7Å; R694-D842 IonicContact CZ-OD2 2.76Å; R694-D842 VanDerWaalsContact CZ-OD2 3.3Å; R694-D842 IonicContact NH1-OD1 2.69Å; R694-D842 PolarHBondContact NH1-OD1 2.82Å; R694-D842 IonicContact NH1-OD2 2.84Å; R694-D842 PolarHBondContact NH1-OD2 3.27Å; R694-D842 IonicContact NH2-OD1 3.28Å; R694-D842 PolarHBondContact NH2-OD1 3.39Å; R694-D842 IonicContact NH2-OD2 2.89Å; R694-D842 PolarHBondContact NH2-OD2 3.09Å
695	C	83.4	Confident	85.8	Confident	55.3333 Å²	55.3333	51.5 Å²	51.5	37%	0.374	24%	0.238	S	C	.	.	H	α-helix	trans	-67.1	-54.5	171.6	-63.2	0	0	0	0	110.4	K692 T693 L697 R698 D699	K692-C695 WeakPolarHBondContact O-CB 3.22Å; K692-C695 PolarHBondContact O-N 3.28Å; K692-C695 VanDerWaalsContact O-N 3.15Å; T693-C695 VanDerWaalsContact C-N 3.27Å; T693-C695 PolarHBondContact O-N 2.99Å; C695-L697 VanDerWaalsContact C-N 3.29Å; C695-L697 PolarHBondContact O-N 2.96Å; C695-R698 WeakPolarHBondContact O-CA 3.27Å; C695-R698 WeakPolarHBondContact O-CB 3.32Å; C695-R698 PolarHBondContact O-N 3.12Å; C695-D699 PolarHBondContact O-N 3.19Å
696	I	86.3	Confident	85.8	Confident	33 Å²	33	51.5 Å²	51.5	17%	0.169	24%	0.237	C	C	.	.	H	α-helix	trans	-54.2	-43.8	-178.5	-58.7	169.7	0	0	0	111.7	A656 P658 V661 K692 T693 R698 D699 L700	A656-I696 WeakPolarHBondContact O-CD1 3.17Å; P658-I696 HydrophobicContact CB-CD1 4.19Å; P658-I696 HydrophobicContact CB-CG2 4.28Å; V661-I696 HydrophobicContact CB-CG2 4.05Å; V661-I696 HydrophobicContact CG1-CG2 3.79Å; K692-I696 PolarHBondContact O-N 3.32Å; T693-I696 PolarHBondContact O-N 2.94Å; T693-I696 VanDerWaalsContact O-N 3.15Å; I696-R698 VanDerWaalsContact C-N 3.33Å; I696-R698 PolarHBondContact O-N 3.09Å; I696-D699 PolarHBondContact O-N 3.13Å; I696-L700 HydrophobicContact CG2-CD1 3.89Å; I696-L700 HydrophobicContact CG2-CG 4.4Å; I696-L700 WeakPolarHBondContact O-CB 3.35Å; I696-L700 VanDerWaalsContact O-CG 3.23Å; I696-L700 WeakPolarHBondContact O-CG 3.21Å; I696-L700 PolarHBondContact O-N 3.13Å
697	L	88.1	Confident	85.8	Confident	2.66667 Å²	2.66667	51.7 Å²	51.7	1%	0.014	24%	0.239	C	C	.	.	H	α-helix	trans	-67.1	-31.4	178.3	-69.5	169.2	0	0	0	113.5	V661 V665 V684 A688 T693 C695 V702 I740	V661-L697 HydrophobicContact CG1-CD2 3.62Å; V661-L697 HydrophobicContact CG1-CG 4.11Å; V665-L697 HydrophobicContact CG2-CD2 3.8Å; V684-L697 HydrophobicContact CG1-CD1 4.21Å; V684-L697 HydrophobicContact CG1-CD2 4.12Å; A688-L697 HydrophobicContact CB-CD1 3.8Å; T693-L697 HydrophobicContact CG2-CD1 4.04Å; T693-L697 HydrophobicContact CG2-CG 4.17Å; T693-L697 WeakPolarHBondContact O-CB 3.3Å; T693-L697 WeakPolarHBondContact O-CG 3.35Å; T693-L697 PolarHBondContact O-N 3.1Å; C695-L697 VanDerWaalsContact C-N 3.29Å; C695-L697 PolarHBondContact O-N 2.96Å; L697-V702 HydrophobicContact CB-CG2 4.45Å; L697-V702 HydrophobicContact CD2-CG2 4.03Å; L697-V702 WeakPolarHBondContact O-CB 3.32Å; L697-V702 VanDerWaalsContact O-CG2 3.26Å; L697-V702 WeakPolarHBondContact O-CG2 3.35Å; L697-V702 PolarHBondContact O-N 3.21Å; L697-I740 HydrophobicContact CB-CD1 3.64Å; L697-I740 HydrophobicContact CB-CG1 4.03Å; L697-I740 HydrophobicContact CB-CG2 3.91Å; L697-I740 HydrophobicContact CD1-CD1 4.19Å; L697-I740 HydrophobicContact CD1-CG1 4.3Å; L697-I740 HydrophobicContact CD1-CG2 4.08Å; L697-I740 HydrophobicContact CG-CD1 4.48Å
698	R	85.2	Confident	85.6	Confident	120.667 Å²	120.667	56.6 Å²	56.6	46%	0.455	26%	0.262	S	S	.	.	H	α-helix	trans	-72.5	-43.8	172.9	-177.9	-170.1	64.5	-173.5	-3.1	110.9	R694 C695 I696 L700 R701 I740	R694-R698 WeakPolarHBondContact O-CB 3.4Å; R694-R698 PolarHBondContact O-N 3.13Å; C695-R698 WeakPolarHBondContact O-CA 3.27Å; C695-R698 WeakPolarHBondContact O-CB 3.32Å; C695-R698 PolarHBondContact O-N 3.12Å; I696-R698 VanDerWaalsContact C-N 3.33Å; I696-R698 PolarHBondContact O-N 3.09Å; R698-L700 PolarHBondContact O-N 3.18Å; R698-R701 PolarHBondContact O-N 3.16Å; R698-R701 VanDerWaalsContact O-N 3.11Å; R698-I740 HydrophobicContact CB-CG2 3.9Å
699	D	86.9	Confident	85.4	Confident	106.667 Å²	106.667	56.7 Å²	56.7	57%	0.57	26%	0.262	S	S	*	.	H	α-helix	trans	-69.3	-24.5	-177	-51	-20.7	0	0	0	111.2	C695 I696 R701	C695-D699 PolarHBondContact O-N 3.19Å; I696-D699 PolarHBondContact O-N 3.13Å; D699-R701 VanDerWaalsContact C-N 3.34Å
700	L	87.9	Confident	85.3	Confident	53 Å²	53	55 Å²	55	28%	0.277	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	1.9	171	-70.2	173.8	0	0	0	115.1	V661 R662 V665 I696 R698 V702	V661-L700 HydrophobicContact CG1-CD1 4.08Å; R662-L700 HydrophobicContact CB-CD1 4.23Å; R662-L700 HydrophobicContact CB-CD2 4.35Å; R662-L700 HydrophobicContact CG-CD1 3.79Å; R662-L700 HydrophobicContact CG-CD2 3.82Å; R662-L700 HydrophobicContact CG-CG 4.38Å; V665-L700 HydrophobicContact CG2-CD1 4.28Å; I696-L700 HydrophobicContact CG2-CD1 3.89Å; I696-L700 HydrophobicContact CG2-CG 4.4Å; I696-L700 WeakPolarHBondContact O-CB 3.35Å; I696-L700 VanDerWaalsContact O-CG 3.23Å; I696-L700 WeakPolarHBondContact O-CG 3.21Å; I696-L700 PolarHBondContact O-N 3.13Å; R698-L700 PolarHBondContact O-N 3.18Å; L700-V702 VanDerWaalsContact C-N 3.29Å; L700-V702 HydrophobicContact CB-CG2 3.92Å; L700-V702 PolarHBondContact O-N 3.07Å
701	R	86.4	Confident	85.3	Confident	164 Å²	164	54.6 Å²	54.6	62%	0.619	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.3	39.2	-179.1	-57.5	-168.6	-177.9	-166.4	1.4	115.1	R698 D699 D703 E704	R698-R701 PolarHBondContact O-N 3.16Å; R698-R701 VanDerWaalsContact O-N 3.11Å; D699-R701 VanDerWaalsContact C-N 3.34Å; R701-D703 VanDerWaalsContact CA-OD1 3.26Å; R701-D703 WeakPolarHBondContact CA-OD1 3.34Å; R701-D703 PolarHBondContact O-N 3.17Å; R701-D703 VanDerWaalsContact O-N 3.14Å; R701-E704 HydrophobicContact CB-CG 4.33Å; R701-E704 WeakPolarHBondContact CD-OE1 3.33Å; R701-E704 IonicContact CZ-OE1 2.83Å; R701-E704 IonicContact NH1-OE1 2.63Å; R701-E704 PolarHBondContact NH1-OE1 3.13Å; R701-E704 PolarHBondContact O-N 2.95Å
702	V	87.7	Confident	84.5	Confident	2.66667 Å²	2.66667	55.1 Å²	55.1	2%	0.016	27%	0.268	C	S	.	.	H	α-helix	trans	-64.9	-19.2	179.5	-173	0	0	0	0	111.9	V665 L697 L700 E704 L705 L706	V665-V702 HydrophobicContact CB-CG2 4.31Å; V665-V702 HydrophobicContact CG1-CG2 3.75Å; V665-V702 HydrophobicContact CG2-CG1 4.38Å; V665-V702 HydrophobicContact CG2-CG2 3.5Å; V665-V702 VanDerWaalsContact CG2-CG2 3.47Å; L697-V702 HydrophobicContact CB-CG2 4.45Å; L697-V702 HydrophobicContact CD2-CG2 4.03Å; L697-V702 WeakPolarHBondContact O-CB 3.32Å; L697-V702 VanDerWaalsContact O-CG2 3.26Å; L697-V702 WeakPolarHBondContact O-CG2 3.35Å; L697-V702 PolarHBondContact O-N 3.21Å; L700-V702 VanDerWaalsContact C-N 3.29Å; L700-V702 HydrophobicContact CB-CG2 3.92Å; L700-V702 PolarHBondContact O-N 3.07Å; V702-E704 VanDerWaalsContact C-N 3.26Å; V702-E704 PolarHBondContact O-N 3.08Å; V702-L705 PolarHBondContact O-N 3.1Å; V702-L706 HydrophobicContact CG1-CD1 3.83Å; V702-L706 HydrophobicContact CG1-CG 4.03Å; V702-L706 VanDerWaalsContact O-CG 3.28Å; V702-L706 WeakPolarHBondContact O-CG 3.37Å; V702-L706 PolarHBondContact O-N 3.35Å; V702-L706 VanDerWaalsContact O-N 3.11Å
703	D	87.3	Confident	83.8	Confident	8 Å²	8	48.1 Å²	48.1	4%	0.043	24%	0.243	C	C	.	.	H	α-helix	trans	-60.9	-31.2	175.6	51.2	-18.1	0	0	0	113.9	R701 L705 V707 L737 I740 R742 M745	R701-D703 VanDerWaalsContact CA-OD1 3.26Å; R701-D703 WeakPolarHBondContact CA-OD1 3.34Å; R701-D703 PolarHBondContact O-N 3.17Å; R701-D703 VanDerWaalsContact O-N 3.14Å; D703-L705 PolarHBondContact O-N 2.97Å; D703-V707 WeakPolarHBondContact O-CB 3.45Å; D703-V707 VanDerWaalsContact O-CG2 3.23Å; D703-V707 WeakPolarHBondContact O-CG2 3.36Å; D703-V707 PolarHBondContact O-N 3.18Å; D703-L737 HydrophobicContact CB-CD2 3.73Å; D703-I740 HydrophobicContact CB-CD1 4.31Å; D703-R742 HydrophobicContact CB-CB 4.35Å; D703-R742 HydrophobicContact CB-CG 4Å; D703-R742 IonicContact OD2-CZ 3.23Å; D703-R742 IonicContact OD2-NE 3.17Å; D703-R742 PolarHBondContact OD2-NE 3.12Å; D703-R742 IonicContact OD2-NH2 3.31Å; D703-R742 PolarHBondContact OD2-NH2 3.12Å; D703-R742 VanDerWaalsContact OD2-NH2 3.08Å; D703-M745 HydrophobicContact CB-SD 3.95Å
704	E	86.7	Confident	83.2	Confident	95 Å²	95	49.4 Å²	49.4	44%	0.444	25%	0.25	S	S	.	.	H	α-helix	trans	-63.8	-47.2	174.9	-56.8	-163.4	-178.5	0	0	111.9	R701 V702 V707 Q708 R987	R701-E704 HydrophobicContact CB-CG 4.33Å; R701-E704 WeakPolarHBondContact CD-OE1 3.33Å; R701-E704 IonicContact CZ-OE1 2.83Å; R701-E704 IonicContact NH1-OE1 2.63Å; R701-E704 PolarHBondContact NH1-OE1 3.13Å; R701-E704 PolarHBondContact O-N 2.95Å; V702-E704 VanDerWaalsContact C-N 3.26Å; V702-E704 PolarHBondContact O-N 3.08Å; E704-V707 PolarHBondContact O-N 3.32Å; E704-Q708 PolarHBondContact O-N 3.14Å; E704-Q708 VanDerWaalsContact O-N 3.17Å; E704-R987 VanDerWaalsContact CD-CZ 3.48Å; E704-R987 VanDerWaalsContact CD-NH1 3.35Å; E704-R987 VanDerWaalsContact CD-NH2 3.27Å; E704-R987 IonicContact OE1-CZ 3.88Å; E704-R987 IonicContact OE1-NH1 2.81Å; E704-R987 PolarHBondContact OE1-NH1 3.34Å; E704-R987 IonicContact OE2-CZ 2.83Å; E704-R987 IonicContact OE2-NH1 3.17Å; E704-R987 PolarHBondContact OE2-NH1 2.94Å; E704-R987 IonicContact OE2-NH2 3.33Å; E704-R987 PolarHBondContact OE2-NH2 2.9Å
705	L	86.8	Confident	82.5	Confident	39.6667 Å²	39.6667	56.8 Å²	56.8	21%	0.208	29%	0.285	C	S	.	.	H	α-helix	trans	-69.6	-41.8	-179.4	179.8	62.9	0	0	0	112.3	L668 V670 V702 D703 V707 Q708 M709	L668-L705 HydrophobicContact CB-CD2 3.62Å; L668-L705 WeakPolarHBondContact O-CD2 3.5Å; V670-L705 HydrophobicContact CG2-CD1 4.36Å; V702-L705 PolarHBondContact O-N 3.1Å; D703-L705 PolarHBondContact O-N 2.97Å; L705-V707 VanDerWaalsContact C-N 3.33Å; L705-V707 PolarHBondContact O-N 2.98Å; L705-Q708 WeakPolarHBondContact O-CB 3.3Å; L705-Q708 PolarHBondContact O-N 3.28Å; L705-M709 HydrophobicContact CD1-CE 4.29Å; L705-M709 HydrophobicContact CG-CE 4.17Å; L705-M709 PolarHBondContact O-N 2.96Å; L705-M709 VanDerWaalsContact O-N 3.15Å
706	L	89.8	Confident	81.9	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-67.3	-34.6	178.5	-66.4	170.8	0	0	0	112	L681 V702 Q708 M709 L710 A733 I736 L737	L681-L706 HydrophobicContact CD2-CD2 3.83Å; V702-L706 HydrophobicContact CG1-CD1 3.83Å; V702-L706 HydrophobicContact CG1-CG 4.03Å; V702-L706 VanDerWaalsContact O-CG 3.28Å; V702-L706 WeakPolarHBondContact O-CG 3.37Å; V702-L706 PolarHBondContact O-N 3.35Å; V702-L706 VanDerWaalsContact O-N 3.11Å; L706-Q708 VanDerWaalsContact C-N 3.32Å; L706-Q708 PolarHBondContact O-N 2.88Å; L706-M709 HydrophobicContact CD2-SD 4.32Å; L706-M709 WeakPolarHBondContact O-CB 3.44Å; L706-M709 PolarHBondContact O-N 3.33Å; L706-L710 WeakPolarHBondContact O-CG 3.29Å; L706-L710 PolarHBondContact O-N 3.29Å; L706-L710 VanDerWaalsContact O-N 3.16Å; L706-A733 HydrophobicContact CD2-CB 4.16Å; L706-I736 HydrophobicContact CD1-CB 3.84Å; L706-I736 HydrophobicContact CD1-CD1 4.42Å; L706-I736 HydrophobicContact CD1-CG2 3.49Å; L706-I736 VanDerWaalsContact CD1-CG2 3.48Å; L706-I736 HydrophobicContact CD2-CD1 4.1Å; L706-L737 HydrophobicContact CB-CD1 3.92Å; L706-L737 HydrophobicContact CB-CD2 4.08Å; L706-L737 HydrophobicContact CB-CG 3.83Å; L706-L737 HydrophobicContact CD1-CD2 4.29Å; L706-L737 HydrophobicContact CD1-CG 4.06Å
707	V	87.2	Confident	81.6	Confident	20.6667 Å²	20.6667	60.7 Å²	60.7	13%	0.125	29%	0.29	C	S	.	.	H	α-helix	trans	-68.7	-31.5	174	170.1	0	0	0	0	111.7	D703 E704 L705 M709 L710 L711 L737 M745	D703-V707 WeakPolarHBondContact O-CB 3.45Å; D703-V707 VanDerWaalsContact O-CG2 3.23Å; D703-V707 WeakPolarHBondContact O-CG2 3.36Å; D703-V707 PolarHBondContact O-N 3.18Å; E704-V707 PolarHBondContact O-N 3.32Å; L705-V707 VanDerWaalsContact C-N 3.33Å; L705-V707 PolarHBondContact O-N 2.98Å; V707-M709 VanDerWaalsContact C-N 3.34Å; V707-L710 CarbonylContact O-C 3.57Å; V707-L710 PolarHBondContact O-N 3.14Å; V707-L710 VanDerWaalsContact O-N 3.11Å; V707-L711 PolarHBondContact O-N 3.36Å; V707-L737 HydrophobicContact CG2-CD1 4Å; V707-L737 HydrophobicContact CG2-CD2 4.32Å; V707-M745 HydrophobicContact CG2-CB 3.68Å; V707-M745 HydrophobicContact CG2-CE 4.03Å; V707-M745 HydrophobicContact CG2-CG 4.47Å; V707-M745 HydrophobicContact CG2-SD 4.17Å
708	Q	84.8	Confident	80.9	Confident	107 Å²	107	65.5 Å²	65.5	50%	0.5	31%	0.309	S	S	.	.	H	α-helix	trans	-62.6	-40.5	170.4	-169.1	-178.9	-13	0	0	111.5	V670 E704 L705 L706 L710 L711	V670-Q708 HydrophobicContact CG2-CG 4.11Å; E704-Q708 PolarHBondContact O-N 3.14Å; E704-Q708 VanDerWaalsContact O-N 3.17Å; L705-Q708 WeakPolarHBondContact O-CB 3.3Å; L705-Q708 PolarHBondContact O-N 3.28Å; L706-Q708 VanDerWaalsContact C-N 3.32Å; L706-Q708 PolarHBondContact O-N 2.88Å; Q708-L710 PolarHBondContact O-N 3.33Å; Q708-L711 HydrophobicContact CG-CD1 4.47Å; Q708-L711 WeakPolarHBondContact O-CB 3.32Å; Q708-L711 PolarHBondContact O-N 3.12Å; Q708-L711 VanDerWaalsContact O-N 3.15Å
709	M	84.4	Confident	80.2	Confident	0.666667 Å²	0.666667	61.2 Å²	61.2	0%	0.003	30%	0.296	C	S	.	.	H	α-helix	trans	-66.6	-18.6	173.3	-62.7	176.5	-179.9	0	0	113.5	L668 V670 L677 L681 L705 L706 V707 V729 K730 A733	L668-M709 HydrophobicContact CB-CE 4.43Å; V670-M709 HydrophobicContact CG2-CE 4.27Å; V670-M709 HydrophobicContact CG2-CG 3.99Å; L677-M709 HydrophobicContact CD1-CE 3.76Å; L677-M709 HydrophobicContact CD1-SD 4.28Å; L677-M709 HydrophobicContact CD2-CE 4.45Å; L681-M709 HydrophobicContact CD1-SD 4.28Å; L681-M709 HydrophobicContact CD2-SD 4.13Å; L705-M709 HydrophobicContact CD1-CE 4.29Å; L705-M709 HydrophobicContact CG-CE 4.17Å; L705-M709 PolarHBondContact O-N 2.96Å; L705-M709 VanDerWaalsContact O-N 3.15Å; L706-M709 HydrophobicContact CD2-SD 4.32Å; L706-M709 WeakPolarHBondContact O-CB 3.44Å; L706-M709 PolarHBondContact O-N 3.33Å; V707-M709 VanDerWaalsContact C-N 3.34Å; M709-V729 HydrophobicContact CB-CG1 4.47Å; M709-K730 WeakPolarHBondContact O-CG 3.46Å; M709-A733 HydrophobicContact CB-CB 4.1Å
710	L	82.9	Confident	79.1	Confident	5.66667 Å²	5.66667	64.3 Å²	64.3	3%	0.03	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	2.8	174	-67.6	-173.3	0	0	0	114.6	L706 V707 Q708 K730 A733 A734 L737 V746 R749 V750	L706-L710 WeakPolarHBondContact O-CG 3.29Å; L706-L710 PolarHBondContact O-N 3.29Å; L706-L710 VanDerWaalsContact O-N 3.16Å; V707-L710 CarbonylContact O-C 3.57Å; V707-L710 PolarHBondContact O-N 3.14Å; V707-L710 VanDerWaalsContact O-N 3.11Å; Q708-L710 PolarHBondContact O-N 3.33Å; L710-K730 HydrophobicContact CD2-CB 4.01Å; L710-K730 HydrophobicContact CD2-CG 4.15Å; L710-K730 WeakPolarHBondContact CD2-O 3.36Å; L710-A733 HydrophobicContact CD2-CB 4.06Å; L710-A733 HydrophobicContact CG-CB 4.27Å; L710-A734 HydrophobicContact CD1-CB 4.47Å; L710-A734 HydrophobicContact CD2-CB 4.34Å; L710-L737 HydrophobicContact CD1-CD1 3.5Å; L710-L737 VanDerWaalsContact CD1-CD1 3.5Å; L710-L737 HydrophobicContact CG-CD1 4.39Å; L710-V746 HydrophobicContact CD1-CB 4.26Å; L710-V746 HydrophobicContact CD1-CG1 4.16Å; L710-V746 HydrophobicContact CD1-CG2 4Å; L710-R749 WeakPolarHBondContact O-CD 3.38Å; L710-R749 PolarHBondContact O-NH1 3.21Å; L710-V750 HydrophobicContact CD2-CG2 3.72Å
711	L	79.5	Confident	78.1	Confident	46.3333 Å²	46.3333	64.3 Å²	64.3	24%	0.243	31%	0.311	C	S	.	.	S	Bend	trans	-78.2	162.9	172.8	-73.3	169.6	0	0	0	111.4	V707 Q708 G713 L984	V707-L711 PolarHBondContact O-N 3.36Å; Q708-L711 HydrophobicContact CG-CD1 4.47Å; Q708-L711 WeakPolarHBondContact O-CB 3.32Å; Q708-L711 PolarHBondContact O-N 3.12Å; Q708-L711 VanDerWaalsContact O-N 3.15Å; L711-G713 PolarHBondContact O-N 3.09Å; L711-G713 VanDerWaalsContact O-N 3.16Å; L711-L984 HydrophobicContact CD1-CD2 4.31Å; L711-L984 HydrophobicContact CD2-CD2 4.07Å; L711-L984 HydrophobicContact CD2-CG 4.39Å
712	P	62.9	Low	77.5	Confident	119.667 Å²	119.667	56.7 Å²	56.7	78%	0.777	28%	0.283	S	S	*	.	S	Bend	trans	-64.7	100.8	167.8	-3.1	11.5	0	0	0	109.8
713	G	65.7	Low	77.1	Confident	20 Å²	20	61.9 Å²	61.9	21%	0.206	31%	0.309	C	S	.	.			trans	-156.5	30.4	-173.9	0	0	0	0	0	111.7	L711 E715 W716	L711-G713 PolarHBondContact O-N 3.09Å; L711-G713 VanDerWaalsContact O-N 3.16Å; G713-E715 PolarHBondContact O-N 2.81Å; G713-E715 VanDerWaalsContact O-N 3.13Å; G713-W716 WeakPolarHBondContact O-CB 3.13Å; G713-W716 VanDerWaalsContact O-CD1 3.27Å; G713-W716 PolarHBondContact O-N 3.03Å; G713-W716 VanDerWaalsContact O-N 3.1Å
714	D	72.5	Confident	76.8	Confident	28 Å²	28	62.9 Å²	62.9	15%	0.15	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-64.6	-24.5	-170.1	-60.5	29.8	0	0	0	112.3	W716 Y717 Y718 P726 K730 F886	D714-W716 PolarHBondContact O-N 3.14Å; D714-Y717 PolarHBondContact O-N 3.29Å; D714-Y718 HydrophobicContact CB-CE1 4.22Å; D714-Y718 HydrophobicContact CB-CE2 4.05Å; D714-Y718 WeakPolarHBondContact CB-OH 3.46Å; D714-Y718 WeakPolarHBondContact O-CD2 3.34Å; D714-Y718 PolarHBondContact O-N 3.08Å; D714-Y718 VanDerWaalsContact O-N 3.13Å; D714-P726 HydrophobicContact CB-CB 3.98Å; D714-P726 HydrophobicContact CB-CG 4.2Å; D714-P726 WeakPolarHBondContact OD1-CB 3.14Å; D714-P726 WeakPolarHBondContact OD2-CB 3.42Å; D714-K730 VanDerWaalsContact OD1-CE 3.28Å; D714-K730 WeakPolarHBondContact OD1-CE 3.32Å; D714-K730 IonicContact OD1-NZ 3.52Å; D714-K730 PolarHBondContact OD1-NZ 3.07Å; D714-K730 IonicContact OD2-NZ 3.42Å; D714-K730 PolarHBondContact OD2-NZ 3.16Å; D714-F886 WeakPolarHBondContact OD2-CZ 3.31Å
715	E	70.3	Confident	76.8	Confident	164.333 Å²	164.333	58.4 Å²	58.4	77%	0.768	29%	0.292	S	S	*	.	G	3₁₀ helix	trans	-57.6	-28.3	172	-62.5	-179.1	179.3	0	0	113.9	G713 Y717 Y718	G713-E715 PolarHBondContact O-N 2.81Å; G713-E715 VanDerWaalsContact O-N 3.13Å; E715-Y717 VanDerWaalsContact C-N 3.27Å; E715-Y717 PolarHBondContact O-N 3.04Å; E715-Y718 HydrophobicContact CG-CD2 4.43Å; E715-Y718 HydrophobicContact CG-CE2 4.39Å
716	W	71	Confident	76.7	Confident	166.667 Å²	166.667	56.6 Å²	56.6	63%	0.631	28%	0.283	S	S	*	.	G	3₁₀ helix	trans	-72	-18.6	175.2	-64.2	93.7	0	0	0	113	V670 T671 G713 D714	V670-W716 HydrophobicContact CG1-CB 4.46Å; V670-W716 HydrophobicContact CG1-CG 4.44Å; T671-W716 HydrophobicContact CG2-CE3 4.4Å; T671-W716 HydrophobicContact CG2-CZ3 4.01Å; G713-W716 WeakPolarHBondContact O-CB 3.13Å; G713-W716 VanDerWaalsContact O-CD1 3.27Å; G713-W716 PolarHBondContact O-N 3.03Å; G713-W716 VanDerWaalsContact O-N 3.1Å; D714-W716 PolarHBondContact O-N 3.14Å
717	Y	79	Confident	76.3	Confident	4 Å²	4	62.3 Å²	62.3	2%	0.016	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113	-7.2	-175.7	-50.1	-53.6	0	0	0	113.6	V670 L677 D714 E715 T719 F725 P726 V729	V670-Y717 HydrophobicContact CG1-CE1 4.42Å; L677-Y717 HydrophobicContact CD2-CD1 4.36Å; L677-Y717 HydrophobicContact CD2-CE1 3.68Å; D714-Y717 PolarHBondContact O-N 3.29Å; E715-Y717 VanDerWaalsContact C-N 3.27Å; E715-Y717 PolarHBondContact O-N 3.04Å; Y717-T719 PolarHBondContact O-N 3.46Å; Y717-F725 WeakPolarHBondContact O-CB 3.48Å; Y717-P726 HydrophobicContact CD2-CB 3.99Å; Y717-P726 HydrophobicContact CG-CB 4.49Å; Y717-V729 HydrophobicContact CD1-CG2 4.3Å; Y717-V729 HydrophobicContact CE1-CG1 3.96Å; Y717-V729 HydrophobicContact CE1-CG2 4.46Å; Y717-V729 HydrophobicContact CE2-CB 4.48Å; Y717-V729 HydrophobicContact CE2-CG1 4.1Å
718	Y	74.6	Confident	76.3	Confident	103.333 Å²	103.333	61.3 Å²	61.3	41%	0.405	30%	0.302	S	S	.	.			trans	-72.9	127.2	173.5	-65.1	-35.9	0	0	0	110.5	D714 E715 M723 P726	D714-Y718 HydrophobicContact CB-CE1 4.22Å; D714-Y718 HydrophobicContact CB-CE2 4.05Å; D714-Y718 WeakPolarHBondContact CB-OH 3.46Å; D714-Y718 WeakPolarHBondContact O-CD2 3.34Å; D714-Y718 PolarHBondContact O-N 3.08Å; D714-Y718 VanDerWaalsContact O-N 3.13Å; E715-Y718 HydrophobicContact CG-CD2 4.43Å; E715-Y718 HydrophobicContact CG-CE2 4.39Å; Y718-M723 HydrophobicContact CD1-CB 4.36Å; Y718-M723 HydrophobicContact CD1-CE 4.36Å; Y718-M723 HydrophobicContact CD1-CG 4.48Å; Y718-M723 HydrophobicContact CD1-SD 3.31Å; Y718-M723 WeakPolarHBondContact CD1-SD 3.31Å; Y718-M723 HydrophobicContact CD2-SD 4.25Å; Y718-M723 HydrophobicContact CE1-CB 4.29Å; Y718-M723 HydrophobicContact CE1-SD 3.56Å; Y718-M723 VanDerWaalsContact CE1-SD 3.57Å; Y718-M723 WeakPolarHBondContact CE1-SD 3.41Å; Y718-M723 HydrophobicContact CE2-SD 4.41Å; Y718-M723 HydrophobicContact CG-CE 4.31Å; Y718-M723 HydrophobicContact CG-SD 3.69Å; Y718-P726 HydrophobicContact CD1-CG 3.61Å; Y718-P726 HydrophobicContact CE1-CG 3.43Å; Y718-P726 VanDerWaalsContact CE1-CG 3.45Å
719	T	69.5	Low	76.4	Confident	30 Å²	30	56.2 Å²	56.2	18%	0.184	28%	0.278	C	S	.	.			trans	-104	166.6	167.6	73.2	0	0	0	0	109.3	P674 Y717 Q721 T722 F725	P674-T719 HydrophobicContact CG-CG2 4.04Å; Y717-T719 PolarHBondContact O-N 3.46Å; T719-Q721 PolarHBondContact O-N 3.14Å; T719-Q721 PolarHBondContact OG1-N 3.25Å; T719-T722 HydrophobicContact CG2-CG2 4.47Å; T719-T722 PolarHBondContact N-O 3.14Å; T719-T722 VanDerWaalsContact OG1-CG2 3.27Å; T719-T722 WeakPolarHBondContact OG1-CG2 3.34Å; T719-T722 PolarHBondContact OG1-N 3.02Å; T719-T722 VanDerWaalsContact OG1-N 3.13Å; T719-F725 HydrophobicContact CG2-CD2 4.05Å; T719-F725 HydrophobicContact CG2-CE2 4.09Å
720	N	63.9	Low	76.6	Confident	172.333 Å²	172.333	57.4 Å²	57.4	92%	0.922	28%	0.283	S	S	*	.	S	Bend	trans	-63.9	-1	172.6	-64.3	-29	0	0	0	113.8
721	Q	67.3	Low	76.9	Confident	53 Å²	53	57.8 Å²	57.8	25%	0.248	29%	0.285	C	S	.	.	S	Bend	trans	-122.7	-24.7	-171.2	-69.3	148	1.1	0	0	113.3	C621 L622 P623 T719 N779	C621-Q721 PolarHBondContact O-NE2 2.98Å; L622-Q721 VanDerWaalsContact CD2-CD 3.46Å; L622-Q721 HydrophobicContact CD2-CG 4.06Å; P623-Q721 VanDerWaalsContact CD-OE1 3.24Å; T719-Q721 PolarHBondContact O-N 3.14Å; T719-Q721 PolarHBondContact OG1-N 3.25Å; Q721-N779 WeakPolarHBondContact CA-ND2 3.4Å; Q721-N779 PolarHBondContact O-ND2 2.99Å
722	T	74.2	Confident	77.4	Confident	4.33333 Å²	4.33333	55.6 Å²	55.6	3%	0.027	27%	0.273	C	S	.	.			trans	-151.7	150.4	-176.5	179	0	0	0	0	113.6	T719 I724 F725 D783 I786	T719-T722 HydrophobicContact CG2-CG2 4.47Å; T719-T722 PolarHBondContact N-O 3.14Å; T719-T722 VanDerWaalsContact OG1-CG2 3.27Å; T719-T722 WeakPolarHBondContact OG1-CG2 3.34Å; T719-T722 PolarHBondContact OG1-N 3.02Å; T719-T722 VanDerWaalsContact OG1-N 3.13Å; T722-I724 WeakPolarHBondContact OG1-CB 3.41Å; T722-I724 PolarHBondContact OG1-N 3.16Å; T722-F725 HydrophobicContact CG2-CD2 3.34Å; T722-F725 HydrophobicContact CG2-CE2 3.35Å; T722-F725 HydrophobicContact CG2-CG 4.36Å; T722-F725 HydrophobicContact CG2-CZ 4.36Å; T722-D783 VanDerWaalsContact CB-OD1 3.25Å; T722-D783 WeakPolarHBondContact CB-OD1 3.34Å; T722-D783 PolarHBondContact OG1-OD1 3Å; T722-I786 HydrophobicContact CG2-CD1 3.58Å
723	M	78	Confident	78.7	Confident	112 Å²	112	49.9 Å²	49.9	55%	0.552	24%	0.236	S	C	*	.	S	Bend	trans	-110.3	7.7	173.3	-59.5	-71.5	147	0	0	112.2	Y718	Y718-M723 HydrophobicContact CD1-CB 4.36Å; Y718-M723 HydrophobicContact CD1-CE 4.36Å; Y718-M723 HydrophobicContact CD1-CG 4.48Å; Y718-M723 HydrophobicContact CD1-SD 3.31Å; Y718-M723 WeakPolarHBondContact CD1-SD 3.31Å; Y718-M723 HydrophobicContact CD2-SD 4.25Å; Y718-M723 HydrophobicContact CE1-CB 4.29Å; Y718-M723 HydrophobicContact CE1-SD 3.56Å; Y718-M723 VanDerWaalsContact CE1-SD 3.57Å; Y718-M723 WeakPolarHBondContact CE1-SD 3.41Å; Y718-M723 HydrophobicContact CE2-SD 4.41Å; Y718-M723 HydrophobicContact CG-CE 4.31Å; Y718-M723 HydrophobicContact CG-SD 3.69Å
724	I	82.7	Confident	79.9	Confident	27.6667 Å²	27.6667	48.9 Å²	48.9	14%	0.142	23%	0.226	C	C	.	.			trans	-83.7	-37.4	-173.8	-66.6	-169.8	0	0	0	112.7	T722 K727 V728 D783 I786 L787	T722-I724 WeakPolarHBondContact OG1-CB 3.41Å; T722-I724 PolarHBondContact OG1-N 3.16Å; I724-K727 WeakPolarHBondContact O-CB 3.25Å; I724-K727 PolarHBondContact O-N 3.02Å; I724-V728 HydrophobicContact CG2-CG2 3.77Å; I724-V728 PolarHBondContact O-N 2.88Å; I724-D783 HydrophobicContact CD1-CB 3.53Å; I724-D783 VanDerWaalsContact CD1-CG 3.4Å; I724-D783 WeakPolarHBondContact CD1-OD1 3.24Å; I724-D783 HydrophobicContact CG1-CB 4.48Å; I724-D783 WeakPolarHBondContact CG1-OD1 3.25Å; I724-I786 HydrophobicContact CG2-CG2 4.27Å; I724-L787 HydrophobicContact CD1-CD1 3.99Å; I724-L787 HydrophobicContact CD1-CD2 4.43Å; I724-L787 HydrophobicContact CD1-CG 4.04Å; I724-L787 HydrophobicContact CG2-CD2 3.82Å; I724-L787 HydrophobicContact CG2-CG 4.27Å
725	F	85.2	Confident	80.7	Confident	0.333333 Å²	0.333333	48.6 Å²	48.6	0%	0.001	22%	0.223	C	C	.	.	H	α-helix	trans	-48.3	-45.7	-176.1	-75.2	-55.9	0	0	0	115.7	P623 P674 Q675 Y717 T719 T722 K727 V728 V729 I786	P623-F725 HydrophobicContact CG-CZ 4.46Å; P674-F725 HydrophobicContact CB-CB 3.64Å; P674-F725 HydrophobicContact CB-CD1 3.88Å; P674-F725 HydrophobicContact CB-CD2 3.79Å; P674-F725 HydrophobicContact CB-CE1 4.4Å; P674-F725 HydrophobicContact CB-CE2 4.4Å; P674-F725 HydrophobicContact CB-CG 3.52Å; P674-F725 VanDerWaalsContact CB-CG 3.45Å; P674-F725 HydrophobicContact CG-CB 4.2Å; P674-F725 HydrophobicContact CG-CD1 4.34Å; P674-F725 HydrophobicContact CG-CD2 3.68Å; P674-F725 VanDerWaalsContact CG-CD2 3.48Å; P674-F725 HydrophobicContact CG-CE2 3.84Å; P674-F725 HydrophobicContact CG-CG 3.93Å; P674-F725 HydrophobicContact CG-CZ 4.47Å; Q675-F725 HydrophobicContact CB-CE1 3.8Å; Q675-F725 HydrophobicContact CB-CZ 3.75Å; Q675-F725 HydrophobicContact CG-CE1 4.47Å; Y717-F725 WeakPolarHBondContact O-CB 3.48Å; T719-F725 HydrophobicContact CG2-CD2 4.05Å; T719-F725 HydrophobicContact CG2-CE2 4.09Å; T722-F725 HydrophobicContact CG2-CD2 3.34Å; T722-F725 HydrophobicContact CG2-CE2 3.35Å; T722-F725 HydrophobicContact CG2-CG 4.36Å; T722-F725 HydrophobicContact CG2-CZ 4.36Å; F725-K727 PolarHBondContact O-N 3.12Å; F725-K727 VanDerWaalsContact O-N 3.14Å; F725-V728 PolarHBondContact O-N 3.05Å; F725-V729 WeakPolarHBondContact O-CG2 3.36Å; F725-V729 PolarHBondContact O-N 2.92Å; F725-I786 HydrophobicContact CD1-CG2 4Å; F725-I786 HydrophobicContact CE1-CD1 4.38Å; F725-I786 HydrophobicContact CE1-CG1 4.21Å; F725-I786 HydrophobicContact CE1-CG2 3.61Å; F725-I786 HydrophobicContact CE2-CD1 3.95Å; F725-I786 HydrophobicContact CZ-CD1 3.74Å; F725-I786 HydrophobicContact CZ-CG1 3.86Å; F725-I786 HydrophobicContact CZ-CG2 4.09Å
726	P	84.5	Confident	81.7	Confident	2.66667 Å²	2.66667	40.7 Å²	40.7	2%	0.017	19%	0.186	C	C	.	.	H	α-helix	trans	-55	-35	178	-7.4	3	0	0	0	113.7	D714 Y717 Y718 K730	D714-P726 HydrophobicContact CB-CB 3.98Å; D714-P726 HydrophobicContact CB-CG 4.2Å; D714-P726 WeakPolarHBondContact OD1-CB 3.14Å; D714-P726 WeakPolarHBondContact OD2-CB 3.42Å; Y717-P726 HydrophobicContact CD2-CB 3.99Å; Y717-P726 HydrophobicContact CG-CB 4.49Å; Y718-P726 HydrophobicContact CD1-CG 3.61Å; Y718-P726 HydrophobicContact CE1-CG 3.43Å; Y718-P726 VanDerWaalsContact CE1-CG 3.45Å; P726-K730 VanDerWaalsContact O-CB 3.25Å; P726-K730 WeakPolarHBondContact O-CB 3.41Å; P726-K730 WeakPolarHBondContact O-CD 3.35Å; P726-K730 WeakPolarHBondContact O-CG 3.39Å; P726-K730 PolarHBondContact O-N 3.04Å; P726-K730 VanDerWaalsContact O-N 3.12Å
727	K	83.1	Confident	82.6	Confident	119 Å²	119	32.8 Å²	32.8	52%	0.517	16%	0.156	S	C	.	.	H	α-helix	trans	-70.3	-39.4	177.5	-59.3	179.2	-178.3	176.1	0	111.5	I724 F725 H731	I724-K727 WeakPolarHBondContact O-CB 3.25Å; I724-K727 PolarHBondContact O-N 3.02Å; F725-K727 PolarHBondContact O-N 3.12Å; F725-K727 VanDerWaalsContact O-N 3.14Å; K727-H731 VanDerWaalsContact O-CB 3.29Å; K727-H731 WeakPolarHBondContact O-CB 3.43Å; K727-H731 PolarHBondContact O-N 3.27Å
728	V	85.9	Confident	83	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-74.5	-43.3	-178.2	-177.2	0	0	0	0	111.6	I724 F725 H731 H732 C790 L791	I724-V728 HydrophobicContact CG2-CG2 3.77Å; I724-V728 PolarHBondContact O-N 2.88Å; F725-V728 PolarHBondContact O-N 3.05Å; V728-H731 PolarHBondContact O-N 3.22Å; V728-H732 PolarHBondContact O-CD2 3.25Å; V728-H732 VanDerWaalsContact O-CD2 3.26Å; V728-H732 PolarHBondContact O-N 3.15Å; V728-H732 VanDerWaalsContact O-N 3.07Å; V728-C790 HydrophobicContact CG1-CB 4.11Å; V728-C790 WeakPolarHBondContact CG1-O 3.3Å; V728-L791 HydrophobicContact CG1-CB 4.46Å; V728-L791 HydrophobicContact CG1-CD1 4.4Å
729	V	88.3	Confident	83.7	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-59.9	-49.3	174.1	173.4	0	0	0	0	110.4	L677 L681 M709 Y717 F725 H731 H732 A733	L677-V729 HydrophobicContact CD2-CG1 3.85Å; L677-V729 HydrophobicContact CD2-CG2 4.12Å; L677-V729 HydrophobicContact CG-CG1 4.44Å; L677-V729 HydrophobicContact CG-CG2 4.43Å; L681-V729 HydrophobicContact CD1-CG1 3.96Å; M709-V729 HydrophobicContact CB-CG1 4.47Å; Y717-V729 HydrophobicContact CD1-CG2 4.3Å; Y717-V729 HydrophobicContact CE1-CG1 3.96Å; Y717-V729 HydrophobicContact CE1-CG2 4.46Å; Y717-V729 HydrophobicContact CE2-CB 4.48Å; Y717-V729 HydrophobicContact CE2-CG1 4.1Å; F725-V729 WeakPolarHBondContact O-CG2 3.36Å; F725-V729 PolarHBondContact O-N 2.92Å; V729-H731 VanDerWaalsContact C-N 3.34Å; V729-H731 PolarHBondContact O-N 3.26Å; V729-H732 PolarHBondContact O-N 3.3Å; V729-A733 WeakPolarHBondContact O-CB 3.38Å; V729-A733 PolarHBondContact O-N 3.18Å
730	K	88.2	Confident	84.6	Confident	26 Å²	26	26.8 Å²	26.8	11%	0.113	13%	0.13	C	C	.	.	H	α-helix	trans	-62	-38.8	177.3	-74.8	175	178.8	176	0	112.9	M709 L710 D714 P726 A734 V750	M709-K730 WeakPolarHBondContact O-CG 3.46Å; L710-K730 HydrophobicContact CD2-CB 4.01Å; L710-K730 HydrophobicContact CD2-CG 4.15Å; L710-K730 WeakPolarHBondContact CD2-O 3.36Å; D714-K730 VanDerWaalsContact OD1-CE 3.28Å; D714-K730 WeakPolarHBondContact OD1-CE 3.32Å; D714-K730 IonicContact OD1-NZ 3.52Å; D714-K730 PolarHBondContact OD1-NZ 3.07Å; D714-K730 IonicContact OD2-NZ 3.42Å; D714-K730 PolarHBondContact OD2-NZ 3.16Å; P726-K730 VanDerWaalsContact O-CB 3.25Å; P726-K730 WeakPolarHBondContact O-CB 3.41Å; P726-K730 WeakPolarHBondContact O-CD 3.35Å; P726-K730 WeakPolarHBondContact O-CG 3.39Å; P726-K730 PolarHBondContact O-N 3.04Å; P726-K730 VanDerWaalsContact O-N 3.12Å; K730-A734 WeakPolarHBondContact O-CB 3.22Å; K730-A734 PolarHBondContact O-N 2.89Å; K730-V750 HydrophobicContact CB-CG2 3.94Å
731	H	88.2	Confident	85.5	Confident	13.6667 Å²	13.6667	19.4 Å²	19.4	6%	0.063	10%	0.095	C	C	.	.	H	α-helix	trans	-59.4	-51.7	174.5	176.1	87.5	0	0	0	111.8	K727 V728 V729 A734 R735 L752	K727-H731 VanDerWaalsContact O-CB 3.29Å; K727-H731 WeakPolarHBondContact O-CB 3.43Å; K727-H731 PolarHBondContact O-N 3.27Å; V728-H731 PolarHBondContact O-N 3.22Å; V729-H731 VanDerWaalsContact C-N 3.34Å; V729-H731 PolarHBondContact O-N 3.26Å; H731-A734 PolarHBondContact O-N 3.45Å; H731-R735 WeakPolarHBondContact O-CB 3.41Å; H731-R735 PolarHBondContact O-N 3.11Å; H731-L752 PolarHBondContact CE1-O 3.09Å
732	H	89.6	Confident	86.2	Confident	0 Å²	0	21.3 Å²	21.3	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-68.9	-35.4	179.4	-65.9	-58.3	0	0	0	113.2	L681 Q682 V728 V729 R735 I736 C790	L681-H732 HydrophobicContact CB-CB 3.77Å; L681-H732 HydrophobicContact CD1-CB 4.33Å; Q682-H732 VanDerWaalsContact CG-CE1 3.48Å; Q682-H732 WeakPolarHBondContact CG-CE1 3.38Å; Q682-H732 WeakPolarHBondContact CG-NE2 3.45Å; V728-H732 PolarHBondContact O-CD2 3.25Å; V728-H732 VanDerWaalsContact O-CD2 3.26Å; V728-H732 PolarHBondContact O-N 3.15Å; V728-H732 VanDerWaalsContact O-N 3.07Å; V729-H732 PolarHBondContact O-N 3.3Å; H732-R735 WeakPolarHBondContact O-CB 3.4Å; H732-R735 PolarHBondContact O-N 3.27Å; H732-I736 WeakPolarHBondContact O-CD1 3.31Å; H732-I736 VanDerWaalsContact O-CG1 3.31Å; H732-I736 WeakPolarHBondContact O-CG1 3.33Å; H732-I736 PolarHBondContact O-N 3.11Å; H732-C790 PolarHBondContact NE2-O 2.87Å
733	A	90.9	Very high	86.6	Confident	0 Å²	0	22.1 Å²	22.1	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-63	-44.3	175.3	0	0	0	0	0	112	L706 M709 L710 V729 R735 I736 L737	L706-A733 HydrophobicContact CD2-CB 4.16Å; M709-A733 HydrophobicContact CB-CB 4.1Å; L710-A733 HydrophobicContact CD2-CB 4.06Å; L710-A733 HydrophobicContact CG-CB 4.27Å; V729-A733 WeakPolarHBondContact O-CB 3.38Å; V729-A733 PolarHBondContact O-N 3.18Å; A733-R735 VanDerWaalsContact C-N 3.33Å; A733-R735 PolarHBondContact O-N 3.15Å; A733-I736 PolarHBondContact O-N 2.98Å; A733-L737 WeakPolarHBondContact O-CG 3.21Å; A733-L737 PolarHBondContact O-N 3.06Å; A733-L737 VanDerWaalsContact O-N 3.16Å
734	A	90.2	Very high	86.6	Confident	0 Å²	0	22.3 Å²	22.3	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-61.5	-41.8	172.3	0	0	0	0	0	112	L710 K730 H731 I736 L737 I738 V746 V750 L752	L710-A734 HydrophobicContact CD1-CB 4.47Å; L710-A734 HydrophobicContact CD2-CB 4.34Å; K730-A734 WeakPolarHBondContact O-CB 3.22Å; K730-A734 PolarHBondContact O-N 2.89Å; H731-A734 PolarHBondContact O-N 3.45Å; A734-I736 PolarHBondContact O-N 2.83Å; A734-L737 PolarHBondContact O-N 3.13Å; A734-I738 WeakPolarHBondContact O-CD1 3.46Å; A734-I738 WeakPolarHBondContact O-CG1 3.43Å; A734-I738 PolarHBondContact O-N 3.34Å; A734-V746 HydrophobicContact CB-CG1 3.72Å; A734-V746 HydrophobicContact CB-CG2 4Å; A734-V750 HydrophobicContact CB-CB 3.84Å; A734-V750 HydrophobicContact CB-CG1 3.79Å; A734-V750 HydrophobicContact CB-CG2 4.38Å; A734-L752 HydrophobicContact CB-CD2 4.05Å
735	R	90.4	Very high	86.6	Confident	20.6667 Å²	20.6667	23.6 Å²	23.6	8%	0.078	11%	0.114	C	C	.	.	H	α-helix	trans	-57.2	-50.1	179.1	-166.1	-178.3	-166.6	-172.6	9.7	111.7	H731 H732 A733 L737 I738 Y739 L752 S792 E808	H731-R735 WeakPolarHBondContact O-CB 3.41Å; H731-R735 PolarHBondContact O-N 3.11Å; H732-R735 WeakPolarHBondContact O-CB 3.4Å; H732-R735 PolarHBondContact O-N 3.27Å; A733-R735 VanDerWaalsContact C-N 3.33Å; A733-R735 PolarHBondContact O-N 3.15Å; R735-L737 PolarHBondContact O-N 2.99Å; R735-I738 PolarHBondContact O-N 3.23Å; R735-Y739 HydrophobicContact CG-CD1 4.22Å; R735-Y739 HydrophobicContact CG-CE1 3.75Å; R735-Y739 HydrophobicContact CG-CE2 4.35Å; R735-Y739 PolarHBondContact NE-OH 3.12Å; R735-Y739 VanDerWaalsContact NE-OH 3.13Å; R735-Y739 PolarHBondContact NH2-OH 3.31Å; R735-Y739 WeakPolarHBondContact O-CB 3.35Å; R735-Y739 WeakPolarHBondContact O-CD1 3.27Å; R735-Y739 VanDerWaalsContact O-CG 3.29Å; R735-Y739 PolarHBondContact O-N 3.25Å; R735-L752 HydrophobicContact CB-CD1 4.48Å; R735-L752 HydrophobicContact CB-CD2 3.93Å; R735-L752 HydrophobicContact CG-CD1 4.42Å; R735-L752 HydrophobicContact CG-CD2 4.49Å; R735-S792 PolarHBondContact NH1-OG 3.37Å; R735-S792 VanDerWaalsContact NH1-OG 3.1Å; R735-E808 WeakPolarHBondContact CG-OE1 3.41Å; R735-E808 IonicContact CZ-OE1 3.1Å; R735-E808 IonicContact CZ-OE2 3.09Å; R735-E808 IonicContact NE-OE1 2.85Å; R735-E808 PolarHBondContact NE-OE1 3.1Å; R735-E808 IonicContact NE-OE2 3.06Å; R735-E808 IonicContact NH2-OE1 3.22Å; R735-E808 PolarHBondContact NH2-OE1 3.12Å; R735-E808 VanDerWaalsContact NH2-OE1 3.17Å; R735-E808 IonicContact NH2-OE2 3.29Å; R735-E808 PolarHBondContact NH2-OE2 3.02Å
736	I	90.6	Very high	86.4	Confident	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-63.1	-44.3	178.6	-60.3	158	0	0	0	110.9	L681 V684 A685 A688 L706 H732 A733 A734 I738 Y739 I740	L681-I736 HydrophobicContact CB-CD1 4.26Å; L681-I736 HydrophobicContact CD2-CD1 3.68Å; V684-I736 HydrophobicContact CB-CD1 4.13Å; V684-I736 HydrophobicContact CG1-CD1 3.97Å; V684-I736 HydrophobicContact CG1-CG1 4.34Å; V684-I736 HydrophobicContact CG1-CG2 4.05Å; A685-I736 HydrophobicContact CB-CG1 3.87Å; A688-I736 HydrophobicContact CB-CG2 4.5Å; L706-I736 HydrophobicContact CD1-CB 3.84Å; L706-I736 HydrophobicContact CD1-CD1 4.42Å; L706-I736 HydrophobicContact CD1-CG2 3.49Å; L706-I736 VanDerWaalsContact CD1-CG2 3.48Å; L706-I736 HydrophobicContact CD2-CD1 4.1Å; H732-I736 WeakPolarHBondContact O-CD1 3.31Å; H732-I736 VanDerWaalsContact O-CG1 3.31Å; H732-I736 WeakPolarHBondContact O-CG1 3.33Å; H732-I736 PolarHBondContact O-N 3.11Å; A733-I736 PolarHBondContact O-N 2.98Å; A734-I736 PolarHBondContact O-N 2.83Å; I736-I738 VanDerWaalsContact C-N 3.33Å; I736-I738 PolarHBondContact O-N 3.28Å; I736-Y739 PolarHBondContact O-N 3.26Å; I736-I740 HydrophobicContact CG2-CD1 3.6Å; I736-I740 HydrophobicContact CG2-CG1 4.26Å; I736-I740 HydrophobicContact CG2-CG2 4.3Å; I736-I740 WeakPolarHBondContact O-CB 3.36Å; I736-I740 VanDerWaalsContact O-CG1 3.29Å; I736-I740 WeakPolarHBondContact O-CG1 3.29Å; I736-I740 PolarHBondContact O-N 3.17Å
737	L	89.9	Confident	86	Confident	0 Å²	0	25 Å²	25	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-58.3	-44.4	177	-78	165.3	0	0	0	112.3	D703 L706 V707 L710 A733 A734 R735 I740 G741 R742 G743 V746	D703-L737 HydrophobicContact CB-CD2 3.73Å; L706-L737 HydrophobicContact CB-CD1 3.92Å; L706-L737 HydrophobicContact CB-CD2 4.08Å; L706-L737 HydrophobicContact CB-CG 3.83Å; L706-L737 HydrophobicContact CD1-CD2 4.29Å; L706-L737 HydrophobicContact CD1-CG 4.06Å; V707-L737 HydrophobicContact CG2-CD1 4Å; V707-L737 HydrophobicContact CG2-CD2 4.32Å; L710-L737 HydrophobicContact CD1-CD1 3.5Å; L710-L737 VanDerWaalsContact CD1-CD1 3.5Å; L710-L737 HydrophobicContact CG-CD1 4.39Å; A733-L737 WeakPolarHBondContact O-CG 3.21Å; A733-L737 PolarHBondContact O-N 3.06Å; A733-L737 VanDerWaalsContact O-N 3.16Å; A734-L737 PolarHBondContact O-N 3.13Å; R735-L737 PolarHBondContact O-N 2.99Å; L737-I740 HydrophobicContact CD2-CD1 4.5Å; L737-I740 WeakPolarHBondContact O-CG1 3.4Å; L737-G741 PolarHBondContact O-N 3.06Å; L737-G741 VanDerWaalsContact O-N 3.1Å; L737-R742 HydrophobicContact CD2-CB 3.87Å; L737-R742 CarbonylContact O-C 3.55Å; L737-R742 WeakPolarHBondContact O-CA 3.18Å; L737-R742 PolarHBondContact O-N 3.12Å; L737-G743 PolarHBondContact O-N 3Å; L737-V746 HydrophobicContact CB-CG2 3.87Å; L737-V746 HydrophobicContact CD1-CG2 3.96Å
738	I	88.3	Confident	85.6	Confident	2.33333 Å²	2.33333	23.5 Å²	23.5	1%	0.012	13%	0.126	C	C	.	.	H	α-helix	trans	-67.7	-42.5	178.1	-68.1	156.8	0	0	0	110.6	A734 R735 I736 I740 G741 V746 L752 R848 L849 H852	A734-I738 WeakPolarHBondContact O-CD1 3.46Å; A734-I738 WeakPolarHBondContact O-CG1 3.43Å; A734-I738 PolarHBondContact O-N 3.34Å; R735-I738 PolarHBondContact O-N 3.23Å; I736-I738 VanDerWaalsContact C-N 3.33Å; I736-I738 PolarHBondContact O-N 3.28Å; I738-I740 PolarHBondContact O-N 3.05Å; I738-G741 PolarHBondContact O-N 3.22Å; I738-V746 HydrophobicContact CD1-CG2 4.26Å; I738-V746 HydrophobicContact CG1-CG2 4.15Å; I738-L752 HydrophobicContact CB-CD1 4.46Å; I738-L752 HydrophobicContact CD1-CD1 3.57Å; I738-L752 HydrophobicContact CD1-CD2 4.38Å; I738-L752 HydrophobicContact CD1-CG 3.83Å; I738-L752 HydrophobicContact CG2-CD1 4.5Å; I738-R848 HydrophobicContact CG2-CB 4.39Å; I738-L849 HydrophobicContact CG2-CD2 4Å; I738-H852 HydrophobicContact CD1-CB 4.08Å; I738-H852 VanDerWaalsContact CD1-CD2 3.45Å; I738-H852 WeakPolarHBondContact CD1-CD2 3.31Å; I738-H852 VanDerWaalsContact CD1-CG 3.43Å; I738-H852 HydrophobicContact CG1-CB 4.4Å; I738-H852 HydrophobicContact CG2-CB 4.23Å
739	Y	89.6	Confident	85.2	Confident	2.66667 Å²	2.66667	28.7 Å²	28.7	1%	0.01	15%	0.146	C	C	.	.	H	α-helix	trans	-58.9	-49.1	176.6	-76.7	19.1	0	0	0	111.7	A685 A688 L689 R694 R735 I736 G741 E808 L845 R848 L849	A685-Y739 WeakPolarHBondContact O-CE2 3.33Å; A688-Y739 HydrophobicContact CB-CD2 3.99Å; L689-Y739 HydrophobicContact CD2-CD2 4.14Å; L689-Y739 HydrophobicContact CD2-CE2 3.39Å; L689-Y739 VanDerWaalsContact CD2-CE2 3.43Å; L689-Y739 HydrophobicContact CG-CE2 3.99Å; R694-Y739 WeakPolarHBondContact CD-O 3.47Å; R735-Y739 HydrophobicContact CG-CD1 4.22Å; R735-Y739 HydrophobicContact CG-CE1 3.75Å; R735-Y739 HydrophobicContact CG-CE2 4.35Å; R735-Y739 PolarHBondContact NE-OH 3.12Å; R735-Y739 VanDerWaalsContact NE-OH 3.13Å; R735-Y739 PolarHBondContact NH2-OH 3.31Å; R735-Y739 WeakPolarHBondContact O-CB 3.35Å; R735-Y739 WeakPolarHBondContact O-CD1 3.27Å; R735-Y739 VanDerWaalsContact O-CG 3.29Å; R735-Y739 PolarHBondContact O-N 3.25Å; I736-Y739 PolarHBondContact O-N 3.26Å; Y739-G741 VanDerWaalsContact C-N 3.28Å; Y739-G741 PolarHBondContact O-N 3.09Å; Y739-E808 WeakPolarHBondContact CE1-OE1 3.31Å; Y739-E808 VanDerWaalsContact CZ-OE1 3.23Å; Y739-E808 PolarHBondContact OH-OE1 3.15Å; Y739-E808 PolarHBondContact OH-OE2 3.19Å; Y739-L845 HydrophobicContact CD1-CD1 3.54Å; Y739-L845 HydrophobicContact CD2-CD1 4.33Å; Y739-L845 HydrophobicContact CE1-CD1 4Å; Y739-L845 HydrophobicContact CG-CD1 3.71Å; Y739-R848 PolarHBondContact O-NH1 3.02Å; Y739-L849 HydrophobicContact CE1-CD1 4.45Å; Y739-L849 HydrophobicContact CE1-CD2 4.32Å
740	I	87.2	Confident	84.9	Confident	6.66667 Å²	6.66667	29.6 Å²	29.6	3%	0.034	15%	0.151	C	C	.	.	H	α-helix	trans	-65.6	-27.5	179.6	-38.9	171.6	0	0	0	112.5	R694 L697 R698 D703 I736 L737 I738 R742 R848	R694-I740 HydrophobicContact CG-CG2 4.43Å; L697-I740 HydrophobicContact CB-CD1 3.64Å; L697-I740 HydrophobicContact CB-CG1 4.03Å; L697-I740 HydrophobicContact CB-CG2 3.91Å; L697-I740 HydrophobicContact CD1-CD1 4.19Å; L697-I740 HydrophobicContact CD1-CG1 4.3Å; L697-I740 HydrophobicContact CD1-CG2 4.08Å; L697-I740 HydrophobicContact CG-CD1 4.48Å; R698-I740 HydrophobicContact CB-CG2 3.9Å; D703-I740 HydrophobicContact CB-CD1 4.31Å; I736-I740 HydrophobicContact CG2-CD1 3.6Å; I736-I740 HydrophobicContact CG2-CG1 4.26Å; I736-I740 HydrophobicContact CG2-CG2 4.3Å; I736-I740 WeakPolarHBondContact O-CB 3.36Å; I736-I740 VanDerWaalsContact O-CG1 3.29Å; I736-I740 WeakPolarHBondContact O-CG1 3.29Å; I736-I740 PolarHBondContact O-N 3.17Å; L737-I740 HydrophobicContact CD2-CD1 4.5Å; L737-I740 WeakPolarHBondContact O-CG1 3.4Å; I738-I740 PolarHBondContact O-N 3.05Å; I740-R742 HydrophobicContact CD1-CB 4.25Å; I740-R742 HydrophobicContact CD1-CG 4.03Å; I740-R742 HydrophobicContact CG1-CB 4.14Å; I740-R742 HydrophobicContact CG1-CG 4.12Å; I740-R742 HydrophobicContact CG2-CG 4.5Å; I740-R848 PolarHBondContact O-NH1 3.45Å
741	G	82.3	Confident	84.6	Confident	17.3333 Å²	17.3333	29.1 Å²	29.1	18%	0.179	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	102.6	28.7	-177.5	0	0	0	0	0	114	L737 I738 Y739 R848	L737-G741 PolarHBondContact O-N 3.06Å; L737-G741 VanDerWaalsContact O-N 3.1Å; I738-G741 PolarHBondContact O-N 3.22Å; Y739-G741 VanDerWaalsContact C-N 3.28Å; Y739-G741 PolarHBondContact O-N 3.09Å; G741-R848 VanDerWaalsContact CA-CZ 3.47Å
742	R	83.7	Confident	84.3	Confident	92 Å²	92	28.4 Å²	28.4	35%	0.347	15%	0.147	S	C	.	.			trans	-113.9	26.5	172.8	-67.6	-63.7	-145.2	-153.9	2.1	111.8	D703 L737 I740 H744 M745	D703-R742 HydrophobicContact CB-CB 4.35Å; D703-R742 HydrophobicContact CB-CG 4Å; D703-R742 IonicContact OD2-CZ 3.23Å; D703-R742 IonicContact OD2-NE 3.17Å; D703-R742 PolarHBondContact OD2-NE 3.12Å; D703-R742 IonicContact OD2-NH2 3.31Å; D703-R742 PolarHBondContact OD2-NH2 3.12Å; D703-R742 VanDerWaalsContact OD2-NH2 3.08Å; L737-R742 HydrophobicContact CD2-CB 3.87Å; L737-R742 CarbonylContact O-C 3.55Å; L737-R742 WeakPolarHBondContact O-CA 3.18Å; L737-R742 PolarHBondContact O-N 3.12Å; I740-R742 HydrophobicContact CD1-CB 4.25Å; I740-R742 HydrophobicContact CD1-CG 4.03Å; I740-R742 HydrophobicContact CG1-CB 4.14Å; I740-R742 HydrophobicContact CG1-CG 4.12Å; I740-R742 HydrophobicContact CG2-CG 4.5Å; R742-H744 PolarHBondContact O-N 2.79Å; R742-H744 VanDerWaalsContact O-N 3.14Å; R742-M745 HydrophobicContact CB-CG 4.26Å; R742-M745 HydrophobicContact CB-SD 3.96Å; R742-M745 HydrophobicContact CG-SD 4.28Å; R742-M745 WeakPolarHBondContact O-CB 3.29Å; R742-M745 WeakPolarHBondContact O-CG 3.22Å; R742-M745 PolarHBondContact O-N 3.06Å
743	G	81.5	Confident	83.7	Confident	21 Å²	21	29.4 Å²	29.4	22%	0.216	15%	0.151	C	C	.	.	G	3₁₀ helix	trans	-55.8	-30.6	-175.7	0	0	0	0	0	114.2	L737 M745 V746	L737-G743 PolarHBondContact O-N 3Å; G743-M745 PolarHBondContact O-N 3.2Å; G743-M745 VanDerWaalsContact O-N 3.12Å; G743-V746 WeakPolarHBondContact O-CB 3.31Å; G743-V746 PolarHBondContact O-N 3.04Å
744	H	77.8	Confident	82.7	Confident	117 Å²	117	33.9 Å²	33.9	54%	0.542	18%	0.179	S	C	.	.	G	3₁₀ helix	trans	-58.9	-22.6	173.7	60	-105.6	0	0	0	114	R742 V746 E1200	R742-H744 PolarHBondContact O-N 2.79Å; R742-H744 VanDerWaalsContact O-N 3.14Å; H744-V746 VanDerWaalsContact C-N 3.34Å; H744-E1200 IonicContact CE1-OE1 3.36Å; H744-E1200 IonicContact CG-OE1 3.04Å; H744-E1200 IonicContact ND1-OE1 3.74Å; H744-E1200 PolarHBondContact ND1-OE1 3.41Å
745	M	82.2	Confident	81.3	Confident	55 Å²	55	35.6 Å²	35.6	27%	0.271	19%	0.19	S	C	.	.	G	3₁₀ helix	trans	-78.9	-17.5	176.5	-51.9	-175.4	87.5	0	0	113.1	D703 V707 R742 G743	D703-M745 HydrophobicContact CB-SD 3.95Å; V707-M745 HydrophobicContact CG2-CB 3.68Å; V707-M745 HydrophobicContact CG2-CE 4.03Å; V707-M745 HydrophobicContact CG2-CG 4.47Å; V707-M745 HydrophobicContact CG2-SD 4.17Å; R742-M745 HydrophobicContact CB-CG 4.26Å; R742-M745 HydrophobicContact CB-SD 3.96Å; R742-M745 HydrophobicContact CG-SD 4.28Å; R742-M745 WeakPolarHBondContact O-CB 3.29Å; R742-M745 WeakPolarHBondContact O-CG 3.22Å; R742-M745 PolarHBondContact O-N 3.06Å; G743-M745 PolarHBondContact O-N 3.2Å; G743-M745 VanDerWaalsContact O-N 3.12Å
746	V	83.1	Confident	79.6	Confident	1 Å²	1	35.9 Å²	35.9	1%	0.006	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-44.8	171.8	-174.6	0	0	0	0	109.9	L710 A734 L737 I738 G743 H744 R749 V750	L710-V746 HydrophobicContact CD1-CB 4.26Å; L710-V746 HydrophobicContact CD1-CG1 4.16Å; L710-V746 HydrophobicContact CD1-CG2 4Å; A734-V746 HydrophobicContact CB-CG1 3.72Å; A734-V746 HydrophobicContact CB-CG2 4Å; L737-V746 HydrophobicContact CB-CG2 3.87Å; L737-V746 HydrophobicContact CD1-CG2 3.96Å; I738-V746 HydrophobicContact CD1-CG2 4.26Å; I738-V746 HydrophobicContact CG1-CG2 4.15Å; G743-V746 WeakPolarHBondContact O-CB 3.31Å; G743-V746 PolarHBondContact O-N 3.04Å; H744-V746 VanDerWaalsContact C-N 3.34Å; V746-R749 VanDerWaalsContact O-CB 3.27Å; V746-R749 WeakPolarHBondContact O-CB 3.45Å; V746-R749 WeakPolarHBondContact O-CD 3.36Å; V746-R749 VanDerWaalsContact O-CG 3.24Å; V746-R749 WeakPolarHBondContact O-CG 3.39Å; V746-R749 PolarHBondContact O-N 3.27Å; V746-V750 HydrophobicContact CG1-CB 4.02Å
747	G	74.3	Confident	77.4	Confident	29.6667 Å²	29.6667	41.6 Å²	41.6	31%	0.306	23%	0.225	S	C	.	.	G	3₁₀ helix	trans	51.1	-148	-173.7	0	0	0	0	0	112.4	R749	G747-R749 PolarHBondContact O-N 3.12Å; G747-R749 VanDerWaalsContact O-N 3.16Å
748	N	74.7	Confident	75.4	Confident	89.3333 Å²	89.3333	44.3 Å²	44.3	48%	0.478	24%	0.242	S	C	.	.	G	3₁₀ helix	trans	-81.4	25.5	-178.3	-56	12.8	0	0	0	112.8	W856	N748-W856 VanDerWaalsContact C-CZ3 3.45Å; N748-W856 HydrophobicContact CB-CZ3 4.44Å; N748-W856 WeakPolarHBondContact O-CH2 3.26Å; N748-W856 WeakPolarHBondContact O-CZ3 3.46Å
749	R	78.6	Confident	73	Confident	109.333 Å²	109.333	48 Å²	48	41%	0.413	27%	0.272	S	S	.	.	G	3₁₀ helix	trans	-85.8	-36.4	-178	-61.3	179.9	-177.5	-166.1	6.3	113.7	L710 V746 G747	L710-R749 WeakPolarHBondContact O-CD 3.38Å; L710-R749 PolarHBondContact O-NH1 3.21Å; V746-R749 VanDerWaalsContact O-CB 3.27Å; V746-R749 WeakPolarHBondContact O-CB 3.45Å; V746-R749 WeakPolarHBondContact O-CD 3.36Å; V746-R749 VanDerWaalsContact O-CG 3.24Å; V746-R749 WeakPolarHBondContact O-CG 3.39Å; V746-R749 PolarHBondContact O-N 3.27Å; G747-R749 PolarHBondContact O-N 3.12Å; G747-R749 VanDerWaalsContact O-N 3.16Å
750	V	81.6	Confident	70.4	Confident	18 Å²	18	54.2 Å²	54.2	11%	0.109	31%	0.306	C	S	.	.			trans	-145.1	133.9	-174.3	-176.2	0	0	0	0	109.9	L710 K730 A734 V746 H852 W856	L710-V750 HydrophobicContact CD2-CG2 3.72Å; K730-V750 HydrophobicContact CB-CG2 3.94Å; A734-V750 HydrophobicContact CB-CB 3.84Å; A734-V750 HydrophobicContact CB-CG1 3.79Å; A734-V750 HydrophobicContact CB-CG2 4.38Å; V746-V750 HydrophobicContact CG1-CB 4.02Å; V750-H852 PolarHBondContact O-CE1 3.11Å; V750-H852 VanDerWaalsContact O-CE1 3.29Å; V750-H852 PolarHBondContact O-NE2 3.15Å; V750-W856 VanDerWaalsContact C-CZ3 3.42Å; V750-W856 VanDerWaalsContact O-CZ3 3.31Å; V750-W856 WeakPolarHBondContact O-CZ3 3.29Å
751	N	81.4	Confident	68.2	Low	15 Å²	15	57.9 Å²	57.9	8%	0.08	33%	0.325	C	S	.	.			trans	-106.1	131.3	170.6	-175.4	-11.6	0	0	0	109.5	F753 T754 W856	N751-F753 VanDerWaalsContact C-N 3.33Å; N751-F753 WeakPolarHBondContact OD1-CA 3.48Å; N751-F753 WeakPolarHBondContact OD1-CB 3.32Å; N751-F753 VanDerWaalsContact OD1-CD2 3.3Å; N751-F753 WeakPolarHBondContact OD1-CD2 3.35Å; N751-F753 PolarHBondContact OD1-N 3.15Å; N751-T754 WeakPolarHBondContact CB-OG1 3.46Å; N751-T754 PolarHBondContact O-OG1 3.17Å; N751-W856 HydrophobicContact CB-CD2 3.64Å; N751-W856 HydrophobicContact CB-CE3 3.84Å; N751-W856 HydrophobicContact CB-CG 4.24Å; N751-W856 HydrophobicContact CB-CH2 4.01Å; N751-W856 HydrophobicContact CB-CZ2 3.81Å; N751-W856 HydrophobicContact CB-CZ3 4.01Å; N751-W856 PolarHBondContact ND2-NE1 3.08Å; N751-W856 VanDerWaalsContact ND2-NE1 3.17Å
752	L	82.5	Confident	66	Low	0 Å²	0	61.7 Å²	61.7	0%	0	35%	0.345	C	S	.	.	S	Bend	trans	-75.5	-26.2	176.3	-61.6	-173.9	0	0	0	112.8	H731 A734 R735 I738 Q794 E808 L849 H852	H731-L752 PolarHBondContact CE1-O 3.09Å; A734-L752 HydrophobicContact CB-CD2 4.05Å; R735-L752 HydrophobicContact CB-CD1 4.48Å; R735-L752 HydrophobicContact CB-CD2 3.93Å; R735-L752 HydrophobicContact CG-CD1 4.42Å; R735-L752 HydrophobicContact CG-CD2 4.49Å; I738-L752 HydrophobicContact CB-CD1 4.46Å; I738-L752 HydrophobicContact CD1-CD1 3.57Å; I738-L752 HydrophobicContact CD1-CD2 4.38Å; I738-L752 HydrophobicContact CD1-CG 3.83Å; I738-L752 HydrophobicContact CG2-CD1 4.5Å; L752-Q794 PolarHBondContact O-NE2 3.31Å; L752-Q794 VanDerWaalsContact O-NE2 3.14Å; L752-E808 HydrophobicContact CB-CG 4.43Å; L752-E808 HydrophobicContact CD1-CG 4.37Å; L752-L849 HydrophobicContact CD1-CD2 3.72Å; L752-H852 PolarHBondContact N-NE2 3.19Å
753	F	78	Confident	63.6	Low	20 Å²	20	63.8 Å²	63.8	9%	0.088	36%	0.363	C	S	.	.	S	Bend	trans	-86.4	-28.9	-170.3	-54.8	-71.9	0	0	0	112.5	N751 C755 Q794 E808 L811 M812 L849 H852 K853	N751-F753 VanDerWaalsContact C-N 3.33Å; N751-F753 WeakPolarHBondContact OD1-CA 3.48Å; N751-F753 WeakPolarHBondContact OD1-CB 3.32Å; N751-F753 VanDerWaalsContact OD1-CD2 3.3Å; N751-F753 WeakPolarHBondContact OD1-CD2 3.35Å; N751-F753 PolarHBondContact OD1-N 3.15Å; F753-C755 VanDerWaalsContact C-N 3.32Å; F753-C755 PolarHBondContact O-N 3.03Å; F753-C755 VanDerWaalsContact O-N 3.1Å; F753-Q794 PolarHBondContact O-NE2 2.99Å; F753-E808 HydrophobicContact CD1-CB 4.37Å; F753-E808 HydrophobicContact CE1-CB 4.05Å; F753-E808 HydrophobicContact CE1-CG 4.3Å; F753-L811 HydrophobicContact CE1-CD2 4.07Å; F753-L811 HydrophobicContact CZ-CD2 3.94Å; F753-M812 HydrophobicContact CB-CG 4.42Å; F753-M812 HydrophobicContact CB-SD 4.04Å; F753-M812 HydrophobicContact CD1-CG 3.65Å; F753-M812 HydrophobicContact CD1-SD 3.61Å; F753-M812 VanDerWaalsContact CD1-SD 3.59Å; F753-M812 HydrophobicContact CE1-CG 4.33Å; F753-M812 HydrophobicContact CE1-SD 4.34Å; F753-M812 HydrophobicContact CG-CG 4.43Å; F753-M812 HydrophobicContact CG-SD 3.98Å; F753-L849 HydrophobicContact CZ-CB 4.42Å; F753-L849 HydrophobicContact CZ-CD2 4.36Å; F753-H852 AromaticContact CE2-CD2 3.82Å; F753-K853 HydrophobicContact CD2-CB 4.16Å; F753-K853 HydrophobicContact CD2-CD 3.8Å; F753-K853 HydrophobicContact CD2-CG 4.48Å; F753-K853 HydrophobicContact CE2-CB 3.59Å; F753-K853 HydrophobicContact CE2-CD 4.13Å; F753-K853 HydrophobicContact CE2-CG 4.35Å; F753-K853 HydrophobicContact CG-CD 4.22Å; F753-K853 HydrophobicContact CZ-CB 4.07Å
754	T	68.5	Low	61.1	Low	95 Å²	95	67.5 Å²	67.5	58%	0.583	39%	0.385	S	S	*	.	S	Bend	trans	-79	84.5	168.6	54.7	0	0	0	0	110.8	N751	N751-T754 WeakPolarHBondContact CB-OG1 3.46Å; N751-T754 PolarHBondContact O-OG1 3.17Å
755	C	60.1	Low	58.9	Low	35.3333 Å²	35.3333	66.9 Å²	66.9	24%	0.239	39%	0.394	C	S	.	.			trans	-62.1	130.8	174.4	-169.6	0	0	0	0	110.8	F753 N757	F753-C755 VanDerWaalsContact C-N 3.32Å; F753-C755 PolarHBondContact O-N 3.03Å; F753-C755 VanDerWaalsContact O-N 3.1Å; C755-N757 PolarHBondContact O-N 3.38Å
756	P	55	Low	56.5	Low	27.3333 Å²	27.3333	69.5 Å²	69.5	18%	0.177	41%	0.414	C	S	.	.	S	Bend	trans	-69	98.6	-178.1	26	-33.8	0	0	0	112.7	V758 L787 L791	P756-V758 VanDerWaalsContact C-N 3.31Å; P756-V758 PolarHBondContact O-N 3.01Å; P756-V758 VanDerWaalsContact O-N 3.13Å; P756-L787 HydrophobicContact CG-CD2 4.31Å; P756-L791 HydrophobicContact CG-CD1 4.23Å; P756-L791 HydrophobicContact CG-CD2 3.8Å
757	N	44.7	Very low	54	Low	120.333 Å²	120.333	77 Å²	77	64%	0.643	45%	0.454	S	S	*	.	S	Bend	trans	54.4	23.8	164.8	-74	18.8	0	0	0	118.6	C755 A759	C755-N757 PolarHBondContact O-N 3.38Å; N757-A759 VanDerWaalsContact C-N 3.26Å; N757-A759 PolarHBondContact O-N 3.4Å
758	V	47.5	Very low	52	Low	57 Å²	57	81.2 Å²	81.2	35%	0.345	48%	0.478	S	S	.	.			trans	-70.3	-32.5	168.2	-178.4	0	0	0	0	111.9	P756 N760 L761 L791	P756-V758 VanDerWaalsContact C-N 3.31Å; P756-V758 PolarHBondContact O-N 3.01Å; P756-V758 VanDerWaalsContact O-N 3.13Å; V758-N760 VanDerWaalsContact C-N 3.3Å; V758-N760 PolarHBondContact O-N 3.09Å; V758-N760 VanDerWaalsContact O-N 3.14Å; V758-L761 PolarHBondContact O-N 3.15Å; V758-L761 VanDerWaalsContact O-N 3.16Å; V758-L791 HydrophobicContact CG2-CD2 4.02Å
759	A	38	Very low	50.1	Low	79.3333 Å²	79.3333	82.7 Å²	82.7	66%	0.656	50%	0.495	S	S	*	.	G	3₁₀ helix	trans	-61	-34.3	-172.6	0	0	0	0	0	114.8	N757 L761	N757-A759 VanDerWaalsContact C-N 3.26Å; N757-A759 PolarHBondContact O-N 3.4Å; A759-L761 VanDerWaalsContact C-N 3.3Å; A759-L761 PolarHBondContact O-N 2.94Å; A759-L761 VanDerWaalsContact O-N 3.13Å
760	N	35.6	Very low	47.8	Very low	133.333 Å²	133.333	86.9 Å²	86.9	71%	0.713	52%	0.52	S	S	*	.	G	3₁₀ helix	trans	-84.4	0.9	-177.2	-67.2	23.6	0	0	0	113.8	V758 S764	V758-N760 VanDerWaalsContact C-N 3.3Å; V758-N760 PolarHBondContact O-N 3.09Å; V758-N760 VanDerWaalsContact O-N 3.14Å; N760-S764 PolarHBondContact O-OG 3.48Å
761	L	40.3	Very low	45.3	Very low	83.3333 Å²	83.3333	90.7 Å²	90.7	44%	0.436	55%	0.547	S	S	.	.	G	3₁₀ helix	trans	-101.3	1.4	-173.2	-84.3	164.5	0	0	0	114.6	V758 A759 R784	V758-L761 PolarHBondContact O-N 3.15Å; V758-L761 VanDerWaalsContact O-N 3.16Å; A759-L761 VanDerWaalsContact C-N 3.3Å; A759-L761 PolarHBondContact O-N 2.94Å; A759-L761 VanDerWaalsContact O-N 3.13Å; L761-R784 HydrophobicContact CD1-CG 4.29Å; L761-R784 HydrophobicContact CD2-CG 4.33Å
762	V	37.3	Very low	42.9	Very low	98.3333 Å²	98.3333	96.1 Å²	96.1	60%	0.596	58%	0.583	S	S	*	*	S	Bend	trans	-98.6	-44.7	-174.9	-176.8	0	0	0	0	112.3	S765	V762-S765 PolarHBondContact O-OG 3.36Å
763	D	32.4	Very low	40.5	Very low	135 Å²	135	103.4 Å²	103.4	72%	0.722	62%	0.621	S	S	*	*	S	Bend	trans	-96.1	-3.5	-167.6	-59.9	-41.3	0	0	0	115.4	S765	D763-S765 VanDerWaalsContact C-N 3.28Å; D763-S765 PolarHBondContact O-N 3.05Å; D763-S765 VanDerWaalsContact O-N 3.08Å
764	S	30	Very low	38.5	Very low	98 Å²	98	108 Å²	108	69%	0.685	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83	26.8	-176.3	62.7	0	0	0	0	114.5	N760	N760-S764 PolarHBondContact O-OG 3.48Å
765	S	31.4	Very low	36.9	Very low	104.667 Å²	104.667	113.2 Å²	113.2	73%	0.732	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.4	19.2	-175.8	64.8	0	0	0	0	114.8	V762 D763	V762-S765 PolarHBondContact O-OG 3.36Å; D763-S765 VanDerWaalsContact C-N 3.28Å; D763-S765 PolarHBondContact O-N 3.05Å; D763-S765 VanDerWaalsContact O-N 3.08Å
766	T	31.1	Very low	35.8	Very low	110.667 Å²	110.667	119.5 Å²	119.5	68%	0.679	69%	0.686	S	S	*	*	S	Bend	trans	-134.3	153.4	163	54.8	0	0	0	0	111.1
767	N	32.1	Very low	35.1	Very low	158 Å²	158	122.8 Å²	122.8	85%	0.845	70%	0.702	S	S	*	*	S	Bend	trans	69.7	110.6	177.9	-56.4	-25.9	0	0	0	117.3
768	S	30.9	Very low	35.2	Very low	117.667 Å²	117.667	125 Å²	125	82%	0.823	71%	0.708	S	S	*	*			trans	-60.5	119.8	170.4	54.8	0	0	0	0	115.6
769	S	34.5	Very low	35.7	Very low	120 Å²	120	125.8 Å²	125.8	84%	0.839	71%	0.71	S	S	*	*			trans	-164.6	129.3	139.2	45.3	0	0	0	0	110.2
770	E	30.5	Very low	37.2	Very low	199 Å²	199	125.8 Å²	125.8	93%	0.93	70%	0.696	S	S	*	*			trans	-82	138.3	-177.8	-60	-178.2	134.6	0	0	111.6
771	S	30	Very low	39	Very low	97.6667 Å²	97.6667	124.2 Å²	124.2	68%	0.683	69%	0.691	S	S	*	*			trans	-127.5	118.9	163.8	61.7	0	0	0	0	110.5	L773	S771-L773 PolarHBondContact O-N 3.09Å; S771-L773 VanDerWaalsContact O-N 3.16Å
772	P	30.5	Very low	40.6	Very low	128.667 Å²	128.667	120.9 Å²	120.9	84%	0.835	67%	0.674	S	S	*	*			trans	-88	62.3	-162.7	34.7	-37.7	0	0	0	114.1
773	L	32.7	Very low	42.6	Very low	152.667 Å²	152.667	117.8 Å²	117.8	80%	0.799	65%	0.654	S	S	*	*			trans	-119	5.4	178	-90.6	166.6	0	0	0	115.5	S771 K775	S771-L773 PolarHBondContact O-N 3.09Å; S771-L773 VanDerWaalsContact O-N 3.16Å; L773-K775 PolarHBondContact O-N 3.06Å
774	I	36.3	Very low	44.7	Very low	116.667 Å²	116.667	116.3 Å²	116.3	60%	0.598	64%	0.638	S	S	*	*			trans	-87.2	60.3	-177.6	-57.9	177.2	0	0	0	111.6	E776 L777	I774-E776 VanDerWaalsContact C-N 3.25Å; I774-E776 PolarHBondContact O-N 3.43Å; I774-L777 HydrophobicContact CG1-CD1 4.38Å; I774-L777 HydrophobicContact CG2-CB 4.12Å; I774-L777 HydrophobicContact CG2-CD1 4.25Å; I774-L777 HydrophobicContact CG2-CD2 3.97Å; I774-L777 HydrophobicContact CG2-CG 4.34Å
775	K	34.6	Very low	47.1	Very low	204.667 Å²	204.667	115.2 Å²	115.2	89%	0.89	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.2	3.7	175.1	-75.6	-169.5	175	177.4	0	115.7	L773 L777	L773-K775 PolarHBondContact O-N 3.06Å; K775-L777 VanDerWaalsContact C-N 3.3Å
776	E	36.1	Very low	49.5	Very low	167 Å²	167	110.2 Å²	110.2	78%	0.78	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.3	8.6	178.5	-61.1	-169.1	149.6	0	0	113.8	I774 H778 N779	I774-E776 VanDerWaalsContact C-N 3.25Å; I774-E776 PolarHBondContact O-N 3.43Å; E776-H778 PolarHBondContact O-N 3.32Å; E776-N779 PolarHBondContact O-N 2.88Å
777	L	40.8	Very low	51.8	Low	96.3333 Å²	96.3333	106 Å²	106	50%	0.504	56%	0.558	S	S	.	*	T	Hydrogen-bonded Turn	trans	-78.1	28.7	-167.6	-138.9	79.8	0	0	0	115.5	I774 K775 N779	I774-L777 HydrophobicContact CG1-CD1 4.38Å; I774-L777 HydrophobicContact CG2-CB 4.12Å; I774-L777 HydrophobicContact CG2-CD1 4.25Å; I774-L777 HydrophobicContact CG2-CD2 3.97Å; I774-L777 HydrophobicContact CG2-CG 4.34Å; K775-L777 VanDerWaalsContact C-N 3.3Å; L777-N779 VanDerWaalsContact C-N 3.28Å; L777-N779 PolarHBondContact O-N 3.34Å
778	H	45.9	Very low	54	Low	167.333 Å²	167.333	107 Å²	107	78%	0.775	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.2	-30.7	-179.6	-91.2	51.2	0	0	0	113.8	E776 E780 V781	E776-H778 PolarHBondContact O-N 3.32Å; H778-E780 VanDerWaalsContact C-N 3.35Å; H778-E780 PolarHBondContact O-N 3.22Å; H778-V781 PolarHBondContact O-N 3.36Å
779	N	60	Low	56.3	Low	73.3333 Å²	73.3333	102.8 Å²	102.8	39%	0.392	52%	0.524	S	S	.	.	H	α-helix	trans	-83.2	-16.2	-170	-65.7	-3.6	0	0	0	112.9	Q721 E776 L777 V781 E782 D783	Q721-N779 WeakPolarHBondContact CA-ND2 3.4Å; Q721-N779 PolarHBondContact O-ND2 2.99Å; E776-N779 PolarHBondContact O-N 2.88Å; L777-N779 VanDerWaalsContact C-N 3.28Å; L777-N779 PolarHBondContact O-N 3.34Å; N779-V781 VanDerWaalsContact C-N 3.28Å; N779-V781 PolarHBondContact O-N 3.24Å; N779-V781 VanDerWaalsContact O-N 3.15Å; N779-E782 PolarHBondContact O-N 3.03Å; N779-E782 VanDerWaalsContact O-N 3.16Å; N779-D783 WeakPolarHBondContact O-CB 3.28Å; N779-D783 PolarHBondContact O-N 3.21Å
780	E	68	Low	58.6	Low	78.6667 Å²	78.6667	97.1 Å²	97.1	37%	0.368	48%	0.484	S	S	.	.	H	α-helix	trans	-56.1	-33.4	-178.9	-63	-165.2	164.4	0	0	114	H778 R784	H778-E780 VanDerWaalsContact C-N 3.35Å; H778-E780 PolarHBondContact O-N 3.22Å; E780-R784 VanDerWaalsContact O-CB 3.25Å; E780-R784 WeakPolarHBondContact O-CB 3.44Å; E780-R784 WeakPolarHBondContact O-CD 3.32Å; E780-R784 WeakPolarHBondContact O-CG 3.33Å; E780-R784 PolarHBondContact O-N 3.19Å; E780-R784 IonicContact OE1-CZ 2.64Å; E780-R784 IonicContact OE1-NH2 3.84Å; E780-R784 PolarHBondContact OE1-NH2 3.09Å; E780-R784 IonicContact OE2-CZ 3.19Å; E780-R784 IonicContact OE2-NE 2.59Å; E780-R784 IonicContact OE2-NH1 3.36Å; E780-R784 PolarHBondContact OE2-NH1 3.29Å; E780-R784 IonicContact OE2-NH2 2.8Å; E780-R784 PolarHBondContact OE2-NH2 3.07Å
781	V	73.3	Confident	61.1	Low	100.333 Å²	100.333	87.9 Å²	87.9	61%	0.608	44%	0.442	S	S	*	.	H	α-helix	trans	-71.6	-41.2	-178.7	-177.9	0	0	0	0	110.6	H778 N779 Y785	H778-V781 PolarHBondContact O-N 3.36Å; N779-V781 VanDerWaalsContact C-N 3.28Å; N779-V781 PolarHBondContact O-N 3.24Å; N779-V781 VanDerWaalsContact O-N 3.15Å; V781-Y785 WeakPolarHBondContact O-CB 3.45Å; V781-Y785 PolarHBondContact O-N 3.13Å
782	E	74.1	Confident	63.2	Low	14.6667 Å²	14.6667	84.5 Å²	84.5	7%	0.069	42%	0.418	C	S	.	.	H	α-helix	trans	-70.7	-43.3	176.4	-59.7	-109.9	119	0	0	111.1	L622 P623 S624 N779 R784 Y785 I786	L622-E782 WeakPolarHBondContact CB-OE1 3.47Å; L622-E782 HydrophobicContact CD2-CG 3.86Å; L622-E782 VanDerWaalsContact CD2-OE2 3.31Å; L622-E782 WeakPolarHBondContact CD2-OE2 3.37Å; P623-E782 WeakPolarHBondContact CB-OE2 3.29Å; P623-E782 WeakPolarHBondContact CD-OE2 3.44Å; S624-E782 VanDerWaalsContact CB-OE1 3.31Å; S624-E782 WeakPolarHBondContact CB-OE1 3.46Å; S624-E782 WeakPolarHBondContact CB-OE2 3.24Å; S624-E782 PolarHBondContact N-OE1 2.87Å; S624-E782 VanDerWaalsContact N-OE1 3.08Å; S624-E782 PolarHBondContact N-OE2 3.08Å; S624-E782 PolarHBondContact OG-OE1 3.18Å; S624-E782 PolarHBondContact OG-OE2 3.21Å; N779-E782 PolarHBondContact O-N 3.03Å; N779-E782 VanDerWaalsContact O-N 3.16Å; E782-R784 VanDerWaalsContact C-N 3.34Å; E782-R784 PolarHBondContact O-N 3.22Å; E782-Y785 CarbonylContact O-C 3.57Å; E782-Y785 WeakPolarHBondContact O-CA 3.43Å; E782-Y785 WeakPolarHBondContact O-CB 3.3Å; E782-Y785 PolarHBondContact O-N 3.08Å; E782-Y785 VanDerWaalsContact O-N 3.09Å; E782-I786 WeakPolarHBondContact O-CB 3.02Å; E782-I786 WeakPolarHBondContact O-CD1 3.23Å; E782-I786 VanDerWaalsContact O-CG1 3.25Å; E782-I786 WeakPolarHBondContact O-CG1 3.17Å; E782-I786 PolarHBondContact O-N 3.25Å
783	D	79.2	Confident	65.1	Low	32.6667 Å²	32.6667	81.6 Å²	81.6	18%	0.175	40%	0.399	C	S	.	.	H	α-helix	trans	-61.2	-43	175.9	-84.2	-17.5	0	0	0	111.9	T722 I724 N779 Y785 I786 L787	T722-D783 VanDerWaalsContact CB-OD1 3.25Å; T722-D783 WeakPolarHBondContact CB-OD1 3.34Å; T722-D783 PolarHBondContact OG1-OD1 3Å; I724-D783 HydrophobicContact CD1-CB 3.53Å; I724-D783 VanDerWaalsContact CD1-CG 3.4Å; I724-D783 WeakPolarHBondContact CD1-OD1 3.24Å; I724-D783 HydrophobicContact CG1-CB 4.48Å; I724-D783 WeakPolarHBondContact CG1-OD1 3.25Å; N779-D783 WeakPolarHBondContact O-CB 3.28Å; N779-D783 PolarHBondContact O-N 3.21Å; D783-Y785 VanDerWaalsContact C-N 3.31Å; D783-Y785 PolarHBondContact O-N 3.06Å; D783-I786 PolarHBondContact O-N 3.18Å; D783-L787 WeakPolarHBondContact O-CB 3.43Å; D783-L787 VanDerWaalsContact O-CG 3.32Å; D783-L787 WeakPolarHBondContact O-CG 3.36Å; D783-L787 PolarHBondContact O-N 3.3Å
784	R	77.2	Confident	67	Low	104 Å²	104	76.2 Å²	76.2	39%	0.392	37%	0.369	S	S	.	.	H	α-helix	trans	-63	-37.2	172	-74	170.7	-170.1	144.3	6.8	112	L761 E780 E782 K788	L761-R784 HydrophobicContact CD1-CG 4.29Å; L761-R784 HydrophobicContact CD2-CG 4.33Å; E780-R784 VanDerWaalsContact O-CB 3.25Å; E780-R784 WeakPolarHBondContact O-CB 3.44Å; E780-R784 WeakPolarHBondContact O-CD 3.32Å; E780-R784 WeakPolarHBondContact O-CG 3.33Å; E780-R784 PolarHBondContact O-N 3.19Å; E780-R784 IonicContact OE1-CZ 2.64Å; E780-R784 IonicContact OE1-NH2 3.84Å; E780-R784 PolarHBondContact OE1-NH2 3.09Å; E780-R784 IonicContact OE2-CZ 3.19Å; E780-R784 IonicContact OE2-NE 2.59Å; E780-R784 IonicContact OE2-NH1 3.36Å; E780-R784 PolarHBondContact OE2-NH1 3.29Å; E780-R784 IonicContact OE2-NH2 2.8Å; E780-R784 PolarHBondContact OE2-NH2 3.07Å; E782-R784 VanDerWaalsContact C-N 3.34Å; E782-R784 PolarHBondContact O-N 3.22Å; R784-K788 WeakPolarHBondContact O-CB 3.41Å; R784-K788 VanDerWaalsContact O-CG 3.28Å; R784-K788 WeakPolarHBondContact O-CG 3.31Å; R784-K788 PolarHBondContact O-N 3.07Å; R784-K788 VanDerWaalsContact O-N 3.08Å
785	Y	79.5	Confident	68.6	Low	75 Å²	75	76.1 Å²	76.1	29%	0.294	37%	0.365	S	S	.	.	H	α-helix	trans	-68.6	-42.7	176.5	174.5	-97.6	0	0	0	112	P623 V781 E782 D783 K788 T789	P623-Y785 HydrophobicContact CB-CD1 4.29Å; P623-Y785 HydrophobicContact CB-CE1 4.27Å; P623-Y785 VanDerWaalsContact O-CE1 3.23Å; P623-Y785 WeakPolarHBondContact O-CE1 3.34Å; P623-Y785 PolarHBondContact O-OH 3.38Å; V781-Y785 WeakPolarHBondContact O-CB 3.45Å; V781-Y785 PolarHBondContact O-N 3.13Å; E782-Y785 CarbonylContact O-C 3.57Å; E782-Y785 WeakPolarHBondContact O-CA 3.43Å; E782-Y785 WeakPolarHBondContact O-CB 3.3Å; E782-Y785 PolarHBondContact O-N 3.08Å; E782-Y785 VanDerWaalsContact O-N 3.09Å; D783-Y785 VanDerWaalsContact C-N 3.31Å; D783-Y785 PolarHBondContact O-N 3.06Å; Y785-K788 PolarHBondContact O-N 3.04Å; Y785-T789 HydrophobicContact CD2-CG2 4.16Å; Y785-T789 HydrophobicContact CE1-CG2 4.42Å; Y785-T789 HydrophobicContact CE2-CG2 3.83Å; Y785-T789 WeakPolarHBondContact O-CB 3.41Å; Y785-T789 WeakPolarHBondContact O-CG2 3.11Å; Y785-T789 PolarHBondContact O-N 3.28Å; Y785-T789 PolarHBondContact O-OG1 3.26Å
786	I	81.4	Confident	70.2	Confident	0 Å²	0	69.6 Å²	69.6	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-63.5	-46.7	175.9	-67.7	160	0	0	0	110.3	P623 T722 I724 F725 E782 D783 K788 T789 C790	P623-I786 HydrophobicContact CB-CD1 4.28Å; P623-I786 HydrophobicContact CB-CG1 4.13Å; P623-I786 HydrophobicContact CG-CD1 4.1Å; P623-I786 HydrophobicContact CG-CG1 4.21Å; T722-I786 HydrophobicContact CG2-CD1 3.58Å; I724-I786 HydrophobicContact CG2-CG2 4.27Å; F725-I786 HydrophobicContact CD1-CG2 4Å; F725-I786 HydrophobicContact CE1-CD1 4.38Å; F725-I786 HydrophobicContact CE1-CG1 4.21Å; F725-I786 HydrophobicContact CE1-CG2 3.61Å; F725-I786 HydrophobicContact CE2-CD1 3.95Å; F725-I786 HydrophobicContact CZ-CD1 3.74Å; F725-I786 HydrophobicContact CZ-CG1 3.86Å; F725-I786 HydrophobicContact CZ-CG2 4.09Å; E782-I786 WeakPolarHBondContact O-CB 3.02Å; E782-I786 WeakPolarHBondContact O-CD1 3.23Å; E782-I786 VanDerWaalsContact O-CG1 3.25Å; E782-I786 WeakPolarHBondContact O-CG1 3.17Å; E782-I786 PolarHBondContact O-N 3.25Å; D783-I786 PolarHBondContact O-N 3.18Å; I786-K788 VanDerWaalsContact C-N 3.28Å; I786-K788 PolarHBondContact O-N 3.26Å; I786-T789 PolarHBondContact O-N 3.2Å; I786-C790 HydrophobicContact CG2-CB 4.09Å; I786-C790 WeakPolarHBondContact O-CA 3.48Å; I786-C790 VanDerWaalsContact O-CB 3.29Å; I786-C790 WeakPolarHBondContact O-CB 3.42Å; I786-C790 PolarHBondContact O-N 3.05Å
787	L	80.1	Confident	71.5	Confident	22 Å²	22	67.6 Å²	67.6	12%	0.115	33%	0.333	C	S	.	.	H	α-helix	trans	-62.8	-31.2	175.7	-71.8	173.2	0	0	0	112.8	I724 P756 D783 L791	I724-L787 HydrophobicContact CD1-CD1 3.99Å; I724-L787 HydrophobicContact CD1-CD2 4.43Å; I724-L787 HydrophobicContact CD1-CG 4.04Å; I724-L787 HydrophobicContact CG2-CD2 3.82Å; I724-L787 HydrophobicContact CG2-CG 4.27Å; P756-L787 HydrophobicContact CG-CD2 4.31Å; D783-L787 WeakPolarHBondContact O-CB 3.43Å; D783-L787 VanDerWaalsContact O-CG 3.32Å; D783-L787 WeakPolarHBondContact O-CG 3.36Å; D783-L787 PolarHBondContact O-N 3.3Å; L787-L791 HydrophobicContact CD2-CD2 4.07Å; L787-L791 WeakPolarHBondContact O-CB 3.36Å
788	K	78.7	Confident	72.6	Confident	178.333 Å²	178.333	65.3 Å²	65.3	78%	0.775	32%	0.323	S	S	*	.	H	α-helix	trans	-80.3	-18.4	176	-76.7	-178.9	177.1	-172	0	114.9	R784 Y785 I786	R784-K788 WeakPolarHBondContact O-CB 3.41Å; R784-K788 VanDerWaalsContact O-CG 3.28Å; R784-K788 WeakPolarHBondContact O-CG 3.31Å; R784-K788 PolarHBondContact O-N 3.07Å; R784-K788 VanDerWaalsContact O-N 3.08Å; Y785-K788 PolarHBondContact O-N 3.04Å; I786-K788 VanDerWaalsContact C-N 3.28Å; I786-K788 PolarHBondContact O-N 3.26Å
789	T	79.7	Confident	73.1	Confident	30.6667 Å²	30.6667	63.1 Å²	63.1	19%	0.188	33%	0.334	C	S	.	.	H	α-helix	trans	-118	-33.8	-173.1	56.5	0	0	0	0	114.3	Y679 Q682 Y785 I786	Y679-T789 WeakPolarHBondContact CE1-O 3.39Å; Y679-T789 WeakPolarHBondContact OH-CB 3.35Å; Q682-T789 PolarHBondContact NE2-O 2.94Å; Y785-T789 HydrophobicContact CD2-CG2 4.16Å; Y785-T789 HydrophobicContact CE1-CG2 4.42Å; Y785-T789 HydrophobicContact CE2-CG2 3.83Å; Y785-T789 WeakPolarHBondContact O-CB 3.41Å; Y785-T789 WeakPolarHBondContact O-CG2 3.11Å; Y785-T789 PolarHBondContact O-N 3.28Å; Y785-T789 PolarHBondContact O-OG1 3.26Å; I786-T789 PolarHBondContact O-N 3.2Å
790	C	82.9	Confident	72.9	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.9	-16.1	-174.2	-59.5	0	0	0	0	113.3	Q675 C678 Q682 V728 H732 I786	Q675-C790 PolarHBondContact NE2-SG 3Å; C678-C790 HydrophobicContact CB-CB 3.91Å; Q682-C790 PolarHBondContact NE2-O 3.31Å; Q682-C790 VanDerWaalsContact NE2-O 3.13Å; V728-C790 HydrophobicContact CG1-CB 4.11Å; V728-C790 WeakPolarHBondContact CG1-O 3.3Å; H732-C790 PolarHBondContact NE2-O 2.87Å; I786-C790 HydrophobicContact CG2-CB 4.09Å; I786-C790 WeakPolarHBondContact O-CA 3.48Å; I786-C790 VanDerWaalsContact O-CB 3.29Å; I786-C790 WeakPolarHBondContact O-CB 3.42Å; I786-C790 PolarHBondContact O-N 3.05Å
791	L	81.8	Confident	72.7	Confident	6 Å²	6	61.9 Å²	61.9	3%	0.031	36%	0.36	C	S	.	.	S	Bend	trans	-106	135.6	177.3	-173.8	68.4	0	0	0	109.8	V728 P756 V758 L787 P793	V728-L791 HydrophobicContact CG1-CB 4.46Å; V728-L791 HydrophobicContact CG1-CD1 4.4Å; P756-L791 HydrophobicContact CG-CD1 4.23Å; P756-L791 HydrophobicContact CG-CD2 3.8Å; V758-L791 HydrophobicContact CG2-CD2 4.02Å; L787-L791 HydrophobicContact CD2-CD2 4.07Å; L787-L791 WeakPolarHBondContact O-CB 3.36Å; L791-P793 WeakPolarHBondContact O-CD 3.21Å
792	S	74.5	Confident	72.2	Confident	25.6667 Å²	25.6667	60.2 Å²	60.2	18%	0.179	35%	0.35	C	S	.	.			trans	-80.3	121.3	171.4	-51.8	0	0	0	0	109.1	Q682 R735	Q682-S792 PolarHBondContact OE1-OG 3.24Å; R735-S792 PolarHBondContact NH1-OG 3.37Å; R735-S792 VanDerWaalsContact NH1-OG 3.1Å
793	P	70.9	Confident	71.9	Confident	68 Å²	68	60.9 Å²	60.9	44%	0.442	36%	0.355	S	S	.	.			trans	-66.2	143.5	176.2	27.8	-34.7	0	0	0	110.8	L791 F795 V796	L791-P793 WeakPolarHBondContact O-CD 3.21Å; P793-F795 VanDerWaalsContact C-N 3.33Å; P793-F795 PolarHBondContact O-N 3.24Å; P793-V796 HydrophobicContact CB-CG2 3.9Å; P793-V796 HydrophobicContact CG-CG2 3.41Å; P793-V796 VanDerWaalsContact CG-CG2 3.45Å
794	Q	72.1	Confident	71.3	Confident	38.6667 Å²	38.6667	61.4 Å²	61.4	18%	0.181	36%	0.357	C	S	.	.	S	Bend	trans	-67.8	-35.4	177.7	-75.4	176.9	-4.8	0	0	111.8	L752 F753 Y805 S806 G809	L752-Q794 PolarHBondContact O-NE2 3.31Å; L752-Q794 VanDerWaalsContact O-NE2 3.14Å; F753-Q794 PolarHBondContact O-NE2 2.99Å; Q794-Y805 CarbonylContact O-C 3.52Å; Q794-Y805 WeakPolarHBondContact O-CA 3.11Å; Q794-S806 VanDerWaalsContact CA-OG 3.31Å; Q794-S806 WeakPolarHBondContact CA-OG 3.44Å; Q794-S806 WeakPolarHBondContact O-CB 3.41Å; Q794-S806 PolarHBondContact O-N 2.94Å; Q794-S806 PolarHBondContact O-OG 3.08Å; Q794-G809 WeakPolarHBondContact O-CA 3.36Å
795	F	69.8	Low	71.1	Confident	115 Å²	115	58.5 Å²	58.5	50%	0.504	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	159.4	171	69.3	-84.8	0	0	0	111	P793 E797 L804 Y805	P793-F795 VanDerWaalsContact C-N 3.33Å; P793-F795 PolarHBondContact O-N 3.24Å; F795-E797 HydrophobicContact CD2-CG 4.48Å; F795-L804 CarbonylContact C-O 3.58Å; F795-L804 WeakPolarHBondContact CA-O 3.33Å; F795-L804 WeakPolarHBondContact CB-O 3.39Å; F795-Y805 HydrophobicContact CB-CD1 3.62Å; F795-Y805 VanDerWaalsContact CB-CD1 3.46Å; F795-Y805 HydrophobicContact CB-CE1 3.8Å; F795-Y805 HydrophobicContact CB-CG 4.26Å; F795-Y805 HydrophobicContact CG-CD1 4.48Å; F795-Y805 HydrophobicContact CG-CE1 4.34Å
796	V	67.8	Low	71	Confident	68.6667 Å²	68.6667	55.7 Å²	55.7	42%	0.416	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	127.6	175.9	-178.7	0	0	0	0	108.9	P793 L804	P793-V796 HydrophobicContact CB-CG2 3.9Å; P793-V796 HydrophobicContact CG-CG2 3.41Å; P793-V796 VanDerWaalsContact CG-CG2 3.45Å; V796-L804 PolarHBondContact N-O 2.81Å; V796-L804 PolarHBondContact O-N 2.99Å
797	E	63.7	Low	71	Confident	123.667 Å²	123.667	56.6 Å²	56.6	58%	0.578	34%	0.344	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.6	130.6	170.5	-48.5	-149.8	142.5	0	0	110	F795 T803	F795-E797 HydrophobicContact CD2-CG 4.48Å; E797-T803 HydrophobicContact CB-CG2 4.41Å; E797-T803 HydrophobicContact CG-CG2 3.94Å; E797-T803 WeakPolarHBondContact OE1-CG2 3.49Å
798	T	63.1	Low	71.1	Confident	48.6667 Å²	48.6667	55.8 Å²	55.8	30%	0.299	34%	0.339	S	S	.	.			trans	-85.5	157.3	173.9	73.3	0	0	0	0	110.8	G800 G801 T802 L804	T798-G800 PolarHBondContact O-N 3.28Å; T798-G800 PolarHBondContact OG1-N 2.9Å; T798-G801 PolarHBondContact O-N 3.06Å; T798-T802 WeakPolarHBondContact CB-O 3.47Å; T798-T802 WeakPolarHBondContact CG2-O 3.36Å; T798-T802 WeakPolarHBondContact CG2-OG1 3.41Å; T798-T802 PolarHBondContact N-O 3.2Å; T798-T802 PolarHBondContact OG1-N 3.14Å; T798-T802 VanDerWaalsContact OG1-N 3.09Å; T798-T802 PolarHBondContact OG1-O 2.84Å; T798-T802 PolarHBondContact OG1-OG1 3.19Å; T798-L804 HydrophobicContact CG2-CD1 3.99Å; T798-L804 HydrophobicContact CG2-CG 4.08Å
799	A	58	Low	71.2	Confident	121 Å²	121	47.5 Å²	47.5	100%	1	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-12.5	173	0	0	0	0	0	114.2
800	G	55.3	Low	71.1	Confident	68.6667 Å²	68.6667	46.7 Å²	46.7	71%	0.708	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.4	5.3	171.9	0	0	0	0	0	114.6	T798 T802	T798-G800 PolarHBondContact O-N 3.28Å; T798-G800 PolarHBondContact OG1-N 2.9Å; G800-T802 VanDerWaalsContact C-N 3.28Å; G800-T802 PolarHBondContact O-N 3.1Å
801	G	63.8	Low	71	Confident	58.25 Å²	58.25	46.7 Å²	46.7	60%	0.601	30%	0.299	S	S	*	.	S	Bend	trans	77.9	3.3	-178.4	0	0	0	0	0	115.1	T798	T798-G801 PolarHBondContact O-N 3.06Å
802	T	62.7	Low	70.8	Confident	64.25 Å²	64.25	48.6 Å²	48.6	39%	0.394	31%	0.309	S	S	.	.	P	Polyproline II helix	trans	-81	132.6	172.2	60.7	0	0	0	0	110.3	T798 G800	T798-T802 WeakPolarHBondContact CB-O 3.47Å; T798-T802 WeakPolarHBondContact CG2-O 3.36Å; T798-T802 WeakPolarHBondContact CG2-OG1 3.41Å; T798-T802 PolarHBondContact N-O 3.2Å; T798-T802 PolarHBondContact OG1-N 3.14Å; T798-T802 VanDerWaalsContact OG1-N 3.09Å; T798-T802 PolarHBondContact OG1-O 2.84Å; T798-T802 PolarHBondContact OG1-OG1 3.19Å; G800-T802 VanDerWaalsContact C-N 3.28Å; G800-T802 PolarHBondContact O-N 3.1Å
803	T	67.3	Low	71	Confident	29.75 Å²	29.75	51.3 Å²	51.3	18%	0.183	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	119.3	177.1	50.8	0	0	0	0	110.2	L536 E797 Y805	L536-T803 WeakPolarHBondContact CD1-O 3.3Å; E797-T803 HydrophobicContact CB-CG2 4.41Å; E797-T803 HydrophobicContact CG-CG2 3.94Å; E797-T803 WeakPolarHBondContact OE1-CG2 3.49Å; T803-Y805 VanDerWaalsContact CB-CE2 3.42Å; T803-Y805 VanDerWaalsContact CB-CZ 3.49Å; T803-Y805 WeakPolarHBondContact CB-OH 3.29Å; T803-Y805 WeakPolarHBondContact O-CD2 3.29Å; T803-Y805 WeakPolarHBondContact O-CE2 2.85Å; T803-Y805 VanDerWaalsContact OG1-CE2 3.27Å; T803-Y805 WeakPolarHBondContact OG1-CE2 3.39Å; T803-Y805 PolarHBondContact OG1-OH 3.13Å; T803-Y805 VanDerWaalsContact OG1-OH 3.11Å
804	L	67.8	Low	71.1	Confident	43.25 Å²	43.25	48.3 Å²	48.3	23%	0.226	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	135.9	175.2	-59.6	-180	0	0	0	109.3	F795 V796 T798	F795-L804 CarbonylContact C-O 3.58Å; F795-L804 WeakPolarHBondContact CA-O 3.33Å; F795-L804 WeakPolarHBondContact CB-O 3.39Å; V796-L804 PolarHBondContact N-O 2.81Å; V796-L804 PolarHBondContact O-N 2.99Å; T798-L804 HydrophobicContact CG2-CD1 3.99Å; T798-L804 HydrophobicContact CG2-CG 4.08Å
805	Y	71.6	Confident	71.2	Confident	42 Å²	42	46.8 Å²	46.8	17%	0.165	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	140.6	-179.3	-64.8	-93.6	0	0	0	111.1	L536 Q794 F795 T803 G809 L810 K813	L536-Y805 HydrophobicContact CD1-CD2 3.9Å; L536-Y805 HydrophobicContact CD1-CG 4.37Å; L536-Y805 HydrophobicContact CD2-CD2 3.68Å; L536-Y805 HydrophobicContact CD2-CE2 4.24Å; L536-Y805 HydrophobicContact CG-CD2 4.41Å; Q794-Y805 CarbonylContact O-C 3.52Å; Q794-Y805 WeakPolarHBondContact O-CA 3.11Å; F795-Y805 HydrophobicContact CB-CD1 3.62Å; F795-Y805 VanDerWaalsContact CB-CD1 3.46Å; F795-Y805 HydrophobicContact CB-CE1 3.8Å; F795-Y805 HydrophobicContact CB-CG 4.26Å; F795-Y805 HydrophobicContact CG-CD1 4.48Å; F795-Y805 HydrophobicContact CG-CE1 4.34Å; T803-Y805 VanDerWaalsContact CB-CE2 3.42Å; T803-Y805 VanDerWaalsContact CB-CZ 3.49Å; T803-Y805 WeakPolarHBondContact CB-OH 3.29Å; T803-Y805 WeakPolarHBondContact O-CD2 3.29Å; T803-Y805 WeakPolarHBondContact O-CE2 2.85Å; T803-Y805 VanDerWaalsContact OG1-CE2 3.27Å; T803-Y805 WeakPolarHBondContact OG1-CE2 3.39Å; T803-Y805 PolarHBondContact OG1-OH 3.13Å; T803-Y805 VanDerWaalsContact OG1-OH 3.11Å; Y805-G809 WeakPolarHBondContact CD1-O 3.41Å; Y805-L810 HydrophobicContact CD2-CD1 4.28Å; Y805-L810 HydrophobicContact CG-CD1 4.23Å; Y805-K813 HydrophobicContact CD1-CB 4.12Å; Y805-K813 HydrophobicContact CD1-CD 4.29Å; Y805-K813 HydrophobicContact CD1-CG 4.46Å; Y805-K813 HydrophobicContact CE1-CB 3.89Å; Y805-K813 HydrophobicContact CE1-CD 4.08Å; Y805-K813 HydrophobicContact CE1-CG 3.88Å; Y805-K813 HydrophobicContact CE2-CD 4.08Å; Y805-K813 HydrophobicContact CE2-CG 4.3Å; Y805-K813 WeakPolarHBondContact OH-CD 3.26Å; Y805-K813 PolarHBondContact OH-NZ 2.58Å
806	S	78.6	Confident	71.5	Confident	16.5 Å²	16.5	45.8 Å²	45.8	12%	0.115	29%	0.29	C	S	.	.			trans	-68.5	170.5	159.7	69.4	0	0	0	0	110.5	Q794 E808 G809 L810	Q794-S806 VanDerWaalsContact CA-OG 3.31Å; Q794-S806 WeakPolarHBondContact CA-OG 3.44Å; Q794-S806 WeakPolarHBondContact O-CB 3.41Å; Q794-S806 PolarHBondContact O-N 2.94Å; Q794-S806 PolarHBondContact O-OG 3.08Å; S806-E808 VanDerWaalsContact C-N 3.29Å; S806-E808 VanDerWaalsContact CB-OE2 3.26Å; S806-E808 WeakPolarHBondContact CB-OE2 3.4Å; S806-E808 PolarHBondContact O-N 3.05Å; S806-E808 PolarHBondContact OG-N 3.18Å; S806-E808 PolarHBondContact OG-OE2 3.02Å; S806-G809 PolarHBondContact O-N 3.28Å; S806-G809 PolarHBondContact OG-N 3.01Å; S806-L810 VanDerWaalsContact O-CB 3.24Å; S806-L810 WeakPolarHBondContact O-CB 3.38Å; S806-L810 PolarHBondContact O-N 3.23Å
807	V	80.5	Confident	71.5	Confident	18.75 Å²	18.75	44.6 Å²	44.6	11%	0.114	28%	0.283	C	S	.	.	H	α-helix	trans	-64	-38	177	-168.9	0	0	0	0	111.2	L689 L810 L811 V841 L845 L846 L849	L689-V807 HydrophobicContact CD2-CG2 3.79Å; V807-L810 PolarHBondContact O-N 3.44Å; V807-L811 PolarHBondContact O-N 2.97Å; V807-L811 VanDerWaalsContact O-N 3.08Å; V807-V841 HydrophobicContact CG1-CG1 3.8Å; V807-V841 HydrophobicContact CG2-CG1 4.43Å; V807-L845 HydrophobicContact CB-CD2 4.5Å; V807-L845 HydrophobicContact CG1-CD2 4Å; V807-L845 HydrophobicContact CG1-CG 4.3Å; V807-L845 HydrophobicContact CG2-CD2 4.2Å; V807-L846 HydrophobicContact CG1-CD2 4.25Å; V807-L849 HydrophobicContact CB-CD1 4.12Å; V807-L849 HydrophobicContact CG1-CD1 3.58Å
808	E	82.6	Confident	71.6	Confident	5 Å²	5	39.2 Å²	39.2	2%	0.023	26%	0.259	C	S	.	.	H	α-helix	trans	-67.2	-43	174.4	-58.8	85.2	169.7	0	0	112.1	R735 Y739 L752 F753 S806 L810 L811 M812 L849	R735-E808 WeakPolarHBondContact CG-OE1 3.41Å; R735-E808 IonicContact CZ-OE1 3.1Å; R735-E808 IonicContact CZ-OE2 3.09Å; R735-E808 IonicContact NE-OE1 2.85Å; R735-E808 PolarHBondContact NE-OE1 3.1Å; R735-E808 IonicContact NE-OE2 3.06Å; R735-E808 IonicContact NH2-OE1 3.22Å; R735-E808 PolarHBondContact NH2-OE1 3.12Å; R735-E808 VanDerWaalsContact NH2-OE1 3.17Å; R735-E808 IonicContact NH2-OE2 3.29Å; R735-E808 PolarHBondContact NH2-OE2 3.02Å; Y739-E808 WeakPolarHBondContact CE1-OE1 3.31Å; Y739-E808 VanDerWaalsContact CZ-OE1 3.23Å; Y739-E808 PolarHBondContact OH-OE1 3.15Å; Y739-E808 PolarHBondContact OH-OE2 3.19Å; L752-E808 HydrophobicContact CB-CG 4.43Å; L752-E808 HydrophobicContact CD1-CG 4.37Å; F753-E808 HydrophobicContact CD1-CB 4.37Å; F753-E808 HydrophobicContact CE1-CB 4.05Å; F753-E808 HydrophobicContact CE1-CG 4.3Å; S806-E808 VanDerWaalsContact C-N 3.29Å; S806-E808 VanDerWaalsContact CB-OE2 3.26Å; S806-E808 WeakPolarHBondContact CB-OE2 3.4Å; S806-E808 PolarHBondContact O-N 3.05Å; S806-E808 PolarHBondContact OG-N 3.18Å; S806-E808 PolarHBondContact OG-OE2 3.02Å; E808-L810 VanDerWaalsContact C-N 3.32Å; E808-L811 PolarHBondContact O-N 3.12Å; E808-M812 WeakPolarHBondContact O-CG 3.36Å; E808-M812 PolarHBondContact O-N 3.03Å; E808-L849 HydrophobicContact CG-CD1 4.25Å; E808-L849 HydrophobicContact CG-CD2 3.95Å
809	G	79.9	Confident	71.4	Confident	4.25 Å²	4.25	38.8 Å²	38.8	4%	0.044	26%	0.264	C	S	.	.	H	α-helix	trans	-67.3	-34.6	176.8	0	0	0	0	0	112.9	Q794 Y805 S806 M812 K813	Q794-G809 WeakPolarHBondContact O-CA 3.36Å; Y805-G809 WeakPolarHBondContact CD1-O 3.41Å; S806-G809 PolarHBondContact O-N 3.28Å; S806-G809 PolarHBondContact OG-N 3.01Å; G809-M812 PolarHBondContact O-N 3.42Å; G809-K813 VanDerWaalsContact O-CB 3.31Å; G809-K813 WeakPolarHBondContact O-CB 3.44Å; G809-K813 PolarHBondContact O-N 3.16Å
810	L	78.6	Confident	71.5	Confident	15.25 Å²	15.25	39.3 Å²	39.3	8%	0.08	25%	0.25	C	C	.	.	H	α-helix	trans	-67.6	-41.8	172.8	-174.6	70.3	0	0	0	110.6	L536 Y805 S806 V807 E808 M812 K813 L814 T837 V841	L536-L810 HydrophobicContact CD2-CD1 4.2Å; Y805-L810 HydrophobicContact CD2-CD1 4.28Å; Y805-L810 HydrophobicContact CG-CD1 4.23Å; S806-L810 VanDerWaalsContact O-CB 3.24Å; S806-L810 WeakPolarHBondContact O-CB 3.38Å; S806-L810 PolarHBondContact O-N 3.23Å; V807-L810 PolarHBondContact O-N 3.44Å; E808-L810 VanDerWaalsContact C-N 3.32Å; L810-M812 PolarHBondContact O-N 2.93Å; L810-K813 CarbonylContact O-C 3.53Å; L810-K813 PolarHBondContact O-N 3.2Å; L810-L814 HydrophobicContact CD1-CG 4.4Å; L810-L814 HydrophobicContact CD2-CD1 4.25Å; L810-L814 HydrophobicContact CG-CD1 4.24Å; L810-L814 HydrophobicContact CG-CG 4.47Å; L810-L814 WeakPolarHBondContact O-CB 3.31Å; L810-L814 VanDerWaalsContact O-CG 3.3Å; L810-L814 WeakPolarHBondContact O-CG 3.3Å; L810-L814 PolarHBondContact O-N 3.27Å; L810-T837 HydrophobicContact CD1-CG2 4.08Å; L810-T837 HydrophobicContact CD2-CG2 4.19Å; L810-T837 HydrophobicContact CG-CG2 4.19Å; L810-V841 HydrophobicContact CD2-CG2 3.61Å
811	L	80.3	Confident	71.5	Confident	0 Å²	0	39 Å²	39	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-61.3	-46.4	173.4	177.5	60.2	0	0	0	111.3	F753 V807 E808 K813 L814 L815 L846 L849 L850 I1179	F753-L811 HydrophobicContact CE1-CD2 4.07Å; F753-L811 HydrophobicContact CZ-CD2 3.94Å; V807-L811 PolarHBondContact O-N 2.97Å; V807-L811 VanDerWaalsContact O-N 3.08Å; E808-L811 PolarHBondContact O-N 3.12Å; L811-K813 VanDerWaalsContact C-N 3.29Å; L811-K813 PolarHBondContact O-N 3.15Å; L811-L814 WeakPolarHBondContact O-CB 3.37Å; L811-L814 PolarHBondContact O-N 3.27Å; L811-L814 VanDerWaalsContact O-N 3.16Å; L811-L815 HydrophobicContact CD1-CD1 4.28Å; L811-L815 HydrophobicContact CD1-CD2 4.37Å; L811-L815 HydrophobicContact CD1-CG 4.06Å; L811-L815 HydrophobicContact CG-CD1 4.2Å; L811-L815 HydrophobicContact CG-CG 4.37Å; L811-L815 WeakPolarHBondContact O-CB 3.46Å; L811-L815 VanDerWaalsContact O-CG 3.29Å; L811-L815 WeakPolarHBondContact O-CG 3.4Å; L811-L815 PolarHBondContact O-N 3.32Å; L811-L846 HydrophobicContact CB-CD1 4.09Å; L811-L846 HydrophobicContact CB-CD2 4.42Å; L811-L846 HydrophobicContact CD1-CD1 4Å; L811-L846 HydrophobicContact CD1-CD2 4.46Å; L811-L846 HydrophobicContact CG-CD1 4.44Å; L811-L849 HydrophobicContact CD2-CB 3.63Å; L811-L850 HydrophobicContact CD1-CB 4.24Å; L811-L850 HydrophobicContact CD1-CD1 4.13Å; L811-L850 HydrophobicContact CD1-CD2 3.54Å; L811-L850 HydrophobicContact CD1-CG 3.93Å; L811-L850 HydrophobicContact CD2-CB 3.98Å; L811-L850 HydrophobicContact CD2-CD1 4.47Å; L811-L850 HydrophobicContact CD2-CD2 4.37Å; L811-L850 HydrophobicContact CD2-CG 4.2Å; L811-I1179 HydrophobicContact CD1-CD1 4.35Å
812	M	78.7	Confident	70.8	Confident	46.25 Å²	46.25	40.7 Å²	40.7	23%	0.228	23%	0.232	C	C	.	.	H	α-helix	trans	-61.6	-38.2	175	-70.7	-56.5	-53.1	0	0	112.3	F753 E808 G809 L810 L815 N816 K853	F753-M812 HydrophobicContact CB-CG 4.42Å; F753-M812 HydrophobicContact CB-SD 4.04Å; F753-M812 HydrophobicContact CD1-CG 3.65Å; F753-M812 HydrophobicContact CD1-SD 3.61Å; F753-M812 VanDerWaalsContact CD1-SD 3.59Å; F753-M812 HydrophobicContact CE1-CG 4.33Å; F753-M812 HydrophobicContact CE1-SD 4.34Å; F753-M812 HydrophobicContact CG-CG 4.43Å; F753-M812 HydrophobicContact CG-SD 3.98Å; E808-M812 WeakPolarHBondContact O-CG 3.36Å; E808-M812 PolarHBondContact O-N 3.03Å; G809-M812 PolarHBondContact O-N 3.42Å; L810-M812 PolarHBondContact O-N 2.93Å; M812-L815 PolarHBondContact O-N 3.15Å; M812-L815 HydrophobicContact SD-CD1 4.05Å; M812-N816 WeakPolarHBondContact O-CB 3.18Å; M812-N816 VanDerWaalsContact O-CG 3.25Å; M812-N816 PolarHBondContact O-N 3.15Å; M812-N816 VanDerWaalsContact O-N 3.12Å; M812-N816 PolarHBondContact O-OD1 3.23Å; M812-N816 VanDerWaalsContact O-OD1 3.1Å; M812-K853 HydrophobicContact SD-CD 4.48Å
813	K	76.9	Confident	70.3	Confident	82.5 Å²	82.5	46.5 Å²	46.5	36%	0.359	25%	0.254	S	S	.	.	H	α-helix	trans	-65	-42.9	174.7	-175.3	76.9	177.5	170.1	0	111.5	Y805 G809 L810 L811 N816 T817	Y805-K813 HydrophobicContact CD1-CB 4.12Å; Y805-K813 HydrophobicContact CD1-CD 4.29Å; Y805-K813 HydrophobicContact CD1-CG 4.46Å; Y805-K813 HydrophobicContact CE1-CB 3.89Å; Y805-K813 HydrophobicContact CE1-CD 4.08Å; Y805-K813 HydrophobicContact CE1-CG 3.88Å; Y805-K813 HydrophobicContact CE2-CD 4.08Å; Y805-K813 HydrophobicContact CE2-CG 4.3Å; Y805-K813 WeakPolarHBondContact OH-CD 3.26Å; Y805-K813 PolarHBondContact OH-NZ 2.58Å; G809-K813 VanDerWaalsContact O-CB 3.31Å; G809-K813 WeakPolarHBondContact O-CB 3.44Å; G809-K813 PolarHBondContact O-N 3.16Å; L810-K813 CarbonylContact O-C 3.53Å; L810-K813 PolarHBondContact O-N 3.2Å; L811-K813 VanDerWaalsContact C-N 3.29Å; L811-K813 PolarHBondContact O-N 3.15Å; K813-N816 PolarHBondContact O-N 3.19Å; K813-T817 HydrophobicContact CD-CG2 3.96Å; K813-T817 HydrophobicContact CG-CG2 4.35Å; K813-T817 VanDerWaalsContact O-CB 3.31Å; K813-T817 WeakPolarHBondContact O-CB 3.37Å; K813-T817 VanDerWaalsContact O-CG2 3.3Å; K813-T817 WeakPolarHBondContact O-CG2 3.28Å; K813-T817 PolarHBondContact O-N 3.16Å; K813-T817 PolarHBondContact O-OG1 3.21Å; K813-T817 VanDerWaalsContact O-OG1 3.08Å
814	L	74.9	Confident	69.1	Low	4.5 Å²	4.5	52.4 Å²	52.4	2%	0.024	29%	0.285	C	S	.	.	H	α-helix	trans	-60.3	-49.6	174.9	-75.5	167.1	0	0	0	111.1	L810 L811 N816 T817 V818 F833 L834 T837 I838 I1179	L810-L814 HydrophobicContact CD1-CG 4.4Å; L810-L814 HydrophobicContact CD2-CD1 4.25Å; L810-L814 HydrophobicContact CG-CD1 4.24Å; L810-L814 HydrophobicContact CG-CG 4.47Å; L810-L814 WeakPolarHBondContact O-CB 3.31Å; L810-L814 VanDerWaalsContact O-CG 3.3Å; L810-L814 WeakPolarHBondContact O-CG 3.3Å; L810-L814 PolarHBondContact O-N 3.27Å; L811-L814 WeakPolarHBondContact O-CB 3.37Å; L811-L814 PolarHBondContact O-N 3.27Å; L811-L814 VanDerWaalsContact O-N 3.16Å; L814-N816 VanDerWaalsContact C-N 3.31Å; L814-N816 PolarHBondContact O-N 3.04Å; L814-T817 WeakPolarHBondContact CA-OG1 3.32Å; L814-T817 PolarHBondContact O-N 3.2Å; L814-T817 VanDerWaalsContact O-N 3.17Å; L814-T817 PolarHBondContact O-OG1 3.07Å; L814-T817 VanDerWaalsContact O-OG1 3.06Å; L814-V818 VanDerWaalsContact O-CG2 3.24Å; L814-V818 WeakPolarHBondContact O-CG2 3.41Å; L814-V818 PolarHBondContact O-N 3.19Å; L814-F833 HydrophobicContact CD2-CD1 4.17Å; L814-F833 HydrophobicContact CD2-CE1 3.79Å; L814-L834 HydrophobicContact CD2-CD1 3.79Å; L814-L834 HydrophobicContact CD2-CD2 3.82Å; L814-T837 HydrophobicContact CD1-CG2 4.22Å; L814-T837 HydrophobicContact CD2-CG2 3.97Å; L814-T837 WeakPolarHBondContact CD2-OG1 3.4Å; L814-T837 HydrophobicContact CG-CG2 4.23Å; L814-I838 HydrophobicContact CD1-CG1 4.35Å; L814-I1179 HydrophobicContact CB-CD1 4.42Å
815	L	74.3	Confident	67.7	Low	5.75 Å²	5.75	53.9 Å²	53.9	3%	0.03	30%	0.304	C	S	.	.	H	α-helix	trans	-54	-50.7	177	-71.4	171.7	0	0	0	111.6	L811 M812 T817 V818 G819 L850 K853 D1172 T1175 L1176 I1179	L811-L815 HydrophobicContact CD1-CD1 4.28Å; L811-L815 HydrophobicContact CD1-CD2 4.37Å; L811-L815 HydrophobicContact CD1-CG 4.06Å; L811-L815 HydrophobicContact CG-CD1 4.2Å; L811-L815 HydrophobicContact CG-CG 4.37Å; L811-L815 WeakPolarHBondContact O-CB 3.46Å; L811-L815 VanDerWaalsContact O-CG 3.29Å; L811-L815 WeakPolarHBondContact O-CG 3.4Å; L811-L815 PolarHBondContact O-N 3.32Å; M812-L815 PolarHBondContact O-N 3.15Å; M812-L815 HydrophobicContact SD-CD1 4.05Å; L815-T817 PolarHBondContact O-N 3.42Å; L815-V818 PolarHBondContact O-N 3.02Å; L815-G819 PolarHBondContact O-N 3.09Å; L815-G819 VanDerWaalsContact O-N 3.09Å; L815-L850 HydrophobicContact CD1-CD1 4.1Å; L815-L850 HydrophobicContact CD2-CD1 3.87Å; L815-L850 HydrophobicContact CD2-CD2 4.46Å; L815-L850 HydrophobicContact CG-CD1 4.36Å; L815-K853 HydrophobicContact CD1-CD 4.04Å; L815-K853 HydrophobicContact CD1-CG 4.17Å; L815-D1172 WeakPolarHBondContact CD2-OD1 3.25Å; L815-T1175 HydrophobicContact CB-CG2 4.37Å; L815-T1175 HydrophobicContact CD2-CG2 3.87Å; L815-T1175 HydrophobicContact CG-CG2 4.48Å; L815-L1176 HydrophobicContact CD2-CD2 3.68Å; L815-L1176 VanDerWaalsContact CD2-CD2 3.48Å; L815-L1176 HydrophobicContact CD2-CG 3.75Å; L815-I1179 HydrophobicContact CD2-CD1 3.9Å; L815-I1179 HydrophobicContact CG-CD1 4.37Å
816	N	74.1	Confident	66.4	Low	94.75 Å²	94.75	57.4 Å²	57.4	51%	0.507	33%	0.325	S	S	.	.	H	α-helix	trans	-62.9	-48.2	177.8	-64.8	9.7	0	0	0	111.6	M812 K813 L814 V818 G819 D820	M812-N816 WeakPolarHBondContact O-CB 3.18Å; M812-N816 VanDerWaalsContact O-CG 3.25Å; M812-N816 PolarHBondContact O-N 3.15Å; M812-N816 VanDerWaalsContact O-N 3.12Å; M812-N816 PolarHBondContact O-OD1 3.23Å; M812-N816 VanDerWaalsContact O-OD1 3.1Å; K813-N816 PolarHBondContact O-N 3.19Å; L814-N816 VanDerWaalsContact C-N 3.31Å; L814-N816 PolarHBondContact O-N 3.04Å; N816-V818 VanDerWaalsContact C-N 3.34Å; N816-V818 PolarHBondContact O-N 3.14Å; N816-V818 VanDerWaalsContact O-N 3.11Å; N816-G819 PolarHBondContact O-N 3.07Å; N816-G819 VanDerWaalsContact O-N 3.12Å; N816-D820 PolarHBondContact O-N 3.02Å; N816-D820 VanDerWaalsContact O-N 3.11Å
817	T	69.2	Low	65.2	Low	44.5 Å²	44.5	59.7 Å²	59.7	27%	0.273	34%	0.341	S	S	.	.	H	α-helix	trans	-67.5	-18.6	-177	52.4	0	0	0	0	114.9	K813 L814 L815 I821	K813-T817 HydrophobicContact CD-CG2 3.96Å; K813-T817 HydrophobicContact CG-CG2 4.35Å; K813-T817 VanDerWaalsContact O-CB 3.31Å; K813-T817 WeakPolarHBondContact O-CB 3.37Å; K813-T817 VanDerWaalsContact O-CG2 3.3Å; K813-T817 WeakPolarHBondContact O-CG2 3.28Å; K813-T817 PolarHBondContact O-N 3.16Å; K813-T817 PolarHBondContact O-OG1 3.21Å; K813-T817 VanDerWaalsContact O-OG1 3.08Å; L814-T817 WeakPolarHBondContact CA-OG1 3.32Å; L814-T817 PolarHBondContact O-N 3.2Å; L814-T817 VanDerWaalsContact O-N 3.17Å; L814-T817 PolarHBondContact O-OG1 3.07Å; L814-T817 VanDerWaalsContact O-OG1 3.06Å; L815-T817 PolarHBondContact O-N 3.42Å; T817-I821 WeakPolarHBondContact O-CD1 3.35Å; T817-I821 VanDerWaalsContact O-CG1 3.27Å; T817-I821 WeakPolarHBondContact O-CG1 3.28Å
818	V	65.3	Low	63.8	Low	10 Å²	10	66.3 Å²	66.3	6%	0.061	37%	0.368	C	S	.	.	H	α-helix	trans	-88.1	-32.5	173.2	179.1	0	0	0	0	111.1	L814 L815 N816 D820 I821 L834 T1175 I1178	L814-V818 VanDerWaalsContact O-CG2 3.24Å; L814-V818 WeakPolarHBondContact O-CG2 3.41Å; L814-V818 PolarHBondContact O-N 3.19Å; L815-V818 PolarHBondContact O-N 3.02Å; N816-V818 VanDerWaalsContact C-N 3.34Å; N816-V818 PolarHBondContact O-N 3.14Å; N816-V818 VanDerWaalsContact O-N 3.11Å; V818-D820 VanDerWaalsContact C-N 3.32Å; V818-D820 PolarHBondContact O-N 2.9Å; V818-I821 HydrophobicContact CB-CD1 4.39Å; V818-I821 HydrophobicContact CG1-CD1 4.36Å; V818-I821 HydrophobicContact CG2-CD1 4.35Å; V818-I821 WeakPolarHBondContact O-CB 3.34Å; V818-I821 WeakPolarHBondContact O-CG1 3.16Å; V818-I821 PolarHBondContact O-N 3.12Å; V818-I821 VanDerWaalsContact O-N 3.12Å; V818-L834 HydrophobicContact CG1-CD1 4.49Å; V818-L834 HydrophobicContact CG2-CD1 3.81Å; V818-L834 VanDerWaalsContact CG2-CD1 3.5Å; V818-L834 HydrophobicContact CG2-CD2 3.39Å; V818-L834 VanDerWaalsContact CG2-CD2 3.44Å; V818-L834 HydrophobicContact CG2-CG 4.17Å; V818-T1175 HydrophobicContact CB-CG2 3.62Å; V818-T1175 VanDerWaalsContact CB-CG2 3.45Å; V818-T1175 VanDerWaalsContact CB-OG1 3.32Å; V818-T1175 WeakPolarHBondContact CB-OG1 3.3Å; V818-T1175 HydrophobicContact CG1-CG2 3.81Å; V818-T1175 WeakPolarHBondContact CG1-OG1 3.29Å; V818-T1175 HydrophobicContact CG2-CG2 4.17Å; V818-I1178 HydrophobicContact CG1-CB 4.36Å; V818-I1178 HydrophobicContact CG1-CD1 3.86Å; V818-I1178 HydrophobicContact CG1-CG2 4.23Å
819	G	59.8	Low	62.3	Low	39.75 Å²	39.75	71.7 Å²	71.7	41%	0.41	40%	0.396	S	S	.	.	H	α-helix	trans	-63.7	-27.9	173.9	0	0	0	0	0	113.8	L815 N816 I821 T1175	L815-G819 PolarHBondContact O-N 3.09Å; L815-G819 VanDerWaalsContact O-N 3.09Å; N816-G819 PolarHBondContact O-N 3.07Å; N816-G819 VanDerWaalsContact O-N 3.12Å; G819-I821 VanDerWaalsContact C-N 3.32Å; G819-I821 PolarHBondContact O-N 2.97Å; G819-T1175 VanDerWaalsContact CA-CG2 3.46Å; G819-T1175 PolarHBondContact N-OG1 3.24Å
820	D	58.4	Low	61.2	Low	132 Å²	132	72.9 Å²	72.9	71%	0.706	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-1.6	177.8	-66.4	-32	0	0	0	114.2	N816 V818 P822	N816-D820 PolarHBondContact O-N 3.02Å; N816-D820 VanDerWaalsContact O-N 3.11Å; V818-D820 VanDerWaalsContact C-N 3.32Å; V818-D820 PolarHBondContact O-N 2.9Å; D820-P822 VanDerWaalsContact O-CD 3.29Å; D820-P822 WeakPolarHBondContact O-CD 3.31Å
821	I	55.5	Low	60.2	Low	61.5 Å²	61.5	76.9 Å²	76.9	32%	0.315	42%	0.422	S	S	.	.			trans	-86.7	116.8	-175.2	-55.5	177.4	0	0	0	110.6	T817 V818 G819 L834	T817-I821 WeakPolarHBondContact O-CD1 3.35Å; T817-I821 VanDerWaalsContact O-CG1 3.27Å; T817-I821 WeakPolarHBondContact O-CG1 3.28Å; V818-I821 HydrophobicContact CB-CD1 4.39Å; V818-I821 HydrophobicContact CG1-CD1 4.36Å; V818-I821 HydrophobicContact CG2-CD1 4.35Å; V818-I821 WeakPolarHBondContact O-CB 3.34Å; V818-I821 WeakPolarHBondContact O-CG1 3.16Å; V818-I821 PolarHBondContact O-N 3.12Å; V818-I821 VanDerWaalsContact O-N 3.12Å; G819-I821 VanDerWaalsContact C-N 3.32Å; G819-I821 PolarHBondContact O-N 2.97Å; I821-L834 HydrophobicContact CD1-CD1 4.2Å
822	P	50.5	Low	59.2	Low	94.75 Å²	94.75	79.7 Å²	79.7	62%	0.615	44%	0.442	S	S	*	.			trans	-68.6	138.7	170.2	29.5	-33.8	0	0	0	110.5	D820 D824 A825	D820-P822 VanDerWaalsContact O-CD 3.29Å; D820-P822 WeakPolarHBondContact O-CD 3.31Å; P822-D824 VanDerWaalsContact C-N 3.26Å; P822-D824 PolarHBondContact O-N 3.16Å; P822-D824 VanDerWaalsContact O-N 3.11Å; P822-A825 HydrophobicContact CG-CB 4.14Å; P822-A825 PolarHBondContact O-N 3.15Å
823	E	51.8	Low	58.4	Low	185.25 Å²	185.25	82.2 Å²	82.2	87%	0.866	45%	0.452	S	S	*	.	S	Bend	trans	-62.3	-24.6	-169.6	-59.9	-162.6	126	0	0	114.2	A825	E823-A825 PolarHBondContact O-N 3Å
824	D	42.7	Very low	57.8	Low	154.75 Å²	154.75	78.6 Å²	78.6	83%	0.828	44%	0.436	S	S	*	.	S	Bend	trans	-87	70.8	-174.4	-73.3	-53	0	0	0	115.4	P822 N826	P822-D824 VanDerWaalsContact C-N 3.26Å; P822-D824 PolarHBondContact O-N 3.16Å; P822-D824 VanDerWaalsContact O-N 3.11Å; D824-N826 VanDerWaalsContact C-N 3.29Å; D824-N826 PolarHBondContact O-N 3.14Å
825	A	38.5	Very low	57.3	Low	74.25 Å²	74.25	79.9 Å²	79.9	61%	0.614	45%	0.446	S	S	*	.	S	Bend	trans	-15	43.1	177.1	0	0	0	0	0	117.4	P822 E823 S827	P822-A825 HydrophobicContact CG-CB 4.14Å; P822-A825 PolarHBondContact O-N 3.15Å; E823-A825 PolarHBondContact O-N 3Å; A825-S827 VanDerWaalsContact C-N 3.34Å; A825-S827 PolarHBondContact O-N 3.09Å
826	N	43	Very low	56.9	Low	114.5 Å²	114.5	83.8 Å²	83.8	61%	0.612	46%	0.46	S	S	*	.			trans	7.4	25.6	174.3	-84.8	-31.2	0	0	0	116.9	D824 K828 I829 S830	D824-N826 VanDerWaalsContact C-N 3.29Å; D824-N826 PolarHBondContact O-N 3.14Å; N826-K828 VanDerWaalsContact C-N 3.29Å; N826-K828 PolarHBondContact O-N 3.16Å; N826-I829 HydrophobicContact CB-CB 4.26Å; N826-I829 HydrophobicContact CB-CD1 4.17Å; N826-I829 HydrophobicContact CB-CG1 4.01Å; N826-I829 PolarHBondContact O-N 3.24Å; N826-I829 VanDerWaalsContact O-N 3.12Å; N826-S830 PolarHBondContact O-N 3.06Å; N826-S830 PolarHBondContact O-OG 3.11Å
827	S	53.4	Low	56.5	Low	65 Å²	65	79.6 Å²	79.6	46%	0.455	44%	0.438	S	S	.	.	H	α-helix	trans	-47.9	-33.7	-178	56.4	0	0	0	0	116.1	A825 I829 S830 Q831	A825-S827 VanDerWaalsContact C-N 3.34Å; A825-S827 PolarHBondContact O-N 3.09Å; S827-I829 PolarHBondContact O-N 3.32Å; S827-S830 PolarHBondContact O-N 2.76Å; S827-S830 PolarHBondContact O-OG 3.32Å; S827-Q831 VanDerWaalsContact O-CB 3.25Å; S827-Q831 WeakPolarHBondContact O-CB 3.36Å; S827-Q831 VanDerWaalsContact O-CG 3.29Å; S827-Q831 WeakPolarHBondContact O-CG 3.42Å; S827-Q831 PolarHBondContact O-N 3.11Å; S827-Q831 VanDerWaalsContact O-N 3.16Å
828	K	51.7	Low	56.4	Low	158 Å²	158	77.6 Å²	77.6	69%	0.687	43%	0.425	S	S	*	.	H	α-helix	trans	-66.6	-39.7	177.5	-68.5	-174.7	-178.1	179.2	0	113.4	N826 Q831 S832 I1152	N826-K828 VanDerWaalsContact C-N 3.29Å; N826-K828 PolarHBondContact O-N 3.16Å; K828-Q831 PolarHBondContact O-N 3.23Å; K828-S832 VanDerWaalsContact O-CB 3.32Å; K828-S832 WeakPolarHBondContact O-CB 3.38Å; K828-S832 PolarHBondContact O-N 3.04Å; K828-S832 VanDerWaalsContact O-N 3.09Å; K828-S832 PolarHBondContact O-OG 3.2Å; K828-S832 VanDerWaalsContact O-OG 3.1Å; K828-I1152 HydrophobicContact CD-CD1 3.92Å; K828-I1152 VanDerWaalsContact CE-CD1 3.42Å; K828-I1152 HydrophobicContact CG-CD1 4.47Å
829	I	51.2	Low	56.4	Low	117.25 Å²	117.25	78.7 Å²	78.7	60%	0.601	44%	0.435	S	S	*	.	H	α-helix	trans	-74.2	-43	-176.4	-62	176.5	0	0	0	109.5	N826 S827 Q831 S832 F833	N826-I829 HydrophobicContact CB-CB 4.26Å; N826-I829 HydrophobicContact CB-CD1 4.17Å; N826-I829 HydrophobicContact CB-CG1 4.01Å; N826-I829 PolarHBondContact O-N 3.24Å; N826-I829 VanDerWaalsContact O-N 3.12Å; S827-I829 PolarHBondContact O-N 3.32Å; I829-Q831 PolarHBondContact O-N 3.39Å; I829-S832 WeakPolarHBondContact O-CB 3.42Å; I829-S832 PolarHBondContact O-N 3.1Å; I829-S832 VanDerWaalsContact O-N 3.14Å; I829-F833 WeakPolarHBondContact O-CB 3.29Å; I829-F833 PolarHBondContact O-N 3.15Å
830	S	56.6	Low	56.7	Low	30 Å²	30	79 Å²	79	21%	0.21	43%	0.427	C	S	.	.	H	α-helix	trans	-63.9	-44.5	175.2	34.9	0	0	0	0	112.1	N826 S827 S832 F833 L834	N826-S830 PolarHBondContact O-N 3.06Å; N826-S830 PolarHBondContact O-OG 3.11Å; S827-S830 PolarHBondContact O-N 2.76Å; S827-S830 PolarHBondContact O-OG 3.32Å; S830-S832 VanDerWaalsContact C-N 3.31Å; S830-S832 PolarHBondContact O-N 3.14Å; S830-F833 PolarHBondContact O-N 3.09Å; S830-L834 WeakPolarHBondContact O-CB 3.42Å; S830-L834 WeakPolarHBondContact O-CD1 3.33Å; S830-L834 VanDerWaalsContact O-CG 3.26Å; S830-L834 WeakPolarHBondContact O-CG 3.14Å; S830-L834 PolarHBondContact O-N 2.98Å
831	Q	58.5	Low	57.2	Low	99.5 Å²	99.5	73.3 Å²	73.3	47%	0.465	40%	0.398	S	S	.	.	H	α-helix	trans	-60.3	-38.3	172.6	-76.5	178	-8.1	0	0	112.6	S827 K828 I829 L834 S835 I1178	S827-Q831 VanDerWaalsContact O-CB 3.25Å; S827-Q831 WeakPolarHBondContact O-CB 3.36Å; S827-Q831 VanDerWaalsContact O-CG 3.29Å; S827-Q831 WeakPolarHBondContact O-CG 3.42Å; S827-Q831 PolarHBondContact O-N 3.11Å; S827-Q831 VanDerWaalsContact O-N 3.16Å; K828-Q831 PolarHBondContact O-N 3.23Å; I829-Q831 PolarHBondContact O-N 3.39Å; Q831-L834 PolarHBondContact O-N 3.13Å; Q831-S835 VanDerWaalsContact O-CB 3.31Å; Q831-S835 WeakPolarHBondContact O-CB 3.35Å; Q831-S835 PolarHBondContact O-N 3.2Å; Q831-S835 PolarHBondContact O-OG 2.92Å; Q831-I1178 HydrophobicContact CG-CG2 4.37Å
832	S	58.3	Low	58.1	Low	59 Å²	59	72.3 Å²	72.3	41%	0.413	39%	0.393	S	S	.	.	H	α-helix	trans	-64.1	-46.6	175.7	-61.1	0	0	0	0	111.7	K828 I829 S830 L834 S835 W836	K828-S832 VanDerWaalsContact O-CB 3.32Å; K828-S832 WeakPolarHBondContact O-CB 3.38Å; K828-S832 PolarHBondContact O-N 3.04Å; K828-S832 VanDerWaalsContact O-N 3.09Å; K828-S832 PolarHBondContact O-OG 3.2Å; K828-S832 VanDerWaalsContact O-OG 3.1Å; I829-S832 WeakPolarHBondContact O-CB 3.42Å; I829-S832 PolarHBondContact O-N 3.1Å; I829-S832 VanDerWaalsContact O-N 3.14Å; S830-S832 VanDerWaalsContact C-N 3.31Å; S830-S832 PolarHBondContact O-N 3.14Å; S832-L834 VanDerWaalsContact C-N 3.35Å; S832-L834 PolarHBondContact O-N 3.18Å; S832-S835 PolarHBondContact O-N 3.01Å; S832-S835 PolarHBondContact O-OG 3.18Å; S832-W836 WeakPolarHBondContact O-CB 3.23Å; S832-W836 PolarHBondContact O-N 3.32Å; S832-W836 VanDerWaalsContact O-N 3.11Å
833	F	61.5	Low	59.1	Low	99 Å²	99	68.3 Å²	68.3	43%	0.434	37%	0.367	S	S	.	.	H	α-helix	trans	-62.4	-43.2	176.8	-175.8	-89.9	0	0	0	112.4	M538 L814 I829 S830 S835 W836 T837	M538-F833 HydrophobicContact CE-CD2 3.85Å; M538-F833 HydrophobicContact CE-CE1 4.31Å; M538-F833 HydrophobicContact CE-CE2 3.39Å; M538-F833 VanDerWaalsContact CE-CE2 3.42Å; M538-F833 HydrophobicContact CE-CZ 3.86Å; M538-F833 HydrophobicContact CG-CE2 4.28Å; M538-F833 HydrophobicContact CG-CZ 4.24Å; M538-F833 HydrophobicContact SD-CD2 4.21Å; M538-F833 HydrophobicContact SD-CE2 3.5Å; M538-F833 VanDerWaalsContact SD-CE2 3.54Å; M538-F833 WeakPolarHBondContact SD-CE2 3.4Å; M538-F833 HydrophobicContact SD-CZ 4.04Å; L814-F833 HydrophobicContact CD2-CD1 4.17Å; L814-F833 HydrophobicContact CD2-CE1 3.79Å; I829-F833 WeakPolarHBondContact O-CB 3.29Å; I829-F833 PolarHBondContact O-N 3.15Å; S830-F833 PolarHBondContact O-N 3.09Å; F833-S835 VanDerWaalsContact C-N 3.33Å; F833-S835 PolarHBondContact O-N 2.96Å; F833-W836 AromaticContact CD2-CE3 3.93Å; F833-W836 HydrophobicContact CD2-CE3 3.99Å; F833-W836 AromaticContact CD2-CZ3 3.94Å; F833-W836 HydrophobicContact CD2-CZ3 3.97Å; F833-W836 HydrophobicContact CE1-CZ3 4.49Å; F833-W836 AromaticContact CE2-CE3 3.86Å; F833-W836 HydrophobicContact CE2-CE3 3.98Å; F833-W836 HydrophobicContact CE2-CH2 4.37Å; F833-W836 AromaticContact CE2-CZ3 3.5Å; F833-W836 HydrophobicContact CE2-CZ3 3.5Å; F833-W836 VanDerWaalsContact CE2-CZ3 3.43Å; F833-W836 HydrophobicContact CG-CE3 4.43Å; F833-W836 HydrophobicContact CZ-CE3 4.29Å; F833-W836 AromaticContact CZ-CZ3 3.73Å; F833-W836 HydrophobicContact CZ-CZ3 4.04Å; F833-W836 WeakPolarHBondContact O-CA 3.49Å; F833-W836 WeakPolarHBondContact O-CB 3.29Å; F833-W836 PolarHBondContact O-N 3.04Å; F833-W836 VanDerWaalsContact O-N 3.09Å; F833-T837 HydrophobicContact CD1-CG2 4.18Å; F833-T837 HydrophobicContact CE1-CG2 4.07Å; F833-T837 HydrophobicContact CZ-CG2 4.37Å; F833-T837 WeakPolarHBondContact O-CB 3.2Å; F833-T837 WeakPolarHBondContact O-CG2 3.4Å; F833-T837 PolarHBondContact O-N 3.31Å; F833-T837 PolarHBondContact O-OG1 3Å; F833-T837 VanDerWaalsContact O-OG1 3.12Å
834	L	65.6	Low	60.3	Low	7 Å²	7	60 Å²	60	4%	0.037	33%	0.328	C	S	.	.	H	α-helix	trans	-65.3	-43.4	176.5	-83.9	148.5	0	0	0	111.6	L814 V818 I821 S830 Q831 S832 W836 T837 I838 I1178 I1179	L814-L834 HydrophobicContact CD2-CD1 3.79Å; L814-L834 HydrophobicContact CD2-CD2 3.82Å; V818-L834 HydrophobicContact CG1-CD1 4.49Å; V818-L834 HydrophobicContact CG2-CD1 3.81Å; V818-L834 VanDerWaalsContact CG2-CD1 3.5Å; V818-L834 HydrophobicContact CG2-CD2 3.39Å; V818-L834 VanDerWaalsContact CG2-CD2 3.44Å; V818-L834 HydrophobicContact CG2-CG 4.17Å; I821-L834 HydrophobicContact CD1-CD1 4.2Å; S830-L834 WeakPolarHBondContact O-CB 3.42Å; S830-L834 WeakPolarHBondContact O-CD1 3.33Å; S830-L834 VanDerWaalsContact O-CG 3.26Å; S830-L834 WeakPolarHBondContact O-CG 3.14Å; S830-L834 PolarHBondContact O-N 2.98Å; Q831-L834 PolarHBondContact O-N 3.13Å; S832-L834 VanDerWaalsContact C-N 3.35Å; S832-L834 PolarHBondContact O-N 3.18Å; L834-W836 VanDerWaalsContact C-N 3.32Å; L834-W836 PolarHBondContact O-N 3.3Å; L834-T837 WeakPolarHBondContact CA-OG1 3.28Å; L834-T837 PolarHBondContact O-N 3.13Å; L834-T837 PolarHBondContact O-OG1 3.13Å; L834-T837 VanDerWaalsContact O-OG1 3.12Å; L834-I838 HydrophobicContact CD2-CD1 4.39Å; L834-I838 HydrophobicContact CG-CD1 4.4Å; L834-I838 VanDerWaalsContact O-CB 3.27Å; L834-I838 WeakPolarHBondContact O-CB 3.31Å; L834-I838 WeakPolarHBondContact O-CD1 3.26Å; L834-I838 VanDerWaalsContact O-CG1 3.23Å; L834-I838 WeakPolarHBondContact O-CG1 3.38Å; L834-I838 PolarHBondContact O-N 3.12Å; L834-I1178 HydrophobicContact CD1-CG2 4.31Å; L834-I1178 HydrophobicContact CD2-CB 3.75Å; L834-I1178 HydrophobicContact CD2-CG2 3.48Å; L834-I1178 VanDerWaalsContact CD2-CG2 3.48Å; L834-I1179 HydrophobicContact CD2-CG1 3.7Å
835	S	64.2	Low	62.1	Low	31.5 Å²	31.5	52.8 Å²	52.8	22%	0.22	29%	0.29	C	S	.	.	H	α-helix	trans	-59.9	-38.4	175.5	94.3	0	0	0	0	112.3	Q831 S832 F833 I838 A839 I1186 M1604	Q831-S835 VanDerWaalsContact O-CB 3.31Å; Q831-S835 WeakPolarHBondContact O-CB 3.35Å; Q831-S835 PolarHBondContact O-N 3.2Å; Q831-S835 PolarHBondContact O-OG 2.92Å; S832-S835 PolarHBondContact O-N 3.01Å; S832-S835 PolarHBondContact O-OG 3.18Å; F833-S835 VanDerWaalsContact C-N 3.33Å; F833-S835 PolarHBondContact O-N 2.96Å; S835-I838 CarbonylContact O-C 3.48Å; S835-A839 WeakPolarHBondContact O-CB 3.32Å; S835-A839 PolarHBondContact O-N 3.3Å; S835-A839 VanDerWaalsContact O-N 3.08Å; S835-I1186 WeakPolarHBondContact OG-CD1 3.2Å; S835-M1604 WeakPolarHBondContact OG-CE 3.47Å
836	W	65.2	Low	64.1	Low	86.75 Å²	86.75	49.3 Å²	49.3	33%	0.329	26%	0.261	S	S	.	.	H	α-helix	trans	-72.1	-43.7	177.7	-179.1	81.2	0	0	0	112.6	M538 S832 F833 L834 I838 A839 L840 M1604	M538-W836 HydrophobicContact CE-CD2 4.48Å; M538-W836 HydrophobicContact CE-CE3 3.58Å; M538-W836 HydrophobicContact CE-CH2 4.18Å; M538-W836 HydrophobicContact CE-CZ3 3.45Å; M538-W836 HydrophobicContact CG-CZ3 4.33Å; M538-W836 HydrophobicContact SD-CZ3 4.48Å; S832-W836 WeakPolarHBondContact O-CB 3.23Å; S832-W836 PolarHBondContact O-N 3.32Å; S832-W836 VanDerWaalsContact O-N 3.11Å; F833-W836 AromaticContact CD2-CE3 3.93Å; F833-W836 HydrophobicContact CD2-CE3 3.99Å; F833-W836 AromaticContact CD2-CZ3 3.94Å; F833-W836 HydrophobicContact CD2-CZ3 3.97Å; F833-W836 HydrophobicContact CE1-CZ3 4.49Å; F833-W836 AromaticContact CE2-CE3 3.86Å; F833-W836 HydrophobicContact CE2-CE3 3.98Å; F833-W836 HydrophobicContact CE2-CH2 4.37Å; F833-W836 AromaticContact CE2-CZ3 3.5Å; F833-W836 HydrophobicContact CE2-CZ3 3.5Å; F833-W836 VanDerWaalsContact CE2-CZ3 3.43Å; F833-W836 HydrophobicContact CG-CE3 4.43Å; F833-W836 HydrophobicContact CZ-CE3 4.29Å; F833-W836 AromaticContact CZ-CZ3 3.73Å; F833-W836 HydrophobicContact CZ-CZ3 4.04Å; F833-W836 WeakPolarHBondContact O-CA 3.49Å; F833-W836 WeakPolarHBondContact O-CB 3.29Å; F833-W836 PolarHBondContact O-N 3.04Å; F833-W836 VanDerWaalsContact O-N 3.09Å; L834-W836 VanDerWaalsContact C-N 3.32Å; L834-W836 PolarHBondContact O-N 3.3Å; W836-I838 VanDerWaalsContact C-N 3.33Å; W836-I838 PolarHBondContact O-N 3.02Å; W836-A839 WeakPolarHBondContact O-CB 3.2Å; W836-A839 PolarHBondContact O-N 3.3Å; W836-A839 VanDerWaalsContact O-N 3.13Å; W836-L840 HydrophobicContact CD2-CD1 4.2Å; W836-L840 HydrophobicContact CE3-CD1 3.92Å; W836-L840 HydrophobicContact CE3-CG 4.47Å; W836-L840 HydrophobicContact CG-CD1 4.5Å; W836-L840 HydrophobicContact CH2-CD1 3.83Å; W836-L840 HydrophobicContact CZ2-CD1 4Å; W836-L840 VanDerWaalsContact CZ2-CD1 3.42Å; W836-L840 HydrophobicContact CZ2-CD2 4.47Å; W836-L840 HydrophobicContact CZ3-CD1 3.76Å; W836-L840 VanDerWaalsContact CZ3-CD1 3.47Å; W836-L840 HydrophobicContact CZ3-CG 4.49Å; W836-L840 WeakPolarHBondContact O-CD1 3.26Å; W836-L840 WeakPolarHBondContact O-CG 3.28Å; W836-L840 PolarHBondContact O-N 2.98Å; W836-L840 VanDerWaalsContact O-N 3.12Å; W836-M1604 HydrophobicContact CB-CE 4.16Å
837	T	65	Low	65.8	Low	8 Å²	8	43.9 Å²	43.9	5%	0.049	23%	0.232	C	C	.	.	H	α-helix	trans	-67.5	-34.3	176.1	25.7	0	0	0	0	112.6	M538 L810 L814 F833 L834 A839 L840 V841	M538-T837 HydrophobicContact CE-CG2 3.61Å; L810-T837 HydrophobicContact CD1-CG2 4.08Å; L810-T837 HydrophobicContact CD2-CG2 4.19Å; L810-T837 HydrophobicContact CG-CG2 4.19Å; L814-T837 HydrophobicContact CD1-CG2 4.22Å; L814-T837 HydrophobicContact CD2-CG2 3.97Å; L814-T837 WeakPolarHBondContact CD2-OG1 3.4Å; L814-T837 HydrophobicContact CG-CG2 4.23Å; F833-T837 HydrophobicContact CD1-CG2 4.18Å; F833-T837 HydrophobicContact CE1-CG2 4.07Å; F833-T837 HydrophobicContact CZ-CG2 4.37Å; F833-T837 WeakPolarHBondContact O-CB 3.2Å; F833-T837 WeakPolarHBondContact O-CG2 3.4Å; F833-T837 PolarHBondContact O-N 3.31Å; F833-T837 PolarHBondContact O-OG1 3Å; F833-T837 VanDerWaalsContact O-OG1 3.12Å; L834-T837 WeakPolarHBondContact CA-OG1 3.28Å; L834-T837 PolarHBondContact O-N 3.13Å; L834-T837 PolarHBondContact O-OG1 3.13Å; L834-T837 VanDerWaalsContact O-OG1 3.12Å; T837-A839 VanDerWaalsContact C-N 3.31Å; T837-A839 PolarHBondContact O-N 3.44Å; T837-L840 PolarHBondContact O-N 3.24Å; T837-V841 PolarHBondContact O-N 3.4Å
838	I	68.4	Low	67.2	Low	2 Å²	2	42.6 Å²	42.6	1%	0.01	22%	0.217	C	C	.	.	H	α-helix	trans	-66.4	-35.3	169.7	-70.8	166.6	0	0	0	111.2	L814 L834 S835 W836 L840 V841 P843 L846 I1179 C1182 I1183 I1186 F1187	L814-I838 HydrophobicContact CD1-CG1 4.35Å; L834-I838 HydrophobicContact CD2-CD1 4.39Å; L834-I838 HydrophobicContact CG-CD1 4.4Å; L834-I838 VanDerWaalsContact O-CB 3.27Å; L834-I838 WeakPolarHBondContact O-CB 3.31Å; L834-I838 WeakPolarHBondContact O-CD1 3.26Å; L834-I838 VanDerWaalsContact O-CG1 3.23Å; L834-I838 WeakPolarHBondContact O-CG1 3.38Å; L834-I838 PolarHBondContact O-N 3.12Å; S835-I838 CarbonylContact O-C 3.48Å; W836-I838 VanDerWaalsContact C-N 3.33Å; W836-I838 PolarHBondContact O-N 3.02Å; I838-L840 VanDerWaalsContact C-N 3.27Å; I838-L840 PolarHBondContact O-N 2.97Å; I838-V841 PolarHBondContact O-N 3.12Å; I838-V841 VanDerWaalsContact O-N 3.15Å; I838-P843 HydrophobicContact CG2-CB 3.73Å; I838-P843 HydrophobicContact CG2-CG 3.72Å; I838-L846 HydrophobicContact CB-CD2 4.35Å; I838-L846 HydrophobicContact CG1-CD1 4.04Å; I838-L846 HydrophobicContact CG1-CD2 4.06Å; I838-L846 HydrophobicContact CG2-CD2 4.01Å; I838-I1179 HydrophobicContact CD1-CB 4.28Å; I838-I1179 HydrophobicContact CD1-CG1 4.29Å; I838-I1179 HydrophobicContact CD1-CG2 4.1Å; I838-I1179 HydrophobicContact CG1-CG2 4.5Å; I838-C1182 HydrophobicContact CD1-CB 3.7Å; I838-I1183 HydrophobicContact CG2-CD1 4.48Å; I838-I1183 HydrophobicContact CG2-CG1 3.8Å; I838-I1186 HydrophobicContact CG2-CD1 4.43Å; I838-F1187 HydrophobicContact CG2-CE2 4.32Å
839	A	64.9	Low	68.8	Low	32.75 Å²	32.75	35.1 Å²	35.1	27%	0.271	18%	0.184	S	C	.	.	H	α-helix	trans	-73.8	-17.8	179.3	0	0	0	0	0	114.6	S835 W836 T837 V841 F1187 I1611 F1766	S835-A839 WeakPolarHBondContact O-CB 3.32Å; S835-A839 PolarHBondContact O-N 3.3Å; S835-A839 VanDerWaalsContact O-N 3.08Å; W836-A839 WeakPolarHBondContact O-CB 3.2Å; W836-A839 PolarHBondContact O-N 3.3Å; W836-A839 VanDerWaalsContact O-N 3.13Å; T837-A839 VanDerWaalsContact C-N 3.31Å; T837-A839 PolarHBondContact O-N 3.44Å; A839-V841 VanDerWaalsContact C-N 3.33Å; A839-V841 PolarHBondContact O-N 3.49Å; A839-F1187 HydrophobicContact CB-CZ 4.32Å; A839-I1611 HydrophobicContact CB-CD1 3.3Å; A839-I1611 HydrophobicContact CB-CG1 3.77Å; A839-F1766 HydrophobicContact CB-CE1 4.37Å; A839-F1766 HydrophobicContact CB-CZ 4.12Å
840	L	65	Low	70.2	Confident	46 Å²	46	29.6 Å²	29.6	24%	0.241	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-18.5	177.4	-77.6	170.2	0	0	0	113.4	L535 W836 T837 I838	L535-L840 HydrophobicContact CD2-CB 3.73Å; L535-L840 HydrophobicContact CD2-CD1 4.42Å; L535-L840 HydrophobicContact CD2-CD2 4.06Å; L535-L840 HydrophobicContact CD2-CG 4.28Å; L535-L840 WeakPolarHBondContact CD2-O 3.43Å; W836-L840 HydrophobicContact CD2-CD1 4.2Å; W836-L840 HydrophobicContact CE3-CD1 3.92Å; W836-L840 HydrophobicContact CE3-CG 4.47Å; W836-L840 HydrophobicContact CG-CD1 4.5Å; W836-L840 HydrophobicContact CH2-CD1 3.83Å; W836-L840 HydrophobicContact CZ2-CD1 4Å; W836-L840 VanDerWaalsContact CZ2-CD1 3.42Å; W836-L840 HydrophobicContact CZ2-CD2 4.47Å; W836-L840 HydrophobicContact CZ3-CD1 3.76Å; W836-L840 VanDerWaalsContact CZ3-CD1 3.47Å; W836-L840 HydrophobicContact CZ3-CG 4.49Å; W836-L840 WeakPolarHBondContact O-CD1 3.26Å; W836-L840 WeakPolarHBondContact O-CG 3.28Å; W836-L840 PolarHBondContact O-N 2.98Å; W836-L840 VanDerWaalsContact O-N 3.12Å; T837-L840 PolarHBondContact O-N 3.24Å; I838-L840 VanDerWaalsContact C-N 3.27Å; I838-L840 PolarHBondContact O-N 2.97Å
841	V	70.6	Confident	71.3	Confident	13 Å²	13	29.1 Å²	29.1	8%	0.079	15%	0.151	C	C	.	.	S	Bend	trans	-113.4	149.2	178.9	179.4	0	0	0	0	109.1	L535 V807 L810 T837 I838 A839 P843 L845 L846	L535-V841 HydrophobicContact CD2-CG2 4.11Å; V807-V841 HydrophobicContact CG1-CG1 3.8Å; V807-V841 HydrophobicContact CG2-CG1 4.43Å; L810-V841 HydrophobicContact CD2-CG2 3.61Å; T837-V841 PolarHBondContact O-N 3.4Å; I838-V841 PolarHBondContact O-N 3.12Å; I838-V841 VanDerWaalsContact O-N 3.15Å; A839-V841 VanDerWaalsContact C-N 3.33Å; A839-V841 PolarHBondContact O-N 3.49Å; V841-P843 VanDerWaalsContact O-CD 3.26Å; V841-P843 WeakPolarHBondContact O-CD 3.35Å; V841-P843 VanDerWaalsContact O-N 3.1Å; V841-L845 HydrophobicContact CG1-CB 4.5Å; V841-L845 HydrophobicContact CG1-CD2 4.22Å; V841-L846 HydrophobicContact CB-CD1 4.12Å; V841-L846 HydrophobicContact CB-CD2 4.44Å; V841-L846 HydrophobicContact CB-CG 4.17Å; V841-L846 HydrophobicContact CG1-CB 4.28Å; V841-L846 HydrophobicContact CG1-CD1 4.31Å; V841-L846 HydrophobicContact CG1-CD2 4.03Å; V841-L846 HydrophobicContact CG1-CG 3.8Å
842	D	73.5	Confident	72.5	Confident	40.5 Å²	40.5	24.9 Å²	24.9	22%	0.217	13%	0.132	C	C	.	.			trans	-58.4	115.1	171	-178.7	-43.1	0	0	0	109.7	R694 L844 L845 L846	R694-D842 IonicContact CZ-OD1 2.7Å; R694-D842 IonicContact CZ-OD2 2.76Å; R694-D842 VanDerWaalsContact CZ-OD2 3.3Å; R694-D842 IonicContact NH1-OD1 2.69Å; R694-D842 PolarHBondContact NH1-OD1 2.82Å; R694-D842 IonicContact NH1-OD2 2.84Å; R694-D842 PolarHBondContact NH1-OD2 3.27Å; R694-D842 IonicContact NH2-OD1 3.28Å; R694-D842 PolarHBondContact NH2-OD1 3.39Å; R694-D842 IonicContact NH2-OD2 2.89Å; R694-D842 PolarHBondContact NH2-OD2 3.09Å; D842-L844 PolarHBondContact O-N 3.12Å; D842-L844 VanDerWaalsContact O-N 3.13Å; D842-L844 WeakPolarHBondContact OD1-CB 3.44Å; D842-L844 PolarHBondContact OD1-N 3.25Å; D842-L845 HydrophobicContact CB-CB 4.1Å; D842-L845 WeakPolarHBondContact O-CA 3.47Å; D842-L845 VanDerWaalsContact O-CB 3.25Å; D842-L845 WeakPolarHBondContact O-CB 3.29Å; D842-L845 PolarHBondContact O-N 3.17Å; D842-L845 WeakPolarHBondContact OD1-CB 3.4Å; D842-L845 PolarHBondContact OD1-N 2.86Å; D842-L845 VanDerWaalsContact OD1-N 3.12Å; D842-L846 PolarHBondContact O-N 2.9Å
843	P	71.4	Confident	73.5	Confident	10.5 Å²	10.5	22.8 Å²	22.8	7%	0.068	12%	0.115	C	C	.	.	H	α-helix	trans	-62.5	-27.2	-174.4	21	-31.3	0	0	0	112.7	I838 V841 L845 L846 L847 I1183 F1187 I1194	I838-P843 HydrophobicContact CG2-CB 3.73Å; I838-P843 HydrophobicContact CG2-CG 3.72Å; V841-P843 VanDerWaalsContact O-CD 3.26Å; V841-P843 WeakPolarHBondContact O-CD 3.35Å; V841-P843 VanDerWaalsContact O-N 3.1Å; P843-L845 VanDerWaalsContact C-N 3.34Å; P843-L845 PolarHBondContact O-N 3.21Å; P843-L846 PolarHBondContact O-N 3.22Å; P843-L847 VanDerWaalsContact O-CB 3.23Å; P843-L847 WeakPolarHBondContact O-CB 3.33Å; P843-L847 PolarHBondContact O-N 3.29Å; P843-I1183 HydrophobicContact CB-CD1 3.61Å; P843-I1183 HydrophobicContact CB-CG1 3.5Å; P843-I1183 VanDerWaalsContact CB-CG1 3.5Å; P843-I1183 HydrophobicContact CB-CG2 4.37Å; P843-I1183 HydrophobicContact CG-CG1 4.5Å; P843-F1187 HydrophobicContact CB-CB 4.47Å; P843-F1187 HydrophobicContact CB-CD2 3.53Å; P843-F1187 VanDerWaalsContact CB-CD2 3.49Å; P843-F1187 HydrophobicContact CB-CE2 3.64Å; P843-F1187 HydrophobicContact CB-CG 4.04Å; P843-F1187 HydrophobicContact CB-CZ 4.22Å; P843-F1187 HydrophobicContact CG-CB 4.38Å; P843-F1187 HydrophobicContact CG-CD1 3.88Å; P843-F1187 HydrophobicContact CG-CD2 3.87Å; P843-F1187 HydrophobicContact CG-CE1 3.95Å; P843-F1187 HydrophobicContact CG-CE2 3.75Å; P843-F1187 HydrophobicContact CG-CG 3.76Å; P843-F1187 HydrophobicContact CG-CZ 3.92Å; P843-I1194 HydrophobicContact CB-CD1 4.24Å; P843-I1194 HydrophobicContact CG-CD1 3.79Å
844	L	76.1	Confident	74.2	Confident	11 Å²	11	18.3 Å²	18.3	6%	0.058	10%	0.095	C	C	.	.	H	α-helix	trans	-68.2	-34.8	175.3	-170.7	63.9	0	0	0	111.6	D842 R848 G1193 I1194 V1197	D842-L844 PolarHBondContact O-N 3.12Å; D842-L844 VanDerWaalsContact O-N 3.13Å; D842-L844 WeakPolarHBondContact OD1-CB 3.44Å; D842-L844 PolarHBondContact OD1-N 3.25Å; L844-R848 WeakPolarHBondContact O-CB 3.39Å; L844-R848 VanDerWaalsContact O-CD 3.26Å; L844-R848 WeakPolarHBondContact O-CD 3.4Å; L844-R848 WeakPolarHBondContact O-CG 3.39Å; L844-R848 PolarHBondContact O-N 3.05Å; L844-G1193 WeakPolarHBondContact CD1-O 3.25Å; L844-I1194 HydrophobicContact CB-CG1 4.27Å; L844-I1194 HydrophobicContact CD1-CG1 4.23Å; L844-V1197 HydrophobicContact CD1-CB 4Å; L844-V1197 HydrophobicContact CD1-CG1 3.78Å; L844-V1197 HydrophobicContact CD1-CG2 3.55Å; L844-V1197 VanDerWaalsContact CD1-CG2 3.46Å; L844-V1197 HydrophobicContact CD2-CG2 3.95Å; L844-V1197 HydrophobicContact CG-CB 4.31Å; L844-V1197 HydrophobicContact CG-CG1 4.16Å; L844-V1197 HydrophobicContact CG-CG2 3.86Å
845	L	81.4	Confident	74.7	Confident	3.75 Å²	3.75	19.8 Å²	19.8	2%	0.02	11%	0.106	C	C	.	.	H	α-helix	trans	-72.8	-44.3	175.5	-175	64	0	0	0	111.2	L689 Y739 V807 V841 D842 P843 L847 R848 L849	L689-L845 HydrophobicContact CD2-CD2 3.66Å; Y739-L845 HydrophobicContact CD1-CD1 3.54Å; Y739-L845 HydrophobicContact CD2-CD1 4.33Å; Y739-L845 HydrophobicContact CE1-CD1 4Å; Y739-L845 HydrophobicContact CG-CD1 3.71Å; V807-L845 HydrophobicContact CB-CD2 4.5Å; V807-L845 HydrophobicContact CG1-CD2 4Å; V807-L845 HydrophobicContact CG1-CG 4.3Å; V807-L845 HydrophobicContact CG2-CD2 4.2Å; V841-L845 HydrophobicContact CG1-CB 4.5Å; V841-L845 HydrophobicContact CG1-CD2 4.22Å; D842-L845 HydrophobicContact CB-CB 4.1Å; D842-L845 WeakPolarHBondContact O-CA 3.47Å; D842-L845 VanDerWaalsContact O-CB 3.25Å; D842-L845 WeakPolarHBondContact O-CB 3.29Å; D842-L845 PolarHBondContact O-N 3.17Å; D842-L845 WeakPolarHBondContact OD1-CB 3.4Å; D842-L845 PolarHBondContact OD1-N 2.86Å; D842-L845 VanDerWaalsContact OD1-N 3.12Å; P843-L845 VanDerWaalsContact C-N 3.34Å; P843-L845 PolarHBondContact O-N 3.21Å; L845-L847 PolarHBondContact O-N 3.12Å; L845-R848 PolarHBondContact O-N 3.06Å; L845-L849 HydrophobicContact CG-CD1 4.44Å; L845-L849 PolarHBondContact O-N 3.15Å; L845-L849 VanDerWaalsContact O-N 3.09Å
846	L	80.5	Confident	75.2	Confident	1 Å²	1	20.4 Å²	20.4	1%	0.005	10%	0.104	C	C	.	.	H	α-helix	trans	-61	-45.9	176	-151	85.6	0	0	0	111.1	V807 L811 I838 V841 D842 P843 R848 L849 L850 I1179 I1183	V807-L846 HydrophobicContact CG1-CD2 4.25Å; L811-L846 HydrophobicContact CB-CD1 4.09Å; L811-L846 HydrophobicContact CB-CD2 4.42Å; L811-L846 HydrophobicContact CD1-CD1 4Å; L811-L846 HydrophobicContact CD1-CD2 4.46Å; L811-L846 HydrophobicContact CG-CD1 4.44Å; I838-L846 HydrophobicContact CB-CD2 4.35Å; I838-L846 HydrophobicContact CG1-CD1 4.04Å; I838-L846 HydrophobicContact CG1-CD2 4.06Å; I838-L846 HydrophobicContact CG2-CD2 4.01Å; V841-L846 HydrophobicContact CB-CD1 4.12Å; V841-L846 HydrophobicContact CB-CD2 4.44Å; V841-L846 HydrophobicContact CB-CG 4.17Å; V841-L846 HydrophobicContact CG1-CB 4.28Å; V841-L846 HydrophobicContact CG1-CD1 4.31Å; V841-L846 HydrophobicContact CG1-CD2 4.03Å; V841-L846 HydrophobicContact CG1-CG 3.8Å; D842-L846 PolarHBondContact O-N 2.9Å; P843-L846 PolarHBondContact O-N 3.22Å; L846-R848 VanDerWaalsContact C-N 3.32Å; L846-R848 PolarHBondContact O-N 3.04Å; L846-L849 PolarHBondContact O-N 3.1Å; L846-L850 HydrophobicContact CG-CD1 4.04Å; L846-L850 WeakPolarHBondContact O-CB 3.34Å; L846-L850 WeakPolarHBondContact O-CD1 3.37Å; L846-L850 VanDerWaalsContact O-CG 3.26Å; L846-L850 WeakPolarHBondContact O-CG 3.33Å; L846-L850 PolarHBondContact O-N 3.14Å; L846-I1179 HydrophobicContact CB-CD1 4.49Å; L846-I1179 HydrophobicContact CD2-CG2 4.47Å; L846-I1183 HydrophobicContact CD2-CD1 4.12Å; L846-I1183 HydrophobicContact CD2-CG1 4.47Å; L846-I1183 HydrophobicContact CG-CD1 4.3Å
847	L	79	Confident	75.5	Confident	1 Å²	1	18.7 Å²	18.7	1%	0.005	10%	0.101	C	C	.	.	H	α-helix	trans	-61.8	-37.4	177.2	-174.2	62.3	0	0	0	112.5	P843 L845 L850 L851 I1179 L1180 I1183 I1194 V1197 L1198	P843-L847 VanDerWaalsContact O-CB 3.23Å; P843-L847 WeakPolarHBondContact O-CB 3.33Å; P843-L847 PolarHBondContact O-N 3.29Å; L845-L847 PolarHBondContact O-N 3.12Å; L847-L850 HydrophobicContact CD1-CD2 3.95Å; L847-L850 WeakPolarHBondContact O-CB 3.24Å; L847-L850 PolarHBondContact O-N 2.85Å; L847-L851 HydrophobicContact CD1-CD1 3.87Å; L847-L851 HydrophobicContact CD1-CG 3.97Å; L847-L851 HydrophobicContact CG-CD1 3.77Å; L847-L851 HydrophobicContact CG-CG 4.33Å; L847-L851 VanDerWaalsContact O-CB 3.29Å; L847-L851 WeakPolarHBondContact O-CB 3.25Å; L847-L851 WeakPolarHBondContact O-CD1 3.47Å; L847-L851 WeakPolarHBondContact O-CG 3.08Å; L847-L851 PolarHBondContact O-N 3.08Å; L847-I1179 HydrophobicContact CB-CG2 4.35Å; L847-I1179 HydrophobicContact CD1-CG2 4.5Å; L847-L1180 HydrophobicContact CD1-CD1 3.62Å; L847-L1180 HydrophobicContact CD1-CD2 3.57Å; L847-L1180 HydrophobicContact CD1-CG 4.09Å; L847-L1180 HydrophobicContact CD2-CG 4.47Å; L847-I1183 HydrophobicContact CB-CD1 4.27Å; L847-I1183 HydrophobicContact CD1-CD1 4.42Å; L847-I1183 HydrophobicContact CD2-CD1 3.91Å; L847-I1183 HydrophobicContact CG-CD1 4.46Å; L847-I1194 HydrophobicContact CD2-CG2 4.22Å; L847-V1197 HydrophobicContact CB-CG1 4.41Å; L847-V1197 HydrophobicContact CD2-CB 3.93Å; L847-V1197 HydrophobicContact CD2-CG1 3.75Å; L847-V1197 HydrophobicContact CG-CB 4.44Å; L847-V1197 HydrophobicContact CG-CG1 3.7Å; L847-L1198 HydrophobicContact CD1-CD2 4.37Å; L847-L1198 HydrophobicContact CD2-CD2 3.94Å; L847-L1198 HydrophobicContact CD2-CG 4.14Å
848	R	83.3	Confident	75.6	Confident	36.75 Å²	36.75	18.7 Å²	18.7	14%	0.139	10%	0.101	C	C	.	.	H	α-helix	trans	-67.7	-38.8	175	-75.4	166.6	178.4	-169.3	-6.1	113	I738 Y739 I740 G741 L844 L845 L846 L851 H852 V1197 E1200	I738-R848 HydrophobicContact CG2-CB 4.39Å; Y739-R848 PolarHBondContact O-NH1 3.02Å; I740-R848 PolarHBondContact O-NH1 3.45Å; G741-R848 VanDerWaalsContact CA-CZ 3.47Å; L844-R848 WeakPolarHBondContact O-CB 3.39Å; L844-R848 VanDerWaalsContact O-CD 3.26Å; L844-R848 WeakPolarHBondContact O-CD 3.4Å; L844-R848 WeakPolarHBondContact O-CG 3.39Å; L844-R848 PolarHBondContact O-N 3.05Å; L845-R848 PolarHBondContact O-N 3.06Å; L846-R848 VanDerWaalsContact C-N 3.32Å; L846-R848 PolarHBondContact O-N 3.04Å; R848-L851 PolarHBondContact O-N 3.35Å; R848-H852 WeakPolarHBondContact O-CB 3.5Å; R848-H852 PolarHBondContact O-N 3.13Å; R848-H852 VanDerWaalsContact O-N 3.07Å; R848-V1197 HydrophobicContact CG-CG1 4.32Å; R848-V1197 HydrophobicContact CG-CG2 4.34Å; R848-E1200 IonicContact CZ-OE2 2.93Å; R848-E1200 IonicContact NE-OE2 3.9Å; R848-E1200 PolarHBondContact NE-OE2 3.09Å; R848-E1200 IonicContact NH2-OE2 3.77Å; R848-E1200 PolarHBondContact NH2-OE2 3.16Å
849	L	84.8	Confident	75.2	Confident	0 Å²	0	18.9 Å²	18.9	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-68.8	-40.6	174.8	-75.4	169.8	0	0	0	111.9	I738 Y739 L752 F753 V807 E808 L811 L845 L846 H852 K853	I738-L849 HydrophobicContact CG2-CD2 4Å; Y739-L849 HydrophobicContact CE1-CD1 4.45Å; Y739-L849 HydrophobicContact CE1-CD2 4.32Å; L752-L849 HydrophobicContact CD1-CD2 3.72Å; F753-L849 HydrophobicContact CZ-CB 4.42Å; F753-L849 HydrophobicContact CZ-CD2 4.36Å; V807-L849 HydrophobicContact CB-CD1 4.12Å; V807-L849 HydrophobicContact CG1-CD1 3.58Å; E808-L849 HydrophobicContact CG-CD1 4.25Å; E808-L849 HydrophobicContact CG-CD2 3.95Å; L811-L849 HydrophobicContact CD2-CB 3.63Å; L845-L849 HydrophobicContact CG-CD1 4.44Å; L845-L849 PolarHBondContact O-N 3.15Å; L845-L849 VanDerWaalsContact O-N 3.09Å; L846-L849 PolarHBondContact O-N 3.1Å; L849-H852 WeakPolarHBondContact O-CB 3.48Å; L849-H852 PolarHBondContact O-N 3.15Å; L849-K853 PolarHBondContact O-N 3.33Å
850	L	79.8	Confident	74.5	Confident	3 Å²	3	24.2 Å²	24.2	2%	0.016	12%	0.121	C	C	.	.	H	α-helix	trans	-60.6	-47.6	173.1	-119.8	117.2	0	0	0	111.3	L811 L815 L846 L847 H852 K853 F854 T1175 L1176 I1179 L1180 I1183	L811-L850 HydrophobicContact CD1-CB 4.24Å; L811-L850 HydrophobicContact CD1-CD1 4.13Å; L811-L850 HydrophobicContact CD1-CD2 3.54Å; L811-L850 HydrophobicContact CD1-CG 3.93Å; L811-L850 HydrophobicContact CD2-CB 3.98Å; L811-L850 HydrophobicContact CD2-CD1 4.47Å; L811-L850 HydrophobicContact CD2-CD2 4.37Å; L811-L850 HydrophobicContact CD2-CG 4.2Å; L815-L850 HydrophobicContact CD1-CD1 4.1Å; L815-L850 HydrophobicContact CD2-CD1 3.87Å; L815-L850 HydrophobicContact CD2-CD2 4.46Å; L815-L850 HydrophobicContact CG-CD1 4.36Å; L846-L850 HydrophobicContact CG-CD1 4.04Å; L846-L850 WeakPolarHBondContact O-CB 3.34Å; L846-L850 WeakPolarHBondContact O-CD1 3.37Å; L846-L850 VanDerWaalsContact O-CG 3.26Å; L846-L850 WeakPolarHBondContact O-CG 3.33Å; L846-L850 PolarHBondContact O-N 3.14Å; L847-L850 HydrophobicContact CD1-CD2 3.95Å; L847-L850 WeakPolarHBondContact O-CB 3.24Å; L847-L850 PolarHBondContact O-N 2.85Å; L850-H852 VanDerWaalsContact C-N 3.3Å; L850-H852 PolarHBondContact O-N 3.24Å; L850-K853 WeakPolarHBondContact O-CB 3.42Å; L850-K853 PolarHBondContact O-N 3.19Å; L850-K853 VanDerWaalsContact O-N 3.12Å; L850-F854 HydrophobicContact CD2-CD2 4.38Å; L850-F854 HydrophobicContact CD2-CE2 3.98Å; L850-F854 HydrophobicContact CG-CD2 4.12Å; L850-F854 HydrophobicContact CG-CE2 4.06Å; L850-F854 WeakPolarHBondContact O-CB 3.39Å; L850-F854 VanDerWaalsContact O-CD2 3.25Å; L850-F854 WeakPolarHBondContact O-CD2 3.32Å; L850-F854 PolarHBondContact O-N 3.07Å; L850-T1175 HydrophobicContact CD2-CG2 4.08Å; L850-L1176 HydrophobicContact CD1-CD2 3.32Å; L850-L1176 HydrophobicContact CD2-CB 3.71Å; L850-L1176 HydrophobicContact CD2-CD1 4.31Å; L850-L1176 HydrophobicContact CD2-CD2 3.72Å; L850-L1176 VanDerWaalsContact CD2-CD2 3.43Å; L850-L1176 HydrophobicContact CD2-CG 3.86Å; L850-L1176 HydrophobicContact CG-CB 4.27Å; L850-L1176 HydrophobicContact CG-CD1 3.99Å; L850-L1176 HydrophobicContact CG-CD2 3.74Å; L850-L1176 HydrophobicContact CG-CG 4.1Å; L850-I1179 HydrophobicContact CD1-CB 4.33Å; L850-I1179 HydrophobicContact CD1-CD1 4.19Å; L850-I1179 HydrophobicContact CD1-CG2 3.68Å; L850-I1179 HydrophobicContact CD2-CD1 4.14Å; L850-I1179 HydrophobicContact CD2-CG2 4.22Å; L850-L1180 HydrophobicContact CD2-CD1 4.45Å; L850-L1180 HydrophobicContact CD2-CD2 3.69Å; L850-L1180 HydrophobicContact CD2-CG 3.79Å; L850-I1183 HydrophobicContact CD1-CD1 3.54Å; L850-I1183 VanDerWaalsContact CD1-CD1 3.43Å
851	L	80	Confident	73.3	Confident	19.5 Å²	19.5	25.5 Å²	25.5	10%	0.102	13%	0.128	C	C	.	.	H	α-helix	trans	-60.6	-38	176.6	-153.9	84.3	0	0	0	112	L847 R848 S855 L1176 V1197 E1200 T1201 L1204 F1205	L847-L851 HydrophobicContact CD1-CD1 3.87Å; L847-L851 HydrophobicContact CD1-CG 3.97Å; L847-L851 HydrophobicContact CG-CD1 3.77Å; L847-L851 HydrophobicContact CG-CG 4.33Å; L847-L851 VanDerWaalsContact O-CB 3.29Å; L847-L851 WeakPolarHBondContact O-CB 3.25Å; L847-L851 WeakPolarHBondContact O-CD1 3.47Å; L847-L851 WeakPolarHBondContact O-CG 3.08Å; L847-L851 PolarHBondContact O-N 3.08Å; R848-L851 PolarHBondContact O-N 3.35Å; L851-S855 WeakPolarHBondContact O-CB 3.38Å; L851-S855 PolarHBondContact O-N 3.36Å; L851-S855 PolarHBondContact O-OG 3.09Å; L851-L1176 HydrophobicContact CD2-CD1 4.08Å; L851-L1176 HydrophobicContact CD2-CD2 4.4Å; L851-V1197 HydrophobicContact CD2-CG1 4.21Å; L851-E1200 HydrophobicContact CD2-CB 4.05Å; L851-E1200 HydrophobicContact CD2-CG 4.12Å; L851-T1201 HydrophobicContact CD1-CG2 4.08Å; L851-T1201 WeakPolarHBondContact CD1-OG1 3.37Å; L851-T1201 HydrophobicContact CD2-CG2 3.91Å; L851-L1204 HydrophobicContact CB-CD2 3.78Å; L851-L1204 HydrophobicContact CD1-CB 4.26Å; L851-L1204 HydrophobicContact CD1-CD2 3.47Å; L851-L1204 VanDerWaalsContact CD1-CD2 3.47Å; L851-L1204 HydrophobicContact CD1-CG 4.46Å; L851-L1204 HydrophobicContact CD2-CD2 3.74Å; L851-L1204 HydrophobicContact CG-CD2 4.24Å; L851-F1205 HydrophobicContact CD2-CE1 3.9Å; L851-F1205 HydrophobicContact CD2-CZ 4.21Å
852	H	83.3	Confident	72.1	Confident	11.25 Å²	11.25	29.1 Å²	29.1	5%	0.052	14%	0.143	C	C	.	.	H	α-helix	trans	-65.7	-48	173.4	-178.5	42.4	0	0	0	112.2	I738 V750 L752 F753 R848 L849 L850 F854 S855 W856	I738-H852 HydrophobicContact CD1-CB 4.08Å; I738-H852 VanDerWaalsContact CD1-CD2 3.45Å; I738-H852 WeakPolarHBondContact CD1-CD2 3.31Å; I738-H852 VanDerWaalsContact CD1-CG 3.43Å; I738-H852 HydrophobicContact CG1-CB 4.4Å; I738-H852 HydrophobicContact CG2-CB 4.23Å; V750-H852 PolarHBondContact O-CE1 3.11Å; V750-H852 VanDerWaalsContact O-CE1 3.29Å; V750-H852 PolarHBondContact O-NE2 3.15Å; L752-H852 PolarHBondContact N-NE2 3.19Å; F753-H852 AromaticContact CE2-CD2 3.82Å; R848-H852 WeakPolarHBondContact O-CB 3.5Å; R848-H852 PolarHBondContact O-N 3.13Å; R848-H852 VanDerWaalsContact O-N 3.07Å; L849-H852 WeakPolarHBondContact O-CB 3.48Å; L849-H852 PolarHBondContact O-N 3.15Å; L850-H852 VanDerWaalsContact C-N 3.3Å; L850-H852 PolarHBondContact O-N 3.24Å; H852-F854 PolarHBondContact O-N 3.2Å; H852-S855 WeakPolarHBondContact CA-OG 3.37Å; H852-S855 PolarHBondContact O-N 3.19Å; H852-S855 PolarHBondContact O-OG 3.32Å; H852-W856 VanDerWaalsContact O-CB 3.31Å; H852-W856 WeakPolarHBondContact O-CB 3.34Å; H852-W856 PolarHBondContact O-N 3.09Å
853	K	80.5	Confident	70.4	Confident	15 Å²	15	36.4 Å²	36.4	7%	0.065	17%	0.169	C	C	.	.	H	α-helix	trans	-54.3	-55.4	176.1	-178.6	80.9	171.5	58.8	0	110.3	F753 M812 L815 L849 L850 S855 W856 D857 D1172	F753-K853 HydrophobicContact CD2-CB 4.16Å; F753-K853 HydrophobicContact CD2-CD 3.8Å; F753-K853 HydrophobicContact CD2-CG 4.48Å; F753-K853 HydrophobicContact CE2-CB 3.59Å; F753-K853 HydrophobicContact CE2-CD 4.13Å; F753-K853 HydrophobicContact CE2-CG 4.35Å; F753-K853 HydrophobicContact CG-CD 4.22Å; F753-K853 HydrophobicContact CZ-CB 4.07Å; M812-K853 HydrophobicContact SD-CD 4.48Å; L815-K853 HydrophobicContact CD1-CD 4.04Å; L815-K853 HydrophobicContact CD1-CG 4.17Å; L849-K853 PolarHBondContact O-N 3.33Å; L850-K853 WeakPolarHBondContact O-CB 3.42Å; L850-K853 PolarHBondContact O-N 3.19Å; L850-K853 VanDerWaalsContact O-N 3.12Å; K853-S855 PolarHBondContact O-N 3.07Å; K853-W856 WeakPolarHBondContact O-CB 3.36Å; K853-W856 PolarHBondContact O-N 3.05Å; K853-W856 VanDerWaalsContact O-N 3.1Å; K853-D857 WeakPolarHBondContact CD-OD2 3.36Å; K853-D857 WeakPolarHBondContact CG-OD2 3.33Å; K853-D857 IonicContact NZ-OD1 2.88Å; K853-D857 PolarHBondContact NZ-OD1 3.17Å; K853-D857 IonicContact NZ-OD2 3.09Å; K853-D857 PolarHBondContact NZ-OD2 3.04Å; K853-D857 PolarHBondContact O-N 3.24Å; K853-D1172 WeakPolarHBondContact CD-OD1 3.49Å; K853-D1172 VanDerWaalsContact CE-OD1 3.3Å; K853-D1172 WeakPolarHBondContact CE-OD1 3.21Å; K853-D1172 IonicContact NZ-OD1 3.17Å; K853-D1172 PolarHBondContact NZ-OD1 2.78Å; K853-D1172 IonicContact NZ-OD2 3.03Å; K853-D1172 PolarHBondContact NZ-OD2 3.01Å
854	F	75.3	Confident	68.6	Low	3.25 Å²	3.25	46.3 Å²	46.3	1%	0.014	21%	0.205	C	C	.	.	H	α-helix	trans	-54.8	-48.3	176.5	-134.3	-86.9	0	0	0	113	L850 H852 W856 D857 V858 L1169 M1173 L1176 L1180 L1204 F1205 I1208 V1217 W1220	L850-F854 HydrophobicContact CD2-CD2 4.38Å; L850-F854 HydrophobicContact CD2-CE2 3.98Å; L850-F854 HydrophobicContact CG-CD2 4.12Å; L850-F854 HydrophobicContact CG-CE2 4.06Å; L850-F854 WeakPolarHBondContact O-CB 3.39Å; L850-F854 VanDerWaalsContact O-CD2 3.25Å; L850-F854 WeakPolarHBondContact O-CD2 3.32Å; L850-F854 PolarHBondContact O-N 3.07Å; H852-F854 PolarHBondContact O-N 3.2Å; F854-W856 VanDerWaalsContact C-N 3.29Å; F854-W856 PolarHBondContact O-N 3.17Å; F854-D857 PolarHBondContact O-N 3.19Å; F854-V858 HydrophobicContact CD2-CG2 3.98Å; F854-V858 HydrophobicContact CE1-CG2 4.35Å; F854-V858 HydrophobicContact CE2-CG2 3.62Å; F854-V858 HydrophobicContact CG-CG2 4.38Å; F854-V858 HydrophobicContact CZ-CG2 3.82Å; F854-V858 VanDerWaalsContact O-CB 3.31Å; F854-V858 WeakPolarHBondContact O-CB 3.47Å; F854-V858 WeakPolarHBondContact O-CG2 3.34Å; F854-V858 PolarHBondContact O-N 3.19Å; F854-L1169 HydrophobicContact CD2-CD1 4.31Å; F854-L1169 HydrophobicContact CE2-CD1 4.23Å; F854-M1173 HydrophobicContact CD1-SD 4.2Å; F854-M1173 HydrophobicContact CD2-CE 4.39Å; F854-M1173 HydrophobicContact CD2-SD 4.27Å; F854-M1173 HydrophobicContact CE1-CE 4.44Å; F854-M1173 HydrophobicContact CE1-SD 3.84Å; F854-M1173 HydrophobicContact CE2-CE 3.74Å; F854-M1173 HydrophobicContact CE2-CG 4.28Å; F854-M1173 HydrophobicContact CE2-SD 3.59Å; F854-M1173 WeakPolarHBondContact CE2-SD 3.41Å; F854-M1173 HydrophobicContact CZ-CE 3.61Å; F854-M1173 HydrophobicContact CZ-SD 3.57Å; F854-M1173 VanDerWaalsContact CZ-SD 3.57Å; F854-L1176 HydrophobicContact CB-CD1 4.2Å; F854-L1176 HydrophobicContact CD1-CD1 4.06Å; F854-L1176 HydrophobicContact CD2-CD1 4.1Å; F854-L1176 HydrophobicContact CD2-CD2 4.3Å; F854-L1176 HydrophobicContact CE1-CB 4.05Å; F854-L1176 HydrophobicContact CE1-CD1 3.56Å; F854-L1176 HydrophobicContact CE1-CG 4.3Å; F854-L1176 HydrophobicContact CE2-CB 3.92Å; F854-L1176 HydrophobicContact CE2-CD1 4.16Å; F854-L1176 HydrophobicContact CE2-CD2 3.87Å; F854-L1176 HydrophobicContact CE2-CG 4.21Å; F854-L1176 HydrophobicContact CG-CD1 4.36Å; F854-L1176 HydrophobicContact CZ-CB 3.4Å; F854-L1176 HydrophobicContact CZ-CD1 3.7Å; F854-L1176 HydrophobicContact CZ-CD2 4.12Å; F854-L1176 HydrophobicContact CZ-CG 3.93Å; F854-L1180 HydrophobicContact CE2-CD1 3.91Å; F854-L1180 HydrophobicContact CE2-CG 4.5Å; F854-L1180 HydrophobicContact CZ-CD1 4.02Å; F854-L1204 HydrophobicContact CB-CD2 4.46Å; F854-F1205 HydrophobicContact CD1-CE1 4.4Å; F854-F1205 HydrophobicContact CE1-CD1 4.47Å; F854-F1205 HydrophobicContact CE1-CE1 4.28Å; F854-F1205 HydrophobicContact CE1-CZ 4.44Å; F854-F1205 HydrophobicContact CE2-CZ 4.41Å; F854-F1205 HydrophobicContact CZ-CE1 4.19Å; F854-F1205 HydrophobicContact CZ-CZ 4.19Å; F854-I1208 HydrophobicContact CD1-CD1 3.69Å; F854-I1208 HydrophobicContact CE1-CD1 3.61Å; F854-I1208 HydrophobicContact CE1-CG2 4.24Å; F854-V1217 HydrophobicContact CZ-CG1 4.05Å; F854-W1220 AromaticContact CE1-CH2 3.61Å; F854-W1220 HydrophobicContact CE1-CH2 3.61Å; F854-W1220 HydrophobicContact CE1-CZ2 4.18Å; F854-W1220 AromaticContact CE1-CZ3 3.95Å; F854-W1220 HydrophobicContact CE1-CZ3 4.06Å; F854-W1220 AromaticContact CZ-CH2 3.61Å; F854-W1220 HydrophobicContact CZ-CH2 3.61Å; F854-W1220 HydrophobicContact CZ-CZ2 4.38Å; F854-W1220 HydrophobicContact CZ-CZ3 4.42Å
855	S	75.8	Confident	66.4	Low	38.5 Å²	38.5	48 Å²	48	27%	0.269	23%	0.226	S	C	.	.	H	α-helix	trans	-63.9	-30.4	179.8	132.4	0	0	0	0	112.6	L851 H852 K853 G859	L851-S855 WeakPolarHBondContact O-CB 3.38Å; L851-S855 PolarHBondContact O-N 3.36Å; L851-S855 PolarHBondContact O-OG 3.09Å; H852-S855 WeakPolarHBondContact CA-OG 3.37Å; H852-S855 PolarHBondContact O-N 3.19Å; H852-S855 PolarHBondContact O-OG 3.32Å; K853-S855 PolarHBondContact O-N 3.07Å; S855-G859 VanDerWaalsContact O-CA 3.29Å; S855-G859 WeakPolarHBondContact O-CA 3.31Å; S855-G859 PolarHBondContact O-N 2.88Å; S855-G859 VanDerWaalsContact O-N 3.09Å
856	W	74.6	Confident	64.1	Low	45.5 Å²	45.5	58.6 Å²	58.6	17%	0.172	27%	0.266	C	S	.	.	H	α-helix	trans	-74.2	-51.7	174.9	-173.6	-82.5	0	0	0	111.9	N748 V750 N751 H852 K853 F854 V858 G859 F860	N748-W856 VanDerWaalsContact C-CZ3 3.45Å; N748-W856 HydrophobicContact CB-CZ3 4.44Å; N748-W856 WeakPolarHBondContact O-CH2 3.26Å; N748-W856 WeakPolarHBondContact O-CZ3 3.46Å; V750-W856 VanDerWaalsContact C-CZ3 3.42Å; V750-W856 VanDerWaalsContact O-CZ3 3.31Å; V750-W856 WeakPolarHBondContact O-CZ3 3.29Å; N751-W856 HydrophobicContact CB-CD2 3.64Å; N751-W856 HydrophobicContact CB-CE3 3.84Å; N751-W856 HydrophobicContact CB-CG 4.24Å; N751-W856 HydrophobicContact CB-CH2 4.01Å; N751-W856 HydrophobicContact CB-CZ2 3.81Å; N751-W856 HydrophobicContact CB-CZ3 4.01Å; N751-W856 PolarHBondContact ND2-NE1 3.08Å; N751-W856 VanDerWaalsContact ND2-NE1 3.17Å; H852-W856 VanDerWaalsContact O-CB 3.31Å; H852-W856 WeakPolarHBondContact O-CB 3.34Å; H852-W856 PolarHBondContact O-N 3.09Å; K853-W856 WeakPolarHBondContact O-CB 3.36Å; K853-W856 PolarHBondContact O-N 3.05Å; K853-W856 VanDerWaalsContact O-N 3.1Å; F854-W856 VanDerWaalsContact C-N 3.29Å; F854-W856 PolarHBondContact O-N 3.17Å; W856-V858 VanDerWaalsContact C-N 3.34Å; W856-V858 PolarHBondContact O-N 3.18Å; W856-G859 CarbonylContact O-C 3.58Å; W856-G859 WeakPolarHBondContact O-CA 3.26Å; W856-G859 PolarHBondContact O-N 3.36Å; W856-G859 VanDerWaalsContact O-N 3.1Å; W856-F860 AromaticContact CE2-CE2 3.88Å; W856-F860 HydrophobicContact CZ2-CE2 4.15Å; W856-F860 AromaticContact NE1-CE2 3.55Å; W856-F860 PolarHBondContact O-N 3.01Å
857	D	72.7	Confident	61.6	Low	50 Å²	50	63.8 Å²	63.8	27%	0.267	30%	0.302	S	S	.	.	H	α-helix	trans	-62	-44.7	-176.9	-58.5	-38.4	0	0	0	111	K853 F854 G859 F860 L861 L1169	K853-D857 WeakPolarHBondContact CD-OD2 3.36Å; K853-D857 WeakPolarHBondContact CG-OD2 3.33Å; K853-D857 IonicContact NZ-OD1 2.88Å; K853-D857 PolarHBondContact NZ-OD1 3.17Å; K853-D857 IonicContact NZ-OD2 3.09Å; K853-D857 PolarHBondContact NZ-OD2 3.04Å; K853-D857 PolarHBondContact O-N 3.24Å; F854-D857 PolarHBondContact O-N 3.19Å; D857-G859 VanDerWaalsContact C-N 3.33Å; D857-F860 WeakPolarHBondContact O-CB 3.34Å; D857-F860 PolarHBondContact O-N 2.94Å; D857-L861 PolarHBondContact O-N 3.49Å; D857-L1169 HydrophobicContact CB-CD1 4.4Å
858	V	67	Low	59.4	Low	8 Å²	8	69.3 Å²	69.3	5%	0.048	34%	0.34	C	S	.	.	H	α-helix	trans	-75.2	-26.7	175.9	-177.3	0	0	0	0	111.8	F854 W856 F860 L861 L1169 M1173 I1208 T1212 V1217	F854-V858 HydrophobicContact CD2-CG2 3.98Å; F854-V858 HydrophobicContact CE1-CG2 4.35Å; F854-V858 HydrophobicContact CE2-CG2 3.62Å; F854-V858 HydrophobicContact CG-CG2 4.38Å; F854-V858 HydrophobicContact CZ-CG2 3.82Å; F854-V858 VanDerWaalsContact O-CB 3.31Å; F854-V858 WeakPolarHBondContact O-CB 3.47Å; F854-V858 WeakPolarHBondContact O-CG2 3.34Å; F854-V858 PolarHBondContact O-N 3.19Å; W856-V858 VanDerWaalsContact C-N 3.34Å; W856-V858 PolarHBondContact O-N 3.18Å; V858-F860 PolarHBondContact O-N 3.33Å; V858-F860 VanDerWaalsContact O-N 3.1Å; V858-L861 HydrophobicContact CG1-CD1 4.29Å; V858-L861 WeakPolarHBondContact O-CB 3.21Å; V858-L861 PolarHBondContact O-N 3.11Å; V858-L861 VanDerWaalsContact O-N 3.16Å; V858-L1169 HydrophobicContact CG2-CD1 4.13Å; V858-M1173 HydrophobicContact CG2-CE 4.11Å; V858-I1208 HydrophobicContact CB-CD1 4.11Å; V858-I1208 HydrophobicContact CB-CG1 4.43Å; V858-I1208 HydrophobicContact CG1-CB 4.3Å; V858-I1208 HydrophobicContact CG1-CD1 3.74Å; V858-I1208 HydrophobicContact CG1-CG1 3.65Å; V858-I1208 HydrophobicContact CG1-CG2 3.81Å; V858-I1208 HydrophobicContact CG2-CD1 4.29Å; V858-T1212 HydrophobicContact CG1-CG2 3.74Å; V858-T1212 WeakPolarHBondContact CG1-OG1 3.21Å; V858-V1217 HydrophobicContact CG1-CG1 4.36Å; V858-V1217 HydrophobicContact CG2-CG1 4.21Å
859	G	60.1	Low	56.8	Low	6.25 Å²	6.25	73.4 Å²	73.4	6%	0.064	38%	0.375	C	S	.	.	H	α-helix	trans	-58.3	-26.8	172.6	0	0	0	0	0	113.4	S855 W856 D857 L861 Q862	S855-G859 VanDerWaalsContact O-CA 3.29Å; S855-G859 WeakPolarHBondContact O-CA 3.31Å; S855-G859 PolarHBondContact O-N 2.88Å; S855-G859 VanDerWaalsContact O-N 3.09Å; W856-G859 CarbonylContact O-C 3.58Å; W856-G859 WeakPolarHBondContact O-CA 3.26Å; W856-G859 PolarHBondContact O-N 3.36Å; W856-G859 VanDerWaalsContact O-N 3.1Å; D857-G859 VanDerWaalsContact C-N 3.33Å; G859-L861 PolarHBondContact O-N 3.03Å; G859-Q862 PolarHBondContact O-N 3.2Å
860	F	50.4	Low	54.2	Low	144 Å²	144	76.8 Å²	76.8	63%	0.632	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-25.7	173.6	-107.6	-93.8	0	0	0	113.8	W856 D857 V858 Q862 Y863 R864 A877	W856-F860 AromaticContact CE2-CE2 3.88Å; W856-F860 HydrophobicContact CZ2-CE2 4.15Å; W856-F860 AromaticContact NE1-CE2 3.55Å; W856-F860 PolarHBondContact O-N 3.01Å; D857-F860 WeakPolarHBondContact O-CB 3.34Å; D857-F860 PolarHBondContact O-N 2.94Å; V858-F860 PolarHBondContact O-N 3.33Å; V858-F860 VanDerWaalsContact O-N 3.1Å; F860-Q862 VanDerWaalsContact C-N 3.31Å; F860-Q862 PolarHBondContact O-N 3.4Å; F860-Y863 PolarHBondContact O-N 2.88Å; F860-R864 PolarHBondContact O-N 3.09Å; F860-A877 HydrophobicContact CZ-CB 3.96Å
861	L	40.1	Very low	51.9	Low	73.75 Å²	73.75	85.9 Å²	85.9	39%	0.386	45%	0.452	S	S	.	.	G	3₁₀ helix	trans	-71.3	-27	177.2	-62.5	-180	0	0	0	112.4	D857 V858 G859 Y863 R864 G865 L1169 T1212 V1217	D857-L861 PolarHBondContact O-N 3.49Å; V858-L861 HydrophobicContact CG1-CD1 4.29Å; V858-L861 WeakPolarHBondContact O-CB 3.21Å; V858-L861 PolarHBondContact O-N 3.11Å; V858-L861 VanDerWaalsContact O-N 3.16Å; G859-L861 PolarHBondContact O-N 3.03Å; L861-Y863 VanDerWaalsContact C-N 3.28Å; L861-Y863 PolarHBondContact O-N 3.2Å; L861-Y863 VanDerWaalsContact O-N 3.1Å; L861-R864 WeakPolarHBondContact O-CB 3.34Å; L861-R864 PolarHBondContact O-N 3.38Å; L861-G865 PolarHBondContact O-N 3.29Å; L861-G865 VanDerWaalsContact O-N 3.09Å; L861-L1169 HydrophobicContact CD1-CD2 4.36Å; L861-T1212 HydrophobicContact CB-CG2 4.43Å; L861-T1212 HydrophobicContact CD1-CG2 3.94Å; L861-V1217 HydrophobicContact CD1-CG1 4.47Å; L861-V1217 HydrophobicContact CD1-CG2 3.96Å
862	Q	43.9	Very low	49.5	Very low	88.25 Å²	88.25	89.5 Å²	89.5	41%	0.412	48%	0.48	S	S	.	.	G	3₁₀ helix	trans	-66.5	-13.7	-176.6	-60.5	-170.1	-16.8	0	0	114.2	G859 F860 R864 V1211	G859-Q862 PolarHBondContact O-N 3.2Å; F860-Q862 VanDerWaalsContact C-N 3.31Å; F860-Q862 PolarHBondContact O-N 3.4Å; Q862-R864 VanDerWaalsContact C-N 3.34Å; Q862-V1211 HydrophobicContact CB-CG1 4.16Å; Q862-V1211 HydrophobicContact CG-CG1 3.89Å; Q862-V1211 PolarHBondContact NE2-O 2.9Å
863	Y	38.4	Very low	47	Very low	193.5 Å²	193.5	99 Å²	99	76%	0.759	52%	0.521	S	S	*	.	G	3₁₀ helix	trans	-106.7	11.7	-176.5	-119.2	-87.7	0	0	0	114.9	F860 L861	F860-Y863 PolarHBondContact O-N 2.88Å; L861-Y863 VanDerWaalsContact C-N 3.28Å; L861-Y863 PolarHBondContact O-N 3.2Å; L861-Y863 VanDerWaalsContact O-N 3.1Å
864	R	33.5	Very low	44.6	Very low	218.75 Å²	218.75	101.7 Å²	101.7	83%	0.825	55%	0.554	S	S	*	*	S	Bend	trans	-102.5	-16.2	177	-146	175.1	-174.4	178.5	0.7	114.8	F860 L861 Q862 R866 S867	F860-R864 PolarHBondContact O-N 3.09Å; L861-R864 WeakPolarHBondContact O-CB 3.34Å; L861-R864 PolarHBondContact O-N 3.38Å; Q862-R864 VanDerWaalsContact C-N 3.34Å; R864-R866 PolarHBondContact O-N 3.25Å; R864-S867 PolarHBondContact O-N 3.04Å
865	G	30.6	Very low	42.5	Very low	48 Å²	48	108.2 Å²	108.2	50%	0.495	59%	0.593	S	S	.	*	S	Bend	trans	-84.8	43.3	-176.8	0	0	0	0	0	115.4	L861 S867 E1213	L861-G865 PolarHBondContact O-N 3.29Å; L861-G865 VanDerWaalsContact O-N 3.09Å; G865-S867 VanDerWaalsContact C-N 3.29Å; G865-S867 PolarHBondContact O-N 3.14Å; G865-E1213 WeakPolarHBondContact CA-OE1 3.1Å
866	R	32	Very low	40.3	Very low	224.75 Å²	224.75	111.8 Å²	111.8	85%	0.848	62%	0.616	S	S	*	*			trans	-142.3	70.2	167.7	-90.9	-175	177.1	-168.5	-1.4	114.3	R864	R864-R866 PolarHBondContact O-N 3.25Å
867	S	29	Very low	38	Very low	110.75 Å²	110.75	114.5 Å²	114.5	77%	0.774	65%	0.648	S	S	*	*			trans	-155.6	93.2	156.6	-56.7	0	0	0	0	113.3	R864 G865 S869	R864-S867 PolarHBondContact O-N 3.04Å; G865-S867 VanDerWaalsContact C-N 3.29Å; G865-S867 PolarHBondContact O-N 3.14Å; S867-S869 PolarHBondContact O-N 3Å
868	S	31.3	Very low	35.9	Very low	115.5 Å²	115.5	115.5 Å²	115.5	81%	0.808	67%	0.67	S	S	*	*			trans	-113	96.1	167.7	56.6	0	0	0	0	114.3
869	S	30.6	Very low	34.1	Very low	123.25 Å²	123.25	124 Å²	124	86%	0.862	71%	0.709	S	S	*	*			trans	-115.7	135.2	157.7	50.6	0	0	0	0	111.7	S867	S867-S869 PolarHBondContact O-N 3Å
870	G	30.2	Very low	32.6	Very low	73 Å²	73	129.9 Å²	129.9	75%	0.753	74%	0.744	S	S	*	*			trans	119.6	114	167.4	0	0	0	0	0	115
871	H	31.6	Very low	31.6	Very low	192.75 Å²	192.75	131.1 Å²	131.1	89%	0.892	75%	0.751	S	S	*	*			trans	-46.5	149.8	176.6	-70.9	-83.5	0	0	0	117.2
872	S	29.6	Very low	31	Very low	96.5 Å²	96.5	135.3 Å²	135.3	68%	0.675	77%	0.766	S	S	*	*			trans	-82.9	150.1	149.3	55.4	0	0	0	0	116.1
873	F	30.3	Very low	30.3	Very low	208.75 Å²	208.75	136.1 Å²	136.1	92%	0.916	78%	0.782	S	S	*	*			trans	-175.8	142.1	132.4	-82.2	-85.2	0	0	0	115.1
874	G	29.5	Very low	29.9	Very low	73.25 Å²	73.25	136.9 Å²	136.9	76%	0.755	79%	0.789	S	S	*	*			trans	-167.7	128.2	167.3	0	0	0	0	0	115.1
875	V	30.5	Very low	29.8	Very low	139.25 Å²	139.25	131 Å²	131	84%	0.844	78%	0.782	S	S	*	*			trans	-160.5	142	167.8	168.8	0	0	0	0	110.5
876	P	30.3	Very low	29.9	Very low	114.5 Å²	114.5	136.2 Å²	136.2	74%	0.744	79%	0.791	S	S	*	*				-103.2	171.9	-96.4	33.5	-25.7	0	0	0	114.3	G878	P876-G878 PolarHBondContact O-N 2.87Å; P876-G878 VanDerWaalsContact O-N 3.17Å
877	A	27.3	Very low	29.7	Very low	101.5 Å²	101.5	131.4 Å²	131.4	84%	0.839	78%	0.782	S	S	*	*	S	Bend	trans	-7	125.7	166.2	0	0	0	0	0	117.2	F860	F860-A877 HydrophobicContact CZ-CB 3.96Å
878	G	27.5	Very low	29.9	Very low	72.25 Å²	72.25	137.6 Å²	137.6	75%	0.745	79%	0.788	S	S	*	*			trans	144.7	83.7	159.7	0	0	0	0	0	117.3	P876	P876-G878 PolarHBondContact O-N 2.87Å; P876-G878 VanDerWaalsContact O-N 3.17Å
879	Q	28.7	Very low	29.9	Very low	186 Å²	186	140.3 Å²	140.3	87%	0.869	79%	0.788	S	S	*	*			trans	154	110.9	170.4	-67	-167.8	-7.4	0	0	114.7
880	V	29.7	Very low	29.9	Very low	130.5 Å²	130.5	142 Å²	142	79%	0.791	79%	0.787	S	S	*	*			trans	-106.1	140.3	138.4	175.6	0	0	0	0	109.4	K882	V880-K882 PolarHBondContact O-N 3.27Å
881	Q	28.4	Very low	29.9	Very low	167.5 Å²	167.5	144 Å²	144	78%	0.783	79%	0.786	S	S	*	*			trans	-65.2	107.4	-175.2	-103.2	172.1	-10.5	0	0	112.2	S883	Q881-S883 PolarHBondContact O-N 2.84Å; Q881-S883 VanDerWaalsContact O-N 3.16Å
882	K	27.8	Very low	29.7	Very low	162.25 Å²	162.25	144 Å²	144	71%	0.705	78%	0.784	S	S	*	*			trans	-68.6	124.3	166.6	-77.9	-173.9	169.9	-173.4	0	110.8	V880 K884 D887	V880-K882 PolarHBondContact O-N 3.27Å; K882-K884 PolarHBondContact O-N 3.02Å; K882-D887 WeakPolarHBondContact CD-OD2 3.08Å; K882-D887 WeakPolarHBondContact CE-OD2 3.28Å; K882-D887 IonicContact NZ-OD1 3.47Å; K882-D887 PolarHBondContact NZ-OD1 2.72Å; K882-D887 IonicContact NZ-OD2 2.96Å; K882-D887 PolarHBondContact NZ-OD2 3.01Å
883	S	30.7	Very low	29.8	Very low	105 Å²	105	145.8 Å²	145.8	73%	0.734	79%	0.791	S	S	*	*			trans	-64.8	121.5	161.9	39.8	0	0	0	0	109.7	Q881 S885	Q881-S883 PolarHBondContact O-N 2.84Å; Q881-S883 VanDerWaalsContact O-N 3.16Å; S883-S885 PolarHBondContact O-N 3.37Å; S883-S885 VanDerWaalsContact O-N 3.12Å
884	K	28.6	Very low	29.7	Very low	210 Å²	210	142.7 Å²	142.7	91%	0.913	78%	0.783	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.4	73.3	-170.3	-66.7	-179.7	178.1	177.3	0	112.9	K882	K882-K884 PolarHBondContact O-N 3.02Å
885	S	31.3	Very low	29.8	Very low	96 Å²	96	148.1 Å²	148.1	67%	0.671	79%	0.789	S	S	*	*	T	Hydrogen-bonded Turn	trans	-141.4	66.2	167.8	69.6	0	0	0	0	113.3	S883	S883-S885 PolarHBondContact O-N 3.37Å; S883-S885 VanDerWaalsContact O-N 3.12Å
886	F	33.4	Very low	29.8	Very low	156.75 Å²	156.75	144.6 Å²	144.6	69%	0.688	78%	0.78	S	S	*	*	S	Bend	trans	-22.6	38.8	-177.2	-92.3	-85.5	0	0	0	117.3	D714	D714-F886 WeakPolarHBondContact OD2-CZ 3.31Å
887	D	28.4	Very low	29.8	Very low	123.5 Å²	123.5	148.7 Å²	148.7	66%	0.66	79%	0.79	S	S	*	*			trans	-102.1	124.1	156.5	-81.5	-57.9	0	0	0	110.6	K882	K882-D887 WeakPolarHBondContact CD-OD2 3.08Å; K882-D887 WeakPolarHBondContact CE-OD2 3.28Å; K882-D887 IonicContact NZ-OD1 3.47Å; K882-D887 PolarHBondContact NZ-OD1 2.72Å; K882-D887 IonicContact NZ-OD2 2.96Å; K882-D887 PolarHBondContact NZ-OD2 3.01Å
888	R	33	Very low	30	Very low	241 Å²	241	149.2 Å²	149.2	91%	0.909	79%	0.787	S	S	*	*			trans	-138.3	122.5	156.6	-101.3	-173.1	177.4	-174.3	-0.2	108.6
889	Q	30.5	Very low	30.2	Very low	171.75 Å²	171.75	152.7 Å²	152.7	80%	0.803	79%	0.788	S	S	*	*			trans	-2.8	137.2	-172.6	-55.5	168.3	-9.1	0	0	111.6
890	L	30.1	Very low	30.4	Very low	159.75 Å²	159.75	149.3 Å²	149.3	84%	0.836	78%	0.781	S	S	*	*				-135.5	167.6	76.4	-119.4	73.5	0	0	0	110.6
891	P	31.2	Very low	30.5	Very low	114.5 Å²	114.5	150.1 Å²	150.1	74%	0.744	78%	0.78	S	S	*	*			trans	-96.5	163.8	-155	36.4	-32.2	0	0	0	114.8
892	K	28	Very low	30.7	Very low	194.25 Å²	194.25	147.4 Å²	147.4	85%	0.845	78%	0.78	S	S	*	*			trans	-83.1	137.4	174.8	-62.8	-178.6	178	-175.3	0	112.2
893	T	30.9	Very low	30.8	Very low	132.5 Å²	132.5	147.4 Å²	147.4	81%	0.813	79%	0.785	S	S	*	*			trans	-126.1	134.2	157.3	45.9	0	0	0	0	107.8
894	L	28.4	Very low	30.8	Very low	145 Å²	145	149 Å²	149	76%	0.759	78%	0.784	S	S	*	*			trans	-133.6	146.5	130.6	-89.9	163.4	0	0	0	111.1
895	H	31.3	Very low	30.9	Very low	187.25 Å²	187.25	149.5 Å²	149.5	87%	0.867	78%	0.78	S	S	*	*			trans	74.8	138.2	165.4	-64.4	-70.5	0	0	0	115.8
896	G	30.7	Very low	30.9	Very low	64.75 Å²	64.75	150.4 Å²	150.4	67%	0.668	79%	0.787	S	S	*	*				-176.4	133.6	69.2	0	0	0	0	0	112.3
897	E	29.9	Very low	30.9	Very low	201.5 Å²	201.5	146.6 Å²	146.6	94%	0.942	79%	0.791	S	S	*	*			trans	57.3	140.3	157.9	-67.1	164.6	-165.5	0	0	117.8
898	S	32.3	Very low	31.1	Very low	111.25 Å²	111.25	145.7 Å²	145.7	78%	0.778	80%	0.795	S	S	*	*			cis	-150.7	156.1	15.5	52	0	0	0	0	110.3
899	D	30.2	Very low	31	Very low	144.75 Å²	144.75	140.8 Å²	140.8	77%	0.774	78%	0.784	S	S	*	*			trans	-108.7	161.7	163.8	-103.6	-26.7	0	0	0	116.4
900	T	33.5	Very low	31.1	Very low	116.5 Å²	116.5	142.2 Å²	142.2	72%	0.715	78%	0.782	S	S	*	*			trans	100.8	107.7	151.5	55.9	0	0	0	0	120.3
901	N	31.2	Very low	31.3	Very low	145.5 Å²	145.5	139.8 Å²	139.8	78%	0.778	77%	0.774	S	S	*	*			trans	63	123	133.8	-61.4	-25.6	0	0	0	122.7
902	S	33	Very low	31.3	Very low	111 Å²	111	140.3 Å²	140.3	78%	0.776	77%	0.77	S	S	*	*				139.8	129.5	113.7	59.2	0	0	0	0	116.1
903	M	30.1	Very low	31.5	Very low	163.75 Å²	163.75	137.5 Å²	137.5	81%	0.807	77%	0.765	S	S	*	*				70.5	124.5	99.9	-85	175.4	69.8	0	0	118.1
904	L	31.7	Very low	31.7	Very low	136.75 Å²	136.75	136.6 Å²	136.6	72%	0.716	76%	0.759	S	S	*	*				65.6	145	122.4	-65.4	166.5	0	0	0	118.2
905	R	30.6	Very low	31.9	Very low	220.75 Å²	220.75	138.8 Å²	138.8	83%	0.833	76%	0.762	S	S	*	*				139.8	139	73.4	-99.4	172.3	176.1	-173.5	-0.7	115.9
906	S	31.3	Very low	32	Very low	115.5 Å²	115.5	137.5 Å²	137.5	81%	0.808	76%	0.761	S	S	*	*				70.8	139	74	-41	0	0	0	0	117.4
907	G	32.6	Very low	32.3	Very low	76.5 Å²	76.5	139.5 Å²	139.5	79%	0.789	76%	0.762	S	S	*	*			trans	151.6	135.5	157	0	0	0	0	0	112.4
908	S	32.4	Very low	32.6	Very low	105.25 Å²	105.25	140.8 Å²	140.8	74%	0.736	76%	0.758	S	S	*	*			cis	142.3	144.1	6.9	-164.1	0	0	0	0	112.1
909	M	32.5	Very low	32.9	Very low	138.25 Å²	138.25	140.3 Å²	140.3	68%	0.681	75%	0.752	S	S	*	*			trans	67.6	138.4	154.5	-57.8	-72.4	102	0	0	115.9
910	R	32.3	Very low	33.1	Very low	201.25 Å²	201.25	144.5 Å²	144.5	76%	0.759	76%	0.757	S	S	*	*			cis	171.7	143.2	5.7	-103.9	-177.7	-169.6	173.8	-0.2	110.5
911	T	33	Very low	33	Very low	108.25 Å²	108.25	144.8 Å²	144.8	66%	0.664	76%	0.763	S	S	*	*				86.1	156.9	103.9	45.1	0	0	0	0	117.4
912	D	31.6	Very low	33.1	Very low	126 Å²	126	140.7 Å²	140.7	67%	0.674	76%	0.756	S	S	*	*				135.6	147.5	73.4	-89.7	-13	0	0	0	118.2
913	N	32.7	Very low	33.1	Very low	136.25 Å²	136.25	147.8 Å²	147.8	73%	0.729	77%	0.765	S	S	*	*			trans	89.2	147.5	132.7	-82.2	-40.4	0	0	0	120.3
914	V	34.4	Very low	33.3	Very low	112.25 Å²	112.25	143.6 Å²	143.6	68%	0.68	76%	0.764	S	S	*	*				-167	131.6	82.4	155.3	0	0	0	0	118
915	K	32.6	Very low	33.2	Very low	191.25 Å²	191.25	142.2 Å²	142.2	83%	0.832	77%	0.766	S	S	*	*			trans	70.8	147	140.3	-70	167.1	-168.6	169.8	0	121
916	L	33.5	Very low	33.3	Very low	160 Å²	160	138.9 Å²	138.9	84%	0.838	76%	0.764	S	S	*	*			trans	-140.8	174	157.5	-123.7	80.1	0	0	0	109.5
917	P	38.1	Very low	33.3	Very low	107.25 Å²	107.25	139.2 Å²	139.2	70%	0.696	76%	0.761	S	S	*	*				-145.2	176.3	-102.5	41.5	-20.5	0	0	0	119
918	R	35.2	Very low	33.3	Very low	227.75 Å²	227.75	140.1 Å²	140.1	86%	0.859	76%	0.761	S	S	*	*			trans	80.6	167.2	148.2	-68.5	177.7	178	172.5	-1.2	117.9
919	P	38.8	Very low	33.2	Very low	101.25 Å²	101.25	139.8 Å²	139.8	66%	0.657	76%	0.759	S	S	*	*				-126.7	-168.2	-87.2	42.6	-27.6	0	0	0	114.2	P1102 Y1103	P919-P1102 VanDerWaalsContact CB-O 3.26Å; P919-P1102 WeakPolarHBondContact CB-O 3.31Å; P919-P1102 WeakPolarHBondContact CG-O 3.32Å; P919-Y1103 WeakPolarHBondContact CB-O 3.26Å
920	R	33.8	Very low	33.1	Very low	232.5 Å²	232.5	140.9 Å²	140.9	88%	0.877	76%	0.762	S	S	*	*			trans	-163	170.7	146.8	-108.1	170.8	-179.1	-178.3	0.3	112.9	Y1103 S1104	R920-Y1103 VanDerWaalsContact C-CB 3.43Å; R920-Y1103 WeakPolarHBondContact O-CB 3.49Å; R920-S1104 VanDerWaalsContact O-CB 3.31Å; R920-S1104 WeakPolarHBondContact O-CB 3.07Å
921	C	31.5	Very low	33	Very low	122.5 Å²	122.5	137.1 Å²	137.1	83%	0.828	76%	0.761	S	S	*	*			trans	-143.5	151.4	-161.6	-115.8	0	0	0	0	114.1	Y1103	C921-Y1103 HydrophobicContact CB-CD1 3.63Å; C921-Y1103 HydrophobicContact CB-CD2 3.56Å; C921-Y1103 HydrophobicContact CB-CE1 3.6Å; C921-Y1103 HydrophobicContact CB-CE2 3.54Å; C921-Y1103 HydrophobicContact CB-CG 3.59Å
922	G	34.1	Very low	32.7	Very low	61.25 Å²	61.25	137.3 Å²	137.3	63%	0.631	77%	0.766	S	S	*	*			trans	135.3	147.5	148.8	0	0	0	0	0	115.5	Y1103	G922-Y1103 PolarHBondContact N-OH 3.25Å
923	R	33.1	Very low	32.6	Very low	258.75 Å²	258.75	136.4 Å²	136.4	98%	0.976	77%	0.77	S	S	*	*			cis	127.1	135.8	12.8	-115.1	-175.7	-179	-166.5	0.7	114.6
924	G	33.2	Very low	32.4	Very low	75.75 Å²	75.75	138.8 Å²	138.8	78%	0.781	78%	0.777	S	S	*	*			trans	109.7	158.2	133.5	0	0	0	0	0	116.4
925	S	29.8	Very low	32.2	Very low	108.25 Å²	108.25	136.7 Å²	136.7	76%	0.757	78%	0.778	S	S	*	*			cis	-152.5	140.7	-26.5	-159.1	0	0	0	0	112.9
926	L	32.3	Very low	32.2	Very low	150.5 Å²	150.5	135 Å²	135	79%	0.788	78%	0.776	S	S	*	*			trans	81.7	151.3	148.6	-65.3	173.2	0	0	0	118.3
927	T	32.3	Very low	32	Very low	123 Å²	123	138.4 Å²	138.4	76%	0.755	78%	0.778	S	S	*	*				135.5	136.7	63	31.8	0	0	0	0	116.9
928	A	31.7	Very low	31.7	Very low	95 Å²	95	139.4 Å²	139.4	79%	0.785	78%	0.782	S	S	*	*			trans	76.9	133.5	130.4	0	0	0	0	0	119.4
929	S	30.5	Very low	31.5	Very low	97.5 Å²	97.5	138.1 Å²	138.1	68%	0.682	78%	0.783	S	S	*	*				139.5	164.5	68	-156.5	0	0	0	0	117
930	E	30	Very low	31.2	Very low	162.25 Å²	162.25	138.3 Å²	138.3	76%	0.758	79%	0.786	S	S	*	*				81.4	132.9	124.6	-93.7	131.8	-113.4	0	0	120.6
931	T	30.1	Very low	31.1	Very low	120.75 Å²	120.75	134.4 Å²	134.4	74%	0.741	78%	0.783	S	S	*	*			trans	42.4	128.1	146.9	49.9	0	0	0	0	122
932	C	27.8	Very low	31.1	Very low	113.75 Å²	113.75	138.3 Å²	138.3	77%	0.769	79%	0.786	S	S	*	*			trans	96.3	120	135.6	-70.8	0	0	0	0	119
933	S	29.3	Very low	30.9	Very low	106.5 Å²	106.5	139.8 Å²	139.8	75%	0.745	79%	0.787	S	S	*	*				61.3	120.4	128.4	27.8	0	0	0	0	119.5
934	E	29.2	Very low	30.8	Very low	187.25 Å²	187.25	136.7 Å²	136.7	88%	0.875	78%	0.781	S	S	*	*				127.1	150.3	107.1	-88.4	-150.6	140.2	0	0	116.2	I936	E934-I936 WeakPolarHBondContact OE2-CD1 3.49Å
935	G	30.2	Very low	30.7	Very low	67.75 Å²	67.75	142.7 Å²	142.7	70%	0.698	78%	0.781	S	S	*	*			trans	171.1	87.2	170.8	0	0	0	0	0	118.3
936	I	31.8	Very low	30.9	Very low	156.25 Å²	156.25	144.3 Å²	144.3	80%	0.801	78%	0.78	S	S	*	*			trans	58.2	122.5	131.5	-60.5	175	0	0	0	115.1	E934	E934-I936 WeakPolarHBondContact OE2-CD1 3.49Å
937	R	28.5	Very low	30.9	Very low	230.25 Å²	230.25	144.7 Å²	144.7	87%	0.869	78%	0.777	S	S	*	*			trans	-8.4	148.5	146.6	-58.4	172.8	177	171.1	-1.2	115.3
938	T	33.3	Very low	30.8	Very low	128.75 Å²	128.75	145.5 Å²	145.5	79%	0.79	78%	0.777	S	S	*	*			trans	-163.2	140.6	132.8	40.6	0	0	0	0	114.1
939	K	29.8	Very low	30.8	Very low	200.25 Å²	200.25	147.8 Å²	147.8	87%	0.871	78%	0.776	S	S	*	*			trans	-101.4	144.1	150	-74	171.4	-178.6	176.5	0	110.4
940	S	33.9	Very low	30.9	Very low	105.75 Å²	105.75	152.2 Å²	152.2	74%	0.74	78%	0.783	S	S	*	*			trans	-141.1	132.1	134.8	53	0	0	0	0	111.5
941	N	30.7	Very low	30.9	Very low	149.5 Å²	149.5	155.1 Å²	155.1	80%	0.799	79%	0.787	S	S	*	*			trans	-108.4	131.3	165.2	-70.1	-18.8	0	0	0	111.5
942	F	30.7	Very low	31.1	Very low	205 Å²	205	155.1 Å²	155.1	90%	0.899	79%	0.787	S	S	*	*			trans	-155.9	123.2	156.8	-112	-85.6	0	0	0	108.6
943	S	31.7	Very low	31.3	Very low	93 Å²	93	158.8 Å²	158.8	65%	0.65	79%	0.79	S	S	*	*			trans	175.9	111.8	131.7	173.5	0	0	0	0	110.4
944	K	30.9	Very low	31.4	Very low	194 Å²	194	165.1 Å²	165.1	84%	0.843	80%	0.797	S	S	*	*			trans	78.5	113.4	165.6	-68.2	179	-176.1	177	0	116.4
945	Y	30.9	Very low	31.5	Very low	202.25 Å²	202.25	160.5 Å²	160.5	79%	0.793	79%	0.792	S	S	*	*				-141.1	145.8	75.6	-135.1	-119.2	0	0	0	107.6	Q947	Y945-Q947 HydrophobicContact CE1-CG 4.43Å
946	I	32.8	Very low	31.4	Very low	141 Å²	141	166.6 Å²	166.6	72%	0.723	80%	0.799	S	S	*	*			trans	118	99.3	133.1	-70.3	171.3	0	0	0	111.1	N948	I946-N948 VanDerWaalsContact C-N 3.28Å; I946-N948 PolarHBondContact O-N 3.44Å; I946-N948 VanDerWaalsContact O-N 3.09Å
947	Q	33.3	Very low	31.5	Very low	158 Å²	158	166.8 Å²	166.8	74%	0.738	80%	0.798	S	S	*	*				-122.4	129.6	128.1	-99	169.3	2.7	0	0	116.3	Y945	Y945-Q947 HydrophobicContact CE1-CG 4.43Å
948	N	29.6	Very low	31.6	Very low	141 Å²	141	162.2 Å²	162.2	75%	0.754	79%	0.791	S	S	*	*			trans	99.6	117.2	166.5	-77.6	-13.6	0	0	0	117.1	I946	I946-N948 VanDerWaalsContact C-N 3.28Å; I946-N948 PolarHBondContact O-N 3.44Å; I946-N948 VanDerWaalsContact O-N 3.09Å
949	L	31.5	Very low	31.5	Very low	143.25 Å²	143.25	160.6 Å²	160.6	75%	0.75	79%	0.785	S	S	*	*			trans	-178.4	99.2	164.2	-72.5	132.6	0	0	0	115.8
950	F	32.7	Very low	31.6	Very low	190.25 Å²	190.25	158.9 Å²	158.9	83%	0.834	78%	0.784	S	S	*	*			trans	-43.6	111.6	138.4	-66.5	-75.1	0	0	0	118.5
951	R	31	Very low	31.5	Very low	222.75 Å²	222.75	157.6 Å²	157.6	84%	0.841	78%	0.779	S	S	*	*			trans	-115.6	130.6	153.8	-98.4	-172.5	175.3	-171.8	-0.2	113.6
952	T	33.3	Very low	31.4	Very low	120.5 Å²	120.5	155.4 Å²	155.4	74%	0.739	78%	0.776	S	S	*	*			trans	143.3	147	137.7	51.7	0	0	0	0	115.5
953	K	31.8	Very low	31.5	Very low	192.25 Å²	192.25	151.6 Å²	151.6	84%	0.836	77%	0.77	S	S	*	*			trans	-150.2	150.6	154.2	-84.2	166.2	-175.8	172.3	0	112.7
954	R	31.1	Very low	31.5	Very low	237.25 Å²	237.25	156 Å²	156	90%	0.895	78%	0.78	S	S	*	*			trans	-91.1	125.8	161.1	-84.1	176.3	170.5	164.1	-3.5	113.3
955	A	31.4	Very low	31.6	Very low	92 Å²	92	151.6 Å²	151.6	76%	0.76	77%	0.774	S	S	*	*				83.3	146.4	114.3	0	0	0	0	0	117.3
956	K	30	Very low	31.7	Very low	194.75 Å²	194.75	149.1 Å²	149.1	85%	0.847	77%	0.774	S	S	*	*			trans	126.1	140.5	152.4	-87.2	-177.8	176.9	-175.4	0	114.7
957	M	32.1	Very low	31.7	Very low	160.25 Å²	160.25	151.1 Å²	151.1	79%	0.789	78%	0.78	S	S	*	*				145.1	145.3	122.6	-99.6	175.6	114.3	0	0	115
958	N	32.3	Very low	31.7	Very low	134.5 Å²	134.5	150.4 Å²	150.4	72%	0.719	78%	0.782	S	S	*	*			trans	136.9	137.7	149.8	-78.7	7.8	0	0	0	114.5
959	S	29.8	Very low	32.1	Very low	95.5 Å²	95.5	148.1 Å²	148.1	67%	0.668	78%	0.777	S	S	*	*				99.4	145.3	85.4	66.4	0	0	0	0	115.7
960	I	33.4	Very low	32.5	Very low	163.25 Å²	163.25	147.3 Å²	147.3	84%	0.837	77%	0.773	S	S	*	*			trans	115.4	133.6	149.2	-73.6	160.1	0	0	0	113.9
961	A	30.3	Very low	33	Very low	78.75 Å²	78.75	143.1 Å²	143.1	65%	0.651	76%	0.763	S	S	*	*			trans	-10.4	142.6	154.7	0	0	0	0	0	114.8
962	S	29.3	Very low	33.8	Very low	103.25 Å²	103.25	139.7 Å²	139.7	72%	0.722	76%	0.757	S	S	*	*				65.1	132.3	63.5	65.5	0	0	0	0	113.4
963	T	31.7	Very low	34.4	Very low	126.75 Å²	126.75	137.8 Å²	137.8	78%	0.778	75%	0.749	S	S	*	*				-166	165.5	58	6	0	0	0	0	110.9
964	Q	33.2	Very low	35.3	Very low	184.75 Å²	184.75	134.4 Å²	134.4	86%	0.863	74%	0.739	S	S	*	*			trans	60.8	139.7	170	-58.6	173.5	13.7	0	0	115
965	S	33	Very low	36.4	Very low	101.5 Å²	101.5	128.1 Å²	128.1	71%	0.71	72%	0.723	S	S	*	*			cis	-159.9	148.9	9.4	48.4	0	0	0	0	113.8
966	N	31.8	Very low	37.5	Very low	150.25 Å²	150.25	128.5 Å²	128.5	80%	0.803	71%	0.709	S	S	*	*			trans	25.4	115.9	155.4	-57.4	-2	0	0	0	119.4
967	Q	33.2	Very low	38.2	Very low	181.75 Å²	181.75	126.2 Å²	126.2	85%	0.849	70%	0.699	S	S	*	*				-168.9	135.7	94	-87.8	179.6	40.1	0	0	111.7
968	N	32.6	Very low	39.3	Very low	143.75 Å²	143.75	124.2 Å²	124.2	77%	0.769	69%	0.688	S	S	*	*			trans	140.7	100.8	158.7	-76.1	-20.1	0	0	0	112.8
969	S	37.9	Very low	40.1	Very low	93.5 Å²	93.5	124.8 Å²	124.8	65%	0.654	68%	0.684	S	S	*	*			trans	-19.5	15.7	143.3	59	0	0	0	0	117.1	S973	S969-S973 PolarHBondContact O-OG 3.35Å
970	D	40.6	Very low	41.1	Very low	125.5 Å²	125.5	126.5 Å²	126.5	67%	0.671	68%	0.679	S	S	*	*	H	α-helix	trans	-127.3	-10.1	-153.2	-84.8	-22.8	0	0	0	112.3	E972 S973 L974	D970-E972 PolarHBondContact O-N 2.94Å; D970-S973 PolarHBondContact O-OG 3.16Å; D970-L974 WeakPolarHBondContact O-CB 3.35Å
971	T	44.3	Very low	41.5	Very low	102.25 Å²	102.25	124.9 Å²	124.9	63%	0.627	67%	0.672	S	S	*	*	H	α-helix	trans	-60	-18.4	170.9	50	0	0	0	0	116.3	S973 L974 L975	T971-S973 PolarHBondContact O-N 2.82Å; T971-L974 WeakPolarHBondContact O-CB 3.42Å; T971-L974 PolarHBondContact O-N 2.95Å; T971-L974 VanDerWaalsContact O-N 3.12Å; T971-L975 WeakPolarHBondContact O-CB 3.44Å; T971-L975 WeakPolarHBondContact O-CG 3.47Å; T971-L975 PolarHBondContact O-N 3.3Å
972	E	46.4	Very low	42.1	Very low	151.25 Å²	151.25	127 Å²	127	71%	0.707	67%	0.668	S	S	*	*	H	α-helix	trans	-84.8	-32.9	-179.9	-167.5	159.6	-149.7	0	0	113.6	D970 L974 L975 E976	D970-E972 PolarHBondContact O-N 2.94Å; E972-L974 VanDerWaalsContact C-N 3.3Å; E972-L974 PolarHBondContact O-N 3.09Å; E972-L975 PolarHBondContact O-N 3.02Å; E972-E976 WeakPolarHBondContact O-CB 3.45Å; E972-E976 PolarHBondContact O-N 2.92Å
973	S	46.5	Very low	42.5	Very low	81.25 Å²	81.25	128.5 Å²	128.5	57%	0.568	67%	0.668	S	S	*	*	H	α-helix	trans	-66.3	-35	175	46.5	0	0	0	0	113.5	S969 D970 T971 E976 F977	S969-S973 PolarHBondContact O-OG 3.35Å; D970-S973 PolarHBondContact O-OG 3.16Å; T971-S973 PolarHBondContact O-N 2.82Å; S973-E976 PolarHBondContact O-N 3.1Å; S973-F977 VanDerWaalsContact O-CB 3.26Å; S973-F977 WeakPolarHBondContact O-CB 3.39Å; S973-F977 PolarHBondContact O-N 2.89Å; S973-F977 VanDerWaalsContact O-N 3.16Å
974	L	50.9	Low	42.7	Very low	121.25 Å²	121.25	127.9 Å²	127.9	64%	0.635	66%	0.66	S	S	*	*	H	α-helix	trans	-76.8	-33.7	-179.3	-145.3	158.7	0	0	0	111.9	D970 T971 E972 F977 Q978	D970-L974 WeakPolarHBondContact O-CB 3.35Å; T971-L974 WeakPolarHBondContact O-CB 3.42Å; T971-L974 PolarHBondContact O-N 2.95Å; T971-L974 VanDerWaalsContact O-N 3.12Å; E972-L974 VanDerWaalsContact C-N 3.3Å; E972-L974 PolarHBondContact O-N 3.09Å; L974-F977 WeakPolarHBondContact O-CB 3.5Å; L974-F977 PolarHBondContact O-N 3.35Å; L974-Q978 VanDerWaalsContact O-CB 3.25Å; L974-Q978 WeakPolarHBondContact O-CB 3.34Å; L974-Q978 PolarHBondContact O-N 3.31Å
975	L	53.1	Low	42.7	Very low	105 Å²	105	124 Å²	124	55%	0.55	65%	0.65	S	S	.	*	H	α-helix	trans	-75.2	-32.4	171.9	-80	166	0	0	0	113	T971 E972 F977 Q978 K979	T971-L975 WeakPolarHBondContact O-CB 3.44Å; T971-L975 WeakPolarHBondContact O-CG 3.47Å; T971-L975 PolarHBondContact O-N 3.3Å; E972-L975 PolarHBondContact O-N 3.02Å; L975-F977 VanDerWaalsContact C-N 3.28Å; L975-F977 PolarHBondContact O-N 3.2Å; L975-Q978 PolarHBondContact O-N 3.12Å; L975-K979 WeakPolarHBondContact O-CB 3.25Å; L975-K979 VanDerWaalsContact O-CG 3.28Å; L975-K979 WeakPolarHBondContact O-CG 3.4Å; L975-K979 PolarHBondContact O-N 3.09Å
976	E	54.5	Low	42.8	Very low	100.25 Å²	100.25	124.9 Å²	124.9	47%	0.468	65%	0.653	S	S	.	*	H	α-helix	trans	-75	-32.3	174.5	-132.9	-144.4	151.6	0	0	112.3	E972 S973 Q978 K979 K980	E972-E976 WeakPolarHBondContact O-CB 3.45Å; E972-E976 PolarHBondContact O-N 2.92Å; S973-E976 PolarHBondContact O-N 3.1Å; E976-Q978 VanDerWaalsContact C-N 3.27Å; E976-Q978 PolarHBondContact O-N 2.75Å; E976-K979 CarbonylContact O-C 3.57Å; E976-K979 PolarHBondContact O-N 3.1Å; E976-K980 WeakPolarHBondContact O-CB 3.42Å; E976-K980 WeakPolarHBondContact O-CD 3.34Å; E976-K980 VanDerWaalsContact O-CG 3.28Å; E976-K980 WeakPolarHBondContact O-CG 3.33Å; E976-K980 PolarHBondContact O-N 3.04Å; E976-K980 VanDerWaalsContact O-N 3.08Å; E976-K980 PolarHBondContact O-NZ 3.32Å; E976-K980 WeakPolarHBondContact OE1-CE 3.26Å; E976-K980 IonicContact OE1-NZ 3.06Å; E976-K980 PolarHBondContact OE1-NZ 3.04Å; E976-K980 IonicContact OE2-NZ 2.75Å; E976-K980 PolarHBondContact OE2-NZ 3.17Å
977	F	46.5	Very low	42.8	Very low	145.25 Å²	145.25	126.8 Å²	126.8	64%	0.637	65%	0.65	S	S	*	*	H	α-helix	trans	-66.1	-42.4	172.2	-174.7	-108.2	0	0	0	111.5	S973 L974 L975 K979 K980 L981	S973-F977 VanDerWaalsContact O-CB 3.26Å; S973-F977 WeakPolarHBondContact O-CB 3.39Å; S973-F977 PolarHBondContact O-N 2.89Å; S973-F977 VanDerWaalsContact O-N 3.16Å; L974-F977 WeakPolarHBondContact O-CB 3.5Å; L974-F977 PolarHBondContact O-N 3.35Å; L975-F977 VanDerWaalsContact C-N 3.28Å; L975-F977 PolarHBondContact O-N 3.2Å; F977-K979 VanDerWaalsContact C-N 3.3Å; F977-K979 PolarHBondContact O-N 3.1Å; F977-K980 WeakPolarHBondContact O-CB 3.23Å; F977-K980 PolarHBondContact O-N 3.02Å; F977-L981 HydrophobicContact CD1-CD1 4.02Å; F977-L981 HydrophobicContact CE1-CD1 3.71Å; F977-L981 HydrophobicContact CE1-CG 4.36Å; F977-L981 HydrophobicContact CZ-CD1 4.19Å; F977-L981 HydrophobicContact CZ-CG 4.47Å; F977-L981 WeakPolarHBondContact O-CG 3.44Å; F977-L981 PolarHBondContact O-N 3.24Å
978	Q	54.5	Low	42.5	Very low	119 Å²	119	123.6 Å²	123.6	56%	0.556	65%	0.646	S	S	*	*	H	α-helix	trans	-68.3	-30	176.7	-164	172.4	5.7	0	0	112.8	L974 L975 E976 K980 L981 Q982	L974-Q978 VanDerWaalsContact O-CB 3.25Å; L974-Q978 WeakPolarHBondContact O-CB 3.34Å; L974-Q978 PolarHBondContact O-N 3.31Å; L975-Q978 PolarHBondContact O-N 3.12Å; E976-Q978 VanDerWaalsContact C-N 3.27Å; E976-Q978 PolarHBondContact O-N 2.75Å; Q978-K980 PolarHBondContact O-N 3.33Å; Q978-L981 PolarHBondContact O-N 3.03Å; Q978-Q982 WeakPolarHBondContact O-CG 3.37Å; Q978-Q982 PolarHBondContact O-N 3.13Å
979	K	49.1	Very low	42.4	Very low	146 Å²	146	121.5 Å²	121.5	64%	0.635	64%	0.642	S	S	*	*	H	α-helix	trans	-76.8	-27	172.6	-75.3	173.3	179.8	173.9	0	113.2	L975 E976 F977 L981 Q982	L975-K979 WeakPolarHBondContact O-CB 3.25Å; L975-K979 VanDerWaalsContact O-CG 3.28Å; L975-K979 WeakPolarHBondContact O-CG 3.4Å; L975-K979 PolarHBondContact O-N 3.09Å; E976-K979 CarbonylContact O-C 3.57Å; E976-K979 PolarHBondContact O-N 3.1Å; F977-K979 VanDerWaalsContact C-N 3.3Å; F977-K979 PolarHBondContact O-N 3.1Å; K979-L981 VanDerWaalsContact C-N 3.3Å; K979-L981 PolarHBondContact O-N 3.1Å; K979-Q982 PolarHBondContact O-N 3.33Å; K979-Q982 VanDerWaalsContact O-N 3.1Å
980	K	50.4	Low	42	Very low	131.75 Å²	131.75	124.7 Å²	124.7	57%	0.573	65%	0.649	S	S	*	*	H	α-helix	trans	-76.6	-17.2	176.4	-77.3	171.3	178.6	147.3	0	113.3	E976 F977 Q978 Q982	E976-K980 WeakPolarHBondContact O-CB 3.42Å; E976-K980 WeakPolarHBondContact O-CD 3.34Å; E976-K980 VanDerWaalsContact O-CG 3.28Å; E976-K980 WeakPolarHBondContact O-CG 3.33Å; E976-K980 PolarHBondContact O-N 3.04Å; E976-K980 VanDerWaalsContact O-N 3.08Å; E976-K980 PolarHBondContact O-NZ 3.32Å; E976-K980 WeakPolarHBondContact OE1-CE 3.26Å; E976-K980 IonicContact OE1-NZ 3.06Å; E976-K980 PolarHBondContact OE1-NZ 3.04Å; E976-K980 IonicContact OE2-NZ 2.75Å; E976-K980 PolarHBondContact OE2-NZ 3.17Å; F977-K980 WeakPolarHBondContact O-CB 3.23Å; F977-K980 PolarHBondContact O-N 3.02Å; Q978-K980 PolarHBondContact O-N 3.33Å; K980-Q982 VanDerWaalsContact C-N 3.31Å; K980-Q982 PolarHBondContact O-N 3.03Å
981	L	42	Very low	41.6	Very low	130.25 Å²	130.25	125.5 Å²	125.5	68%	0.682	65%	0.653	S	S	*	*	H	α-helix	trans	-78.3	-2.9	173	-75.2	171	0	0	0	113.8	F977 Q978 K979 N983	F977-L981 HydrophobicContact CD1-CD1 4.02Å; F977-L981 HydrophobicContact CE1-CD1 3.71Å; F977-L981 HydrophobicContact CE1-CG 4.36Å; F977-L981 HydrophobicContact CZ-CD1 4.19Å; F977-L981 HydrophobicContact CZ-CG 4.47Å; F977-L981 WeakPolarHBondContact O-CG 3.44Å; F977-L981 PolarHBondContact O-N 3.24Å; Q978-L981 PolarHBondContact O-N 3.03Å; K979-L981 VanDerWaalsContact C-N 3.3Å; K979-L981 PolarHBondContact O-N 3.1Å; L981-N983 VanDerWaalsContact C-N 3.34Å; L981-N983 PolarHBondContact O-N 3.39Å
982	Q	43.6	Very low	40.9	Very low	122.5 Å²	122.5	129.3 Å²	129.3	57%	0.572	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.1	23.2	-176.6	-87.1	-179.5	-2.6	0	0	112.7	Q978 K979 K980 L984	Q978-Q982 WeakPolarHBondContact O-CG 3.37Å; Q978-Q982 PolarHBondContact O-N 3.13Å; K979-Q982 PolarHBondContact O-N 3.33Å; K979-Q982 VanDerWaalsContact O-N 3.1Å; K980-Q982 VanDerWaalsContact C-N 3.31Å; K980-Q982 PolarHBondContact O-N 3.03Å; Q982-L984 HydrophobicContact CB-CD1 4.1Å; Q982-L984 HydrophobicContact CB-CG 4.26Å; Q982-L984 PolarHBondContact O-N 3.11Å; Q982-L984 VanDerWaalsContact O-N 3.14Å
983	N	36.2	Very low	40.4	Very low	134.25 Å²	134.25	129.1 Å²	129.1	72%	0.718	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	129.8	93	174.5	-78.2	-67.7	0	0	0	113.5	L981	L981-N983 VanDerWaalsContact C-N 3.34Å; L981-N983 PolarHBondContact O-N 3.39Å
984	L	35.5	Very low	39.6	Very low	115 Å²	115	132.5 Å²	132.5	60%	0.602	68%	0.68	S	S	*	*	P	Polyproline II helix	trans	-1.2	136.3	167.3	-70.5	154	0	0	0	113.9	L711 Q982	L711-L984 HydrophobicContact CD1-CD2 4.31Å; L711-L984 HydrophobicContact CD2-CD2 4.07Å; L711-L984 HydrophobicContact CD2-CG 4.39Å; Q982-L984 HydrophobicContact CB-CD1 4.1Å; Q982-L984 HydrophobicContact CB-CG 4.26Å; Q982-L984 PolarHBondContact O-N 3.11Å; Q982-L984 VanDerWaalsContact O-N 3.14Å
985	P	34.9	Very low	38.7	Very low	102.75 Å²	102.75	132.3 Å²	132.3	67%	0.667	68%	0.683	S	S	*	*			trans	-90.5	169.8	-160.1	15.3	-2.6	0	0	0	112.3	R987	P985-R987 PolarHBondContact O-N 3.4Å; P985-R987 VanDerWaalsContact O-N 3.16Å
986	P	34.4	Very low	37.5	Very low	120 Å²	120	134.2 Å²	134.2	78%	0.779	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-84.2	142.2	175.1	32.7	-33	0	0	0	113.2	C988	P986-C988 PolarHBondContact O-N 2.72Å
987	R	31.7	Very low	36.2	Very low	191 Å²	191	139.3 Å²	139.3	72%	0.721	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-108.1	133.8	168.8	-64.5	-175.9	177.9	177.8	-1.7	111.8	E704 P985 S989	E704-R987 VanDerWaalsContact CD-CZ 3.48Å; E704-R987 VanDerWaalsContact CD-NH1 3.35Å; E704-R987 VanDerWaalsContact CD-NH2 3.27Å; E704-R987 IonicContact OE1-CZ 3.88Å; E704-R987 IonicContact OE1-NH1 2.81Å; E704-R987 PolarHBondContact OE1-NH1 3.34Å; E704-R987 IonicContact OE2-CZ 2.83Å; E704-R987 IonicContact OE2-NH1 3.17Å; E704-R987 PolarHBondContact OE2-NH1 2.94Å; E704-R987 IonicContact OE2-NH2 3.33Å; E704-R987 PolarHBondContact OE2-NH2 2.9Å; P985-R987 PolarHBondContact O-N 3.4Å; P985-R987 VanDerWaalsContact O-N 3.16Å; R987-S989 PolarHBondContact O-N 3.15Å
988	C	27	Very low	35.3	Very low	114 Å²	114	141.6 Å²	141.6	77%	0.77	72%	0.72	S	S	*	*			trans	-72.5	128.4	158	-71.1	0	0	0	0	111	P986 M990	P986-C988 PolarHBondContact O-N 2.72Å; C988-M990 PolarHBondContact O-N 3.1Å
989	S	30.2	Very low	34	Very low	99.5 Å²	99.5	140.6 Å²	140.6	70%	0.696	73%	0.726	S	S	*	*			trans	-0.4	125.1	147.8	60.5	0	0	0	0	111.4	R987	R987-S989 PolarHBondContact O-N 3.15Å
990	M	29.5	Very low	33.1	Very low	160.5 Å²	160.5	138.6 Å²	138.6	79%	0.791	73%	0.731	S	S	*	*				-116.3	139.3	80.5	-68.8	-64.2	-160.9	0	0	108.4	C988	C988-M990 PolarHBondContact O-N 3.1Å
991	D	32.4	Very low	32	Very low	142.25 Å²	142.25	140 Å²	140	76%	0.761	74%	0.744	S	S	*	*			trans	-18.4	145.7	153.8	-55.6	-40.7	0	0	0	112.8	D993	D991-D993 PolarHBondContact O-N 3.11Å
992	E	30.4	Very low	31.5	Very low	182 Å²	182	138.9 Å²	138.9	85%	0.85	74%	0.744	S	S	*	*				-109.5	141.7	-76.4	-61.3	-171.2	141.2	0	0	111.8
993	D	34.5	Very low	30.7	Very low	147.5 Å²	147.5	140.7 Å²	140.7	79%	0.789	76%	0.757	S	S	*	*			trans	134.9	145.4	164.1	-70.5	-32.9	0	0	0	117.7	D991 V995	D991-D993 PolarHBondContact O-N 3.11Å; D993-V995 PolarHBondContact O-N 2.97Å
994	D	30.3	Very low	30.2	Very low	153 Å²	153	143.3 Å²	143.3	82%	0.818	76%	0.762	S	S	*	*			trans	51.5	118.8	175	-96.2	-22.4	0	0	0	118.1
995	V	31	Very low	30	Very low	117.5 Å²	117.5	144.3 Å²	144.3	71%	0.712	77%	0.773	S	S	*	*			trans	12.7	107.9	152.7	-176	0	0	0	0	116.8	D993	D993-V995 PolarHBondContact O-N 2.97Å
996	N	27.8	Very low	29.7	Very low	144.75 Å²	144.75	145.9 Å²	145.9	77%	0.774	78%	0.78	S	S	*	*			trans	56.6	113	147.7	-65.5	-26.1	0	0	0	119.7	F998	N996-F998 PolarHBondContact O-N 3.04Å
997	Y	28	Very low	29.5	Very low	205.5 Å²	205.5	143.4 Å²	143.4	81%	0.806	78%	0.777	S	S	*	*			trans	-123.8	125.4	151.3	-96.5	-104.7	0	0	0	114
998	F	28	Very low	29.5	Very low	194.25 Å²	194.25	142.8 Å²	142.8	85%	0.852	78%	0.782	S	S	*	*			trans	-138.3	128.5	130.1	-103.3	-85.4	0	0	0	113	N996	N996-F998 PolarHBondContact O-N 3.04Å
999	S	27.5	Very low	29.7	Very low	98 Å²	98	145.2 Å²	145.2	69%	0.685	78%	0.779	S	S	*	*			trans	-149.1	137.2	160.7	95.5	0	0	0	0	111.6
1000	S	29.6	Very low	29.7	Very low	104.25 Å²	104.25	147.1 Å²	147.1	73%	0.729	78%	0.782	S	S	*	*			trans	77.1	146	167.5	70.2	0	0	0	0	115.4
1001	L	26.6	Very low	29.8	Very low	160.8 Å²	160.8	143 Å²	143	84%	0.842	78%	0.781	S	S	*	*				-109.6	162	116.1	-86.1	112.3	0	0	0	110.8
1002	P	31.8	Very low	29.7	Very low	107.6 Å²	107.6	145.4 Å²	145.4	70%	0.699	79%	0.787	S	S	*	*				-115	170.7	-89.3	33	-19.6	0	0	0	113.8
1003	L	27.5	Very low	29.6	Very low	160.4 Å²	160.4	141.8 Å²	141.8	84%	0.84	78%	0.782	S	S	*	*			trans	-88.1	133.2	160.8	-86.8	135.9	0	0	0	114.7
1004	K	26.2	Very low	29.2	Very low	188.6 Å²	188.6	141.7 Å²	141.7	82%	0.82	78%	0.78	S	S	*	*			trans	-114.2	140.2	169.6	-87.8	-177.6	177.6	179.3	0	112.7	V1006	K1004-V1006 HydrophobicContact CB-CG2 4.29Å
1005	V	30.3	Very low	29	Very low	136.6 Å²	136.6	139.7 Å²	139.7	83%	0.828	78%	0.777	S	S	*	*			trans	-136.5	132.8	155.6	-178.5	0	0	0	0	112
1006	V	29.4	Very low	28.8	Very low	136.2 Å²	136.2	143 Å²	143	83%	0.825	78%	0.782	S	S	*	*			trans	-84.2	136.7	158.3	-178.6	0	0	0	0	113.7	K1004	K1004-V1006 HydrophobicContact CB-CG2 4.29Å
1007	G	30.7	Very low	28.8	Very low	68 Å²	68	146.4 Å²	146.4	70%	0.701	79%	0.785	S	S	*	*			trans	140.3	119	151.1	0	0	0	0	0	111.8
1008	Q	31.2	Very low	29.2	Very low	178.2 Å²	178.2	141.9 Å²	141.9	83%	0.833	78%	0.781	S	S	*	*				94.7	142.8	88.1	-101.4	-176.2	-13.7	0	0	113
1009	K	30.6	Very low	29.2	Very low	163 Å²	163	139 Å²	139	71%	0.709	78%	0.775	S	S	*	*				143.8	151.9	113.6	-96	-172.3	166.2	-155.8	0	113.9
1010	D	31	Very low	29.2	Very low	140.4 Å²	140.4	141.3 Å²	141.3	75%	0.751	78%	0.779	S	S	*	*			trans	96.9	146.1	142	-65.7	-28.5	0	0	0	113.8
1011	G	31.4	Very low	29.3	Very low	74.6 Å²	74.6	141.2 Å²	141.2	77%	0.769	78%	0.779	S	S	*	*			trans	154.3	90.9	175.1	0	0	0	0	0	118.9
1012	Q	30.1	Very low	29.4	Very low	193.2 Å²	193.2	142.4 Å²	142.4	90%	0.903	78%	0.78	S	S	*	*			trans	62	139	149.7	-74.3	-177.9	-8.3	0	0	119.3
1013	S	28.8	Very low	29.2	Very low	104.8 Å²	104.8	143.1 Å²	143.1	73%	0.733	79%	0.786	S	S	*	*			trans	159.9	120.7	152.2	77.8	0	0	0	0	116.9
1014	I	26.2	Very low	29.1	Very low	146.2 Å²	146.2	140.5 Å²	140.5	75%	0.75	78%	0.781	S	S	*	*				58.2	115.1	127.1	-59.6	171	0	0	0	117.7	F1016	I1014-F1016 HydrophobicContact CG2-CD2 3.52Å; I1014-F1016 HydrophobicContact CG2-CE2 3.63Å
1015	C	25.6	Very low	29.3	Very low	111.6 Å²	111.6	137.7 Å²	137.7	75%	0.754	78%	0.779	S	S	*	*			trans	95.3	156.9	144.8	-73.5	0	0	0	0	117.4
1016	F	27.1	Very low	29.1	Very low	186.2 Å²	186.2	136.6 Å²	136.6	82%	0.817	78%	0.776	S	S	*	*			trans	-133.4	159.5	-162.3	-83.7	-81.3	0	0	0	112.5	I1014	I1014-F1016 HydrophobicContact CG2-CD2 3.52Å; I1014-F1016 HydrophobicContact CG2-CE2 3.63Å
1017	Y	27.2	Very low	29.1	Very low	216.4 Å²	216.4	136.2 Å²	136.2	85%	0.849	77%	0.774	S	S	*	*			trans	-81.3	170.3	168.1	-70	-76.3	0	0	0	111.8
1018	P	36.3	Very low	29	Very low	110.6 Å²	110.6	140.8 Å²	140.8	72%	0.718	78%	0.777	S	S	*	*			cis	-126.4	-173.5	7.5	36.5	-18.5	0	0	0	113.6
1019	N	28.2	Very low	28.9	Very low	133.6 Å²	133.6	138.9 Å²	138.9	71%	0.714	77%	0.773	S	S	*	*			trans	161.8	150.8	148.9	-93.8	21.1	0	0	0	116
1020	D	27.5	Very low	28.9	Very low	146.4 Å²	146.4	136.3 Å²	136.3	78%	0.783	78%	0.775	S	S	*	*			trans	-147.2	141.8	138.8	-72.9	-34.2	0	0	0	117.1
1021	S	31.6	Very low	28.9	Very low	102.8 Å²	102.8	134.7 Å²	134.7	72%	0.719	78%	0.781	S	S	*	*			trans	152.9	132.4	149	51.9	0	0	0	0	116.6
1022	E	28.9	Very low	29	Very low	186 Å²	186	134.3 Å²	134.3	87%	0.869	78%	0.778	S	S	*	*			trans	38.6	145.1	142.3	-70.7	-177.5	175.1	0	0	118.2
1023	C	27.1	Very low	29.1	Very low	121 Å²	121	134.1 Å²	134.1	82%	0.818	78%	0.777	S	S	*	*			trans	-177.4	157.7	143.6	-91.3	0	0	0	0	116
1024	S	26.7	Very low	29.3	Very low	105.6 Å²	105.6	134.6 Å²	134.6	74%	0.738	78%	0.776	S	S	*	*			trans	-157.7	156.4	164.5	70.6	0	0	0	0	114.6
1025	V	29.2	Very low	29.5	Very low	130 Å²	130	138.4 Å²	138.4	79%	0.788	78%	0.781	S	S	*	*			trans	116	122.4	162.2	173.5	0	0	0	0	114.8
1026	C	26	Very low	29.9	Very low	113.2 Å²	113.2	137.4 Å²	137.4	77%	0.765	77%	0.774	S	S	*	*			trans	43	156.3	149	-55.9	0	0	0	0	117.1
1027	V	30.1	Very low	30.2	Very low	129 Å²	129	135.3 Å²	135.3	78%	0.782	77%	0.772	S	S	*	*				166.3	138.4	103.4	170.6	0	0	0	0	113.2
1028	E	27.4	Very low	30.5	Very low	164 Å²	164	128.7 Å²	128.7	77%	0.766	76%	0.762	S	S	*	*			trans	-36	166.5	146.2	-70	166.2	175.9	0	0	120.5
1029	N	30.2	Very low	30.3	Very low	138.6 Å²	138.6	130.6 Å²	130.6	74%	0.741	77%	0.766	S	S	*	*			trans	118.6	151.5	149.7	-76.8	-53.6	0	0	0	120.4
1030	S	31.5	Very low	30.5	Very low	107.4 Å²	107.4	129.5 Å²	129.5	75%	0.751	77%	0.765	S	S	*	*			trans	138.8	147.7	-164.7	58.1	0	0	0	0	117.4
1031	A	30.9	Very low	30.7	Very low	106.8 Å²	106.8	130.3 Å²	130.3	88%	0.883	76%	0.763	S	S	*	*			trans	143.7	153.7	171.6	0	0	0	0	0	115.1
1032	G	32.7	Very low	30.6	Very low	67.4 Å²	67.4	132.1 Å²	132.1	70%	0.695	77%	0.765	S	S	*	*			trans	141.3	133.8	162.8	0	0	0	0	0	113.8
1033	Q	32.9	Very low	30.6	Very low	187.8 Å²	187.8	128.1 Å²	128.1	88%	0.878	76%	0.764	S	S	*	*				76.9	127.1	100.3	-65.5	-169.6	8.8	0	0	115.9
1034	T	31.8	Very low	30.8	Very low	115.6 Å²	115.6	125.8 Å²	125.8	71%	0.709	76%	0.76	S	S	*	*			cis	167.6	153.5	32.9	48.6	0	0	0	0	114.4
1035	R	31.9	Very low	30.9	Very low	227 Å²	227	128.9 Å²	128.9	86%	0.857	77%	0.769	S	S	*	*				103.4	162.9	107.3	-99.3	176.4	166.6	150.9	-2.2	115.1	D1037	R1035-D1037 IonicContact CZ-OD2 3.99Å; R1035-D1037 IonicContact NE-OD2 3.72Å; R1035-D1037 PolarHBondContact NE-OD2 2.92Å; R1035-D1037 IonicContact NH2-OD1 2.72Å; R1035-D1037 IonicContact NH2-OD2 3.62Å; R1035-D1037 PolarHBondContact NH2-OD2 3.28Å
1036	S	32.9	Very low	30.8	Very low	89.4 Å²	89.4	127.2 Å²	127.2	63%	0.625	77%	0.768	S	S	*	*			cis	-176.8	158.3	-15.7	49.9	0	0	0	0	111.3
1037	D	33.7	Very low	30.9	Very low	142 Å²	142	127.7 Å²	127.7	76%	0.759	77%	0.772	S	S	*	*				123.6	139	79.9	-83.1	-39	0	0	0	116.4	R1035	R1035-D1037 IonicContact CZ-OD2 3.99Å; R1035-D1037 IonicContact NE-OD2 3.72Å; R1035-D1037 PolarHBondContact NE-OD2 2.92Å; R1035-D1037 IonicContact NH2-OD1 2.72Å; R1035-D1037 IonicContact NH2-OD2 3.62Å; R1035-D1037 PolarHBondContact NH2-OD2 3.28Å
1038	A	33	Very low	30.9	Very low	78.2 Å²	78.2	130.2 Å²	130.2	65%	0.646	78%	0.775	S	S	*	*			trans	102.8	137.2	139.5	0	0	0	0	0	118.3
1039	N	31.8	Very low	30.8	Very low	151.2 Å²	151.2	127.9 Å²	127.9	81%	0.809	78%	0.777	S	S	*	*			trans	84	140.7	138.1	-69	-9	0	0	0	118.6
1040	T	32.5	Very low	30.7	Very low	110.4 Å²	110.4	128.9 Å²	128.9	68%	0.677	78%	0.782	S	S	*	*			cis	157	135.5	22.9	-29.8	0	0	0	0	114.1
1041	E	32	Very low	30.6	Very low	162.2 Å²	162.2	128.2 Å²	128.2	76%	0.758	78%	0.782	S	S	*	*			trans	74.2	132.7	151.1	-71.1	-179.5	-140.8	0	0	120.4
1042	N	29.6	Very low	30.4	Very low	142 Å²	142	129 Å²	129	76%	0.759	78%	0.776	S	S	*	*				112.5	118	70.7	-85.5	-35.2	0	0	0	115.2
1043	A	29.6	Very low	30.3	Very low	102 Å²	102	131.2 Å²	131.2	84%	0.843	78%	0.778	S	S	*	*			trans	161.5	153.9	148.7	0	0	0	0	0	114.5
1044	G	29.8	Very low	30	Very low	71 Å²	71	130.5 Å²	130.5	73%	0.732	77%	0.774	S	S	*	*			trans	144.4	85	167.6	0	0	0	0	0	116.9	A1046	G1044-A1046 PolarHBondContact O-N 2.94Å
1045	N	29.5	Very low	29.8	Very low	171.4 Å²	171.4	132.1 Å²	132.1	92%	0.917	78%	0.777	S	S	*	*			trans	23	131.9	152	-71	-21.8	0	0	0	115.1
1046	A	27.7	Very low	29.6	Very low	95.2 Å²	95.2	129.6 Å²	129.6	79%	0.787	78%	0.775	S	S	*	*			trans	-152.4	146	158.1	0	0	0	0	0	113.6	G1044 Q1048	G1044-A1046 PolarHBondContact O-N 2.94Å; A1046-Q1048 PolarHBondContact O-N 3.44Å
1047	C	26.7	Very low	29.4	Very low	122.8 Å²	122.8	132.5 Å²	132.5	83%	0.83	78%	0.782	S	S	*	*			trans	-72.3	128.7	173.6	-101.8	0	0	0	0	113.3
1048	Q	30.2	Very low	29	Very low	182 Å²	182	132.9 Å²	132.9	85%	0.85	78%	0.779	S	S	*	*				-137.4	130	111.2	-82.8	166.8	25.7	0	0	111.5	A1046 L1050	A1046-Q1048 PolarHBondContact O-N 3.44Å; Q1048-L1050 VanDerWaalsContact C-N 3.32Å; Q1048-L1050 PolarHBondContact O-N 3.44Å
1049	S	26.7	Very low	28.8	Very low	116.2 Å²	116.2	136.2 Å²	136.2	81%	0.813	79%	0.785	S	S	*	*			trans	-127.1	121.1	160	-165.1	0	0	0	0	111.1
1050	L	28.3	Very low	28.7	Very low	159.6 Å²	159.6	138.9 Å²	138.9	84%	0.836	78%	0.783	S	S	*	*			trans	-128.1	129	166	-102.1	150.7	0	0	0	110.5	Q1048 V1052	Q1048-L1050 VanDerWaalsContact C-N 3.32Å; Q1048-L1050 PolarHBondContact O-N 3.44Å; L1050-V1052 PolarHBondContact O-N 3.24Å
1051	A	27.8	Very low	28.5	Very low	92.6 Å²	92.6	143.9 Å²	143.9	77%	0.765	79%	0.79	S	S	*	*			trans	-69.8	128.4	177.8	0	0	0	0	0	114.1
1052	V	28.5	Very low	28.3	Very low	124 Å²	124	141 Å²	141	75%	0.752	79%	0.794	S	S	*	*			trans	-84.1	131.5	163.6	177.9	0	0	0	0	109.8	L1050 Q1054	L1050-V1052 PolarHBondContact O-N 3.24Å; V1052-Q1054 HydrophobicContact CG1-CG 4.25Å; V1052-Q1054 PolarHBondContact O-N 2.92Å
1053	P	28.7	Very low	28.4	Very low	112.2 Å²	112.2	139.1 Å²	139.1	73%	0.729	79%	0.792	S	S	*	*			trans	-84.3	133.9	177.3	30	-31.6	0	0	0	111.9	I1055	P1053-I1055 HydrophobicContact CG-CG1 4.4Å; P1053-I1055 PolarHBondContact O-N 3.31Å; P1053-I1055 VanDerWaalsContact O-N 3.11Å
1054	Q	27	Very low	28.4	Very low	172.8 Å²	172.8	140.6 Å²	140.6	81%	0.807	79%	0.79	S	S	*	*			trans	-86	115.7	168.5	-76.2	-177.9	-38.7	0	0	110.3	V1052 Q1056	V1052-Q1054 HydrophobicContact CG1-CG 4.25Å; V1052-Q1054 PolarHBondContact O-N 2.92Å; Q1054-Q1056 PolarHBondContact O-N 3.05Å
1055	I	28.4	Very low	28.4	Very low	150 Å²	150	145.2 Å²	145.2	77%	0.769	80%	0.797	S	S	*	*			trans	-108.7	108.9	159	-59.1	-178.6	0	0	0	107	P1053 I1057	P1053-I1055 HydrophobicContact CG-CG1 4.4Å; P1053-I1055 PolarHBondContact O-N 3.31Å; P1053-I1055 VanDerWaalsContact O-N 3.11Å; I1055-I1057 HydrophobicContact CG2-CD1 4.2Å; I1055-I1057 HydrophobicContact CG2-CG1 3.88Å; I1055-I1057 PolarHBondContact O-N 3.03Å
1056	Q	26.9	Very low	28.4	Very low	175 Å²	175	141.5 Å²	141.5	82%	0.818	79%	0.785	S	S	*	*			trans	-83.4	122.2	169.2	-69.6	179.1	-59.9	0	0	109.3	Q1054 E1058	Q1054-Q1056 PolarHBondContact O-N 3.05Å; Q1056-E1058 PolarHBondContact O-N 3.28Å
1057	I	28.5	Very low	28.5	Very low	149.8 Å²	149.8	145 Å²	145	77%	0.768	79%	0.785	S	S	*	*			trans	-92	118.7	163.2	-60.3	177.4	0	0	0	108.4	I1055 I1059	I1055-I1057 HydrophobicContact CG2-CD1 4.2Å; I1055-I1057 HydrophobicContact CG2-CG1 3.88Å; I1055-I1057 PolarHBondContact O-N 3.03Å; I1057-I1059 HydrophobicContact CG2-CD1 4.18Å; I1057-I1059 HydrophobicContact CG2-CG1 4.17Å; I1057-I1059 WeakPolarHBondContact O-CG1 3.48Å; I1057-I1059 PolarHBondContact O-N 3.18Å
1058	E	26.4	Very low	28.6	Very low	150.4 Å²	150.4	148.4 Å²	148.4	70%	0.703	79%	0.786	S	S	*	*			trans	-94.7	122.7	176.8	-169.1	-179.9	-159.8	0	0	111.1	Q1056 R1060	Q1056-E1058 PolarHBondContact O-N 3.28Å; E1058-R1060 VanDerWaalsContact C-N 3.3Å; E1058-R1060 HydrophobicContact CG-CB 4.41Å; E1058-R1060 HydrophobicContact CG-CG 4.24Å; E1058-R1060 PolarHBondContact O-N 3.04Å; E1058-R1060 WeakPolarHBondContact OE1-CD 3.35Å; E1058-R1060 WeakPolarHBondContact OE1-CG 3.13Å; E1058-R1060 IonicContact OE1-CZ 3.3Å; E1058-R1060 IonicContact OE1-NE 2.75Å; E1058-R1060 PolarHBondContact OE1-NE 2.72Å; E1058-R1060 IonicContact OE1-NH1 3.23Å; E1058-R1060 PolarHBondContact OE1-NH1 3.29Å; E1058-R1060 IonicContact OE1-NH2 2.95Å; E1058-R1060 PolarHBondContact OE1-NH2 3.44Å; E1058-R1060 IonicContact OE2-CZ 3.1Å; E1058-R1060 IonicContact OE2-NE 3.16Å; E1058-R1060 PolarHBondContact OE2-NE 2.99Å; E1058-R1060 IonicContact OE2-NH2 3.1Å; E1058-R1060 PolarHBondContact OE2-NH2 3.02Å
1059	I	28.7	Very low	28.5	Very low	147.2 Å²	147.2	144.5 Å²	144.5	76%	0.755	78%	0.779	S	S	*	*			trans	-90.6	97.1	176.2	-57	174.7	0	0	0	109.1	I1057 R1061	I1057-I1059 HydrophobicContact CG2-CD1 4.18Å; I1057-I1059 HydrophobicContact CG2-CG1 4.17Å; I1057-I1059 WeakPolarHBondContact O-CG1 3.48Å; I1057-I1059 PolarHBondContact O-N 3.18Å; I1059-R1061 HydrophobicContact CG2-CG 4.09Å; I1059-R1061 PolarHBondContact O-N 3.04Å; I1059-R1061 VanDerWaalsContact O-N 3.1Å
1060	R	29.1	Very low	28.5	Very low	207.2 Å²	207.2	145.6 Å²	145.6	78%	0.782	78%	0.78	S	S	*	*			trans	-113.3	111.4	165.9	-77.8	178.1	-178	170.9	0.7	111.4	E1058 A1062	E1058-R1060 VanDerWaalsContact C-N 3.3Å; E1058-R1060 HydrophobicContact CG-CB 4.41Å; E1058-R1060 HydrophobicContact CG-CG 4.24Å; E1058-R1060 PolarHBondContact O-N 3.04Å; E1058-R1060 WeakPolarHBondContact OE1-CD 3.35Å; E1058-R1060 WeakPolarHBondContact OE1-CG 3.13Å; E1058-R1060 IonicContact OE1-CZ 3.3Å; E1058-R1060 IonicContact OE1-NE 2.75Å; E1058-R1060 PolarHBondContact OE1-NE 2.72Å; E1058-R1060 IonicContact OE1-NH1 3.23Å; E1058-R1060 PolarHBondContact OE1-NH1 3.29Å; E1058-R1060 IonicContact OE1-NH2 2.95Å; E1058-R1060 PolarHBondContact OE1-NH2 3.44Å; E1058-R1060 IonicContact OE2-CZ 3.1Å; E1058-R1060 IonicContact OE2-NE 3.16Å; E1058-R1060 PolarHBondContact OE2-NE 2.99Å; E1058-R1060 IonicContact OE2-NH2 3.1Å; E1058-R1060 PolarHBondContact OE2-NH2 3.02Å; R1060-A1062 PolarHBondContact O-N 3.18Å
1061	R	28.6	Very low	28.5	Very low	215.6 Å²	215.6	141.5 Å²	141.5	81%	0.814	78%	0.777	S	S	*	*			trans	-78.2	123.2	164.3	-69.4	-177.4	173.6	146.3	-2.1	111	I1059 S1063 S1302 S1306	I1059-R1061 HydrophobicContact CG2-CG 4.09Å; I1059-R1061 PolarHBondContact O-N 3.04Å; I1059-R1061 VanDerWaalsContact O-N 3.1Å; R1061-S1063 PolarHBondContact O-N 3.18Å; R1061-S1063 VanDerWaalsContact O-N 3.17Å; R1061-S1302 PolarHBondContact NH2-OG 3.36Å; R1061-S1306 PolarHBondContact NH1-OG 2.93Å
1062	A	28.7	Very low	28.5	Very low	103 Å²	103	146.5 Å²	146.5	85%	0.851	78%	0.784	S	S	*	*			trans	-101.7	116.7	146.1	0	0	0	0	0	110	R1060 V1064	R1060-A1062 PolarHBondContact O-N 3.18Å; A1062-V1064 VanDerWaalsContact C-N 3.26Å; A1062-V1064 PolarHBondContact O-N 2.98Å
1063	S	29.8	Very low	28.5	Very low	101.4 Å²	101.4	143.9 Å²	143.9	71%	0.709	78%	0.783	S	S	*	*			trans	-133.1	127.5	164.5	-104.2	0	0	0	0	110	R1061 L1065	R1061-S1063 PolarHBondContact O-N 3.18Å; R1061-S1063 VanDerWaalsContact O-N 3.17Å; S1063-L1065 PolarHBondContact O-N 3Å; S1063-L1065 VanDerWaalsContact O-N 3.16Å
1064	V	29.6	Very low	28.5	Very low	134.2 Å²	134.2	146.6 Å²	146.6	81%	0.813	79%	0.79	S	S	*	*			trans	-153.6	113.1	169.5	-173.2	0	0	0	0	110.9	A1062	A1062-V1064 VanDerWaalsContact C-N 3.26Å; A1062-V1064 PolarHBondContact O-N 2.98Å
1065	L	30.3	Very low	28.5	Very low	166.8 Å²	166.8	143.6 Å²	143.6	87%	0.873	79%	0.788	S	S	*	*			trans	172.4	115.3	151.6	-88.6	173.6	0	0	0	111	S1063	S1063-L1065 PolarHBondContact O-N 3Å; S1063-L1065 VanDerWaalsContact O-N 3.16Å
1066	S	29.1	Very low	28.5	Very low	94.2 Å²	94.2	142 Å²	142	66%	0.659	79%	0.79	S	S	*	*			trans	-150.9	140.8	154	70.8	0	0	0	0	113.2
1067	Q	29.5	Very low	28.5	Very low	167.2 Å²	167.2	139 Å²	139	78%	0.781	79%	0.789	S	S	*	*			trans	155	122.9	146.8	-82.2	170	-0.4	0	0	113
1068	F	28.8	Very low	28.5	Very low	194.8 Å²	194.8	136 Å²	136	85%	0.854	79%	0.786	S	S	*	*			trans	-78.1	142	155.2	-82	-80.1	0	0	0	113
1069	S	28	Very low	28.6	Very low	100.6 Å²	100.6	134.8 Å²	134.8	70%	0.703	79%	0.789	S	S	*	*			trans	-139.4	151.2	-145	46.2	0	0	0	0	113.6
1070	V	27.5	Very low	28.6	Very low	139 Å²	139	135.2 Å²	135.2	84%	0.842	79%	0.787	S	S	*	*			trans	28	122.2	154	-174.7	0	0	0	0	116.5	Q1072	V1070-Q1072 HydrophobicContact CG1-CG 4.29Å; V1070-Q1072 PolarHBondContact O-N 3.36Å
1071	G	28.1	Very low	28.5	Very low	74 Å²	74	135.2 Å²	135.2	76%	0.763	79%	0.789	S	S	*	*			trans	-163.6	123.2	156.9	0	0	0	0	0	112.3
1072	Q	28.4	Very low	28.6	Very low	196.4 Å²	196.4	132.3 Å²	132.3	92%	0.918	79%	0.789	S	S	*	*			trans	-86.4	152.1	172.2	-64	175.2	-23.7	0	0	112.8	V1070	V1070-Q1072 HydrophobicContact CG1-CG 4.29Å; V1070-Q1072 PolarHBondContact O-N 3.36Å
1073	G	28.1	Very low	28.9	Very low	70 Å²	70	132.3 Å²	132.3	72%	0.722	78%	0.78	S	S	*	*			trans	142.2	102.2	158.8	0	0	0	0	0	114
1074	L	29	Very low	28.9	Very low	168.8 Å²	168.8	134.3 Å²	134.3	88%	0.884	78%	0.782	S	S	*	*				57.5	119.4	118.8	-63.8	171.5	0	0	0	118
1075	S	26.4	Very low	28.9	Very low	110.6 Å²	110.6	135.2 Å²	135.2	77%	0.773	78%	0.781	S	S	*	*			trans	59.3	126.7	140.2	56	0	0	0	0	119.3
1076	S	28.3	Very low	28.9	Very low	116.2 Å²	116.2	133 Å²	133	81%	0.813	78%	0.775	S	S	*	*			trans	112.5	120.4	131.9	-167.4	0	0	0	0	117.3
1077	S	27.3	Very low	29	Very low	112 Å²	112	133 Å²	133	78%	0.783	78%	0.781	S	S	*	*			trans	28.6	137.4	150.3	-147.3	0	0	0	0	120
1078	A	27.8	Very low	29.3	Very low	87.2 Å²	87.2	130.3 Å²	130.3	72%	0.721	78%	0.778	S	S	*	*			trans	79.6	144.9	139.8	0	0	0	0	0	116
1079	V	29.5	Very low	29.4	Very low	125.2 Å²	125.2	126.6 Å²	126.6	76%	0.759	77%	0.771	S	S	*	*				-138.9	135.3	63.8	152.7	0	0	0	0	111.2
1080	E	27.5	Very low	29.5	Very low	153.8 Å²	153.8	128.5 Å²	128.5	72%	0.719	77%	0.774	S	S	*	*			trans	51.7	145.9	143.5	-69.3	174.1	155.3	0	0	116.1
1081	Y	28.6	Very low	29.7	Very low	208.2 Å²	208.2	127.8 Å²	127.8	82%	0.816	77%	0.77	S	S	*	*				-134.1	157.8	90.9	-87.3	-73.3	0	0	0	113.7
1082	L	29.6	Very low	29.8	Very low	154.8 Å²	154.8	129.2 Å²	129.2	81%	0.81	77%	0.767	S	S	*	*			trans	-145.3	160.9	163.7	-120.9	87.4	0	0	0	113.3
1083	P	35.9	Very low	29.9	Very low	102.4 Å²	102.4	130.1 Å²	130.1	67%	0.665	76%	0.762	S	S	*	*				-126.6	173.5	-109.2	34.6	-16.5	0	0	0	114.3
1084	L	29.6	Very low	30	Very low	143.2 Å²	143.2	137.6 Å²	137.6	75%	0.75	77%	0.769	S	S	*	*			trans	92.4	129.4	138.9	-79.7	148.5	0	0	0	116.8	T1086	L1084-T1086 HydrophobicContact CD2-CG2 4.36Å
1085	L	29.8	Very low	30.1	Very low	153.2 Å²	153.2	134.4 Å²	134.4	80%	0.802	76%	0.761	S	S	*	*				-168.4	124.6	117.1	-80.3	165.1	0	0	0	115.5
1086	T	31	Very low	30.5	Very low	120.6 Å²	120.6	134.3 Å²	134.3	74%	0.74	76%	0.76	S	S	*	*			trans	1.4	134.1	154.2	52.9	0	0	0	0	117.5	L1084	L1084-T1086 HydrophobicContact CD2-CG2 4.36Å
1087	A	30.9	Very low	30.6	Very low	93.8 Å²	93.8	132.8 Å²	132.8	78%	0.775	75%	0.754	S	S	*	*				177.8	164.7	127.4	0	0	0	0	0	113.3
1088	P	35.6	Very low	30.8	Very low	110.8 Å²	110.8	133.2 Å²	133.2	72%	0.719	75%	0.752	S	S	*	*			trans	-116.8	171.8	-140.8	36.2	-25.2	0	0	0	115.3
1089	T	30.6	Very low	30.9	Very low	116.8 Å²	116.8	134.9 Å²	134.9	72%	0.717	75%	0.754	S	S	*	*			trans	83.8	133.8	142.8	51.8	0	0	0	0	119.4
1090	N	30.9	Very low	31	Very low	142.2 Å²	142.2	134.8 Å²	134.8	76%	0.76	75%	0.754	S	S	*	*				118.4	141.5	110.8	-82.6	-24.1	0	0	0	118.6
1091	V	30.9	Very low	31.1	Very low	124.6 Å²	124.6	133.6 Å²	133.6	76%	0.755	76%	0.757	S	S	*	*				66.5	122.5	119	-179.7	0	0	0	0	117.7	R1093	V1091-R1093 HydrophobicContact CG1-CG 4.12Å
1092	S	29.8	Very low	31.5	Very low	101.8 Å²	101.8	128.1 Å²	128.1	71%	0.712	75%	0.747	S	S	*	*				164.8	158.1	104.3	-154.8	0	0	0	0	115
1093	R	30.1	Very low	31.7	Very low	215.4 Å²	215.4	130.2 Å²	130.2	81%	0.813	75%	0.745	S	S	*	*			trans	-178.7	148.6	-178.1	-76.6	168.2	-170.8	-161.4	0.4	115.4	V1091	V1091-R1093 HydrophobicContact CG1-CG 4.12Å
1094	R	30.3	Very low	31.3	Very low	228.8 Å²	228.8	130.1 Å²	130.1	86%	0.863	75%	0.747	S	S	*	*			trans	85.8	133	135.9	-75.2	-180	176.3	-174.7	-2.5	115.3
1095	S	31.7	Very low	31.1	Very low	101.8 Å²	101.8	128.8 Å²	128.8	71%	0.712	75%	0.748	S	S	*	*			cis	141.5	158.9	47.5	58.7	0	0	0	0	111.1
1096	S	34	Very low	31	Very low	108 Å²	108	127.8 Å²	127.8	76%	0.755	75%	0.749	S	S	*	*			cis	174.4	156.2	22.6	31.2	0	0	0	0	111
1097	A	31.2	Very low	30.8	Very low	83.8 Å²	83.8	126.8 Å²	126.8	69%	0.693	75%	0.747	S	S	*	*				121.4	168.7	67.9	0	0	0	0	0	113.3
1098	T	31.7	Very low	30.7	Very low	121.2 Å²	121.2	130.5 Å²	130.5	74%	0.744	75%	0.748	S	S	*	*			trans	97.2	135.4	153.7	36.7	0	0	0	0	116.2
1099	T	29.3	Very low	30.2	Very low	123.4 Å²	123.4	132.7 Å²	132.7	76%	0.757	75%	0.753	S	S	*	*				84.2	144	102.7	53.6	0	0	0	0	117.9
1100	T	32	Very low	30	Very low	121.8 Å²	121.8	132.3 Å²	132.3	75%	0.747	76%	0.755	S	S	*	*			cis	-170.9	139.3	49.8	30.4	0	0	0	0	112.6
1101	T	29.7	Very low	29.9	Very low	128.8 Å²	128.8	130.1 Å²	130.1	79%	0.79	75%	0.75	S	S	*	*			trans	109.8	165.6	149.5	52.7	0	0	0	0	115.6
1102	P	36.7	Very low	29.8	Very low	92.4 Å²	92.4	131.6 Å²	131.6	60%	0.6	75%	0.749	S	S	*	*				-125.8	-176.2	-119.2	41.3	-26.1	0	0	0	115	P919	P919-P1102 VanDerWaalsContact CB-O 3.26Å; P919-P1102 WeakPolarHBondContact CB-O 3.31Å; P919-P1102 WeakPolarHBondContact CG-O 3.32Å
1103	Y	33.3	Very low	29.7	Very low	200.2 Å²	200.2	136.3 Å²	136.3	79%	0.785	75%	0.751	S	S	*	*			trans	148.7	131.5	160.9	-66.8	-80.1	0	0	0	113.2	P919 R920 C921 G922	P919-Y1103 WeakPolarHBondContact CB-O 3.26Å; R920-Y1103 VanDerWaalsContact C-CB 3.43Å; R920-Y1103 WeakPolarHBondContact O-CB 3.49Å; C921-Y1103 HydrophobicContact CB-CD1 3.63Å; C921-Y1103 HydrophobicContact CB-CD2 3.56Å; C921-Y1103 HydrophobicContact CB-CE1 3.6Å; C921-Y1103 HydrophobicContact CB-CE2 3.54Å; C921-Y1103 HydrophobicContact CB-CG 3.59Å; G922-Y1103 PolarHBondContact N-OH 3.25Å
1104	S	28.5	Very low	29.6	Very low	100.4 Å²	100.4	131 Å²	131	70%	0.702	75%	0.747	S	S	*	*			cis	133	122.2	34.4	-106.8	0	0	0	0	115.8	R920	R920-S1104 VanDerWaalsContact O-CB 3.31Å; R920-S1104 WeakPolarHBondContact O-CB 3.07Å
1105	C	26.1	Very low	29.6	Very low	114.6 Å²	114.6	125.3 Å²	125.3	77%	0.774	74%	0.742	S	S	*	*			trans	-163.1	152.6	178.3	-80.3	0	0	0	0	113.9
1106	T	26.5	Very low	29.4	Very low	132.4 Å²	132.4	125.9 Å²	125.9	81%	0.812	74%	0.742	S	S	*	*			trans	73.8	126.5	147.5	59.9	0	0	0	0	118.1
1107	S	27.8	Very low	29.3	Very low	99.6 Å²	99.6	126.8 Å²	126.8	70%	0.697	74%	0.742	S	S	*	*			cis	177.9	164.4	10.7	48.2	0	0	0	0	111.3
1108	Q	28	Very low	29.1	Very low	172.4 Å²	172.4	127.7 Å²	127.7	81%	0.806	74%	0.744	S	S	*	*				165.4	155.8	121.1	-101	172.3	1.5	0	0	113.3	S1110	Q1108-S1110 PolarHBondContact O-N 2.64Å
1109	L	25.9	Very low	29	Very low	157.2 Å²	157.2	126.7 Å²	126.7	82%	0.823	74%	0.741	S	S	*	*			trans	45.6	125.9	138.3	-68.1	144.5	0	0	0	116.1	S1111	L1109-S1111 PolarHBondContact O-N 2.87Å
1110	S	26.3	Very low	28.9	Very low	106.6 Å²	106.6	128.4 Å²	128.4	75%	0.745	75%	0.745	S	S	*	*			trans	-143	142.9	146.7	58.4	0	0	0	0	114.9	Q1108 Q1112	Q1108-S1110 PolarHBondContact O-N 2.64Å; S1110-Q1112 PolarHBondContact O-N 3.28Å
1111	S	28.1	Very low	28.7	Very low	96.2 Å²	96.2	127.7 Å²	127.7	67%	0.673	74%	0.74	S	S	*	*			trans	98.7	125.2	152.4	179.7	0	0	0	0	117.7	L1109 R1113	L1109-S1111 PolarHBondContact O-N 2.87Å; S1111-R1113 VanDerWaalsContact C-N 3.29Å; S1111-R1113 PolarHBondContact O-N 3.02Å
1112	Q	28.5	Very low	28.7	Very low	157.4 Å²	157.4	131.1 Å²	131.1	74%	0.736	75%	0.745	S	S	*	*			trans	85.8	130.7	156.5	-76.5	-162.5	50.3	0	0	117.1	S1110 S1114	S1110-Q1112 PolarHBondContact O-N 3.28Å; Q1112-S1114 PolarHBondContact O-N 3.02Å
1113	R	27.5	Very low	28.1	Very low	200 Å²	200	131 Å²	131	76%	0.755	75%	0.746	S	S	*	*			trans	49.8	132.5	140.4	-84.8	171.9	170.7	-162.1	-5.1	117.9	S1111 R1299	S1111-R1113 VanDerWaalsContact C-N 3.29Å; S1111-R1113 PolarHBondContact O-N 3.02Å; R1113-R1299 VanDerWaalsContact NH1-CD 3.34Å
1114	S	28.1	Very low	27.8	Very low	104 Å²	104	128.8 Å²	128.8	73%	0.727	75%	0.748	S	S	*	*			trans	-153.5	146.9	156.6	59.2	0	0	0	0	115.7	Q1112 V1116	Q1112-S1114 PolarHBondContact O-N 3.02Å; S1114-V1116 WeakPolarHBondContact O-CG2 3.42Å
1115	S	31.1	Very low	27.7	Very low	108.6 Å²	108.6	128.8 Å²	128.8	76%	0.759	75%	0.748	S	S	*	*			trans	-145.2	142.1	140.6	49.5	0	0	0	0	111.3
1116	V	28.1	Very low	27.9	Very low	114.4 Å²	114.4	128.6 Å²	128.6	69%	0.693	75%	0.747	S	S	*	*			cis	122.1	121.8	13.8	-177.5	0	0	0	0	112.4	S1114 S1118	S1114-V1116 WeakPolarHBondContact O-CG2 3.42Å; V1116-S1118 PolarHBondContact O-N 3.16Å; V1116-S1118 PolarHBondContact O-OG 3.25Å
1117	V	30.6	Very low	27.9	Very low	127.2 Å²	127.2	127.6 Å²	127.6	77%	0.771	75%	0.746	S	S	*	*			trans	-146.9	126.8	145.5	179.7	0	0	0	0	110.1
1118	S	27.9	Very low	28.2	Very low	103.2 Å²	103.2	128.1 Å²	128.1	72%	0.722	75%	0.747	S	S	*	*			trans	-95.7	144.1	159.5	-55.5	0	0	0	0	114.3	V1116	V1116-S1118 PolarHBondContact O-N 3.16Å; V1116-S1118 PolarHBondContact O-OG 3.25Å
1119	S	28.7	Very low	28.2	Very low	99 Å²	99	127.5 Å²	127.5	69%	0.692	75%	0.749	S	S	*	*			cis	-179.7	143.1	26.1	42	0	0	0	0	110.5
1120	L	28	Very low	28.5	Very low	160.6 Å²	160.6	125.1 Å²	125.1	84%	0.841	74%	0.743	S	S	*	*				-124.1	149.9	117.2	-80.7	172.4	0	0	0	110.4
1121	V	27.7	Very low	28.7	Very low	105.8 Å²	105.8	126.1 Å²	126.1	64%	0.641	74%	0.744	S	S	*	*			trans	-126.7	122.7	143	170.7	0	0	0	0	111.5
1122	F	28.6	Very low	28.8	Very low	201.6 Å²	201.6	126.6 Å²	126.6	88%	0.884	75%	0.748	S	S	*	*				-126	143.5	127.4	-88.1	-89.2	0	0	0	113.1
1123	S	25.7	Very low	28.9	Very low	90.6 Å²	90.6	125.1 Å²	125.1	63%	0.634	75%	0.745	S	S	*	*			trans	-122.3	144.7	-165	-45.2	0	0	0	0	110.6
1124	N	26.8	Very low	29.2	Very low	152.4 Å²	152.4	124 Å²	124	82%	0.815	75%	0.748	S	S	*	*			trans	139.9	149.6	142.8	-80.3	-7	0	0	0	114.4
1125	S	26.5	Very low	29.5	Very low	102 Å²	102	124.2 Å²	124.2	71%	0.713	74%	0.744	S	S	*	*			trans	165.3	129.4	164.3	49.5	0	0	0	0	116.1
1126	S	29.2	Very low	29.8	Very low	108.4 Å²	108.4	123.8 Å²	123.8	76%	0.758	74%	0.739	S	S	*	*			trans	71.1	115.1	143.9	47.8	0	0	0	0	118.8	P1128	S1126-P1128 WeakPolarHBondContact O-CD 3.36Å
1127	S	27.8	Very low	30	Very low	112.6 Å²	112.6	126.8 Å²	126.8	79%	0.787	74%	0.743	S	S	*	*				159.5	150.2	104.7	57.1	0	0	0	0	112.9
1128	P	32.8	Very low	30.2	Very low	110.2 Å²	110.2	125.5 Å²	125.5	72%	0.716	74%	0.735	S	S	*	*			trans	-111.1	168.7	-157.5	37.4	-27.7	0	0	0	115.1	S1126	S1126-P1128 WeakPolarHBondContact O-CD 3.36Å
1129	L	28.6	Very low	30.5	Very low	160.4 Å²	160.4	127.9 Å²	127.9	84%	0.84	73%	0.733	S	S	*	*			trans	103.5	162.6	163.9	-74.4	129.4	0	0	0	113.6	T1131	L1129-T1131 PolarHBondContact O-N 2.97Å; L1129-T1131 VanDerWaalsContact O-N 3.13Å
1130	P	32	Very low	30.6	Very low	106.6 Å²	106.6	129.6 Å²	129.6	69%	0.692	73%	0.734	S	S	*	*				-121.4	172.6	-95.2	36.9	-23.1	0	0	0	113.8
1131	T	29.8	Very low	30.8	Very low	127.8 Å²	127.8	126.8 Å²	126.8	78%	0.784	72%	0.724	S	S	*	*			trans	57	147.5	164.9	56.9	0	0	0	0	116.7	L1129 D1133	L1129-T1131 PolarHBondContact O-N 2.97Å; L1129-T1131 VanDerWaalsContact O-N 3.13Å; T1131-D1133 PolarHBondContact O-N 3.27Å
1132	S	30.1	Very low	31	Very low	106.6 Å²	106.6	127 Å²	127	75%	0.745	73%	0.725	S	S	*	*			cis	-168.9	141.5	-40.7	54.1	0	0	0	0	110.8
1133	D	31.5	Very low	31	Very low	124.8 Å²	124.8	122.8 Å²	122.8	67%	0.667	72%	0.717	S	S	*	*			cis	-166.1	171.7	6.3	-121.9	-67.9	0	0	0	113.1	T1131 V1135	T1131-D1133 PolarHBondContact O-N 3.27Å; D1133-V1135 PolarHBondContact O-N 2.91Å
1134	H	34.5	Very low	31.2	Very low	176.8 Å²	176.8	123.8 Å²	123.8	82%	0.819	72%	0.721	S	S	*	*			trans	40.1	107.1	176	-61	-52	0	0	0	119
1135	V	33.9	Very low	31.3	Very low	108.6 Å²	108.6	123.7 Å²	123.7	66%	0.658	72%	0.72	S	S	*	*			trans	-102.3	139.9	163.8	-175.3	0	0	0	0	112.9	D1133 F1137 Q1741 L1744	D1133-V1135 PolarHBondContact O-N 2.91Å; V1135-F1137 PolarHBondContact O-N 2.91Å; V1135-F1137 VanDerWaalsContact O-N 3.14Å; V1135-Q1741 HydrophobicContact CB-CG 4.43Å; V1135-Q1741 HydrophobicContact CG1-CG 3.87Å; V1135-L1744 HydrophobicContact CG1-CB 4.49Å
1136	P	37.1	Very low	31.3	Very low	99.2 Å²	99.2	130 Å²	130	64%	0.644	73%	0.728	S	S	*	*			trans	-100.7	153.9	-144.9	33.5	-27.5	0	0	0	114.4	V1138	P1136-V1138 PolarHBondContact O-N 3.08Å; P1136-V1138 VanDerWaalsContact O-N 3.15Å
1137	F	33	Very low	31.2	Very low	178 Å²	178	135 Å²	135	78%	0.781	73%	0.73	S	S	*	*			trans	-81.8	108.1	173.6	-82.9	-95.5	0	0	0	115	V1135 F1139 N1140	V1135-F1137 PolarHBondContact O-N 2.91Å; V1135-F1137 VanDerWaalsContact O-N 3.14Å; F1137-F1139 HydrophobicContact CB-CD2 4.46Å; F1137-F1139 AromaticContact CD1-CD2 3.37Å; F1137-F1139 HydrophobicContact CD1-CD2 3.37Å; F1137-F1139 AromaticContact CD1-CE2 3.73Å; F1137-F1139 HydrophobicContact CD1-CE2 3.73Å; F1137-F1139 HydrophobicContact CD1-CG 4.36Å; F1137-F1139 AromaticContact CE1-CD2 3.83Å; F1137-F1139 HydrophobicContact CE1-CD2 3.83Å; F1137-F1139 AromaticContact CE1-CE2 3.74Å; F1137-F1139 HydrophobicContact CE1-CE2 3.74Å; F1137-F1139 HydrophobicContact CG-CD2 4.14Å; F1137-F1139 HydrophobicContact CG-CE2 4.48Å; F1137-F1139 PolarHBondContact O-N 2.99Å; F1137-N1140 WeakPolarHBondContact CB-ND2 3.22Å; F1137-N1140 PolarHBondContact O-ND2 2.91Å
1138	V	34.2	Very low	31.1	Very low	100.6 Å²	100.6	134.4 Å²	134.4	61%	0.61	73%	0.733	S	S	*	*			trans	-38.5	120.2	153.5	-169.4	0	0	0	0	112.9	P1136 N1140 T1740 L1744	P1136-V1138 PolarHBondContact O-N 3.08Å; P1136-V1138 VanDerWaalsContact O-N 3.15Å; V1138-N1140 PolarHBondContact O-N 3.38Å; V1138-T1740 HydrophobicContact CB-CG2 4.42Å; V1138-T1740 HydrophobicContact CG2-CG2 4.42Å; V1138-L1744 HydrophobicContact CG2-CD1 3.86Å
1139	F	34.7	Very low	30.8	Very low	152.4 Å²	152.4	134.2 Å²	134.2	67%	0.668	73%	0.734	S	S	*	*			trans	-112.8	120	152.3	-90.3	-87.3	0	0	0	114.2	F1137 V1141 P1732 R1737 T1740 T1757 F1758	F1137-F1139 HydrophobicContact CB-CD2 4.46Å; F1137-F1139 AromaticContact CD1-CD2 3.37Å; F1137-F1139 HydrophobicContact CD1-CD2 3.37Å; F1137-F1139 AromaticContact CD1-CE2 3.73Å; F1137-F1139 HydrophobicContact CD1-CE2 3.73Å; F1137-F1139 HydrophobicContact CD1-CG 4.36Å; F1137-F1139 AromaticContact CE1-CD2 3.83Å; F1137-F1139 HydrophobicContact CE1-CD2 3.83Å; F1137-F1139 AromaticContact CE1-CE2 3.74Å; F1137-F1139 HydrophobicContact CE1-CE2 3.74Å; F1137-F1139 HydrophobicContact CG-CD2 4.14Å; F1137-F1139 HydrophobicContact CG-CE2 4.48Å; F1137-F1139 PolarHBondContact O-N 2.99Å; F1139-V1141 HydrophobicContact CB-CG2 4.12Å; F1139-V1141 PolarHBondContact O-N 3.25Å; F1139-P1732 HydrophobicContact CB-CB 4.31Å; F1139-P1732 HydrophobicContact CB-CG 3.83Å; F1139-P1732 HydrophobicContact CD1-CB 4.35Å; F1139-P1732 HydrophobicContact CD1-CG 4.35Å; F1139-P1732 HydrophobicContact CG-CB 4.23Å; F1139-P1732 HydrophobicContact CG-CG 4.22Å; F1139-R1737 HydrophobicContact CB-CG 4.18Å; F1139-R1737 HydrophobicContact CD2-CG 3.94Å; F1139-R1737 HydrophobicContact CG-CG 4.48Å; F1139-T1740 HydrophobicContact CE2-CG2 3.96Å; F1139-T1757 HydrophobicContact CE1-CG2 4.38Å; F1139-F1758 HydrophobicContact CE1-CE1 4.41Å
1140	N	30.6	Very low	30.7	Very low	135.6 Å²	135.6	131.3 Å²	131.3	73%	0.725	73%	0.727	S	S	*	*			trans	-86.5	116.8	175.5	-112.5	-27.9	0	0	0	111.8	F1137 V1138 T1142	F1137-N1140 WeakPolarHBondContact CB-ND2 3.22Å; F1137-N1140 PolarHBondContact O-ND2 2.91Å; V1138-N1140 PolarHBondContact O-N 3.38Å; N1140-T1142 VanDerWaalsContact C-N 3.28Å; N1140-T1142 PolarHBondContact O-N 2.92Å
1141	V	32.4	Very low	30.5	Very low	101.6 Å²	101.6	132.6 Å²	132.6	62%	0.616	73%	0.732	S	S	*	*			trans	-113.1	89.7	160.6	173.7	0	0	0	0	112.7	F1139 T1143 P1144 I1765	F1139-V1141 HydrophobicContact CB-CG2 4.12Å; F1139-V1141 PolarHBondContact O-N 3.25Å; V1141-T1143 PolarHBondContact O-N 3.11Å; V1141-P1144 HydrophobicContact CG1-CG 4.47Å; V1141-I1765 HydrophobicContact CG1-CD1 4.22Å
1142	T	30.8	Very low	30.4	Very low	110.2 Å²	110.2	133.1 Å²	133.1	68%	0.676	73%	0.729	S	S	*	*			trans	-28.7	111.6	165.8	56.1	0	0	0	0	117.6	N1140 P1144	N1140-T1142 VanDerWaalsContact C-N 3.28Å; N1140-T1142 PolarHBondContact O-N 2.92Å; T1142-P1144 WeakPolarHBondContact O-CD 3.49Å
1143	T	28.6	Very low	30.3	Very low	113.8 Å²	113.8	132.2 Å²	132.2	70%	0.698	72%	0.723	S	S	*	*			trans	-66.3	145.3	165.6	59.3	0	0	0	0	113.8	V1141 N1145	V1141-T1143 PolarHBondContact O-N 3.11Å; T1143-N1145 PolarHBondContact O-N 3.17Å; T1143-N1145 VanDerWaalsContact O-N 3.17Å
1144	P	30.7	Very low	30	Very low	111.2 Å²	111.2	133.7 Å²	133.7	72%	0.722	73%	0.729	S	S	*	*			trans	-99.3	113.4	-159.7	35.7	-30.1	0	0	0	112.5	V1141 T1142 R1146	V1141-P1144 HydrophobicContact CG1-CG 4.47Å; T1142-P1144 WeakPolarHBondContact O-CD 3.49Å; P1144-R1146 PolarHBondContact O-N 3.06Å
1145	N	27.6	Very low	29.6	Very low	149.6 Å²	149.6	131.7 Å²	131.7	80%	0.8	72%	0.722	S	S	*	*			trans	-82.8	115.8	162.4	-97.8	-31	0	0	0	114.2	T1143 R1147	T1143-N1145 PolarHBondContact O-N 3.17Å; T1143-N1145 VanDerWaalsContact O-N 3.17Å; N1145-R1147 PolarHBondContact O-N 2.93Å
1146	R	27.9	Very low	29.2	Very low	234.2 Å²	234.2	131.3 Å²	131.3	88%	0.884	72%	0.721	S	S	*	*			trans	-32.9	119.3	166.8	-82.3	-175.3	171.7	-170.9	-2.1	115.8	P1144 A1148	P1144-R1146 PolarHBondContact O-N 3.06Å; R1146-A1148 PolarHBondContact O-N 2.88Å
1147	R	27	Very low	28.7	Very low	213.4 Å²	213.4	138.1 Å²	138.1	81%	0.805	73%	0.734	S	S	*	*			trans	40.1	94.4	158.8	-69.4	-177	176.8	170.6	-1.8	115.2	N1145 S1149 S1150	N1145-R1147 PolarHBondContact O-N 2.93Å; R1147-S1149 VanDerWaalsContact C-N 3.27Å; R1147-S1149 PolarHBondContact O-N 3.07Å; R1147-S1150 WeakPolarHBondContact CG-OG 3.34Å
1148	A	25.7	Very low	28.3	Very low	101.8 Å²	101.8	136.1 Å²	136.1	84%	0.841	73%	0.73	S	S	*	*			trans	-37.2	115	135.9	0	0	0	0	0	114.5	R1146 S1150	R1146-A1148 PolarHBondContact O-N 2.88Å; A1148-S1150 PolarHBondContact O-N 2.58Å
1149	S	26.7	Very low	27.9	Very low	104.8 Å²	104.8	135.4 Å²	135.4	73%	0.733	73%	0.73	S	S	*	*			trans	-61.3	115	168.2	-176.6	0	0	0	0	113.9	R1147 V1151	R1147-S1149 VanDerWaalsContact C-N 3.27Å; R1147-S1149 PolarHBondContact O-N 3.07Å; S1149-V1151 VanDerWaalsContact C-N 3.29Å; S1149-V1151 PolarHBondContact O-N 3.11Å; S1149-V1151 VanDerWaalsContact O-N 3.13Å
1150	S	25.8	Very low	27.7	Very low	100.4 Å²	100.4	132.8 Å²	132.8	70%	0.702	73%	0.726	S	S	*	*			trans	-131.8	79.7	164.1	60.9	0	0	0	0	113.2	R1147 A1148 I1152	R1147-S1150 WeakPolarHBondContact CG-OG 3.34Å; A1148-S1150 PolarHBondContact O-N 2.58Å; S1150-I1152 PolarHBondContact O-N 2.89Å
1151	V	28.4	Very low	27.6	Very low	132.4 Å²	132.4	137 Å²	137	80%	0.802	73%	0.732	S	S	*	*			trans	-92.3	91	163.3	-172.4	0	0	0	0	110.4	S1149 S1153	S1149-V1151 VanDerWaalsContact C-N 3.29Å; S1149-V1151 PolarHBondContact O-N 3.11Å; S1149-V1151 VanDerWaalsContact O-N 3.13Å; V1151-S1153 PolarHBondContact O-N 3.24Å; V1151-S1153 VanDerWaalsContact O-N 3.16Å
1152	I	27.4	Very low	27.5	Very low	138.6 Å²	138.6	137.2 Å²	137.2	71%	0.711	74%	0.738	S	S	*	*			trans	-79.3	120.2	163.1	-65.7	167.7	0	0	0	107.1	K828 S1150 I1154	K828-I1152 HydrophobicContact CD-CD1 3.92Å; K828-I1152 VanDerWaalsContact CE-CD1 3.42Å; K828-I1152 HydrophobicContact CG-CD1 4.47Å; S1150-I1152 PolarHBondContact O-N 2.89Å; I1152-I1154 PolarHBondContact O-N 3.3Å
1153	S	26.9	Very low	27.6	Very low	89.2 Å²	89.2	138.4 Å²	138.4	62%	0.624	74%	0.74	S	S	*	*			trans	-10.4	125.4	164.6	174.9	0	0	0	0	111.6	V1151 M1155	V1151-S1153 PolarHBondContact O-N 3.24Å; V1151-S1153 VanDerWaalsContact O-N 3.16Å; S1153-M1155 VanDerWaalsContact C-N 3.28Å; S1153-M1155 PolarHBondContact O-N 3.1Å; S1153-M1155 WeakPolarHBondContact OG-CG 3.45Å
1154	I	26.6	Very low	27.7	Very low	155.6 Å²	155.6	136.9 Å²	136.9	80%	0.798	74%	0.739	S	S	*	*			trans	-85.8	76.7	153.3	-48.5	174.4	0	0	0	110.2	I1152	I1152-I1154 PolarHBondContact O-N 3.3Å
1155	M	26.2	Very low	27.9	Very low	134.8 Å²	134.8	138.5 Å²	138.5	66%	0.664	74%	0.741	S	S	*	*			trans	-80.5	133.9	147.1	-73	-171.8	110.3	0	0	107.9	S1153 R1157 M1234	S1153-M1155 VanDerWaalsContact C-N 3.28Å; S1153-M1155 PolarHBondContact O-N 3.1Å; S1153-M1155 WeakPolarHBondContact OG-CG 3.45Å; M1155-R1157 PolarHBondContact O-N 3.17Å; M1155-M1234 HydrophobicContact CE-CE 4.47Å
1156	P	25.1	Very low	28.2	Very low	99.4 Å²	99.4	141.4 Å²	141.4	65%	0.645	74%	0.741	S	S	*	*			trans	-63.1	122.7	169.4	27.4	-32.8	0	0	0	108.7	I1158	P1156-I1158 VanDerWaalsContact C-N 3.32Å; P1156-I1158 HydrophobicContact CB-CG1 4.12Å; P1156-I1158 HydrophobicContact CG-CD1 4.36Å; P1156-I1158 HydrophobicContact CG-CG1 4.05Å; P1156-I1158 PolarHBondContact O-N 2.98Å
1157	R	25.6	Very low	28.9	Very low	241.8 Å²	241.8	134.7 Å²	134.7	91%	0.912	73%	0.728	S	S	*	*			trans	-68.5	85.4	163.3	-78	-176.8	173.4	171.6	-1.8	107.9	M1155 S1159	M1155-R1157 PolarHBondContact O-N 3.17Å; R1157-S1159 VanDerWaalsContact C-N 3.33Å; R1157-S1159 PolarHBondContact O-N 2.89Å
1158	I	26.4	Very low	29.6	Very low	136.6 Å²	136.6	131.5 Å²	131.5	70%	0.701	73%	0.725	S	S	*	*			trans	-67.2	111.6	165.3	-58.8	-179.8	0	0	0	106.2	P1156 V1160	P1156-I1158 VanDerWaalsContact C-N 3.32Å; P1156-I1158 HydrophobicContact CB-CG1 4.12Å; P1156-I1158 HydrophobicContact CG-CD1 4.36Å; P1156-I1158 HydrophobicContact CG-CG1 4.05Å; P1156-I1158 PolarHBondContact O-N 2.98Å; I1158-V1160 HydrophobicContact CB-CG2 4.41Å; I1158-V1160 HydrophobicContact CG2-CG2 4.06Å; I1158-V1160 WeakPolarHBondContact O-CG2 3.49Å; I1158-V1160 PolarHBondContact O-N 3.3Å; I1158-V1160 VanDerWaalsContact O-N 3.08Å
1159	S	25.2	Very low	30.7	Very low	85.6 Å²	85.6	130.1 Å²	130.1	60%	0.599	70%	0.703	S	S	*	*			trans	-89.3	101.4	-179.2	178.9	0	0	0	0	108.8	R1157 R1161 S1162	R1157-S1159 VanDerWaalsContact C-N 3.33Å; R1157-S1159 PolarHBondContact O-N 2.89Å; S1159-R1161 PolarHBondContact O-N 2.92Å; S1159-R1161 WeakPolarHBondContact OG-CB 3.49Å; S1159-S1162 PolarHBondContact O-N 2.96Å
1160	V	29.6	Very low	32.2	Very low	97.8 Å²	97.8	128.8 Å²	128.8	59%	0.593	69%	0.694	S	S	*	*	G	3₁₀ helix	trans	-66.3	28.7	175.1	-162.3	0	0	0	0	112.9	I1158 S1162 L1163 A1164	I1158-V1160 HydrophobicContact CB-CG2 4.41Å; I1158-V1160 HydrophobicContact CG2-CG2 4.06Å; I1158-V1160 WeakPolarHBondContact O-CG2 3.49Å; I1158-V1160 PolarHBondContact O-N 3.3Å; I1158-V1160 VanDerWaalsContact O-N 3.08Å; V1160-S1162 PolarHBondContact O-N 3.14Å; V1160-L1163 HydrophobicContact CG1-CB 3.73Å; V1160-L1163 HydrophobicContact CG1-CD2 4.3Å; V1160-L1163 CarbonylContact O-C 3.48Å; V1160-L1163 WeakPolarHBondContact O-CA 3.33Å; V1160-L1163 WeakPolarHBondContact O-CB 3.29Å; V1160-L1163 PolarHBondContact O-N 3.35Å; V1160-A1164 PolarHBondContact O-N 3.47Å
1161	R	28.4	Very low	33.8	Very low	223.6 Å²	223.6	126.1 Å²	126.1	84%	0.844	68%	0.678	S	S	*	*	G	3₁₀ helix	trans	-50.7	12.6	156.6	-68.7	-179.3	171.4	174.9	-5.2	114.3	S1159 L1163 A1164	S1159-R1161 PolarHBondContact O-N 2.92Å; S1159-R1161 WeakPolarHBondContact OG-CB 3.49Å; R1161-L1163 PolarHBondContact O-N 2.99Å; R1161-A1164 WeakPolarHBondContact O-CB 3.15Å; R1161-A1164 PolarHBondContact O-N 2.97Å
1162	S	31.1	Very low	35.4	Very low	107.4 Å²	107.4	122.3 Å²	122.3	75%	0.751	65%	0.653	S	S	*	*	G	3₁₀ helix	trans	-84.3	31.3	164.9	-169	0	0	0	0	115.1	S1159 V1160	S1159-S1162 PolarHBondContact O-N 2.96Å; V1160-S1162 PolarHBondContact O-N 3.14Å
1163	L	31.6	Very low	37.3	Very low	134.4 Å²	134.4	116.8 Å²	116.8	70%	0.704	63%	0.625	S	S	*	*			trans	-130.1	37	164.6	-135.7	74.3	0	0	0	112	V1160 R1161 D1165 V1223	V1160-L1163 HydrophobicContact CG1-CB 3.73Å; V1160-L1163 HydrophobicContact CG1-CD2 4.3Å; V1160-L1163 CarbonylContact O-C 3.48Å; V1160-L1163 WeakPolarHBondContact O-CA 3.33Å; V1160-L1163 WeakPolarHBondContact O-CB 3.29Å; V1160-L1163 PolarHBondContact O-N 3.35Å; R1161-L1163 PolarHBondContact O-N 2.99Å; L1163-D1165 VanDerWaalsContact C-N 3.34Å; L1163-D1165 PolarHBondContact O-N 3.02Å; L1163-V1223 HydrophobicContact CD2-CG2 4.4Å
1164	A	32.8	Very low	39.1	Very low	82 Å²	82	115.1 Å²	115.1	68%	0.678	61%	0.613	S	S	*	*			trans	-81.6	0.1	177.3	0	0	0	0	0	112	V1160 R1161 R1166	V1160-A1164 PolarHBondContact O-N 3.47Å; R1161-A1164 WeakPolarHBondContact O-CB 3.15Å; R1161-A1164 PolarHBondContact O-N 2.97Å; A1164-R1166 PolarHBondContact O-N 3Å
1165	D	33	Very low	41	Very low	144.8 Å²	144.8	107.7 Å²	107.7	77%	0.774	58%	0.575	S	S	*	*	S	Bend	trans	-98.6	92	173.9	-78.1	-47.2	0	0	0	114.2	L1163	L1163-D1165 VanDerWaalsContact C-N 3.34Å; L1163-D1165 PolarHBondContact O-N 3.02Å
1166	R	35.9	Very low	43.1	Very low	211.6 Å²	211.6	101.6 Å²	101.6	80%	0.798	55%	0.545	S	S	*	.			trans	158.5	127	165.6	-66.9	177.2	-177.9	-145.7	-0.6	115.6	A1164	A1164-R1166 PolarHBondContact O-N 3Å
1167	P	41.7	Very low	45.3	Very low	93.4 Å²	93.4	100.5 Å²	100.5	61%	0.606	53%	0.53	S	S	*	.			trans	-102.6	172.9	-171.6	30.4	-23.4	0	0	0	115.6	L1169 S1170 Q1216	P1167-L1169 PolarHBondContact O-N 3.18Å; P1167-L1169 VanDerWaalsContact O-N 3.13Å; P1167-S1170 PolarHBondContact O-N 2.92Å; P1167-S1170 VanDerWaalsContact O-N 3.14Å; P1167-Q1216 PolarHBondContact O-NE2 3.15Å
1168	I	40.9	Very low	47.4	Very low	146 Å²	146	91.3 Å²	91.3	75%	0.749	50%	0.498	S	S	*	.	S	Bend	trans	73.7	-17.7	163.4	-57.5	165.3	0	0	0	116.1	S1170 A1171 D1172 Q1216	I1168-S1170 PolarHBondContact O-N 3.16Å; I1168-A1171 PolarHBondContact O-N 2.88Å; I1168-D1172 PolarHBondContact O-N 3.49Å; I1168-Q1216 VanDerWaalsContact C-OE1 3.28Å
1169	L	48.9	Very low	49.5	Very low	71.8 Å²	71.8	84.9 Å²	84.9	38%	0.376	47%	0.465	S	S	.	.	S	Bend	trans	-82.9	30	173.5	-98.1	129.7	0	0	0	113	F854 D857 V858 L861 P1167 M1173 Q1216 V1217 W1220	F854-L1169 HydrophobicContact CD2-CD1 4.31Å; F854-L1169 HydrophobicContact CE2-CD1 4.23Å; D857-L1169 HydrophobicContact CB-CD1 4.4Å; V858-L1169 HydrophobicContact CG2-CD1 4.13Å; L861-L1169 HydrophobicContact CD1-CD2 4.36Å; P1167-L1169 PolarHBondContact O-N 3.18Å; P1167-L1169 VanDerWaalsContact O-N 3.13Å; L1169-M1173 HydrophobicContact CB-CB 4.27Å; L1169-M1173 HydrophobicContact CD2-CB 4.09Å; L1169-M1173 HydrophobicContact CD2-CE 4.09Å; L1169-M1173 HydrophobicContact CD2-CG 4.34Å; L1169-M1173 WeakPolarHBondContact O-CB 3.42Å; L1169-M1173 VanDerWaalsContact O-CG 3.31Å; L1169-M1173 WeakPolarHBondContact O-CG 3.35Å; L1169-M1173 PolarHBondContact O-N 2.67Å; L1169-Q1216 HydrophobicContact CG-CB 4.38Å; L1169-V1217 HydrophobicContact CD2-CG2 3.59Å; L1169-W1220 HydrophobicContact CD1-CB 4.24Å; L1169-W1220 HydrophobicContact CD1-CG 4.26Å; L1169-W1220 HydrophobicContact CD2-CB 3.95Å; L1169-W1220 HydrophobicContact CD2-CG 3.97Å
1170	S	59.2	Low	51.8	Low	77.8 Å²	77.8	80.9 Å²	80.9	54%	0.544	44%	0.438	S	S	.	.	H	α-helix	trans	-73	-52	-174.6	67.7	0	0	0	0	114	P1167 I1168 D1172 M1173 S1174	P1167-S1170 PolarHBondContact O-N 2.92Å; P1167-S1170 VanDerWaalsContact O-N 3.14Å; I1168-S1170 PolarHBondContact O-N 3.16Å; S1170-D1172 PolarHBondContact O-N 2.8Å; S1170-D1172 VanDerWaalsContact O-N 3.17Å; S1170-M1173 PolarHBondContact O-N 3.26Å; S1170-M1173 WeakPolarHBondContact OG-CG 3.3Å; S1170-S1174 PolarHBondContact O-N 3.33Å; S1170-S1174 PolarHBondContact O-OG 3.26Å
1171	A	59.1	Low	53.8	Low	44.4 Å²	44.4	78.7 Å²	78.7	37%	0.367	42%	0.421	S	S	.	.	H	α-helix	trans	-65.5	-38.2	-175.3	0	0	0	0	0	113.5	I1168 M1173 S1174 T1175	I1168-A1171 PolarHBondContact O-N 2.88Å; A1171-M1173 VanDerWaalsContact C-N 3.27Å; A1171-M1173 PolarHBondContact O-N 3.25Å; A1171-S1174 PolarHBondContact O-N 3.25Å; A1171-S1174 PolarHBondContact O-OG 3.11Å; A1171-S1174 VanDerWaalsContact O-OG 3.07Å; A1171-T1175 VanDerWaalsContact O-CB 3.27Å; A1171-T1175 WeakPolarHBondContact O-CB 3.32Å; A1171-T1175 WeakPolarHBondContact O-CG2 3.42Å; A1171-T1175 PolarHBondContact O-N 3.1Å; A1171-T1175 VanDerWaalsContact O-N 3.1Å; A1171-T1175 PolarHBondContact O-OG1 3.08Å
1172	D	61.8	Low	55.7	Low	52 Å²	52	68.9 Å²	68.9	28%	0.278	39%	0.386	S	S	.	.	H	α-helix	trans	-59	-42.7	170.9	-76.9	23.9	0	0	0	111	L815 K853 I1168 S1170 T1175 L1176	L815-D1172 WeakPolarHBondContact CD2-OD1 3.25Å; K853-D1172 WeakPolarHBondContact CD-OD1 3.49Å; K853-D1172 VanDerWaalsContact CE-OD1 3.3Å; K853-D1172 WeakPolarHBondContact CE-OD1 3.21Å; K853-D1172 IonicContact NZ-OD1 3.17Å; K853-D1172 PolarHBondContact NZ-OD1 2.78Å; K853-D1172 IonicContact NZ-OD2 3.03Å; K853-D1172 PolarHBondContact NZ-OD2 3.01Å; I1168-D1172 PolarHBondContact O-N 3.49Å; S1170-D1172 PolarHBondContact O-N 2.8Å; S1170-D1172 VanDerWaalsContact O-N 3.17Å; D1172-T1175 WeakPolarHBondContact CA-OG1 3.05Å; D1172-T1175 WeakPolarHBondContact O-CB 3.12Å; D1172-T1175 PolarHBondContact O-N 3.21Å; D1172-T1175 PolarHBondContact O-OG1 3.3Å; D1172-L1176 HydrophobicContact CB-CD1 4.21Å; D1172-L1176 VanDerWaalsContact O-CB 3.26Å; D1172-L1176 WeakPolarHBondContact O-CB 3.4Å; D1172-L1176 VanDerWaalsContact O-CD1 3.25Å; D1172-L1176 WeakPolarHBondContact O-CD1 3.35Å; D1172-L1176 WeakPolarHBondContact O-CG 3.39Å; D1172-L1176 PolarHBondContact O-N 3.02Å
1173	M	66.3	Low	57.6	Low	22.8 Å²	22.8	63.8 Å²	63.8	11%	0.112	35%	0.35	C	S	.	.	H	α-helix	trans	-70.9	-38.6	-176.9	-66.4	-68.4	-173	0	0	113.3	F854 V858 L1169 S1170 A1171 L1176 K1177 V1217 W1220	F854-M1173 HydrophobicContact CD1-SD 4.2Å; F854-M1173 HydrophobicContact CD2-CE 4.39Å; F854-M1173 HydrophobicContact CD2-SD 4.27Å; F854-M1173 HydrophobicContact CE1-CE 4.44Å; F854-M1173 HydrophobicContact CE1-SD 3.84Å; F854-M1173 HydrophobicContact CE2-CE 3.74Å; F854-M1173 HydrophobicContact CE2-CG 4.28Å; F854-M1173 HydrophobicContact CE2-SD 3.59Å; F854-M1173 WeakPolarHBondContact CE2-SD 3.41Å; F854-M1173 HydrophobicContact CZ-CE 3.61Å; F854-M1173 HydrophobicContact CZ-SD 3.57Å; F854-M1173 VanDerWaalsContact CZ-SD 3.57Å; V858-M1173 HydrophobicContact CG2-CE 4.11Å; L1169-M1173 HydrophobicContact CB-CB 4.27Å; L1169-M1173 HydrophobicContact CD2-CB 4.09Å; L1169-M1173 HydrophobicContact CD2-CE 4.09Å; L1169-M1173 HydrophobicContact CD2-CG 4.34Å; L1169-M1173 WeakPolarHBondContact O-CB 3.42Å; L1169-M1173 VanDerWaalsContact O-CG 3.31Å; L1169-M1173 WeakPolarHBondContact O-CG 3.35Å; L1169-M1173 PolarHBondContact O-N 2.67Å; S1170-M1173 PolarHBondContact O-N 3.26Å; S1170-M1173 WeakPolarHBondContact OG-CG 3.3Å; A1171-M1173 VanDerWaalsContact C-N 3.27Å; A1171-M1173 PolarHBondContact O-N 3.25Å; M1173-L1176 PolarHBondContact O-N 2.95Å; M1173-L1176 HydrophobicContact SD-CD1 4.42Å; M1173-K1177 WeakPolarHBondContact O-CB 3.36Å; M1173-K1177 PolarHBondContact O-N 2.88Å; M1173-K1177 VanDerWaalsContact O-N 3.1Å; M1173-V1217 HydrophobicContact CE-CB 4.35Å; M1173-V1217 HydrophobicContact CE-CG1 4.07Å; M1173-V1217 HydrophobicContact CE-CG2 4.32Å; M1173-W1220 HydrophobicContact CB-CD2 4.45Å; M1173-W1220 HydrophobicContact CB-CZ2 4.29Å; M1173-W1220 HydrophobicContact CE-CB 3.9Å; M1173-W1220 HydrophobicContact CE-CD2 3.69Å; M1173-W1220 HydrophobicContact CE-CE3 3.65Å; M1173-W1220 HydrophobicContact CE-CG 3.8Å; M1173-W1220 HydrophobicContact CE-CZ3 4.45Å; M1173-W1220 HydrophobicContact CG-CD2 4.38Å; M1173-W1220 VanDerWaalsContact O-CZ2 3.26Å; M1173-W1220 WeakPolarHBondContact O-CZ2 3.4Å; M1173-W1220 PolarHBondContact O-NE1 3.02Å; M1173-W1220 HydrophobicContact SD-CD2 3.59Å; M1173-W1220 HydrophobicContact SD-CE3 3.58Å; M1173-W1220 HydrophobicContact SD-CG 4.21Å; M1173-W1220 HydrophobicContact SD-CH2 4.13Å; M1173-W1220 HydrophobicContact SD-CZ2 4.16Å; M1173-W1220 HydrophobicContact SD-CZ3 3.98Å; M1173-W1220 VanDerWaalsContact SD-CZ3 3.57Å
1174	S	65.5	Low	59.4	Low	53 Å²	53	57.7 Å²	57.7	37%	0.371	32%	0.318	S	S	.	.	H	α-helix	trans	-68.3	-41	173.5	60	0	0	0	0	111.3	S1170 A1171 L1176 K1177 I1178	S1170-S1174 PolarHBondContact O-N 3.33Å; S1170-S1174 PolarHBondContact O-OG 3.26Å; A1171-S1174 PolarHBondContact O-N 3.25Å; A1171-S1174 PolarHBondContact O-OG 3.11Å; A1171-S1174 VanDerWaalsContact O-OG 3.07Å; S1174-L1176 PolarHBondContact O-N 2.79Å; S1174-K1177 WeakPolarHBondContact O-CB 3.39Å; S1174-K1177 PolarHBondContact O-N 3.06Å; S1174-I1178 VanDerWaalsContact O-CG1 3.3Å; S1174-I1178 WeakPolarHBondContact O-CG1 3.27Å; S1174-I1178 PolarHBondContact O-N 3.18Å; S1174-I1178 VanDerWaalsContact O-N 3.13Å
1175	T	66.2	Low	61.1	Low	0.8 Å²	0.8	58.2 Å²	58.2	1%	0.005	31%	0.309	C	S	.	.	H	α-helix	trans	-63.2	-46.8	175.4	-46.5	0	0	0	0	112.2	L815 V818 G819 L850 A1171 D1172 K1177 I1178 I1179	L815-T1175 HydrophobicContact CB-CG2 4.37Å; L815-T1175 HydrophobicContact CD2-CG2 3.87Å; L815-T1175 HydrophobicContact CG-CG2 4.48Å; V818-T1175 HydrophobicContact CB-CG2 3.62Å; V818-T1175 VanDerWaalsContact CB-CG2 3.45Å; V818-T1175 VanDerWaalsContact CB-OG1 3.32Å; V818-T1175 WeakPolarHBondContact CB-OG1 3.3Å; V818-T1175 HydrophobicContact CG1-CG2 3.81Å; V818-T1175 WeakPolarHBondContact CG1-OG1 3.29Å; V818-T1175 HydrophobicContact CG2-CG2 4.17Å; G819-T1175 VanDerWaalsContact CA-CG2 3.46Å; G819-T1175 PolarHBondContact N-OG1 3.24Å; L850-T1175 HydrophobicContact CD2-CG2 4.08Å; A1171-T1175 VanDerWaalsContact O-CB 3.27Å; A1171-T1175 WeakPolarHBondContact O-CB 3.32Å; A1171-T1175 WeakPolarHBondContact O-CG2 3.42Å; A1171-T1175 PolarHBondContact O-N 3.1Å; A1171-T1175 VanDerWaalsContact O-N 3.1Å; A1171-T1175 PolarHBondContact O-OG1 3.08Å; D1172-T1175 WeakPolarHBondContact CA-OG1 3.05Å; D1172-T1175 WeakPolarHBondContact O-CB 3.12Å; D1172-T1175 PolarHBondContact O-N 3.21Å; D1172-T1175 PolarHBondContact O-OG1 3.3Å; T1175-K1177 VanDerWaalsContact C-N 3.29Å; T1175-K1177 PolarHBondContact O-N 3.03Å; T1175-I1178 WeakPolarHBondContact O-CA 3.41Å; T1175-I1178 WeakPolarHBondContact O-CB 3.47Å; T1175-I1178 PolarHBondContact O-N 2.9Å; T1175-I1179 HydrophobicContact CG2-CD1 3.91Å; T1175-I1179 HydrophobicContact CG2-CG1 4.39Å; T1175-I1179 WeakPolarHBondContact O-CG1 3.35Å; T1175-I1179 PolarHBondContact O-N 3.19Å
1176	L	71	Confident	62.5	Low	6.2 Å²	6.2	53.2 Å²	53.2	3%	0.032	28%	0.283	C	S	.	.	H	α-helix	trans	-61	-38.9	177.2	-93.2	163.1	0	0	0	111.5	L815 L850 L851 F854 D1172 M1173 S1174 I1179 L1180 F1205 W1220	L815-L1176 HydrophobicContact CD2-CD2 3.68Å; L815-L1176 VanDerWaalsContact CD2-CD2 3.48Å; L815-L1176 HydrophobicContact CD2-CG 3.75Å; L850-L1176 HydrophobicContact CD1-CD2 3.32Å; L850-L1176 HydrophobicContact CD2-CB 3.71Å; L850-L1176 HydrophobicContact CD2-CD1 4.31Å; L850-L1176 HydrophobicContact CD2-CD2 3.72Å; L850-L1176 VanDerWaalsContact CD2-CD2 3.43Å; L850-L1176 HydrophobicContact CD2-CG 3.86Å; L850-L1176 HydrophobicContact CG-CB 4.27Å; L850-L1176 HydrophobicContact CG-CD1 3.99Å; L850-L1176 HydrophobicContact CG-CD2 3.74Å; L850-L1176 HydrophobicContact CG-CG 4.1Å; L851-L1176 HydrophobicContact CD2-CD1 4.08Å; L851-L1176 HydrophobicContact CD2-CD2 4.4Å; F854-L1176 HydrophobicContact CB-CD1 4.2Å; F854-L1176 HydrophobicContact CD1-CD1 4.06Å; F854-L1176 HydrophobicContact CD2-CD1 4.1Å; F854-L1176 HydrophobicContact CD2-CD2 4.3Å; F854-L1176 HydrophobicContact CE1-CB 4.05Å; F854-L1176 HydrophobicContact CE1-CD1 3.56Å; F854-L1176 HydrophobicContact CE1-CG 4.3Å; F854-L1176 HydrophobicContact CE2-CB 3.92Å; F854-L1176 HydrophobicContact CE2-CD1 4.16Å; F854-L1176 HydrophobicContact CE2-CD2 3.87Å; F854-L1176 HydrophobicContact CE2-CG 4.21Å; F854-L1176 HydrophobicContact CG-CD1 4.36Å; F854-L1176 HydrophobicContact CZ-CB 3.4Å; F854-L1176 HydrophobicContact CZ-CD1 3.7Å; F854-L1176 HydrophobicContact CZ-CD2 4.12Å; F854-L1176 HydrophobicContact CZ-CG 3.93Å; D1172-L1176 HydrophobicContact CB-CD1 4.21Å; D1172-L1176 VanDerWaalsContact O-CB 3.26Å; D1172-L1176 WeakPolarHBondContact O-CB 3.4Å; D1172-L1176 VanDerWaalsContact O-CD1 3.25Å; D1172-L1176 WeakPolarHBondContact O-CD1 3.35Å; D1172-L1176 WeakPolarHBondContact O-CG 3.39Å; D1172-L1176 PolarHBondContact O-N 3.02Å; M1173-L1176 PolarHBondContact O-N 2.95Å; M1173-L1176 HydrophobicContact SD-CD1 4.42Å; S1174-L1176 PolarHBondContact O-N 2.79Å; L1176-I1179 PolarHBondContact O-N 3.4Å; L1176-L1180 HydrophobicContact CD2-CD1 3.71Å; L1176-L1180 HydrophobicContact CG-CD1 4.48Å; L1176-L1180 WeakPolarHBondContact O-CB 3.3Å; L1176-L1180 VanDerWaalsContact O-CG 3.32Å; L1176-L1180 WeakPolarHBondContact O-CG 3.38Å; L1176-L1180 PolarHBondContact O-N 3.17Å; L1176-L1180 VanDerWaalsContact O-N 3.11Å; L1176-F1205 HydrophobicContact CD2-CE1 4.09Å; L1176-F1205 HydrophobicContact CD2-CZ 3.61Å; L1176-W1220 HydrophobicContact CB-CH2 4.34Å; L1176-W1220 HydrophobicContact CB-CZ2 4.12Å; L1176-W1220 HydrophobicContact CD2-CH2 3.85Å
1177	K	70.7	Confident	63.9	Low	76 Å²	76	44 Å²	44	33%	0.33	25%	0.248	S	C	.	.	H	α-helix	trans	-58.3	-52.7	171.4	174.7	-178.1	171	-174.2	0	111.2	M1173 S1174 T1175 I1179 L1180 E1181 W1220 M1224	M1173-K1177 WeakPolarHBondContact O-CB 3.36Å; M1173-K1177 PolarHBondContact O-N 2.88Å; M1173-K1177 VanDerWaalsContact O-N 3.1Å; S1174-K1177 WeakPolarHBondContact O-CB 3.39Å; S1174-K1177 PolarHBondContact O-N 3.06Å; T1175-K1177 VanDerWaalsContact C-N 3.29Å; T1175-K1177 PolarHBondContact O-N 3.03Å; K1177-I1179 VanDerWaalsContact C-N 3.3Å; K1177-I1179 PolarHBondContact O-N 3.05Å; K1177-L1180 PolarHBondContact O-N 3.18Å; K1177-L1180 VanDerWaalsContact O-N 3.12Å; K1177-E1181 WeakPolarHBondContact CE-OE1 3.32Å; K1177-E1181 HydrophobicContact CG-CG 4.28Å; K1177-E1181 IonicContact NZ-OE1 3.54Å; K1177-E1181 WeakPolarHBondContact O-CB 3.37Å; K1177-E1181 WeakPolarHBondContact O-CG 3.36Å; K1177-E1181 PolarHBondContact O-N 3.05Å; K1177-W1220 HydrophobicContact CB-CZ2 4.21Å; K1177-M1224 HydrophobicContact CB-CE 3.82Å; K1177-M1224 HydrophobicContact CB-SD 4.42Å; K1177-M1224 HydrophobicContact CG-CE 4.06Å; K1177-M1224 HydrophobicContact CG-SD 4.29Å
1178	I	69.8	Low	64.7	Low	49.8 Å²	49.8	39.6 Å²	39.6	26%	0.255	22%	0.22	S	C	.	.	H	α-helix	trans	-60.3	-42.2	-178.4	-64.6	161.2	0	0	0	111.1	V818 Q831 L834 S1174 T1175 L1180 E1181 C1182	V818-I1178 HydrophobicContact CG1-CB 4.36Å; V818-I1178 HydrophobicContact CG1-CD1 3.86Å; V818-I1178 HydrophobicContact CG1-CG2 4.23Å; Q831-I1178 HydrophobicContact CG-CG2 4.37Å; L834-I1178 HydrophobicContact CD1-CG2 4.31Å; L834-I1178 HydrophobicContact CD2-CB 3.75Å; L834-I1178 HydrophobicContact CD2-CG2 3.48Å; L834-I1178 VanDerWaalsContact CD2-CG2 3.48Å; S1174-I1178 VanDerWaalsContact O-CG1 3.3Å; S1174-I1178 WeakPolarHBondContact O-CG1 3.27Å; S1174-I1178 PolarHBondContact O-N 3.18Å; S1174-I1178 VanDerWaalsContact O-N 3.13Å; T1175-I1178 WeakPolarHBondContact O-CA 3.41Å; T1175-I1178 WeakPolarHBondContact O-CB 3.47Å; T1175-I1178 PolarHBondContact O-N 2.9Å; I1178-L1180 PolarHBondContact O-N 3.49Å; I1178-E1181 PolarHBondContact O-N 3.12Å; I1178-C1182 WeakPolarHBondContact O-CB 3.4Å; I1178-C1182 PolarHBondContact O-N 3.21Å; I1178-C1182 PolarHBondContact O-SG 3.12Å; I1178-C1182 VanDerWaalsContact O-SG 3.38Å
1179	I	70.8	Confident	65.4	Low	1 Å²	1	39.4 Å²	39.4	1%	0.005	21%	0.21	C	C	.	.	H	α-helix	trans	-64.7	-43.7	177.8	-64.2	170.3	0	0	0	111.1	L811 L814 L815 L834 I838 L846 L847 L850 T1175 L1176 K1177 C1182 I1183	L811-I1179 HydrophobicContact CD1-CD1 4.35Å; L814-I1179 HydrophobicContact CB-CD1 4.42Å; L815-I1179 HydrophobicContact CD2-CD1 3.9Å; L815-I1179 HydrophobicContact CG-CD1 4.37Å; L834-I1179 HydrophobicContact CD2-CG1 3.7Å; I838-I1179 HydrophobicContact CD1-CB 4.28Å; I838-I1179 HydrophobicContact CD1-CG1 4.29Å; I838-I1179 HydrophobicContact CD1-CG2 4.1Å; I838-I1179 HydrophobicContact CG1-CG2 4.5Å; L846-I1179 HydrophobicContact CB-CD1 4.49Å; L846-I1179 HydrophobicContact CD2-CG2 4.47Å; L847-I1179 HydrophobicContact CB-CG2 4.35Å; L847-I1179 HydrophobicContact CD1-CG2 4.5Å; L850-I1179 HydrophobicContact CD1-CB 4.33Å; L850-I1179 HydrophobicContact CD1-CD1 4.19Å; L850-I1179 HydrophobicContact CD1-CG2 3.68Å; L850-I1179 HydrophobicContact CD2-CD1 4.14Å; L850-I1179 HydrophobicContact CD2-CG2 4.22Å; T1175-I1179 HydrophobicContact CG2-CD1 3.91Å; T1175-I1179 HydrophobicContact CG2-CG1 4.39Å; T1175-I1179 WeakPolarHBondContact O-CG1 3.35Å; T1175-I1179 PolarHBondContact O-N 3.19Å; L1176-I1179 PolarHBondContact O-N 3.4Å; K1177-I1179 VanDerWaalsContact C-N 3.3Å; K1177-I1179 PolarHBondContact O-N 3.05Å; I1179-C1182 WeakPolarHBondContact O-CB 3.5Å; I1179-C1182 PolarHBondContact O-N 3.2Å; I1179-I1183 HydrophobicContact CG2-CD1 3.81Å; I1179-I1183 HydrophobicContact CG2-CG1 4.4Å; I1179-I1183 WeakPolarHBondContact O-CB 3.39Å; I1179-I1183 VanDerWaalsContact O-CG1 3.29Å; I1179-I1183 WeakPolarHBondContact O-CG1 3.35Å; I1179-I1183 PolarHBondContact O-N 3.1Å
1180	L	73.3	Confident	65.7	Low	3 Å²	3	38.6 Å²	38.6	2%	0.016	21%	0.213	C	C	.	.	H	α-helix	trans	-64.8	-42.8	175.4	-97.1	143.4	0	0	0	112.2	L847 L850 F854 L1176 K1177 I1178 C1182 I1183 I1184 L1198 T1201 F1205 M1224 M1228	L847-L1180 HydrophobicContact CD1-CD1 3.62Å; L847-L1180 HydrophobicContact CD1-CD2 3.57Å; L847-L1180 HydrophobicContact CD1-CG 4.09Å; L847-L1180 HydrophobicContact CD2-CG 4.47Å; L850-L1180 HydrophobicContact CD2-CD1 4.45Å; L850-L1180 HydrophobicContact CD2-CD2 3.69Å; L850-L1180 HydrophobicContact CD2-CG 3.79Å; F854-L1180 HydrophobicContact CE2-CD1 3.91Å; F854-L1180 HydrophobicContact CE2-CG 4.5Å; F854-L1180 HydrophobicContact CZ-CD1 4.02Å; L1176-L1180 HydrophobicContact CD2-CD1 3.71Å; L1176-L1180 HydrophobicContact CG-CD1 4.48Å; L1176-L1180 WeakPolarHBondContact O-CB 3.3Å; L1176-L1180 VanDerWaalsContact O-CG 3.32Å; L1176-L1180 WeakPolarHBondContact O-CG 3.38Å; L1176-L1180 PolarHBondContact O-N 3.17Å; L1176-L1180 VanDerWaalsContact O-N 3.11Å; K1177-L1180 PolarHBondContact O-N 3.18Å; K1177-L1180 VanDerWaalsContact O-N 3.12Å; I1178-L1180 PolarHBondContact O-N 3.49Å; L1180-C1182 VanDerWaalsContact C-N 3.33Å; L1180-C1182 PolarHBondContact O-N 2.9Å; L1180-I1183 PolarHBondContact O-N 3.14Å; L1180-I1184 HydrophobicContact CB-CD1 4.38Å; L1180-I1184 HydrophobicContact CD2-CD1 4.19Å; L1180-I1184 HydrophobicContact CG-CD1 3.86Å; L1180-I1184 WeakPolarHBondContact O-CB 3.37Å; L1180-I1184 WeakPolarHBondContact O-CD1 3.34Å; L1180-I1184 VanDerWaalsContact O-CG1 3.27Å; L1180-I1184 WeakPolarHBondContact O-CG1 3.38Å; L1180-I1184 PolarHBondContact O-N 3.24Å; L1180-L1198 HydrophobicContact CD2-CD2 4.1Å; L1180-T1201 HydrophobicContact CD1-CG2 4.14Å; L1180-T1201 HydrophobicContact CD2-CG2 4.39Å; L1180-F1205 HydrophobicContact CD1-CE2 4.4Å; L1180-F1205 HydrophobicContact CD1-CZ 4.25Å; L1180-M1224 HydrophobicContact CB-CE 3.87Å; L1180-M1224 HydrophobicContact CB-SD 4.38Å; L1180-M1224 HydrophobicContact CD1-CE 3.91Å; L1180-M1224 HydrophobicContact CD1-CG 4.4Å; L1180-M1224 HydrophobicContact CD1-SD 3.9Å; L1180-M1224 HydrophobicContact CD2-CE 4.36Å; L1180-M1224 HydrophobicContact CG-CE 4.13Å; L1180-M1228 HydrophobicContact CD2-CE 3.99Å; L1180-M1228 HydrophobicContact CD2-CG 4.19Å; L1180-M1228 HydrophobicContact CD2-SD 3.87Å
1181	E	71.3	Confident	65.7	Low	51.6 Å²	51.6	36.5 Å²	36.5	24%	0.241	20%	0.196	C	C	.	.	H	α-helix	trans	-57.9	-46.8	174.4	-74.1	-173.6	175.3	0	0	110.9	K1177 I1178 N1185 F1227	K1177-E1181 WeakPolarHBondContact CE-OE1 3.32Å; K1177-E1181 HydrophobicContact CG-CG 4.28Å; K1177-E1181 IonicContact NZ-OE1 3.54Å; K1177-E1181 WeakPolarHBondContact O-CB 3.37Å; K1177-E1181 WeakPolarHBondContact O-CG 3.36Å; K1177-E1181 PolarHBondContact O-N 3.05Å; I1178-E1181 PolarHBondContact O-N 3.12Å; E1181-N1185 WeakPolarHBondContact O-CB 3.29Å; E1181-N1185 PolarHBondContact O-N 3.27Å; E1181-N1185 PolarHBondContact O-ND2 3.06Å; E1181-N1185 VanDerWaalsContact O-ND2 3.11Å; E1181-F1227 HydrophobicContact CB-CE1 4.43Å; E1181-F1227 HydrophobicContact CB-CZ 4.21Å; E1181-F1227 HydrophobicContact CG-CD1 4.49Å; E1181-F1227 HydrophobicContact CG-CE1 3.88Å; E1181-F1227 HydrophobicContact CG-CE2 4.18Å; E1181-F1227 HydrophobicContact CG-CZ 3.69Å
1182	C	69.2	Low	65.8	Low	16.2 Å²	16.2	40.4 Å²	40.4	11%	0.109	21%	0.211	C	C	.	.	H	α-helix	trans	-59.8	-50.8	174.3	-74.9	0	0	0	0	112.5	I838 I1178 I1179 L1180 I1184 N1185 I1186	I838-C1182 HydrophobicContact CD1-CB 3.7Å; I1178-C1182 WeakPolarHBondContact O-CB 3.4Å; I1178-C1182 PolarHBondContact O-N 3.21Å; I1178-C1182 PolarHBondContact O-SG 3.12Å; I1178-C1182 VanDerWaalsContact O-SG 3.38Å; I1179-C1182 WeakPolarHBondContact O-CB 3.5Å; I1179-C1182 PolarHBondContact O-N 3.2Å; L1180-C1182 VanDerWaalsContact C-N 3.33Å; L1180-C1182 PolarHBondContact O-N 2.9Å; C1182-I1184 VanDerWaalsContact C-N 3.33Å; C1182-I1184 PolarHBondContact O-N 3.13Å; C1182-N1185 PolarHBondContact O-N 3.16Å; C1182-I1186 HydrophobicContact CB-CD1 4.42Å; C1182-I1186 VanDerWaalsContact O-CB 3.28Å; C1182-I1186 WeakPolarHBondContact O-CB 3.28Å; C1182-I1186 WeakPolarHBondContact O-CD1 3.35Å; C1182-I1186 VanDerWaalsContact O-CG1 3.23Å; C1182-I1186 WeakPolarHBondContact O-CG1 3.38Å; C1182-I1186 PolarHBondContact O-N 3.21Å
1183	I	70.5	Confident	66	Low	0.4 Å²	0.4	39 Å²	39	0%	0.002	21%	0.208	C	C	.	.	H	α-helix	trans	-58.4	-47.1	-179.5	-71.2	170.3	0	0	0	110.9	I838 P843 L846 L847 L850 I1179 L1180 N1185 I1186 F1187 I1194	I838-I1183 HydrophobicContact CG2-CD1 4.48Å; I838-I1183 HydrophobicContact CG2-CG1 3.8Å; P843-I1183 HydrophobicContact CB-CD1 3.61Å; P843-I1183 HydrophobicContact CB-CG1 3.5Å; P843-I1183 VanDerWaalsContact CB-CG1 3.5Å; P843-I1183 HydrophobicContact CB-CG2 4.37Å; P843-I1183 HydrophobicContact CG-CG1 4.5Å; L846-I1183 HydrophobicContact CD2-CD1 4.12Å; L846-I1183 HydrophobicContact CD2-CG1 4.47Å; L846-I1183 HydrophobicContact CG-CD1 4.3Å; L847-I1183 HydrophobicContact CB-CD1 4.27Å; L847-I1183 HydrophobicContact CD1-CD1 4.42Å; L847-I1183 HydrophobicContact CD2-CD1 3.91Å; L847-I1183 HydrophobicContact CG-CD1 4.46Å; L850-I1183 HydrophobicContact CD1-CD1 3.54Å; L850-I1183 VanDerWaalsContact CD1-CD1 3.43Å; I1179-I1183 HydrophobicContact CG2-CD1 3.81Å; I1179-I1183 HydrophobicContact CG2-CG1 4.4Å; I1179-I1183 WeakPolarHBondContact O-CB 3.39Å; I1179-I1183 VanDerWaalsContact O-CG1 3.29Å; I1179-I1183 WeakPolarHBondContact O-CG1 3.35Å; I1179-I1183 PolarHBondContact O-N 3.1Å; L1180-I1183 PolarHBondContact O-N 3.14Å; I1183-N1185 VanDerWaalsContact C-N 3.34Å; I1183-N1185 PolarHBondContact O-N 3.18Å; I1183-I1186 PolarHBondContact O-N 3.15Å; I1183-F1187 HydrophobicContact CG2-CD2 4.26Å; I1183-F1187 WeakPolarHBondContact O-CB 3.41Å; I1183-F1187 PolarHBondContact O-N 3.3Å; I1183-I1194 HydrophobicContact CG2-CG2 4.24Å
1184	I	70.1	Confident	66	Low	7.4 Å²	7.4	38 Å²	38	4%	0.038	20%	0.204	C	C	.	.	H	α-helix	trans	-74.6	-32	-177.8	-51.6	160.7	0	0	0	110.9	L1180 C1182 I1186 G1188 L1198 F1227 M1228 K1231	L1180-I1184 HydrophobicContact CB-CD1 4.38Å; L1180-I1184 HydrophobicContact CD2-CD1 4.19Å; L1180-I1184 HydrophobicContact CG-CD1 3.86Å; L1180-I1184 WeakPolarHBondContact O-CB 3.37Å; L1180-I1184 WeakPolarHBondContact O-CD1 3.34Å; L1180-I1184 VanDerWaalsContact O-CG1 3.27Å; L1180-I1184 WeakPolarHBondContact O-CG1 3.38Å; L1180-I1184 PolarHBondContact O-N 3.24Å; C1182-I1184 VanDerWaalsContact C-N 3.33Å; C1182-I1184 PolarHBondContact O-N 3.13Å; I1184-I1186 VanDerWaalsContact C-N 3.31Å; I1184-I1186 PolarHBondContact O-N 3.16Å; I1184-G1188 PolarHBondContact O-N 3.05Å; I1184-G1188 VanDerWaalsContact O-N 3.12Å; I1184-L1198 HydrophobicContact CD1-CD2 3.83Å; I1184-L1198 HydrophobicContact CG1-CD1 4.03Å; I1184-L1198 HydrophobicContact CG1-CD2 3.69Å; I1184-L1198 HydrophobicContact CG1-CG 4.47Å; I1184-L1198 HydrophobicContact CG2-CD1 4.27Å; I1184-F1227 HydrophobicContact CB-CE1 4.41Å; I1184-F1227 HydrophobicContact CD1-CD1 4.36Å; I1184-F1227 HydrophobicContact CD1-CE1 4Å; I1184-M1228 HydrophobicContact CD1-CG 4.25Å; I1184-K1231 VanDerWaalsContact C-NZ 3.3Å; I1184-K1231 HydrophobicContact CB-CD 4.26Å; I1184-K1231 HydrophobicContact CD1-CD 4.45Å; I1184-K1231 HydrophobicContact CG2-CB 4.22Å; I1184-K1231 HydrophobicContact CG2-CD 3.42Å; I1184-K1231 VanDerWaalsContact CG2-CD 3.42Å; I1184-K1231 HydrophobicContact CG2-CG 4.49Å; I1184-K1231 PolarHBondContact O-NZ 2.77Å
1185	N	67.4	Low	66.2	Low	91.4 Å²	91.4	37.8 Å²	37.8	49%	0.489	20%	0.198	S	C	.	.	H	α-helix	trans	-65.9	-37.3	173.8	-77.1	-20.4	0	0	0	112.7	E1181 C1182 I1183 K1231	E1181-N1185 WeakPolarHBondContact O-CB 3.29Å; E1181-N1185 PolarHBondContact O-N 3.27Å; E1181-N1185 PolarHBondContact O-ND2 3.06Å; E1181-N1185 VanDerWaalsContact O-ND2 3.11Å; C1182-N1185 PolarHBondContact O-N 3.16Å; I1183-N1185 VanDerWaalsContact C-N 3.34Å; I1183-N1185 PolarHBondContact O-N 3.18Å; N1185-K1231 PolarHBondContact OD1-NZ 2.97Å
1186	I	63.2	Low	66.4	Low	40.8 Å²	40.8	42 Å²	42	21%	0.209	22%	0.221	C	C	.	.	H	α-helix	trans	-87.7	-39.7	-175.5	-60.3	163.8	0	0	0	111.5	S835 I838 C1182 I1183 I1184 V1617	S835-I1186 WeakPolarHBondContact OG-CD1 3.2Å; I838-I1186 HydrophobicContact CG2-CD1 4.43Å; C1182-I1186 HydrophobicContact CB-CD1 4.42Å; C1182-I1186 VanDerWaalsContact O-CB 3.28Å; C1182-I1186 WeakPolarHBondContact O-CB 3.28Å; C1182-I1186 WeakPolarHBondContact O-CD1 3.35Å; C1182-I1186 VanDerWaalsContact O-CG1 3.23Å; C1182-I1186 WeakPolarHBondContact O-CG1 3.38Å; C1182-I1186 PolarHBondContact O-N 3.21Å; I1183-I1186 PolarHBondContact O-N 3.15Å; I1184-I1186 VanDerWaalsContact C-N 3.31Å; I1184-I1186 PolarHBondContact O-N 3.16Å; I1186-V1617 WeakPolarHBondContact O-CG2 3.35Å
1187	F	64.3	Low	66.4	Low	18 Å²	18	42 Å²	42	8%	0.079	22%	0.221	C	C	.	.	H	α-helix	trans	-123.1	-13.6	-164.1	-57.9	-75.9	0	0	0	117	I838 A839 P843 I1183 R1189 A1190 I1194 I1611 N1615 V1617	I838-F1187 HydrophobicContact CG2-CE2 4.32Å; A839-F1187 HydrophobicContact CB-CZ 4.32Å; P843-F1187 HydrophobicContact CB-CB 4.47Å; P843-F1187 HydrophobicContact CB-CD2 3.53Å; P843-F1187 VanDerWaalsContact CB-CD2 3.49Å; P843-F1187 HydrophobicContact CB-CE2 3.64Å; P843-F1187 HydrophobicContact CB-CG 4.04Å; P843-F1187 HydrophobicContact CB-CZ 4.22Å; P843-F1187 HydrophobicContact CG-CB 4.38Å; P843-F1187 HydrophobicContact CG-CD1 3.88Å; P843-F1187 HydrophobicContact CG-CD2 3.87Å; P843-F1187 HydrophobicContact CG-CE1 3.95Å; P843-F1187 HydrophobicContact CG-CE2 3.75Å; P843-F1187 HydrophobicContact CG-CG 3.76Å; P843-F1187 HydrophobicContact CG-CZ 3.92Å; I1183-F1187 HydrophobicContact CG2-CD2 4.26Å; I1183-F1187 WeakPolarHBondContact O-CB 3.41Å; I1183-F1187 PolarHBondContact O-N 3.3Å; F1187-R1189 VanDerWaalsContact C-N 3.29Å; F1187-R1189 PolarHBondContact O-N 3.21Å; F1187-R1189 VanDerWaalsContact O-N 3.16Å; F1187-A1190 PolarHBondContact O-N 3.06Å; F1187-I1194 HydrophobicContact CB-CD1 3.54Å; F1187-I1194 HydrophobicContact CB-CG2 4.24Å; F1187-I1194 HydrophobicContact CD1-CD1 4.31Å; F1187-I1194 HydrophobicContact CD2-CD1 4.45Å; F1187-I1194 HydrophobicContact CG-CD1 4.15Å; F1187-I1611 HydrophobicContact CE1-CG2 4.18Å; F1187-I1611 HydrophobicContact CZ-CG2 3.97Å; F1187-N1615 HydrophobicContact CD1-CB 3.86Å; F1187-N1615 HydrophobicContact CE1-CB 4.05Å; F1187-V1617 HydrophobicContact CD1-CG2 4.3Å
1188	G	59	Low	66.5	Low	1.4 Å²	1.4	38.9 Å²	38.9	1%	0.014	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-56.8	-36	-175.9	0	0	0	0	0	113.7	I1184 A1190 N1195	I1184-G1188 PolarHBondContact O-N 3.05Å; I1184-G1188 VanDerWaalsContact O-N 3.12Å; G1188-A1190 PolarHBondContact O-N 3.14Å; G1188-N1195 WeakPolarHBondContact CA-OD1 3.34Å; G1188-N1195 PolarHBondContact O-ND2 3.17Å; G1188-N1195 PolarHBondContact O-OD1 2.84Å; G1188-N1195 VanDerWaalsContact O-OD1 3.05Å
1189	R	55.9	Low	66.7	Low	142.6 Å²	142.6	41.6 Å²	41.6	54%	0.538	22%	0.218	S	C	.	.	G	3₁₀ helix	trans	-62.9	3.5	-176.4	-67.5	-178.5	166.3	-177.7	-11.7	116.1	F1187 E1235 E1238 L1621	F1187-R1189 VanDerWaalsContact C-N 3.29Å; F1187-R1189 PolarHBondContact O-N 3.21Å; F1187-R1189 VanDerWaalsContact O-N 3.16Å; R1189-E1235 WeakPolarHBondContact CA-OE1 3.44Å; R1189-E1235 VanDerWaalsContact CG-OE1 3.24Å; R1189-E1235 WeakPolarHBondContact CG-OE1 3.46Å; R1189-E1235 PolarHBondContact N-OE1 2.94Å; R1189-E1238 IonicContact CZ-OE2 2.84Å; R1189-E1238 IonicContact NE-OE2 2.89Å; R1189-E1238 PolarHBondContact NE-OE2 3.21Å; R1189-E1238 VanDerWaalsContact NE-OE2 3.09Å; R1189-E1238 VanDerWaalsContact NH2-CD 3.33Å; R1189-E1238 IonicContact NH2-OE1 3.3Å; R1189-E1238 PolarHBondContact NH2-OE1 2.83Å; R1189-E1238 IonicContact NH2-OE2 3.36Å; R1189-E1238 PolarHBondContact NH2-OE2 3.32Å; R1189-L1621 HydrophobicContact CB-CB 4.21Å; R1189-L1621 HydrophobicContact CB-CD1 4.33Å; R1189-L1621 HydrophobicContact CB-CD2 4.36Å; R1189-L1621 WeakPolarHBondContact O-CD1 3.08Å
1190	A	54.4	Low	66.9	Low	54 Å²	54	45.1 Å²	45.1	45%	0.446	23%	0.234	S	C	.	.	G	3₁₀ helix	trans	-162.7	5.2	-169.9	0	0	0	0	0	118.1	F1187 G1188 V1617 L1621	F1187-A1190 PolarHBondContact O-N 3.06Å; G1188-A1190 PolarHBondContact O-N 3.14Å; A1190-V1617 HydrophobicContact CB-CB 4.38Å; A1190-V1617 HydrophobicContact CB-CG1 3.8Å; A1190-V1617 HydrophobicContact CB-CG2 4.31Å; A1190-L1621 HydrophobicContact CB-CB 4.06Å; A1190-L1621 HydrophobicContact CB-CD1 3.78Å
1191	N	60	Low	67	Low	33 Å²	33	45.4 Å²	45.4	18%	0.176	24%	0.236	C	C	.	.			trans	-127.1	100	-174.9	-129.8	-47.8	0	0	0	112.1	R691 G1193 I1194 N1195 N1615	R691-N1191 PolarHBondContact NH1-ND2 3.13Å; R691-N1191 PolarHBondContact NH1-OD1 3.2Å; R691-N1191 PolarHBondContact NH2-OD1 3.25Å; R691-N1191 VanDerWaalsContact NH2-OD1 3.08Å; N1191-G1193 VanDerWaalsContact C-N 3.28Å; N1191-G1193 PolarHBondContact O-N 3.07Å; N1191-G1193 VanDerWaalsContact O-N 3.14Å; N1191-G1193 PolarHBondContact OD1-N 3.28Å; N1191-I1194 HydrophobicContact CB-CB 4.25Å; N1191-I1194 HydrophobicContact CB-CD1 3.83Å; N1191-I1194 HydrophobicContact CB-CG1 4.04Å; N1191-I1194 WeakPolarHBondContact ND2-CD1 3.25Å; N1191-I1194 WeakPolarHBondContact O-CA 3.2Å; N1191-I1194 WeakPolarHBondContact O-CB 3.42Å; N1191-I1194 PolarHBondContact O-N 3.3Å; N1191-N1195 PolarHBondContact O-N 3.11Å; N1191-N1195 VanDerWaalsContact O-N 3.16Å; N1191-N1615 PolarHBondContact ND2-O 3.36Å; N1191-N1615 PolarHBondContact ND2-OD1 3.5Å
1192	D	61.8	Low	67.3	Low	127.2 Å²	127.2	45.2 Å²	45.2	68%	0.68	23%	0.234	S	C	*	.	H	α-helix	trans	-51	-44.7	-175.9	-52.9	-48.4	0	0	0	113	I1194 N1195 D1196	D1192-I1194 VanDerWaalsContact C-N 3.27Å; D1192-I1194 PolarHBondContact O-N 3.14Å; D1192-N1195 CarbonylContact O-C 3.52Å; D1192-N1195 WeakPolarHBondContact O-CA 3.31Å; D1192-N1195 WeakPolarHBondContact O-CB 3.43Å; D1192-N1195 PolarHBondContact O-N 3.09Å; D1192-N1195 VanDerWaalsContact O-N 3.08Å; D1192-D1196 PolarHBondContact O-N 3.11Å
1193	G	64.6	Low	67.8	Low	21.4 Å²	21.4	49.2 Å²	49.2	22%	0.221	26%	0.255	C	S	.	.	H	α-helix	trans	-67	-17.4	179.6	0	0	0	0	0	114.7	L844 N1191 V1197	L844-G1193 WeakPolarHBondContact CD1-O 3.25Å; N1191-G1193 VanDerWaalsContact C-N 3.28Å; N1191-G1193 PolarHBondContact O-N 3.07Å; N1191-G1193 VanDerWaalsContact O-N 3.14Å; N1191-G1193 PolarHBondContact OD1-N 3.28Å; G1193-V1197 VanDerWaalsContact O-CG2 3.3Å; G1193-V1197 WeakPolarHBondContact O-CG2 3.36Å; G1193-V1197 PolarHBondContact O-N 3.06Å
1194	I	67.8	Low	68	Low	3 Å²	3	51.2 Å²	51.2	2%	0.015	27%	0.265	C	S	.	.	H	α-helix	trans	-81.6	-41.6	169.7	-65.2	177.3	0	0	0	109.2	P843 L844 L847 I1183 F1187 N1191 D1192 D1196 V1197 L1198	P843-I1194 HydrophobicContact CB-CD1 4.24Å; P843-I1194 HydrophobicContact CG-CD1 3.79Å; L844-I1194 HydrophobicContact CB-CG1 4.27Å; L844-I1194 HydrophobicContact CD1-CG1 4.23Å; L847-I1194 HydrophobicContact CD2-CG2 4.22Å; I1183-I1194 HydrophobicContact CG2-CG2 4.24Å; F1187-I1194 HydrophobicContact CB-CD1 3.54Å; F1187-I1194 HydrophobicContact CB-CG2 4.24Å; F1187-I1194 HydrophobicContact CD1-CD1 4.31Å; F1187-I1194 HydrophobicContact CD2-CD1 4.45Å; F1187-I1194 HydrophobicContact CG-CD1 4.15Å; N1191-I1194 HydrophobicContact CB-CB 4.25Å; N1191-I1194 HydrophobicContact CB-CD1 3.83Å; N1191-I1194 HydrophobicContact CB-CG1 4.04Å; N1191-I1194 WeakPolarHBondContact ND2-CD1 3.25Å; N1191-I1194 WeakPolarHBondContact O-CA 3.2Å; N1191-I1194 WeakPolarHBondContact O-CB 3.42Å; N1191-I1194 PolarHBondContact O-N 3.3Å; D1192-I1194 VanDerWaalsContact C-N 3.27Å; D1192-I1194 PolarHBondContact O-N 3.14Å; I1194-D1196 VanDerWaalsContact C-N 3.29Å; I1194-D1196 PolarHBondContact O-N 3.11Å; I1194-V1197 CarbonylContact O-C 3.58Å; I1194-V1197 WeakPolarHBondContact O-CA 3.38Å; I1194-V1197 PolarHBondContact O-N 2.99Å; I1194-V1197 VanDerWaalsContact O-N 3.12Å; I1194-L1198 HydrophobicContact CG2-CD1 4.07Å; I1194-L1198 HydrophobicContact CG2-CG 4.26Å; I1194-L1198 VanDerWaalsContact O-CG 3.3Å; I1194-L1198 WeakPolarHBondContact O-CG 3.34Å; I1194-L1198 PolarHBondContact O-N 3.1Å
1195	N	68.6	Low	68.4	Low	48.6 Å²	48.6	51 Å²	51	26%	0.26	26%	0.264	S	S	.	.	H	α-helix	trans	-63.1	-33.5	176.4	-66.6	-11.5	0	0	0	112.1	G1188 N1191 D1192 V1197 L1198 K1199	G1188-N1195 WeakPolarHBondContact CA-OD1 3.34Å; G1188-N1195 PolarHBondContact O-ND2 3.17Å; G1188-N1195 PolarHBondContact O-OD1 2.84Å; G1188-N1195 VanDerWaalsContact O-OD1 3.05Å; N1191-N1195 PolarHBondContact O-N 3.11Å; N1191-N1195 VanDerWaalsContact O-N 3.16Å; D1192-N1195 CarbonylContact O-C 3.52Å; D1192-N1195 WeakPolarHBondContact O-CA 3.31Å; D1192-N1195 WeakPolarHBondContact O-CB 3.43Å; D1192-N1195 PolarHBondContact O-N 3.09Å; D1192-N1195 VanDerWaalsContact O-N 3.08Å; N1195-V1197 PolarHBondContact O-N 3.49Å; N1195-L1198 PolarHBondContact O-N 3.33Å; N1195-K1199 VanDerWaalsContact O-CB 3.24Å; N1195-K1199 WeakPolarHBondContact O-CB 3.36Å; N1195-K1199 WeakPolarHBondContact O-CD 3.45Å; N1195-K1199 WeakPolarHBondContact O-CE 3.4Å; N1195-K1199 VanDerWaalsContact O-CG 3.26Å; N1195-K1199 WeakPolarHBondContact O-CG 3.38Å; N1195-K1199 PolarHBondContact O-N 3.28Å
1196	D	70.8	Confident	69	Low	89.8 Å²	89.8	48.1 Å²	48.1	48%	0.48	26%	0.255	S	S	.	.	H	α-helix	trans	-64.4	-41.2	170.8	-74.5	-20.2	0	0	0	112.9	D1192 I1194 L1198 K1199 E1200	D1192-D1196 PolarHBondContact O-N 3.11Å; I1194-D1196 VanDerWaalsContact C-N 3.29Å; I1194-D1196 PolarHBondContact O-N 3.11Å; D1196-L1198 VanDerWaalsContact C-N 3.3Å; D1196-L1198 PolarHBondContact O-N 3.02Å; D1196-K1199 WeakPolarHBondContact O-CB 3.31Å; D1196-K1199 PolarHBondContact O-N 3.09Å; D1196-K1199 IonicContact OD1-NZ 3.4Å; D1196-K1199 PolarHBondContact OD1-NZ 3.17Å; D1196-E1200 WeakPolarHBondContact O-CB 3.49Å; D1196-E1200 PolarHBondContact O-N 3.15Å
1197	V	69.9	Low	69.7	Low	4.4 Å²	4.4	52.5 Å²	52.5	3%	0.027	27%	0.273	C	S	.	.	H	α-helix	trans	-76.5	-28.5	177.3	178.6	0	0	0	0	111.8	L844 L847 R848 L851 G1193 I1194 N1195 K1199 E1200 T1201	L844-V1197 HydrophobicContact CD1-CB 4Å; L844-V1197 HydrophobicContact CD1-CG1 3.78Å; L844-V1197 HydrophobicContact CD1-CG2 3.55Å; L844-V1197 VanDerWaalsContact CD1-CG2 3.46Å; L844-V1197 HydrophobicContact CD2-CG2 3.95Å; L844-V1197 HydrophobicContact CG-CB 4.31Å; L844-V1197 HydrophobicContact CG-CG1 4.16Å; L844-V1197 HydrophobicContact CG-CG2 3.86Å; L847-V1197 HydrophobicContact CB-CG1 4.41Å; L847-V1197 HydrophobicContact CD2-CB 3.93Å; L847-V1197 HydrophobicContact CD2-CG1 3.75Å; L847-V1197 HydrophobicContact CG-CB 4.44Å; L847-V1197 HydrophobicContact CG-CG1 3.7Å; R848-V1197 HydrophobicContact CG-CG1 4.32Å; R848-V1197 HydrophobicContact CG-CG2 4.34Å; L851-V1197 HydrophobicContact CD2-CG1 4.21Å; G1193-V1197 VanDerWaalsContact O-CG2 3.3Å; G1193-V1197 WeakPolarHBondContact O-CG2 3.36Å; G1193-V1197 PolarHBondContact O-N 3.06Å; I1194-V1197 CarbonylContact O-C 3.58Å; I1194-V1197 WeakPolarHBondContact O-CA 3.38Å; I1194-V1197 PolarHBondContact O-N 2.99Å; I1194-V1197 VanDerWaalsContact O-N 3.12Å; N1195-V1197 PolarHBondContact O-N 3.49Å; V1197-K1199 VanDerWaalsContact C-N 3.3Å; V1197-K1199 PolarHBondContact O-N 3.31Å; V1197-E1200 WeakPolarHBondContact O-CB 3.27Å; V1197-E1200 PolarHBondContact O-N 3.04Å; V1197-T1201 VanDerWaalsContact O-CB 3.24Å; V1197-T1201 WeakPolarHBondContact O-CB 3.25Å; V1197-T1201 PolarHBondContact O-N 3.16Å; V1197-T1201 PolarHBondContact O-OG1 3.26Å
1198	L	73.1	Confident	70.2	Confident	11.6 Å²	11.6	52.6 Å²	52.6	6%	0.061	27%	0.274	C	S	.	.	H	α-helix	trans	-64.7	-41.1	167.8	-68.2	172.6	0	0	0	110.7	L847 L1180 I1184 I1194 N1195 D1196 E1200 T1201 K1202 M1228	L847-L1198 HydrophobicContact CD1-CD2 4.37Å; L847-L1198 HydrophobicContact CD2-CD2 3.94Å; L847-L1198 HydrophobicContact CD2-CG 4.14Å; L1180-L1198 HydrophobicContact CD2-CD2 4.1Å; I1184-L1198 HydrophobicContact CD1-CD2 3.83Å; I1184-L1198 HydrophobicContact CG1-CD1 4.03Å; I1184-L1198 HydrophobicContact CG1-CD2 3.69Å; I1184-L1198 HydrophobicContact CG1-CG 4.47Å; I1184-L1198 HydrophobicContact CG2-CD1 4.27Å; I1194-L1198 HydrophobicContact CG2-CD1 4.07Å; I1194-L1198 HydrophobicContact CG2-CG 4.26Å; I1194-L1198 VanDerWaalsContact O-CG 3.3Å; I1194-L1198 WeakPolarHBondContact O-CG 3.34Å; I1194-L1198 PolarHBondContact O-N 3.1Å; N1195-L1198 PolarHBondContact O-N 3.33Å; D1196-L1198 VanDerWaalsContact C-N 3.3Å; D1196-L1198 PolarHBondContact O-N 3.02Å; L1198-E1200 PolarHBondContact O-N 3.32Å; L1198-T1201 WeakPolarHBondContact CA-OG1 3.4Å; L1198-T1201 WeakPolarHBondContact O-CB 3.39Å; L1198-T1201 PolarHBondContact O-N 3.14Å; L1198-T1201 PolarHBondContact O-OG1 3.43Å; L1198-K1202 VanDerWaalsContact O-CB 3.27Å; L1198-K1202 WeakPolarHBondContact O-CB 3.42Å; L1198-K1202 PolarHBondContact O-N 2.91Å; L1198-M1228 HydrophobicContact CB-CE 3.89Å; L1198-M1228 HydrophobicContact CD2-CE 3.88Å; L1198-M1228 HydrophobicContact CG-CE 4.42Å; L1198-M1228 WeakPolarHBondContact O-CE 3.27Å
1199	K	75.3	Confident	71	Confident	107.6 Å²	107.6	55.2 Å²	55.2	47%	0.468	29%	0.286	S	S	.	.	H	α-helix	trans	-62.7	-40.9	170.6	-81.4	164.2	-162.3	165.3	0	112	N1195 D1196 V1197 T1201 K1202 N1203	N1195-K1199 VanDerWaalsContact O-CB 3.24Å; N1195-K1199 WeakPolarHBondContact O-CB 3.36Å; N1195-K1199 WeakPolarHBondContact O-CD 3.45Å; N1195-K1199 WeakPolarHBondContact O-CE 3.4Å; N1195-K1199 VanDerWaalsContact O-CG 3.26Å; N1195-K1199 WeakPolarHBondContact O-CG 3.38Å; N1195-K1199 PolarHBondContact O-N 3.28Å; D1196-K1199 WeakPolarHBondContact O-CB 3.31Å; D1196-K1199 PolarHBondContact O-N 3.09Å; D1196-K1199 IonicContact OD1-NZ 3.4Å; D1196-K1199 PolarHBondContact OD1-NZ 3.17Å; V1197-K1199 VanDerWaalsContact C-N 3.3Å; V1197-K1199 PolarHBondContact O-N 3.31Å; K1199-T1201 VanDerWaalsContact C-N 3.32Å; K1199-T1201 PolarHBondContact O-N 3.36Å; K1199-K1202 PolarHBondContact O-N 3.11Å; K1199-N1203 VanDerWaalsContact O-CB 3.31Å; K1199-N1203 WeakPolarHBondContact O-CB 3.41Å; K1199-N1203 VanDerWaalsContact O-CG 3.25Å; K1199-N1203 PolarHBondContact O-N 3.07Å; K1199-N1203 PolarHBondContact O-ND2 3.11Å
1200	E	73.6	Confident	72	Confident	74.4 Å²	74.4	52.5 Å²	52.5	35%	0.348	30%	0.295	S	S	.	.	H	α-helix	trans	-61	-42.5	173.3	-153.5	178.1	-169.3	0	0	111.6	H744 R848 L851 D1196 V1197 L1198 N1203 L1204	H744-E1200 IonicContact CE1-OE1 3.36Å; H744-E1200 IonicContact CG-OE1 3.04Å; H744-E1200 IonicContact ND1-OE1 3.74Å; H744-E1200 PolarHBondContact ND1-OE1 3.41Å; R848-E1200 IonicContact CZ-OE2 2.93Å; R848-E1200 IonicContact NE-OE2 3.9Å; R848-E1200 PolarHBondContact NE-OE2 3.09Å; R848-E1200 IonicContact NH2-OE2 3.77Å; R848-E1200 PolarHBondContact NH2-OE2 3.16Å; L851-E1200 HydrophobicContact CD2-CB 4.05Å; L851-E1200 HydrophobicContact CD2-CG 4.12Å; D1196-E1200 WeakPolarHBondContact O-CB 3.49Å; D1196-E1200 PolarHBondContact O-N 3.15Å; V1197-E1200 WeakPolarHBondContact O-CB 3.27Å; V1197-E1200 PolarHBondContact O-N 3.04Å; L1198-E1200 PolarHBondContact O-N 3.32Å; E1200-N1203 PolarHBondContact O-N 3.02Å; E1200-L1204 WeakPolarHBondContact O-CB 3.27Å; E1200-L1204 PolarHBondContact O-N 3.06Å
1201	T	75.3	Confident	72.9	Confident	7.8 Å²	7.8	54 Å²	54	5%	0.048	30%	0.298	C	S	.	.	H	α-helix	trans	-65.3	-43.9	177.4	-45.5	0	0	0	0	111.7	L851 L1180 V1197 L1198 K1199 N1203 L1204 F1205 M1228	L851-T1201 HydrophobicContact CD1-CG2 4.08Å; L851-T1201 WeakPolarHBondContact CD1-OG1 3.37Å; L851-T1201 HydrophobicContact CD2-CG2 3.91Å; L1180-T1201 HydrophobicContact CD1-CG2 4.14Å; L1180-T1201 HydrophobicContact CD2-CG2 4.39Å; V1197-T1201 VanDerWaalsContact O-CB 3.24Å; V1197-T1201 WeakPolarHBondContact O-CB 3.25Å; V1197-T1201 PolarHBondContact O-N 3.16Å; V1197-T1201 PolarHBondContact O-OG1 3.26Å; L1198-T1201 WeakPolarHBondContact CA-OG1 3.4Å; L1198-T1201 WeakPolarHBondContact O-CB 3.39Å; L1198-T1201 PolarHBondContact O-N 3.14Å; L1198-T1201 PolarHBondContact O-OG1 3.43Å; K1199-T1201 VanDerWaalsContact C-N 3.32Å; K1199-T1201 PolarHBondContact O-N 3.36Å; T1201-N1203 VanDerWaalsContact C-N 3.33Å; T1201-N1203 PolarHBondContact O-N 3.19Å; T1201-L1204 WeakPolarHBondContact O-CA 3.37Å; T1201-L1204 WeakPolarHBondContact O-CB 3.48Å; T1201-L1204 PolarHBondContact O-N 3.03Å; T1201-L1204 VanDerWaalsContact O-N 3.12Å; T1201-F1205 HydrophobicContact CG2-CD2 4.2Å; T1201-F1205 HydrophobicContact CG2-CE1 4.37Å; T1201-F1205 HydrophobicContact CG2-CE2 3.55Å; T1201-F1205 VanDerWaalsContact CG2-CE2 3.49Å; T1201-F1205 HydrophobicContact CG2-CZ 3.74Å; T1201-F1205 WeakPolarHBondContact O-CD2 3.39Å; T1201-F1205 WeakPolarHBondContact O-CG 3.33Å; T1201-F1205 PolarHBondContact O-N 3.04Å; T1201-M1228 HydrophobicContact CG2-CE 4.17Å; T1201-M1228 HydrophobicContact CG2-SD 4.44Å
1202	K	77.9	Confident	73.4	Confident	49 Å²	49	53.1 Å²	53.1	21%	0.213	29%	0.294	C	S	.	.	H	α-helix	trans	-59.8	-44.3	174.1	-171.1	178.1	-175.8	176.1	0	111.4	L1198 K1199 L1204 F1205 G1206 M1225 M1228 T1229 E1232	L1198-K1202 VanDerWaalsContact O-CB 3.27Å; L1198-K1202 WeakPolarHBondContact O-CB 3.42Å; L1198-K1202 PolarHBondContact O-N 2.91Å; K1199-K1202 PolarHBondContact O-N 3.11Å; K1202-L1204 VanDerWaalsContact C-N 3.31Å; K1202-L1204 PolarHBondContact O-N 2.96Å; K1202-F1205 PolarHBondContact O-N 3.09Å; K1202-G1206 PolarHBondContact O-N 3.09Å; K1202-M1225 HydrophobicContact CB-SD 4.39Å; K1202-M1225 HydrophobicContact CG-CE 4.3Å; K1202-M1225 HydrophobicContact CG-CG 4.13Å; K1202-M1225 HydrophobicContact CG-SD 3.89Å; K1202-M1225 WeakPolarHBondContact CG-SD 3.39Å; K1202-M1225 VanDerWaalsContact O-SD 3.41Å; K1202-M1228 HydrophobicContact CB-CE 4.06Å; K1202-M1228 HydrophobicContact CB-SD 4.32Å; K1202-T1229 VanDerWaalsContact CE-OG1 3.27Å; K1202-T1229 WeakPolarHBondContact CE-OG1 3.34Å; K1202-T1229 PolarHBondContact NZ-OG1 3.16Å; K1202-E1232 WeakPolarHBondContact CD-OE1 3.2Å; K1202-E1232 IonicContact NZ-OE1 3.11Å; K1202-E1232 PolarHBondContact NZ-OE1 3.07Å; K1202-E1232 IonicContact NZ-OE2 3.14Å; K1202-E1232 PolarHBondContact NZ-OE2 3.12Å
1203	N	79.5	Confident	73.8	Confident	99.6 Å²	99.6	54.7 Å²	54.7	53%	0.533	30%	0.297	S	S	.	.	H	α-helix	trans	-65.3	-31.9	173.8	-74.8	-39.2	0	0	0	112.8	K1199 E1200 T1201 G1206 K1207	K1199-N1203 VanDerWaalsContact O-CB 3.31Å; K1199-N1203 WeakPolarHBondContact O-CB 3.41Å; K1199-N1203 VanDerWaalsContact O-CG 3.25Å; K1199-N1203 PolarHBondContact O-N 3.07Å; K1199-N1203 PolarHBondContact O-ND2 3.11Å; E1200-N1203 PolarHBondContact O-N 3.02Å; T1201-N1203 VanDerWaalsContact C-N 3.33Å; T1201-N1203 PolarHBondContact O-N 3.19Å; N1203-G1206 PolarHBondContact O-N 3.15Å; N1203-K1207 WeakPolarHBondContact O-CD 3.16Å; N1203-K1207 VanDerWaalsContact O-CG 3.29Å; N1203-K1207 WeakPolarHBondContact O-CG 3.39Å; N1203-K1207 PolarHBondContact O-N 3.12Å; N1203-K1207 VanDerWaalsContact O-N 3.12Å
1204	L	75.8	Confident	74.2	Confident	42.6 Å²	42.6	56.9 Å²	56.9	22%	0.223	30%	0.304	C	S	.	.	H	α-helix	trans	-69.2	-47.3	173.6	-172	70.2	0	0	0	111.3	L851 F854 E1200 T1201 K1202 G1206 K1207 I1208	L851-L1204 HydrophobicContact CB-CD2 3.78Å; L851-L1204 HydrophobicContact CD1-CB 4.26Å; L851-L1204 HydrophobicContact CD1-CD2 3.47Å; L851-L1204 VanDerWaalsContact CD1-CD2 3.47Å; L851-L1204 HydrophobicContact CD1-CG 4.46Å; L851-L1204 HydrophobicContact CD2-CD2 3.74Å; L851-L1204 HydrophobicContact CG-CD2 4.24Å; F854-L1204 HydrophobicContact CB-CD2 4.46Å; E1200-L1204 WeakPolarHBondContact O-CB 3.27Å; E1200-L1204 PolarHBondContact O-N 3.06Å; T1201-L1204 WeakPolarHBondContact O-CA 3.37Å; T1201-L1204 WeakPolarHBondContact O-CB 3.48Å; T1201-L1204 PolarHBondContact O-N 3.03Å; T1201-L1204 VanDerWaalsContact O-N 3.12Å; K1202-L1204 VanDerWaalsContact C-N 3.31Å; K1202-L1204 PolarHBondContact O-N 2.96Å; L1204-G1206 VanDerWaalsContact C-N 3.31Å; L1204-G1206 PolarHBondContact O-N 3.14Å; L1204-K1207 CarbonylContact O-C 3.57Å; L1204-K1207 WeakPolarHBondContact O-CB 3.34Å; L1204-K1207 PolarHBondContact O-N 2.97Å; L1204-K1207 VanDerWaalsContact O-N 3.11Å; L1204-I1208 HydrophobicContact CD1-CD1 4.33Å; L1204-I1208 HydrophobicContact CD1-CG1 4.49Å; L1204-I1208 HydrophobicContact CD2-CD1 4.27Å; L1204-I1208 HydrophobicContact CG-CD1 3.91Å; L1204-I1208 HydrophobicContact CG-CG1 4.42Å; L1204-I1208 WeakPolarHBondContact O-CB 3.49Å; L1204-I1208 VanDerWaalsContact O-CG1 3.29Å; L1204-I1208 WeakPolarHBondContact O-CG1 3.36Å; L1204-I1208 PolarHBondContact O-N 3.25Å
1205	F	79.3	Confident	74.5	Confident	3.2 Å²	3.2	63.1 Å²	63.1	1%	0.014	33%	0.334	C	S	.	.	H	α-helix	trans	-59.5	-40.8	174.9	-64.5	-39.8	0	0	0	112	L851 F854 L1176 L1180 T1201 K1202 K1207 I1208 M1209 W1220 C1221 M1224 M1225 M1228	L851-F1205 HydrophobicContact CD2-CE1 3.9Å; L851-F1205 HydrophobicContact CD2-CZ 4.21Å; F854-F1205 HydrophobicContact CD1-CE1 4.4Å; F854-F1205 HydrophobicContact CE1-CD1 4.47Å; F854-F1205 HydrophobicContact CE1-CE1 4.28Å; F854-F1205 HydrophobicContact CE1-CZ 4.44Å; F854-F1205 HydrophobicContact CE2-CZ 4.41Å; F854-F1205 HydrophobicContact CZ-CE1 4.19Å; F854-F1205 HydrophobicContact CZ-CZ 4.19Å; L1176-F1205 HydrophobicContact CD2-CE1 4.09Å; L1176-F1205 HydrophobicContact CD2-CZ 3.61Å; L1180-F1205 HydrophobicContact CD1-CE2 4.4Å; L1180-F1205 HydrophobicContact CD1-CZ 4.25Å; T1201-F1205 HydrophobicContact CG2-CD2 4.2Å; T1201-F1205 HydrophobicContact CG2-CE1 4.37Å; T1201-F1205 HydrophobicContact CG2-CE2 3.55Å; T1201-F1205 VanDerWaalsContact CG2-CE2 3.49Å; T1201-F1205 HydrophobicContact CG2-CZ 3.74Å; T1201-F1205 WeakPolarHBondContact O-CD2 3.39Å; T1201-F1205 WeakPolarHBondContact O-CG 3.33Å; T1201-F1205 PolarHBondContact O-N 3.04Å; K1202-F1205 PolarHBondContact O-N 3.09Å; F1205-K1207 VanDerWaalsContact C-N 3.33Å; F1205-K1207 PolarHBondContact O-N 3.15Å; F1205-I1208 HydrophobicContact CD1-CD1 4.21Å; F1205-I1208 PolarHBondContact O-N 3.17Å; F1205-I1208 VanDerWaalsContact O-N 3.14Å; F1205-M1209 WeakPolarHBondContact O-CB 3.24Å; F1205-M1209 WeakPolarHBondContact O-CG 3.33Å; F1205-M1209 PolarHBondContact O-N 3.17Å; F1205-W1220 HydrophobicContact CD1-CZ3 4.31Å; F1205-W1220 HydrophobicContact CE1-CH2 4.11Å; F1205-W1220 AromaticContact CE1-CZ3 3.67Å; F1205-W1220 HydrophobicContact CE1-CZ3 3.75Å; F1205-W1220 AromaticContact CZ-CH2 3.97Å; F1205-W1220 HydrophobicContact CZ-CH2 4.21Å; F1205-W1220 AromaticContact CZ-CZ3 3.93Å; F1205-W1220 HydrophobicContact CZ-CZ3 4.1Å; F1205-C1221 HydrophobicContact CB-CB 4.3Å; F1205-M1224 HydrophobicContact CD2-CB 4.42Å; F1205-M1224 HydrophobicContact CD2-CG 3.9Å; F1205-M1224 HydrophobicContact CE2-CB 4.2Å; F1205-M1224 HydrophobicContact CE2-CG 3.6Å; F1205-M1224 HydrophobicContact CZ-CB 4.39Å; F1205-M1224 HydrophobicContact CZ-CG 4.02Å; F1205-M1225 HydrophobicContact CB-CE 4.2Å; F1205-M1225 HydrophobicContact CB-CG 3.75Å; F1205-M1225 HydrophobicContact CB-SD 3.89Å; F1205-M1225 HydrophobicContact CD2-CG 4.04Å; F1205-M1225 HydrophobicContact CG-CG 4.36Å; F1205-M1228 HydrophobicContact CD2-CE 4.45Å; F1205-M1228 HydrophobicContact CD2-SD 4.12Å; F1205-M1228 HydrophobicContact CE2-CE 3.82Å; F1205-M1228 HydrophobicContact CE2-SD 3.91Å
1206	G	79	Confident	74.6	Confident	29.6 Å²	29.6	65.7 Å²	65.7	31%	0.305	35%	0.345	S	S	.	.	H	α-helix	trans	-58.4	-42.4	172.6	0	0	0	0	0	113.4	K1202 N1203 L1204 A1210 M1225	K1202-G1206 PolarHBondContact O-N 3.09Å; N1203-G1206 PolarHBondContact O-N 3.15Å; L1204-G1206 VanDerWaalsContact C-N 3.31Å; L1204-G1206 PolarHBondContact O-N 3.14Å; G1206-A1210 WeakPolarHBondContact O-CB 3.32Å; G1206-A1210 PolarHBondContact O-N 3.03Å; G1206-M1225 PolarHBondContact N-SD 3.31Å; G1206-M1225 VanDerWaalsContact N-SD 3.42Å
1207	K	78	Confident	74.6	Confident	134 Å²	134	62.3 Å²	62.3	58%	0.583	33%	0.327	S	S	*	.	H	α-helix	trans	-66.4	-40.4	173.7	-70.9	166.8	-176	176	0	112.2	N1203 L1204 F1205 A1210 V1211	N1203-K1207 WeakPolarHBondContact O-CD 3.16Å; N1203-K1207 VanDerWaalsContact O-CG 3.29Å; N1203-K1207 WeakPolarHBondContact O-CG 3.39Å; N1203-K1207 PolarHBondContact O-N 3.12Å; N1203-K1207 VanDerWaalsContact O-N 3.12Å; L1204-K1207 CarbonylContact O-C 3.57Å; L1204-K1207 WeakPolarHBondContact O-CB 3.34Å; L1204-K1207 PolarHBondContact O-N 2.97Å; L1204-K1207 VanDerWaalsContact O-N 3.11Å; F1205-K1207 VanDerWaalsContact C-N 3.33Å; F1205-K1207 PolarHBondContact O-N 3.15Å; K1207-A1210 WeakPolarHBondContact O-CB 3.36Å; K1207-A1210 PolarHBondContact O-N 3.18Å; K1207-A1210 VanDerWaalsContact O-N 3.12Å; K1207-V1211 WeakPolarHBondContact O-CG2 3.41Å; K1207-V1211 PolarHBondContact O-N 2.97Å
1208	I	74.2	Confident	74.9	Confident	19 Å²	19	65.2 Å²	65.2	10%	0.097	34%	0.34	C	S	.	.	H	α-helix	trans	-63.9	-45.4	179.2	-71.9	167.2	0	0	0	110.7	F854 V858 L1204 F1205 A1210 V1211 T1212 V1217	F854-I1208 HydrophobicContact CD1-CD1 3.69Å; F854-I1208 HydrophobicContact CE1-CD1 3.61Å; F854-I1208 HydrophobicContact CE1-CG2 4.24Å; V858-I1208 HydrophobicContact CB-CD1 4.11Å; V858-I1208 HydrophobicContact CB-CG1 4.43Å; V858-I1208 HydrophobicContact CG1-CB 4.3Å; V858-I1208 HydrophobicContact CG1-CD1 3.74Å; V858-I1208 HydrophobicContact CG1-CG1 3.65Å; V858-I1208 HydrophobicContact CG1-CG2 3.81Å; V858-I1208 HydrophobicContact CG2-CD1 4.29Å; L1204-I1208 HydrophobicContact CD1-CD1 4.33Å; L1204-I1208 HydrophobicContact CD1-CG1 4.49Å; L1204-I1208 HydrophobicContact CD2-CD1 4.27Å; L1204-I1208 HydrophobicContact CG-CD1 3.91Å; L1204-I1208 HydrophobicContact CG-CG1 4.42Å; L1204-I1208 WeakPolarHBondContact O-CB 3.49Å; L1204-I1208 VanDerWaalsContact O-CG1 3.29Å; L1204-I1208 WeakPolarHBondContact O-CG1 3.36Å; L1204-I1208 PolarHBondContact O-N 3.25Å; F1205-I1208 HydrophobicContact CD1-CD1 4.21Å; F1205-I1208 PolarHBondContact O-N 3.17Å; F1205-I1208 VanDerWaalsContact O-N 3.14Å; I1208-A1210 VanDerWaalsContact C-N 3.27Å; I1208-A1210 PolarHBondContact O-N 3.07Å; I1208-A1210 VanDerWaalsContact O-N 3.15Å; I1208-V1211 PolarHBondContact O-N 3Å; I1208-V1211 VanDerWaalsContact O-N 3.11Å; I1208-T1212 HydrophobicContact CG2-CG2 4.48Å; I1208-T1212 VanDerWaalsContact O-CB 3.28Å; I1208-T1212 WeakPolarHBondContact O-CB 3.3Å; I1208-T1212 WeakPolarHBondContact O-CG2 3.42Å; I1208-T1212 PolarHBondContact O-N 3.02Å; I1208-T1212 PolarHBondContact O-OG1 3.16Å; I1208-V1217 HydrophobicContact CG2-CG1 3.99Å
1209	M	75.7	Confident	75	Confident	55.8 Å²	55.8	70.5 Å²	70.5	28%	0.275	36%	0.364	S	S	.	.	H	α-helix	trans	-60.2	-30.4	175.2	-68.6	-170.2	-33.4	0	0	113.3	F1205 K1218 C1221 A1222 M1225	F1205-M1209 WeakPolarHBondContact O-CB 3.24Å; F1205-M1209 WeakPolarHBondContact O-CG 3.33Å; F1205-M1209 PolarHBondContact O-N 3.17Å; M1209-K1218 HydrophobicContact CB-CG 4.34Å; M1209-K1218 HydrophobicContact CG-CG 4.48Å; M1209-K1218 VanDerWaalsContact O-CE 3.28Å; M1209-K1218 WeakPolarHBondContact O-CE 3.41Å; M1209-C1221 HydrophobicContact CG-CB 3.53Å; M1209-C1221 VanDerWaalsContact CG-CB 3.44Å; M1209-C1221 HydrophobicContact SD-CB 3.94Å; M1209-A1222 HydrophobicContact CE-CB 3.86Å; M1209-A1222 HydrophobicContact SD-CB 4.12Å; M1209-M1225 HydrophobicContact CE-CE 3.8Å; M1209-M1225 VanDerWaalsContact CE-CE 3.43Å; M1209-M1225 HydrophobicContact CE-CG 3.84Å; M1209-M1225 HydrophobicContact CE-SD 4.37Å; M1209-M1225 HydrophobicContact CG-CE 4.04Å; M1209-M1225 HydrophobicContact SD-CE 3.39Å; M1209-M1225 WeakPolarHBondContact SD-CE 3.32Å
1210	A	77.5	Confident	75	Confident	86.2 Å²	86.2	67 Å²	67	71%	0.712	35%	0.348	S	S	*	.	H	α-helix	trans	-78.9	-19.8	179.2	0	0	0	0	0	114.1	G1206 K1207 I1208	G1206-A1210 WeakPolarHBondContact O-CB 3.32Å; G1206-A1210 PolarHBondContact O-N 3.03Å; K1207-A1210 WeakPolarHBondContact O-CB 3.36Å; K1207-A1210 PolarHBondContact O-N 3.18Å; K1207-A1210 VanDerWaalsContact O-N 3.12Å; I1208-A1210 VanDerWaalsContact C-N 3.27Å; I1208-A1210 PolarHBondContact O-N 3.07Å; I1208-A1210 VanDerWaalsContact O-N 3.15Å
1211	V	72.7	Confident	75.2	Confident	86.2 Å²	86.2	63.5 Å²	63.5	52%	0.522	33%	0.332	S	S	.	.	H	α-helix	trans	-110.4	-30.9	-176	-179.2	0	0	0	0	112.8	Q862 K1207 I1208	Q862-V1211 HydrophobicContact CB-CG1 4.16Å; Q862-V1211 HydrophobicContact CG-CG1 3.89Å; Q862-V1211 PolarHBondContact NE2-O 2.9Å; K1207-V1211 WeakPolarHBondContact O-CG2 3.41Å; K1207-V1211 PolarHBondContact O-N 2.97Å; I1208-V1211 PolarHBondContact O-N 3Å; I1208-V1211 VanDerWaalsContact O-N 3.11Å
1212	T	71.3	Confident	75.3	Confident	13.8 Å²	13.8	65 Å²	65	9%	0.085	35%	0.345	C	S	.	.			trans	-77.7	138.4	-176.3	-70.5	0	0	0	0	111.5	V858 L861 I1208 D1214 V1217 K1218	V858-T1212 HydrophobicContact CG1-CG2 3.74Å; V858-T1212 WeakPolarHBondContact CG1-OG1 3.21Å; L861-T1212 HydrophobicContact CB-CG2 4.43Å; L861-T1212 HydrophobicContact CD1-CG2 3.94Å; I1208-T1212 HydrophobicContact CG2-CG2 4.48Å; I1208-T1212 VanDerWaalsContact O-CB 3.28Å; I1208-T1212 WeakPolarHBondContact O-CB 3.3Å; I1208-T1212 WeakPolarHBondContact O-CG2 3.42Å; I1208-T1212 PolarHBondContact O-N 3.02Å; I1208-T1212 PolarHBondContact O-OG1 3.16Å; T1212-D1214 HydrophobicContact CG2-CB 3.8Å; T1212-D1214 PolarHBondContact OG1-N 3.29Å; T1212-V1217 HydrophobicContact CG2-CB 4.01Å; T1212-V1217 HydrophobicContact CG2-CG1 4.05Å; T1212-V1217 HydrophobicContact CG2-CG2 4.42Å; T1212-K1218 HydrophobicContact CG2-CD 4.45Å; T1212-K1218 HydrophobicContact CG2-CG 3.81Å; T1212-K1218 WeakPolarHBondContact O-CE 3.38Å; T1212-K1218 PolarHBondContact O-NZ 3.26Å
1213	E	70.6	Confident	75.2	Confident	161.8 Å²	161.8	66 Å²	66	76%	0.756	36%	0.355	S	S	*	.			trans	-86.1	-30	172.7	-68.2	-177.9	170	0	0	112.3	G865 M1215 K1218	G865-E1213 WeakPolarHBondContact CA-OE1 3.1Å; E1213-M1215 PolarHBondContact O-N 3.13Å; E1213-K1218 PolarHBondContact O-NZ 2.88Å
1214	D	73.4	Confident	75	Confident	66.2 Å²	66.2	61.5 Å²	61.5	35%	0.354	33%	0.331	S	S	.	.			trans	-58.8	124.1	-179.9	-169	-25.7	0	0	0	113	T1212 Q1216 V1217 K1218	T1212-D1214 HydrophobicContact CG2-CB 3.8Å; T1212-D1214 PolarHBondContact OG1-N 3.29Å; D1214-Q1216 WeakPolarHBondContact OD1-CB 3.39Å; D1214-Q1216 PolarHBondContact OD1-N 3.15Å; D1214-V1217 HydrophobicContact CB-CB 4.28Å; D1214-V1217 HydrophobicContact CB-CG2 4.08Å; D1214-V1217 PolarHBondContact OD1-N 3.37Å; D1214-V1217 WeakPolarHBondContact OD2-CG2 3.29Å; D1214-K1218 WeakPolarHBondContact O-CG 3.45Å; D1214-K1218 PolarHBondContact O-N 3.34Å; D1214-K1218 VanDerWaalsContact O-N 3.15Å
1215	M	73.8	Confident	75	Confident	133.6 Å²	133.6	61.1 Å²	61.1	66%	0.658	33%	0.328	S	S	*	.	H	α-helix	trans	-71.2	-35.2	-179.8	-161.3	69	75.2	0	0	112.5	E1213 V1217 K1218 E1219	E1213-M1215 PolarHBondContact O-N 3.13Å; M1215-V1217 VanDerWaalsContact C-N 3.3Å; M1215-V1217 PolarHBondContact O-N 3.05Å; M1215-K1218 WeakPolarHBondContact O-CB 3.3Å; M1215-K1218 PolarHBondContact O-N 3.02Å; M1215-K1218 VanDerWaalsContact O-N 3.15Å; M1215-K1218 HydrophobicContact SD-CD 4.39Å; M1215-E1219 HydrophobicContact CG-CG 4.39Å; M1215-E1219 WeakPolarHBondContact CG-OE1 3.48Å; M1215-E1219 WeakPolarHBondContact O-CB 3.39Å; M1215-E1219 WeakPolarHBondContact O-CG 3.49Å; M1215-E1219 PolarHBondContact O-N 3.28Å
1216	Q	70.5	Confident	74.7	Confident	103.2 Å²	103.2	66.5 Å²	66.5	48%	0.482	35%	0.354	S	S	.	.	H	α-helix	trans	-66.9	-40.7	-179.3	-62.2	-170.4	-26.4	0	0	110.8	P1167 I1168 L1169 D1214 K1218 E1219 W1220	P1167-Q1216 PolarHBondContact O-NE2 3.15Å; I1168-Q1216 VanDerWaalsContact C-OE1 3.28Å; L1169-Q1216 HydrophobicContact CG-CB 4.38Å; D1214-Q1216 WeakPolarHBondContact OD1-CB 3.39Å; D1214-Q1216 PolarHBondContact OD1-N 3.15Å; Q1216-K1218 VanDerWaalsContact C-N 3.34Å; Q1216-E1219 PolarHBondContact O-N 3.02Å; Q1216-W1220 VanDerWaalsContact O-CB 3.28Å; Q1216-W1220 WeakPolarHBondContact O-CB 3.32Å; Q1216-W1220 PolarHBondContact O-N 3.13Å
1217	V	71.2	Confident	74.3	Confident	17.8 Å²	17.8	67.6 Å²	67.6	11%	0.108	35%	0.35	C	S	.	.	H	α-helix	trans	-66.5	-38.7	174.9	-179.7	0	0	0	0	111	F854 V858 L861 L1169 M1173 I1208 T1212 D1214 M1215 C1221	F854-V1217 HydrophobicContact CZ-CG1 4.05Å; V858-V1217 HydrophobicContact CG1-CG1 4.36Å; V858-V1217 HydrophobicContact CG2-CG1 4.21Å; L861-V1217 HydrophobicContact CD1-CG1 4.47Å; L861-V1217 HydrophobicContact CD1-CG2 3.96Å; L1169-V1217 HydrophobicContact CD2-CG2 3.59Å; M1173-V1217 HydrophobicContact CE-CB 4.35Å; M1173-V1217 HydrophobicContact CE-CG1 4.07Å; M1173-V1217 HydrophobicContact CE-CG2 4.32Å; I1208-V1217 HydrophobicContact CG2-CG1 3.99Å; T1212-V1217 HydrophobicContact CG2-CB 4.01Å; T1212-V1217 HydrophobicContact CG2-CG1 4.05Å; T1212-V1217 HydrophobicContact CG2-CG2 4.42Å; D1214-V1217 HydrophobicContact CB-CB 4.28Å; D1214-V1217 HydrophobicContact CB-CG2 4.08Å; D1214-V1217 PolarHBondContact OD1-N 3.37Å; D1214-V1217 WeakPolarHBondContact OD2-CG2 3.29Å; M1215-V1217 VanDerWaalsContact C-N 3.3Å; M1215-V1217 PolarHBondContact O-N 3.05Å; V1217-C1221 VanDerWaalsContact O-CB 3.27Å; V1217-C1221 WeakPolarHBondContact O-CB 3.4Å; V1217-C1221 PolarHBondContact O-N 3.19Å; V1217-C1221 PolarHBondContact O-SG 3.19Å; V1217-C1221 VanDerWaalsContact O-SG 3.37Å
1218	K	76.2	Confident	73.9	Confident	66 Å²	66	61.5 Å²	61.5	29%	0.287	32%	0.324	S	S	.	.	H	α-helix	trans	-63.2	-48.4	173.8	-83	169.9	174	155.9	0	112.5	M1209 T1212 E1213 D1214 M1215 Q1216 C1221 A1222	M1209-K1218 HydrophobicContact CB-CG 4.34Å; M1209-K1218 HydrophobicContact CG-CG 4.48Å; M1209-K1218 VanDerWaalsContact O-CE 3.28Å; M1209-K1218 WeakPolarHBondContact O-CE 3.41Å; T1212-K1218 HydrophobicContact CG2-CD 4.45Å; T1212-K1218 HydrophobicContact CG2-CG 3.81Å; T1212-K1218 WeakPolarHBondContact O-CE 3.38Å; T1212-K1218 PolarHBondContact O-NZ 3.26Å; E1213-K1218 PolarHBondContact O-NZ 2.88Å; D1214-K1218 WeakPolarHBondContact O-CG 3.45Å; D1214-K1218 PolarHBondContact O-N 3.34Å; D1214-K1218 VanDerWaalsContact O-N 3.15Å; M1215-K1218 WeakPolarHBondContact O-CB 3.3Å; M1215-K1218 PolarHBondContact O-N 3.02Å; M1215-K1218 VanDerWaalsContact O-N 3.15Å; M1215-K1218 HydrophobicContact SD-CD 4.39Å; Q1216-K1218 VanDerWaalsContact C-N 3.34Å; K1218-C1221 PolarHBondContact O-N 3.21Å; K1218-A1222 VanDerWaalsContact O-CB 3.26Å; K1218-A1222 WeakPolarHBondContact O-CB 3.36Å; K1218-A1222 PolarHBondContact O-N 3Å
1219	E	75	Confident	73.6	Confident	123 Å²	123	62.9 Å²	62.9	58%	0.575	33%	0.333	S	S	*	.	H	α-helix	trans	-64	-44.3	179.7	-158.1	168	-157	0	0	111.1	M1215 Q1216 C1221 A1222 V1223	M1215-E1219 HydrophobicContact CG-CG 4.39Å; M1215-E1219 WeakPolarHBondContact CG-OE1 3.48Å; M1215-E1219 WeakPolarHBondContact O-CB 3.39Å; M1215-E1219 WeakPolarHBondContact O-CG 3.49Å; M1215-E1219 PolarHBondContact O-N 3.28Å; Q1216-E1219 PolarHBondContact O-N 3.02Å; E1219-C1221 PolarHBondContact O-N 2.87Å; E1219-A1222 WeakPolarHBondContact O-CB 3.37Å; E1219-A1222 PolarHBondContact O-N 3.15Å; E1219-V1223 WeakPolarHBondContact O-CB 3.21Å; E1219-V1223 VanDerWaalsContact O-CG2 3.29Å; E1219-V1223 WeakPolarHBondContact O-CG2 3.39Å; E1219-V1223 PolarHBondContact O-N 3.25Å
1220	W	75.8	Confident	72.9	Confident	34 Å²	34	64.2 Å²	64.2	13%	0.129	34%	0.34	C	S	.	.	H	α-helix	trans	-62.3	-44.6	174.5	-175	92.6	0	0	0	112.4	F854 L1169 M1173 L1176 K1177 F1205 Q1216 A1222 V1223 M1224	F854-W1220 AromaticContact CE1-CH2 3.61Å; F854-W1220 HydrophobicContact CE1-CH2 3.61Å; F854-W1220 HydrophobicContact CE1-CZ2 4.18Å; F854-W1220 AromaticContact CE1-CZ3 3.95Å; F854-W1220 HydrophobicContact CE1-CZ3 4.06Å; F854-W1220 AromaticContact CZ-CH2 3.61Å; F854-W1220 HydrophobicContact CZ-CH2 3.61Å; F854-W1220 HydrophobicContact CZ-CZ2 4.38Å; F854-W1220 HydrophobicContact CZ-CZ3 4.42Å; L1169-W1220 HydrophobicContact CD1-CB 4.24Å; L1169-W1220 HydrophobicContact CD1-CG 4.26Å; L1169-W1220 HydrophobicContact CD2-CB 3.95Å; L1169-W1220 HydrophobicContact CD2-CG 3.97Å; M1173-W1220 HydrophobicContact CB-CD2 4.45Å; M1173-W1220 HydrophobicContact CB-CZ2 4.29Å; M1173-W1220 HydrophobicContact CE-CB 3.9Å; M1173-W1220 HydrophobicContact CE-CD2 3.69Å; M1173-W1220 HydrophobicContact CE-CE3 3.65Å; M1173-W1220 HydrophobicContact CE-CG 3.8Å; M1173-W1220 HydrophobicContact CE-CZ3 4.45Å; M1173-W1220 HydrophobicContact CG-CD2 4.38Å; M1173-W1220 VanDerWaalsContact O-CZ2 3.26Å; M1173-W1220 WeakPolarHBondContact O-CZ2 3.4Å; M1173-W1220 PolarHBondContact O-NE1 3.02Å; M1173-W1220 HydrophobicContact SD-CD2 3.59Å; M1173-W1220 HydrophobicContact SD-CE3 3.58Å; M1173-W1220 HydrophobicContact SD-CG 4.21Å; M1173-W1220 HydrophobicContact SD-CH2 4.13Å; M1173-W1220 HydrophobicContact SD-CZ2 4.16Å; M1173-W1220 HydrophobicContact SD-CZ3 3.98Å; M1173-W1220 VanDerWaalsContact SD-CZ3 3.57Å; L1176-W1220 HydrophobicContact CB-CH2 4.34Å; L1176-W1220 HydrophobicContact CB-CZ2 4.12Å; L1176-W1220 HydrophobicContact CD2-CH2 3.85Å; K1177-W1220 HydrophobicContact CB-CZ2 4.21Å; F1205-W1220 HydrophobicContact CD1-CZ3 4.31Å; F1205-W1220 HydrophobicContact CE1-CH2 4.11Å; F1205-W1220 AromaticContact CE1-CZ3 3.67Å; F1205-W1220 HydrophobicContact CE1-CZ3 3.75Å; F1205-W1220 AromaticContact CZ-CH2 3.97Å; F1205-W1220 HydrophobicContact CZ-CH2 4.21Å; F1205-W1220 AromaticContact CZ-CZ3 3.93Å; F1205-W1220 HydrophobicContact CZ-CZ3 4.1Å; Q1216-W1220 VanDerWaalsContact O-CB 3.28Å; Q1216-W1220 WeakPolarHBondContact O-CB 3.32Å; Q1216-W1220 PolarHBondContact O-N 3.13Å; W1220-A1222 VanDerWaalsContact C-N 3.32Å; W1220-A1222 PolarHBondContact O-N 3.26Å; W1220-V1223 PolarHBondContact O-N 3.04Å; W1220-M1224 HydrophobicContact CE3-CB 4.33Å; W1220-M1224 HydrophobicContact CH2-CB 4.31Å; W1220-M1224 HydrophobicContact CH2-CE 3.98Å; W1220-M1224 HydrophobicContact CH2-CG 4.13Å; W1220-M1224 HydrophobicContact CH2-SD 4.45Å; W1220-M1224 HydrophobicContact CZ2-CE 3.73Å; W1220-M1224 HydrophobicContact CZ2-CG 4.42Å; W1220-M1224 HydrophobicContact CZ2-SD 4.47Å; W1220-M1224 HydrophobicContact CZ3-CB 4.16Å; W1220-M1224 HydrophobicContact CZ3-CG 4.26Å; W1220-M1224 VanDerWaalsContact O-CB 3.31Å; W1220-M1224 WeakPolarHBondContact O-CB 3.42Å; W1220-M1224 PolarHBondContact O-N 3.06Å
1221	C	77.6	Confident	71.9	Confident	1 Å²	1	61.6 Å²	61.6	1%	0.007	31%	0.313	C	S	.	.	H	α-helix	trans	-63.7	-37	175.1	-74.4	0	0	0	0	112.1	F1205 M1209 V1217 K1218 E1219 M1224 M1225	F1205-C1221 HydrophobicContact CB-CB 4.3Å; M1209-C1221 HydrophobicContact CG-CB 3.53Å; M1209-C1221 VanDerWaalsContact CG-CB 3.44Å; M1209-C1221 HydrophobicContact SD-CB 3.94Å; V1217-C1221 VanDerWaalsContact O-CB 3.27Å; V1217-C1221 WeakPolarHBondContact O-CB 3.4Å; V1217-C1221 PolarHBondContact O-N 3.19Å; V1217-C1221 PolarHBondContact O-SG 3.19Å; V1217-C1221 VanDerWaalsContact O-SG 3.37Å; K1218-C1221 PolarHBondContact O-N 3.21Å; E1219-C1221 PolarHBondContact O-N 2.87Å; C1221-M1224 PolarHBondContact O-N 3.08Å; C1221-M1225 HydrophobicContact CB-CE 4.47Å; C1221-M1225 VanDerWaalsContact O-CB 3.29Å; C1221-M1225 WeakPolarHBondContact O-CB 3.34Å; C1221-M1225 WeakPolarHBondContact O-CE 3.45Å; C1221-M1225 WeakPolarHBondContact O-CG 3.38Å; C1221-M1225 PolarHBondContact O-N 3.11Å
1222	A	76.3	Confident	71.1	Confident	38.4 Å²	38.4	60.4 Å²	60.4	32%	0.317	30%	0.302	S	S	.	.	H	α-helix	trans	-66.4	-45.3	175.7	0	0	0	0	0	111.5	M1209 K1218 E1219 W1220 M1224 M1225 Q1226	M1209-A1222 HydrophobicContact CE-CB 3.86Å; M1209-A1222 HydrophobicContact SD-CB 4.12Å; K1218-A1222 VanDerWaalsContact O-CB 3.26Å; K1218-A1222 WeakPolarHBondContact O-CB 3.36Å; K1218-A1222 PolarHBondContact O-N 3Å; E1219-A1222 WeakPolarHBondContact O-CB 3.37Å; E1219-A1222 PolarHBondContact O-N 3.15Å; W1220-A1222 VanDerWaalsContact C-N 3.32Å; W1220-A1222 PolarHBondContact O-N 3.26Å; A1222-M1224 VanDerWaalsContact C-N 3.33Å; A1222-M1224 PolarHBondContact O-N 3.01Å; A1222-M1225 PolarHBondContact O-N 3.01Å; A1222-Q1226 VanDerWaalsContact O-CB 3.31Å; A1222-Q1226 WeakPolarHBondContact O-CB 3.41Å; A1222-Q1226 VanDerWaalsContact O-CG 3.27Å; A1222-Q1226 WeakPolarHBondContact O-CG 3.47Å; A1222-Q1226 PolarHBondContact O-N 3.03Å
1223	V	75.7	Confident	70.1	Confident	70.2 Å²	70.2	63.5 Å²	63.5	43%	0.425	32%	0.32	S	S	.	.	H	α-helix	trans	-61.3	-41.8	174.2	169.8	0	0	0	0	111.1	L1163 E1219 W1220 Q1226 F1227	L1163-V1223 HydrophobicContact CD2-CG2 4.4Å; E1219-V1223 WeakPolarHBondContact O-CB 3.21Å; E1219-V1223 VanDerWaalsContact O-CG2 3.29Å; E1219-V1223 WeakPolarHBondContact O-CG2 3.39Å; E1219-V1223 PolarHBondContact O-N 3.25Å; W1220-V1223 PolarHBondContact O-N 3.04Å; V1223-Q1226 PolarHBondContact O-N 3.13Å; V1223-F1227 WeakPolarHBondContact O-CB 3.24Å; V1223-F1227 PolarHBondContact O-N 3.1Å
1224	M	74.7	Confident	69	Low	5.2 Å²	5.2	60.1 Å²	60.1	3%	0.026	31%	0.305	C	S	.	.	H	α-helix	trans	-69.9	-42.4	179	-162	61	146.7	0	0	112.1	K1177 L1180 F1205 W1220 C1221 A1222 Q1226 F1227 M1228	K1177-M1224 HydrophobicContact CB-CE 3.82Å; K1177-M1224 HydrophobicContact CB-SD 4.42Å; K1177-M1224 HydrophobicContact CG-CE 4.06Å; K1177-M1224 HydrophobicContact CG-SD 4.29Å; L1180-M1224 HydrophobicContact CB-CE 3.87Å; L1180-M1224 HydrophobicContact CB-SD 4.38Å; L1180-M1224 HydrophobicContact CD1-CE 3.91Å; L1180-M1224 HydrophobicContact CD1-CG 4.4Å; L1180-M1224 HydrophobicContact CD1-SD 3.9Å; L1180-M1224 HydrophobicContact CD2-CE 4.36Å; L1180-M1224 HydrophobicContact CG-CE 4.13Å; F1205-M1224 HydrophobicContact CD2-CB 4.42Å; F1205-M1224 HydrophobicContact CD2-CG 3.9Å; F1205-M1224 HydrophobicContact CE2-CB 4.2Å; F1205-M1224 HydrophobicContact CE2-CG 3.6Å; F1205-M1224 HydrophobicContact CZ-CB 4.39Å; F1205-M1224 HydrophobicContact CZ-CG 4.02Å; W1220-M1224 HydrophobicContact CE3-CB 4.33Å; W1220-M1224 HydrophobicContact CH2-CB 4.31Å; W1220-M1224 HydrophobicContact CH2-CE 3.98Å; W1220-M1224 HydrophobicContact CH2-CG 4.13Å; W1220-M1224 HydrophobicContact CH2-SD 4.45Å; W1220-M1224 HydrophobicContact CZ2-CE 3.73Å; W1220-M1224 HydrophobicContact CZ2-CG 4.42Å; W1220-M1224 HydrophobicContact CZ2-SD 4.47Å; W1220-M1224 HydrophobicContact CZ3-CB 4.16Å; W1220-M1224 HydrophobicContact CZ3-CG 4.26Å; W1220-M1224 VanDerWaalsContact O-CB 3.31Å; W1220-M1224 WeakPolarHBondContact O-CB 3.42Å; W1220-M1224 PolarHBondContact O-N 3.06Å; C1221-M1224 PolarHBondContact O-N 3.08Å; A1222-M1224 VanDerWaalsContact C-N 3.33Å; A1222-M1224 PolarHBondContact O-N 3.01Å; M1224-Q1226 VanDerWaalsContact C-N 3.3Å; M1224-Q1226 PolarHBondContact O-N 3.08Å; M1224-F1227 HydrophobicContact CE-CD1 4.06Å; M1224-F1227 HydrophobicContact CE-CE1 4.31Å; M1224-F1227 WeakPolarHBondContact O-CB 3.46Å; M1224-F1227 PolarHBondContact O-N 3.31Å; M1224-F1227 HydrophobicContact SD-CD1 4.27Å; M1224-M1228 HydrophobicContact CG-SD 4.21Å; M1224-M1228 WeakPolarHBondContact O-CB 3.2Å; M1224-M1228 VanDerWaalsContact O-CG 3.27Å; M1224-M1228 WeakPolarHBondContact O-CG 3.27Å; M1224-M1228 PolarHBondContact O-N 3.27Å
1225	M	76.3	Confident	67.6	Low	35.8 Å²	35.8	59.1 Å²	59.1	18%	0.176	30%	0.299	C	S	.	.	H	α-helix	trans	-61.7	-36.1	170.8	-75.4	-136.2	-66.7	0	0	112.1	K1202 F1205 G1206 M1209 C1221 A1222 T1229	K1202-M1225 HydrophobicContact CB-SD 4.39Å; K1202-M1225 HydrophobicContact CG-CE 4.3Å; K1202-M1225 HydrophobicContact CG-CG 4.13Å; K1202-M1225 HydrophobicContact CG-SD 3.89Å; K1202-M1225 WeakPolarHBondContact CG-SD 3.39Å; K1202-M1225 VanDerWaalsContact O-SD 3.41Å; F1205-M1225 HydrophobicContact CB-CE 4.2Å; F1205-M1225 HydrophobicContact CB-CG 3.75Å; F1205-M1225 HydrophobicContact CB-SD 3.89Å; F1205-M1225 HydrophobicContact CD2-CG 4.04Å; F1205-M1225 HydrophobicContact CG-CG 4.36Å; G1206-M1225 PolarHBondContact N-SD 3.31Å; G1206-M1225 VanDerWaalsContact N-SD 3.42Å; M1209-M1225 HydrophobicContact CE-CE 3.8Å; M1209-M1225 VanDerWaalsContact CE-CE 3.43Å; M1209-M1225 HydrophobicContact CE-CG 3.84Å; M1209-M1225 HydrophobicContact CE-SD 4.37Å; M1209-M1225 HydrophobicContact CG-CE 4.04Å; M1209-M1225 HydrophobicContact SD-CE 3.39Å; M1209-M1225 WeakPolarHBondContact SD-CE 3.32Å; C1221-M1225 HydrophobicContact CB-CE 4.47Å; C1221-M1225 VanDerWaalsContact O-CB 3.29Å; C1221-M1225 WeakPolarHBondContact O-CB 3.34Å; C1221-M1225 WeakPolarHBondContact O-CE 3.45Å; C1221-M1225 WeakPolarHBondContact O-CG 3.38Å; C1221-M1225 PolarHBondContact O-N 3.11Å; A1222-M1225 PolarHBondContact O-N 3.01Å; M1225-T1229 VanDerWaalsContact O-CB 3.26Å; M1225-T1229 WeakPolarHBondContact O-CB 3.42Å; M1225-T1229 PolarHBondContact O-N 3.3Å; M1225-T1229 PolarHBondContact O-OG1 3.02Å
1226	Q	73	Confident	65.9	Low	116.6 Å²	116.6	59.4 Å²	59.4	55%	0.545	30%	0.298	S	S	.	.	H	α-helix	trans	-68.4	-42.5	174.3	-136	175.5	14.9	0	0	111.2	A1222 V1223 M1224 M1228 T1229 I1230	A1222-Q1226 VanDerWaalsContact O-CB 3.31Å; A1222-Q1226 WeakPolarHBondContact O-CB 3.41Å; A1222-Q1226 VanDerWaalsContact O-CG 3.27Å; A1222-Q1226 WeakPolarHBondContact O-CG 3.47Å; A1222-Q1226 PolarHBondContact O-N 3.03Å; V1223-Q1226 PolarHBondContact O-N 3.13Å; M1224-Q1226 VanDerWaalsContact C-N 3.3Å; M1224-Q1226 PolarHBondContact O-N 3.08Å; Q1226-M1228 VanDerWaalsContact C-N 3.34Å; Q1226-M1228 PolarHBondContact O-N 3.18Å; Q1226-T1229 PolarHBondContact O-N 3.2Å; Q1226-I1230 HydrophobicContact CB-CD1 4.42Å; Q1226-I1230 HydrophobicContact CG-CD1 3.85Å; Q1226-I1230 HydrophobicContact CG-CG1 4.32Å; Q1226-I1230 WeakPolarHBondContact O-CA 3.28Å; Q1226-I1230 VanDerWaalsContact O-CB 3.27Å; Q1226-I1230 WeakPolarHBondContact O-CB 3.35Å; Q1226-I1230 WeakPolarHBondContact O-CD1 3.38Å; Q1226-I1230 VanDerWaalsContact O-CG1 3.24Å; Q1226-I1230 WeakPolarHBondContact O-CG1 3.33Å; Q1226-I1230 PolarHBondContact O-N 3.06Å
1227	F	70.6	Confident	64.4	Low	52.2 Å²	52.2	57.5 Å²	57.5	23%	0.229	30%	0.297	C	S	.	.	H	α-helix	trans	-59.3	-45.8	174	178.7	-100.4	0	0	0	112	E1181 I1184 V1223 M1224 T1229 I1230 K1231	E1181-F1227 HydrophobicContact CB-CE1 4.43Å; E1181-F1227 HydrophobicContact CB-CZ 4.21Å; E1181-F1227 HydrophobicContact CG-CD1 4.49Å; E1181-F1227 HydrophobicContact CG-CE1 3.88Å; E1181-F1227 HydrophobicContact CG-CE2 4.18Å; E1181-F1227 HydrophobicContact CG-CZ 3.69Å; I1184-F1227 HydrophobicContact CB-CE1 4.41Å; I1184-F1227 HydrophobicContact CD1-CD1 4.36Å; I1184-F1227 HydrophobicContact CD1-CE1 4Å; V1223-F1227 WeakPolarHBondContact O-CB 3.24Å; V1223-F1227 PolarHBondContact O-N 3.1Å; M1224-F1227 HydrophobicContact CE-CD1 4.06Å; M1224-F1227 HydrophobicContact CE-CE1 4.31Å; M1224-F1227 WeakPolarHBondContact O-CB 3.46Å; M1224-F1227 PolarHBondContact O-N 3.31Å; M1224-F1227 HydrophobicContact SD-CD1 4.27Å; F1227-T1229 PolarHBondContact O-N 3.26Å; F1227-I1230 PolarHBondContact O-N 3.34Å; F1227-K1231 HydrophobicContact CE1-CD 4.21Å; F1227-K1231 HydrophobicContact CE2-CD 4.26Å; F1227-K1231 HydrophobicContact CZ-CD 4.07Å; F1227-K1231 VanDerWaalsContact CZ-CE 3.49Å; F1227-K1231 PolarHBondContact O-N 3.2Å
1228	M	69.9	Low	62.9	Low	6.2 Å²	6.2	62.9 Å²	62.9	3%	0.031	32%	0.321	C	S	.	.	H	α-helix	trans	-63.4	-44.9	175.5	-66.5	173.5	91.4	0	0	111.7	L1180 I1184 L1198 T1201 K1202 F1205 M1224 Q1226 K1231 E1232	L1180-M1228 HydrophobicContact CD2-CE 3.99Å; L1180-M1228 HydrophobicContact CD2-CG 4.19Å; L1180-M1228 HydrophobicContact CD2-SD 3.87Å; I1184-M1228 HydrophobicContact CD1-CG 4.25Å; L1198-M1228 HydrophobicContact CB-CE 3.89Å; L1198-M1228 HydrophobicContact CD2-CE 3.88Å; L1198-M1228 HydrophobicContact CG-CE 4.42Å; L1198-M1228 WeakPolarHBondContact O-CE 3.27Å; T1201-M1228 HydrophobicContact CG2-CE 4.17Å; T1201-M1228 HydrophobicContact CG2-SD 4.44Å; K1202-M1228 HydrophobicContact CB-CE 4.06Å; K1202-M1228 HydrophobicContact CB-SD 4.32Å; F1205-M1228 HydrophobicContact CD2-CE 4.45Å; F1205-M1228 HydrophobicContact CD2-SD 4.12Å; F1205-M1228 HydrophobicContact CE2-CE 3.82Å; F1205-M1228 HydrophobicContact CE2-SD 3.91Å; M1224-M1228 HydrophobicContact CG-SD 4.21Å; M1224-M1228 WeakPolarHBondContact O-CB 3.2Å; M1224-M1228 VanDerWaalsContact O-CG 3.27Å; M1224-M1228 WeakPolarHBondContact O-CG 3.27Å; M1224-M1228 PolarHBondContact O-N 3.27Å; Q1226-M1228 VanDerWaalsContact C-N 3.34Å; Q1226-M1228 PolarHBondContact O-N 3.18Å; M1228-K1231 PolarHBondContact O-N 3.07Å; M1228-K1231 VanDerWaalsContact O-N 3.16Å; M1228-E1232 WeakPolarHBondContact O-CG 3.43Å; M1228-E1232 PolarHBondContact O-N 3Å
1229	T	67.8	Low	61.3	Low	48.6 Å²	48.6	64.7 Å²	64.7	30%	0.298	34%	0.337	S	S	.	.	H	α-helix	trans	-70.1	-35.6	-179.9	-51.3	0	0	0	0	112.4	K1202 M1225 Q1226 F1227 K1231 E1232 V1233	K1202-T1229 VanDerWaalsContact CE-OG1 3.27Å; K1202-T1229 WeakPolarHBondContact CE-OG1 3.34Å; K1202-T1229 PolarHBondContact NZ-OG1 3.16Å; M1225-T1229 VanDerWaalsContact O-CB 3.26Å; M1225-T1229 WeakPolarHBondContact O-CB 3.42Å; M1225-T1229 PolarHBondContact O-N 3.3Å; M1225-T1229 PolarHBondContact O-OG1 3.02Å; Q1226-T1229 PolarHBondContact O-N 3.2Å; F1227-T1229 PolarHBondContact O-N 3.26Å; T1229-K1231 VanDerWaalsContact C-N 3.28Å; T1229-K1231 PolarHBondContact O-N 3.19Å; T1229-E1232 WeakPolarHBondContact CA-OE2 3.38Å; T1229-E1232 PolarHBondContact O-N 3.13Å; T1229-V1233 HydrophobicContact CG2-CG2 4.24Å; T1229-V1233 WeakPolarHBondContact O-CB 3.34Å; T1229-V1233 VanDerWaalsContact O-CG2 3.28Å; T1229-V1233 WeakPolarHBondContact O-CG2 3.29Å; T1229-V1233 PolarHBondContact O-N 3.14Å
1230	I	60.4	Low	59.5	Low	83 Å²	83	67.8 Å²	67.8	43%	0.426	35%	0.345	S	S	.	.	H	α-helix	trans	-62.5	-39.9	173	-74.2	166.4	0	0	0	109.6	Q1226 F1227 V1233 M1234	Q1226-I1230 HydrophobicContact CB-CD1 4.42Å; Q1226-I1230 HydrophobicContact CG-CD1 3.85Å; Q1226-I1230 HydrophobicContact CG-CG1 4.32Å; Q1226-I1230 WeakPolarHBondContact O-CA 3.28Å; Q1226-I1230 VanDerWaalsContact O-CB 3.27Å; Q1226-I1230 WeakPolarHBondContact O-CB 3.35Å; Q1226-I1230 WeakPolarHBondContact O-CD1 3.38Å; Q1226-I1230 VanDerWaalsContact O-CG1 3.24Å; Q1226-I1230 WeakPolarHBondContact O-CG1 3.33Å; Q1226-I1230 PolarHBondContact O-N 3.06Å; F1227-I1230 PolarHBondContact O-N 3.34Å; I1230-V1233 PolarHBondContact O-N 3.18Å; I1230-M1234 HydrophobicContact CG2-CG 4.35Å; I1230-M1234 HydrophobicContact CG2-SD 3.87Å; I1230-M1234 WeakPolarHBondContact O-CA 3.46Å; I1230-M1234 VanDerWaalsContact O-CB 3.25Å; I1230-M1234 WeakPolarHBondContact O-CB 3.46Å; I1230-M1234 VanDerWaalsContact O-CG 3.3Å; I1230-M1234 WeakPolarHBondContact O-CG 3.38Å; I1230-M1234 PolarHBondContact O-N 3.08Å
1231	K	57	Low	57.9	Low	31.8 Å²	31.8	69.7 Å²	69.7	14%	0.138	36%	0.358	C	S	.	.	H	α-helix	trans	-70.1	-43.7	175.2	-81.1	-167.1	169.5	-163.3	0	113.3	I1184 N1185 F1227 M1228 T1229 V1233 M1234 E1235	I1184-K1231 VanDerWaalsContact C-NZ 3.3Å; I1184-K1231 HydrophobicContact CB-CD 4.26Å; I1184-K1231 HydrophobicContact CD1-CD 4.45Å; I1184-K1231 HydrophobicContact CG2-CB 4.22Å; I1184-K1231 HydrophobicContact CG2-CD 3.42Å; I1184-K1231 VanDerWaalsContact CG2-CD 3.42Å; I1184-K1231 HydrophobicContact CG2-CG 4.49Å; I1184-K1231 PolarHBondContact O-NZ 2.77Å; N1185-K1231 PolarHBondContact OD1-NZ 2.97Å; F1227-K1231 HydrophobicContact CE1-CD 4.21Å; F1227-K1231 HydrophobicContact CE2-CD 4.26Å; F1227-K1231 HydrophobicContact CZ-CD 4.07Å; F1227-K1231 VanDerWaalsContact CZ-CE 3.49Å; F1227-K1231 PolarHBondContact O-N 3.2Å; M1228-K1231 PolarHBondContact O-N 3.07Å; M1228-K1231 VanDerWaalsContact O-N 3.16Å; T1229-K1231 VanDerWaalsContact C-N 3.28Å; T1229-K1231 PolarHBondContact O-N 3.19Å; K1231-V1233 VanDerWaalsContact C-N 3.3Å; K1231-V1233 PolarHBondContact O-N 3.25Å; K1231-M1234 CarbonylContact O-C 3.54Å; K1231-M1234 PolarHBondContact O-N 3.02Å; K1231-M1234 VanDerWaalsContact O-N 3.15Å; K1231-E1235 IonicContact NZ-OE1 2.74Å; K1231-E1235 PolarHBondContact NZ-OE1 3.47Å; K1231-E1235 VanDerWaalsContact O-CB 3.31Å; K1231-E1235 WeakPolarHBondContact O-CB 3.38Å; K1231-E1235 VanDerWaalsContact O-CG 3.29Å; K1231-E1235 WeakPolarHBondContact O-CG 3.29Å; K1231-E1235 PolarHBondContact O-N 3.04Å
1232	E	56	Low	56.4	Low	60.4 Å²	60.4	73.9 Å²	73.9	28%	0.282	39%	0.385	S	S	.	.	H	α-helix	trans	-54.8	-46.2	171.9	-71.4	167	161.4	0	0	111	K1202 M1228 T1229 M1234 E1235 E1236	K1202-E1232 WeakPolarHBondContact CD-OE1 3.2Å; K1202-E1232 IonicContact NZ-OE1 3.11Å; K1202-E1232 PolarHBondContact NZ-OE1 3.07Å; K1202-E1232 IonicContact NZ-OE2 3.14Å; K1202-E1232 PolarHBondContact NZ-OE2 3.12Å; M1228-E1232 WeakPolarHBondContact O-CG 3.43Å; M1228-E1232 PolarHBondContact O-N 3Å; T1229-E1232 WeakPolarHBondContact CA-OE2 3.38Å; T1229-E1232 PolarHBondContact O-N 3.13Å; E1232-M1234 PolarHBondContact O-N 2.94Å; E1232-E1235 PolarHBondContact O-N 3.23Å; E1232-E1236 VanDerWaalsContact O-CB 3.27Å; E1232-E1236 WeakPolarHBondContact O-CB 3.38Å; E1232-E1236 VanDerWaalsContact O-CG 3.23Å; E1232-E1236 WeakPolarHBondContact O-CG 3.33Å; E1232-E1236 PolarHBondContact O-N 3.16Å
1233	V	50.1	Low	55.4	Low	79 Å²	79	76.2 Å²	76.2	48%	0.479	39%	0.392	S	S	.	.	H	α-helix	trans	-70.6	-34.6	179.1	171.3	0	0	0	0	112.6	T1229 I1230 K1231 E1235 E1236 S1237	T1229-V1233 HydrophobicContact CG2-CG2 4.24Å; T1229-V1233 WeakPolarHBondContact O-CB 3.34Å; T1229-V1233 VanDerWaalsContact O-CG2 3.28Å; T1229-V1233 WeakPolarHBondContact O-CG2 3.29Å; T1229-V1233 PolarHBondContact O-N 3.14Å; I1230-V1233 PolarHBondContact O-N 3.18Å; K1231-V1233 VanDerWaalsContact C-N 3.3Å; K1231-V1233 PolarHBondContact O-N 3.25Å; V1233-E1235 VanDerWaalsContact C-N 3.34Å; V1233-E1236 CarbonylContact O-C 3.53Å; V1233-E1236 WeakPolarHBondContact O-CA 3.44Å; V1233-E1236 PolarHBondContact O-N 3.2Å; V1233-S1237 VanDerWaalsContact O-CB 3.29Å; V1233-S1237 WeakPolarHBondContact O-CB 3.38Å; V1233-S1237 PolarHBondContact O-N 3.11Å; V1233-S1237 PolarHBondContact O-OG 3.36Å
1234	M	47.6	Very low	54.9	Low	89.2 Å²	89.2	80.1 Å²	80.1	44%	0.439	40%	0.399	S	S	.	.	H	α-helix	trans	-70.9	-36.9	173.3	-75.8	-179	70.6	0	0	111.8	M1155 I1230 K1231 E1232 E1236 S1237 E1238	M1155-M1234 HydrophobicContact CE-CE 4.47Å; I1230-M1234 HydrophobicContact CG2-CG 4.35Å; I1230-M1234 HydrophobicContact CG2-SD 3.87Å; I1230-M1234 WeakPolarHBondContact O-CA 3.46Å; I1230-M1234 VanDerWaalsContact O-CB 3.25Å; I1230-M1234 WeakPolarHBondContact O-CB 3.46Å; I1230-M1234 VanDerWaalsContact O-CG 3.3Å; I1230-M1234 WeakPolarHBondContact O-CG 3.38Å; I1230-M1234 PolarHBondContact O-N 3.08Å; K1231-M1234 CarbonylContact O-C 3.54Å; K1231-M1234 PolarHBondContact O-N 3.02Å; K1231-M1234 VanDerWaalsContact O-N 3.15Å; E1232-M1234 PolarHBondContact O-N 2.94Å; M1234-E1236 VanDerWaalsContact C-N 3.32Å; M1234-S1237 WeakPolarHBondContact CA-OG 3.28Å; M1234-S1237 CarbonylContact O-C 3.57Å; M1234-S1237 VanDerWaalsContact O-C 3.27Å; M1234-S1237 WeakPolarHBondContact O-CA 3.38Å; M1234-S1237 WeakPolarHBondContact O-CB 3.31Å; M1234-S1237 PolarHBondContact O-N 3.05Å; M1234-S1237 VanDerWaalsContact O-N 3.11Å; M1234-S1237 PolarHBondContact O-OG 3.14Å; M1234-E1238 WeakPolarHBondContact CE-OE1 3.4Å; M1234-E1238 WeakPolarHBondContact O-CB 3.37Å; M1234-E1238 PolarHBondContact O-N 3.31Å
1235	E	44.5	Very low	55	Low	46.4 Å²	46.4	82 Å²	82	22%	0.217	41%	0.409	C	S	.	.	H	α-helix	trans	-73.3	-36	176.2	-71.1	172.8	167.5	0	0	111.1	R1189 K1231 E1232 V1233 S1237 E1238 V1239 Y1240	R1189-E1235 WeakPolarHBondContact CA-OE1 3.44Å; R1189-E1235 VanDerWaalsContact CG-OE1 3.24Å; R1189-E1235 WeakPolarHBondContact CG-OE1 3.46Å; R1189-E1235 PolarHBondContact N-OE1 2.94Å; K1231-E1235 IonicContact NZ-OE1 2.74Å; K1231-E1235 PolarHBondContact NZ-OE1 3.47Å; K1231-E1235 VanDerWaalsContact O-CB 3.31Å; K1231-E1235 WeakPolarHBondContact O-CB 3.38Å; K1231-E1235 VanDerWaalsContact O-CG 3.29Å; K1231-E1235 WeakPolarHBondContact O-CG 3.29Å; K1231-E1235 PolarHBondContact O-N 3.04Å; E1232-E1235 PolarHBondContact O-N 3.23Å; V1233-E1235 VanDerWaalsContact C-N 3.34Å; E1235-S1237 VanDerWaalsContact C-N 3.31Å; E1235-S1237 PolarHBondContact O-N 2.98Å; E1235-E1238 PolarHBondContact O-N 3.08Å; E1235-E1238 VanDerWaalsContact O-N 3.09Å; E1235-V1239 HydrophobicContact CB-CG2 3.96Å; E1235-V1239 HydrophobicContact CG-CG2 4.32Å; E1235-V1239 CarbonylContact O-C 3.54Å; E1235-V1239 WeakPolarHBondContact O-CA 3.4Å; E1235-V1239 VanDerWaalsContact O-CB 3.24Å; E1235-V1239 WeakPolarHBondContact O-CB 3.34Å; E1235-V1239 VanDerWaalsContact O-CG2 3.28Å; E1235-V1239 WeakPolarHBondContact O-CG2 3.39Å; E1235-V1239 PolarHBondContact O-N 3.24Å; E1235-Y1240 PolarHBondContact O-N 3.11Å
1236	E	38.6	Very low	55.1	Low	138.8 Å²	138.8	80.5 Å²	80.5	65%	0.649	40%	0.403	S	S	*	.	H	α-helix	trans	-63.2	-26.9	165.1	-75.1	-172.4	163.9	0	0	112.6	E1232 V1233 M1234 Y1240	E1232-E1236 VanDerWaalsContact O-CB 3.27Å; E1232-E1236 WeakPolarHBondContact O-CB 3.38Å; E1232-E1236 VanDerWaalsContact O-CG 3.23Å; E1232-E1236 WeakPolarHBondContact O-CG 3.33Å; E1232-E1236 PolarHBondContact O-N 3.16Å; V1233-E1236 CarbonylContact O-C 3.53Å; V1233-E1236 WeakPolarHBondContact O-CA 3.44Å; V1233-E1236 PolarHBondContact O-N 3.2Å; M1234-E1236 VanDerWaalsContact C-N 3.32Å; E1236-Y1240 CarbonylContact C-O 3.47Å; E1236-Y1240 CarbonylContact O-C 3.55Å; E1236-Y1240 VanDerWaalsContact O-CA 3.26Å; E1236-Y1240 WeakPolarHBondContact O-CA 3.21Å; E1236-Y1240 VanDerWaalsContact O-CB 3.32Å; E1236-Y1240 WeakPolarHBondContact O-CB 3.29Å; E1236-Y1240 PolarHBondContact O-N 3.32Å
1237	S	38.1	Very low	55.2	Low	64.8 Å²	64.8	79.2 Å²	79.2	45%	0.453	40%	0.399	S	S	.	.	H	α-helix	trans	-87.7	-24	176.7	-20.1	0	0	0	0	114.3	V1233 M1234 E1235 Y1240 N1241	V1233-S1237 VanDerWaalsContact O-CB 3.29Å; V1233-S1237 WeakPolarHBondContact O-CB 3.38Å; V1233-S1237 PolarHBondContact O-N 3.11Å; V1233-S1237 PolarHBondContact O-OG 3.36Å; M1234-S1237 WeakPolarHBondContact CA-OG 3.28Å; M1234-S1237 CarbonylContact O-C 3.57Å; M1234-S1237 VanDerWaalsContact O-C 3.27Å; M1234-S1237 WeakPolarHBondContact O-CA 3.38Å; M1234-S1237 WeakPolarHBondContact O-CB 3.31Å; M1234-S1237 PolarHBondContact O-N 3.05Å; M1234-S1237 VanDerWaalsContact O-N 3.11Å; M1234-S1237 PolarHBondContact O-OG 3.14Å; E1235-S1237 VanDerWaalsContact C-N 3.31Å; E1235-S1237 PolarHBondContact O-N 2.98Å; S1237-Y1240 CarbonylContact C-O 3.44Å; S1237-Y1240 WeakPolarHBondContact CA-O 3.27Å; S1237-Y1240 PolarHBondContact N-O 2.78Å; S1237-N1241 VanDerWaalsContact O-CA 3.25Å; S1237-N1241 WeakPolarHBondContact O-CA 3.36Å; S1237-N1241 VanDerWaalsContact O-CB 3.3Å; S1237-N1241 WeakPolarHBondContact O-CB 3.44Å; S1237-N1241 PolarHBondContact O-N 2.93Å; S1237-N1241 PolarHBondContact O-ND2 3.27Å
1238	E	39.4	Very low	55.8	Low	129.6 Å²	129.6	78.9 Å²	78.9	61%	0.606	40%	0.399	S	S	*	.	H	α-helix	trans	-97.1	-30.6	177.3	-71.5	-169.8	173.3	0	0	113	R1189 M1234 E1235	R1189-E1238 IonicContact CZ-OE2 2.84Å; R1189-E1238 IonicContact NE-OE2 2.89Å; R1189-E1238 PolarHBondContact NE-OE2 3.21Å; R1189-E1238 VanDerWaalsContact NE-OE2 3.09Å; R1189-E1238 VanDerWaalsContact NH2-CD 3.33Å; R1189-E1238 IonicContact NH2-OE1 3.3Å; R1189-E1238 PolarHBondContact NH2-OE1 2.83Å; R1189-E1238 IonicContact NH2-OE2 3.36Å; R1189-E1238 PolarHBondContact NH2-OE2 3.32Å; M1234-E1238 WeakPolarHBondContact CE-OE1 3.4Å; M1234-E1238 WeakPolarHBondContact O-CB 3.37Å; M1234-E1238 PolarHBondContact O-N 3.31Å; E1235-E1238 PolarHBondContact O-N 3.08Å; E1235-E1238 VanDerWaalsContact O-N 3.09Å
1239	V	43.5	Very low	56.6	Low	105.4 Å²	105.4	78.8 Å²	78.8	64%	0.639	40%	0.398	S	S	*	.	H	α-helix	trans	-94.7	-30.5	-178.6	-177.6	0	0	0	0	112.3	E1235	E1235-V1239 HydrophobicContact CB-CG2 3.96Å; E1235-V1239 HydrophobicContact CG-CG2 4.32Å; E1235-V1239 CarbonylContact O-C 3.54Å; E1235-V1239 WeakPolarHBondContact O-CA 3.4Å; E1235-V1239 VanDerWaalsContact O-CB 3.24Å; E1235-V1239 WeakPolarHBondContact O-CB 3.34Å; E1235-V1239 VanDerWaalsContact O-CG2 3.28Å; E1235-V1239 WeakPolarHBondContact O-CG2 3.39Å; E1235-V1239 PolarHBondContact O-N 3.24Å
1240	Y	37.4	Very low	57.3	Low	186.4 Å²	186.4	79 Å²	79	73%	0.731	40%	0.395	S	S	*	.			trans	-117.9	64.5	173.5	-112.7	-88.5	0	0	0	111.7	E1235 E1236 S1237 P1242	E1235-Y1240 PolarHBondContact O-N 3.11Å; E1236-Y1240 CarbonylContact C-O 3.47Å; E1236-Y1240 CarbonylContact O-C 3.55Å; E1236-Y1240 VanDerWaalsContact O-CA 3.26Å; E1236-Y1240 WeakPolarHBondContact O-CA 3.21Å; E1236-Y1240 VanDerWaalsContact O-CB 3.32Å; E1236-Y1240 WeakPolarHBondContact O-CB 3.29Å; E1236-Y1240 PolarHBondContact O-N 3.32Å; S1237-Y1240 CarbonylContact C-O 3.44Å; S1237-Y1240 WeakPolarHBondContact CA-O 3.27Å; S1237-Y1240 PolarHBondContact N-O 2.78Å; Y1240-P1242 VanDerWaalsContact C-CD 3.45Å; Y1240-P1242 WeakPolarHBondContact O-CA 3.27Å; Y1240-P1242 VanDerWaalsContact O-CD 3.3Å; Y1240-P1242 WeakPolarHBondContact O-CD 3.3Å
1241	N	40.5	Very low	58.4	Low	74.8 Å²	74.8	80.3 Å²	80.3	40%	0.4	40%	0.399	S	S	.	.			trans	-59.5	105.9	171.5	-158.6	-19.8	0	0	0	110.6	S1237 D1243 R1244 D1247	S1237-N1241 VanDerWaalsContact O-CA 3.25Å; S1237-N1241 WeakPolarHBondContact O-CA 3.36Å; S1237-N1241 VanDerWaalsContact O-CB 3.3Å; S1237-N1241 WeakPolarHBondContact O-CB 3.44Å; S1237-N1241 PolarHBondContact O-N 2.93Å; S1237-N1241 PolarHBondContact O-ND2 3.27Å; N1241-D1243 VanDerWaalsContact C-N 3.27Å; N1241-D1243 PolarHBondContact O-N 3.27Å; N1241-D1243 VanDerWaalsContact O-N 3.12Å; N1241-D1243 PolarHBondContact OD1-N 3.04Å; N1241-R1244 HydrophobicContact CB-CB 3.98Å; N1241-R1244 HydrophobicContact CB-CG 3.9Å; N1241-R1244 VanDerWaalsContact O-CB 3.24Å; N1241-R1244 WeakPolarHBondContact O-CB 3.25Å; N1241-R1244 PolarHBondContact O-N 3.05Å; N1241-R1244 VanDerWaalsContact O-N 3.15Å; N1241-R1244 PolarHBondContact OD1-N 3.3Å; N1241-D1247 PolarHBondContact ND2-OD2 3.09Å
1242	P	46.4	Very low	59.8	Low	89.2 Å²	89.2	79.1 Å²	79.1	58%	0.579	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-18.1	-173.7	28.3	-35.6	0	0	0	112.5	Y1240 G1246	Y1240-P1242 VanDerWaalsContact C-CD 3.45Å; Y1240-P1242 WeakPolarHBondContact O-CA 3.27Å; Y1240-P1242 VanDerWaalsContact O-CD 3.3Å; Y1240-P1242 WeakPolarHBondContact O-CD 3.3Å; P1242-G1246 PolarHBondContact O-N 3.29Å
1243	D	56.4	Low	61.2	Low	86.8 Å²	86.8	77.4 Å²	77.4	46%	0.464	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91	-3.8	176.3	-88.8	-29.9	0	0	0	112.8	N1241 L1245 G1246 D1247 K1286	N1241-D1243 VanDerWaalsContact C-N 3.27Å; N1241-D1243 PolarHBondContact O-N 3.27Å; N1241-D1243 VanDerWaalsContact O-N 3.12Å; N1241-D1243 PolarHBondContact OD1-N 3.04Å; D1243-L1245 VanDerWaalsContact C-N 3.29Å; D1243-L1245 PolarHBondContact O-N 3.06Å; D1243-L1245 VanDerWaalsContact O-N 3.12Å; D1243-G1246 CarbonylContact O-C 3.53Å; D1243-G1246 VanDerWaalsContact O-CA 3.23Å; D1243-G1246 WeakPolarHBondContact O-CA 3.28Å; D1243-G1246 PolarHBondContact O-N 3.15Å; D1243-D1247 VanDerWaalsContact O-CG 3.31Å; D1243-D1247 PolarHBondContact O-N 3.01Å; D1243-K1286 IonicContact OD2-NZ 2.79Å; D1243-K1286 PolarHBondContact OD2-NZ 3.43Å
1244	R	65.1	Low	62.8	Low	151.6 Å²	151.6	77.5 Å²	77.5	57%	0.572	38%	0.384	S	S	*	.	H	α-helix	trans	-53.3	-37.9	176.9	-164.4	179.7	166.7	163.3	3.8	113.4	N1241 G1246 D1247 E1248 E1564	N1241-R1244 HydrophobicContact CB-CB 3.98Å; N1241-R1244 HydrophobicContact CB-CG 3.9Å; N1241-R1244 VanDerWaalsContact O-CB 3.24Å; N1241-R1244 WeakPolarHBondContact O-CB 3.25Å; N1241-R1244 PolarHBondContact O-N 3.05Å; N1241-R1244 VanDerWaalsContact O-N 3.15Å; N1241-R1244 PolarHBondContact OD1-N 3.3Å; R1244-G1246 VanDerWaalsContact C-N 3.3Å; R1244-G1246 PolarHBondContact O-N 3.24Å; R1244-D1247 PolarHBondContact O-N 3.14Å; R1244-E1248 HydrophobicContact CG-CG 4.44Å; R1244-E1248 IonicContact CZ-OE1 2.83Å; R1244-E1248 IonicContact NE-OE1 2.96Å; R1244-E1248 PolarHBondContact NE-OE1 3.21Å; R1244-E1248 IonicContact NH2-OE1 3.33Å; R1244-E1248 PolarHBondContact NH2-OE1 3.18Å; R1244-E1248 WeakPolarHBondContact O-CB 3.36Å; R1244-E1248 WeakPolarHBondContact O-CG 3.33Å; R1244-E1248 PolarHBondContact O-N 3.18Å; R1244-E1564 IonicContact CZ-OE2 2.72Å; R1244-E1564 IonicContact NH1-OE2 2.76Å; R1244-E1564 IonicContact NH2-OE2 2.96Å; R1244-E1564 PolarHBondContact NH2-OE2 3Å
1245	L	76.4	Confident	64.5	Low	46.4 Å²	46.4	75.6 Å²	75.6	24%	0.243	37%	0.374	C	S	.	.	H	α-helix	trans	-69.5	-28.5	174.3	-176.2	67.9	0	0	0	112.4	D1243 Y1249 K1398 K1401 H1402 V1405	D1243-L1245 VanDerWaalsContact C-N 3.29Å; D1243-L1245 PolarHBondContact O-N 3.06Å; D1243-L1245 VanDerWaalsContact O-N 3.12Å; L1245-Y1249 WeakPolarHBondContact O-CB 3.34Å; L1245-Y1249 PolarHBondContact O-N 3.21Å; L1245-Y1249 VanDerWaalsContact O-N 3.14Å; L1245-K1398 HydrophobicContact CD2-CB 4.47Å; L1245-K1401 HydrophobicContact CD2-CB 4.18Å; L1245-K1401 HydrophobicContact CG-CB 4.23Å; L1245-H1402 HydrophobicContact CD1-CB 4.47Å; L1245-H1402 HydrophobicContact CD2-CB 4.29Å; L1245-V1405 HydrophobicContact CD1-CB 4.41Å; L1245-V1405 HydrophobicContact CD1-CG2 4.1Å
1246	G	78.1	Confident	66.5	Low	4 Å²	4	73.5 Å²	73.5	4%	0.041	37%	0.365	C	S	.	.	H	α-helix	trans	-70.5	-44.9	170.1	0	0	0	0	0	112.3	P1242 D1243 R1244 Y1249 F1250	P1242-G1246 PolarHBondContact O-N 3.29Å; D1243-G1246 CarbonylContact O-C 3.53Å; D1243-G1246 VanDerWaalsContact O-CA 3.23Å; D1243-G1246 WeakPolarHBondContact O-CA 3.28Å; D1243-G1246 PolarHBondContact O-N 3.15Å; R1244-G1246 VanDerWaalsContact C-N 3.3Å; R1244-G1246 PolarHBondContact O-N 3.24Å; G1246-Y1249 CarbonylContact O-C 3.39Å; G1246-Y1249 WeakPolarHBondContact O-CB 3.35Å; G1246-Y1249 PolarHBondContact O-N 2.87Å; G1246-F1250 WeakPolarHBondContact O-CB 3.28Å; G1246-F1250 WeakPolarHBondContact O-CD2 3.3Å; G1246-F1250 WeakPolarHBondContact O-CG 3.28Å; G1246-F1250 PolarHBondContact O-N 3.15Å
1247	D	76.3	Confident	68.5	Low	88 Å²	88	67.8 Å²	67.8	47%	0.471	34%	0.341	S	S	.	.	H	α-helix	trans	-65.3	-48.9	178.4	-63.7	-33.1	0	0	0	111.4	N1241 D1243 R1244 Y1249 F1250 E1251	N1241-D1247 PolarHBondContact ND2-OD2 3.09Å; D1243-D1247 VanDerWaalsContact O-CG 3.31Å; D1243-D1247 PolarHBondContact O-N 3.01Å; R1244-D1247 PolarHBondContact O-N 3.14Å; D1247-Y1249 VanDerWaalsContact C-N 3.26Å; D1247-Y1249 PolarHBondContact O-N 3.1Å; D1247-F1250 PolarHBondContact O-N 3.07Å; D1247-F1250 VanDerWaalsContact O-N 3.15Å; D1247-E1251 WeakPolarHBondContact O-CB 3.31Å; D1247-E1251 PolarHBondContact O-N 3.02Å
1248	E	81.7	Confident	70.5	Confident	46.6 Å²	46.6	67.8 Å²	67.8	22%	0.218	34%	0.341	C	S	.	.	H	α-helix	trans	-58	-37.2	172.3	-74.6	-168.1	-171.4	0	0	111.6	R1244 L1252 V1405 K1409	R1244-E1248 HydrophobicContact CG-CG 4.44Å; R1244-E1248 IonicContact CZ-OE1 2.83Å; R1244-E1248 IonicContact NE-OE1 2.96Å; R1244-E1248 PolarHBondContact NE-OE1 3.21Å; R1244-E1248 IonicContact NH2-OE1 3.33Å; R1244-E1248 PolarHBondContact NH2-OE1 3.18Å; R1244-E1248 WeakPolarHBondContact O-CB 3.36Å; R1244-E1248 WeakPolarHBondContact O-CG 3.33Å; R1244-E1248 PolarHBondContact O-N 3.18Å; E1248-L1252 VanDerWaalsContact O-CB 3.25Å; E1248-L1252 WeakPolarHBondContact O-CB 3.3Å; E1248-L1252 VanDerWaalsContact O-CD1 3.28Å; E1248-L1252 WeakPolarHBondContact O-CD1 3.37Å; E1248-L1252 VanDerWaalsContact O-CG 3.27Å; E1248-L1252 WeakPolarHBondContact O-CG 3.3Å; E1248-L1252 PolarHBondContact O-N 2.94Å; E1248-L1252 VanDerWaalsContact O-N 3.15Å; E1248-V1405 HydrophobicContact CB-CG1 4.46Å; E1248-V1405 HydrophobicContact CB-CG2 4.3Å; E1248-V1405 WeakPolarHBondContact OE2-CG1 3.37Å; E1248-K1409 WeakPolarHBondContact OE1-CE 3.31Å; E1248-K1409 IonicContact OE1-NZ 3.03Å; E1248-K1409 PolarHBondContact OE1-NZ 2.86Å; E1248-K1409 WeakPolarHBondContact OE2-CE 3.22Å; E1248-K1409 IonicContact OE2-NZ 3.22Å; E1248-K1409 PolarHBondContact OE2-NZ 3.36Å
1249	Y	86.2	Confident	72.4	Confident	3.4 Å²	3.4	63 Å²	63	1%	0.013	33%	0.326	C	S	.	.	H	α-helix	trans	-65.8	-47.6	175.2	167.6	-91	0	0	0	112.1	L1245 G1246 D1247 L1252 Q1253 I1278 K1401 Y1404	L1245-Y1249 WeakPolarHBondContact O-CB 3.34Å; L1245-Y1249 PolarHBondContact O-N 3.21Å; L1245-Y1249 VanDerWaalsContact O-N 3.14Å; G1246-Y1249 CarbonylContact O-C 3.39Å; G1246-Y1249 WeakPolarHBondContact O-CB 3.35Å; G1246-Y1249 PolarHBondContact O-N 2.87Å; D1247-Y1249 VanDerWaalsContact C-N 3.26Å; D1247-Y1249 PolarHBondContact O-N 3.1Å; Y1249-L1252 PolarHBondContact O-N 3.27Å; Y1249-Q1253 VanDerWaalsContact CE1-OE1 3.27Å; Y1249-Q1253 VanDerWaalsContact O-CB 3.25Å; Y1249-Q1253 WeakPolarHBondContact O-CB 3.32Å; Y1249-Q1253 PolarHBondContact O-N 2.9Å; Y1249-I1278 HydrophobicContact CD2-CD1 4.43Å; Y1249-I1278 HydrophobicContact CE2-CD1 3.7Å; Y1249-K1401 HydrophobicContact CD1-CG 4.45Å; Y1249-K1401 HydrophobicContact CD2-CB 4.34Å; Y1249-K1401 HydrophobicContact CD2-CG 3.98Å; Y1249-K1401 HydrophobicContact CE2-CG 4.37Å; Y1249-K1401 HydrophobicContact CG-CG 4.05Å; Y1249-Y1404 AromaticContact CD2-CD1 3.65Å; Y1249-Y1404 HydrophobicContact CD2-CD1 3.65Å; Y1249-Y1404 HydrophobicContact CD2-CD2 4.5Å; Y1249-Y1404 HydrophobicContact CD2-CE1 4.29Å; Y1249-Y1404 AromaticContact CD2-CG 3.79Å; Y1249-Y1404 HydrophobicContact CD2-CG 3.79Å; Y1249-Y1404 AromaticContact CE2-CD1 3.82Å; Y1249-Y1404 HydrophobicContact CE2-CD1 3.82Å; Y1249-Y1404 AromaticContact CE2-CD2 3.93Å; Y1249-Y1404 HydrophobicContact CE2-CD2 3.93Å; Y1249-Y1404 HydrophobicContact CE2-CE1 4.26Å; Y1249-Y1404 HydrophobicContact CE2-CE2 4.35Å; Y1249-Y1404 AromaticContact CE2-CG 3.65Å; Y1249-Y1404 HydrophobicContact CE2-CG 3.65Å
1250	F	83.1	Confident	74.1	Confident	53.6 Å²	53.6	61.2 Å²	61.2	24%	0.235	32%	0.318	C	S	.	.	H	α-helix	trans	-67.8	-39.2	-179.1	-73.5	-56.1	0	0	0	112.5	G1246 D1247 Q1253 D1254 R1287 Q1288 L1289 L1292	G1246-F1250 WeakPolarHBondContact O-CB 3.28Å; G1246-F1250 WeakPolarHBondContact O-CD2 3.3Å; G1246-F1250 WeakPolarHBondContact O-CG 3.28Å; G1246-F1250 PolarHBondContact O-N 3.15Å; D1247-F1250 PolarHBondContact O-N 3.07Å; D1247-F1250 VanDerWaalsContact O-N 3.15Å; F1250-Q1253 WeakPolarHBondContact O-CB 3.33Å; F1250-Q1253 PolarHBondContact O-N 3.23Å; F1250-D1254 PolarHBondContact O-N 3.14Å; F1250-D1254 VanDerWaalsContact O-N 3.09Å; F1250-R1287 HydrophobicContact CE1-CG 4.4Å; F1250-R1287 HydrophobicContact CZ-CG 4.26Å; F1250-Q1288 HydrophobicContact CE2-CB 4.48Å; F1250-Q1288 HydrophobicContact CZ-CB 3.98Å; F1250-L1289 HydrophobicContact CD1-CD2 4.27Å; F1250-L1289 HydrophobicContact CE1-CD2 4.01Å; F1250-L1289 HydrophobicContact CE1-CG 4.14Å; F1250-L1292 HydrophobicContact CB-CD1 4.34Å; F1250-L1292 HydrophobicContact CD1-CD1 3.88Å; F1250-L1292 HydrophobicContact CE1-CD1 4.4Å; F1250-L1292 HydrophobicContact CG-CD1 4.13Å
1251	E	83	Confident	76.5	Confident	110.4 Å²	110.4	52.6 Å²	52.6	52%	0.516	29%	0.285	S	S	.	.	H	α-helix	trans	-63.6	-47.6	175.8	-166.2	-164.9	159.7	0	0	110.8	D1247 Q1253 D1254 Q1255	D1247-E1251 WeakPolarHBondContact O-CB 3.31Å; D1247-E1251 PolarHBondContact O-N 3.02Å; E1251-Q1253 VanDerWaalsContact C-N 3.3Å; E1251-Q1253 PolarHBondContact O-N 3.09Å; E1251-D1254 PolarHBondContact O-N 3.01Å; E1251-D1254 VanDerWaalsContact O-N 3.11Å; E1251-Q1255 WeakPolarHBondContact O-CG 3.28Å; E1251-Q1255 PolarHBondContact O-N 3.01Å; E1251-Q1255 PolarHBondContact OE1-NE2 3.06Å
1252	L	86.4	Confident	78.6	Confident	6.6 Å²	6.6	49.5 Å²	49.5	4%	0.035	27%	0.269	C	S	.	.	H	α-helix	trans	-66.1	-32.5	177.8	-70.1	169.6	0	0	0	112.4	E1248 Y1249 Q1255 I1256 L1261 Y1404 V1405 C1408 F1414	E1248-L1252 VanDerWaalsContact O-CB 3.25Å; E1248-L1252 WeakPolarHBondContact O-CB 3.3Å; E1248-L1252 VanDerWaalsContact O-CD1 3.28Å; E1248-L1252 WeakPolarHBondContact O-CD1 3.37Å; E1248-L1252 VanDerWaalsContact O-CG 3.27Å; E1248-L1252 WeakPolarHBondContact O-CG 3.3Å; E1248-L1252 PolarHBondContact O-N 2.94Å; E1248-L1252 VanDerWaalsContact O-N 3.15Å; Y1249-L1252 PolarHBondContact O-N 3.27Å; L1252-Q1255 PolarHBondContact O-N 3.1Å; L1252-I1256 WeakPolarHBondContact O-CB 3.32Å; L1252-I1256 WeakPolarHBondContact O-CD1 3.4Å; L1252-I1256 VanDerWaalsContact O-CG1 3.31Å; L1252-I1256 WeakPolarHBondContact O-CG1 3.37Å; L1252-I1256 PolarHBondContact O-N 3.19Å; L1252-I1256 VanDerWaalsContact O-N 3.1Å; L1252-L1261 HydrophobicContact CD2-CD2 4.12Å; L1252-Y1404 HydrophobicContact CB-CE1 4.37Å; L1252-V1405 HydrophobicContact CD1-CB 4.33Å; L1252-V1405 HydrophobicContact CD1-CG1 4.03Å; L1252-V1405 HydrophobicContact CD1-CG2 4.19Å; L1252-C1408 HydrophobicContact CB-CB 4.32Å; L1252-C1408 HydrophobicContact CD1-CB 3.77Å; L1252-C1408 HydrophobicContact CD2-CB 4.05Å; L1252-C1408 HydrophobicContact CG-CB 4.27Å; L1252-F1414 HydrophobicContact CD1-CE2 4.37Å; L1252-F1414 HydrophobicContact CD2-CD2 4.29Å; L1252-F1414 HydrophobicContact CD2-CE2 3.85Å
1253	Q	86.7	Confident	80.5	Confident	23.8 Å²	23.8	45.4 Å²	45.4	11%	0.111	24%	0.242	C	C	.	.	H	α-helix	trans	-62.7	-45.2	172.7	-173.4	-176.5	9.9	0	0	111.4	Y1249 F1250 E1251 I1256 A1257 Q1275 L1289 Y1404	Y1249-Q1253 VanDerWaalsContact CE1-OE1 3.27Å; Y1249-Q1253 VanDerWaalsContact O-CB 3.25Å; Y1249-Q1253 WeakPolarHBondContact O-CB 3.32Å; Y1249-Q1253 PolarHBondContact O-N 2.9Å; F1250-Q1253 WeakPolarHBondContact O-CB 3.33Å; F1250-Q1253 PolarHBondContact O-N 3.23Å; E1251-Q1253 VanDerWaalsContact C-N 3.3Å; E1251-Q1253 PolarHBondContact O-N 3.09Å; Q1253-I1256 PolarHBondContact O-N 3.1Å; Q1253-A1257 VanDerWaalsContact O-CB 3.3Å; Q1253-A1257 WeakPolarHBondContact O-CB 3.36Å; Q1253-A1257 PolarHBondContact O-N 3.21Å; Q1253-Q1275 VanDerWaalsContact NE2-CD 3.3Å; Q1253-L1289 VanDerWaalsContact NE2-CD1 3.33Å; Q1253-L1289 VanDerWaalsContact NE2-CD2 3.33Å; Q1253-Y1404 WeakPolarHBondContact CA-OH 3.48Å; Q1253-Y1404 HydrophobicContact CB-CE1 4.41Å
1254	D	82.6	Confident	82	Confident	81.6 Å²	81.6	42 Å²	42	44%	0.436	23%	0.225	S	C	.	.	H	α-helix	trans	-69.1	-39.6	175.3	-167.2	56.8	0	0	0	112	F1250 E1251 I1256 A1257 S1258 R1296 R1299	F1250-D1254 PolarHBondContact O-N 3.14Å; F1250-D1254 VanDerWaalsContact O-N 3.09Å; E1251-D1254 PolarHBondContact O-N 3.01Å; E1251-D1254 VanDerWaalsContact O-N 3.11Å; D1254-I1256 VanDerWaalsContact C-N 3.27Å; D1254-I1256 PolarHBondContact O-N 3.08Å; D1254-A1257 PolarHBondContact O-N 3.09Å; D1254-S1258 WeakPolarHBondContact O-CB 3.26Å; D1254-S1258 PolarHBondContact O-N 3.12Å; D1254-S1258 PolarHBondContact O-OG 3.17Å; D1254-R1296 PolarHBondContact O-NH2 3.5Å; D1254-R1296 IonicContact OD1-CZ 2.65Å; D1254-R1296 IonicContact OD1-NE 3.61Å; D1254-R1296 PolarHBondContact OD1-NE 3.03Å; D1254-R1296 IonicContact OD1-NH1 3.93Å; D1254-R1296 PolarHBondContact OD1-NH1 3.23Å; D1254-R1296 IonicContact OD1-NH2 3.2Å; D1254-R1296 PolarHBondContact OD1-NH2 3.36Å; D1254-R1299 IonicContact OD2-CZ 3.01Å; D1254-R1299 IonicContact OD2-NH1 2.84Å; D1254-R1299 PolarHBondContact OD2-NH1 3.37Å; D1254-R1299 VanDerWaalsContact OD2-NH1 3.16Å
1255	Q	83.6	Confident	83.1	Confident	49.6 Å²	49.6	37.4 Å²	37.4	23%	0.232	21%	0.209	C	C	.	.	H	α-helix	trans	-59.9	-37.5	175.3	-71.1	-177.2	18.6	0	0	112.7	E1251 L1252 S1258 G1259 S1260 L1261	E1251-Q1255 WeakPolarHBondContact O-CG 3.28Å; E1251-Q1255 PolarHBondContact O-N 3.01Å; E1251-Q1255 PolarHBondContact OE1-NE2 3.06Å; L1252-Q1255 PolarHBondContact O-N 3.1Å; Q1255-S1258 WeakPolarHBondContact CA-OG 3.42Å; Q1255-S1258 PolarHBondContact O-OG 3.2Å; Q1255-S1258 VanDerWaalsContact O-OG 3.12Å; Q1255-G1259 PolarHBondContact O-N 3.05Å; Q1255-S1260 VanDerWaalsContact CA-OG 3.31Å; Q1255-S1260 WeakPolarHBondContact CA-OG 3.38Å; Q1255-S1260 PolarHBondContact O-N 2.92Å; Q1255-S1260 VanDerWaalsContact O-N 3.07Å; Q1255-S1260 PolarHBondContact O-OG 3.01Å; Q1255-S1260 VanDerWaalsContact O-OG 3.1Å; Q1255-L1261 HydrophobicContact CB-CB 3.99Å; Q1255-L1261 PolarHBondContact O-N 3.23Å; Q1255-L1261 VanDerWaalsContact O-N 3.11Å
1256	I	86.5	Confident	83.6	Confident	3 Å²	3	41.3 Å²	41.3	2%	0.015	23%	0.227	C	C	.	.	H	α-helix	trans	-75.7	-47.8	175.6	-70.4	164.5	0	0	0	111.2	L1252 Q1253 D1254 S1258 G1259 L1261 L1271 P1368 Y1404 C1408 L1411	L1252-I1256 WeakPolarHBondContact O-CB 3.32Å; L1252-I1256 WeakPolarHBondContact O-CD1 3.4Å; L1252-I1256 VanDerWaalsContact O-CG1 3.31Å; L1252-I1256 WeakPolarHBondContact O-CG1 3.37Å; L1252-I1256 PolarHBondContact O-N 3.19Å; L1252-I1256 VanDerWaalsContact O-N 3.1Å; Q1253-I1256 PolarHBondContact O-N 3.1Å; D1254-I1256 VanDerWaalsContact C-N 3.27Å; D1254-I1256 PolarHBondContact O-N 3.08Å; I1256-S1258 VanDerWaalsContact C-N 3.3Å; I1256-S1258 PolarHBondContact O-N 3.09Å; I1256-G1259 WeakPolarHBondContact O-CA 3.31Å; I1256-G1259 PolarHBondContact O-N 3.02Å; I1256-G1259 VanDerWaalsContact O-N 3.07Å; I1256-L1261 HydrophobicContact CD1-CD2 4.12Å; I1256-L1261 HydrophobicContact CG1-CB 4.03Å; I1256-L1261 HydrophobicContact CG1-CD2 4.27Å; I1256-L1261 HydrophobicContact CG1-CG 4.22Å; I1256-L1271 HydrophobicContact CD1-CD1 3.69Å; I1256-L1271 HydrophobicContact CD1-CD2 4.11Å; I1256-L1271 HydrophobicContact CD1-CG 4.4Å; I1256-L1271 HydrophobicContact CG1-CD1 4.48Å; I1256-P1368 HydrophobicContact CG2-CG 4.23Å; I1256-P1368 WeakPolarHBondContact O-CG 3.41Å; I1256-Y1404 HydrophobicContact CD1-CE1 3.94Å; I1256-C1408 WeakPolarHBondContact CD1-SG 3.26Å; I1256-L1411 HydrophobicContact CD1-CD1 3.82Å
1257	A	80.7	Confident	84.1	Confident	17.2 Å²	17.2	43.9 Å²	43.9	14%	0.142	24%	0.238	C	C	.	.	H	α-helix	trans	-68.1	-31	-177.1	0	0	0	0	0	113.2	Q1253 D1254 G1259 R1296	Q1253-A1257 VanDerWaalsContact O-CB 3.3Å; Q1253-A1257 WeakPolarHBondContact O-CB 3.36Å; Q1253-A1257 PolarHBondContact O-N 3.21Å; D1254-A1257 PolarHBondContact O-N 3.09Å; A1257-G1259 VanDerWaalsContact C-N 3.29Å; A1257-G1259 PolarHBondContact O-N 2.92Å; A1257-R1296 PolarHBondContact O-NH2 3.06Å
1258	S	79.4	Confident	84.7	Confident	66 Å²	66	39.8 Å²	39.8	46%	0.462	22%	0.216	S	C	.	.	H	α-helix	trans	-74.4	-22.4	169.1	63	0	0	0	0	112.9	D1254 Q1255 I1256 S1260 R1296	D1254-S1258 WeakPolarHBondContact O-CB 3.26Å; D1254-S1258 PolarHBondContact O-N 3.12Å; D1254-S1258 PolarHBondContact O-OG 3.17Å; Q1255-S1258 WeakPolarHBondContact CA-OG 3.42Å; Q1255-S1258 PolarHBondContact O-OG 3.2Å; Q1255-S1258 VanDerWaalsContact O-OG 3.12Å; I1256-S1258 VanDerWaalsContact C-N 3.3Å; I1256-S1258 PolarHBondContact O-N 3.09Å; S1258-S1260 VanDerWaalsContact C-N 3.3Å; S1258-S1260 PolarHBondContact OG-N 3.05Å; S1258-S1260 PolarHBondContact OG-OG 3.12Å; S1258-S1260 VanDerWaalsContact OG-OG 3.12Å; S1258-R1296 VanDerWaalsContact N-NH2 3.17Å
1259	G	79.3	Confident	85.1	Confident	28.8 Å²	28.8	37.6 Å²	37.6	30%	0.297	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.9	12.1	-176.9	0	0	0	0	0	114.6	Q1255 I1256 A1257 L1261	Q1255-G1259 PolarHBondContact O-N 3.05Å; I1256-G1259 WeakPolarHBondContact O-CA 3.31Å; I1256-G1259 PolarHBondContact O-N 3.02Å; I1256-G1259 VanDerWaalsContact O-N 3.07Å; A1257-G1259 VanDerWaalsContact C-N 3.29Å; A1257-G1259 PolarHBondContact O-N 2.92Å; G1259-L1261 VanDerWaalsContact C-N 3.31Å; G1259-L1261 PolarHBondContact O-N 2.98Å
1260	S	81.1	Confident	85.3	Confident	66.4 Å²	66.4	38.8 Å²	38.8	46%	0.464	21%	0.212	S	C	.	.	S	Bend	trans	-67.6	-31.4	174.2	61.4	0	0	0	0	112.2	Q1255 S1258 P1262 L1418	Q1255-S1260 VanDerWaalsContact CA-OG 3.31Å; Q1255-S1260 WeakPolarHBondContact CA-OG 3.38Å; Q1255-S1260 PolarHBondContact O-N 2.92Å; Q1255-S1260 VanDerWaalsContact O-N 3.07Å; Q1255-S1260 PolarHBondContact O-OG 3.01Å; Q1255-S1260 VanDerWaalsContact O-OG 3.1Å; S1258-S1260 VanDerWaalsContact C-N 3.3Å; S1258-S1260 PolarHBondContact OG-N 3.05Å; S1258-S1260 PolarHBondContact OG-OG 3.12Å; S1258-S1260 VanDerWaalsContact OG-OG 3.12Å; S1260-P1262 VanDerWaalsContact O-CD 3.27Å; S1260-P1262 WeakPolarHBondContact O-CD 3.26Å; S1260-L1418 VanDerWaalsContact O-CD1 3.27Å; S1260-L1418 WeakPolarHBondContact O-CD1 3.42Å
1261	L	85.9	Confident	85.6	Confident	7.4 Å²	7.4	36.3 Å²	36.3	4%	0.039	20%	0.201	C	C	.	.	S	Bend	trans	-96.9	102.6	169.6	-175.3	58.2	0	0	0	110.4	L1252 Q1255 I1256 G1259 C1263 C1408 L1411 A1413 F1414	L1252-L1261 HydrophobicContact CD2-CD2 4.12Å; Q1255-L1261 HydrophobicContact CB-CB 3.99Å; Q1255-L1261 PolarHBondContact O-N 3.23Å; Q1255-L1261 VanDerWaalsContact O-N 3.11Å; I1256-L1261 HydrophobicContact CD1-CD2 4.12Å; I1256-L1261 HydrophobicContact CG1-CB 4.03Å; I1256-L1261 HydrophobicContact CG1-CD2 4.27Å; I1256-L1261 HydrophobicContact CG1-CG 4.22Å; G1259-L1261 VanDerWaalsContact C-N 3.31Å; G1259-L1261 PolarHBondContact O-N 2.98Å; L1261-C1263 PolarHBondContact O-N 3.07Å; L1261-C1263 VanDerWaalsContact O-N 3.13Å; L1261-C1408 HydrophobicContact CD2-CB 4.49Å; L1261-L1411 HydrophobicContact CD1-CD1 4.45Å; L1261-L1411 HydrophobicContact CD2-CD1 3.83Å; L1261-L1411 HydrophobicContact CG-CD1 3.85Å; L1261-A1413 HydrophobicContact CD1-CB 4.2Å; L1261-F1414 HydrophobicContact CD1-CB 4.39Å; L1261-F1414 HydrophobicContact CD2-CD2 4.41Å
1262	P	84.7	Confident	85.9	Confident	9.8 Å²	9.8	31.1 Å²	31.1	6%	0.064	18%	0.177	C	C	.	.			trans	-76.6	102.9	-172.4	29.1	-36	0	0	0	113	S1260 A1413 L1418 L1447 K1452	S1260-P1262 VanDerWaalsContact O-CD 3.27Å; S1260-P1262 WeakPolarHBondContact O-CD 3.26Å; P1262-A1413 HydrophobicContact CG-CB 3.59Å; P1262-L1418 HydrophobicContact CG-CD1 4Å; P1262-L1418 HydrophobicContact CG-CD2 4.34Å; P1262-L1447 HydrophobicContact CB-CD1 4.41Å; P1262-L1447 HydrophobicContact CG-CD1 4.01Å; P1262-K1452 HydrophobicContact CB-CB 4.48Å; P1262-K1452 HydrophobicContact CB-CD 3.91Å; P1262-K1452 HydrophobicContact CB-CG 4.22Å
1263	C	87.1	Confident	86	Confident	2.6 Å²	2.6	30.8 Å²	30.8	2%	0.018	18%	0.175	C	C	.	.			trans	-95	153.2	170.3	58.3	0	0	0	0	112.6	L1261 E1267 L1271 Y1371 L1411 K1452	L1261-C1263 PolarHBondContact O-N 3.07Å; L1261-C1263 VanDerWaalsContact O-N 3.13Å; C1263-E1267 HydrophobicContact CB-CB 4.12Å; C1263-L1271 HydrophobicContact CB-CD1 4.49Å; C1263-Y1371 WeakPolarHBondContact O-CE2 3.48Å; C1263-Y1371 PolarHBondContact O-OH 3.02Å; C1263-L1411 HydrophobicContact CB-CD1 4.06Å; C1263-L1411 HydrophobicContact CB-CD2 4.1Å; C1263-K1452 WeakPolarHBondContact O-CB 3.44Å; C1263-K1452 WeakPolarHBondContact O-CD 3.49Å; C1263-K1452 VanDerWaalsContact O-CG 3.28Å; C1263-K1452 WeakPolarHBondContact O-CG 3.39Å
1264	S	88.5	Confident	86.1	Confident	15.6 Å²	15.6	29.7 Å²	29.7	11%	0.109	17%	0.17	C	C	.	.			trans	-73.9	171.2	170	72	0	0	0	0	112.3	E1266 E1267 A1268	S1264-E1266 VanDerWaalsContact C-N 3.29Å; S1264-E1266 PolarHBondContact O-N 3.18Å; S1264-E1267 WeakPolarHBondContact CA-OE2 3.41Å; S1264-E1267 WeakPolarHBondContact CB-OE2 3.41Å; S1264-E1267 PolarHBondContact N-OE2 3.08Å; S1264-E1267 PolarHBondContact O-N 3.18Å; S1264-E1267 VanDerWaalsContact OG-CD 3.25Å; S1264-E1267 WeakPolarHBondContact OG-CG 3.34Å; S1264-E1267 PolarHBondContact OG-N 3.19Å; S1264-E1267 PolarHBondContact OG-OE2 3.22Å; S1264-A1268 VanDerWaalsContact O-CB 3.28Å; S1264-A1268 WeakPolarHBondContact O-CB 3.39Å; S1264-A1268 PolarHBondContact O-N 3.15Å
1265	K	87.3	Confident	86.3	Confident	53.6 Å²	53.6	25.9 Å²	25.9	23%	0.233	15%	0.15	C	C	.	.	H	α-helix	trans	-61.2	-32.8	179.4	-171	174.4	-170	162.7	0	113.7	A1269 Y1371 S1374 I1377 L1380	K1265-A1269 WeakPolarHBondContact O-CB 3.25Å; K1265-A1269 PolarHBondContact O-N 2.96Å; K1265-A1269 VanDerWaalsContact O-N 3.15Å; K1265-Y1371 HydrophobicContact CB-CE1 4.31Å; K1265-Y1371 PolarHBondContact N-OH 2.8Å; K1265-S1374 WeakPolarHBondContact CE-OG 3.46Å; K1265-S1374 PolarHBondContact NZ-OG 3.17Å; K1265-I1377 HydrophobicContact CG-CD1 4.12Å; K1265-I1377 HydrophobicContact CG-CG1 4.2Å; K1265-L1380 HydrophobicContact CG-CD1 4.3Å
1266	E	87.5	Confident	86.3	Confident	129.8 Å²	129.8	24.6 Å²	24.6	61%	0.607	15%	0.146	S	C	*	.	H	α-helix	trans	-80.6	-41.2	-178.2	-68.4	173.8	-155.7	0	0	111.5	S1264 A1269 L1270 L1380 W1384	S1264-E1266 VanDerWaalsContact C-N 3.29Å; S1264-E1266 PolarHBondContact O-N 3.18Å; E1266-A1269 PolarHBondContact O-N 3.04Å; E1266-L1270 PolarHBondContact O-N 3.06Å; E1266-L1380 HydrophobicContact CG-CD1 4.28Å; E1266-W1384 PolarHBondContact O-NE1 2.94Å
1267	E	89	Confident	86.1	Confident	58.4 Å²	58.4	24.6 Å²	24.6	27%	0.273	15%	0.146	S	C	.	.	H	α-helix	trans	-64.4	-44.2	173.2	-67.3	157.5	145.2	0	0	110.8	C1263 S1264 A1269 L1270 L1271 L1411	C1263-E1267 HydrophobicContact CB-CB 4.12Å; S1264-E1267 WeakPolarHBondContact CA-OE2 3.41Å; S1264-E1267 WeakPolarHBondContact CB-OE2 3.41Å; S1264-E1267 PolarHBondContact N-OE2 3.08Å; S1264-E1267 PolarHBondContact O-N 3.18Å; S1264-E1267 VanDerWaalsContact OG-CD 3.25Å; S1264-E1267 WeakPolarHBondContact OG-CG 3.34Å; S1264-E1267 PolarHBondContact OG-N 3.19Å; S1264-E1267 PolarHBondContact OG-OE2 3.22Å; E1267-A1269 VanDerWaalsContact C-N 3.31Å; E1267-A1269 PolarHBondContact O-N 3.03Å; E1267-L1270 WeakPolarHBondContact O-CB 3.35Å; E1267-L1270 PolarHBondContact O-N 3Å; E1267-L1270 VanDerWaalsContact O-N 3.14Å; E1267-L1271 WeakPolarHBondContact O-CB 3.39Å; E1267-L1271 WeakPolarHBondContact O-CD1 3.35Å; E1267-L1271 VanDerWaalsContact O-CG 3.31Å; E1267-L1271 WeakPolarHBondContact O-CG 3.36Å; E1267-L1271 PolarHBondContact O-N 3.05Å; E1267-L1411 HydrophobicContact CB-CD2 4.04Å; E1267-L1411 HydrophobicContact CG-CD2 3.96Å; E1267-L1411 VanDerWaalsContact OE1-CD2 3.28Å; E1267-L1411 WeakPolarHBondContact OE1-CD2 3.32Å
1268	A	89	Confident	86.3	Confident	1 Å²	1	23.8 Å²	23.8	1%	0.008	14%	0.14	C	C	.	.	H	α-helix	trans	-59.3	-39.9	174.3	0	0	0	0	0	112.3	S1264 A1272 L1367 Y1371 I1377	S1264-A1268 VanDerWaalsContact O-CB 3.28Å; S1264-A1268 WeakPolarHBondContact O-CB 3.39Å; S1264-A1268 PolarHBondContact O-N 3.15Å; A1268-A1272 VanDerWaalsContact O-CB 3.22Å; A1268-A1272 WeakPolarHBondContact O-CB 3.37Å; A1268-A1272 PolarHBondContact O-N 3.17Å; A1268-L1367 HydrophobicContact CB-CD2 4.25Å; A1268-Y1371 HydrophobicContact CB-CD2 3.78Å; A1268-Y1371 HydrophobicContact CB-CE2 3.95Å; A1268-I1377 HydrophobicContact CB-CD1 4.03Å
1269	A	89.6	Confident	86.2	Confident	0 Å²	0	22.2 Å²	22.2	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-68	-36.8	176.1	0	0	0	0	0	112.8	K1265 E1266 E1267 S1273 I1377 L1380 I1381	K1265-A1269 WeakPolarHBondContact O-CB 3.25Å; K1265-A1269 PolarHBondContact O-N 2.96Å; K1265-A1269 VanDerWaalsContact O-N 3.15Å; E1266-A1269 PolarHBondContact O-N 3.04Å; E1267-A1269 VanDerWaalsContact C-N 3.31Å; E1267-A1269 PolarHBondContact O-N 3.03Å; A1269-S1273 WeakPolarHBondContact O-CB 3.33Å; A1269-S1273 PolarHBondContact O-N 3.07Å; A1269-S1273 VanDerWaalsContact O-N 3.11Å; A1269-S1273 PolarHBondContact O-OG 3.14Å; A1269-I1377 HydrophobicContact CB-CD1 4.45Å; A1269-I1377 HydrophobicContact CB-CG1 3.84Å; A1269-L1380 HydrophobicContact CB-CB 3.56Å; A1269-L1380 HydrophobicContact CB-CD1 4.47Å; A1269-I1381 HydrophobicContact CB-CG1 3.97Å; A1269-I1381 WeakPolarHBondContact O-CG1 3.34Å
1270	L	89.7	Confident	86	Confident	30 Å²	30	26.6 Å²	26.6	16%	0.157	14%	0.138	C	C	.	.	H	α-helix	trans	-65.6	-52.3	173.9	174.5	73.6	0	0	0	110.7	E1266 E1267 A1272 S1273 I1274 W1384 L1388 T1407	E1266-L1270 PolarHBondContact O-N 3.06Å; E1267-L1270 WeakPolarHBondContact O-CB 3.35Å; E1267-L1270 PolarHBondContact O-N 3Å; E1267-L1270 VanDerWaalsContact O-N 3.14Å; L1270-A1272 PolarHBondContact O-N 3.23Å; L1270-S1273 WeakPolarHBondContact O-CB 3.47Å; L1270-S1273 PolarHBondContact O-N 3.1Å; L1270-S1273 VanDerWaalsContact O-N 3.07Å; L1270-S1273 PolarHBondContact O-OG 3.16Å; L1270-I1274 HydrophobicContact CD1-CD1 3.94Å; L1270-I1274 HydrophobicContact CD1-CG1 4.26Å; L1270-I1274 HydrophobicContact CD2-CD1 3.6Å; L1270-I1274 HydrophobicContact CD2-CG1 4.48Å; L1270-I1274 HydrophobicContact CG-CD1 4.14Å; L1270-I1274 WeakPolarHBondContact O-CG1 3.41Å; L1270-I1274 PolarHBondContact O-N 3.32Å; L1270-W1384 HydrophobicContact CB-CD2 4.15Å; L1270-W1384 HydrophobicContact CB-CG 4.21Å; L1270-W1384 HydrophobicContact CB-CZ2 4.49Å; L1270-W1384 HydrophobicContact CD1-CB 4.5Å; L1270-W1384 HydrophobicContact CD1-CD2 3.95Å; L1270-W1384 HydrophobicContact CD1-CE3 3.78Å; L1270-W1384 HydrophobicContact CD1-CG 4.3Å; L1270-W1384 HydrophobicContact CD1-CH2 3.86Å; L1270-W1384 HydrophobicContact CD1-CZ2 4.04Å; L1270-W1384 HydrophobicContact CD1-CZ3 4.13Å; L1270-W1384 HydrophobicContact CG-CD2 4.3Å; L1270-W1384 HydrophobicContact CG-CE3 4.41Å; L1270-L1388 HydrophobicContact CD1-CD1 4.39Å; L1270-L1388 HydrophobicContact CD1-CD2 4.39Å; L1270-T1407 HydrophobicContact CD2-CG2 3.88Å; L1270-T1407 HydrophobicContact CG-CG2 4.48Å
1271	L	90.9	Very high	85.7	Confident	1.4 Å²	1.4	26.5 Å²	26.5	1%	0.007	13%	0.129	C	C	.	.	H	α-helix	trans	-59.3	-46.6	-179.7	-71.2	159.3	0	0	0	111.7	I1256 C1263 E1267 S1273 I1274 Q1275 Y1404 T1407	I1256-L1271 HydrophobicContact CD1-CD1 3.69Å; I1256-L1271 HydrophobicContact CD1-CD2 4.11Å; I1256-L1271 HydrophobicContact CD1-CG 4.4Å; I1256-L1271 HydrophobicContact CG1-CD1 4.48Å; C1263-L1271 HydrophobicContact CB-CD1 4.49Å; E1267-L1271 WeakPolarHBondContact O-CB 3.39Å; E1267-L1271 WeakPolarHBondContact O-CD1 3.35Å; E1267-L1271 VanDerWaalsContact O-CG 3.31Å; E1267-L1271 WeakPolarHBondContact O-CG 3.36Å; E1267-L1271 PolarHBondContact O-N 3.05Å; L1271-S1273 VanDerWaalsContact C-N 3.29Å; L1271-S1273 PolarHBondContact O-N 3.2Å; L1271-I1274 PolarHBondContact O-N 2.98Å; L1271-I1274 VanDerWaalsContact O-N 3.13Å; L1271-Q1275 WeakPolarHBondContact O-CB 3.41Å; L1271-Q1275 PolarHBondContact O-N 3.1Å; L1271-Y1404 HydrophobicContact CB-CD2 4.44Å; L1271-Y1404 HydrophobicContact CB-CE2 3.92Å; L1271-Y1404 HydrophobicContact CD2-CD1 4.26Å; L1271-Y1404 HydrophobicContact CD2-CD2 3.72Å; L1271-Y1404 HydrophobicContact CD2-CE1 4.25Å; L1271-Y1404 HydrophobicContact CD2-CE2 3.72Å; L1271-Y1404 HydrophobicContact CD2-CG 4Å; L1271-Y1404 HydrophobicContact CG-CE2 4.43Å; L1271-Y1404 WeakPolarHBondContact O-CE2 3.45Å; L1271-T1407 HydrophobicContact CD1-CG2 4.41Å; L1271-T1407 HydrophobicContact CD2-CG2 3.8Å; L1271-T1407 HydrophobicContact CG-CG2 4.02Å
1272	A	88.5	Confident	85.2	Confident	0.6 Å²	0.6	29.8 Å²	29.8	1%	0.005	14%	0.141	C	C	.	.	H	α-helix	trans	-61.9	-34	174.5	0	0	0	0	0	112.9	A1268 L1270 S1276 C1366 L1367 I1381	A1268-A1272 VanDerWaalsContact O-CB 3.22Å; A1268-A1272 WeakPolarHBondContact O-CB 3.37Å; A1268-A1272 PolarHBondContact O-N 3.17Å; L1270-A1272 PolarHBondContact O-N 3.23Å; A1272-S1276 WeakPolarHBondContact O-CB 3.37Å; A1272-S1276 PolarHBondContact O-N 3Å; A1272-C1366 HydrophobicContact CB-CB 3.93Å; A1272-C1366 WeakPolarHBondContact CB-O 3.34Å; A1272-L1367 HydrophobicContact CB-CD2 3.76Å; A1272-L1367 HydrophobicContact CB-CG 4.17Å; A1272-I1381 HydrophobicContact CB-CD1 3.85Å; A1272-I1381 HydrophobicContact CB-CG1 4.13Å
1273	S	88.7	Confident	84.2	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-70.7	-35.5	175.7	75.6	0	0	0	0	113	A1269 L1270 L1271 L1277 W1384 L1388	A1269-S1273 WeakPolarHBondContact O-CB 3.33Å; A1269-S1273 PolarHBondContact O-N 3.07Å; A1269-S1273 VanDerWaalsContact O-N 3.11Å; A1269-S1273 PolarHBondContact O-OG 3.14Å; L1270-S1273 WeakPolarHBondContact O-CB 3.47Å; L1270-S1273 PolarHBondContact O-N 3.1Å; L1270-S1273 VanDerWaalsContact O-N 3.07Å; L1270-S1273 PolarHBondContact O-OG 3.16Å; L1271-S1273 VanDerWaalsContact C-N 3.29Å; L1271-S1273 PolarHBondContact O-N 3.2Å; S1273-L1277 WeakPolarHBondContact O-CB 3.33Å; S1273-L1277 VanDerWaalsContact O-CG 3.29Å; S1273-L1277 WeakPolarHBondContact O-CG 3.41Å; S1273-L1277 PolarHBondContact O-N 3.09Å; S1273-L1277 VanDerWaalsContact O-N 3.1Å; S1273-W1384 VanDerWaalsContact OG-CB 3.25Å; S1273-W1384 WeakPolarHBondContact OG-CB 3.37Å; S1273-L1388 VanDerWaalsContact OG-CD1 3.26Å; S1273-L1388 WeakPolarHBondContact OG-CD1 3.41Å
1274	I	88.1	Confident	82.7	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-69.2	-50.5	174.4	-62.7	165.5	0	0	0	110.1	L1270 L1271 S1276 L1277 I1278 L1388 L1400 L1403 Y1404	L1270-I1274 HydrophobicContact CD1-CD1 3.94Å; L1270-I1274 HydrophobicContact CD1-CG1 4.26Å; L1270-I1274 HydrophobicContact CD2-CD1 3.6Å; L1270-I1274 HydrophobicContact CD2-CG1 4.48Å; L1270-I1274 HydrophobicContact CG-CD1 4.14Å; L1270-I1274 WeakPolarHBondContact O-CG1 3.41Å; L1270-I1274 PolarHBondContact O-N 3.32Å; L1271-I1274 PolarHBondContact O-N 2.98Å; L1271-I1274 VanDerWaalsContact O-N 3.13Å; I1274-S1276 VanDerWaalsContact C-N 3.33Å; I1274-S1276 PolarHBondContact O-N 3.03Å; I1274-L1277 WeakPolarHBondContact O-CB 3.4Å; I1274-L1277 PolarHBondContact O-N 2.85Å; I1274-L1277 VanDerWaalsContact O-N 3.17Å; I1274-I1278 HydrophobicContact CG2-CD1 3.87Å; I1274-I1278 HydrophobicContact CG2-CG1 4.44Å; I1274-I1278 WeakPolarHBondContact O-CG1 3.31Å; I1274-I1278 PolarHBondContact O-N 3.19Å; I1274-L1388 HydrophobicContact CB-CD1 4.48Å; I1274-L1388 HydrophobicContact CG1-CD1 3.62Å; I1274-L1388 HydrophobicContact CG1-CD2 4.27Å; I1274-L1400 HydrophobicContact CG2-CB 4.2Å; I1274-L1400 HydrophobicContact CG2-CD2 4.48Å; I1274-L1400 WeakPolarHBondContact CG2-O 3.34Å; I1274-L1403 HydrophobicContact CD1-CB 4.45Å; I1274-L1403 HydrophobicContact CD1-CD2 4.01Å; I1274-L1403 HydrophobicContact CD1-CG 3.94Å; I1274-L1403 HydrophobicContact CG1-CD2 4.42Å; I1274-Y1404 HydrophobicContact CB-CD2 4.17Å; I1274-Y1404 HydrophobicContact CG2-CD2 4.07Å
1275	Q	87.2	Confident	80.7	Confident	1.8 Å²	1.8	39 Å²	39	1%	0.008	20%	0.203	C	C	.	.	H	α-helix	trans	-56.2	-48.1	176.6	175.9	179.4	-18.5	0	0	111.1	Q1253 L1271 L1277 I1278 E1279 H1365 C1366 Y1404	Q1253-Q1275 VanDerWaalsContact NE2-CD 3.3Å; L1271-Q1275 WeakPolarHBondContact O-CB 3.41Å; L1271-Q1275 PolarHBondContact O-N 3.1Å; Q1275-L1277 VanDerWaalsContact C-N 3.29Å; Q1275-L1277 PolarHBondContact O-N 2.94Å; Q1275-I1278 WeakPolarHBondContact O-CB 3.18Å; Q1275-I1278 PolarHBondContact O-N 3.13Å; Q1275-I1278 VanDerWaalsContact O-N 3.14Å; Q1275-E1279 HydrophobicContact CG-CG 4.4Å; Q1275-E1279 VanDerWaalsContact CG-OE1 3.28Å; Q1275-E1279 WeakPolarHBondContact CG-OE1 3.44Å; Q1275-E1279 PolarHBondContact NE2-OE1 3.11Å; Q1275-E1279 WeakPolarHBondContact O-CB 3.4Å; Q1275-E1279 VanDerWaalsContact O-CG 3.23Å; Q1275-E1279 WeakPolarHBondContact O-CG 3.32Å; Q1275-E1279 PolarHBondContact O-N 3.07Å; Q1275-H1365 PolarHBondContact NE2-O 2.98Å; Q1275-C1366 VanDerWaalsContact CD-SG 3.5Å; Q1275-C1366 PolarHBondContact NE2-SG 3.2Å; Q1275-C1366 VanDerWaalsContact NE2-SG 3.39Å; Q1275-Y1404 HydrophobicContact CB-CE2 4.14Å
1276	S	82.8	Confident	79	Confident	22.2 Å²	22.2	42.9 Å²	42.9	16%	0.155	22%	0.22	C	C	.	.	H	α-helix	trans	-64	-27.9	178.8	-177.3	0	0	0	0	113	A1272 I1274 E1279 E1280 K1385	A1272-S1276 WeakPolarHBondContact O-CB 3.37Å; A1272-S1276 PolarHBondContact O-N 3Å; I1274-S1276 VanDerWaalsContact C-N 3.33Å; I1274-S1276 PolarHBondContact O-N 3.03Å; S1276-E1279 PolarHBondContact O-N 2.82Å; S1276-E1280 WeakPolarHBondContact O-CB 3.37Å; S1276-E1280 PolarHBondContact O-N 3.02Å; S1276-K1385 PolarHBondContact O-NZ 2.98Å; S1276-K1385 VanDerWaalsContact O-NZ 3.14Å; S1276-K1385 VanDerWaalsContact OG-CE 3.25Å; S1276-K1385 WeakPolarHBondContact OG-CE 3.39Å; S1276-K1385 PolarHBondContact OG-NZ 3.01Å
1277	L	83.7	Confident	77.1	Confident	4.4 Å²	4.4	41.1 Å²	41.1	2%	0.023	21%	0.208	C	C	.	.	H	α-helix	trans	-75.2	-38.9	172	-80.7	168.5	0	0	0	112.6	S1273 I1274 Q1275 E1279 E1280 K1281 K1385 L1388 Y1394 L1400	S1273-L1277 WeakPolarHBondContact O-CB 3.33Å; S1273-L1277 VanDerWaalsContact O-CG 3.29Å; S1273-L1277 WeakPolarHBondContact O-CG 3.41Å; S1273-L1277 PolarHBondContact O-N 3.09Å; S1273-L1277 VanDerWaalsContact O-N 3.1Å; I1274-L1277 WeakPolarHBondContact O-CB 3.4Å; I1274-L1277 PolarHBondContact O-N 2.85Å; I1274-L1277 VanDerWaalsContact O-N 3.17Å; Q1275-L1277 VanDerWaalsContact C-N 3.29Å; Q1275-L1277 PolarHBondContact O-N 2.94Å; L1277-E1279 VanDerWaalsContact C-N 3.3Å; L1277-E1279 PolarHBondContact O-N 2.88Å; L1277-E1280 PolarHBondContact O-N 3.07Å; L1277-K1281 PolarHBondContact O-N 3.05Å; L1277-K1385 HydrophobicContact CD1-CG 4.33Å; L1277-K1385 HydrophobicContact CD2-CD 4.25Å; L1277-K1385 HydrophobicContact CD2-CG 4.42Å; L1277-K1385 HydrophobicContact CG-CD 4.29Å; L1277-K1385 HydrophobicContact CG-CG 4.27Å; L1277-L1388 HydrophobicContact CD1-CB 3.79Å; L1277-L1388 HydrophobicContact CD1-CD1 3.82Å; L1277-L1388 HydrophobicContact CD1-CG 4.44Å; L1277-Y1394 HydrophobicContact CD1-CD2 4.36Å; L1277-Y1394 HydrophobicContact CD1-CE2 4.05Å; L1277-Y1394 HydrophobicContact CD2-CD2 4.45Å; L1277-Y1394 HydrophobicContact CD2-CE2 3.75Å; L1277-Y1394 VanDerWaalsContact CD2-CE2 3.48Å; L1277-Y1394 HydrophobicContact CG-CE2 4.3Å; L1277-L1400 HydrophobicContact CB-CD1 4.2Å
1278	I	83.9	Confident	75.1	Confident	0.6 Å²	0.6	43.6 Å²	43.6	0%	0.003	22%	0.219	C	C	.	.	H	α-helix	trans	-62.8	-42	174.5	-68.4	167.5	0	0	0	110.6	Y1249 I1274 Q1275 E1280 W1282 R1287 E1397 L1400 K1401	Y1249-I1278 HydrophobicContact CD2-CD1 4.43Å; Y1249-I1278 HydrophobicContact CE2-CD1 3.7Å; I1274-I1278 HydrophobicContact CG2-CD1 3.87Å; I1274-I1278 HydrophobicContact CG2-CG1 4.44Å; I1274-I1278 WeakPolarHBondContact O-CG1 3.31Å; I1274-I1278 PolarHBondContact O-N 3.19Å; Q1275-I1278 WeakPolarHBondContact O-CB 3.18Å; Q1275-I1278 PolarHBondContact O-N 3.13Å; Q1275-I1278 VanDerWaalsContact O-N 3.14Å; I1278-E1280 PolarHBondContact O-N 3.21Å; I1278-W1282 PolarHBondContact O-N 3.15Å; I1278-R1287 VanDerWaalsContact CG2-NH1 3.33Å; I1278-R1287 PolarHBondContact O-NH1 3.08Å; I1278-E1397 HydrophobicContact CG2-CG 4.42Å; I1278-L1400 HydrophobicContact CD1-CB 3.86Å; I1278-L1400 HydrophobicContact CG1-CB 3.67Å; I1278-L1400 HydrophobicContact CG1-CD1 4.06Å; I1278-L1400 HydrophobicContact CG1-CG 4.48Å; I1278-K1401 HydrophobicContact CD1-CG 4.15Å
1279	E	77.9	Confident	72.7	Confident	31.6 Å²	31.6	46.6 Å²	46.6	15%	0.148	24%	0.235	C	C	.	.	H	α-helix	trans	-73.9	-25.5	178.5	-68.9	-178.2	-174.5	0	0	113.9	Q1275 S1276 L1277 L1289 R1291	Q1275-E1279 HydrophobicContact CG-CG 4.4Å; Q1275-E1279 VanDerWaalsContact CG-OE1 3.28Å; Q1275-E1279 WeakPolarHBondContact CG-OE1 3.44Å; Q1275-E1279 PolarHBondContact NE2-OE1 3.11Å; Q1275-E1279 WeakPolarHBondContact O-CB 3.4Å; Q1275-E1279 VanDerWaalsContact O-CG 3.23Å; Q1275-E1279 WeakPolarHBondContact O-CG 3.32Å; Q1275-E1279 PolarHBondContact O-N 3.07Å; S1276-E1279 PolarHBondContact O-N 2.82Å; L1277-E1279 VanDerWaalsContact C-N 3.3Å; L1277-E1279 PolarHBondContact O-N 2.88Å; E1279-L1289 HydrophobicContact CG-CD1 3.74Å; E1279-R1291 VanDerWaalsContact CD-NH2 3.3Å; E1279-R1291 IonicContact OE1-CZ 3.55Å; E1279-R1291 IonicContact OE1-NE 3.62Å; E1279-R1291 IonicContact OE1-NH2 3.12Å; E1279-R1291 PolarHBondContact OE1-NH2 3.31Å; E1279-R1291 IonicContact OE2-CZ 2.75Å; E1279-R1291 IonicContact OE2-NH2 3.07Å; E1279-R1291 PolarHBondContact OE2-NH2 2.81Å; E1279-R1291 VanDerWaalsContact OE2-NH2 3.11Å
1280	E	75.4	Confident	70.6	Confident	121.4 Å²	121.4	49.7 Å²	49.7	57%	0.567	26%	0.256	S	S	*	.	H	α-helix	trans	-82.9	-41.5	179.3	-179.4	175.7	-166.8	0	0	112.3	S1276 L1277 I1278 K1385	S1276-E1280 WeakPolarHBondContact O-CB 3.37Å; S1276-E1280 PolarHBondContact O-N 3.02Å; L1277-E1280 PolarHBondContact O-N 3.07Å; I1278-E1280 PolarHBondContact O-N 3.21Å; E1280-K1385 IonicContact OE1-NZ 2.64Å; E1280-K1385 IonicContact OE2-NZ 2.86Å; E1280-K1385 PolarHBondContact OE2-NZ 3.09Å
1281	K	75.2	Confident	68.4	Low	63.4 Å²	63.4	54.4 Å²	54.4	28%	0.276	27%	0.272	S	S	.	.	H	α-helix	trans	-85.8	-31.6	179.1	-78.5	-170.7	177.4	-178.6	0	114.7	L1277 P1283 Y1394 D1395	L1277-K1281 PolarHBondContact O-N 3.05Å; K1281-P1283 VanDerWaalsContact O-CD 3.28Å; K1281-P1283 WeakPolarHBondContact O-CD 3.36Å; K1281-Y1394 VanDerWaalsContact NZ-CZ 3.34Å; K1281-Y1394 PolarHBondContact NZ-O 3.16Å; K1281-D1395 IonicContact NZ-OD1 2.84Å; K1281-D1395 PolarHBondContact NZ-OD1 3.07Å
1282	W	75.8	Confident	66	Low	76.6 Å²	76.6	58.8 Å²	58.8	29%	0.29	30%	0.295	S	S	.	.			trans	-129.5	72.6	-172.3	-64.4	-82.4	0	0	0	113.1	I1278 S1284 S1285 R1287 D1395 E1397 L1400	I1278-W1282 PolarHBondContact O-N 3.15Å; W1282-S1284 VanDerWaalsContact C-N 3.34Å; W1282-S1284 PolarHBondContact O-N 3.14Å; W1282-S1284 VanDerWaalsContact O-N 3.11Å; W1282-S1284 PolarHBondContact O-OG 3.14Å; W1282-S1285 PolarHBondContact O-N 2.95Å; W1282-S1285 VanDerWaalsContact O-N 3.11Å; W1282-R1287 PolarHBondContact O-NE 2.62Å; W1282-R1287 PolarHBondContact O-NH1 3.2Å; W1282-R1287 PolarHBondContact O-NH2 3.02Å; W1282-R1287 VanDerWaalsContact O-NH2 3.07Å; W1282-D1395 WeakPolarHBondContact CZ2-O 3.42Å; W1282-E1397 HydrophobicContact CB-CG 4.4Å; W1282-E1397 VanDerWaalsContact CB-OE2 3.28Å; W1282-E1397 WeakPolarHBondContact CB-OE2 3.25Å; W1282-E1397 HydrophobicContact CD2-CB 3.88Å; W1282-E1397 HydrophobicContact CD2-CG 4.09Å; W1282-E1397 HydrophobicContact CE3-CB 4.02Å; W1282-E1397 HydrophobicContact CE3-CG 4.16Å; W1282-E1397 HydrophobicContact CG-CB 4.24Å; W1282-E1397 HydrophobicContact CG-CG 4.26Å; W1282-E1397 HydrophobicContact CH2-CB 4.3Å; W1282-E1397 HydrophobicContact CZ2-CB 4.24Å; W1282-E1397 HydrophobicContact CZ3-CB 4.28Å; W1282-L1400 HydrophobicContact CZ3-CD1 3.97Å
1283	P	63.1	Low	63.8	Low	94.6 Å²	94.6	62.6 Å²	62.6	61%	0.614	32%	0.315	S	S	*	.			trans	-69	47.7	-178.6	19.4	-23.5	0	0	0	113.8	K1281 S1285 K1286	K1281-P1283 VanDerWaalsContact O-CD 3.28Å; K1281-P1283 WeakPolarHBondContact O-CD 3.36Å; P1283-S1285 PolarHBondContact O-N 3.01Å; P1283-K1286 WeakPolarHBondContact O-CB 3.43Å; P1283-K1286 PolarHBondContact O-N 2.96Å; P1283-K1286 VanDerWaalsContact O-N 3.12Å
1284	S	55.4	Low	61.8	Low	65.8 Å²	65.8	65 Å²	65	46%	0.46	33%	0.332	S	S	.	.			trans	-71.9	141.8	176.3	-32.9	0	0	0	0	113	W1282 K1286 R1287	W1282-S1284 VanDerWaalsContact C-N 3.34Å; W1282-S1284 PolarHBondContact O-N 3.14Å; W1282-S1284 VanDerWaalsContact O-N 3.11Å; W1282-S1284 PolarHBondContact O-OG 3.14Å; S1284-K1286 VanDerWaalsContact C-N 3.32Å; S1284-K1286 PolarHBondContact O-N 2.94Å; S1284-R1287 WeakPolarHBondContact O-CA 3.44Å; S1284-R1287 VanDerWaalsContact O-CB 3.29Å; S1284-R1287 WeakPolarHBondContact O-CB 3.31Å; S1284-R1287 WeakPolarHBondContact O-CG 3.27Å; S1284-R1287 PolarHBondContact O-N 3.09Å; S1284-R1287 VanDerWaalsContact OG-CZ 3.27Å; S1284-R1287 PolarHBondContact OG-NE 3.22Å; S1284-R1287 PolarHBondContact OG-NH2 3.18Å
1285	S	45.7	Very low	59.6	Low	61 Å²	61	72.9 Å²	72.9	43%	0.427	36%	0.363	S	S	.	.	H	α-helix	trans	-60.6	-30	179.7	-57.8	0	0	0	0	113.9	W1282 P1283 R1287 Q1288 L1289 E1397 K1401	W1282-S1285 PolarHBondContact O-N 2.95Å; W1282-S1285 VanDerWaalsContact O-N 3.11Å; P1283-S1285 PolarHBondContact O-N 3.01Å; S1285-R1287 VanDerWaalsContact C-N 3.3Å; S1285-R1287 PolarHBondContact O-N 3.35Å; S1285-R1287 VanDerWaalsContact O-N 3.14Å; S1285-Q1288 PolarHBondContact O-N 3.06Å; S1285-Q1288 VanDerWaalsContact O-N 3.08Å; S1285-L1289 WeakPolarHBondContact O-CG 3.49Å; S1285-L1289 PolarHBondContact O-N 2.95Å; S1285-L1289 VanDerWaalsContact O-N 3.14Å; S1285-E1397 PolarHBondContact OG-OE1 2.88Å; S1285-K1401 PolarHBondContact OG-NZ 3.46Å
1286	K	51.4	Low	57.7	Low	135.6 Å²	135.6	78.4 Å²	78.4	59%	0.59	38%	0.383	S	S	*	.	H	α-helix	trans	-56.3	-32.3	172.8	-88.8	-175.1	-179.9	178.7	0	112.4	D1243 P1283 S1284 L1289 S1290	D1243-K1286 IonicContact OD2-NZ 2.79Å; D1243-K1286 PolarHBondContact OD2-NZ 3.43Å; P1283-K1286 WeakPolarHBondContact O-CB 3.43Å; P1283-K1286 PolarHBondContact O-N 2.96Å; P1283-K1286 VanDerWaalsContact O-N 3.12Å; S1284-K1286 VanDerWaalsContact C-N 3.32Å; S1284-K1286 PolarHBondContact O-N 2.94Å; K1286-L1289 PolarHBondContact O-N 3.11Å; K1286-S1290 PolarHBondContact O-N 3.02Å; K1286-S1290 PolarHBondContact O-OG 3.13Å
1287	R	48.9	Very low	55.9	Low	92.6 Å²	92.6	84.4 Å²	84.4	35%	0.349	40%	0.403	S	S	.	.	H	α-helix	trans	-74.3	-29.6	178	-58.7	-176.7	-162.5	178.5	1.3	112.9	F1250 I1278 W1282 S1284 S1285 S1290 R1291 E1397	F1250-R1287 HydrophobicContact CE1-CG 4.4Å; F1250-R1287 HydrophobicContact CZ-CG 4.26Å; I1278-R1287 VanDerWaalsContact CG2-NH1 3.33Å; I1278-R1287 PolarHBondContact O-NH1 3.08Å; W1282-R1287 PolarHBondContact O-NE 2.62Å; W1282-R1287 PolarHBondContact O-NH1 3.2Å; W1282-R1287 PolarHBondContact O-NH2 3.02Å; W1282-R1287 VanDerWaalsContact O-NH2 3.07Å; S1284-R1287 WeakPolarHBondContact O-CA 3.44Å; S1284-R1287 VanDerWaalsContact O-CB 3.29Å; S1284-R1287 WeakPolarHBondContact O-CB 3.31Å; S1284-R1287 WeakPolarHBondContact O-CG 3.27Å; S1284-R1287 PolarHBondContact O-N 3.09Å; S1284-R1287 VanDerWaalsContact OG-CZ 3.27Å; S1284-R1287 PolarHBondContact OG-NE 3.22Å; S1284-R1287 PolarHBondContact OG-NH2 3.18Å; S1285-R1287 VanDerWaalsContact C-N 3.3Å; S1285-R1287 PolarHBondContact O-N 3.35Å; S1285-R1287 VanDerWaalsContact O-N 3.14Å; R1287-S1290 WeakPolarHBondContact CA-OG 3.14Å; R1287-S1290 PolarHBondContact O-N 3.37Å; R1287-S1290 PolarHBondContact O-OG 3.09Å; R1287-R1291 WeakPolarHBondContact O-CB 3.46Å; R1287-R1291 WeakPolarHBondContact O-CD 3.4Å; R1287-R1291 VanDerWaalsContact O-CG 3.23Å; R1287-R1291 WeakPolarHBondContact O-CG 3.36Å; R1287-R1291 PolarHBondContact O-N 3.33Å; R1287-R1291 VanDerWaalsContact O-N 3.13Å; R1287-E1397 IonicContact CZ-OE1 2.96Å; R1287-E1397 IonicContact CZ-OE2 2.8Å; R1287-E1397 IonicContact NH1-OE1 2.62Å; R1287-E1397 IonicContact NH1-OE2 3.89Å; R1287-E1397 PolarHBondContact NH1-OE2 3.15Å; R1287-E1397 IonicContact NH2-OE1 3.13Å; R1287-E1397 PolarHBondContact NH2-OE1 3.19Å; R1287-E1397 IonicContact NH2-OE2 3.24Å; R1287-E1397 PolarHBondContact NH2-OE2 2.84Å
1288	Q	45.7	Very low	54.1	Low	110.4 Å²	110.4	88.5 Å²	88.5	52%	0.516	42%	0.424	S	S	.	.	H	α-helix	trans	-72.8	-41.8	171.4	-73.2	-176.9	-21.7	0	0	111.1	F1250 S1285 S1290 R1291 L1292	F1250-Q1288 HydrophobicContact CE2-CB 4.48Å; F1250-Q1288 HydrophobicContact CZ-CB 3.98Å; S1285-Q1288 PolarHBondContact O-N 3.06Å; S1285-Q1288 VanDerWaalsContact O-N 3.08Å; Q1288-S1290 PolarHBondContact O-N 3.03Å; Q1288-R1291 WeakPolarHBondContact O-CA 3.49Å; Q1288-R1291 WeakPolarHBondContact O-CB 3.4Å; Q1288-R1291 PolarHBondContact O-N 3.2Å; Q1288-L1292 WeakPolarHBondContact O-CG 3.35Å; Q1288-L1292 PolarHBondContact O-N 3.23Å; Q1288-L1292 VanDerWaalsContact O-N 3.13Å
1289	L	40.1	Very low	52.4	Low	65.6 Å²	65.6	95.2 Å²	95.2	34%	0.343	45%	0.449	S	S	.	.	H	α-helix	trans	-60.2	-43.2	174.4	-99.1	152.3	0	0	0	112.4	F1250 Q1253 E1279 S1285 K1286 R1291 L1292 L1293	F1250-L1289 HydrophobicContact CD1-CD2 4.27Å; F1250-L1289 HydrophobicContact CE1-CD2 4.01Å; F1250-L1289 HydrophobicContact CE1-CG 4.14Å; Q1253-L1289 VanDerWaalsContact NE2-CD1 3.33Å; Q1253-L1289 VanDerWaalsContact NE2-CD2 3.33Å; E1279-L1289 HydrophobicContact CG-CD1 3.74Å; S1285-L1289 WeakPolarHBondContact O-CG 3.49Å; S1285-L1289 PolarHBondContact O-N 2.95Å; S1285-L1289 VanDerWaalsContact O-N 3.14Å; K1286-L1289 PolarHBondContact O-N 3.11Å; L1289-R1291 VanDerWaalsContact C-N 3.3Å; L1289-R1291 PolarHBondContact O-N 3.15Å; L1289-L1292 PolarHBondContact O-N 3.24Å; L1289-L1292 VanDerWaalsContact O-N 3.14Å; L1289-L1293 HydrophobicContact CD2-CD1 4.14Å; L1289-L1293 VanDerWaalsContact O-CB 3.3Å; L1289-L1293 WeakPolarHBondContact O-CB 3.28Å; L1289-L1293 WeakPolarHBondContact O-CD1 3.34Å; L1289-L1293 VanDerWaalsContact O-CG 3.3Å; L1289-L1293 WeakPolarHBondContact O-CG 3.31Å; L1289-L1293 PolarHBondContact O-N 3.18Å; L1289-L1293 VanDerWaalsContact O-N 3.1Å
1290	S	45	Very low	50.9	Low	63.8 Å²	63.8	98.3 Å²	98.3	45%	0.446	46%	0.464	S	S	.	.	H	α-helix	trans	-65	-31.1	176.6	52.6	0	0	0	0	113.6	K1286 R1287 Q1288 S1294	K1286-S1290 PolarHBondContact O-N 3.02Å; K1286-S1290 PolarHBondContact O-OG 3.13Å; R1287-S1290 WeakPolarHBondContact CA-OG 3.14Å; R1287-S1290 PolarHBondContact O-N 3.37Å; R1287-S1290 PolarHBondContact O-OG 3.09Å; Q1288-S1290 PolarHBondContact O-N 3.03Å; S1290-S1294 WeakPolarHBondContact O-CA 3.21Å; S1290-S1294 WeakPolarHBondContact O-CB 3.07Å; S1290-S1294 PolarHBondContact O-N 3.09Å; S1290-S1294 VanDerWaalsContact O-N 3.11Å
1291	R	43.4	Very low	49.7	Very low	130 Å²	130	96.7 Å²	96.7	49%	0.491	46%	0.458	S	S	.	.	H	α-helix	trans	-69.2	-39.1	171.2	-73.5	170.9	175.4	166	-5.3	112.1	E1279 R1287 Q1288 L1289 L1293 S1294 Y1295	E1279-R1291 VanDerWaalsContact CD-NH2 3.3Å; E1279-R1291 IonicContact OE1-CZ 3.55Å; E1279-R1291 IonicContact OE1-NE 3.62Å; E1279-R1291 IonicContact OE1-NH2 3.12Å; E1279-R1291 PolarHBondContact OE1-NH2 3.31Å; E1279-R1291 IonicContact OE2-CZ 2.75Å; E1279-R1291 IonicContact OE2-NH2 3.07Å; E1279-R1291 PolarHBondContact OE2-NH2 2.81Å; E1279-R1291 VanDerWaalsContact OE2-NH2 3.11Å; R1287-R1291 WeakPolarHBondContact O-CB 3.46Å; R1287-R1291 WeakPolarHBondContact O-CD 3.4Å; R1287-R1291 VanDerWaalsContact O-CG 3.23Å; R1287-R1291 WeakPolarHBondContact O-CG 3.36Å; R1287-R1291 PolarHBondContact O-N 3.33Å; R1287-R1291 VanDerWaalsContact O-N 3.13Å; Q1288-R1291 WeakPolarHBondContact O-CA 3.49Å; Q1288-R1291 WeakPolarHBondContact O-CB 3.4Å; Q1288-R1291 PolarHBondContact O-N 3.2Å; L1289-R1291 VanDerWaalsContact C-N 3.3Å; L1289-R1291 PolarHBondContact O-N 3.15Å; R1291-L1293 VanDerWaalsContact C-N 3.33Å; R1291-L1293 PolarHBondContact O-N 3.04Å; R1291-S1294 WeakPolarHBondContact O-CB 3.43Å; R1291-S1294 PolarHBondContact O-N 2.9Å; R1291-S1294 PolarHBondContact O-OG 3.23Å; R1291-Y1295 WeakPolarHBondContact O-CD2 3.4Å
1292	L	41	Very low	48.2	Very low	93.8 Å²	93.8	96.5 Å²	96.5	49%	0.491	47%	0.465	S	S	.	.	H	α-helix	trans	-70.3	-37.5	176.6	-74.1	166.3	0	0	0	112.5	F1250 Q1288 L1289 S1294 Y1295 R1296	F1250-L1292 HydrophobicContact CB-CD1 4.34Å; F1250-L1292 HydrophobicContact CD1-CD1 3.88Å; F1250-L1292 HydrophobicContact CE1-CD1 4.4Å; F1250-L1292 HydrophobicContact CG-CD1 4.13Å; Q1288-L1292 WeakPolarHBondContact O-CG 3.35Å; Q1288-L1292 PolarHBondContact O-N 3.23Å; Q1288-L1292 VanDerWaalsContact O-N 3.13Å; L1289-L1292 PolarHBondContact O-N 3.24Å; L1289-L1292 VanDerWaalsContact O-N 3.14Å; L1292-S1294 VanDerWaalsContact C-N 3.31Å; L1292-S1294 PolarHBondContact O-N 3.3Å; L1292-Y1295 PolarHBondContact O-N 3Å; L1292-R1296 VanDerWaalsContact O-CB 3.27Å; L1292-R1296 WeakPolarHBondContact O-CB 3.45Å; L1292-R1296 PolarHBondContact O-N 3.35Å
1293	L	41.7	Very low	46.9	Very low	79 Å²	79	98.4 Å²	98.4	41%	0.414	48%	0.477	S	S	.	.	H	α-helix	trans	-77.5	-9.8	179.2	-68.4	169.5	0	0	0	113.6	L1289 R1291 Y1295 R1296 R1297 L1298	L1289-L1293 HydrophobicContact CD2-CD1 4.14Å; L1289-L1293 VanDerWaalsContact O-CB 3.3Å; L1289-L1293 WeakPolarHBondContact O-CB 3.28Å; L1289-L1293 WeakPolarHBondContact O-CD1 3.34Å; L1289-L1293 VanDerWaalsContact O-CG 3.3Å; L1289-L1293 WeakPolarHBondContact O-CG 3.31Å; L1289-L1293 PolarHBondContact O-N 3.18Å; L1289-L1293 VanDerWaalsContact O-N 3.1Å; R1291-L1293 VanDerWaalsContact C-N 3.33Å; R1291-L1293 PolarHBondContact O-N 3.04Å; L1293-Y1295 PolarHBondContact O-N 3.07Å; L1293-R1296 WeakPolarHBondContact O-CB 3.46Å; L1293-R1296 PolarHBondContact O-N 3.02Å; L1293-R1297 PolarHBondContact O-N 3.07Å; L1293-L1298 HydrophobicContact CB-CD1 4.44Å; L1293-L1298 HydrophobicContact CD2-CD1 4.2Å
1294	S	46.6	Very low	46.2	Very low	50.4 Å²	50.4	100.5 Å²	100.5	35%	0.352	48%	0.476	S	S	.	.	H	α-helix	trans	-62.3	129.2	174.6	62.3	0	0	0	0	111.1	S1290 R1291 L1292 R1296 R1297 L1298	S1290-S1294 WeakPolarHBondContact O-CA 3.21Å; S1290-S1294 WeakPolarHBondContact O-CB 3.07Å; S1290-S1294 PolarHBondContact O-N 3.09Å; S1290-S1294 VanDerWaalsContact O-N 3.11Å; R1291-S1294 WeakPolarHBondContact O-CB 3.43Å; R1291-S1294 PolarHBondContact O-N 2.9Å; R1291-S1294 PolarHBondContact O-OG 3.23Å; L1292-S1294 VanDerWaalsContact C-N 3.31Å; L1292-S1294 PolarHBondContact O-N 3.3Å; S1294-R1296 VanDerWaalsContact C-N 3.27Å; S1294-R1296 PolarHBondContact O-N 3.03Å; S1294-R1297 PolarHBondContact O-N 2.94Å; S1294-L1298 WeakPolarHBondContact O-CG 3.4Å; S1294-L1298 PolarHBondContact O-N 3.12Å
1295	Y	42.7	Very low	45.9	Very low	165.8 Å²	165.8	102.6 Å²	102.6	65%	0.65	48%	0.481	S	S	*	.	H	α-helix	trans	-59.1	-26.3	-174.5	-114	-87.1	0	0	0	113.5	R1291 L1292 L1293 L1298 R1299	R1291-Y1295 WeakPolarHBondContact O-CD2 3.4Å; L1292-Y1295 PolarHBondContact O-N 3Å; L1293-Y1295 PolarHBondContact O-N 3.07Å; Y1295-L1298 PolarHBondContact O-N 3.12Å; Y1295-R1299 WeakPolarHBondContact O-CB 3.32Å; Y1295-R1299 PolarHBondContact O-N 3.26Å; Y1295-R1299 VanDerWaalsContact O-N 3.09Å
1296	R	46.3	Very low	45.9	Very low	117.4 Å²	117.4	103.8 Å²	103.8	44%	0.443	49%	0.49	S	S	.	.	H	α-helix	trans	-68.7	-46.2	172.8	-115.4	-179.3	177.9	177	-2.6	112.9	D1254 A1257 S1258 L1292 L1293 S1294 L1298 R1299 E1300	D1254-R1296 PolarHBondContact O-NH2 3.5Å; D1254-R1296 IonicContact OD1-CZ 2.65Å; D1254-R1296 IonicContact OD1-NE 3.61Å; D1254-R1296 PolarHBondContact OD1-NE 3.03Å; D1254-R1296 IonicContact OD1-NH1 3.93Å; D1254-R1296 PolarHBondContact OD1-NH1 3.23Å; D1254-R1296 IonicContact OD1-NH2 3.2Å; D1254-R1296 PolarHBondContact OD1-NH2 3.36Å; A1257-R1296 PolarHBondContact O-NH2 3.06Å; S1258-R1296 VanDerWaalsContact N-NH2 3.17Å; L1292-R1296 VanDerWaalsContact O-CB 3.27Å; L1292-R1296 WeakPolarHBondContact O-CB 3.45Å; L1292-R1296 PolarHBondContact O-N 3.35Å; L1293-R1296 WeakPolarHBondContact O-CB 3.46Å; L1293-R1296 PolarHBondContact O-N 3.02Å; S1294-R1296 VanDerWaalsContact C-N 3.27Å; S1294-R1296 PolarHBondContact O-N 3.03Å; R1296-L1298 VanDerWaalsContact C-N 3.34Å; R1296-L1298 PolarHBondContact O-N 3.12Å; R1296-R1299 CarbonylContact O-C 3.6Å; R1296-R1299 WeakPolarHBondContact O-CA 3.29Å; R1296-R1299 VanDerWaalsContact O-CB 3.31Å; R1296-R1299 WeakPolarHBondContact O-CB 3.24Å; R1296-R1299 PolarHBondContact O-N 3.19Å; R1296-R1299 VanDerWaalsContact O-N 3.13Å; R1296-E1300 PolarHBondContact O-N 2.94Å
1297	R	44.3	Very low	45.6	Very low	148.4 Å²	148.4	102.6 Å²	102.6	56%	0.56	49%	0.494	S	S	*	.	H	α-helix	trans	-65.8	-40.9	-179.7	-116.6	177.5	-176.5	157.1	2	111.7	L1293 S1294 R1299 E1300 I1301	L1293-R1297 PolarHBondContact O-N 3.07Å; S1294-R1297 PolarHBondContact O-N 2.94Å; R1297-R1299 VanDerWaalsContact C-N 3.3Å; R1297-R1299 PolarHBondContact O-N 2.95Å; R1297-E1300 PolarHBondContact O-N 3.25Å; R1297-I1301 HydrophobicContact CG-CD1 4.4Å; R1297-I1301 VanDerWaalsContact O-CB 3.31Å; R1297-I1301 WeakPolarHBondContact O-CB 3.34Å; R1297-I1301 WeakPolarHBondContact O-CD1 3.34Å; R1297-I1301 VanDerWaalsContact O-CG1 3.23Å; R1297-I1301 WeakPolarHBondContact O-CG1 3.27Å; R1297-I1301 PolarHBondContact O-N 3.23Å
1298	L	47	Very low	45	Very low	91.2 Å²	91.2	104.3 Å²	104.3	48%	0.477	51%	0.51	S	S	.	.	H	α-helix	trans	-61.4	-34.8	171.6	-77.8	166.2	0	0	0	112.6	L1293 S1294 Y1295 R1296 I1301 S1302	L1293-L1298 HydrophobicContact CB-CD1 4.44Å; L1293-L1298 HydrophobicContact CD2-CD1 4.2Å; S1294-L1298 WeakPolarHBondContact O-CG 3.4Å; S1294-L1298 PolarHBondContact O-N 3.12Å; Y1295-L1298 PolarHBondContact O-N 3.12Å; R1296-L1298 VanDerWaalsContact C-N 3.34Å; R1296-L1298 PolarHBondContact O-N 3.12Å; L1298-I1301 PolarHBondContact O-N 3.36Å; L1298-S1302 VanDerWaalsContact O-CB 3.24Å; L1298-S1302 WeakPolarHBondContact O-CB 3.35Å; L1298-S1302 PolarHBondContact O-N 3.36Å
1299	R	46.9	Very low	44.6	Very low	140.2 Å²	140.2	104.3 Å²	104.3	53%	0.529	52%	0.517	S	S	.	.	H	α-helix	trans	-71.1	-42.4	176.1	-168.1	177.2	-132.7	172.1	0.2	112.3	R1113 D1254 Y1295 R1296 R1297 S1302 Q1303	R1113-R1299 VanDerWaalsContact NH1-CD 3.34Å; D1254-R1299 IonicContact OD2-CZ 3.01Å; D1254-R1299 IonicContact OD2-NH1 2.84Å; D1254-R1299 PolarHBondContact OD2-NH1 3.37Å; D1254-R1299 VanDerWaalsContact OD2-NH1 3.16Å; Y1295-R1299 WeakPolarHBondContact O-CB 3.32Å; Y1295-R1299 PolarHBondContact O-N 3.26Å; Y1295-R1299 VanDerWaalsContact O-N 3.09Å; R1296-R1299 CarbonylContact O-C 3.6Å; R1296-R1299 WeakPolarHBondContact O-CA 3.29Å; R1296-R1299 VanDerWaalsContact O-CB 3.31Å; R1296-R1299 WeakPolarHBondContact O-CB 3.24Å; R1296-R1299 PolarHBondContact O-N 3.19Å; R1296-R1299 VanDerWaalsContact O-N 3.13Å; R1297-R1299 VanDerWaalsContact C-N 3.3Å; R1297-R1299 PolarHBondContact O-N 2.95Å; R1299-S1302 PolarHBondContact O-N 2.92Å; R1299-Q1303 WeakPolarHBondContact O-CB 3.21Å; R1299-Q1303 VanDerWaalsContact O-CG 3.31Å; R1299-Q1303 WeakPolarHBondContact O-CG 3.43Å; R1299-Q1303 PolarHBondContact O-N 3.09Å
1300	E	47.1	Very low	44.3	Very low	96.4 Å²	96.4	113.3 Å²	113.3	45%	0.45	55%	0.547	S	S	.	.	H	α-helix	trans	-66.2	-40.3	174.3	-73.6	176.4	-160.9	0	0	112.4	R1296 R1297 Q1303 K1304	R1296-E1300 PolarHBondContact O-N 2.94Å; R1297-E1300 PolarHBondContact O-N 3.25Å; E1300-Q1303 PolarHBondContact O-N 3.06Å; E1300-K1304 WeakPolarHBondContact O-CB 3.32Å; E1300-K1304 VanDerWaalsContact O-CG 3.29Å; E1300-K1304 WeakPolarHBondContact O-CG 3.39Å; E1300-K1304 PolarHBondContact O-N 3.07Å; E1300-K1304 IonicContact OE2-NZ 3.41Å
1301	I	49.4	Very low	43.7	Very low	88.6 Å²	88.6	116.7 Å²	116.7	45%	0.454	56%	0.56	S	S	.	*	H	α-helix	trans	-65.5	-46.6	174.8	-70.4	165.1	0	0	0	109.9	R1297 L1298 Q1303 K1304 I1305	R1297-I1301 HydrophobicContact CG-CD1 4.4Å; R1297-I1301 VanDerWaalsContact O-CB 3.31Å; R1297-I1301 WeakPolarHBondContact O-CB 3.34Å; R1297-I1301 WeakPolarHBondContact O-CD1 3.34Å; R1297-I1301 VanDerWaalsContact O-CG1 3.23Å; R1297-I1301 WeakPolarHBondContact O-CG1 3.27Å; R1297-I1301 PolarHBondContact O-N 3.23Å; L1298-I1301 PolarHBondContact O-N 3.36Å; I1301-Q1303 VanDerWaalsContact C-N 3.34Å; I1301-Q1303 PolarHBondContact O-N 3.11Å; I1301-K1304 PolarHBondContact O-N 3.1Å; I1301-I1305 HydrophobicContact CG2-CD1 3.64Å; I1301-I1305 HydrophobicContact CG2-CG1 4.36Å; I1301-I1305 WeakPolarHBondContact O-CB 3.3Å; I1301-I1305 VanDerWaalsContact O-CG1 3.28Å; I1301-I1305 WeakPolarHBondContact O-CG1 3.4Å; I1301-I1305 PolarHBondContact O-N 3.15Å
1302	S	44.7	Very low	43.2	Very low	60.2 Å²	60.2	115.6 Å²	115.6	42%	0.421	57%	0.572	S	S	.	*	H	α-helix	trans	-57.4	-45.7	174.5	172.6	0	0	0	0	112	R1061 L1298 R1299 K1304 I1305 S1306	R1061-S1302 PolarHBondContact NH2-OG 3.36Å; L1298-S1302 VanDerWaalsContact O-CB 3.24Å; L1298-S1302 WeakPolarHBondContact O-CB 3.35Å; L1298-S1302 PolarHBondContact O-N 3.36Å; R1299-S1302 PolarHBondContact O-N 2.92Å; S1302-K1304 PolarHBondContact O-N 2.91Å; S1302-I1305 PolarHBondContact O-N 3.07Å; S1302-S1306 VanDerWaalsContact O-CB 3.31Å; S1302-S1306 WeakPolarHBondContact O-CB 3.32Å; S1302-S1306 PolarHBondContact O-N 3.07Å; S1302-S1306 PolarHBondContact O-OG 3.28Å; S1302-S1306 VanDerWaalsContact O-OG 3.1Å
1303	Q	48.4	Very low	42.6	Very low	115.2 Å²	115.2	119.1 Å²	119.1	54%	0.538	59%	0.586	S	S	.	*	H	α-helix	trans	-65.1	-41.7	177.6	-75.9	179.2	-53.3	0	0	112.3	R1299 E1300 I1301 I1305 S1306 T1307	R1299-Q1303 WeakPolarHBondContact O-CB 3.21Å; R1299-Q1303 VanDerWaalsContact O-CG 3.31Å; R1299-Q1303 WeakPolarHBondContact O-CG 3.43Å; R1299-Q1303 PolarHBondContact O-N 3.09Å; E1300-Q1303 PolarHBondContact O-N 3.06Å; I1301-Q1303 VanDerWaalsContact C-N 3.34Å; I1301-Q1303 PolarHBondContact O-N 3.11Å; Q1303-I1305 PolarHBondContact O-N 3.28Å; Q1303-S1306 CarbonylContact O-C 3.56Å; Q1303-S1306 WeakPolarHBondContact O-CA 3.26Å; Q1303-S1306 PolarHBondContact O-N 3.21Å; Q1303-T1307 WeakPolarHBondContact O-CG2 3.38Å; Q1303-T1307 PolarHBondContact O-N 3.22Å; Q1303-T1307 VanDerWaalsContact O-N 3.14Å; Q1303-T1307 PolarHBondContact O-OG1 3.14Å; Q1303-T1307 VanDerWaalsContact O-OG1 3.08Å
1304	K	48.5	Very low	42.2	Very low	138.8 Å²	138.8	123.2 Å²	123.2	60%	0.603	61%	0.608	S	S	*	*	H	α-helix	trans	-65.4	-38.9	176.4	-75.2	172.8	178.7	173.1	0	112.8	E1300 I1301 S1302 S1306 T1307 L1308	E1300-K1304 WeakPolarHBondContact O-CB 3.32Å; E1300-K1304 VanDerWaalsContact O-CG 3.29Å; E1300-K1304 WeakPolarHBondContact O-CG 3.39Å; E1300-K1304 PolarHBondContact O-N 3.07Å; E1300-K1304 IonicContact OE2-NZ 3.41Å; I1301-K1304 PolarHBondContact O-N 3.1Å; S1302-K1304 PolarHBondContact O-N 2.91Å; K1304-S1306 VanDerWaalsContact C-N 3.25Å; K1304-S1306 PolarHBondContact O-N 2.85Å; K1304-T1307 WeakPolarHBondContact CA-OG1 3.35Å; K1304-T1307 PolarHBondContact O-N 3.24Å; K1304-T1307 VanDerWaalsContact O-N 3.13Å; K1304-T1307 PolarHBondContact O-OG1 3.06Å; K1304-L1308 PolarHBondContact O-N 3.2Å
1305	I	49.9	Very low	41.3	Very low	109.4 Å²	109.4	124.5 Å²	124.5	56%	0.561	62%	0.622	S	S	*	*	H	α-helix	trans	-65.2	-40.3	173.4	-69.4	168.9	0	0	0	110.6	I1301 S1302 Q1303 T1307 L1308	I1301-I1305 HydrophobicContact CG2-CD1 3.64Å; I1301-I1305 HydrophobicContact CG2-CG1 4.36Å; I1301-I1305 WeakPolarHBondContact O-CB 3.3Å; I1301-I1305 VanDerWaalsContact O-CG1 3.28Å; I1301-I1305 WeakPolarHBondContact O-CG1 3.4Å; I1301-I1305 PolarHBondContact O-N 3.15Å; S1302-I1305 PolarHBondContact O-N 3.07Å; Q1303-I1305 PolarHBondContact O-N 3.28Å; I1305-T1307 VanDerWaalsContact C-N 3.26Å; I1305-T1307 PolarHBondContact O-N 3.07Å; I1305-L1308 PolarHBondContact O-N 3.2Å
1306	S	44.6	Very low	40.9	Very low	88 Å²	88	123.7 Å²	123.7	62%	0.615	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.8	-5.1	178.1	-57.2	0	0	0	0	114.7	R1061 S1302 Q1303 K1304	R1061-S1306 PolarHBondContact NH1-OG 2.93Å; S1302-S1306 VanDerWaalsContact O-CB 3.31Å; S1302-S1306 WeakPolarHBondContact O-CB 3.32Å; S1302-S1306 PolarHBondContact O-N 3.07Å; S1302-S1306 PolarHBondContact O-OG 3.28Å; S1302-S1306 VanDerWaalsContact O-OG 3.1Å; Q1303-S1306 CarbonylContact O-C 3.56Å; Q1303-S1306 WeakPolarHBondContact O-CA 3.26Å; Q1303-S1306 PolarHBondContact O-N 3.21Å; K1304-S1306 VanDerWaalsContact C-N 3.25Å; K1304-S1306 PolarHBondContact O-N 2.85Å
1307	T	45.8	Very low	40.3	Very low	108.8 Å²	108.8	123.7 Å²	123.7	67%	0.667	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.9	1.6	176.9	51.2	0	0	0	0	114.3	Q1303 K1304 I1305 T1309	Q1303-T1307 WeakPolarHBondContact O-CG2 3.38Å; Q1303-T1307 PolarHBondContact O-N 3.22Å; Q1303-T1307 VanDerWaalsContact O-N 3.14Å; Q1303-T1307 PolarHBondContact O-OG1 3.14Å; Q1303-T1307 VanDerWaalsContact O-OG1 3.08Å; K1304-T1307 WeakPolarHBondContact CA-OG1 3.35Å; K1304-T1307 PolarHBondContact O-N 3.24Å; K1304-T1307 VanDerWaalsContact O-N 3.13Å; K1304-T1307 PolarHBondContact O-OG1 3.06Å; I1305-T1307 VanDerWaalsContact C-N 3.26Å; I1305-T1307 PolarHBondContact O-N 3.07Å; T1307-T1309 PolarHBondContact O-N 3.09Å
1308	L	36.2	Very low	39.8	Very low	129.2 Å²	129.2	122 Å²	122	68%	0.676	65%	0.652	S	S	*	*			trans	-87.2	111.3	172.2	-71.9	168.4	0	0	0	109.2	K1304 I1305	K1304-L1308 PolarHBondContact O-N 3.2Å; I1305-L1308 PolarHBondContact O-N 3.2Å
1309	T	36.4	Very low	39	Very low	109.2 Å²	109.2	125.4 Å²	125.4	67%	0.67	67%	0.67	S	S	*	*			trans	-67.6	140.5	168.2	44.9	0	0	0	0	109.8	T1307 D1311	T1307-T1309 PolarHBondContact O-N 3.09Å; T1309-D1311 VanDerWaalsContact C-N 3.29Å; T1309-D1311 VanDerWaalsContact CB-OD2 3.25Å; T1309-D1311 WeakPolarHBondContact CB-OD2 3.33Å; T1309-D1311 PolarHBondContact O-N 3.25Å; T1309-D1311 VanDerWaalsContact O-N 3.1Å; T1309-D1311 PolarHBondContact OG1-OD2 3.13Å; T1309-D1311 VanDerWaalsContact OG1-OD2 3.07Å
1310	W	34	Very low	38.4	Very low	255.8 Å²	255.8	126.3 Å²	126.3	97%	0.969	68%	0.684	S	S	*	*			trans	-83.2	67.2	177.4	-71.7	84.3	0	0	0	110.3	S1312	W1310-S1312 PolarHBondContact O-N 3.39Å
1311	D	33.3	Very low	37.6	Very low	135.6 Å²	135.6	129.2 Å²	129.2	73%	0.725	70%	0.701	S	S	*	*			trans	-81	116.3	170.2	-65.5	-63.4	0	0	0	109	T1309	T1309-D1311 VanDerWaalsContact C-N 3.29Å; T1309-D1311 VanDerWaalsContact CB-OD2 3.25Å; T1309-D1311 WeakPolarHBondContact CB-OD2 3.33Å; T1309-D1311 PolarHBondContact O-N 3.25Å; T1309-D1311 VanDerWaalsContact O-N 3.1Å; T1309-D1311 PolarHBondContact OG1-OD2 3.13Å; T1309-D1311 VanDerWaalsContact OG1-OD2 3.07Å
1312	S	32	Very low	36.6	Very low	105.4 Å²	105.4	134.8 Å²	134.8	74%	0.737	72%	0.717	S	S	*	*			trans	-77.6	172.6	178.2	-166.4	0	0	0	0	111.2	W1310	W1310-S1312 PolarHBondContact O-N 3.39Å
1313	E	29.6	Very low	35.7	Very low	168 Å²	168	137.7 Å²	137.7	79%	0.785	73%	0.734	S	S	*	*			trans	63.8	74.1	168.3	-59.4	179.1	-157.7	0	0	116
1314	N	32.3	Very low	34.9	Very low	166.2 Å²	166.2	138.7 Å²	138.7	89%	0.889	74%	0.742	S	S	*	*				-168.1	161.2	112.6	-104.6	-71.1	0	0	0	113.4
1315	A	28.7	Very low	33.8	Very low	77 Å²	77	139.4 Å²	139.4	64%	0.636	75%	0.752	S	S	*	*			trans	-61.4	152.4	-175.4	0	0	0	0	0	116.5
1316	N	33.8	Very low	32.8	Very low	148.6 Å²	148.6	142.8 Å²	142.8	80%	0.795	76%	0.763	S	S	*	*			trans	81.1	99.1	168.1	-50.6	-52.6	0	0	0	117.3	P1318	N1316-P1318 WeakPolarHBondContact O-CD 3.33Å
1317	P	33.1	Very low	32	Very low	117.2 Å²	117.2	143.2 Å²	143.2	76%	0.761	77%	0.766	S	S	*	*			trans	-76.3	133.2	170.4	31.2	-33.3	0	0	0	111.8	L1319	P1317-L1319 PolarHBondContact O-N 2.95Å
1318	P	34.5	Very low	31.2	Very low	113.4 Å²	113.4	145.9 Å²	145.9	74%	0.736	77%	0.773	S	S	*	*			trans	-76.3	119.4	178.7	29.3	-33.5	0	0	0	112.1	N1316 L1320	N1316-P1318 WeakPolarHBondContact O-CD 3.33Å; P1318-L1320 PolarHBondContact O-N 3.24Å
1319	L	30.2	Very low	30.9	Very low	162 Å²	162	146.8 Å²	146.8	85%	0.848	78%	0.778	S	S	*	*			trans	-67.2	99.1	176.3	-67.1	171.4	0	0	0	111.9	P1317 I1321	P1317-L1319 PolarHBondContact O-N 2.95Å; L1319-I1321 VanDerWaalsContact C-N 3.3Å; L1319-I1321 PolarHBondContact O-N 3.25Å
1320	L	33	Very low	30.6	Very low	159.2 Å²	159.2	151 Å²	151	83%	0.834	79%	0.788	S	S	*	*			trans	-107.5	49.3	171.7	-68	-178.9	0	0	0	112.8	P1318 R1322	P1318-L1320 PolarHBondContact O-N 3.24Å; L1320-R1322 VanDerWaalsContact C-N 3.27Å; L1320-R1322 PolarHBondContact O-N 3.38Å; L1320-R1322 VanDerWaalsContact O-N 3.09Å
1321	I	30.7	Very low	30.5	Very low	157.2 Å²	157.2	146.9 Å²	146.9	81%	0.806	78%	0.779	S	S	*	*			trans	-104.5	95.3	147.3	-59.4	177.1	0	0	0	109.2	L1319	L1319-I1321 VanDerWaalsContact C-N 3.3Å; L1319-I1321 PolarHBondContact O-N 3.25Å
1322	R	28.1	Very low	30.4	Very low	206.4 Å²	206.4	149.4 Å²	149.4	78%	0.779	78%	0.784	S	S	*	*			trans	-176	102.2	156	-105.9	170.4	-178.7	179.9	1.2	113.3	L1320 L1324	L1320-R1322 VanDerWaalsContact C-N 3.27Å; L1320-R1322 PolarHBondContact O-N 3.38Å; L1320-R1322 VanDerWaalsContact O-N 3.09Å; R1322-L1324 VanDerWaalsContact C-N 3.29Å; R1322-L1324 HydrophobicContact CB-CB 4.2Å; R1322-L1324 HydrophobicContact CB-CD1 4.24Å; R1322-L1324 HydrophobicContact CB-CD2 4.13Å; R1322-L1324 HydrophobicContact CB-CG 4.15Å; R1322-L1324 HydrophobicContact CG-CD1 4.31Å; R1322-L1324 HydrophobicContact CG-CD2 4.48Å; R1322-L1324 HydrophobicContact CG-CG 3.97Å; R1322-L1324 PolarHBondContact O-N 2.96Å; R1322-L1324 VanDerWaalsContact O-N 3.13Å
1323	P	27.5	Very low	30.4	Very low	121.4 Å²	121.4	149.3 Å²	149.3	79%	0.788	79%	0.789	S	S	*	*			trans	-70.1	104.7	162	21.5	-20.9	0	0	0	108.7	L1325	P1323-L1325 VanDerWaalsContact C-N 3.32Å; P1323-L1325 PolarHBondContact O-N 3.21Å
1324	L	29.8	Very low	30.5	Very low	135.4 Å²	135.4	152.1 Å²	152.1	71%	0.709	79%	0.793	S	S	*	*			trans	-79.4	101.2	-175.7	-80.6	175.3	0	0	0	112.2	R1322 F1326	R1322-L1324 VanDerWaalsContact C-N 3.29Å; R1322-L1324 HydrophobicContact CB-CB 4.2Å; R1322-L1324 HydrophobicContact CB-CD1 4.24Å; R1322-L1324 HydrophobicContact CB-CD2 4.13Å; R1322-L1324 HydrophobicContact CB-CG 4.15Å; R1322-L1324 HydrophobicContact CG-CD1 4.31Å; R1322-L1324 HydrophobicContact CG-CD2 4.48Å; R1322-L1324 HydrophobicContact CG-CG 3.97Å; R1322-L1324 PolarHBondContact O-N 2.96Å; R1322-L1324 VanDerWaalsContact O-N 3.13Å; L1324-F1326 VanDerWaalsContact C-N 3.27Å; L1324-F1326 HydrophobicContact CB-CD2 4.22Å; L1324-F1326 HydrophobicContact CB-CE2 4.32Å; L1324-F1326 HydrophobicContact CD1-CE2 4.29Å; L1324-F1326 HydrophobicContact CD2-CE2 3.92Å; L1324-F1326 HydrophobicContact CD2-CZ 4.47Å; L1324-F1326 HydrophobicContact CG-CE2 4.31Å; L1324-F1326 PolarHBondContact O-N 2.99Å; L1324-F1326 VanDerWaalsContact O-N 3.13Å
1325	L	26.2	Very low	30.6	Very low	153.2 Å²	153.2	150.7 Å²	150.7	80%	0.802	79%	0.785	S	S	*	*			trans	-67.1	117.4	158.9	-81.7	152.1	0	0	0	110.2	P1323 S1327	P1323-L1325 VanDerWaalsContact C-N 3.32Å; P1323-L1325 PolarHBondContact O-N 3.21Å; L1325-S1327 PolarHBondContact O-N 3.32Å; L1325-S1327 VanDerWaalsContact O-N 3.15Å
1326	F	28.6	Very low	30.6	Very low	180.8 Å²	180.8	151.7 Å²	151.7	79%	0.793	79%	0.787	S	S	*	*			trans	-73.7	110	163.9	-74.2	-72.3	0	0	0	113.4	L1324 M1328	L1324-F1326 VanDerWaalsContact C-N 3.27Å; L1324-F1326 HydrophobicContact CB-CD2 4.22Å; L1324-F1326 HydrophobicContact CB-CE2 4.32Å; L1324-F1326 HydrophobicContact CD1-CE2 4.29Å; L1324-F1326 HydrophobicContact CD2-CE2 3.92Å; L1324-F1326 HydrophobicContact CD2-CZ 4.47Å; L1324-F1326 HydrophobicContact CG-CE2 4.31Å; L1324-F1326 PolarHBondContact O-N 2.99Å; L1324-F1326 VanDerWaalsContact O-N 3.13Å; F1326-M1328 HydrophobicContact CD1-CG 4.31Å
1327	S	28.1	Very low	30.4	Very low	98 Å²	98	153.4 Å²	153.4	69%	0.685	79%	0.788	S	S	*	*				-109.9	127.2	127.9	-163.6	0	0	0	0	111.4	L1325 N1329	L1325-S1327 PolarHBondContact O-N 3.32Å; L1325-S1327 VanDerWaalsContact O-N 3.15Å; S1327-N1329 VanDerWaalsContact C-N 3.34Å; S1327-N1329 PolarHBondContact O-N 3.35Å; S1327-N1329 PolarHBondContact OG-OD1 2.84Å
1328	M	28.6	Very low	30.3	Very low	163.8 Å²	163.8	154.9 Å²	154.9	81%	0.807	78%	0.783	S	S	*	*			trans	-74.5	117.9	169.2	-71.3	-81.3	93	0	0	110	F1326 K1330	F1326-M1328 HydrophobicContact CD1-CG 4.31Å; M1328-K1330 PolarHBondContact O-N 3.3Å; M1328-K1330 VanDerWaalsContact O-N 3.14Å
1329	N	31.2	Very low	30.1	Very low	148.4 Å²	148.4	156.2 Å²	156.2	79%	0.794	78%	0.779	S	S	*	*			trans	-94.2	122.8	168.6	-88.1	-13.4	0	0	0	110.9	S1327 E1331	S1327-N1329 VanDerWaalsContact C-N 3.34Å; S1327-N1329 PolarHBondContact O-N 3.35Å; S1327-N1329 PolarHBondContact OG-OD1 2.84Å; N1329-E1331 PolarHBondContact O-N 3.08Å
1330	K	29.3	Very low	30.1	Very low	198.4 Å²	198.4	157.3 Å²	157.3	86%	0.863	78%	0.78	S	S	*	*			trans	-76.7	116	166.5	-66.1	174.3	-179.9	175.3	0	110.8	M1328	M1328-K1330 PolarHBondContact O-N 3.3Å; M1328-K1330 VanDerWaalsContact O-N 3.14Å
1331	E	32.5	Very low	29.9	Very low	170.2 Å²	170.2	154.6 Å²	154.6	80%	0.795	77%	0.774	S	S	*	*			trans	-153.9	123.8	138.3	-106.3	-175	163.1	0	0	113.7	N1329	N1329-E1331 PolarHBondContact O-N 3.08Å
1332	K	30.4	Very low	30	Very low	188 Å²	188	154.1 Å²	154.1	82%	0.817	77%	0.768	S	S	*	*			trans	34.5	106.7	152.1	-61.6	166.2	-175.8	163.4	0	118.2
1333	A	31.8	Very low	30.2	Very low	103.4 Å²	103.4	153.4 Å²	153.4	86%	0.855	77%	0.771	S	S	*	*			trans	-125.1	147.3	148	0	0	0	0	0	113.5
1334	R	32.4	Very low	30.7	Very low	226.6 Å²	226.6	154.6 Å²	154.6	86%	0.855	77%	0.771	S	S	*	*			trans	-128.2	146.5	175.6	-119.6	177.4	177.8	160.1	-2.9	111.5
1335	N	33.1	Very low	31	Very low	136.6 Å²	136.6	152.1 Å²	152.1	73%	0.73	76%	0.761	S	S	*	*			trans	73.2	136.3	147.8	-65.5	-5.5	0	0	0	116.3
1336	S	28.8	Very low	31.2	Very low	97.4 Å²	97.4	152.3 Å²	152.3	68%	0.681	76%	0.755	S	S	*	*				62.3	131.4	78.9	27.7	0	0	0	0	114.2
1337	F	31.4	Very low	31.5	Very low	183.8 Å²	183.8	149.3 Å²	149.3	81%	0.806	75%	0.748	S	S	*	*				-179.8	151.2	109.8	-112.7	-111.5	0	0	0	114.2
1338	K	30.5	Very low	31.9	Very low	149.4 Å²	149.4	154.8 Å²	154.8	65%	0.65	75%	0.754	S	S	*	*			trans	26.7	151.1	152.3	-73.9	174.9	167.6	-126.7	0	119.9
1339	E	30.1	Very low	32.1	Very low	141.4 Å²	141.4	152.8 Å²	152.8	66%	0.661	75%	0.745	S	S	*	*				112.4	124.2	100.2	-95.5	145	-151	0	0	116.7	S1341	E1339-S1341 VanDerWaalsContact C-N 3.3Å; E1339-S1341 PolarHBondContact O-N 2.9Å
1340	Q	28.9	Very low	32.2	Very low	184.2 Å²	184.2	149.4 Å²	149.4	86%	0.861	73%	0.727	S	S	*	*				43.8	84.9	126.5	-134.5	130.7	-25.1	0	0	118.1
1341	S	29.1	Very low	32.3	Very low	102.2 Å²	102.2	145.1 Å²	145.1	72%	0.715	72%	0.721	S	S	*	*			trans	163.4	158.9	155.9	71.4	0	0	0	0	115.5	E1339 K1343	E1339-S1341 VanDerWaalsContact C-N 3.3Å; E1339-S1341 PolarHBondContact O-N 2.9Å; S1341-K1343 PolarHBondContact O-N 3.41Å
1342	Q	32.8	Very low	32.2	Very low	146.8 Å²	146.8	145.3 Å²	145.3	69%	0.686	72%	0.719	S	S	*	*			trans	84.2	59.5	162.9	-66.8	-172.2	26	0	0	119.4	N1344 V1345	Q1342-N1344 PolarHBondContact O-N 3.17Å; Q1342-V1345 HydrophobicContact CB-CG2 4.32Å; Q1342-V1345 HydrophobicContact CG-CG2 3.94Å; Q1342-V1345 PolarHBondContact O-N 3.01Å
1343	K	32.5	Very low	32.1	Very low	192 Å²	192	141.2 Å²	141.2	84%	0.835	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-47.9	3.4	166.1	-82.4	178.5	175.4	174.2	0	116.1	S1341	S1341-K1343 PolarHBondContact O-N 3.41Å
1344	N	38.6	Very low	32.1	Very low	147 Å²	147	142.9 Å²	142.9	79%	0.786	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87	10.5	176.7	-66.8	-9.2	0	0	0	114.6	Q1342	Q1342-N1344 PolarHBondContact O-N 3.17Å
1345	V	36.6	Very low	32.1	Very low	81.6 Å²	81.6	136.4 Å²	136.4	50%	0.495	69%	0.693	S	S	.	*	T	Hydrogen-bonded Turn	trans	-114.4	-36	174.6	173.1	0	0	0	0	112.1	Q1342 N1347 R1348 L1349	Q1342-V1345 HydrophobicContact CB-CG2 4.32Å; Q1342-V1345 HydrophobicContact CG-CG2 3.94Å; Q1342-V1345 PolarHBondContact O-N 3.01Å; V1345-N1347 VanDerWaalsContact C-N 3.34Å; V1345-N1347 PolarHBondContact O-N 3.38Å; V1345-R1348 WeakPolarHBondContact O-CB 3.37Å; V1345-R1348 PolarHBondContact O-N 3.07Å; V1345-L1349 HydrophobicContact CG1-CD1 3.93Å; V1345-L1349 PolarHBondContact O-N 3Å; V1345-L1349 VanDerWaalsContact O-N 3.17Å
1346	F	30.1	Very low	32	Very low	157.4 Å²	157.4	136.8 Å²	136.8	69%	0.69	69%	0.694	S	S	*	*	H	α-helix	trans	-63.3	-29.1	-172.4	-158.8	-110.5	0	0	0	113.5	R1348 L1349 L1350	F1346-R1348 PolarHBondContact O-N 3.19Å; F1346-L1349 PolarHBondContact O-N 3.26Å; F1346-L1350 HydrophobicContact CD1-CD1 3.75Å; F1346-L1350 HydrophobicContact CE1-CD1 3.52Å; F1346-L1350 VanDerWaalsContact CE1-CD1 3.47Å; F1346-L1350 HydrophobicContact CE1-CG 4.42Å; F1346-L1350 HydrophobicContact CG-CD1 4.41Å; F1346-L1350 HydrophobicContact CZ-CD1 4.16Å; F1346-L1350 PolarHBondContact O-N 3.12Å; F1346-L1350 VanDerWaalsContact O-N 3.1Å
1347	N	34.8	Very low	32.3	Very low	118.6 Å²	118.6	136.7 Å²	136.7	63%	0.634	69%	0.694	S	S	*	*	H	α-helix	trans	-79.9	-10.3	175.8	-79.6	-10.2	0	0	0	114.3	V1345 L1349 L1350 C1351	V1345-N1347 VanDerWaalsContact C-N 3.34Å; V1345-N1347 PolarHBondContact O-N 3.38Å; N1347-L1349 PolarHBondContact O-N 3.01Å; N1347-L1350 WeakPolarHBondContact OD1-CD1 3.38Å; N1347-C1351 PolarHBondContact O-SG 3.23Å
1348	R	35.2	Very low	32.7	Very low	214.6 Å²	214.6	131.1 Å²	131.1	81%	0.81	67%	0.671	S	S	*	*	H	α-helix	trans	-88.2	-13.4	174.6	-88.5	-175.6	177.2	-178.2	0.5	113.9	V1345 F1346	V1345-R1348 WeakPolarHBondContact O-CB 3.37Å; V1345-R1348 PolarHBondContact O-N 3.07Å; F1346-R1348 PolarHBondContact O-N 3.19Å
1349	L	33.2	Very low	33.4	Very low	120.8 Å²	120.8	128.7 Å²	128.7	63%	0.632	67%	0.666	S	S	*	*	H	α-helix	trans	-97	-30.2	177.5	-102.6	78.2	0	0	0	113.4	V1345 F1346 N1347 C1351 K1352 T1353	V1345-L1349 HydrophobicContact CG1-CD1 3.93Å; V1345-L1349 PolarHBondContact O-N 3Å; V1345-L1349 VanDerWaalsContact O-N 3.17Å; F1346-L1349 PolarHBondContact O-N 3.26Å; N1347-L1349 PolarHBondContact O-N 3.01Å; L1349-C1351 VanDerWaalsContact C-N 3.27Å; L1349-C1351 PolarHBondContact O-N 3.26Å; L1349-K1352 WeakPolarHBondContact O-CA 3.34Å; L1349-K1352 PolarHBondContact O-N 3.22Å; L1349-T1353 PolarHBondContact O-N 3.25Å; L1349-T1353 PolarHBondContact O-OG1 2.93Å; L1349-T1353 VanDerWaalsContact O-OG1 3.09Å
1350	L	33.8	Very low	34.1	Very low	77.4 Å²	77.4	125.8 Å²	125.8	41%	0.405	67%	0.666	S	S	.	*	H	α-helix	trans	-64.6	-29.7	179.4	-95.1	164.7	0	0	0	113.3	F1346 N1347 K1352 T1353 L1354	F1346-L1350 HydrophobicContact CD1-CD1 3.75Å; F1346-L1350 HydrophobicContact CE1-CD1 3.52Å; F1346-L1350 VanDerWaalsContact CE1-CD1 3.47Å; F1346-L1350 HydrophobicContact CE1-CG 4.42Å; F1346-L1350 HydrophobicContact CG-CD1 4.41Å; F1346-L1350 HydrophobicContact CZ-CD1 4.16Å; F1346-L1350 PolarHBondContact O-N 3.12Å; F1346-L1350 VanDerWaalsContact O-N 3.1Å; N1347-L1350 WeakPolarHBondContact OD1-CD1 3.38Å; L1350-K1352 PolarHBondContact O-N 3.32Å; L1350-K1352 VanDerWaalsContact O-N 3.14Å; L1350-T1353 VanDerWaalsContact CD2-OG1 3.23Å; L1350-T1353 WeakPolarHBondContact CD2-OG1 3.34Å; L1350-T1353 PolarHBondContact O-N 3.07Å; L1350-L1354 HydrophobicContact CD2-CD1 4.14Å; L1350-L1354 HydrophobicContact CD2-CG 4.37Å; L1350-L1354 WeakPolarHBondContact O-CB 3.27Å; L1350-L1354 VanDerWaalsContact O-CG 3.32Å; L1350-L1354 WeakPolarHBondContact O-CG 3.27Å; L1350-L1354 PolarHBondContact O-N 3.24Å; L1350-L1354 VanDerWaalsContact O-N 3.11Å
1351	C	31.6	Very low	35.1	Very low	108.6 Å²	108.6	124.7 Å²	124.7	73%	0.734	66%	0.66	S	S	*	*	H	α-helix	trans	-69.1	-3	176.8	-62.8	0	0	0	0	115	N1347 L1349	N1347-C1351 PolarHBondContact O-SG 3.23Å; L1349-C1351 VanDerWaalsContact C-N 3.27Å; L1349-C1351 PolarHBondContact O-N 3.26Å
1352	K	29.7	Very low	36.2	Very low	173.2 Å²	173.2	122 Å²	122	75%	0.753	65%	0.645	S	S	*	*	H	α-helix	trans	-103.6	-29.2	175.5	-80.5	-175.3	173	-178.8	0	113.6	L1349 L1350 S1355	L1349-K1352 WeakPolarHBondContact O-CA 3.34Å; L1349-K1352 PolarHBondContact O-N 3.22Å; L1350-K1352 PolarHBondContact O-N 3.32Å; L1350-K1352 VanDerWaalsContact O-N 3.14Å; K1352-S1355 WeakPolarHBondContact O-CB 3.48Å; K1352-S1355 PolarHBondContact O-OG 3.19Å
1353	T	29.7	Very low	37.4	Very low	103 Å²	103	115.9 Å²	115.9	63%	0.632	62%	0.616	S	S	*	*	H	α-helix	trans	-89.6	-14.1	-178.3	24.3	0	0	0	0	113.9	L1349 L1350 S1355	L1349-T1353 PolarHBondContact O-N 3.25Å; L1349-T1353 PolarHBondContact O-OG1 2.93Å; L1349-T1353 VanDerWaalsContact O-OG1 3.09Å; L1350-T1353 VanDerWaalsContact CD2-OG1 3.23Å; L1350-T1353 WeakPolarHBondContact CD2-OG1 3.34Å; L1350-T1353 PolarHBondContact O-N 3.07Å; T1353-S1355 PolarHBondContact O-N 3.12Å; T1353-S1355 VanDerWaalsContact O-N 3.16Å
1354	L	30.5	Very low	38.7	Very low	139 Å²	139	111.3 Å²	111.3	73%	0.728	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.2	5.9	173.6	-69.5	172.1	0	0	0	113.8	L1350 L1356	L1350-L1354 HydrophobicContact CD2-CD1 4.14Å; L1350-L1354 HydrophobicContact CD2-CG 4.37Å; L1350-L1354 WeakPolarHBondContact O-CB 3.27Å; L1350-L1354 VanDerWaalsContact O-CG 3.32Å; L1350-L1354 WeakPolarHBondContact O-CG 3.27Å; L1350-L1354 PolarHBondContact O-N 3.24Å; L1350-L1354 VanDerWaalsContact O-N 3.11Å; L1354-L1356 VanDerWaalsContact C-N 3.28Å; L1354-L1356 PolarHBondContact O-N 3.17Å
1355	S	32.2	Very low	39.8	Very low	89.6 Å²	89.6	108.3 Å²	108.3	63%	0.627	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.8	8.6	-175.4	61.3	0	0	0	0	115	K1352 T1353 S1357	K1352-S1355 WeakPolarHBondContact O-CB 3.48Å; K1352-S1355 PolarHBondContact O-OG 3.19Å; T1353-S1355 PolarHBondContact O-N 3.12Å; T1353-S1355 VanDerWaalsContact O-N 3.16Å; S1355-S1357 PolarHBondContact O-N 3.17Å
1356	L	31.3	Very low	41.3	Very low	145.6 Å²	145.6	104.6 Å²	104.6	76%	0.762	56%	0.557	S	S	*	*	S	Bend	trans	-126.8	2.5	-174.6	-77.2	166.7	0	0	0	117.6	L1354 I1358 Q1382	L1354-L1356 VanDerWaalsContact C-N 3.28Å; L1354-L1356 PolarHBondContact O-N 3.17Å; L1356-I1358 VanDerWaalsContact C-N 3.32Å; L1356-I1358 HydrophobicContact CD2-CD1 4.37Å; L1356-I1358 HydrophobicContact CD2-CG1 4.46Å; L1356-I1358 PolarHBondContact O-N 3.22Å; L1356-Q1382 HydrophobicContact CD1-CG 4.47Å; L1356-Q1382 HydrophobicContact CD2-CG 3.8Å
1357	S	34.7	Very low	43.6	Very low	95 Å²	95	97.3 Å²	97.3	66%	0.664	53%	0.525	S	S	*	.			trans	-106.6	88.3	172.5	-165.8	0	0	0	0	112	S1355 N1359	S1355-S1357 PolarHBondContact O-N 3.17Å; S1357-N1359 PolarHBondContact O-N 3.17Å; S1357-N1359 PolarHBondContact O-OD1 3.17Å; S1357-N1359 PolarHBondContact OG-OD1 3.16Å
1358	I	41.2	Very low	45.6	Very low	66.6 Å²	66.6	91.8 Å²	91.8	34%	0.342	50%	0.496	S	S	.	.			trans	-82.7	97.7	163.9	-58.6	-179.2	0	0	0	107.2	L1356 A1360 L1363 I1378 Q1382	L1356-I1358 VanDerWaalsContact C-N 3.32Å; L1356-I1358 HydrophobicContact CD2-CD1 4.37Å; L1356-I1358 HydrophobicContact CD2-CG1 4.46Å; L1356-I1358 PolarHBondContact O-N 3.22Å; I1358-A1360 PolarHBondContact O-N 3.02Å; I1358-L1363 HydrophobicContact CG2-CD1 3.65Å; I1358-L1363 VanDerWaalsContact CG2-CD1 3.45Å; I1358-L1363 HydrophobicContact CG2-CD2 4.28Å; I1358-L1363 HydrophobicContact CG2-CG 4.28Å; I1358-I1378 HydrophobicContact CD1-CG2 4.1Å; I1358-Q1382 HydrophobicContact CD1-CG 3.66Å
1359	N	45.5	Very low	47.4	Very low	99 Å²	99	84.6 Å²	84.6	53%	0.529	48%	0.482	S	S	.	.			trans	-59.3	119.9	178.8	-65.3	7.8	0	0	0	109.8	S1357 E1361 A1362	S1357-N1359 PolarHBondContact O-N 3.17Å; S1357-N1359 PolarHBondContact O-OD1 3.17Å; S1357-N1359 PolarHBondContact OG-OD1 3.16Å; N1359-E1361 VanDerWaalsContact C-N 3.27Å; N1359-E1361 PolarHBondContact O-N 3.08Å; N1359-A1362 WeakPolarHBondContact O-CB 3.32Å; N1359-A1362 PolarHBondContact O-N 2.97Å; N1359-A1362 VanDerWaalsContact O-N 3.11Å
1360	A	44.1	Very low	49.4	Very low	79.6 Å²	79.6	84.5 Å²	84.5	66%	0.658	48%	0.482	S	S	*	.	H	α-helix	trans	-58.7	-36.4	-171.4	0	0	0	0	0	113	I1358 A1362 L1363 E1364	I1358-A1360 PolarHBondContact O-N 3.02Å; A1360-A1362 VanDerWaalsContact C-N 3.28Å; A1360-A1362 PolarHBondContact O-N 3.15Å; A1360-L1363 PolarHBondContact O-N 3.1Å; A1360-L1363 VanDerWaalsContact O-N 3.14Å; A1360-E1364 PolarHBondContact O-N 3.05Å
1361	E	49.2	Very low	51.5	Low	160.2 Å²	160.2	82 Å²	82	75%	0.749	47%	0.468	S	S	*	.	H	α-helix	trans	-56.1	-35.2	177.8	-59	174.6	159.9	0	0	113	N1359 L1363 E1364	N1359-E1361 VanDerWaalsContact C-N 3.27Å; N1359-E1361 PolarHBondContact O-N 3.08Å; E1361-L1363 VanDerWaalsContact C-N 3.29Å; E1361-L1363 PolarHBondContact O-N 3.17Å; E1361-E1364 WeakPolarHBondContact O-CB 3.42Å; E1361-E1364 PolarHBondContact O-N 3.14Å
1362	A	52.5	Low	53.5	Low	47.4 Å²	47.4	80.7 Å²	80.7	39%	0.392	45%	0.447	S	S	.	.	H	α-helix	trans	-70.4	-24.8	179.8	0	0	0	0	0	112.8	N1359 A1360 C1366	N1359-A1362 WeakPolarHBondContact O-CB 3.32Å; N1359-A1362 PolarHBondContact O-N 2.97Å; N1359-A1362 VanDerWaalsContact O-N 3.11Å; A1360-A1362 VanDerWaalsContact C-N 3.28Å; A1360-A1362 PolarHBondContact O-N 3.15Å; A1362-C1366 PolarHBondContact O-SG 2.96Å; A1362-C1366 VanDerWaalsContact O-SG 3.36Å
1363	L	58.4	Low	55.4	Low	17 Å²	17	81.4 Å²	81.4	9%	0.089	45%	0.453	C	S	.	.	H	α-helix	trans	-81.7	-19	-179	-93.4	107.4	0	0	0	113.5	I1358 A1360 E1361 H1365 C1366 L1367 I1378 I1381	I1358-L1363 HydrophobicContact CG2-CD1 3.65Å; I1358-L1363 VanDerWaalsContact CG2-CD1 3.45Å; I1358-L1363 HydrophobicContact CG2-CD2 4.28Å; I1358-L1363 HydrophobicContact CG2-CG 4.28Å; A1360-L1363 PolarHBondContact O-N 3.1Å; A1360-L1363 VanDerWaalsContact O-N 3.14Å; E1361-L1363 VanDerWaalsContact C-N 3.29Å; E1361-L1363 PolarHBondContact O-N 3.17Å; L1363-H1365 VanDerWaalsContact C-N 3.27Å; L1363-H1365 PolarHBondContact O-N 3.18Å; L1363-C1366 HydrophobicContact CD2-CB 4.47Å; L1363-C1366 PolarHBondContact O-N 2.94Å; L1363-C1366 VanDerWaalsContact O-N 3.11Å; L1363-L1367 HydrophobicContact CD2-CD1 4.38Å; L1363-L1367 HydrophobicContact CG-CD1 4.25Å; L1363-L1367 PolarHBondContact O-N 3Å; L1363-I1378 HydrophobicContact CD1-CG1 4.25Å; L1363-I1378 HydrophobicContact CD1-CG2 4.42Å; L1363-I1378 HydrophobicContact CD2-CG1 4.2Å; L1363-I1381 HydrophobicContact CD2-CD1 3.85Å; L1363-I1381 HydrophobicContact CG-CD1 4.32Å
1364	E	58.9	Low	57.6	Low	95.6 Å²	95.6	78.1 Å²	78.1	45%	0.447	43%	0.434	S	S	.	.	H	α-helix	trans	-57	-40.4	178.4	-70.4	-130	135.8	0	0	112.3	A1360 E1361 C1366 R1372	A1360-E1364 PolarHBondContact O-N 3.05Å; E1361-E1364 WeakPolarHBondContact O-CB 3.42Å; E1361-E1364 PolarHBondContact O-N 3.14Å; E1364-C1366 VanDerWaalsContact C-N 3.32Å; E1364-C1366 PolarHBondContact O-N 3.12Å; E1364-R1372 VanDerWaalsContact O-CZ 3.24Å; E1364-R1372 PolarHBondContact O-NE 3.13Å; E1364-R1372 PolarHBondContact O-NH1 3.45Å; E1364-R1372 PolarHBondContact O-NH2 3.08Å; E1364-R1372 VanDerWaalsContact O-NH2 3.07Å; E1364-R1372 IonicContact OE1-CZ 2.91Å; E1364-R1372 IonicContact OE1-NH1 3.4Å; E1364-R1372 PolarHBondContact OE1-NH1 3.41Å; E1364-R1372 IonicContact OE2-CZ 3.11Å; E1364-R1372 IonicContact OE2-NH1 2.93Å; E1364-R1372 PolarHBondContact OE2-NH1 3.15Å; E1364-R1372 VanDerWaalsContact OE2-NH1 3.17Å; E1364-R1372 IonicContact OE2-NH2 2.74Å; E1364-R1372 PolarHBondContact OE2-NH2 3.01Å
1365	H	62.8	Low	59.8	Low	84.4 Å²	84.4	80 Å²	80	39%	0.391	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-5.5	-178.8	-57.4	-47.5	0	0	0	113.4	Q1275 L1363	Q1275-H1365 PolarHBondContact NE2-O 2.98Å; L1363-H1365 VanDerWaalsContact C-N 3.27Å; L1363-H1365 PolarHBondContact O-N 3.18Å
1366	C	68.9	Low	62.1	Low	4.8 Å²	4.8	82 Å²	82	3%	0.032	44%	0.436	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.6	-8.8	-179.6	-61.9	0	0	0	0	113.9	A1272 Q1275 A1362 L1363 E1364	A1272-C1366 HydrophobicContact CB-CB 3.93Å; A1272-C1366 WeakPolarHBondContact CB-O 3.34Å; Q1275-C1366 VanDerWaalsContact CD-SG 3.5Å; Q1275-C1366 PolarHBondContact NE2-SG 3.2Å; Q1275-C1366 VanDerWaalsContact NE2-SG 3.39Å; A1362-C1366 PolarHBondContact O-SG 2.96Å; A1362-C1366 VanDerWaalsContact O-SG 3.36Å; L1363-C1366 HydrophobicContact CD2-CB 4.47Å; L1363-C1366 PolarHBondContact O-N 2.94Å; L1363-C1366 VanDerWaalsContact O-N 3.11Å; E1364-C1366 VanDerWaalsContact C-N 3.32Å; E1364-C1366 PolarHBondContact O-N 3.12Å
1367	L	77.4	Confident	64.6	Low	2.8 Å²	2.8	75.1 Å²	75.1	2%	0.015	40%	0.4	C	S	.	.	S	Bend	trans	-134.6	139.3	-168.8	-73.6	174.6	0	0	0	113.7	A1268 A1272 L1363 R1372 I1377 I1381	A1268-L1367 HydrophobicContact CB-CD2 4.25Å; A1272-L1367 HydrophobicContact CB-CD2 3.76Å; A1272-L1367 HydrophobicContact CB-CG 4.17Å; L1363-L1367 HydrophobicContact CD2-CD1 4.38Å; L1363-L1367 HydrophobicContact CG-CD1 4.25Å; L1363-L1367 PolarHBondContact O-N 3Å; L1367-R1372 HydrophobicContact CB-CG 4.24Å; L1367-R1372 PolarHBondContact O-NE 3.08Å; L1367-I1377 HydrophobicContact CD1-CD1 4.43Å; L1367-I1377 HydrophobicContact CD1-CG2 3.82Å; L1367-I1377 HydrophobicContact CD2-CD1 3.78Å; L1367-I1381 HydrophobicContact CD1-CD1 4.12Å; L1367-I1381 HydrophobicContact CD2-CD1 4.45Å
1368	P	76.8	Confident	66.7	Low	3.6 Å²	3.6	73.6 Å²	73.6	2%	0.023	38%	0.384	C	S	.	.			trans	-54.9	142.2	167.1	-14.8	22.7	0	0	0	110.7	I1256 N1370 Y1371	I1256-P1368 HydrophobicContact CG2-CG 4.23Å; I1256-P1368 WeakPolarHBondContact O-CG 3.41Å; P1368-N1370 WeakPolarHBondContact CB-OD1 3.41Å; P1368-N1370 PolarHBondContact O-N 3.05Å; P1368-N1370 VanDerWaalsContact O-N 3.09Å; P1368-Y1371 HydrophobicContact CB-CD2 4.33Å; P1368-Y1371 HydrophobicContact CG-CD2 4Å; P1368-Y1371 HydrophobicContact CG-CE2 4.29Å; P1368-Y1371 PolarHBondContact O-N 3.27Å
1369	A	73.4	Confident	68.7	Low	63 Å²	63	77.6 Å²	77.6	52%	0.521	40%	0.399	S	S	.	.	G	3₁₀ helix	trans	-47.6	-44	-176	0	0	0	0	0	113.3	Y1371 R1372	A1369-Y1371 PolarHBondContact O-N 3.22Å; A1369-R1372 PolarHBondContact O-N 3.08Å; A1369-R1372 VanDerWaalsContact O-N 3.16Å
1370	N	74.4	Confident	70.6	Confident	118.6 Å²	118.6	75.4 Å²	75.4	63%	0.634	39%	0.387	S	S	*	.	G	3₁₀ helix	trans	-58.4	-9.9	179.2	-41.2	-49.1	0	0	0	115.7	P1368	P1368-N1370 WeakPolarHBondContact CB-OD1 3.41Å; P1368-N1370 PolarHBondContact O-N 3.05Å; P1368-N1370 VanDerWaalsContact O-N 3.09Å
1371	Y	78.9	Confident	72.6	Confident	25 Å²	25	71.8 Å²	71.8	10%	0.098	36%	0.357	C	S	.	.	G	3₁₀ helix	trans	-119.4	-11.2	-178.1	-64.2	-41.3	0	0	0	114.8	C1263 K1265 A1268 P1368 A1369 E1373 S1374 I1377	C1263-Y1371 WeakPolarHBondContact O-CE2 3.48Å; C1263-Y1371 PolarHBondContact O-OH 3.02Å; K1265-Y1371 HydrophobicContact CB-CE1 4.31Å; K1265-Y1371 PolarHBondContact N-OH 2.8Å; A1268-Y1371 HydrophobicContact CB-CD2 3.78Å; A1268-Y1371 HydrophobicContact CB-CE2 3.95Å; P1368-Y1371 HydrophobicContact CB-CD2 4.33Å; P1368-Y1371 HydrophobicContact CG-CD2 4Å; P1368-Y1371 HydrophobicContact CG-CE2 4.29Å; P1368-Y1371 PolarHBondContact O-N 3.27Å; A1369-Y1371 PolarHBondContact O-N 3.22Å; Y1371-E1373 VanDerWaalsContact C-N 3.33Å; Y1371-E1373 PolarHBondContact O-N 3.17Å; Y1371-S1374 VanDerWaalsContact O-CB 3.32Å; Y1371-S1374 WeakPolarHBondContact O-CB 3.37Å; Y1371-S1374 PolarHBondContact O-N 3.07Å; Y1371-S1374 VanDerWaalsContact O-N 3.1Å; Y1371-I1377 HydrophobicContact CD2-CD1 4.36Å; Y1371-I1377 HydrophobicContact CG-CD1 4.1Å
1372	R	73.9	Confident	74.2	Confident	82 Å²	82	67.5 Å²	67.5	31%	0.309	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-41.9	-173.3	-66.7	-177	179.7	-171	0.8	113.4	E1364 L1367 A1369 S1374	E1364-R1372 VanDerWaalsContact O-CZ 3.24Å; E1364-R1372 PolarHBondContact O-NE 3.13Å; E1364-R1372 PolarHBondContact O-NH1 3.45Å; E1364-R1372 PolarHBondContact O-NH2 3.08Å; E1364-R1372 VanDerWaalsContact O-NH2 3.07Å; E1364-R1372 IonicContact OE1-CZ 2.91Å; E1364-R1372 IonicContact OE1-NH1 3.4Å; E1364-R1372 PolarHBondContact OE1-NH1 3.41Å; E1364-R1372 IonicContact OE2-CZ 3.11Å; E1364-R1372 IonicContact OE2-NH1 2.93Å; E1364-R1372 PolarHBondContact OE2-NH1 3.15Å; E1364-R1372 VanDerWaalsContact OE2-NH1 3.17Å; E1364-R1372 IonicContact OE2-NH2 2.74Å; E1364-R1372 PolarHBondContact OE2-NH2 3.01Å; L1367-R1372 HydrophobicContact CB-CG 4.24Å; L1367-R1372 PolarHBondContact O-NE 3.08Å; A1369-R1372 PolarHBondContact O-N 3.08Å; A1369-R1372 VanDerWaalsContact O-N 3.16Å; R1372-S1374 VanDerWaalsContact C-N 3.28Å; R1372-S1374 PolarHBondContact O-N 3.11Å
1373	E	69.4	Low	75.8	Confident	188 Å²	188	68.1 Å²	68.1	88%	0.879	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-12.2	-178.6	-63.1	169.1	-165.9	0	0	114	Y1371 K1375	Y1371-E1373 VanDerWaalsContact C-N 3.33Å; Y1371-E1373 PolarHBondContact O-N 3.17Å; E1373-K1375 PolarHBondContact O-N 3.17Å; E1373-K1375 VanDerWaalsContact O-N 3.09Å
1374	S	74.7	Confident	77.2	Confident	33 Å²	33	70.4 Å²	70.4	23%	0.231	34%	0.343	C	S	.	.			trans	-81.8	94.6	-166.9	-163.6	0	0	0	0	112.3	K1265 Y1371 R1372 Q1376 I1377	K1265-S1374 WeakPolarHBondContact CE-OG 3.46Å; K1265-S1374 PolarHBondContact NZ-OG 3.17Å; Y1371-S1374 VanDerWaalsContact O-CB 3.32Å; Y1371-S1374 WeakPolarHBondContact O-CB 3.37Å; Y1371-S1374 PolarHBondContact O-N 3.07Å; Y1371-S1374 VanDerWaalsContact O-N 3.1Å; R1372-S1374 VanDerWaalsContact C-N 3.28Å; R1372-S1374 PolarHBondContact O-N 3.11Å; S1374-Q1376 PolarHBondContact O-N 3.13Å; S1374-I1377 VanDerWaalsContact O-CG2 3.3Å; S1374-I1377 WeakPolarHBondContact O-CG2 3.32Å; S1374-I1377 PolarHBondContact O-N 3.27Å
1375	K	77	Confident	78.4	Confident	180.2 Å²	180.2	67.9 Å²	67.9	78%	0.783	33%	0.33	S	S	*	.	H	α-helix	trans	-45.9	-27.9	175.5	-64.1	-176	179.7	-179.5	0	115	E1373 I1377	E1373-K1375 PolarHBondContact O-N 3.17Å; E1373-K1375 VanDerWaalsContact O-N 3.09Å; K1375-I1377 PolarHBondContact O-N 2.75Å
1376	Q	80.2	Confident	79.4	Confident	131 Å²	131	71.7 Å²	71.7	61%	0.612	34%	0.341	S	S	*	.	H	α-helix	trans	-68.8	-33.2	173.8	-72	175.9	-14.1	0	0	114.1	S1374 I1378 K1379 L1380	S1374-Q1376 PolarHBondContact O-N 3.13Å; Q1376-I1378 VanDerWaalsContact C-N 3.34Å; Q1376-I1378 PolarHBondContact O-N 3.15Å; Q1376-K1379 PolarHBondContact O-N 3.08Å; Q1376-L1380 PolarHBondContact O-N 2.9Å; Q1376-L1380 VanDerWaalsContact O-N 3.13Å
1377	I	83.3	Confident	80.1	Confident	0 Å²	0	77.1 Å²	77.1	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-70.4	-33.9	-177.9	-149.9	171.4	0	0	0	111.4	K1265 A1268 A1269 L1367 Y1371 S1374 K1375 K1379 L1380 I1381	K1265-I1377 HydrophobicContact CG-CD1 4.12Å; K1265-I1377 HydrophobicContact CG-CG1 4.2Å; A1268-I1377 HydrophobicContact CB-CD1 4.03Å; A1269-I1377 HydrophobicContact CB-CD1 4.45Å; A1269-I1377 HydrophobicContact CB-CG1 3.84Å; L1367-I1377 HydrophobicContact CD1-CD1 4.43Å; L1367-I1377 HydrophobicContact CD1-CG2 3.82Å; L1367-I1377 HydrophobicContact CD2-CD1 3.78Å; Y1371-I1377 HydrophobicContact CD2-CD1 4.36Å; Y1371-I1377 HydrophobicContact CG-CD1 4.1Å; S1374-I1377 VanDerWaalsContact O-CG2 3.3Å; S1374-I1377 WeakPolarHBondContact O-CG2 3.32Å; S1374-I1377 PolarHBondContact O-N 3.27Å; K1375-I1377 PolarHBondContact O-N 2.75Å; I1377-K1379 VanDerWaalsContact C-N 3.3Å; I1377-K1379 PolarHBondContact O-N 3.13Å; I1377-L1380 CarbonylContact O-C 3.56Å; I1377-L1380 WeakPolarHBondContact O-CA 3.22Å; I1377-L1380 WeakPolarHBondContact O-CB 3.33Å; I1377-L1380 PolarHBondContact O-N 3.11Å; I1377-L1380 VanDerWaalsContact O-N 3.09Å; I1377-I1381 HydrophobicContact CG1-CD1 4.49Å; I1377-I1381 HydrophobicContact CG2-CD1 4.41Å; I1377-I1381 VanDerWaalsContact O-CG1 3.29Å; I1377-I1381 WeakPolarHBondContact O-CG1 3.39Å; I1377-I1381 PolarHBondContact O-N 3.33Å
1378	I	79.4	Confident	80.3	Confident	63.2 Å²	63.2	77.5 Å²	77.5	32%	0.324	37%	0.366	S	S	.	.	H	α-helix	trans	-59.7	-42.9	174.1	-54.9	175.1	0	0	0	110.3	I1358 L1363 Q1376 L1380 I1381 Q1382	I1358-I1378 HydrophobicContact CD1-CG2 4.1Å; L1363-I1378 HydrophobicContact CD1-CG1 4.25Å; L1363-I1378 HydrophobicContact CD1-CG2 4.42Å; L1363-I1378 HydrophobicContact CD2-CG1 4.2Å; Q1376-I1378 VanDerWaalsContact C-N 3.34Å; Q1376-I1378 PolarHBondContact O-N 3.15Å; I1378-L1380 PolarHBondContact O-N 3.1Å; I1378-I1381 PolarHBondContact O-N 3.16Å; I1378-Q1382 WeakPolarHBondContact O-CG 3.33Å; I1378-Q1382 PolarHBondContact O-N 3.14Å; I1378-Q1382 VanDerWaalsContact O-N 3.12Å
1379	K	83.2	Confident	80.3	Confident	150.2 Å²	150.2	83.2 Å²	83.2	65%	0.653	39%	0.391	S	S	*	.	H	α-helix	trans	-63.6	-39.4	173.7	-65.2	-170.8	176.1	-171.1	0	112.3	Q1376 I1377 Q1382 V1383	Q1376-K1379 PolarHBondContact O-N 3.08Å; I1377-K1379 VanDerWaalsContact C-N 3.3Å; I1377-K1379 PolarHBondContact O-N 3.13Å; K1379-Q1382 PolarHBondContact O-N 3.14Å; K1379-V1383 WeakPolarHBondContact O-CG2 3.29Å; K1379-V1383 PolarHBondContact O-N 3.13Å; K1379-V1383 VanDerWaalsContact O-N 3.13Å
1380	L	85.9	Confident	80.3	Confident	54.6 Å²	54.6	87.7 Å²	87.7	29%	0.286	40%	0.401	S	S	.	.	H	α-helix	trans	-66.5	-39.8	175.4	-69.4	170.9	0	0	0	112.3	K1265 E1266 A1269 Q1376 I1377 I1378 Q1382 V1383 W1384	K1265-L1380 HydrophobicContact CG-CD1 4.3Å; E1266-L1380 HydrophobicContact CG-CD1 4.28Å; A1269-L1380 HydrophobicContact CB-CB 3.56Å; A1269-L1380 HydrophobicContact CB-CD1 4.47Å; Q1376-L1380 PolarHBondContact O-N 2.9Å; Q1376-L1380 VanDerWaalsContact O-N 3.13Å; I1377-L1380 CarbonylContact O-C 3.56Å; I1377-L1380 WeakPolarHBondContact O-CA 3.22Å; I1377-L1380 WeakPolarHBondContact O-CB 3.33Å; I1377-L1380 PolarHBondContact O-N 3.11Å; I1377-L1380 VanDerWaalsContact O-N 3.09Å; I1378-L1380 PolarHBondContact O-N 3.1Å; L1380-Q1382 VanDerWaalsContact C-N 3.33Å; L1380-Q1382 PolarHBondContact O-N 3.03Å; L1380-V1383 PolarHBondContact O-N 2.96Å; L1380-V1383 VanDerWaalsContact O-N 3.09Å; L1380-W1384 VanDerWaalsContact O-CD1 3.27Å; L1380-W1384 PolarHBondContact O-N 3.12Å
1381	I	85.5	Confident	80.5	Confident	3.8 Å²	3.8	83.5 Å²	83.5	2%	0.019	38%	0.381	C	S	.	.	H	α-helix	trans	-61.6	-41.9	175.5	-69.3	163.4	0	0	0	110.5	A1269 A1272 L1363 L1367 I1377 I1378 V1383 W1384 K1385	A1269-I1381 HydrophobicContact CB-CG1 3.97Å; A1269-I1381 WeakPolarHBondContact O-CG1 3.34Å; A1272-I1381 HydrophobicContact CB-CD1 3.85Å; A1272-I1381 HydrophobicContact CB-CG1 4.13Å; L1363-I1381 HydrophobicContact CD2-CD1 3.85Å; L1363-I1381 HydrophobicContact CG-CD1 4.32Å; L1367-I1381 HydrophobicContact CD1-CD1 4.12Å; L1367-I1381 HydrophobicContact CD2-CD1 4.45Å; I1377-I1381 HydrophobicContact CG1-CD1 4.49Å; I1377-I1381 HydrophobicContact CG2-CD1 4.41Å; I1377-I1381 VanDerWaalsContact O-CG1 3.29Å; I1377-I1381 WeakPolarHBondContact O-CG1 3.39Å; I1377-I1381 PolarHBondContact O-N 3.33Å; I1378-I1381 PolarHBondContact O-N 3.16Å; I1381-V1383 VanDerWaalsContact C-N 3.3Å; I1381-V1383 PolarHBondContact O-N 3.05Å; I1381-W1384 PolarHBondContact O-N 3.04Å; I1381-K1385 PolarHBondContact O-N 3.16Å
1382	Q	82.7	Confident	80.2	Confident	69.6 Å²	69.6	90.2 Å²	90.2	33%	0.325	42%	0.418	S	S	.	.	H	α-helix	trans	-63.8	-32.8	173.7	-72.4	175.2	-10.8	0	0	113.2	L1356 I1358 I1378 K1379 L1380 R1386	L1356-Q1382 HydrophobicContact CD1-CG 4.47Å; L1356-Q1382 HydrophobicContact CD2-CG 3.8Å; I1358-Q1382 HydrophobicContact CD1-CG 3.66Å; I1378-Q1382 WeakPolarHBondContact O-CG 3.33Å; I1378-Q1382 PolarHBondContact O-N 3.14Å; I1378-Q1382 VanDerWaalsContact O-N 3.12Å; K1379-Q1382 PolarHBondContact O-N 3.14Å; L1380-Q1382 VanDerWaalsContact C-N 3.33Å; L1380-Q1382 PolarHBondContact O-N 3.03Å; Q1382-R1386 WeakPolarHBondContact O-CG 3.44Å; Q1382-R1386 PolarHBondContact O-N 2.86Å; Q1382-R1386 PolarHBondContact O-NE 2.88Å
1383	V	87.4	Confident	80.3	Confident	59.6 Å²	59.6	90.8 Å²	90.8	36%	0.361	42%	0.423	S	S	.	.	H	α-helix	trans	-73.1	-41.7	174	170.2	0	0	0	0	110.9	K1379 L1380 I1381 R1386 K1387	K1379-V1383 WeakPolarHBondContact O-CG2 3.29Å; K1379-V1383 PolarHBondContact O-N 3.13Å; K1379-V1383 VanDerWaalsContact O-N 3.13Å; L1380-V1383 PolarHBondContact O-N 2.96Å; L1380-V1383 VanDerWaalsContact O-N 3.09Å; I1381-V1383 VanDerWaalsContact C-N 3.3Å; I1381-V1383 PolarHBondContact O-N 3.05Å; V1383-R1386 PolarHBondContact O-N 3.23Å; V1383-K1387 HydrophobicContact CG1-CD 4.49Å; V1383-K1387 WeakPolarHBondContact O-CG 3.24Å; V1383-K1387 PolarHBondContact O-N 3.08Å; V1383-K1387 VanDerWaalsContact O-N 3.17Å
1384	W	87.1	Confident	80.6	Confident	66.4 Å²	66.4	83.8 Å²	83.8	25%	0.252	39%	0.389	S	S	.	.	H	α-helix	trans	-69.8	-39.8	177.7	-76.3	121.6	0	0	0	113.3	E1266 L1270 S1273 L1380 I1381 R1386 K1387 L1388	E1266-W1384 PolarHBondContact O-NE1 2.94Å; L1270-W1384 HydrophobicContact CB-CD2 4.15Å; L1270-W1384 HydrophobicContact CB-CG 4.21Å; L1270-W1384 HydrophobicContact CB-CZ2 4.49Å; L1270-W1384 HydrophobicContact CD1-CB 4.5Å; L1270-W1384 HydrophobicContact CD1-CD2 3.95Å; L1270-W1384 HydrophobicContact CD1-CE3 3.78Å; L1270-W1384 HydrophobicContact CD1-CG 4.3Å; L1270-W1384 HydrophobicContact CD1-CH2 3.86Å; L1270-W1384 HydrophobicContact CD1-CZ2 4.04Å; L1270-W1384 HydrophobicContact CD1-CZ3 4.13Å; L1270-W1384 HydrophobicContact CG-CD2 4.3Å; L1270-W1384 HydrophobicContact CG-CE3 4.41Å; S1273-W1384 VanDerWaalsContact OG-CB 3.25Å; S1273-W1384 WeakPolarHBondContact OG-CB 3.37Å; L1380-W1384 VanDerWaalsContact O-CD1 3.27Å; L1380-W1384 PolarHBondContact O-N 3.12Å; I1381-W1384 PolarHBondContact O-N 3.04Å; W1384-R1386 VanDerWaalsContact C-N 3.28Å; W1384-R1386 PolarHBondContact O-N 3.1Å; W1384-K1387 HydrophobicContact CD2-CD 4.35Å; W1384-K1387 HydrophobicContact CE3-CB 4.15Å; W1384-K1387 HydrophobicContact CE3-CD 3.57Å; W1384-K1387 HydrophobicContact CE3-CG 4.47Å; W1384-K1387 HydrophobicContact CH2-CD 4.45Å; W1384-K1387 HydrophobicContact CZ3-CB 4.48Å; W1384-K1387 HydrophobicContact CZ3-CD 3.63Å; W1384-K1387 VanDerWaalsContact CZ3-CD 3.48Å; W1384-K1387 PolarHBondContact O-N 3.1Å; W1384-K1387 VanDerWaalsContact O-N 3.1Å; W1384-L1388 WeakPolarHBondContact O-CB 3.31Å; W1384-L1388 WeakPolarHBondContact O-CG 3.3Å; W1384-L1388 PolarHBondContact O-N 3.1Å
1385	K	84.2	Confident	80.7	Confident	42.6 Å²	42.6	88.1 Å²	88.1	19%	0.185	41%	0.409	C	S	.	.	H	α-helix	trans	-55.4	-43.1	171.1	-83.1	-155.1	175.5	-170.6	0	111.8	S1276 L1277 E1280 I1381 K1387 L1388 F1389	S1276-K1385 PolarHBondContact O-NZ 2.98Å; S1276-K1385 VanDerWaalsContact O-NZ 3.14Å; S1276-K1385 VanDerWaalsContact OG-CE 3.25Å; S1276-K1385 WeakPolarHBondContact OG-CE 3.39Å; S1276-K1385 PolarHBondContact OG-NZ 3.01Å; L1277-K1385 HydrophobicContact CD1-CG 4.33Å; L1277-K1385 HydrophobicContact CD2-CD 4.25Å; L1277-K1385 HydrophobicContact CD2-CG 4.42Å; L1277-K1385 HydrophobicContact CG-CD 4.29Å; L1277-K1385 HydrophobicContact CG-CG 4.27Å; E1280-K1385 IonicContact OE1-NZ 2.64Å; E1280-K1385 IonicContact OE2-NZ 2.86Å; E1280-K1385 PolarHBondContact OE2-NZ 3.09Å; I1381-K1385 PolarHBondContact O-N 3.16Å; K1385-K1387 VanDerWaalsContact C-N 3.33Å; K1385-K1387 PolarHBondContact O-N 2.92Å; K1385-L1388 PolarHBondContact O-N 3.15Å; K1385-F1389 PolarHBondContact O-N 3.06Å; K1385-F1389 VanDerWaalsContact O-N 3.11Å
1386	R	83.5	Confident	81	Confident	164.2 Å²	164.2	82.1 Å²	82.1	62%	0.62	39%	0.39	S	S	*	.	H	α-helix	trans	-64.9	-36.8	175.4	-75.9	177.8	-109.1	167.7	-2.9	113.2	Q1382 V1383 W1384 F1389 H1390	Q1382-R1386 WeakPolarHBondContact O-CG 3.44Å; Q1382-R1386 PolarHBondContact O-N 2.86Å; Q1382-R1386 PolarHBondContact O-NE 2.88Å; V1383-R1386 PolarHBondContact O-N 3.23Å; W1384-R1386 VanDerWaalsContact C-N 3.28Å; W1384-R1386 PolarHBondContact O-N 3.1Å; R1386-F1389 WeakPolarHBondContact O-CB 3.48Å; R1386-F1389 PolarHBondContact O-N 3.35Å; R1386-H1390 PolarHBondContact O-CD2 3.16Å
1387	K	83.9	Confident	81.1	Confident	118.6 Å²	118.6	78 Å²	78	52%	0.516	37%	0.371	S	S	.	.	H	α-helix	trans	-68.4	-40.4	174	-72.8	178.4	174.9	-175.1	0	112.3	V1383 W1384 K1385 F1389 H1390	V1383-K1387 HydrophobicContact CG1-CD 4.49Å; V1383-K1387 WeakPolarHBondContact O-CG 3.24Å; V1383-K1387 PolarHBondContact O-N 3.08Å; V1383-K1387 VanDerWaalsContact O-N 3.17Å; W1384-K1387 HydrophobicContact CD2-CD 4.35Å; W1384-K1387 HydrophobicContact CE3-CB 4.15Å; W1384-K1387 HydrophobicContact CE3-CD 3.57Å; W1384-K1387 HydrophobicContact CE3-CG 4.47Å; W1384-K1387 HydrophobicContact CH2-CD 4.45Å; W1384-K1387 HydrophobicContact CZ3-CB 4.48Å; W1384-K1387 HydrophobicContact CZ3-CD 3.63Å; W1384-K1387 VanDerWaalsContact CZ3-CD 3.48Å; W1384-K1387 PolarHBondContact O-N 3.1Å; W1384-K1387 VanDerWaalsContact O-N 3.1Å; K1385-K1387 VanDerWaalsContact C-N 3.33Å; K1385-K1387 PolarHBondContact O-N 2.92Å; K1387-F1389 VanDerWaalsContact C-N 3.3Å; K1387-F1389 PolarHBondContact O-N 3.12Å; K1387-H1390 PolarHBondContact O-N 2.98Å
1388	L	82.4	Confident	81.1	Confident	11 Å²	11	84.7 Å²	84.7	6%	0.058	40%	0.4	C	S	.	.	H	α-helix	trans	-67.8	-28	179.9	-72.4	167.5	0	0	0	113.1	L1270 S1273 I1274 L1277 W1384 K1385 H1390 S1391 Y1394 L1403	L1270-L1388 HydrophobicContact CD1-CD1 4.39Å; L1270-L1388 HydrophobicContact CD1-CD2 4.39Å; S1273-L1388 VanDerWaalsContact OG-CD1 3.26Å; S1273-L1388 WeakPolarHBondContact OG-CD1 3.41Å; I1274-L1388 HydrophobicContact CB-CD1 4.48Å; I1274-L1388 HydrophobicContact CG1-CD1 3.62Å; I1274-L1388 HydrophobicContact CG1-CD2 4.27Å; L1277-L1388 HydrophobicContact CD1-CB 3.79Å; L1277-L1388 HydrophobicContact CD1-CD1 3.82Å; L1277-L1388 HydrophobicContact CD1-CG 4.44Å; W1384-L1388 WeakPolarHBondContact O-CB 3.31Å; W1384-L1388 WeakPolarHBondContact O-CG 3.3Å; W1384-L1388 PolarHBondContact O-N 3.1Å; K1385-L1388 PolarHBondContact O-N 3.15Å; L1388-H1390 PolarHBondContact O-N 3.05Å; L1388-H1390 VanDerWaalsContact O-N 3.14Å; L1388-S1391 WeakPolarHBondContact O-CB 3.34Å; L1388-S1391 PolarHBondContact O-N 3.22Å; L1388-S1391 PolarHBondContact O-OG 3.01Å; L1388-Y1394 VanDerWaalsContact O-CD2 3.3Å; L1388-Y1394 WeakPolarHBondContact O-CD2 3.41Å; L1388-L1403 HydrophobicContact CD2-CD2 3.65Å
1389	F	75.2	Confident	81.3	Confident	122 Å²	122	82.2 Å²	82.2	54%	0.535	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-28	173.2	-169.8	-90.3	0	0	0	113.4	K1385 R1386 K1387 Y1394	K1385-F1389 PolarHBondContact O-N 3.06Å; K1385-F1389 VanDerWaalsContact O-N 3.11Å; R1386-F1389 WeakPolarHBondContact O-CB 3.48Å; R1386-F1389 PolarHBondContact O-N 3.35Å; K1387-F1389 VanDerWaalsContact C-N 3.3Å; K1387-F1389 PolarHBondContact O-N 3.12Å; F1389-Y1394 HydrophobicContact CB-CE2 4.45Å; F1389-Y1394 HydrophobicContact CD2-CD1 4.45Å; F1389-Y1394 AromaticContact CD2-CE1 3.63Å; F1389-Y1394 HydrophobicContact CD2-CE1 3.63Å; F1389-Y1394 HydrophobicContact CD2-CE2 4.16Å; F1389-Y1394 AromaticContact CD2-CZ 3.48Å; F1389-Y1394 VanDerWaalsContact CD2-CZ 3.45Å; F1389-Y1394 WeakPolarHBondContact CD2-OH 3.29Å; F1389-Y1394 AromaticContact CE2-CE1 3.83Å; F1389-Y1394 HydrophobicContact CE2-CE1 3.83Å; F1389-Y1394 AromaticContact CE2-CZ 3.87Å; F1389-Y1394 HydrophobicContact CG-CE1 4.38Å
1390	H	74.9	Confident	81.5	Confident	158 Å²	158	75 Å²	75	73%	0.731	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.3	16.8	177.8	-60.2	-69.8	0	0	0	113.4	R1386 K1387 L1388	R1386-H1390 PolarHBondContact O-CD2 3.16Å; K1387-H1390 PolarHBondContact O-N 2.98Å; L1388-H1390 PolarHBondContact O-N 3.05Å; L1388-H1390 VanDerWaalsContact O-N 3.14Å
1391	S	77	Confident	81.6	Confident	30.6 Å²	30.6	73.4 Å²	73.4	21%	0.214	35%	0.349	C	S	.	.	S	Bend	trans	-100.7	139.8	179.9	88.1	0	0	0	0	112	L1388 F1393 Y1394	L1388-S1391 WeakPolarHBondContact O-CB 3.34Å; L1388-S1391 PolarHBondContact O-N 3.22Å; L1388-S1391 PolarHBondContact O-OG 3.01Å; S1391-F1393 PolarHBondContact O-N 3Å; S1391-F1393 WeakPolarHBondContact OG-CD2 3.31Å; S1391-F1393 PolarHBondContact OG-N 2.94Å; S1391-Y1394 VanDerWaalsContact O-CB 3.26Å; S1391-Y1394 WeakPolarHBondContact O-CB 3.44Å; S1391-Y1394 PolarHBondContact O-N 3.06Å
1392	N	74.2	Confident	81.7	Confident	164.6 Å²	164.6	77.6 Å²	77.6	88%	0.88	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-14.2	178.5	-58.1	12.8	0	0	0	113.7
1393	F	75.4	Confident	82	Confident	94.6 Å²	94.6	75.9 Å²	75.9	42%	0.415	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-8.6	177.9	-52.1	-67.4	0	0	0	113.6	S1391 D1395 S1396 L1400	S1391-F1393 PolarHBondContact O-N 3Å; S1391-F1393 WeakPolarHBondContact OG-CD2 3.31Å; S1391-F1393 PolarHBondContact OG-N 2.94Å; F1393-D1395 VanDerWaalsContact C-N 3.27Å; F1393-D1395 PolarHBondContact O-N 3.05Å; F1393-D1395 VanDerWaalsContact O-N 3.13Å; F1393-S1396 PolarHBondContact O-N 3.32Å; F1393-S1396 VanDerWaalsContact O-N 3.13Å; F1393-L1400 HydrophobicContact CB-CD2 4.35Å
1394	Y	76.4	Confident	82.1	Confident	41.2 Å²	41.2	73.1 Å²	73.1	16%	0.162	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-34.7	-168.1	-176.6	-116	0	0	0	114.4	L1277 K1281 L1388 F1389 S1391	L1277-Y1394 HydrophobicContact CD1-CD2 4.36Å; L1277-Y1394 HydrophobicContact CD1-CE2 4.05Å; L1277-Y1394 HydrophobicContact CD2-CD2 4.45Å; L1277-Y1394 HydrophobicContact CD2-CE2 3.75Å; L1277-Y1394 VanDerWaalsContact CD2-CE2 3.48Å; L1277-Y1394 HydrophobicContact CG-CE2 4.3Å; K1281-Y1394 VanDerWaalsContact NZ-CZ 3.34Å; K1281-Y1394 PolarHBondContact NZ-O 3.16Å; L1388-Y1394 VanDerWaalsContact O-CD2 3.3Å; L1388-Y1394 WeakPolarHBondContact O-CD2 3.41Å; F1389-Y1394 HydrophobicContact CB-CE2 4.45Å; F1389-Y1394 HydrophobicContact CD2-CD1 4.45Å; F1389-Y1394 AromaticContact CD2-CE1 3.63Å; F1389-Y1394 HydrophobicContact CD2-CE1 3.63Å; F1389-Y1394 HydrophobicContact CD2-CE2 4.16Å; F1389-Y1394 AromaticContact CD2-CZ 3.48Å; F1389-Y1394 VanDerWaalsContact CD2-CZ 3.45Å; F1389-Y1394 WeakPolarHBondContact CD2-OH 3.29Å; F1389-Y1394 AromaticContact CE2-CE1 3.83Å; F1389-Y1394 HydrophobicContact CE2-CE1 3.83Å; F1389-Y1394 AromaticContact CE2-CZ 3.87Å; F1389-Y1394 HydrophobicContact CG-CE1 4.38Å; S1391-Y1394 VanDerWaalsContact O-CB 3.26Å; S1391-Y1394 WeakPolarHBondContact O-CB 3.44Å; S1391-Y1394 PolarHBondContact O-N 3.06Å
1395	D	76.8	Confident	82.2	Confident	124 Å²	124	70.1 Å²	70.1	66%	0.663	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100	6.5	-176.5	-63.6	-54.1	0	0	0	114.2	K1281 W1282 F1393	K1281-D1395 IonicContact NZ-OD1 2.84Å; K1281-D1395 PolarHBondContact NZ-OD1 3.07Å; W1282-D1395 WeakPolarHBondContact CZ2-O 3.42Å; F1393-D1395 VanDerWaalsContact C-N 3.27Å; F1393-D1395 PolarHBondContact O-N 3.05Å; F1393-D1395 VanDerWaalsContact O-N 3.13Å
1396	S	81.8	Confident	82.5	Confident	53.6 Å²	53.6	72 Å²	72	38%	0.375	34%	0.343	S	S	.	.			trans	-116.6	118.2	177.7	-179.4	0	0	0	0	111.9	F1393 K1398 G1399 L1400	F1393-S1396 PolarHBondContact O-N 3.32Å; F1393-S1396 VanDerWaalsContact O-N 3.13Å; S1396-K1398 VanDerWaalsContact C-N 3.31Å; S1396-K1398 PolarHBondContact O-N 3.21Å; S1396-G1399 WeakPolarHBondContact O-CA 3.41Å; S1396-G1399 PolarHBondContact O-N 3.16Å; S1396-G1399 VanDerWaalsContact O-N 3.1Å; S1396-G1399 PolarHBondContact OG-N 3.01Å; S1396-G1399 VanDerWaalsContact OG-N 3.1Å; S1396-L1400 PolarHBondContact O-N 3.14Å
1397	E	83.2	Confident	82.7	Confident	45.4 Å²	45.4	65.2 Å²	65.2	21%	0.212	32%	0.319	C	S	.	.	H	α-helix	trans	-58.2	-44.1	173.4	-168.9	-169.9	150.5	0	0	111.2	I1278 W1282 S1285 R1287 G1399 L1400 K1401	I1278-E1397 HydrophobicContact CG2-CG 4.42Å; W1282-E1397 HydrophobicContact CB-CG 4.4Å; W1282-E1397 VanDerWaalsContact CB-OE2 3.28Å; W1282-E1397 WeakPolarHBondContact CB-OE2 3.25Å; W1282-E1397 HydrophobicContact CD2-CB 3.88Å; W1282-E1397 HydrophobicContact CD2-CG 4.09Å; W1282-E1397 HydrophobicContact CE3-CB 4.02Å; W1282-E1397 HydrophobicContact CE3-CG 4.16Å; W1282-E1397 HydrophobicContact CG-CB 4.24Å; W1282-E1397 HydrophobicContact CG-CG 4.26Å; W1282-E1397 HydrophobicContact CH2-CB 4.3Å; W1282-E1397 HydrophobicContact CZ2-CB 4.24Å; W1282-E1397 HydrophobicContact CZ3-CB 4.28Å; S1285-E1397 PolarHBondContact OG-OE1 2.88Å; R1287-E1397 IonicContact CZ-OE1 2.96Å; R1287-E1397 IonicContact CZ-OE2 2.8Å; R1287-E1397 IonicContact NH1-OE1 2.62Å; R1287-E1397 IonicContact NH1-OE2 3.89Å; R1287-E1397 PolarHBondContact NH1-OE2 3.15Å; R1287-E1397 IonicContact NH2-OE1 3.13Å; R1287-E1397 PolarHBondContact NH2-OE1 3.19Å; R1287-E1397 IonicContact NH2-OE2 3.24Å; R1287-E1397 PolarHBondContact NH2-OE2 2.84Å; E1397-G1399 VanDerWaalsContact C-N 3.33Å; E1397-G1399 PolarHBondContact O-N 3.02Å; E1397-L1400 PolarHBondContact O-N 3.13Å; E1397-K1401 HydrophobicContact CG-CD 4.28Å; E1397-K1401 WeakPolarHBondContact O-CB 3.31Å; E1397-K1401 WeakPolarHBondContact O-CG 3.34Å; E1397-K1401 PolarHBondContact O-N 2.87Å; E1397-K1401 VanDerWaalsContact OE1-CE 3.28Å; E1397-K1401 WeakPolarHBondContact OE1-CE 3.34Å; E1397-K1401 IonicContact OE1-NZ 3.04Å; E1397-K1401 PolarHBondContact OE1-NZ 2.89Å
1398	K	82.9	Confident	83.1	Confident	141 Å²	141	59.5 Å²	59.5	61%	0.613	30%	0.295	S	S	*	.	H	α-helix	trans	-62.5	-39	175.4	-69.3	-169.4	177.3	-173	0	111.2	L1245 S1396 H1402	L1245-K1398 HydrophobicContact CD2-CB 4.47Å; S1396-K1398 VanDerWaalsContact C-N 3.31Å; S1396-K1398 PolarHBondContact O-N 3.21Å; K1398-H1402 VanDerWaalsContact O-CB 3.27Å; K1398-H1402 WeakPolarHBondContact O-CB 3.39Å; K1398-H1402 PolarHBondContact O-N 3.15Å
1399	G	84.3	Confident	83.3	Confident	9.8 Å²	9.8	63.5 Å²	63.5	10%	0.101	31%	0.312	C	S	.	.	H	α-helix	trans	-61.5	-47.3	174.7	0	0	0	0	0	113.3	S1396 E1397 H1402 L1403	S1396-G1399 WeakPolarHBondContact O-CA 3.41Å; S1396-G1399 PolarHBondContact O-N 3.16Å; S1396-G1399 VanDerWaalsContact O-N 3.1Å; S1396-G1399 PolarHBondContact OG-N 3.01Å; S1396-G1399 VanDerWaalsContact OG-N 3.1Å; E1397-G1399 VanDerWaalsContact C-N 3.33Å; E1397-G1399 PolarHBondContact O-N 3.02Å; G1399-H1402 PolarHBondContact O-N 3.43Å; G1399-L1403 WeakPolarHBondContact O-CB 3.29Å; G1399-L1403 PolarHBondContact O-N 3.06Å
1400	L	86.8	Confident	83.9	Confident	0 Å²	0	67.1 Å²	67.1	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-69.5	-39.8	177.7	-67.5	179.5	0	0	0	112.7	I1274 L1277 I1278 W1282 F1393 S1396 E1397 L1403 Y1404	I1274-L1400 HydrophobicContact CG2-CB 4.2Å; I1274-L1400 HydrophobicContact CG2-CD2 4.48Å; I1274-L1400 WeakPolarHBondContact CG2-O 3.34Å; L1277-L1400 HydrophobicContact CB-CD1 4.2Å; I1278-L1400 HydrophobicContact CD1-CB 3.86Å; I1278-L1400 HydrophobicContact CG1-CB 3.67Å; I1278-L1400 HydrophobicContact CG1-CD1 4.06Å; I1278-L1400 HydrophobicContact CG1-CG 4.48Å; W1282-L1400 HydrophobicContact CZ3-CD1 3.97Å; F1393-L1400 HydrophobicContact CB-CD2 4.35Å; S1396-L1400 PolarHBondContact O-N 3.14Å; E1397-L1400 PolarHBondContact O-N 3.13Å; L1400-L1403 PolarHBondContact O-N 3.1Å; L1400-Y1404 PolarHBondContact O-N 3.31Å
1401	K	88.5	Confident	84.5	Confident	21.2 Å²	21.2	59.9 Å²	59.9	9%	0.092	29%	0.289	C	S	.	.	H	α-helix	trans	-59.9	-46.1	172.3	-78.4	177.4	169.7	168	0	111.1	L1245 Y1249 I1278 S1285 E1397 L1403 Y1404 V1405	L1245-K1401 HydrophobicContact CD2-CB 4.18Å; L1245-K1401 HydrophobicContact CG-CB 4.23Å; Y1249-K1401 HydrophobicContact CD1-CG 4.45Å; Y1249-K1401 HydrophobicContact CD2-CB 4.34Å; Y1249-K1401 HydrophobicContact CD2-CG 3.98Å; Y1249-K1401 HydrophobicContact CE2-CG 4.37Å; Y1249-K1401 HydrophobicContact CG-CG 4.05Å; I1278-K1401 HydrophobicContact CD1-CG 4.15Å; S1285-K1401 PolarHBondContact OG-NZ 3.46Å; E1397-K1401 HydrophobicContact CG-CD 4.28Å; E1397-K1401 WeakPolarHBondContact O-CB 3.31Å; E1397-K1401 WeakPolarHBondContact O-CG 3.34Å; E1397-K1401 PolarHBondContact O-N 2.87Å; E1397-K1401 VanDerWaalsContact OE1-CE 3.28Å; E1397-K1401 WeakPolarHBondContact OE1-CE 3.34Å; E1397-K1401 IonicContact OE1-NZ 3.04Å; E1397-K1401 PolarHBondContact OE1-NZ 2.89Å; K1401-L1403 VanDerWaalsContact C-N 3.35Å; K1401-L1403 PolarHBondContact O-N 3.29Å; K1401-Y1404 WeakPolarHBondContact O-CB 3.36Å; K1401-Y1404 PolarHBondContact O-N 3.05Å; K1401-V1405 WeakPolarHBondContact O-CG2 3.39Å; K1401-V1405 PolarHBondContact O-N 3.04Å
1402	H	87.2	Confident	84.9	Confident	92.2 Å²	92.2	59.6 Å²	59.6	43%	0.427	29%	0.286	S	S	.	.	H	α-helix	trans	-60.8	-43.8	175.2	-172.6	-80.5	0	0	0	111.9	L1245 K1398 G1399 Y1404 V1405 Q1406	L1245-H1402 HydrophobicContact CD1-CB 4.47Å; L1245-H1402 HydrophobicContact CD2-CB 4.29Å; K1398-H1402 VanDerWaalsContact O-CB 3.27Å; K1398-H1402 WeakPolarHBondContact O-CB 3.39Å; K1398-H1402 PolarHBondContact O-N 3.15Å; G1399-H1402 PolarHBondContact O-N 3.43Å; H1402-Y1404 VanDerWaalsContact C-N 3.33Å; H1402-Y1404 PolarHBondContact O-N 3.08Å; H1402-V1405 PolarHBondContact O-N 3.01Å; H1402-Q1406 PolarHBondContact ND1-OE1 3.02Å; H1402-Q1406 VanDerWaalsContact O-CB 3.25Å; H1402-Q1406 WeakPolarHBondContact O-CB 3.34Å; H1402-Q1406 PolarHBondContact O-N 3.14Å
1403	L	88.1	Confident	85.5	Confident	32.6 Å²	32.6	51.9 Å²	51.9	17%	0.171	25%	0.245	C	C	.	.	H	α-helix	trans	-62	-38.3	176.3	-175.4	64.2	0	0	0	112.4	I1274 L1388 G1399 L1400 K1401 T1407	I1274-L1403 HydrophobicContact CD1-CB 4.45Å; I1274-L1403 HydrophobicContact CD1-CD2 4.01Å; I1274-L1403 HydrophobicContact CD1-CG 3.94Å; I1274-L1403 HydrophobicContact CG1-CD2 4.42Å; L1388-L1403 HydrophobicContact CD2-CD2 3.65Å; G1399-L1403 WeakPolarHBondContact O-CB 3.29Å; G1399-L1403 PolarHBondContact O-N 3.06Å; L1400-L1403 PolarHBondContact O-N 3.1Å; K1401-L1403 VanDerWaalsContact C-N 3.35Å; K1401-L1403 PolarHBondContact O-N 3.29Å; L1403-T1407 VanDerWaalsContact O-CB 3.31Å; L1403-T1407 WeakPolarHBondContact O-CB 3.31Å; L1403-T1407 PolarHBondContact O-N 3.11Å; L1403-T1407 PolarHBondContact O-OG1 3.19Å
1404	Y	90.9	Very high	86	Confident	0.8 Å²	0.8	50.9 Å²	50.9	0%	0.003	24%	0.241	C	C	.	.	H	α-helix	trans	-62.6	-56.1	174.1	-168.1	-84	0	0	0	110.8	Y1249 L1252 Q1253 I1256 L1271 I1274 Q1275 L1400 K1401 H1402 Q1406 T1407 C1408	Y1249-Y1404 AromaticContact CD2-CD1 3.65Å; Y1249-Y1404 HydrophobicContact CD2-CD1 3.65Å; Y1249-Y1404 HydrophobicContact CD2-CD2 4.5Å; Y1249-Y1404 HydrophobicContact CD2-CE1 4.29Å; Y1249-Y1404 AromaticContact CD2-CG 3.79Å; Y1249-Y1404 HydrophobicContact CD2-CG 3.79Å; Y1249-Y1404 AromaticContact CE2-CD1 3.82Å; Y1249-Y1404 HydrophobicContact CE2-CD1 3.82Å; Y1249-Y1404 AromaticContact CE2-CD2 3.93Å; Y1249-Y1404 HydrophobicContact CE2-CD2 3.93Å; Y1249-Y1404 HydrophobicContact CE2-CE1 4.26Å; Y1249-Y1404 HydrophobicContact CE2-CE2 4.35Å; Y1249-Y1404 AromaticContact CE2-CG 3.65Å; Y1249-Y1404 HydrophobicContact CE2-CG 3.65Å; L1252-Y1404 HydrophobicContact CB-CE1 4.37Å; Q1253-Y1404 WeakPolarHBondContact CA-OH 3.48Å; Q1253-Y1404 HydrophobicContact CB-CE1 4.41Å; I1256-Y1404 HydrophobicContact CD1-CE1 3.94Å; L1271-Y1404 HydrophobicContact CB-CD2 4.44Å; L1271-Y1404 HydrophobicContact CB-CE2 3.92Å; L1271-Y1404 HydrophobicContact CD2-CD1 4.26Å; L1271-Y1404 HydrophobicContact CD2-CD2 3.72Å; L1271-Y1404 HydrophobicContact CD2-CE1 4.25Å; L1271-Y1404 HydrophobicContact CD2-CE2 3.72Å; L1271-Y1404 HydrophobicContact CD2-CG 4Å; L1271-Y1404 HydrophobicContact CG-CE2 4.43Å; L1271-Y1404 WeakPolarHBondContact O-CE2 3.45Å; I1274-Y1404 HydrophobicContact CB-CD2 4.17Å; I1274-Y1404 HydrophobicContact CG2-CD2 4.07Å; Q1275-Y1404 HydrophobicContact CB-CE2 4.14Å; L1400-Y1404 PolarHBondContact O-N 3.31Å; K1401-Y1404 WeakPolarHBondContact O-CB 3.36Å; K1401-Y1404 PolarHBondContact O-N 3.05Å; H1402-Y1404 VanDerWaalsContact C-N 3.33Å; H1402-Y1404 PolarHBondContact O-N 3.08Å; Y1404-Q1406 VanDerWaalsContact C-N 3.33Å; Y1404-Q1406 PolarHBondContact O-N 3.08Å; Y1404-T1407 WeakPolarHBondContact O-CA 3.27Å; Y1404-T1407 WeakPolarHBondContact O-CB 3.33Å; Y1404-T1407 PolarHBondContact O-N 3.08Å; Y1404-C1408 VanDerWaalsContact CE1-SG 3.57Å; Y1404-C1408 PolarHBondContact O-N 3.18Å; Y1404-C1408 PolarHBondContact O-SG 3.03Å; Y1404-C1408 VanDerWaalsContact O-SG 3.33Å
1405	V	89	Confident	86.3	Confident	4.6 Å²	4.6	51.8 Å²	51.8	3%	0.028	26%	0.262	C	S	.	.	H	α-helix	trans	-57.8	-43.9	179.7	172.7	0	0	0	0	111.4	L1245 E1248 L1252 K1401 H1402 T1407 C1408 K1409	L1245-V1405 HydrophobicContact CD1-CB 4.41Å; L1245-V1405 HydrophobicContact CD1-CG2 4.1Å; E1248-V1405 HydrophobicContact CB-CG1 4.46Å; E1248-V1405 HydrophobicContact CB-CG2 4.3Å; E1248-V1405 WeakPolarHBondContact OE2-CG1 3.37Å; L1252-V1405 HydrophobicContact CD1-CB 4.33Å; L1252-V1405 HydrophobicContact CD1-CG1 4.03Å; L1252-V1405 HydrophobicContact CD1-CG2 4.19Å; K1401-V1405 WeakPolarHBondContact O-CG2 3.39Å; K1401-V1405 PolarHBondContact O-N 3.04Å; H1402-V1405 PolarHBondContact O-N 3.01Å; V1405-T1407 VanDerWaalsContact C-N 3.32Å; V1405-T1407 PolarHBondContact O-N 3.12Å; V1405-C1408 PolarHBondContact O-N 3.1Å; V1405-K1409 HydrophobicContact CG1-CD 3.93Å; V1405-K1409 VanDerWaalsContact CG1-CE 3.49Å; V1405-K1409 HydrophobicContact CG1-CG 4.46Å; V1405-K1409 WeakPolarHBondContact O-CB 3.45Å; V1405-K1409 VanDerWaalsContact O-CG 3.3Å; V1405-K1409 WeakPolarHBondContact O-CG 3.41Å; V1405-K1409 PolarHBondContact O-N 3.19Å
1406	Q	89.3	Confident	86.8	Confident	82.8 Å²	82.8	47.1 Å²	47.1	39%	0.387	24%	0.239	S	C	.	.	H	α-helix	trans	-65.5	-33.2	176.8	-170.4	-179.1	18.4	0	0	112.6	H1402 Y1404 K1409 R1410	H1402-Q1406 PolarHBondContact ND1-OE1 3.02Å; H1402-Q1406 VanDerWaalsContact O-CB 3.25Å; H1402-Q1406 WeakPolarHBondContact O-CB 3.34Å; H1402-Q1406 PolarHBondContact O-N 3.14Å; Y1404-Q1406 VanDerWaalsContact C-N 3.33Å; Y1404-Q1406 PolarHBondContact O-N 3.08Å; Q1406-K1409 PolarHBondContact O-N 2.97Å; Q1406-R1410 WeakPolarHBondContact O-CD 3.38Å; Q1406-R1410 VanDerWaalsContact O-CG 3.28Å; Q1406-R1410 WeakPolarHBondContact O-CG 3.27Å; Q1406-R1410 PolarHBondContact O-N 3.14Å
1407	T	89.3	Confident	86.9	Confident	20.2 Å²	20.2	49.4 Å²	49.4	12%	0.124	24%	0.242	C	C	.	.	H	α-helix	trans	-69	-45.4	173.8	-60.2	0	0	0	0	110.6	L1270 L1271 L1403 Y1404 V1405 K1409 R1410	L1270-T1407 HydrophobicContact CD2-CG2 3.88Å; L1270-T1407 HydrophobicContact CG-CG2 4.48Å; L1271-T1407 HydrophobicContact CD1-CG2 4.41Å; L1271-T1407 HydrophobicContact CD2-CG2 3.8Å; L1271-T1407 HydrophobicContact CG-CG2 4.02Å; L1403-T1407 VanDerWaalsContact O-CB 3.31Å; L1403-T1407 WeakPolarHBondContact O-CB 3.31Å; L1403-T1407 PolarHBondContact O-N 3.11Å; L1403-T1407 PolarHBondContact O-OG1 3.19Å; Y1404-T1407 WeakPolarHBondContact O-CA 3.27Å; Y1404-T1407 WeakPolarHBondContact O-CB 3.33Å; Y1404-T1407 PolarHBondContact O-N 3.08Å; V1405-T1407 VanDerWaalsContact C-N 3.32Å; V1405-T1407 PolarHBondContact O-N 3.12Å; T1407-K1409 PolarHBondContact O-N 3.29Å; T1407-R1410 WeakPolarHBondContact O-CB 3.3Å; T1407-R1410 PolarHBondContact O-N 3.22Å; T1407-R1410 VanDerWaalsContact O-N 3.12Å
1408	C	90.6	Very high	87.2	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-59.6	-45.8	175.4	-62.3	0	0	0	0	112.2	L1252 I1256 L1261 Y1404 V1405 R1410 L1411 F1414	L1252-C1408 HydrophobicContact CB-CB 4.32Å; L1252-C1408 HydrophobicContact CD1-CB 3.77Å; L1252-C1408 HydrophobicContact CD2-CB 4.05Å; L1252-C1408 HydrophobicContact CG-CB 4.27Å; I1256-C1408 WeakPolarHBondContact CD1-SG 3.26Å; L1261-C1408 HydrophobicContact CD2-CB 4.49Å; Y1404-C1408 VanDerWaalsContact CE1-SG 3.57Å; Y1404-C1408 PolarHBondContact O-N 3.18Å; Y1404-C1408 PolarHBondContact O-SG 3.03Å; Y1404-C1408 VanDerWaalsContact O-SG 3.33Å; V1405-C1408 PolarHBondContact O-N 3.1Å; C1408-R1410 PolarHBondContact O-N 3.27Å; C1408-R1410 VanDerWaalsContact O-N 3.1Å; C1408-L1411 VanDerWaalsContact O-CB 3.3Å; C1408-L1411 WeakPolarHBondContact O-CB 3.37Å; C1408-L1411 WeakPolarHBondContact O-CG 3.34Å; C1408-L1411 PolarHBondContact O-N 3.04Å; C1408-F1414 WeakPolarHBondContact O-CB 3.5Å; C1408-F1414 VanDerWaalsContact O-CD2 3.27Å; C1408-F1414 WeakPolarHBondContact O-CD2 3.34Å
1409	K	87.7	Confident	87.3	Confident	94.2 Å²	94.2	44.6 Å²	44.6	41%	0.41	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-15.2	177.3	-73.9	176.9	178.7	174.7	0	113.8	E1248 V1405 Q1406 T1407 F1414	E1248-K1409 WeakPolarHBondContact OE1-CE 3.31Å; E1248-K1409 IonicContact OE1-NZ 3.03Å; E1248-K1409 PolarHBondContact OE1-NZ 2.86Å; E1248-K1409 WeakPolarHBondContact OE2-CE 3.22Å; E1248-K1409 IonicContact OE2-NZ 3.22Å; E1248-K1409 PolarHBondContact OE2-NZ 3.36Å; V1405-K1409 HydrophobicContact CG1-CD 3.93Å; V1405-K1409 VanDerWaalsContact CG1-CE 3.49Å; V1405-K1409 HydrophobicContact CG1-CG 4.46Å; V1405-K1409 WeakPolarHBondContact O-CB 3.45Å; V1405-K1409 VanDerWaalsContact O-CG 3.3Å; V1405-K1409 WeakPolarHBondContact O-CG 3.41Å; V1405-K1409 PolarHBondContact O-N 3.19Å; Q1406-K1409 PolarHBondContact O-N 2.97Å; T1407-K1409 PolarHBondContact O-N 3.29Å; K1409-F1414 HydrophobicContact CB-CD1 4.4Å; K1409-F1414 HydrophobicContact CB-CE1 4.33Å; K1409-F1414 HydrophobicContact CB-CZ 4.35Å; K1409-F1414 HydrophobicContact CD-CZ 4.46Å; K1409-F1414 HydrophobicContact CG-CD1 4.34Å; K1409-F1414 HydrophobicContact CG-CD2 4.41Å; K1409-F1414 HydrophobicContact CG-CE1 3.82Å; K1409-F1414 HydrophobicContact CG-CE2 4.02Å; K1409-F1414 HydrophobicContact CG-CZ 3.66Å; K1409-F1414 VanDerWaalsContact CG-CZ 3.45Å
1410	R	87.4	Confident	87.4	Confident	198 Å²	198	49.4 Å²	49.4	75%	0.747	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91	-12.4	174.4	-72	172	116.6	-179.3	3.3	113.9	Q1406 T1407 C1408	Q1406-R1410 WeakPolarHBondContact O-CD 3.38Å; Q1406-R1410 VanDerWaalsContact O-CG 3.28Å; Q1406-R1410 WeakPolarHBondContact O-CG 3.27Å; Q1406-R1410 PolarHBondContact O-N 3.14Å; T1407-R1410 WeakPolarHBondContact O-CB 3.3Å; T1407-R1410 PolarHBondContact O-N 3.22Å; T1407-R1410 VanDerWaalsContact O-N 3.12Å; C1408-R1410 PolarHBondContact O-N 3.27Å; C1408-R1410 VanDerWaalsContact O-N 3.1Å
1411	L	88.6	Confident	87.3	Confident	7 Å²	7	49.6 Å²	49.6	4%	0.037	25%	0.245	C	C	.	.	S	Bend	trans	-64.1	140.7	-179	-65.2	176.1	0	0	0	111.1	I1256 L1261 C1263 E1267 C1408 A1413 F1414	I1256-L1411 HydrophobicContact CD1-CD1 3.82Å; L1261-L1411 HydrophobicContact CD1-CD1 4.45Å; L1261-L1411 HydrophobicContact CD2-CD1 3.83Å; L1261-L1411 HydrophobicContact CG-CD1 3.85Å; C1263-L1411 HydrophobicContact CB-CD1 4.06Å; C1263-L1411 HydrophobicContact CB-CD2 4.1Å; E1267-L1411 HydrophobicContact CB-CD2 4.04Å; E1267-L1411 HydrophobicContact CG-CD2 3.96Å; E1267-L1411 VanDerWaalsContact OE1-CD2 3.28Å; E1267-L1411 WeakPolarHBondContact OE1-CD2 3.32Å; C1408-L1411 VanDerWaalsContact O-CB 3.3Å; C1408-L1411 WeakPolarHBondContact O-CB 3.37Å; C1408-L1411 WeakPolarHBondContact O-CG 3.34Å; C1408-L1411 PolarHBondContact O-N 3.04Å; L1411-A1413 PolarHBondContact O-N 3.11Å; L1411-A1413 VanDerWaalsContact O-N 3.11Å; L1411-F1414 HydrophobicContact CB-CB 4.45Å; L1411-F1414 VanDerWaalsContact O-CB 3.24Å; L1411-F1414 WeakPolarHBondContact O-CB 3.38Å; L1411-F1414 PolarHBondContact O-N 3.04Å; L1411-F1414 VanDerWaalsContact O-N 3.09Å
1412	P	84.9	Confident	87.2	Confident	23.6 Å²	23.6	50.4 Å²	50.4	15%	0.153	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-7.6	-172.4	11.2	-11.6	0	0	0	115.2	S1445 L1447 L1454	P1412-S1445 WeakPolarHBondContact O-CB 3.4Å; P1412-S1445 PolarHBondContact O-OG 3.09Å; P1412-S1445 VanDerWaalsContact O-OG 3.07Å; P1412-L1447 HydrophobicContact CB-CD2 4.01Å; P1412-L1447 HydrophobicContact CG-CD2 4.01Å; P1412-L1454 HydrophobicContact CB-CD1 4.07Å; P1412-L1454 HydrophobicContact CG-CB 4.36Å; P1412-L1454 HydrophobicContact CG-CD2 4.49Å
1413	A	85.8	Confident	87.2	Confident	3.2 Å²	3.2	46.2 Å²	46.2	3%	0.026	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.9	-1.3	176.2	0	0	0	0	0	113.6	L1261 P1262 L1411 G1415 C1416 L1418 L1447	L1261-A1413 HydrophobicContact CD1-CB 4.2Å; P1262-A1413 HydrophobicContact CG-CB 3.59Å; L1411-A1413 PolarHBondContact O-N 3.11Å; L1411-A1413 VanDerWaalsContact O-N 3.11Å; A1413-G1415 PolarHBondContact O-N 3.05Å; A1413-C1416 VanDerWaalsContact O-CB 3.31Å; A1413-C1416 WeakPolarHBondContact O-CB 3.39Å; A1413-C1416 PolarHBondContact O-N 3.01Å; A1413-L1418 HydrophobicContact CB-CD2 4.06Å; A1413-L1447 HydrophobicContact CB-CD1 4.2Å
1414	F	87.4	Confident	86.8	Confident	73 Å²	73	46.8 Å²	46.8	32%	0.32	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	133	177.9	-177.3	-96.9	0	0	0	110.4	L1252 L1261 C1408 K1409 L1411 C1416	L1252-F1414 HydrophobicContact CD1-CE2 4.37Å; L1252-F1414 HydrophobicContact CD2-CD2 4.29Å; L1252-F1414 HydrophobicContact CD2-CE2 3.85Å; L1261-F1414 HydrophobicContact CD1-CB 4.39Å; L1261-F1414 HydrophobicContact CD2-CD2 4.41Å; C1408-F1414 WeakPolarHBondContact O-CB 3.5Å; C1408-F1414 VanDerWaalsContact O-CD2 3.27Å; C1408-F1414 WeakPolarHBondContact O-CD2 3.34Å; K1409-F1414 HydrophobicContact CB-CD1 4.4Å; K1409-F1414 HydrophobicContact CB-CE1 4.33Å; K1409-F1414 HydrophobicContact CB-CZ 4.35Å; K1409-F1414 HydrophobicContact CD-CZ 4.46Å; K1409-F1414 HydrophobicContact CG-CD1 4.34Å; K1409-F1414 HydrophobicContact CG-CD2 4.41Å; K1409-F1414 HydrophobicContact CG-CE1 3.82Å; K1409-F1414 HydrophobicContact CG-CE2 4.02Å; K1409-F1414 HydrophobicContact CG-CZ 3.66Å; K1409-F1414 VanDerWaalsContact CG-CZ 3.45Å; L1411-F1414 HydrophobicContact CB-CB 4.45Å; L1411-F1414 VanDerWaalsContact O-CB 3.24Å; L1411-F1414 WeakPolarHBondContact O-CB 3.38Å; L1411-F1414 PolarHBondContact O-N 3.04Å; L1411-F1414 VanDerWaalsContact O-N 3.09Å; F1414-C1416 VanDerWaalsContact C-N 3.28Å; F1414-C1416 PolarHBondContact O-N 3.03Å; F1414-C1416 PolarHBondContact O-SG 3.2Å; F1414-C1416 VanDerWaalsContact O-SG 3.34Å
1415	G	82.1	Confident	86	Confident	60.2 Å²	60.2	50.5 Å²	50.5	62%	0.621	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.6	23.3	-176.3	0	0	0	0	0	115	A1413 G1440	A1413-G1415 PolarHBondContact O-N 3.05Å; G1415-G1440 WeakPolarHBondContact O-CA 3.45Å
1416	C	86.1	Confident	84.6	Confident	26.6 Å²	26.6	60.8 Å²	60.8	18%	0.18	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	135.7	-178.1	-59.3	0	0	0	0	112.6	A1413 F1414 C1438 L1439 G1440	A1413-C1416 VanDerWaalsContact O-CB 3.31Å; A1413-C1416 WeakPolarHBondContact O-CB 3.39Å; A1413-C1416 PolarHBondContact O-N 3.01Å; F1414-C1416 VanDerWaalsContact C-N 3.28Å; F1414-C1416 PolarHBondContact O-N 3.03Å; F1414-C1416 PolarHBondContact O-SG 3.2Å; F1414-C1416 VanDerWaalsContact O-SG 3.34Å; C1416-C1438 HydrophobicContact CB-CB 3.8Å; C1416-L1439 CarbonylContact C-O 3.51Å; C1416-L1439 VanDerWaalsContact CA-O 3.29Å; C1416-L1439 WeakPolarHBondContact CA-O 3.41Å; C1416-G1440 VanDerWaalsContact SG-CA 3.57Å
1417	K	85.5	Confident	83.4	Confident	100 Å²	100	59.5 Å²	59.5	44%	0.435	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	137.3	164.8	-67.2	-179.7	-179.8	175.3	0	109.4	F1419 C1438 L1439 T1506 E1509	K1417-F1419 HydrophobicContact CB-CE2 3.89Å; K1417-F1419 HydrophobicContact CB-CZ 4.37Å; K1417-C1438 WeakPolarHBondContact O-CA 3.28Å; K1417-L1439 PolarHBondContact N-O 3.26Å; K1417-L1439 PolarHBondContact O-N 3.07Å; K1417-T1506 HydrophobicContact CB-CG2 4.09Å; K1417-T1506 HydrophobicContact CD-CG2 3.48Å; K1417-T1506 VanDerWaalsContact CD-CG2 3.45Å; K1417-T1506 WeakPolarHBondContact CD-OG1 3.46Å; K1417-T1506 HydrophobicContact CG-CG2 4.34Å; K1417-E1509 VanDerWaalsContact NZ-CD 3.3Å; K1417-E1509 IonicContact NZ-OE1 3Å; K1417-E1509 PolarHBondContact NZ-OE1 3.03Å; K1417-E1509 IonicContact NZ-OE2 3.71Å; K1417-E1509 PolarHBondContact NZ-OE2 3.19Å
1418	L	87.7	Confident	81.9	Confident	64.8 Å²	64.8	69.2 Å²	69.2	34%	0.339	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	130.9	-169	-61.8	176	0	0	0	112.7	S1260 P1262 A1413 I1436 L1437 C1438	S1260-L1418 VanDerWaalsContact O-CD1 3.27Å; S1260-L1418 WeakPolarHBondContact O-CD1 3.42Å; P1262-L1418 HydrophobicContact CG-CD1 4Å; P1262-L1418 HydrophobicContact CG-CD2 4.34Å; A1413-L1418 HydrophobicContact CB-CD2 4.06Å; L1418-I1436 HydrophobicContact CB-CG2 4.38Å; L1418-I1436 HydrophobicContact CD2-CG2 4.15Å; L1418-L1437 WeakPolarHBondContact CA-O 3.26Å; L1418-C1438 HydrophobicContact CD2-CB 4Å; L1418-C1438 VanDerWaalsContact CD2-SG 3.53Å; L1418-C1438 WeakPolarHBondContact CD2-SG 3.32Å
1419	F	86.6	Confident	80.5	Confident	20.8 Å²	20.8	75.4 Å²	75.4	9%	0.091	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	133.8	-179	-62.1	-85.2	0	0	0	112.2	K1417 V1421 I1436 L1437 L1439 L1499 T1502 I1503 T1506	K1417-F1419 HydrophobicContact CB-CE2 3.89Å; K1417-F1419 HydrophobicContact CB-CZ 4.37Å; F1419-V1421 HydrophobicContact CB-CG1 4.43Å; F1419-I1436 CarbonylContact O-C 3.53Å; F1419-I1436 WeakPolarHBondContact O-CA 3.38Å; F1419-L1437 HydrophobicContact CB-CB 4.4Å; F1419-L1437 PolarHBondContact N-O 3.16Å; F1419-L1437 PolarHBondContact O-N 3.22Å; F1419-L1439 HydrophobicContact CD2-CD1 3.92Å; F1419-L1439 HydrophobicContact CD2-CG 4.14Å; F1419-L1439 HydrophobicContact CE2-CB 4.5Å; F1419-L1439 HydrophobicContact CE2-CD1 3.74Å; F1419-L1439 HydrophobicContact CE2-CG 4.23Å; F1419-L1499 HydrophobicContact CD1-CD1 3.91Å; F1419-L1499 HydrophobicContact CE1-CD1 4.35Å; F1419-T1502 HydrophobicContact CE1-CG2 3.92Å; F1419-T1502 HydrophobicContact CZ-CG2 4.11Å; F1419-I1503 HydrophobicContact CB-CD1 4.05Å; F1419-I1503 HydrophobicContact CB-CG1 4.32Å; F1419-I1503 HydrophobicContact CD1-CD1 3.93Å; F1419-I1503 HydrophobicContact CD1-CG1 3.47Å; F1419-I1503 VanDerWaalsContact CD1-CG1 3.46Å; F1419-I1503 HydrophobicContact CD2-CG1 4.1Å; F1419-I1503 HydrophobicContact CE1-CG1 3.67Å; F1419-I1503 HydrophobicContact CE2-CG1 4.28Å; F1419-I1503 HydrophobicContact CG-CD1 3.98Å; F1419-I1503 HydrophobicContact CG-CG1 3.69Å; F1419-I1503 HydrophobicContact CZ-CG1 4.07Å; F1419-T1506 HydrophobicContact CE2-CG2 4.38Å; F1419-T1506 HydrophobicContact CZ-CG2 4.12Å; F1419-T1506 WeakPolarHBondContact CZ-OG1 3.3Å
1420	H	86	Confident	79.7	Confident	111.2 Å²	111.2	76.4 Å²	76.4	52%	0.515	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	111	177.6	-74.8	-72.4	0	0	0	111.4	N1491	H1420-N1491 VanDerWaalsContact C-ND2 3.27Å; H1420-N1491 PolarHBondContact O-ND2 3.11Å
1421	V	85.4	Confident	79.1	Confident	5.4 Å²	5.4	75.1 Å²	75.1	3%	0.033	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	159.9	-173.5	-62.6	0	0	0	0	112.7	F1419 R1434 R1435 L1437 L1446 F1488 I1503	F1419-V1421 HydrophobicContact CB-CG1 4.43Å; V1421-R1434 WeakPolarHBondContact O-CA 3.44Å; V1421-R1435 HydrophobicContact CG2-CB 4.08Å; V1421-R1435 PolarHBondContact N-O 3.13Å; V1421-R1435 VanDerWaalsContact N-O 3.17Å; V1421-R1435 PolarHBondContact O-N 3.03Å; V1421-L1437 HydrophobicContact CG1-CB 4.33Å; V1421-L1437 HydrophobicContact CG1-CD2 4.43Å; V1421-L1437 HydrophobicContact CG2-CB 3.89Å; V1421-L1446 HydrophobicContact CG2-CD1 4.49Å; V1421-F1488 HydrophobicContact CB-CB 4.37Å; V1421-F1488 HydrophobicContact CB-CD1 4.04Å; V1421-F1488 HydrophobicContact CB-CG 4.4Å; V1421-F1488 HydrophobicContact CG2-CB 4.48Å; V1421-F1488 HydrophobicContact CG2-CD1 3.49Å; V1421-F1488 VanDerWaalsContact CG2-CD1 3.45Å; V1421-F1488 HydrophobicContact CG2-CE1 3.79Å; V1421-F1488 HydrophobicContact CG2-CG 4.19Å; V1421-I1503 HydrophobicContact CG1-CD1 4.34Å
1422	K	85.7	Confident	78.7	Confident	38.2 Å²	38.2	81.3 Å²	81.3	17%	0.166	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	109	169.3	-76.2	168	173.3	129.8	0	109.6	S1433 R1434 F1488 I1489 N1491	K1422-S1433 CarbonylContact C-O 3.41Å; K1422-S1433 WeakPolarHBondContact CA-O 3.33Å; K1422-R1434 HydrophobicContact CG-CG 4.38Å; K1422-F1488 CarbonylContact O-C 3.39Å; K1422-F1488 VanDerWaalsContact O-CA 3.26Å; K1422-F1488 WeakPolarHBondContact O-CA 3.26Å; K1422-I1489 PolarHBondContact N-O 3.24Å; K1422-I1489 PolarHBondContact O-N 3.23Å; K1422-N1491 WeakPolarHBondContact CD-OD1 3.32Å; K1422-N1491 WeakPolarHBondContact CE-OD1 3.34Å; K1422-N1491 WeakPolarHBondContact CG-OD1 3.23Å; K1422-N1491 PolarHBondContact NZ-O 3.11Å; K1422-N1491 PolarHBondContact NZ-OD1 3.11Å
1423	E	86.1	Confident	78.7	Confident	3.2 Å²	3.2	81.7 Å²	81.7	2%	0.015	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	135.5	174.4	-177.9	-179	-149.9	0	0	111.1	Y1425 K1432 S1433 R1435 L1446 R1456 Y1487 F1488	E1423-Y1425 HydrophobicContact CB-CD2 4.49Å; E1423-Y1425 HydrophobicContact CB-CE2 4.11Å; E1423-Y1425 HydrophobicContact CG-CD1 4.31Å; E1423-Y1425 HydrophobicContact CG-CD2 4.18Å; E1423-Y1425 HydrophobicContact CG-CE2 3.64Å; E1423-Y1425 VanDerWaalsContact OE1-CZ 3.23Å; E1423-Y1425 PolarHBondContact OE1-OH 3.39Å; E1423-Y1425 VanDerWaalsContact OE1-OH 3.12Å; E1423-Y1425 WeakPolarHBondContact OE2-CE2 3.45Å; E1423-Y1425 VanDerWaalsContact OE2-CZ 3.26Å; E1423-Y1425 PolarHBondContact OE2-OH 3.04Å; E1423-K1432 CarbonylContact O-C 3.57Å; E1423-K1432 WeakPolarHBondContact O-CA 3.37Å; E1423-S1433 PolarHBondContact N-O 3.13Å; E1423-S1433 PolarHBondContact O-N 3.22Å; E1423-R1435 HydrophobicContact CB-CG 3.67Å; E1423-R1435 WeakPolarHBondContact OE2-CD 3.35Å; E1423-R1435 WeakPolarHBondContact OE2-CG 3.33Å; E1423-R1435 IonicContact OE2-CZ 3.31Å; E1423-R1435 IonicContact OE2-NE 3.19Å; E1423-R1435 PolarHBondContact OE2-NE 3.2Å; E1423-R1435 IonicContact OE2-NH2 3.14Å; E1423-R1435 PolarHBondContact OE2-NH2 2.82Å; E1423-L1446 WeakPolarHBondContact OE1-CD2 3.25Å; E1423-L1446 VanDerWaalsContact OE2-CD2 3.28Å; E1423-L1446 WeakPolarHBondContact OE2-CD2 3.41Å; E1423-R1456 VanDerWaalsContact CD-NH2 3.33Å; E1423-R1456 IonicContact OE1-CZ 2.9Å; E1423-R1456 IonicContact OE1-NE 3.6Å; E1423-R1456 IonicContact OE1-NH1 3.1Å; E1423-R1456 PolarHBondContact OE1-NH1 2.9Å; E1423-R1456 IonicContact OE1-NH2 3.28Å; E1423-R1456 PolarHBondContact OE1-NH2 3.21Å; E1423-R1456 IonicContact OE2-NH2 2.83Å; E1423-Y1487 WeakPolarHBondContact CA-O 3.17Å; E1423-F1488 HydrophobicContact CB-CD1 3.94Å; E1423-F1488 HydrophobicContact CB-CE1 3.92Å; E1423-F1488 HydrophobicContact CG-CD1 4.21Å; E1423-F1488 HydrophobicContact CG-CE1 4.01Å
1424	L	81.1	Confident	78.7	Confident	46 Å²	46	90.1 Å²	90.1	24%	0.241	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	126.7	168.8	-79.1	168.7	0	0	0	110.1	I1430 K1432 Y1487 I1489	L1424-I1430 HydrophobicContact CD2-CG2 3.55Å; L1424-I1430 VanDerWaalsContact CD2-CG2 3.5Å; L1424-K1432 HydrophobicContact CD2-CD 4.32Å; L1424-K1432 HydrophobicContact CD2-CG 3.79Å; L1424-Y1487 PolarHBondContact N-O 3.16Å; L1424-I1489 HydrophobicContact CD1-CD1 3.77Å; L1424-I1489 HydrophobicContact CD1-CG1 3.67Å; L1424-I1489 VanDerWaalsContact CD1-CG1 3.47Å; L1424-I1489 HydrophobicContact CD2-CD1 3.84Å; L1424-I1489 HydrophobicContact CD2-CG1 4.06Å; L1424-I1489 HydrophobicContact CG-CD1 3.82Å; L1424-I1489 HydrophobicContact CG-CG1 3.92Å
1425	Y	72.9	Confident	78.8	Confident	77 Å²	77	88.3 Å²	88.3	30%	0.302	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	124.7	167.7	-27.2	-92.8	0	0	0	110.1	E1423 G1427 I1430 R1431 S1433 R1435	E1423-Y1425 HydrophobicContact CB-CD2 4.49Å; E1423-Y1425 HydrophobicContact CB-CE2 4.11Å; E1423-Y1425 HydrophobicContact CG-CD1 4.31Å; E1423-Y1425 HydrophobicContact CG-CD2 4.18Å; E1423-Y1425 HydrophobicContact CG-CE2 3.64Å; E1423-Y1425 VanDerWaalsContact OE1-CZ 3.23Å; E1423-Y1425 PolarHBondContact OE1-OH 3.39Å; E1423-Y1425 VanDerWaalsContact OE1-OH 3.12Å; E1423-Y1425 WeakPolarHBondContact OE2-CE2 3.45Å; E1423-Y1425 VanDerWaalsContact OE2-CZ 3.26Å; E1423-Y1425 PolarHBondContact OE2-OH 3.04Å; Y1425-G1427 PolarHBondContact O-N 3.23Å; Y1425-I1430 WeakPolarHBondContact O-CA 3.28Å; Y1425-R1431 HydrophobicContact CD1-CB 4.09Å; Y1425-R1431 VanDerWaalsContact CD1-O 3.28Å; Y1425-R1431 WeakPolarHBondContact CD1-O 3.32Å; Y1425-R1431 HydrophobicContact CD2-CB 3.95Å; Y1425-R1431 HydrophobicContact CE1-CB 3.81Å; Y1425-R1431 VanDerWaalsContact CE1-CB 3.45Å; Y1425-R1431 HydrophobicContact CE2-CB 3.76Å; Y1425-R1431 HydrophobicContact CE2-CG 4.31Å; Y1425-R1431 VanDerWaalsContact CZ-CB 3.49Å; Y1425-R1431 PolarHBondContact N-O 2.97Å; Y1425-R1431 PolarHBondContact O-N 2.96Å; Y1425-R1431 VanDerWaalsContact O-N 3.12Å; Y1425-R1431 WeakPolarHBondContact OH-CD 3.44Å; Y1425-S1433 WeakPolarHBondContact CE1-OG 3.34Å; Y1425-S1433 PolarHBondContact OH-OG 3.33Å; Y1425-R1435 PolarHBondContact OH-NE 3.11Å; Y1425-R1435 PolarHBondContact OH-NH2 2.82Å
1426	R	59.4	Low	79.1	Confident	221.8 Å²	221.8	85.8 Å²	85.8	84%	0.837	39%	0.394	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.9	95.7	169.6	-74.9	-175.6	173.9	-175.2	-2.3	109.1	I1430	R1426-I1430 HydrophobicContact CG-CG1 4.35Å
1427	G	64.6	Low	79.3	Confident	55.2 Å²	55.2	84.5 Å²	84.5	57%	0.569	39%	0.386	S	S	*	.	S	Bend	trans	-102.2	-157	156.5	0	0	0	0	0	109.8	Y1425 L1429	Y1425-G1427 PolarHBondContact O-N 3.23Å; G1427-L1429 CarbonylContact C-O 3.56Å; G1427-L1429 PolarHBondContact N-O 2.98Å; G1427-L1429 PolarHBondContact O-N 3.18Å; G1427-L1429 VanDerWaalsContact O-N 3.11Å
1428	K	58.5	Low	79.6	Confident	223.8 Å²	223.8	79.7 Å²	79.7	97%	0.973	37%	0.365	S	S	*	.	S	Bend	trans	-55.8	-23.8	169.4	-69.6	-170.5	176.7	-173.9	0	113.3
1429	L	61.7	Low	79.7	Confident	130.2 Å²	130.2	76.7 Å²	76.7	68%	0.682	35%	0.349	S	S	*	.	S	Bend	trans	-128.6	146.4	167.7	-73.8	134.8	0	0	0	109.2	G1427 R1431	G1427-L1429 CarbonylContact C-O 3.56Å; G1427-L1429 PolarHBondContact N-O 2.98Å; G1427-L1429 PolarHBondContact O-N 3.18Å; G1427-L1429 VanDerWaalsContact O-N 3.11Å; L1429-R1431 PolarHBondContact O-N 3.21Å
1430	I	69.3	Low	79.7	Confident	116 Å²	116	75.8 Å²	75.8	60%	0.595	35%	0.346	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.2	112.3	174.4	-59.7	176.1	0	0	0	108.7	L1424 Y1425 R1426	L1424-I1430 HydrophobicContact CD2-CG2 3.55Å; L1424-I1430 VanDerWaalsContact CD2-CG2 3.5Å; Y1425-I1430 WeakPolarHBondContact O-CA 3.28Å; R1426-I1430 HydrophobicContact CG-CG1 4.35Å
1431	R	75.8	Confident	79.5	Confident	170 Å²	170	72.4 Å²	72.4	64%	0.642	34%	0.336	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.2	131.6	177.8	-87.8	178.5	174.2	164.6	-1.5	110.7	Y1425 L1429	Y1425-R1431 HydrophobicContact CD1-CB 4.09Å; Y1425-R1431 VanDerWaalsContact CD1-O 3.28Å; Y1425-R1431 WeakPolarHBondContact CD1-O 3.32Å; Y1425-R1431 HydrophobicContact CD2-CB 3.95Å; Y1425-R1431 HydrophobicContact CE1-CB 3.81Å; Y1425-R1431 VanDerWaalsContact CE1-CB 3.45Å; Y1425-R1431 HydrophobicContact CE2-CB 3.76Å; Y1425-R1431 HydrophobicContact CE2-CG 4.31Å; Y1425-R1431 VanDerWaalsContact CZ-CB 3.49Å; Y1425-R1431 PolarHBondContact N-O 2.97Å; Y1425-R1431 PolarHBondContact O-N 2.96Å; Y1425-R1431 VanDerWaalsContact O-N 3.12Å; Y1425-R1431 WeakPolarHBondContact OH-CD 3.44Å; L1429-R1431 PolarHBondContact O-N 3.21Å
1432	K	80.6	Confident	79.3	Confident	137 Å²	137	74.9 Å²	74.9	60%	0.596	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.8	133.6	175.8	-65.1	176.5	-175.7	-180	0	109.4	E1423 L1424 I1489	E1423-K1432 CarbonylContact O-C 3.57Å; E1423-K1432 WeakPolarHBondContact O-CA 3.37Å; L1424-K1432 HydrophobicContact CD2-CD 4.32Å; L1424-K1432 HydrophobicContact CD2-CG 3.79Å; K1432-I1489 HydrophobicContact CD-CD1 4.19Å; K1432-I1489 HydrophobicContact CG-CD1 4.49Å
1433	S	83.8	Confident	79.5	Confident	31.6 Å²	31.6	77.6 Å²	77.6	22%	0.221	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	134.8	178.6	-73.3	0	0	0	0	112.6	K1422 E1423 Y1425 R1435	K1422-S1433 CarbonylContact C-O 3.41Å; K1422-S1433 WeakPolarHBondContact CA-O 3.33Å; E1423-S1433 PolarHBondContact N-O 3.13Å; E1423-S1433 PolarHBondContact O-N 3.22Å; Y1425-S1433 WeakPolarHBondContact CE1-OG 3.34Å; Y1425-S1433 PolarHBondContact OH-OG 3.33Å; S1433-R1435 VanDerWaalsContact CB-CZ 3.42Å; S1433-R1435 VanDerWaalsContact CB-NH1 3.33Å
1434	R	87.1	Confident	79.7	Confident	180.8 Å²	180.8	77.5 Å²	77.5	68%	0.682	37%	0.367	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.5	139.3	173.7	-61.1	-174.2	-172.2	-165.3	2.6	110.5	V1421 K1422 P1449	V1421-R1434 WeakPolarHBondContact O-CA 3.44Å; K1422-R1434 HydrophobicContact CG-CG 4.38Å; R1434-P1449 HydrophobicContact CB-CG 4.06Å; R1434-P1449 VanDerWaalsContact O-CD 3.29Å; R1434-P1449 WeakPolarHBondContact O-CD 3.31Å; R1434-P1449 VanDerWaalsContact O-CG 3.31Å; R1434-P1449 WeakPolarHBondContact O-CG 3.38Å
1435	R	88.5	Confident	80.2	Confident	34.6 Å²	34.6	75.3 Å²	75.3	13%	0.131	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	164.5	179.7	-61.2	-65.5	-179.9	-113.8	3	110.6	V1421 E1423 Y1425 S1433 L1446 I1455	V1421-R1435 HydrophobicContact CG2-CB 4.08Å; V1421-R1435 PolarHBondContact N-O 3.13Å; V1421-R1435 VanDerWaalsContact N-O 3.17Å; V1421-R1435 PolarHBondContact O-N 3.03Å; E1423-R1435 HydrophobicContact CB-CG 3.67Å; E1423-R1435 WeakPolarHBondContact OE2-CD 3.35Å; E1423-R1435 WeakPolarHBondContact OE2-CG 3.33Å; E1423-R1435 IonicContact OE2-CZ 3.31Å; E1423-R1435 IonicContact OE2-NE 3.19Å; E1423-R1435 PolarHBondContact OE2-NE 3.2Å; E1423-R1435 IonicContact OE2-NH2 3.14Å; E1423-R1435 PolarHBondContact OE2-NH2 2.82Å; Y1425-R1435 PolarHBondContact OH-NE 3.11Å; Y1425-R1435 PolarHBondContact OH-NH2 2.82Å; S1433-R1435 VanDerWaalsContact CB-CZ 3.42Å; S1433-R1435 VanDerWaalsContact CB-NH1 3.33Å; R1435-L1446 HydrophobicContact CB-CD1 3.78Å; R1435-L1446 HydrophobicContact CB-CD2 4.31Å; R1435-L1446 HydrophobicContact CB-CG 4.13Å; R1435-L1446 HydrophobicContact CG-CD1 4.12Å; R1435-L1446 HydrophobicContact CG-CD2 4.1Å; R1435-L1446 HydrophobicContact CG-CG 4.17Å; R1435-I1455 VanDerWaalsContact CD-CD1 3.46Å
1436	I	88.7	Confident	81	Confident	6.8 Å²	6.8	71.7 Å²	71.7	4%	0.035	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	117.8	162.4	-48.8	177.8	0	0	0	106.5	L1418 F1419 L1446 L1447 P1449 K1452	L1418-I1436 HydrophobicContact CB-CG2 4.38Å; L1418-I1436 HydrophobicContact CD2-CG2 4.15Å; F1419-I1436 CarbonylContact O-C 3.53Å; F1419-I1436 WeakPolarHBondContact O-CA 3.38Å; I1436-L1446 CarbonylContact O-C 3.52Å; I1436-L1446 WeakPolarHBondContact O-CA 3.37Å; I1436-L1447 HydrophobicContact CB-CB 4.25Å; I1436-L1447 PolarHBondContact N-O 2.94Å; I1436-L1447 VanDerWaalsContact N-O 3.11Å; I1436-L1447 PolarHBondContact O-N 3.19Å; I1436-P1449 HydrophobicContact CG1-CB 4.49Å; I1436-P1449 HydrophobicContact CG1-CG 4.43Å; I1436-K1452 HydrophobicContact CD1-CD 4.27Å
1437	L	90.4	Very high	82.5	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	125	173.2	176.5	65.3	0	0	0	108.1	L1418 F1419 V1421 L1439 I1444 L1446 L1477 L1479 W1486 F1488	L1418-L1437 WeakPolarHBondContact CA-O 3.26Å; F1419-L1437 HydrophobicContact CB-CB 4.4Å; F1419-L1437 PolarHBondContact N-O 3.16Å; F1419-L1437 PolarHBondContact O-N 3.22Å; V1421-L1437 HydrophobicContact CG1-CB 4.33Å; V1421-L1437 HydrophobicContact CG1-CD2 4.43Å; V1421-L1437 HydrophobicContact CG2-CB 3.89Å; L1437-L1439 HydrophobicContact CD1-CD2 3.95Å; L1437-L1439 HydrophobicContact CD2-CD2 4.04Å; L1437-L1439 HydrophobicContact CD2-CG 4.44Å; L1437-L1439 HydrophobicContact CG-CD2 3.79Å; L1437-L1439 HydrophobicContact CG-CG 4.2Å; L1437-I1444 HydrophobicContact CD1-CG2 3.91Å; L1437-L1446 HydrophobicContact CB-CD1 4.21Å; L1437-L1446 HydrophobicContact CD1-CD1 4.15Å; L1437-L1477 HydrophobicContact CD2-CD2 4.2Å; L1437-L1479 HydrophobicContact CD1-CD1 4.33Å; L1437-W1486 HydrophobicContact CD1-CZ3 4.4Å; L1437-F1488 HydrophobicContact CD1-CZ 4.4Å
1438	C	91.1	Very high	83.7	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	118.1	179.9	-49.4	0	0	0	0	108	C1416 K1417 L1418 I1444 S1445 L1447	C1416-C1438 HydrophobicContact CB-CB 3.8Å; K1417-C1438 WeakPolarHBondContact O-CA 3.28Å; L1418-C1438 HydrophobicContact CD2-CB 4Å; L1418-C1438 VanDerWaalsContact CD2-SG 3.53Å; L1418-C1438 WeakPolarHBondContact CD2-SG 3.32Å; C1438-I1444 WeakPolarHBondContact O-CA 3.27Å; C1438-S1445 WeakPolarHBondContact CB-O 3.28Å; C1438-S1445 VanDerWaalsContact CB-OG 3.27Å; C1438-S1445 WeakPolarHBondContact CB-OG 3.39Å; C1438-S1445 PolarHBondContact N-O 3.12Å; C1438-S1445 PolarHBondContact O-N 3.14Å; C1438-L1447 VanDerWaalsContact SG-CD1 3.56Å
1439	L	90.2	Very high	85	Confident	1.4 Å²	1.4	55.2 Å²	55.2	1%	0.007	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	107.2	-178.8	-59	-174.1	0	0	0	109	C1416 K1417 F1419 L1437 I1444 I1503 T1506 L1507 L1510	C1416-L1439 CarbonylContact C-O 3.51Å; C1416-L1439 VanDerWaalsContact CA-O 3.29Å; C1416-L1439 WeakPolarHBondContact CA-O 3.41Å; K1417-L1439 PolarHBondContact N-O 3.26Å; K1417-L1439 PolarHBondContact O-N 3.07Å; F1419-L1439 HydrophobicContact CD2-CD1 3.92Å; F1419-L1439 HydrophobicContact CD2-CG 4.14Å; F1419-L1439 HydrophobicContact CE2-CB 4.5Å; F1419-L1439 HydrophobicContact CE2-CD1 3.74Å; F1419-L1439 HydrophobicContact CE2-CG 4.23Å; L1437-L1439 HydrophobicContact CD1-CD2 3.95Å; L1437-L1439 HydrophobicContact CD2-CD2 4.04Å; L1437-L1439 HydrophobicContact CD2-CG 4.44Å; L1437-L1439 HydrophobicContact CG-CD2 3.79Å; L1437-L1439 HydrophobicContact CG-CG 4.2Å; L1439-I1444 HydrophobicContact CD2-CB 4.44Å; L1439-I1444 HydrophobicContact CD2-CD1 4.16Å; L1439-I1444 HydrophobicContact CD2-CG1 3.94Å; L1439-I1444 HydrophobicContact CD2-CG2 3.84Å; L1439-I1503 HydrophobicContact CD1-CG2 4.28Å; L1439-T1506 HydrophobicContact CB-CG2 3.71Å; L1439-T1506 HydrophobicContact CD1-CG2 3.67Å; L1439-T1506 HydrophobicContact CG-CG2 4.34Å; L1439-L1507 HydrophobicContact CD1-CD2 3.86Å; L1439-L1507 HydrophobicContact CD1-CG 3.92Å; L1439-L1507 HydrophobicContact CD2-CD2 3.73Å; L1439-L1507 HydrophobicContact CD2-CG 4.42Å; L1439-L1507 HydrophobicContact CG-CD2 4.4Å; L1439-L1510 VanDerWaalsContact C-CD1 3.45Å; L1439-L1510 HydrophobicContact CB-CD1 3.58Å
1440	G	86.3	Confident	86	Confident	2 Å²	2	53.5 Å²	53.5	2%	0.021	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	164.4	-178.9	0	0	0	0	0	113.4	G1415 C1416 A1442 Y1443 T1460 L1510	G1415-G1440 WeakPolarHBondContact O-CA 3.45Å; C1416-G1440 VanDerWaalsContact SG-CA 3.57Å; G1440-A1442 PolarHBondContact O-N 3.15Å; G1440-Y1443 CarbonylContact C-O 3.47Å; G1440-Y1443 WeakPolarHBondContact CA-O 3.46Å; G1440-Y1443 PolarHBondContact N-O 3Å; G1440-Y1443 VanDerWaalsContact N-O 3.13Å; G1440-Y1443 PolarHBondContact O-N 2.94Å; G1440-T1460 PolarHBondContact O-OG1 3.05Å; G1440-L1510 VanDerWaalsContact C-CD2 3.46Å
1441	A	82.1	Confident	86.7	Confident	38.4 Å²	38.4	50.7 Å²	50.7	32%	0.317	25%	0.249	S	C	.	.	S	Bend	trans	-59.2	-48.1	-171.7	0	0	0	0	0	112.8	T1460 L1510 I1513 N1514	A1441-T1460 VanDerWaalsContact O-CB 3.28Å; A1441-T1460 WeakPolarHBondContact O-CB 3.43Å; A1441-T1460 PolarHBondContact O-OG1 2.83Å; A1441-L1510 HydrophobicContact CB-CD2 4.37Å; A1441-I1513 HydrophobicContact CB-CG2 4.27Å; A1441-N1514 PolarHBondContact O-ND2 3.24Å; A1441-N1514 PolarHBondContact O-OD1 3.18Å
1442	A	82.5	Confident	87.2	Confident	58 Å²	58	44.4 Å²	44.4	48%	0.479	23%	0.226	S	C	.	.	S	Bend	trans	-85	-33.3	-179.3	0	0	0	0	0	113.7	G1440 T1460	G1440-A1442 PolarHBondContact O-N 3.15Å; A1442-T1460 VanDerWaalsContact C-OG1 3.29Å; A1442-T1460 PolarHBondContact O-N 3.25Å; A1442-T1460 VanDerWaalsContact O-N 3.12Å; A1442-T1460 PolarHBondContact O-OG1 3.01Å
1443	Y	88.2	Confident	87.5	Confident	95.8 Å²	95.8	40.6 Å²	40.6	38%	0.376	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	145.3	-173.2	-60.2	-86.2	0	0	0	113.3	G1440 K1457 Q1458 K1459 T1460	G1440-Y1443 CarbonylContact C-O 3.47Å; G1440-Y1443 WeakPolarHBondContact CA-O 3.46Å; G1440-Y1443 PolarHBondContact N-O 3Å; G1440-Y1443 VanDerWaalsContact N-O 3.13Å; G1440-Y1443 PolarHBondContact O-N 2.94Å; Y1443-K1457 VanDerWaalsContact CB-CE 3.49Å; Y1443-K1457 HydrophobicContact CD1-CD 4.19Å; Y1443-K1457 VanDerWaalsContact CD1-CE 3.45Å; Y1443-K1457 HydrophobicContact CD1-CG 3.85Å; Y1443-K1457 VanDerWaalsContact CD2-CE 3.43Å; Y1443-K1457 HydrophobicContact CG-CD 4.24Å; Y1443-K1457 HydrophobicContact CG-CG 4.11Å; Y1443-Q1458 CarbonylContact C-O 3.57Å; Y1443-Q1458 VanDerWaalsContact CA-O 3.29Å; Y1443-Q1458 WeakPolarHBondContact CA-O 3.3Å; Y1443-K1459 HydrophobicContact CD1-CG 4.1Å; Y1443-K1459 HydrophobicContact CE1-CG 3.7Å; Y1443-T1460 VanDerWaalsContact CA-OG1 3.24Å; Y1443-T1460 WeakPolarHBondContact CA-OG1 3.32Å; Y1443-T1460 PolarHBondContact N-OG1 3Å; Y1443-T1460 VanDerWaalsContact N-OG1 3.09Å
1444	I	90.6	Very high	87.8	Confident	0.6 Å²	0.6	42.7 Å²	42.7	0%	0.003	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	123.5	162.9	-67.9	171.9	0	0	0	107.6	L1437 C1438 L1439 K1457 Q1458 T1460 L1463 L1479 F1481 W1486 L1507	L1437-I1444 HydrophobicContact CD1-CG2 3.91Å; C1438-I1444 WeakPolarHBondContact O-CA 3.27Å; L1439-I1444 HydrophobicContact CD2-CB 4.44Å; L1439-I1444 HydrophobicContact CD2-CD1 4.16Å; L1439-I1444 HydrophobicContact CD2-CG1 3.94Å; L1439-I1444 HydrophobicContact CD2-CG2 3.84Å; I1444-K1457 WeakPolarHBondContact O-CA 3.37Å; I1444-Q1458 PolarHBondContact N-O 3.14Å; I1444-Q1458 PolarHBondContact O-N 2.98Å; I1444-T1460 HydrophobicContact CD1-CG2 4.33Å; I1444-T1460 HydrophobicContact CG1-CG2 4.4Å; I1444-T1460 PolarHBondContact N-OG1 2.92Å; I1444-L1463 HydrophobicContact CD1-CD2 4.14Å; I1444-L1479 HydrophobicContact CG2-CD1 4.42Å; I1444-F1481 HydrophobicContact CB-CE1 4.43Å; I1444-F1481 HydrophobicContact CB-CZ 4.35Å; I1444-F1481 HydrophobicContact CD1-CE1 4.09Å; I1444-F1481 HydrophobicContact CD1-CZ 4.2Å; I1444-F1481 HydrophobicContact CG2-CZ 4.15Å; I1444-W1486 HydrophobicContact CG2-CH2 4.36Å; I1444-W1486 HydrophobicContact CG2-CZ3 3.85Å; I1444-L1507 HydrophobicContact CD1-CD2 3.89Å
1445	S	91.2	Very high	87.9	Confident	0.8 Å²	0.8	36.7 Å²	36.7	1%	0.006	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	154.8	-175.2	-21.9	0	0	0	0	111.8	P1412 C1438 R1456 K1457	P1412-S1445 WeakPolarHBondContact O-CB 3.4Å; P1412-S1445 PolarHBondContact O-OG 3.09Å; P1412-S1445 VanDerWaalsContact O-OG 3.07Å; C1438-S1445 WeakPolarHBondContact CB-O 3.28Å; C1438-S1445 VanDerWaalsContact CB-OG 3.27Å; C1438-S1445 WeakPolarHBondContact CB-OG 3.39Å; C1438-S1445 PolarHBondContact N-O 3.12Å; C1438-S1445 PolarHBondContact O-N 3.14Å; S1445-R1456 CarbonylContact C-O 3.54Å; S1445-R1456 WeakPolarHBondContact CA-O 3.28Å; S1445-K1457 WeakPolarHBondContact OG-CG 3.28Å
1446	L	91.2	Very high	87.9	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	119.1	179.5	-162.1	71.6	0	0	0	109.8	V1421 E1423 R1435 I1436 L1437 I1455 R1456 W1486 F1488	V1421-L1446 HydrophobicContact CG2-CD1 4.49Å; E1423-L1446 WeakPolarHBondContact OE1-CD2 3.25Å; E1423-L1446 VanDerWaalsContact OE2-CD2 3.28Å; E1423-L1446 WeakPolarHBondContact OE2-CD2 3.41Å; R1435-L1446 HydrophobicContact CB-CD1 3.78Å; R1435-L1446 HydrophobicContact CB-CD2 4.31Å; R1435-L1446 HydrophobicContact CB-CG 4.13Å; R1435-L1446 HydrophobicContact CG-CD1 4.12Å; R1435-L1446 HydrophobicContact CG-CD2 4.1Å; R1435-L1446 HydrophobicContact CG-CG 4.17Å; I1436-L1446 CarbonylContact O-C 3.52Å; I1436-L1446 WeakPolarHBondContact O-CA 3.37Å; L1437-L1446 HydrophobicContact CB-CD1 4.21Å; L1437-L1446 HydrophobicContact CD1-CD1 4.15Å; L1446-I1455 WeakPolarHBondContact O-CA 3.34Å; L1446-I1455 VanDerWaalsContact O-CB 3.31Å; L1446-I1455 WeakPolarHBondContact O-CB 3.33Å; L1446-I1455 PolarHBondContact O-N 3.14Å; L1446-R1456 HydrophobicContact CB-CB 4.33Å; L1446-R1456 PolarHBondContact N-O 3.29Å; L1446-R1456 PolarHBondContact O-N 3.07Å; L1446-W1486 HydrophobicContact CB-CH2 4.44Å; L1446-W1486 HydrophobicContact CB-CZ3 4.2Å; L1446-W1486 HydrophobicContact CD2-CE3 4.47Å; L1446-F1488 HydrophobicContact CD1-CE1 3.85Å; L1446-F1488 HydrophobicContact CD1-CZ 4Å; L1446-F1488 HydrophobicContact CD2-CE1 4.33Å; L1446-F1488 HydrophobicContact CD2-CZ 4.43Å
1447	L	91	Very high	88	Confident	0.2 Å²	0.2	43.6 Å²	43.6	0%	0.001	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	153.2	-176.4	-50.8	-179.9	0	0	0	112.7	P1262 P1412 A1413 I1436 C1438 T1453 L1454	P1262-L1447 HydrophobicContact CB-CD1 4.41Å; P1262-L1447 HydrophobicContact CG-CD1 4.01Å; P1412-L1447 HydrophobicContact CB-CD2 4.01Å; P1412-L1447 HydrophobicContact CG-CD2 4.01Å; A1413-L1447 HydrophobicContact CB-CD1 4.2Å; I1436-L1447 HydrophobicContact CB-CB 4.25Å; I1436-L1447 PolarHBondContact N-O 2.94Å; I1436-L1447 VanDerWaalsContact N-O 3.11Å; I1436-L1447 PolarHBondContact O-N 3.19Å; C1438-L1447 VanDerWaalsContact SG-CD1 3.56Å; L1447-T1453 WeakPolarHBondContact CA-O 3.34Å; L1447-L1454 HydrophobicContact CD2-CB 4.32Å; L1447-L1454 HydrophobicContact CD2-CD1 3.87Å
1448	R	89.5	Confident	87.9	Confident	111 Å²	111	45.7 Å²	45.7	42%	0.419	24%	0.242	S	C	.	.			trans	-79	127.5	170.9	-166	174.7	-63.8	135.6	-3.8	110.2	S1450 T1451 K1452 T1453 I1455	R1448-S1450 VanDerWaalsContact C-N 3.31Å; R1448-S1450 PolarHBondContact O-N 3.26Å; R1448-S1450 VanDerWaalsContact O-N 3.15Å; R1448-T1451 WeakPolarHBondContact CB-OG1 3.28Å; R1448-T1451 WeakPolarHBondContact CD-OG1 3.31Å; R1448-T1451 PolarHBondContact NH1-OG1 3.15Å; R1448-T1451 VanDerWaalsContact NH1-OG1 3.14Å; R1448-T1451 PolarHBondContact O-N 2.69Å; R1448-K1452 VanDerWaalsContact O-CA 3.24Å; R1448-K1452 WeakPolarHBondContact O-CA 3.35Å; R1448-K1452 PolarHBondContact O-N 2.93Å; R1448-T1453 PolarHBondContact N-O 3.04Å; R1448-T1453 PolarHBondContact NH1-OG1 2.99Å; R1448-T1453 VanDerWaalsContact NH1-OG1 3.09Å; R1448-I1455 HydrophobicContact CB-CD1 3.89Å; R1448-I1455 HydrophobicContact CB-CG1 4.19Å; R1448-I1455 HydrophobicContact CG-CD1 4.44Å
1449	P	85.3	Confident	87.7	Confident	44.4 Å²	44.4	51.6 Å²	51.6	29%	0.288	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-34.4	-174.1	-26.9	35.2	0	0	0	115.4	R1434 I1436 K1452	R1434-P1449 HydrophobicContact CB-CG 4.06Å; R1434-P1449 VanDerWaalsContact O-CD 3.29Å; R1434-P1449 WeakPolarHBondContact O-CD 3.31Å; R1434-P1449 VanDerWaalsContact O-CG 3.31Å; R1434-P1449 WeakPolarHBondContact O-CG 3.38Å; I1436-P1449 HydrophobicContact CG1-CB 4.49Å; I1436-P1449 HydrophobicContact CG1-CG 4.43Å; P1449-K1452 WeakPolarHBondContact O-CD 3.13Å; P1449-K1452 VanDerWaalsContact O-CE 3.31Å; P1449-K1452 WeakPolarHBondContact O-CE 3.32Å; P1449-K1452 PolarHBondContact O-NZ 2.99Å
1450	S	82.7	Confident	87.4	Confident	93.6 Å²	93.6	51.6 Å²	51.6	66%	0.655	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-44.9	-175.8	50.5	0	0	0	0	113.9	R1448	R1448-S1450 VanDerWaalsContact C-N 3.31Å; R1448-S1450 PolarHBondContact O-N 3.26Å; R1448-S1450 VanDerWaalsContact O-N 3.15Å
1451	T	84.9	Confident	87.1	Confident	57.6 Å²	57.6	55.6 Å²	55.6	35%	0.353	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.2	-10.3	-176.5	52.8	0	0	0	0	113.6	R1448 T1453	R1448-T1451 WeakPolarHBondContact CB-OG1 3.28Å; R1448-T1451 WeakPolarHBondContact CD-OG1 3.31Å; R1448-T1451 PolarHBondContact NH1-OG1 3.15Å; R1448-T1451 VanDerWaalsContact NH1-OG1 3.14Å; R1448-T1451 PolarHBondContact O-N 2.69Å; T1451-T1453 PolarHBondContact O-N 3.16Å; T1451-T1453 PolarHBondContact OG1-N 2.63Å; T1451-T1453 PolarHBondContact OG1-OG1 3.12Å
1452	K	85.8	Confident	87.2	Confident	38.4 Å²	38.4	55.3 Å²	55.3	17%	0.167	29%	0.288	C	S	.	.			trans	56	2.1	-170.9	-53.4	-68.1	-176.2	-179.6	0	115.3	P1262 C1263 I1436 R1448 P1449	P1262-K1452 HydrophobicContact CB-CB 4.48Å; P1262-K1452 HydrophobicContact CB-CD 3.91Å; P1262-K1452 HydrophobicContact CB-CG 4.22Å; C1263-K1452 WeakPolarHBondContact O-CB 3.44Å; C1263-K1452 WeakPolarHBondContact O-CD 3.49Å; C1263-K1452 VanDerWaalsContact O-CG 3.28Å; C1263-K1452 WeakPolarHBondContact O-CG 3.39Å; I1436-K1452 HydrophobicContact CD1-CD 4.27Å; R1448-K1452 VanDerWaalsContact O-CA 3.24Å; R1448-K1452 WeakPolarHBondContact O-CA 3.35Å; R1448-K1452 PolarHBondContact O-N 2.93Å; P1449-K1452 WeakPolarHBondContact O-CD 3.13Å; P1449-K1452 VanDerWaalsContact O-CE 3.31Å; P1449-K1452 WeakPolarHBondContact O-CE 3.32Å; P1449-K1452 PolarHBondContact O-NZ 2.99Å
1453	T	87.1	Confident	87.1	Confident	56.4 Å²	56.4	53.3 Å²	53.3	35%	0.346	27%	0.269	S	S	.	.			trans	-66.2	147.3	177.2	56.7	0	0	0	0	112.4	L1447 R1448 T1451	L1447-T1453 WeakPolarHBondContact CA-O 3.34Å; R1448-T1453 PolarHBondContact N-O 3.04Å; R1448-T1453 PolarHBondContact NH1-OG1 2.99Å; R1448-T1453 VanDerWaalsContact NH1-OG1 3.09Å; T1451-T1453 PolarHBondContact O-N 3.16Å; T1451-T1453 PolarHBondContact OG1-N 2.63Å; T1451-T1453 PolarHBondContact OG1-OG1 3.12Å
1454	L	89.6	Confident	86.6	Confident	76.8 Å²	76.8	54.9 Å²	54.9	40%	0.402	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	140	173.8	-170	63.7	0	0	0	112.2	P1412 L1447 R1456 K1457	P1412-L1454 HydrophobicContact CB-CD1 4.07Å; P1412-L1454 HydrophobicContact CG-CB 4.36Å; P1412-L1454 HydrophobicContact CG-CD2 4.49Å; L1447-L1454 HydrophobicContact CD2-CB 4.32Å; L1447-L1454 HydrophobicContact CD2-CD1 3.87Å; L1454-R1456 VanDerWaalsContact CD1-O 3.26Å; L1454-R1456 WeakPolarHBondContact CD1-O 3.34Å; L1454-K1457 HydrophobicContact CD1-CB 4.18Å; L1454-K1457 HydrophobicContact CD2-CB 4.03Å; L1454-K1457 HydrophobicContact CD2-CD 4.28Å; L1454-K1457 HydrophobicContact CG-CB 4.47Å
1455	I	88.7	Confident	85.9	Confident	53.8 Å²	53.8	61.5 Å²	61.5	28%	0.276	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	-47.7	173.9	-56.1	173.3	0	0	0	110.2	R1435 L1446 R1448	R1435-I1455 VanDerWaalsContact CD-CD1 3.46Å; L1446-I1455 WeakPolarHBondContact O-CA 3.34Å; L1446-I1455 VanDerWaalsContact O-CB 3.31Å; L1446-I1455 WeakPolarHBondContact O-CB 3.33Å; L1446-I1455 PolarHBondContact O-N 3.14Å; R1448-I1455 HydrophobicContact CB-CD1 3.89Å; R1448-I1455 HydrophobicContact CB-CG1 4.19Å; R1448-I1455 HydrophobicContact CG-CD1 4.44Å
1456	R	88.9	Confident	85.5	Confident	87.4 Å²	87.4	64.2 Å²	64.2	33%	0.33	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	149.3	175.5	-70.6	-172.3	-146.1	146.8	0.5	110	E1423 S1445 L1446 L1454 W1486	E1423-R1456 VanDerWaalsContact CD-NH2 3.33Å; E1423-R1456 IonicContact OE1-CZ 2.9Å; E1423-R1456 IonicContact OE1-NE 3.6Å; E1423-R1456 IonicContact OE1-NH1 3.1Å; E1423-R1456 PolarHBondContact OE1-NH1 2.9Å; E1423-R1456 IonicContact OE1-NH2 3.28Å; E1423-R1456 PolarHBondContact OE1-NH2 3.21Å; E1423-R1456 IonicContact OE2-NH2 2.83Å; S1445-R1456 CarbonylContact C-O 3.54Å; S1445-R1456 WeakPolarHBondContact CA-O 3.28Å; L1446-R1456 HydrophobicContact CB-CB 4.33Å; L1446-R1456 PolarHBondContact N-O 3.29Å; L1446-R1456 PolarHBondContact O-N 3.07Å; L1454-R1456 VanDerWaalsContact CD1-O 3.26Å; L1454-R1456 WeakPolarHBondContact CD1-O 3.34Å; R1456-W1486 HydrophobicContact CB-CH2 3.86Å; R1456-W1486 HydrophobicContact CB-CZ2 3.71Å; R1456-W1486 HydrophobicContact CG-CZ2 4.43Å
1457	K	90.1	Very high	84.7	Confident	100 Å²	100	69.3 Å²	69.3	44%	0.435	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	130.4	173.4	-174.3	169.9	179.6	174.8	0	108.5	Y1443 I1444 S1445 L1454	Y1443-K1457 VanDerWaalsContact CB-CE 3.49Å; Y1443-K1457 HydrophobicContact CD1-CD 4.19Å; Y1443-K1457 VanDerWaalsContact CD1-CE 3.45Å; Y1443-K1457 HydrophobicContact CD1-CG 3.85Å; Y1443-K1457 VanDerWaalsContact CD2-CE 3.43Å; Y1443-K1457 HydrophobicContact CG-CD 4.24Å; Y1443-K1457 HydrophobicContact CG-CG 4.11Å; I1444-K1457 WeakPolarHBondContact O-CA 3.37Å; S1445-K1457 WeakPolarHBondContact OG-CG 3.28Å; L1454-K1457 HydrophobicContact CD1-CB 4.18Å; L1454-K1457 HydrophobicContact CD2-CB 4.03Å; L1454-K1457 HydrophobicContact CD2-CD 4.28Å; L1454-K1457 HydrophobicContact CG-CB 4.47Å
1458	Q	89.6	Confident	83.9	Confident	42.6 Å²	42.6	71.1 Å²	71.1	20%	0.199	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	144.6	-176.8	-164.4	74.4	29.2	0	0	108.7	Y1443 I1444 T1460 S1462 F1481 T1483 T1484 W1486	Y1443-Q1458 CarbonylContact C-O 3.57Å; Y1443-Q1458 VanDerWaalsContact CA-O 3.29Å; Y1443-Q1458 WeakPolarHBondContact CA-O 3.3Å; I1444-Q1458 PolarHBondContact N-O 3.14Å; I1444-Q1458 PolarHBondContact O-N 2.98Å; Q1458-T1460 PolarHBondContact O-N 3.01Å; Q1458-S1462 VanDerWaalsContact CG-OG 3.28Å; Q1458-S1462 WeakPolarHBondContact CG-OG 3.41Å; Q1458-S1462 PolarHBondContact NE2-OG 3.1Å; Q1458-F1481 HydrophobicContact CB-CD1 4.24Å; Q1458-F1481 HydrophobicContact CB-CE1 4.07Å; Q1458-F1481 HydrophobicContact CB-CG 4.44Å; Q1458-F1481 HydrophobicContact CB-CZ 4.32Å; Q1458-F1481 VanDerWaalsContact CD-CG 3.47Å; Q1458-F1481 HydrophobicContact CG-CB 4.1Å; Q1458-F1481 HydrophobicContact CG-CD1 3.43Å; Q1458-F1481 HydrophobicContact CG-CD2 4.17Å; Q1458-F1481 HydrophobicContact CG-CE1 3.77Å; Q1458-F1481 HydrophobicContact CG-CE2 4.42Å; Q1458-F1481 HydrophobicContact CG-CG 3.69Å; Q1458-F1481 HydrophobicContact CG-CZ 4.23Å; Q1458-F1481 VanDerWaalsContact OE1-CD2 3.31Å; Q1458-T1483 PolarHBondContact NE2-OG1 3.42Å; Q1458-T1484 PolarHBondContact NE2-OG1 3.45Å; Q1458-T1484 PolarHBondContact OE1-OG1 2.92Å; Q1458-W1486 HydrophobicContact CB-CH2 4.12Å; Q1458-W1486 HydrophobicContact CB-CZ2 3.9Å; Q1458-W1486 VanDerWaalsContact OE1-CE2 3.29Å
1459	K	87.1	Confident	82.6	Confident	123.6 Å²	123.6	66.6 Å²	66.6	54%	0.537	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	133.5	178.5	-70.6	-178.8	178.4	179.4	0	109.4	Y1443 V1461 S1462	Y1443-K1459 HydrophobicContact CD1-CG 4.1Å; Y1443-K1459 HydrophobicContact CE1-CG 3.7Å; K1459-V1461 VanDerWaalsContact C-N 3.27Å; K1459-V1461 HydrophobicContact CB-CG2 3.75Å; K1459-V1461 HydrophobicContact CD-CG2 4.34Å; K1459-V1461 PolarHBondContact O-N 3.17Å; K1459-S1462 PolarHBondContact O-N 2.88Å; K1459-S1462 PolarHBondContact O-OG 3.23Å
1460	T	83.9	Confident	81.2	Confident	3 Å²	3	69.8 Å²	69.8	2%	0.018	36%	0.364	C	S	.	.	G	3₁₀ helix	trans	-60.6	-36.4	-179	-55.1	0	0	0	0	111.6	G1440 A1441 A1442 Y1443 I1444 Q1458 S1462 L1463 L1510 N1514	G1440-T1460 PolarHBondContact O-OG1 3.05Å; A1441-T1460 VanDerWaalsContact O-CB 3.28Å; A1441-T1460 WeakPolarHBondContact O-CB 3.43Å; A1441-T1460 PolarHBondContact O-OG1 2.83Å; A1442-T1460 VanDerWaalsContact C-OG1 3.29Å; A1442-T1460 PolarHBondContact O-N 3.25Å; A1442-T1460 VanDerWaalsContact O-N 3.12Å; A1442-T1460 PolarHBondContact O-OG1 3.01Å; Y1443-T1460 VanDerWaalsContact CA-OG1 3.24Å; Y1443-T1460 WeakPolarHBondContact CA-OG1 3.32Å; Y1443-T1460 PolarHBondContact N-OG1 3Å; Y1443-T1460 VanDerWaalsContact N-OG1 3.09Å; I1444-T1460 HydrophobicContact CD1-CG2 4.33Å; I1444-T1460 HydrophobicContact CG1-CG2 4.4Å; I1444-T1460 PolarHBondContact N-OG1 2.92Å; Q1458-T1460 PolarHBondContact O-N 3.01Å; T1460-S1462 PolarHBondContact O-N 3.21Å; T1460-S1462 VanDerWaalsContact O-N 3.13Å; T1460-L1463 VanDerWaalsContact O-CB 3.28Å; T1460-L1463 WeakPolarHBondContact O-CB 3.32Å; T1460-L1463 PolarHBondContact O-N 3.07Å; T1460-L1463 VanDerWaalsContact O-N 3.12Å; T1460-L1510 HydrophobicContact CG2-CB 4.01Å; T1460-N1514 WeakPolarHBondContact CB-ND2 3.28Å; T1460-N1514 VanDerWaalsContact CG2-ND2 3.26Å; T1460-N1514 WeakPolarHBondContact CG2-ND2 3.2Å
1461	V	79.7	Confident	79.8	Confident	85 Å²	85	66.9 Å²	66.9	52%	0.515	35%	0.349	S	S	.	.	G	3₁₀ helix	trans	-59.2	-14.6	173	-99.8	0	0	0	0	115.1	K1459 N1514 T1518	K1459-V1461 VanDerWaalsContact C-N 3.27Å; K1459-V1461 HydrophobicContact CB-CG2 3.75Å; K1459-V1461 HydrophobicContact CD-CG2 4.34Å; K1459-V1461 PolarHBondContact O-N 3.17Å; V1461-N1514 HydrophobicContact CG1-CB 3.75Å; V1461-N1514 WeakPolarHBondContact CG1-OD1 3.42Å; V1461-N1514 HydrophobicContact CG2-CB 4.41Å; V1461-T1518 HydrophobicContact CG1-CG2 4.27Å; V1461-T1518 VanDerWaalsContact CG1-OG1 3.29Å; V1461-T1518 WeakPolarHBondContact CG1-OG1 3.3Å
1462	S	82.8	Confident	78.2	Confident	33.2 Å²	33.2	68.9 Å²	68.9	23%	0.232	37%	0.365	C	S	.	.	G	3₁₀ helix	trans	-95.2	1.5	177	64.2	0	0	0	0	114	Q1458 K1459 T1460 L1464 F1481	Q1458-S1462 VanDerWaalsContact CG-OG 3.28Å; Q1458-S1462 WeakPolarHBondContact CG-OG 3.41Å; Q1458-S1462 PolarHBondContact NE2-OG 3.1Å; K1459-S1462 PolarHBondContact O-N 2.88Å; K1459-S1462 PolarHBondContact O-OG 3.23Å; T1460-S1462 PolarHBondContact O-N 3.21Å; T1460-S1462 VanDerWaalsContact O-N 3.13Å; S1462-L1464 PolarHBondContact O-N 3.15Å; S1462-F1481 CarbonylContact O-C 3.47Å; S1462-F1481 VanDerWaalsContact O-C 3.32Å; S1462-F1481 VanDerWaalsContact O-CA 3.23Å; S1462-F1481 WeakPolarHBondContact O-CA 3.37Å
1463	L	81.9	Confident	76.6	Confident	15.6 Å²	15.6	73.3 Å²	73.3	8%	0.082	40%	0.396	C	S	.	.			trans	-74	107.6	173.1	-176.9	69.3	0	0	0	109.6	I1444 T1460 R1465 W1466 L1479 F1481 L1507 V1511	I1444-L1463 HydrophobicContact CD1-CD2 4.14Å; T1460-L1463 VanDerWaalsContact O-CB 3.28Å; T1460-L1463 WeakPolarHBondContact O-CB 3.32Å; T1460-L1463 PolarHBondContact O-N 3.07Å; T1460-L1463 VanDerWaalsContact O-N 3.12Å; L1463-R1465 WeakPolarHBondContact CD1-O 3.42Å; L1463-W1466 HydrophobicContact CD2-CD2 4.42Å; L1463-W1466 HydrophobicContact CD2-CE3 3.8Å; L1463-W1466 HydrophobicContact CD2-CZ3 4.15Å; L1463-W1466 HydrophobicContact CG-CE3 4.18Å; L1463-L1479 HydrophobicContact CD1-CB 4Å; L1463-L1479 HydrophobicContact CD1-CD2 4.43Å; L1463-F1481 HydrophobicContact CB-CD1 4.02Å; L1463-F1481 HydrophobicContact CB-CE1 3.93Å; L1463-F1481 HydrophobicContact CD1-CD1 4.05Å; L1463-F1481 HydrophobicContact CD1-CE1 3.78Å; L1463-F1481 HydrophobicContact CD1-CE2 4.35Å; L1463-F1481 HydrophobicContact CD1-CG 4.45Å; L1463-F1481 HydrophobicContact CD1-CZ 4.02Å; L1463-F1481 HydrophobicContact CG-CE1 4.44Å; L1463-L1507 HydrophobicContact CD2-CD2 3.94Å; L1463-V1511 HydrophobicContact CD2-CG2 4.31Å
1464	L	76.7	Confident	75	Confident	128.6 Å²	128.6	74.9 Å²	74.9	67%	0.673	40%	0.402	S	S	*	.			trans	-80.8	-41.5	-179.2	-62.3	179.2	0	0	0	111.8	S1462 D1480 G1482	S1462-L1464 PolarHBondContact O-N 3.15Å; L1464-D1480 PolarHBondContact N-O 3.19Å; L1464-G1482 VanDerWaalsContact CD1-CA 3.43Å
1465	R	77.3	Confident	73.8	Confident	138.6 Å²	138.6	77.1 Å²	77.1	52%	0.523	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158	160.8	177.6	61.6	179.3	-178.1	151.4	4.2	110.8	L1463 D1480 K1485	L1463-R1465 WeakPolarHBondContact CD1-O 3.42Å; R1465-D1480 HydrophobicContact CG-CB 3.63Å; R1465-D1480 IonicContact CZ-OD2 3.19Å; R1465-D1480 VanDerWaalsContact CZ-OD2 3.29Å; R1465-D1480 PolarHBondContact N-O 3.03Å; R1465-D1480 IonicContact NE-OD2 3.24Å; R1465-D1480 PolarHBondContact NE-OD2 3.26Å; R1465-D1480 IonicContact NH2-OD2 2.8Å; R1465-D1480 PolarHBondContact NH2-OD2 3.2Å; R1465-D1480 VanDerWaalsContact NH2-OD2 3.13Å; R1465-D1480 VanDerWaalsContact O-CB 3.29Å; R1465-D1480 WeakPolarHBondContact O-CB 3.39Å; R1465-D1480 PolarHBondContact O-N 3.08Å; R1465-K1485 VanDerWaalsContact NH2-NZ 3.18Å
1466	W	81.7	Confident	73	Confident	58 Å²	58	76 Å²	76	22%	0.22	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	153.2	166.3	61.2	105.5	0	0	0	109.6	L1463 T1478 L1479 L1507 W1508 V1511	L1463-W1466 HydrophobicContact CD2-CD2 4.42Å; L1463-W1466 HydrophobicContact CD2-CE3 3.8Å; L1463-W1466 HydrophobicContact CD2-CZ3 4.15Å; L1463-W1466 HydrophobicContact CG-CE3 4.18Å; W1466-T1478 CarbonylContact C-O 3.58Å; W1466-T1478 VanDerWaalsContact CA-O 3.23Å; W1466-T1478 WeakPolarHBondContact CA-O 3.42Å; W1466-T1478 VanDerWaalsContact CB-O 3.3Å; W1466-T1478 WeakPolarHBondContact CB-O 3.35Å; W1466-L1479 HydrophobicContact CB-CD2 3.7Å; W1466-L1507 HydrophobicContact CB-CD1 4.08Å; W1466-L1507 VanDerWaalsContact CD1-CD1 3.48Å; W1466-L1507 HydrophobicContact CD2-CB 4.18Å; W1466-L1507 HydrophobicContact CD2-CD1 4.26Å; W1466-L1507 HydrophobicContact CG-CB 4.43Å; W1466-L1507 HydrophobicContact CG-CD1 3.74Å; W1466-L1507 HydrophobicContact CH2-CB 4.24Å; W1466-L1507 HydrophobicContact CZ2-CB 4.02Å; W1466-W1508 HydrophobicContact CH2-CB 4.33Å; W1466-W1508 AromaticContact CH2-CD1 3.83Å; W1466-W1508 HydrophobicContact CH2-CG 4.39Å; W1466-W1508 HydrophobicContact CZ2-CB 4.04Å; W1466-W1508 AromaticContact CZ2-CD1 3.73Å; W1466-W1508 HydrophobicContact CZ2-CG 4.27Å; W1466-V1511 HydrophobicContact CH2-CB 4.38Å; W1466-V1511 HydrophobicContact CH2-CG2 4.13Å; W1466-V1511 HydrophobicContact CZ3-CG2 3.93Å
1467	H	75.4	Confident	72.6	Confident	107.2 Å²	107.2	72.5 Å²	72.5	50%	0.496	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	129.8	171.8	-124.3	-9.2	0	0	0	108.4	L1477 T1478	H1467-L1477 CarbonylContact O-C 3.48Å; H1467-L1477 WeakPolarHBondContact O-CA 3.3Å; H1467-T1478 WeakPolarHBondContact CB-OG1 3.48Å; H1467-T1478 PolarHBondContact N-O 3.09Å; H1467-T1478 PolarHBondContact O-N 3.16Å
1468	V	73.2	Confident	72.3	Confident	39.2 Å²	39.2	68.9 Å²	68.9	24%	0.238	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	113.5	173.1	-171.2	0	0	0	0	106.5	S1470 L1477 A1500 P1653	V1468-S1470 PolarHBondContact O-N 3.2Å; V1468-L1477 HydrophobicContact CB-CD1 4.49Å; V1468-L1477 HydrophobicContact CG1-CD1 4.41Å; V1468-L1477 HydrophobicContact CG2-CD1 4Å; V1468-A1500 VanDerWaalsContact CG1-CA 3.5Å; V1468-A1500 HydrophobicContact CG1-CB 3.63Å; V1468-P1653 HydrophobicContact CB-CB 4.43Å; V1468-P1653 WeakPolarHBondContact O-CB 3.41Å
1469	G	62.9	Low	72.2	Confident	16.4 Å²	16.4	66.9 Å²	66.9	17%	0.169	37%	0.367	C	S	.	.			trans	-67.2	117.5	175.5	0	0	0	0	0	110	D1474 S1476	G1469-D1474 CarbonylContact C-O 3.57Å; G1469-D1474 VanDerWaalsContact C-O 3.3Å; G1469-D1474 VanDerWaalsContact CA-O 3.28Å; G1469-D1474 WeakPolarHBondContact CA-O 3.35Å; G1469-S1476 PolarHBondContact N-O 3.24Å
1470	S	55.3	Low	72.1	Confident	110.6 Å²	110.6	61.5 Å²	61.5	77%	0.773	34%	0.344	S	S	*	.			trans	-102	9.8	-179.9	-168.7	0	0	0	0	113	V1468	V1468-S1470 PolarHBondContact O-N 3.2Å
1471	G	53.3	Low	72.1	Confident	33.8 Å²	33.8	61.7 Å²	61.7	35%	0.348	34%	0.344	S	S	.	.	S	Bend	trans	-84.5	154	178	0	0	0	0	0	112.2	T1473 D1474	G1471-T1473 VanDerWaalsContact C-N 3.25Å; G1471-T1473 PolarHBondContact O-N 3.29Å; G1471-T1473 VanDerWaalsContact O-N 3.11Å; G1471-D1474 PolarHBondContact O-N 3.06Å
1472	S	52.2	Low	72	Confident	98.6 Å²	98.6	59.8 Å²	59.8	69%	0.69	34%	0.343	S	S	*	.	S	Bend	trans	-58.6	-32.9	170.9	48.2	0	0	0	0	112.3	R1475	S1472-R1475 PolarHBondContact O-NE 3.09Å; S1472-R1475 PolarHBondContact O-NH2 3.1Å
1473	T	51.7	Low	71.8	Confident	131.2 Å²	131.2	63.9 Å²	63.9	81%	0.805	37%	0.366	S	S	*	.	S	Bend	trans	-92.6	-44.5	-178	51	0	0	0	0	114.1	G1471 R1475	G1471-T1473 VanDerWaalsContact C-N 3.25Å; G1471-T1473 PolarHBondContact O-N 3.29Å; G1471-T1473 VanDerWaalsContact O-N 3.11Å; T1473-R1475 PolarHBondContact O-N 3.04Å
1474	D	54.1	Low	72	Confident	89.2 Å²	89.2	65.8 Å²	65.8	48%	0.477	38%	0.379	S	S	.	.			trans	-99.3	88	-177.3	-166	-6.4	0	0	0	111.9	G1469 G1471 S1476	G1469-D1474 CarbonylContact C-O 3.57Å; G1469-D1474 VanDerWaalsContact C-O 3.3Å; G1469-D1474 VanDerWaalsContact CA-O 3.28Å; G1469-D1474 WeakPolarHBondContact CA-O 3.35Å; G1471-D1474 PolarHBondContact O-N 3.06Å; D1474-S1476 VanDerWaalsContact C-N 3.27Å; D1474-S1476 PolarHBondContact O-N 3.16Å; D1474-S1476 VanDerWaalsContact OD1-CB 3.26Å; D1474-S1476 WeakPolarHBondContact OD1-CB 3.3Å; D1474-S1476 PolarHBondContact OD1-N 3.04Å; D1474-S1476 VanDerWaalsContact OD1-N 3.15Å; D1474-S1476 PolarHBondContact OD1-OG 3.06Å; D1474-S1476 PolarHBondContact OD2-OG 2.91Å
1475	R	62.4	Low	72.4	Confident	123 Å²	123	64.4 Å²	64.4	46%	0.464	37%	0.367	S	S	.	.			trans	-95.3	43.6	177.5	-55.6	-175.7	-166.2	-178.2	1.3	112.2	S1472 T1473 I1489 G1490 V1492 D1496	S1472-R1475 PolarHBondContact O-NE 3.09Å; S1472-R1475 PolarHBondContact O-NH2 3.1Å; T1473-R1475 PolarHBondContact O-N 3.04Å; R1475-I1489 HydrophobicContact CB-CG2 4.24Å; R1475-I1489 WeakPolarHBondContact O-CA 3.45Å; R1475-I1489 WeakPolarHBondContact O-CG2 3.18Å; R1475-G1490 PolarHBondContact O-N 3.06Å; R1475-G1490 VanDerWaalsContact O-N 3.12Å; R1475-V1492 PolarHBondContact NH1-O 3.39Å; R1475-D1496 IonicContact CZ-OD2 2.75Å; R1475-D1496 IonicContact NH1-OD2 3.13Å; R1475-D1496 PolarHBondContact NH1-OD2 2.91Å
1476	S	73	Confident	73	Confident	30.6 Å²	30.6	58 Å²	58	21%	0.214	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	142.8	179.6	62.9	0	0	0	0	112.5	G1469 D1474 F1488	G1469-S1476 PolarHBondContact N-O 3.24Å; D1474-S1476 VanDerWaalsContact C-N 3.27Å; D1474-S1476 PolarHBondContact O-N 3.16Å; D1474-S1476 VanDerWaalsContact OD1-CB 3.26Å; D1474-S1476 WeakPolarHBondContact OD1-CB 3.3Å; D1474-S1476 PolarHBondContact OD1-N 3.04Å; D1474-S1476 VanDerWaalsContact OD1-N 3.15Å; D1474-S1476 PolarHBondContact OD1-OG 3.06Å; D1474-S1476 PolarHBondContact OD2-OG 2.91Å; S1476-F1488 CarbonylContact C-O 3.59Å; S1476-F1488 VanDerWaalsContact CA-O 3.25Å; S1476-F1488 WeakPolarHBondContact CA-O 3.36Å
1477	L	81.3	Confident	73.2	Confident	15 Å²	15	59.9 Å²	59.9	8%	0.079	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	123.6	167.8	165.2	74.3	0	0	0	107.4	L1437 H1467 V1468 L1479 F1488 I1503 L1507	L1437-L1477 HydrophobicContact CD2-CD2 4.2Å; H1467-L1477 CarbonylContact O-C 3.48Å; H1467-L1477 WeakPolarHBondContact O-CA 3.3Å; V1468-L1477 HydrophobicContact CB-CD1 4.49Å; V1468-L1477 HydrophobicContact CG1-CD1 4.41Å; V1468-L1477 HydrophobicContact CG2-CD1 4Å; L1477-L1479 HydrophobicContact CD1-CD2 4.12Å; L1477-L1479 HydrophobicContact CG-CD2 4.42Å; L1477-F1488 HydrophobicContact CB-CB 4.12Å; L1477-F1488 HydrophobicContact CD2-CB 4.31Å; L1477-F1488 HydrophobicContact CD2-CD2 3.97Å; L1477-F1488 HydrophobicContact CD2-CG 4.43Å; L1477-F1488 HydrophobicContact CG-CB 4.42Å; L1477-F1488 HydrophobicContact CG-CD2 4.16Å; L1477-F1488 PolarHBondContact N-O 3.08Å; L1477-F1488 PolarHBondContact O-N 3.03Å; L1477-I1503 HydrophobicContact CD1-CG2 3.97Å; L1477-I1503 HydrophobicContact CD2-CD1 4.07Å; L1477-I1503 HydrophobicContact CD2-CG2 3.85Å; L1477-L1507 HydrophobicContact CD1-CD1 4.44Å
1478	T	82.9	Confident	73.6	Confident	24.8 Å²	24.8	54.9 Å²	54.9	15%	0.152	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	128.1	178.2	-36	0	0	0	0	110.2	W1466 H1467 W1486 Y1487	W1466-T1478 CarbonylContact C-O 3.58Å; W1466-T1478 VanDerWaalsContact CA-O 3.23Å; W1466-T1478 WeakPolarHBondContact CA-O 3.42Å; W1466-T1478 VanDerWaalsContact CB-O 3.3Å; W1466-T1478 WeakPolarHBondContact CB-O 3.35Å; H1467-T1478 WeakPolarHBondContact CB-OG1 3.48Å; H1467-T1478 PolarHBondContact N-O 3.09Å; H1467-T1478 PolarHBondContact O-N 3.16Å; T1478-W1486 CarbonylContact C-O 3.52Å; T1478-W1486 VanDerWaalsContact CA-O 3.28Å; T1478-W1486 WeakPolarHBondContact CA-O 3.38Å; T1478-Y1487 HydrophobicContact CG2-CD1 3.74Å; T1478-Y1487 VanDerWaalsContact CG2-CD1 3.44Å; T1478-Y1487 HydrophobicContact CG2-CE1 3.64Å; T1478-Y1487 HydrophobicContact CG2-CG 4.37Å; T1478-Y1487 WeakPolarHBondContact OG1-CD1 3.43Å
1479	L	86.7	Confident	73.7	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	127.5	172	-53	-177.1	0	0	0	109	L1437 I1444 L1463 W1466 L1477 F1481 K1485 W1486 F1488 L1507	L1437-L1479 HydrophobicContact CD1-CD1 4.33Å; I1444-L1479 HydrophobicContact CG2-CD1 4.42Å; L1463-L1479 HydrophobicContact CD1-CB 4Å; L1463-L1479 HydrophobicContact CD1-CD2 4.43Å; W1466-L1479 HydrophobicContact CB-CD2 3.7Å; L1477-L1479 HydrophobicContact CD1-CD2 4.12Å; L1477-L1479 HydrophobicContact CG-CD2 4.42Å; L1479-F1481 HydrophobicContact CB-CD2 4.4Å; L1479-F1481 HydrophobicContact CB-CE2 3.65Å; L1479-F1481 HydrophobicContact CB-CZ 4.05Å; L1479-F1481 HydrophobicContact CD1-CE2 4.32Å; L1479-F1481 HydrophobicContact CD1-CZ 4.14Å; L1479-K1485 CarbonylContact O-C 3.55Å; L1479-K1485 VanDerWaalsContact O-CA 3.31Å; L1479-K1485 WeakPolarHBondContact O-CA 3.38Å; L1479-W1486 HydrophobicContact CB-CB 4.38Å; L1479-W1486 HydrophobicContact CD1-CE3 4.36Å; L1479-W1486 PolarHBondContact N-O 3.28Å; L1479-W1486 PolarHBondContact O-N 3.03Å; L1479-F1488 HydrophobicContact CD1-CE2 4.05Å; L1479-F1488 HydrophobicContact CG-CE2 4.2Å; L1479-L1507 HydrophobicContact CD2-CD1 3.59Å; L1479-L1507 HydrophobicContact CD2-CD2 4.33Å
1480	D	85.8	Confident	73.6	Confident	10.2 Å²	10.2	55.1 Å²	55.1	6%	0.055	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	109	-175.6	-162.2	-15.5	0	0	0	109.8	L1464 R1465 G1482 K1485	L1464-D1480 PolarHBondContact N-O 3.19Å; R1465-D1480 HydrophobicContact CG-CB 3.63Å; R1465-D1480 IonicContact CZ-OD2 3.19Å; R1465-D1480 VanDerWaalsContact CZ-OD2 3.29Å; R1465-D1480 PolarHBondContact N-O 3.03Å; R1465-D1480 IonicContact NE-OD2 3.24Å; R1465-D1480 PolarHBondContact NE-OD2 3.26Å; R1465-D1480 IonicContact NH2-OD2 2.8Å; R1465-D1480 PolarHBondContact NH2-OD2 3.2Å; R1465-D1480 VanDerWaalsContact NH2-OD2 3.13Å; R1465-D1480 VanDerWaalsContact O-CB 3.29Å; R1465-D1480 WeakPolarHBondContact O-CB 3.39Å; R1465-D1480 PolarHBondContact O-N 3.08Å; D1480-G1482 PolarHBondContact OD1-N 3.24Å; D1480-K1485 HydrophobicContact CB-CG 4.33Å; D1480-K1485 VanDerWaalsContact CG-CE 3.49Å; D1480-K1485 WeakPolarHBondContact OD1-CD 3.49Å; D1480-K1485 VanDerWaalsContact OD1-CE 3.22Å; D1480-K1485 WeakPolarHBondContact OD1-CE 3.37Å; D1480-K1485 VanDerWaalsContact OD1-CG 3.32Å; D1480-K1485 WeakPolarHBondContact OD1-CG 3.37Å; D1480-K1485 IonicContact OD1-NZ 2.7Å; D1480-K1485 PolarHBondContact OD1-NZ 3.12Å; D1480-K1485 VanDerWaalsContact OD2-CE 3.23Å; D1480-K1485 WeakPolarHBondContact OD2-CE 3.37Å; D1480-K1485 IonicContact OD2-NZ 2.92Å; D1480-K1485 PolarHBondContact OD2-NZ 3.44Å
1481	F	84.6	Confident	73.6	Confident	6.2 Å²	6.2	52.1 Å²	52.1	3%	0.027	30%	0.302	C	S	.	.			trans	-101.9	16.1	-177.8	-58.6	-86.7	0	0	0	112.9	I1444 Q1458 S1462 L1463 L1479 T1483 T1484 W1486	I1444-F1481 HydrophobicContact CB-CE1 4.43Å; I1444-F1481 HydrophobicContact CB-CZ 4.35Å; I1444-F1481 HydrophobicContact CD1-CE1 4.09Å; I1444-F1481 HydrophobicContact CD1-CZ 4.2Å; I1444-F1481 HydrophobicContact CG2-CZ 4.15Å; Q1458-F1481 HydrophobicContact CB-CD1 4.24Å; Q1458-F1481 HydrophobicContact CB-CE1 4.07Å; Q1458-F1481 HydrophobicContact CB-CG 4.44Å; Q1458-F1481 HydrophobicContact CB-CZ 4.32Å; Q1458-F1481 VanDerWaalsContact CD-CG 3.47Å; Q1458-F1481 HydrophobicContact CG-CB 4.1Å; Q1458-F1481 HydrophobicContact CG-CD1 3.43Å; Q1458-F1481 HydrophobicContact CG-CD2 4.17Å; Q1458-F1481 HydrophobicContact CG-CE1 3.77Å; Q1458-F1481 HydrophobicContact CG-CE2 4.42Å; Q1458-F1481 HydrophobicContact CG-CG 3.69Å; Q1458-F1481 HydrophobicContact CG-CZ 4.23Å; Q1458-F1481 VanDerWaalsContact OE1-CD2 3.31Å; S1462-F1481 CarbonylContact O-C 3.47Å; S1462-F1481 VanDerWaalsContact O-C 3.32Å; S1462-F1481 VanDerWaalsContact O-CA 3.23Å; S1462-F1481 WeakPolarHBondContact O-CA 3.37Å; L1463-F1481 HydrophobicContact CB-CD1 4.02Å; L1463-F1481 HydrophobicContact CB-CE1 3.93Å; L1463-F1481 HydrophobicContact CD1-CD1 4.05Å; L1463-F1481 HydrophobicContact CD1-CE1 3.78Å; L1463-F1481 HydrophobicContact CD1-CE2 4.35Å; L1463-F1481 HydrophobicContact CD1-CG 4.45Å; L1463-F1481 HydrophobicContact CD1-CZ 4.02Å; L1463-F1481 HydrophobicContact CG-CE1 4.44Å; L1479-F1481 HydrophobicContact CB-CD2 4.4Å; L1479-F1481 HydrophobicContact CB-CE2 3.65Å; L1479-F1481 HydrophobicContact CB-CZ 4.05Å; L1479-F1481 HydrophobicContact CD1-CE2 4.32Å; L1479-F1481 HydrophobicContact CD1-CZ 4.14Å; F1481-T1483 PolarHBondContact O-N 3.14Å; F1481-T1483 PolarHBondContact O-OG1 3.38Å; F1481-T1484 WeakPolarHBondContact CB-O 3.46Å; F1481-T1484 PolarHBondContact N-O 3.2Å; F1481-W1486 HydrophobicContact CD2-CD2 4.36Å; F1481-W1486 HydrophobicContact CD2-CG 4.39Å; F1481-W1486 AromaticContact CD2-NE1 3.9Å; F1481-W1486 AromaticContact CE2-CD2 3.65Å; F1481-W1486 HydrophobicContact CE2-CD2 3.65Å; F1481-W1486 AromaticContact CE2-CE2 3.72Å; F1481-W1486 AromaticContact CE2-CE3 3.95Å; F1481-W1486 HydrophobicContact CE2-CE3 3.99Å; F1481-W1486 AromaticContact CE2-CG 3.92Å; F1481-W1486 HydrophobicContact CE2-CG 3.96Å; F1481-W1486 HydrophobicContact CE2-CH2 4.43Å; F1481-W1486 HydrophobicContact CE2-CZ2 4.16Å; F1481-W1486 HydrophobicContact CE2-CZ3 4.38Å; F1481-W1486 AromaticContact CE2-NE1 3.93Å; F1481-W1486 HydrophobicContact CZ-CD2 4.44Å; F1481-W1486 HydrophobicContact CZ-CE3 4.38Å; F1481-W1486 HydrophobicContact CZ-CH2 4.33Å; F1481-W1486 HydrophobicContact CZ-CZ2 4.39Å; F1481-W1486 HydrophobicContact CZ-CZ3 4.24Å
1482	G	77.3	Confident	73	Confident	46.4 Å²	46.4	55.7 Å²	55.7	48%	0.478	32%	0.317	S	S	.	.	S	Bend	trans	73.4	-63.1	-172.5	0	0	0	0	0	112.6	L1464 D1480	L1464-G1482 VanDerWaalsContact CD1-CA 3.43Å; D1480-G1482 PolarHBondContact OD1-N 3.24Å
1483	T	78.8	Confident	72.5	Confident	119.2 Å²	119.2	60.6 Å²	60.6	73%	0.731	32%	0.32	S	S	*	.	S	Bend	trans	-76.3	-28.9	179	57.3	0	0	0	0	113.5	Q1458 F1481	Q1458-T1483 PolarHBondContact NE2-OG1 3.42Å; F1481-T1483 PolarHBondContact O-N 3.14Å; F1481-T1483 PolarHBondContact O-OG1 3.38Å
1484	T	85.1	Confident	71.9	Confident	54.8 Å²	54.8	63 Å²	63	34%	0.336	32%	0.322	S	S	.	.			trans	-140.7	146.5	177.2	67	0	0	0	0	111.5	Q1458 F1481 W1486	Q1458-T1484 PolarHBondContact NE2-OG1 3.45Å; Q1458-T1484 PolarHBondContact OE1-OG1 2.92Å; F1481-T1484 WeakPolarHBondContact CB-O 3.46Å; F1481-T1484 PolarHBondContact N-O 3.2Å; T1484-W1486 PolarHBondContact OG1-NE1 3.07Å; T1484-W1486 VanDerWaalsContact OG1-NE1 3.08Å
1485	K	86.1	Confident	71.3	Confident	98.8 Å²	98.8	64 Å²	64	43%	0.43	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	128.3	173.8	-61.1	-175.7	-174.4	-167.6	0	109.7	R1465 L1479 D1480 Y1487	R1465-K1485 VanDerWaalsContact NH2-NZ 3.18Å; L1479-K1485 CarbonylContact O-C 3.55Å; L1479-K1485 VanDerWaalsContact O-CA 3.31Å; L1479-K1485 WeakPolarHBondContact O-CA 3.38Å; D1480-K1485 HydrophobicContact CB-CG 4.33Å; D1480-K1485 VanDerWaalsContact CG-CE 3.49Å; D1480-K1485 WeakPolarHBondContact OD1-CD 3.49Å; D1480-K1485 VanDerWaalsContact OD1-CE 3.22Å; D1480-K1485 WeakPolarHBondContact OD1-CE 3.37Å; D1480-K1485 VanDerWaalsContact OD1-CG 3.32Å; D1480-K1485 WeakPolarHBondContact OD1-CG 3.37Å; D1480-K1485 IonicContact OD1-NZ 2.7Å; D1480-K1485 PolarHBondContact OD1-NZ 3.12Å; D1480-K1485 VanDerWaalsContact OD2-CE 3.23Å; D1480-K1485 WeakPolarHBondContact OD2-CE 3.37Å; D1480-K1485 IonicContact OD2-NZ 2.92Å; D1480-K1485 PolarHBondContact OD2-NZ 3.44Å; K1485-Y1487 HydrophobicContact CB-CE2 3.82Å
1486	W	88.6	Confident	70.8	Confident	4.2 Å²	4.2	59.3 Å²	59.3	2%	0.016	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	126.4	-178.4	-58.4	6.7	0	0	0	108.7	L1437 I1444 L1446 R1456 Q1458 T1478 L1479 F1481 T1484 F1488	L1437-W1486 HydrophobicContact CD1-CZ3 4.4Å; I1444-W1486 HydrophobicContact CG2-CH2 4.36Å; I1444-W1486 HydrophobicContact CG2-CZ3 3.85Å; L1446-W1486 HydrophobicContact CB-CH2 4.44Å; L1446-W1486 HydrophobicContact CB-CZ3 4.2Å; L1446-W1486 HydrophobicContact CD2-CE3 4.47Å; R1456-W1486 HydrophobicContact CB-CH2 3.86Å; R1456-W1486 HydrophobicContact CB-CZ2 3.71Å; R1456-W1486 HydrophobicContact CG-CZ2 4.43Å; Q1458-W1486 HydrophobicContact CB-CH2 4.12Å; Q1458-W1486 HydrophobicContact CB-CZ2 3.9Å; Q1458-W1486 VanDerWaalsContact OE1-CE2 3.29Å; T1478-W1486 CarbonylContact C-O 3.52Å; T1478-W1486 VanDerWaalsContact CA-O 3.28Å; T1478-W1486 WeakPolarHBondContact CA-O 3.38Å; L1479-W1486 HydrophobicContact CB-CB 4.38Å; L1479-W1486 HydrophobicContact CD1-CE3 4.36Å; L1479-W1486 PolarHBondContact N-O 3.28Å; L1479-W1486 PolarHBondContact O-N 3.03Å; F1481-W1486 HydrophobicContact CD2-CD2 4.36Å; F1481-W1486 HydrophobicContact CD2-CG 4.39Å; F1481-W1486 AromaticContact CD2-NE1 3.9Å; F1481-W1486 AromaticContact CE2-CD2 3.65Å; F1481-W1486 HydrophobicContact CE2-CD2 3.65Å; F1481-W1486 AromaticContact CE2-CE2 3.72Å; F1481-W1486 AromaticContact CE2-CE3 3.95Å; F1481-W1486 HydrophobicContact CE2-CE3 3.99Å; F1481-W1486 AromaticContact CE2-CG 3.92Å; F1481-W1486 HydrophobicContact CE2-CG 3.96Å; F1481-W1486 HydrophobicContact CE2-CH2 4.43Å; F1481-W1486 HydrophobicContact CE2-CZ2 4.16Å; F1481-W1486 HydrophobicContact CE2-CZ3 4.38Å; F1481-W1486 AromaticContact CE2-NE1 3.93Å; F1481-W1486 HydrophobicContact CZ-CD2 4.44Å; F1481-W1486 HydrophobicContact CZ-CE3 4.38Å; F1481-W1486 HydrophobicContact CZ-CH2 4.33Å; F1481-W1486 HydrophobicContact CZ-CZ2 4.39Å; F1481-W1486 HydrophobicContact CZ-CZ3 4.24Å; T1484-W1486 PolarHBondContact OG1-NE1 3.07Å; T1484-W1486 VanDerWaalsContact OG1-NE1 3.08Å; W1486-F1488 HydrophobicContact CB-CD2 4.39Å; W1486-F1488 HydrophobicContact CB-CE2 3.63Å; W1486-F1488 VanDerWaalsContact CB-CE2 3.47Å; W1486-F1488 HydrophobicContact CB-CZ 3.84Å; W1486-F1488 HydrophobicContact CD2-CZ 4.28Å; W1486-F1488 HydrophobicContact CE3-CE2 4.27Å; W1486-F1488 AromaticContact CE3-CZ 3.9Å; W1486-F1488 HydrophobicContact CE3-CZ 3.9Å; W1486-F1488 HydrophobicContact CG-CE2 4.44Å; W1486-F1488 HydrophobicContact CG-CZ 4.33Å
1487	Y	86.5	Confident	70	Confident	98.8 Å²	98.8	60.3 Å²	60.3	39%	0.387	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	128.2	-175.6	-64.9	-89	0	0	0	110.4	E1423 L1424 T1478 K1485	E1423-Y1487 WeakPolarHBondContact CA-O 3.17Å; L1424-Y1487 PolarHBondContact N-O 3.16Å; T1478-Y1487 HydrophobicContact CG2-CD1 3.74Å; T1478-Y1487 VanDerWaalsContact CG2-CD1 3.44Å; T1478-Y1487 HydrophobicContact CG2-CE1 3.64Å; T1478-Y1487 HydrophobicContact CG2-CG 4.37Å; T1478-Y1487 WeakPolarHBondContact OG1-CD1 3.43Å; K1485-Y1487 HydrophobicContact CB-CE2 3.82Å
1488	F	84.2	Confident	69	Low	1.8 Å²	1.8	66.6 Å²	66.6	1%	0.008	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	153.2	-179.6	-54.4	-77.3	0	0	0	111	V1421 K1422 E1423 L1437 L1446 S1476 L1477 L1479 W1486	V1421-F1488 HydrophobicContact CB-CB 4.37Å; V1421-F1488 HydrophobicContact CB-CD1 4.04Å; V1421-F1488 HydrophobicContact CB-CG 4.4Å; V1421-F1488 HydrophobicContact CG2-CB 4.48Å; V1421-F1488 HydrophobicContact CG2-CD1 3.49Å; V1421-F1488 VanDerWaalsContact CG2-CD1 3.45Å; V1421-F1488 HydrophobicContact CG2-CE1 3.79Å; V1421-F1488 HydrophobicContact CG2-CG 4.19Å; K1422-F1488 CarbonylContact O-C 3.39Å; K1422-F1488 VanDerWaalsContact O-CA 3.26Å; K1422-F1488 WeakPolarHBondContact O-CA 3.26Å; E1423-F1488 HydrophobicContact CB-CD1 3.94Å; E1423-F1488 HydrophobicContact CB-CE1 3.92Å; E1423-F1488 HydrophobicContact CG-CD1 4.21Å; E1423-F1488 HydrophobicContact CG-CE1 4.01Å; L1437-F1488 HydrophobicContact CD1-CZ 4.4Å; L1446-F1488 HydrophobicContact CD1-CE1 3.85Å; L1446-F1488 HydrophobicContact CD1-CZ 4Å; L1446-F1488 HydrophobicContact CD2-CE1 4.33Å; L1446-F1488 HydrophobicContact CD2-CZ 4.43Å; S1476-F1488 CarbonylContact C-O 3.59Å; S1476-F1488 VanDerWaalsContact CA-O 3.25Å; S1476-F1488 WeakPolarHBondContact CA-O 3.36Å; L1477-F1488 HydrophobicContact CB-CB 4.12Å; L1477-F1488 HydrophobicContact CD2-CB 4.31Å; L1477-F1488 HydrophobicContact CD2-CD2 3.97Å; L1477-F1488 HydrophobicContact CD2-CG 4.43Å; L1477-F1488 HydrophobicContact CG-CB 4.42Å; L1477-F1488 HydrophobicContact CG-CD2 4.16Å; L1477-F1488 PolarHBondContact N-O 3.08Å; L1477-F1488 PolarHBondContact O-N 3.03Å; L1479-F1488 HydrophobicContact CD1-CE2 4.05Å; L1479-F1488 HydrophobicContact CG-CE2 4.2Å; W1486-F1488 HydrophobicContact CB-CD2 4.39Å; W1486-F1488 HydrophobicContact CB-CE2 3.63Å; W1486-F1488 VanDerWaalsContact CB-CE2 3.47Å; W1486-F1488 HydrophobicContact CB-CZ 3.84Å; W1486-F1488 HydrophobicContact CD2-CZ 4.28Å; W1486-F1488 HydrophobicContact CE3-CE2 4.27Å; W1486-F1488 AromaticContact CE3-CZ 3.9Å; W1486-F1488 HydrophobicContact CE3-CZ 3.9Å; W1486-F1488 HydrophobicContact CG-CE2 4.44Å; W1486-F1488 HydrophobicContact CG-CZ 4.33Å
1489	I	74.4	Confident	68.2	Low	44 Å²	44	67.9 Å²	67.9	23%	0.226	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	145.9	166.9	-53.4	172.1	0	0	0	108.2	K1422 L1424 K1432 R1475	K1422-I1489 PolarHBondContact N-O 3.24Å; K1422-I1489 PolarHBondContact O-N 3.23Å; L1424-I1489 HydrophobicContact CD1-CD1 3.77Å; L1424-I1489 HydrophobicContact CD1-CG1 3.67Å; L1424-I1489 VanDerWaalsContact CD1-CG1 3.47Å; L1424-I1489 HydrophobicContact CD2-CD1 3.84Å; L1424-I1489 HydrophobicContact CD2-CG1 4.06Å; L1424-I1489 HydrophobicContact CG-CD1 3.82Å; L1424-I1489 HydrophobicContact CG-CG1 3.92Å; K1432-I1489 HydrophobicContact CD-CD1 4.19Å; K1432-I1489 HydrophobicContact CG-CD1 4.49Å; R1475-I1489 HydrophobicContact CB-CG2 4.24Å; R1475-I1489 WeakPolarHBondContact O-CA 3.45Å; R1475-I1489 WeakPolarHBondContact O-CG2 3.18Å
1490	G	61.2	Low	67.2	Low	15 Å²	15	69.1 Å²	69.1	16%	0.155	37%	0.374	C	S	.	.			trans	-51	163	164.9	0	0	0	0	0	114.1	R1475 V1492 D1496	R1475-G1490 PolarHBondContact O-N 3.06Å; R1475-G1490 VanDerWaalsContact O-N 3.12Å; G1490-V1492 PolarHBondContact O-N 3.19Å; G1490-D1496 VanDerWaalsContact C-OD2 3.26Å; G1490-D1496 WeakPolarHBondContact CA-OD1 3.35Å; G1490-D1496 VanDerWaalsContact CA-OD2 3.23Å; G1490-D1496 WeakPolarHBondContact CA-OD2 3.36Å
1491	N	55	Low	66.2	Low	47.8 Å²	47.8	75.1 Å²	75.1	26%	0.256	40%	0.4	S	S	.	.			trans	-99.6	58.9	-166.4	-123.9	-28.3	0	0	0	113.4	H1420 K1422 R1493 D1496	H1420-N1491 VanDerWaalsContact C-ND2 3.27Å; H1420-N1491 PolarHBondContact O-ND2 3.11Å; K1422-N1491 WeakPolarHBondContact CD-OD1 3.32Å; K1422-N1491 WeakPolarHBondContact CE-OD1 3.34Å; K1422-N1491 WeakPolarHBondContact CG-OD1 3.23Å; K1422-N1491 PolarHBondContact NZ-O 3.11Å; K1422-N1491 PolarHBondContact NZ-OD1 3.11Å; N1491-R1493 PolarHBondContact O-N 3.01Å; N1491-D1496 VanDerWaalsContact N-CG 3.33Å; N1491-D1496 PolarHBondContact N-OD1 3.26Å; N1491-D1496 PolarHBondContact N-OD2 3.08Å; N1491-D1496 VanDerWaalsContact N-OD2 3.12Å
1492	V	40.6	Very low	65.7	Low	111 Å²	111	76.7 Å²	76.7	67%	0.673	41%	0.41	S	S	*	.	S	Bend	trans	19.5	57.8	168.5	-169.9	0	0	0	0	115.6	R1475 G1490 D1496	R1475-V1492 PolarHBondContact NH1-O 3.39Å; G1490-V1492 PolarHBondContact O-N 3.19Å; V1492-D1496 PolarHBondContact N-OD2 2.75Å
1493	R	42.6	Very low	65.8	Low	201.2 Å²	201.2	74.6 Å²	74.6	76%	0.759	39%	0.388	S	S	*	.	S	Bend	trans	-161	136.1	152.2	-95.6	176.7	-178.4	-171.1	-2.7	109.6	N1491 V1495 D1496	N1491-R1493 PolarHBondContact O-N 3.01Å; R1493-V1495 VanDerWaalsContact C-N 3.31Å; R1493-V1495 PolarHBondContact O-N 3.04Å; R1493-D1496 PolarHBondContact O-N 3.46Å
1494	E	38.5	Very low	65.5	Low	180.2 Å²	180.2	69.5 Å²	69.5	84%	0.842	36%	0.359	S	S	*	.	S	Bend	trans	6.2	-16.6	178.3	-72.6	100.9	-156.7	0	0	121.4	D1496	E1494-D1496 PolarHBondContact O-N 2.98Å
1495	V	41.5	Very low	64.8	Low	112 Å²	112	71.3 Å²	71.3	68%	0.679	37%	0.365	S	S	*	.			trans	-113.1	15.3	-169.6	-154.7	0	0	0	0	114.6	R1493 G1497 F1498 L1499	R1493-V1495 VanDerWaalsContact C-N 3.31Å; R1493-V1495 PolarHBondContact O-N 3.04Å; V1495-G1497 VanDerWaalsContact C-N 3.3Å; V1495-G1497 PolarHBondContact O-N 3.34Å; V1495-G1497 VanDerWaalsContact O-N 3.12Å; V1495-F1498 PolarHBondContact O-N 2.9Å; V1495-L1499 PolarHBondContact O-N 3.47Å
1496	D	53.2	Low	64.3	Low	22.4 Å²	22.4	66.8 Å²	66.8	12%	0.12	35%	0.345	C	S	.	.	H	α-helix	trans	-67.1	-23.8	-168.4	-95.3	-27.9	0	0	0	115.7	R1475 G1490 N1491 V1492 R1493 E1494 F1498 L1499 A1500	R1475-D1496 IonicContact CZ-OD2 2.75Å; R1475-D1496 IonicContact NH1-OD2 3.13Å; R1475-D1496 PolarHBondContact NH1-OD2 2.91Å; G1490-D1496 VanDerWaalsContact C-OD2 3.26Å; G1490-D1496 WeakPolarHBondContact CA-OD1 3.35Å; G1490-D1496 VanDerWaalsContact CA-OD2 3.23Å; G1490-D1496 WeakPolarHBondContact CA-OD2 3.36Å; N1491-D1496 VanDerWaalsContact N-CG 3.33Å; N1491-D1496 PolarHBondContact N-OD1 3.26Å; N1491-D1496 PolarHBondContact N-OD2 3.08Å; N1491-D1496 VanDerWaalsContact N-OD2 3.12Å; V1492-D1496 PolarHBondContact N-OD2 2.75Å; R1493-D1496 PolarHBondContact O-N 3.46Å; E1494-D1496 PolarHBondContact O-N 2.98Å; D1496-F1498 VanDerWaalsContact C-N 3.26Å; D1496-F1498 PolarHBondContact O-N 3.18Å; D1496-L1499 PolarHBondContact O-N 3.13Å; D1496-L1499 WeakPolarHBondContact OD1-CD2 3.47Å; D1496-A1500 VanDerWaalsContact O-CB 3.29Å; D1496-A1500 WeakPolarHBondContact O-CB 3.34Å; D1496-A1500 PolarHBondContact O-N 2.94Å; D1496-A1500 VanDerWaalsContact O-N 3.12Å
1497	G	54.7	Low	63.9	Low	53.2 Å²	53.2	66.7 Å²	66.7	55%	0.548	35%	0.345	S	S	.	.	H	α-helix	trans	-66.3	-33.9	-176.6	0	0	0	0	0	114	V1495 K1501	V1495-G1497 VanDerWaalsContact C-N 3.3Å; V1495-G1497 PolarHBondContact O-N 3.34Å; V1495-G1497 VanDerWaalsContact O-N 3.12Å; G1497-K1501 VanDerWaalsContact O-CG 3.25Å; G1497-K1501 WeakPolarHBondContact O-CG 2.82Å; G1497-K1501 PolarHBondContact O-N 3.34Å; G1497-K1501 VanDerWaalsContact O-N 3.15Å
1498	F	61.5	Low	63	Low	145.8 Å²	145.8	64.6 Å²	64.6	64%	0.639	34%	0.336	S	S	*	.	H	α-helix	trans	-72.2	-45.3	177	-173.4	-96.4	0	0	0	111.4	V1495 D1496 A1500 K1501 T1502	V1495-F1498 PolarHBondContact O-N 2.9Å; D1496-F1498 VanDerWaalsContact C-N 3.26Å; D1496-F1498 PolarHBondContact O-N 3.18Å; F1498-A1500 VanDerWaalsContact C-N 3.27Å; F1498-A1500 PolarHBondContact O-N 3.19Å; F1498-K1501 WeakPolarHBondContact O-CA 3.35Å; F1498-K1501 WeakPolarHBondContact O-CB 3.37Å; F1498-K1501 PolarHBondContact O-N 3.14Å; F1498-T1502 WeakPolarHBondContact CD1-OG1 3.4Å; F1498-T1502 VanDerWaalsContact CE1-OG1 3.31Å; F1498-T1502 WeakPolarHBondContact CE1-OG1 3.44Å; F1498-T1502 WeakPolarHBondContact O-CB 3.33Å; F1498-T1502 PolarHBondContact O-N 3.22Å; F1498-T1502 PolarHBondContact O-OG1 3.02Å
1499	L	65.6	Low	62.4	Low	52.6 Å²	52.6	67.8 Å²	67.8	28%	0.275	35%	0.351	S	S	.	.	H	α-helix	trans	-59.5	-39.1	-179.8	-174.4	122.8	0	0	0	112.1	F1419 V1495 D1496 K1501 T1502 I1503	F1419-L1499 HydrophobicContact CD1-CD1 3.91Å; F1419-L1499 HydrophobicContact CE1-CD1 4.35Å; V1495-L1499 PolarHBondContact O-N 3.47Å; D1496-L1499 PolarHBondContact O-N 3.13Å; D1496-L1499 WeakPolarHBondContact OD1-CD2 3.47Å; L1499-K1501 PolarHBondContact O-N 3.09Å; L1499-T1502 PolarHBondContact O-N 3.04Å; L1499-I1503 HydrophobicContact CD1-CD1 4.29Å; L1499-I1503 HydrophobicContact CD2-CD1 3.86Å; L1499-I1503 HydrophobicContact CD2-CG1 4.43Å; L1499-I1503 HydrophobicContact CG-CD1 4.14Å; L1499-I1503 HydrophobicContact CG-CG1 4.5Å; L1499-I1503 WeakPolarHBondContact O-CB 3.5Å; L1499-I1503 VanDerWaalsContact O-CG1 3.29Å; L1499-I1503 WeakPolarHBondContact O-CG1 3.34Å; L1499-I1503 PolarHBondContact O-N 2.91Å
1500	A	65.9	Low	62.4	Low	26.4 Å²	26.4	66.4 Å²	66.4	22%	0.218	34%	0.344	C	S	.	.	H	α-helix	trans	-59.4	-47.2	173.9	0	0	0	0	0	112.1	V1468 D1496 F1498 T1502 I1503 G1504	V1468-A1500 VanDerWaalsContact CG1-CA 3.5Å; V1468-A1500 HydrophobicContact CG1-CB 3.63Å; D1496-A1500 VanDerWaalsContact O-CB 3.29Å; D1496-A1500 WeakPolarHBondContact O-CB 3.34Å; D1496-A1500 PolarHBondContact O-N 2.94Å; D1496-A1500 VanDerWaalsContact O-N 3.12Å; F1498-A1500 VanDerWaalsContact C-N 3.27Å; F1498-A1500 PolarHBondContact O-N 3.19Å; A1500-T1502 PolarHBondContact O-N 2.85Å; A1500-I1503 PolarHBondContact O-N 3.19Å; A1500-G1504 PolarHBondContact O-N 3.03Å; A1500-G1504 VanDerWaalsContact O-N 3.09Å
1501	K	65.4	Low	62.7	Low	135 Å²	135	67.6 Å²	67.6	59%	0.587	35%	0.349	S	S	*	.	H	α-helix	trans	-63	-45.1	174.4	-70.6	-175.9	176	-174	0	111.7	G1497 F1498 L1499 I1503 G1504 M1505	G1497-K1501 VanDerWaalsContact O-CG 3.25Å; G1497-K1501 WeakPolarHBondContact O-CG 2.82Å; G1497-K1501 PolarHBondContact O-N 3.34Å; G1497-K1501 VanDerWaalsContact O-N 3.15Å; F1498-K1501 WeakPolarHBondContact O-CA 3.35Å; F1498-K1501 WeakPolarHBondContact O-CB 3.37Å; F1498-K1501 PolarHBondContact O-N 3.14Å; L1499-K1501 PolarHBondContact O-N 3.09Å; K1501-I1503 VanDerWaalsContact C-N 3.35Å; K1501-I1503 PolarHBondContact O-N 3.15Å; K1501-G1504 WeakPolarHBondContact O-CA 3.29Å; K1501-G1504 PolarHBondContact O-N 3.11Å; K1501-G1504 VanDerWaalsContact O-N 3.12Å; K1501-M1505 WeakPolarHBondContact O-CB 3.4Å; K1501-M1505 VanDerWaalsContact O-CG 3.31Å; K1501-M1505 WeakPolarHBondContact O-CG 3.4Å; K1501-M1505 PolarHBondContact O-N 3.15Å
1502	T	73.3	Confident	63	Low	39.2 Å²	39.2	67.5 Å²	67.5	24%	0.24	35%	0.346	C	S	.	.	H	α-helix	trans	-62.9	-40.4	179.9	-43.3	0	0	0	0	112.5	F1419 F1498 L1499 A1500 T1506	F1419-T1502 HydrophobicContact CE1-CG2 3.92Å; F1419-T1502 HydrophobicContact CZ-CG2 4.11Å; F1498-T1502 WeakPolarHBondContact CD1-OG1 3.4Å; F1498-T1502 VanDerWaalsContact CE1-OG1 3.31Å; F1498-T1502 WeakPolarHBondContact CE1-OG1 3.44Å; F1498-T1502 WeakPolarHBondContact O-CB 3.33Å; F1498-T1502 PolarHBondContact O-N 3.22Å; F1498-T1502 PolarHBondContact O-OG1 3.02Å; L1499-T1502 PolarHBondContact O-N 3.04Å; A1500-T1502 PolarHBondContact O-N 2.85Å; T1502-T1506 WeakPolarHBondContact O-CB 3.33Å; T1502-T1506 VanDerWaalsContact O-CG2 3.31Å; T1502-T1506 WeakPolarHBondContact O-CG2 3.3Å; T1502-T1506 PolarHBondContact O-N 3.22Å; T1502-T1506 PolarHBondContact O-OG1 3.18Å
1503	I	78.2	Confident	64	Low	3.4 Å²	3.4	66.2 Å²	66.2	2%	0.017	34%	0.335	C	S	.	.	H	α-helix	trans	-65.5	-42.6	173.2	-69.9	173.6	0	0	0	110.4	F1419 V1421 L1439 L1477 L1499 A1500 K1501 M1505 T1506 L1507	F1419-I1503 HydrophobicContact CB-CD1 4.05Å; F1419-I1503 HydrophobicContact CB-CG1 4.32Å; F1419-I1503 HydrophobicContact CD1-CD1 3.93Å; F1419-I1503 HydrophobicContact CD1-CG1 3.47Å; F1419-I1503 VanDerWaalsContact CD1-CG1 3.46Å; F1419-I1503 HydrophobicContact CD2-CG1 4.1Å; F1419-I1503 HydrophobicContact CE1-CG1 3.67Å; F1419-I1503 HydrophobicContact CE2-CG1 4.28Å; F1419-I1503 HydrophobicContact CG-CD1 3.98Å; F1419-I1503 HydrophobicContact CG-CG1 3.69Å; F1419-I1503 HydrophobicContact CZ-CG1 4.07Å; V1421-I1503 HydrophobicContact CG1-CD1 4.34Å; L1439-I1503 HydrophobicContact CD1-CG2 4.28Å; L1477-I1503 HydrophobicContact CD1-CG2 3.97Å; L1477-I1503 HydrophobicContact CD2-CD1 4.07Å; L1477-I1503 HydrophobicContact CD2-CG2 3.85Å; L1499-I1503 HydrophobicContact CD1-CD1 4.29Å; L1499-I1503 HydrophobicContact CD2-CD1 3.86Å; L1499-I1503 HydrophobicContact CD2-CG1 4.43Å; L1499-I1503 HydrophobicContact CG-CD1 4.14Å; L1499-I1503 HydrophobicContact CG-CG1 4.5Å; L1499-I1503 WeakPolarHBondContact O-CB 3.5Å; L1499-I1503 VanDerWaalsContact O-CG1 3.29Å; L1499-I1503 WeakPolarHBondContact O-CG1 3.34Å; L1499-I1503 PolarHBondContact O-N 2.91Å; A1500-I1503 PolarHBondContact O-N 3.19Å; K1501-I1503 VanDerWaalsContact C-N 3.35Å; K1501-I1503 PolarHBondContact O-N 3.15Å; I1503-M1505 PolarHBondContact O-N 3.27Å; I1503-T1506 WeakPolarHBondContact CA-OG1 3.43Å; I1503-T1506 PolarHBondContact O-N 3.23Å; I1503-T1506 PolarHBondContact O-OG1 3.24Å; I1503-L1507 HydrophobicContact CG2-CD1 3.72Å; I1503-L1507 HydrophobicContact CG2-CG 4.25Å; I1503-L1507 WeakPolarHBondContact O-CB 3.4Å; I1503-L1507 VanDerWaalsContact O-CG 3.26Å; I1503-L1507 WeakPolarHBondContact O-CG 3.38Å; I1503-L1507 PolarHBondContact O-N 2.98Å
1504	G	74	Confident	64.7	Low	12 Å²	12	57.9 Å²	57.9	12%	0.124	31%	0.306	C	S	.	.	H	α-helix	trans	-57.1	-49.5	175.3	0	0	0	0	0	112.9	A1500 K1501 L1507 W1508	A1500-G1504 PolarHBondContact O-N 3.03Å; A1500-G1504 VanDerWaalsContact O-N 3.09Å; K1501-G1504 WeakPolarHBondContact O-CA 3.29Å; K1501-G1504 PolarHBondContact O-N 3.11Å; K1501-G1504 VanDerWaalsContact O-N 3.12Å; G1504-L1507 PolarHBondContact O-N 3.13Å; G1504-W1508 VanDerWaalsContact O-CB 3.3Å; G1504-W1508 WeakPolarHBondContact O-CB 3.26Å; G1504-W1508 PolarHBondContact O-N 3.13Å; G1504-W1508 VanDerWaalsContact O-N 3.12Å
1505	M	69.3	Low	65.2	Low	92.6 Å²	92.6	52 Å²	52	46%	0.456	28%	0.282	S	S	.	.	H	α-helix	trans	-60.4	-48.4	176.6	-70	170.6	72.1	0	0	111.7	K1501 I1503 L1507 W1508 E1509 H1647 L1650	K1501-M1505 WeakPolarHBondContact O-CB 3.4Å; K1501-M1505 VanDerWaalsContact O-CG 3.31Å; K1501-M1505 WeakPolarHBondContact O-CG 3.4Å; K1501-M1505 PolarHBondContact O-N 3.15Å; I1503-M1505 PolarHBondContact O-N 3.27Å; M1505-L1507 PolarHBondContact O-N 3.19Å; M1505-W1508 CarbonylContact O-C 3.56Å; M1505-W1508 WeakPolarHBondContact O-CA 3.3Å; M1505-W1508 VanDerWaalsContact O-CB 3.28Å; M1505-W1508 WeakPolarHBondContact O-CB 3.43Å; M1505-W1508 PolarHBondContact O-N 3.1Å; M1505-W1508 VanDerWaalsContact O-N 3.09Å; M1505-E1509 WeakPolarHBondContact O-CG 3.27Å; M1505-E1509 PolarHBondContact O-N 3.01Å; M1505-H1647 WeakPolarHBondContact CG-NE2 3.46Å; M1505-L1650 HydrophobicContact CG-CB 4.39Å
1506	T	77.3	Confident	65.4	Low	4.2 Å²	4.2	49.2 Å²	49.2	3%	0.026	27%	0.266	C	S	.	.	H	α-helix	trans	-68.7	-35	-177.3	38.7	0	0	0	0	113	K1417 F1419 L1439 T1502 I1503 W1508 E1509 L1510	K1417-T1506 HydrophobicContact CB-CG2 4.09Å; K1417-T1506 HydrophobicContact CD-CG2 3.48Å; K1417-T1506 VanDerWaalsContact CD-CG2 3.45Å; K1417-T1506 WeakPolarHBondContact CD-OG1 3.46Å; K1417-T1506 HydrophobicContact CG-CG2 4.34Å; F1419-T1506 HydrophobicContact CE2-CG2 4.38Å; F1419-T1506 HydrophobicContact CZ-CG2 4.12Å; F1419-T1506 WeakPolarHBondContact CZ-OG1 3.3Å; L1439-T1506 HydrophobicContact CB-CG2 3.71Å; L1439-T1506 HydrophobicContact CD1-CG2 3.67Å; L1439-T1506 HydrophobicContact CG-CG2 4.34Å; T1502-T1506 WeakPolarHBondContact O-CB 3.33Å; T1502-T1506 VanDerWaalsContact O-CG2 3.31Å; T1502-T1506 WeakPolarHBondContact O-CG2 3.3Å; T1502-T1506 PolarHBondContact O-N 3.22Å; T1502-T1506 PolarHBondContact O-OG1 3.18Å; I1503-T1506 WeakPolarHBondContact CA-OG1 3.43Å; I1503-T1506 PolarHBondContact O-N 3.23Å; I1503-T1506 PolarHBondContact O-OG1 3.24Å; T1506-W1508 VanDerWaalsContact C-N 3.33Å; T1506-W1508 PolarHBondContact O-N 3.22Å; T1506-E1509 WeakPolarHBondContact CA-OE2 3.32Å; T1506-E1509 WeakPolarHBondContact CG2-OE2 3.3Å; T1506-E1509 WeakPolarHBondContact O-CB 3.43Å; T1506-E1509 PolarHBondContact O-N 2.8Å; T1506-L1510 HydrophobicContact CG2-CD1 4.05Å; T1506-L1510 HydrophobicContact CG2-CG 4.42Å; T1506-L1510 WeakPolarHBondContact O-CB 3.4Å; T1506-L1510 VanDerWaalsContact O-CD1 3.3Å; T1506-L1510 WeakPolarHBondContact O-CD1 3.44Å; T1506-L1510 WeakPolarHBondContact O-CG 3.32Å; T1506-L1510 PolarHBondContact O-N 3.06Å; T1506-L1510 VanDerWaalsContact O-N 3.12Å
1507	L	79.5	Confident	64.8	Low	1.2 Å²	1.2	55 Å²	55	1%	0.006	29%	0.29	C	S	.	.	H	α-helix	trans	-63.2	-38.7	169.8	-71	168.3	0	0	0	111.6	L1439 I1444 L1463 W1466 L1477 L1479 I1503 G1504 M1505 L1510 V1511	L1439-L1507 HydrophobicContact CD1-CD2 3.86Å; L1439-L1507 HydrophobicContact CD1-CG 3.92Å; L1439-L1507 HydrophobicContact CD2-CD2 3.73Å; L1439-L1507 HydrophobicContact CD2-CG 4.42Å; L1439-L1507 HydrophobicContact CG-CD2 4.4Å; I1444-L1507 HydrophobicContact CD1-CD2 3.89Å; L1463-L1507 HydrophobicContact CD2-CD2 3.94Å; W1466-L1507 HydrophobicContact CB-CD1 4.08Å; W1466-L1507 VanDerWaalsContact CD1-CD1 3.48Å; W1466-L1507 HydrophobicContact CD2-CB 4.18Å; W1466-L1507 HydrophobicContact CD2-CD1 4.26Å; W1466-L1507 HydrophobicContact CG-CB 4.43Å; W1466-L1507 HydrophobicContact CG-CD1 3.74Å; W1466-L1507 HydrophobicContact CH2-CB 4.24Å; W1466-L1507 HydrophobicContact CZ2-CB 4.02Å; L1477-L1507 HydrophobicContact CD1-CD1 4.44Å; L1479-L1507 HydrophobicContact CD2-CD1 3.59Å; L1479-L1507 HydrophobicContact CD2-CD2 4.33Å; I1503-L1507 HydrophobicContact CG2-CD1 3.72Å; I1503-L1507 HydrophobicContact CG2-CG 4.25Å; I1503-L1507 WeakPolarHBondContact O-CB 3.4Å; I1503-L1507 VanDerWaalsContact O-CG 3.26Å; I1503-L1507 WeakPolarHBondContact O-CG 3.38Å; I1503-L1507 PolarHBondContact O-N 2.98Å; G1504-L1507 PolarHBondContact O-N 3.13Å; M1505-L1507 PolarHBondContact O-N 3.19Å; L1507-L1510 PolarHBondContact O-N 3.18Å; L1507-V1511 WeakPolarHBondContact O-CG2 3.34Å; L1507-V1511 PolarHBondContact O-N 2.96Å; L1507-V1511 VanDerWaalsContact O-N 3.09Å
1508	W	68.1	Low	63.8	Low	55.8 Å²	55.8	56.7 Å²	56.7	21%	0.211	29%	0.29	C	S	.	.	H	α-helix	trans	-67.5	-46.7	178.7	-153.9	91.7	0	0	0	112.2	W1466 G1504 M1505 T1506 L1510 V1511 Q1512 S1642 S1643 T1646 H1647 L1650 K1704 F1708	W1466-W1508 HydrophobicContact CH2-CB 4.33Å; W1466-W1508 AromaticContact CH2-CD1 3.83Å; W1466-W1508 HydrophobicContact CH2-CG 4.39Å; W1466-W1508 HydrophobicContact CZ2-CB 4.04Å; W1466-W1508 AromaticContact CZ2-CD1 3.73Å; W1466-W1508 HydrophobicContact CZ2-CG 4.27Å; G1504-W1508 VanDerWaalsContact O-CB 3.3Å; G1504-W1508 WeakPolarHBondContact O-CB 3.26Å; G1504-W1508 PolarHBondContact O-N 3.13Å; G1504-W1508 VanDerWaalsContact O-N 3.12Å; M1505-W1508 CarbonylContact O-C 3.56Å; M1505-W1508 WeakPolarHBondContact O-CA 3.3Å; M1505-W1508 VanDerWaalsContact O-CB 3.28Å; M1505-W1508 WeakPolarHBondContact O-CB 3.43Å; M1505-W1508 PolarHBondContact O-N 3.1Å; M1505-W1508 VanDerWaalsContact O-N 3.09Å; T1506-W1508 VanDerWaalsContact C-N 3.33Å; T1506-W1508 PolarHBondContact O-N 3.22Å; W1508-L1510 VanDerWaalsContact C-N 3.3Å; W1508-L1510 PolarHBondContact O-N 3.03Å; W1508-V1511 PolarHBondContact O-N 3.18Å; W1508-Q1512 HydrophobicContact CD2-CG 4.08Å; W1508-Q1512 HydrophobicContact CE3-CG 4.03Å; W1508-Q1512 HydrophobicContact CH2-CG 4.41Å; W1508-Q1512 HydrophobicContact CZ2-CG 4.39Å; W1508-Q1512 HydrophobicContact CZ3-CG 4.06Å; W1508-Q1512 VanDerWaalsContact O-CG 3.28Å; W1508-Q1512 WeakPolarHBondContact O-CG 3.26Å; W1508-Q1512 PolarHBondContact O-N 2.96Å; W1508-Q1512 VanDerWaalsContact O-N 3.12Å; W1508-S1642 VanDerWaalsContact CH2-OG 3.29Å; W1508-S1642 WeakPolarHBondContact CH2-OG 3.36Å; W1508-S1643 VanDerWaalsContact CE3-OG 3.32Å; W1508-S1643 WeakPolarHBondContact CZ3-OG 3.49Å; W1508-T1646 HydrophobicContact CH2-CG2 3.44Å; W1508-T1646 VanDerWaalsContact CH2-CG2 3.44Å; W1508-T1646 HydrophobicContact CZ2-CG2 3.57Å; W1508-H1647 HydrophobicContact CH2-CB 3.88Å; W1508-H1647 AromaticContact CH2-CD2 3.65Å; W1508-H1647 HydrophobicContact CZ3-CB 4.36Å; W1508-H1647 AromaticContact CZ3-CD2 3.69Å; W1508-L1650 HydrophobicContact CD2-CD1 4.48Å; W1508-L1650 HydrophobicContact CD2-CD2 3.86Å; W1508-L1650 VanDerWaalsContact CE2-CD2 3.42Å; W1508-L1650 HydrophobicContact CE3-CD1 3.9Å; W1508-L1650 HydrophobicContact CE3-CD2 4.14Å; W1508-L1650 HydrophobicContact CG-CD2 4.44Å; W1508-L1650 HydrophobicContact CH2-CD1 3.22Å; W1508-L1650 HydrophobicContact CH2-CD2 3.25Å; W1508-L1650 HydrophobicContact CH2-CG 3.8Å; W1508-L1650 HydrophobicContact CZ2-CD1 4.27Å; W1508-L1650 HydrophobicContact CZ2-CD2 3.07Å; W1508-L1650 HydrophobicContact CZ2-CG 4.12Å; W1508-L1650 HydrophobicContact CZ3-CD1 3.25Å; W1508-L1650 HydrophobicContact CZ3-CD2 3.9Å; W1508-L1650 HydrophobicContact CZ3-CG 4.16Å; W1508-K1704 VanDerWaalsContact CH2-CA 3.46Å; W1508-K1704 HydrophobicContact CH2-CB 3.03Å; W1508-K1704 HydrophobicContact CH2-CD 3.31Å; W1508-K1704 HydrophobicContact CH2-CG 3.02Å; W1508-K1704 HydrophobicContact CZ2-CB 3.36Å; W1508-K1704 HydrophobicContact CZ2-CD 4.45Å; W1508-K1704 HydrophobicContact CZ2-CG 3.76Å; W1508-K1704 WeakPolarHBondContact CZ2-O 3.27Å; W1508-K1704 HydrophobicContact CZ3-CB 3.98Å; W1508-K1704 HydrophobicContact CZ3-CD 3.44Å; W1508-K1704 VanDerWaalsContact CZ3-CD 3.44Å; W1508-K1704 HydrophobicContact CZ3-CG 3.42Å; W1508-K1704 VanDerWaalsContact CZ3-CG 3.42Å; W1508-F1708 AromaticContact NE1-CE2 3.8Å; W1508-F1708 AromaticContact NE1-CZ 3.98Å
1509	E	70.6	Confident	62.5	Low	68.6 Å²	68.6	53.3 Å²	53.3	32%	0.321	28%	0.281	S	S	.	.	H	α-helix	trans	-49.7	-49	171.2	-71.5	171.8	163.9	0	0	111.2	K1417 M1505 T1506 V1511 Q1512 I1513	K1417-E1509 VanDerWaalsContact NZ-CD 3.3Å; K1417-E1509 IonicContact NZ-OE1 3Å; K1417-E1509 PolarHBondContact NZ-OE1 3.03Å; K1417-E1509 IonicContact NZ-OE2 3.71Å; K1417-E1509 PolarHBondContact NZ-OE2 3.19Å; M1505-E1509 WeakPolarHBondContact O-CG 3.27Å; M1505-E1509 PolarHBondContact O-N 3.01Å; T1506-E1509 WeakPolarHBondContact CA-OE2 3.32Å; T1506-E1509 WeakPolarHBondContact CG2-OE2 3.3Å; T1506-E1509 WeakPolarHBondContact O-CB 3.43Å; T1506-E1509 PolarHBondContact O-N 2.8Å; E1509-V1511 VanDerWaalsContact C-N 3.34Å; E1509-V1511 PolarHBondContact O-N 3.32Å; E1509-Q1512 CarbonylContact O-C 3.29Å; E1509-Q1512 WeakPolarHBondContact O-CA 3.24Å; E1509-Q1512 WeakPolarHBondContact O-CB 2.95Å; E1509-Q1512 PolarHBondContact O-N 3.2Å; E1509-I1513 WeakPolarHBondContact O-CD1 3.22Å; E1509-I1513 VanDerWaalsContact O-CG1 3.3Å; E1509-I1513 WeakPolarHBondContact O-CG1 3.36Å; E1509-I1513 PolarHBondContact O-N 3.02Å; E1509-I1513 VanDerWaalsContact O-N 3.1Å
1510	L	73.6	Confident	60.9	Low	14.8 Å²	14.8	55.1 Å²	55.1	8%	0.077	29%	0.288	C	S	.	.	H	α-helix	trans	-71.8	-30.8	-174.9	-66.5	173.1	0	0	0	113.3	L1439 G1440 A1441 T1460 T1506 L1507 W1508 Q1512 I1513 N1514	L1439-L1510 VanDerWaalsContact C-CD1 3.45Å; L1439-L1510 HydrophobicContact CB-CD1 3.58Å; G1440-L1510 VanDerWaalsContact C-CD2 3.46Å; A1441-L1510 HydrophobicContact CB-CD2 4.37Å; T1460-L1510 HydrophobicContact CG2-CB 4.01Å; T1506-L1510 HydrophobicContact CG2-CD1 4.05Å; T1506-L1510 HydrophobicContact CG2-CG 4.42Å; T1506-L1510 WeakPolarHBondContact O-CB 3.4Å; T1506-L1510 VanDerWaalsContact O-CD1 3.3Å; T1506-L1510 WeakPolarHBondContact O-CD1 3.44Å; T1506-L1510 WeakPolarHBondContact O-CG 3.32Å; T1506-L1510 PolarHBondContact O-N 3.06Å; T1506-L1510 VanDerWaalsContact O-N 3.12Å; L1507-L1510 PolarHBondContact O-N 3.18Å; W1508-L1510 VanDerWaalsContact C-N 3.3Å; W1508-L1510 PolarHBondContact O-N 3.03Å; L1510-Q1512 VanDerWaalsContact C-N 3.33Å; L1510-I1513 HydrophobicContact CD2-CD1 4.32Å; L1510-N1514 WeakPolarHBondContact O-CB 3.3Å; L1510-N1514 PolarHBondContact O-N 2.91Å; L1510-N1514 PolarHBondContact O-ND2 3.09Å
1511	V	68.4	Low	59.3	Low	40.4 Å²	40.4	61.7 Å²	61.7	25%	0.245	31%	0.312	C	S	.	.	H	α-helix	trans	-69.9	-40.5	171.7	169.1	0	0	0	0	110.6	L1463 W1466 L1507 W1508 E1509 I1513 N1514 T1515	L1463-V1511 HydrophobicContact CD2-CG2 4.31Å; W1466-V1511 HydrophobicContact CH2-CB 4.38Å; W1466-V1511 HydrophobicContact CH2-CG2 4.13Å; W1466-V1511 HydrophobicContact CZ3-CG2 3.93Å; L1507-V1511 WeakPolarHBondContact O-CG2 3.34Å; L1507-V1511 PolarHBondContact O-N 2.96Å; L1507-V1511 VanDerWaalsContact O-N 3.09Å; W1508-V1511 PolarHBondContact O-N 3.18Å; E1509-V1511 VanDerWaalsContact C-N 3.34Å; E1509-V1511 PolarHBondContact O-N 3.32Å; V1511-I1513 VanDerWaalsContact C-N 3.31Å; V1511-I1513 PolarHBondContact O-N 3.17Å; V1511-N1514 WeakPolarHBondContact O-CA 3.33Å; V1511-N1514 PolarHBondContact O-N 2.89Å; V1511-N1514 VanDerWaalsContact O-N 3.1Å; V1511-T1515 HydrophobicContact CG1-CG2 4.35Å; V1511-T1515 PolarHBondContact O-N 3.16Å; V1511-T1515 VanDerWaalsContact O-N 3.11Å; V1511-T1515 PolarHBondContact O-OG1 3.21Å
1512	Q	60.9	Low	57.6	Low	45 Å²	45	58.2 Å²	58.2	21%	0.21	31%	0.308	C	S	.	.	H	α-helix	trans	-63.6	-34.7	176.6	-70.4	-105	-14.8	0	0	113.5	W1508 E1509 L1510 N1514 T1515 P1516 S1642 E1703 K1704	W1508-Q1512 HydrophobicContact CD2-CG 4.08Å; W1508-Q1512 HydrophobicContact CE3-CG 4.03Å; W1508-Q1512 HydrophobicContact CH2-CG 4.41Å; W1508-Q1512 HydrophobicContact CZ2-CG 4.39Å; W1508-Q1512 HydrophobicContact CZ3-CG 4.06Å; W1508-Q1512 VanDerWaalsContact O-CG 3.28Å; W1508-Q1512 WeakPolarHBondContact O-CG 3.26Å; W1508-Q1512 PolarHBondContact O-N 2.96Å; W1508-Q1512 VanDerWaalsContact O-N 3.12Å; E1509-Q1512 CarbonylContact O-C 3.29Å; E1509-Q1512 WeakPolarHBondContact O-CA 3.24Å; E1509-Q1512 WeakPolarHBondContact O-CB 2.95Å; E1509-Q1512 PolarHBondContact O-N 3.2Å; L1510-Q1512 VanDerWaalsContact C-N 3.33Å; Q1512-N1514 VanDerWaalsContact C-N 3.27Å; Q1512-N1514 PolarHBondContact O-N 3.12Å; Q1512-T1515 WeakPolarHBondContact CA-OG1 3.45Å; Q1512-T1515 PolarHBondContact O-OG1 3.1Å; Q1512-T1515 VanDerWaalsContact O-OG1 3.09Å; Q1512-T1515 PolarHBondContact OE1-OG1 3.19Å; Q1512-T1515 VanDerWaalsContact OE1-OG1 3.04Å; Q1512-P1516 WeakPolarHBondContact O-CD 3.38Å; Q1512-S1642 PolarHBondContact NE2-OG 3.42Å; Q1512-E1703 PolarHBondContact NE2-O 3.49Å; Q1512-E1703 VanDerWaalsContact NE2-O 3.15Å; Q1512-E1703 PolarHBondContact OE1-O 2.82Å; Q1512-K1704 PolarHBondContact NE2-O 2.83Å; Q1512-K1704 VanDerWaalsContact NE2-O 3.15Å
1513	I	62.6	Low	55.5	Low	84.4 Å²	84.4	63.7 Å²	63.7	43%	0.433	33%	0.329	S	S	.	.	H	α-helix	trans	-65.2	-28	174.7	-64.1	170.1	0	0	0	111.9	A1441 E1509 L1510 V1511	A1441-I1513 HydrophobicContact CB-CG2 4.27Å; E1509-I1513 WeakPolarHBondContact O-CD1 3.22Å; E1509-I1513 VanDerWaalsContact O-CG1 3.3Å; E1509-I1513 WeakPolarHBondContact O-CG1 3.36Å; E1509-I1513 PolarHBondContact O-N 3.02Å; E1509-I1513 VanDerWaalsContact O-N 3.1Å; L1510-I1513 HydrophobicContact CD2-CD1 4.32Å; V1511-I1513 VanDerWaalsContact C-N 3.31Å; V1511-I1513 PolarHBondContact O-N 3.17Å
1514	N	56.7	Low	53.3	Low	27.4 Å²	27.4	66.9 Å²	66.9	15%	0.147	35%	0.351	C	S	.	.	H	α-helix	trans	-98	-25.2	-173.5	-79.4	-65.2	0	0	0	114.7	A1441 T1460 V1461 L1510 V1511 Q1512 P1516 K1517 T1518	A1441-N1514 PolarHBondContact O-ND2 3.24Å; A1441-N1514 PolarHBondContact O-OD1 3.18Å; T1460-N1514 WeakPolarHBondContact CB-ND2 3.28Å; T1460-N1514 VanDerWaalsContact CG2-ND2 3.26Å; T1460-N1514 WeakPolarHBondContact CG2-ND2 3.2Å; V1461-N1514 HydrophobicContact CG1-CB 3.75Å; V1461-N1514 WeakPolarHBondContact CG1-OD1 3.42Å; V1461-N1514 HydrophobicContact CG2-CB 4.41Å; L1510-N1514 WeakPolarHBondContact O-CB 3.3Å; L1510-N1514 PolarHBondContact O-N 2.91Å; L1510-N1514 PolarHBondContact O-ND2 3.09Å; V1511-N1514 WeakPolarHBondContact O-CA 3.33Å; V1511-N1514 PolarHBondContact O-N 2.89Å; V1511-N1514 VanDerWaalsContact O-N 3.1Å; Q1512-N1514 VanDerWaalsContact C-N 3.27Å; Q1512-N1514 PolarHBondContact O-N 3.12Å; N1514-P1516 VanDerWaalsContact C-CD 3.46Å; N1514-P1516 WeakPolarHBondContact O-CD 3.39Å; N1514-K1517 PolarHBondContact O-N 3.11Å; N1514-T1518 PolarHBondContact O-N 2.86Å; N1514-T1518 VanDerWaalsContact O-N 3.12Å; N1514-T1518 PolarHBondContact O-OG1 3.07Å
1515	T	48.7	Very low	51.2	Low	55.4 Å²	55.4	70.3 Å²	70.3	34%	0.34	37%	0.373	S	S	.	.	H	α-helix	trans	-55.5	-40.7	179.6	18	0	0	0	0	114.2	V1511 Q1512 K1517 T1518 V1519	V1511-T1515 HydrophobicContact CG1-CG2 4.35Å; V1511-T1515 PolarHBondContact O-N 3.16Å; V1511-T1515 VanDerWaalsContact O-N 3.11Å; V1511-T1515 PolarHBondContact O-OG1 3.21Å; Q1512-T1515 WeakPolarHBondContact CA-OG1 3.45Å; Q1512-T1515 PolarHBondContact O-OG1 3.1Å; Q1512-T1515 VanDerWaalsContact O-OG1 3.09Å; Q1512-T1515 PolarHBondContact OE1-OG1 3.19Å; Q1512-T1515 VanDerWaalsContact OE1-OG1 3.04Å; T1515-K1517 VanDerWaalsContact C-N 3.27Å; T1515-K1517 PolarHBondContact O-N 3.06Å; T1515-T1518 PolarHBondContact O-N 3.24Å; T1515-V1519 WeakPolarHBondContact O-CB 3.35Å; T1515-V1519 WeakPolarHBondContact O-CG2 3.35Å; T1515-V1519 PolarHBondContact O-N 3.03Å
1516	P	45.3	Very low	49.3	Very low	52.4 Å²	52.4	74.6 Å²	74.6	34%	0.34	39%	0.39	S	S	.	.	H	α-helix	trans	-63.1	-33.1	-177.9	14.7	-21.7	0	0	0	112.6	Q1512 N1514 T1518 V1519 Q1520	Q1512-P1516 WeakPolarHBondContact O-CD 3.38Å; N1514-P1516 VanDerWaalsContact C-CD 3.46Å; N1514-P1516 WeakPolarHBondContact O-CD 3.39Å; P1516-T1518 VanDerWaalsContact C-N 3.3Å; P1516-T1518 PolarHBondContact O-N 3.1Å; P1516-V1519 HydrophobicContact CB-CG2 4.29Å; P1516-V1519 HydrophobicContact CG-CG2 4.16Å; P1516-V1519 WeakPolarHBondContact O-CB 3.31Å; P1516-V1519 PolarHBondContact O-N 3.06Å; P1516-Q1520 WeakPolarHBondContact O-CB 3.31Å; P1516-Q1520 WeakPolarHBondContact O-CG 3.23Å; P1516-Q1520 PolarHBondContact O-N 3.02Å
1517	K	40.4	Very low	47.1	Very low	145.8 Å²	145.8	81.8 Å²	81.8	63%	0.634	43%	0.427	S	S	*	.	H	α-helix	trans	-65.8	-27.6	179.1	-66.3	-175.8	178.3	-179.1	0	113.1	N1514 T1515 Q1520 K1521 S1559	N1514-K1517 PolarHBondContact O-N 3.11Å; T1515-K1517 VanDerWaalsContact C-N 3.27Å; T1515-K1517 PolarHBondContact O-N 3.06Å; K1517-Q1520 VanDerWaalsContact O-CB 3.26Å; K1517-Q1520 WeakPolarHBondContact O-CB 3.5Å; K1517-Q1520 PolarHBondContact O-N 2.92Å; K1517-K1521 VanDerWaalsContact O-CB 3.28Å; K1517-K1521 WeakPolarHBondContact O-CB 3.29Å; K1517-K1521 PolarHBondContact O-N 3.06Å; K1517-K1521 VanDerWaalsContact O-N 3.11Å; K1517-S1559 PolarHBondContact NZ-O 3.41Å
1518	T	35.2	Very low	44.7	Very low	88.8 Å²	88.8	90.3 Å²	90.3	55%	0.545	47%	0.467	S	S	.	.	H	α-helix	trans	-78.3	-36.8	175.4	-41.5	0	0	0	0	111.5	V1461 N1514 T1515 P1516 Q1520 K1521 A1522	V1461-T1518 HydrophobicContact CG1-CG2 4.27Å; V1461-T1518 VanDerWaalsContact CG1-OG1 3.29Å; V1461-T1518 WeakPolarHBondContact CG1-OG1 3.3Å; N1514-T1518 PolarHBondContact O-N 2.86Å; N1514-T1518 VanDerWaalsContact O-N 3.12Å; N1514-T1518 PolarHBondContact O-OG1 3.07Å; T1515-T1518 PolarHBondContact O-N 3.24Å; P1516-T1518 VanDerWaalsContact C-N 3.3Å; P1516-T1518 PolarHBondContact O-N 3.1Å; T1518-Q1520 PolarHBondContact O-N 2.95Å; T1518-K1521 CarbonylContact O-C 3.44Å; T1518-K1521 PolarHBondContact O-N 2.99Å; T1518-K1521 VanDerWaalsContact O-N 3.13Å; T1518-A1522 WeakPolarHBondContact O-CB 3.27Å; T1518-A1522 PolarHBondContact O-N 3.35Å; T1518-A1522 VanDerWaalsContact O-N 3.08Å
1519	V	33	Very low	42.8	Very low	73.8 Å²	73.8	97.1 Å²	97.1	45%	0.447	50%	0.501	S	S	.	.	H	α-helix	trans	-71.5	-45.1	178.2	176.8	0	0	0	0	111	T1515 P1516 K1521 A1522 F1523	T1515-V1519 WeakPolarHBondContact O-CB 3.35Å; T1515-V1519 WeakPolarHBondContact O-CG2 3.35Å; T1515-V1519 PolarHBondContact O-N 3.03Å; P1516-V1519 HydrophobicContact CB-CG2 4.29Å; P1516-V1519 HydrophobicContact CG-CG2 4.16Å; P1516-V1519 WeakPolarHBondContact O-CB 3.31Å; P1516-V1519 PolarHBondContact O-N 3.06Å; V1519-K1521 VanDerWaalsContact C-N 3.31Å; V1519-K1521 PolarHBondContact O-N 3.22Å; V1519-A1522 WeakPolarHBondContact O-CB 3.05Å; V1519-A1522 PolarHBondContact O-N 3.14Å; V1519-A1522 VanDerWaalsContact O-N 3.1Å; V1519-F1523 HydrophobicContact CG1-CD2 3.82Å; V1519-F1523 HydrophobicContact CG1-CE2 3.78Å; V1519-F1523 WeakPolarHBondContact O-CD2 3.43Å; V1519-F1523 PolarHBondContact O-N 3.12Å
1520	Q	32.5	Very low	40.8	Very low	90 Å²	90	98.2 Å²	98.2	42%	0.421	52%	0.521	S	S	.	.	H	α-helix	trans	-56.9	-43.7	175.1	-74.7	179.4	-66.1	0	0	111.5	P1516 K1517 T1518 A1522 F1523 S1524	P1516-Q1520 WeakPolarHBondContact O-CB 3.31Å; P1516-Q1520 WeakPolarHBondContact O-CG 3.23Å; P1516-Q1520 PolarHBondContact O-N 3.02Å; K1517-Q1520 VanDerWaalsContact O-CB 3.26Å; K1517-Q1520 WeakPolarHBondContact O-CB 3.5Å; K1517-Q1520 PolarHBondContact O-N 2.92Å; T1518-Q1520 PolarHBondContact O-N 2.95Å; Q1520-A1522 VanDerWaalsContact C-N 3.26Å; Q1520-A1522 PolarHBondContact O-N 3.12Å; Q1520-A1522 VanDerWaalsContact O-N 3.13Å; Q1520-F1523 PolarHBondContact O-N 3.34Å; Q1520-S1524 PolarHBondContact O-N 3.09Å; Q1520-S1524 PolarHBondContact O-OG 3.11Å; Q1520-S1524 VanDerWaalsContact O-OG 3.09Å
1521	K	31.9	Very low	38.6	Very low	165.4 Å²	165.4	106.3 Å²	106.3	72%	0.719	56%	0.559	S	S	*	*	H	α-helix	trans	-67.2	-25	179.1	-126.2	179.5	-177.9	-177.3	0	114.3	K1517 T1518 V1519 F1523 S1524 S1525	K1517-K1521 VanDerWaalsContact O-CB 3.28Å; K1517-K1521 WeakPolarHBondContact O-CB 3.29Å; K1517-K1521 PolarHBondContact O-N 3.06Å; K1517-K1521 VanDerWaalsContact O-N 3.11Å; T1518-K1521 CarbonylContact O-C 3.44Å; T1518-K1521 PolarHBondContact O-N 2.99Å; T1518-K1521 VanDerWaalsContact O-N 3.13Å; V1519-K1521 VanDerWaalsContact C-N 3.31Å; V1519-K1521 PolarHBondContact O-N 3.22Å; K1521-F1523 VanDerWaalsContact C-N 3.29Å; K1521-F1523 PolarHBondContact O-N 3.29Å; K1521-S1524 CarbonylContact O-C 3.43Å; K1521-S1524 WeakPolarHBondContact O-CA 3.25Å; K1521-S1524 WeakPolarHBondContact O-CB 3.33Å; K1521-S1524 PolarHBondContact O-N 3Å; K1521-S1525 WeakPolarHBondContact O-CB 3.37Å; K1521-S1525 PolarHBondContact O-N 3.16Å; K1521-S1525 PolarHBondContact O-OG 3.22Å
1522	A	30.3	Very low	36.7	Very low	61 Å²	61	109.9 Å²	109.9	50%	0.504	58%	0.583	S	S	.	*	H	α-helix	trans	-81.1	-18.2	174.4	0	0	0	0	0	113.2	T1518 V1519 Q1520 S1524 S1525	T1518-A1522 WeakPolarHBondContact O-CB 3.27Å; T1518-A1522 PolarHBondContact O-N 3.35Å; T1518-A1522 VanDerWaalsContact O-N 3.08Å; V1519-A1522 WeakPolarHBondContact O-CB 3.05Å; V1519-A1522 PolarHBondContact O-N 3.14Å; V1519-A1522 VanDerWaalsContact O-N 3.1Å; Q1520-A1522 VanDerWaalsContact C-N 3.26Å; Q1520-A1522 PolarHBondContact O-N 3.12Å; Q1520-A1522 VanDerWaalsContact O-N 3.13Å; A1522-S1524 VanDerWaalsContact C-N 3.31Å; A1522-S1525 PolarHBondContact O-N 2.88Å; A1522-S1525 PolarHBondContact O-OG 3.41Å
1523	F	29.8	Very low	35.3	Very low	155.2 Å²	155.2	113.9 Å²	113.9	68%	0.681	61%	0.613	S	S	*	*	H	α-helix	trans	-93.8	-34.2	173.4	-80.9	-76.9	0	0	0	112.8	V1519 Q1520 K1521 S1525 K1526	V1519-F1523 HydrophobicContact CG1-CD2 3.82Å; V1519-F1523 HydrophobicContact CG1-CE2 3.78Å; V1519-F1523 WeakPolarHBondContact O-CD2 3.43Å; V1519-F1523 PolarHBondContact O-N 3.12Å; Q1520-F1523 PolarHBondContact O-N 3.34Å; K1521-F1523 VanDerWaalsContact C-N 3.29Å; K1521-F1523 PolarHBondContact O-N 3.29Å; F1523-S1525 VanDerWaalsContact C-N 3.33Å; F1523-S1525 PolarHBondContact O-N 3.1Å; F1523-K1526 PolarHBondContact O-N 3.28Å
1524	S	30.3	Very low	33.5	Very low	70.6 Å²	70.6	115.7 Å²	115.7	49%	0.494	63%	0.633	S	S	.	*	H	α-helix	trans	-68.9	-33.3	174.1	-54.5	0	0	0	0	112.9	Q1520 K1521 A1522 K1526 L1527	Q1520-S1524 PolarHBondContact O-N 3.09Å; Q1520-S1524 PolarHBondContact O-OG 3.11Å; Q1520-S1524 VanDerWaalsContact O-OG 3.09Å; K1521-S1524 CarbonylContact O-C 3.43Å; K1521-S1524 WeakPolarHBondContact O-CA 3.25Å; K1521-S1524 WeakPolarHBondContact O-CB 3.33Å; K1521-S1524 PolarHBondContact O-N 3Å; A1522-S1524 VanDerWaalsContact C-N 3.31Å; S1524-K1526 VanDerWaalsContact C-N 3.3Å; S1524-K1526 PolarHBondContact O-N 2.96Å; S1524-L1527 PolarHBondContact O-N 3.28Å; S1524-L1527 VanDerWaalsContact O-N 3.09Å
1525	S	30.3	Very low	32.1	Very low	82.6 Å²	82.6	118.9 Å²	118.9	58%	0.578	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.4	19.2	-176.8	63.8	0	0	0	0	115	K1521 A1522 F1523 L1527	K1521-S1525 WeakPolarHBondContact O-CB 3.37Å; K1521-S1525 PolarHBondContact O-N 3.16Å; K1521-S1525 PolarHBondContact O-OG 3.22Å; A1522-S1525 PolarHBondContact O-N 2.88Å; A1522-S1525 PolarHBondContact O-OG 3.41Å; F1523-S1525 VanDerWaalsContact C-N 3.33Å; F1523-S1525 PolarHBondContact O-N 3.1Å; S1525-L1527 PolarHBondContact O-N 3.43Å
1526	K	29.9	Very low	31	Very low	184.6 Å²	184.6	120.6 Å²	120.6	80%	0.803	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.6	12.1	175.9	-78.6	-161	170.4	-165.9	0	114.2	F1523 S1524	F1523-K1526 PolarHBondContact O-N 3.28Å; S1524-K1526 VanDerWaalsContact C-N 3.3Å; S1524-K1526 PolarHBondContact O-N 2.96Å
1527	L	30.3	Very low	30	Very low	153.6 Å²	153.6	127.6 Å²	127.6	80%	0.804	71%	0.708	S	S	*	*	S	Bend	trans	-124	5.8	-178.9	-117.8	92	0	0	0	114.9	S1524 S1525 E1529	S1524-L1527 PolarHBondContact O-N 3.28Å; S1524-L1527 VanDerWaalsContact O-N 3.09Å; S1525-L1527 PolarHBondContact O-N 3.43Å; L1527-E1529 PolarHBondContact O-N 2.98Å
1528	E	29.5	Very low	29.2	Very low	181.4 Å²	181.4	128.9 Å²	128.9	85%	0.848	72%	0.716	S	S	*	*	S	Bend	trans	-108.1	7.2	-178.9	-69.8	-174.5	134.8	0	0	114.5	A1530	E1528-A1530 VanDerWaalsContact C-N 3.31Å; E1528-A1530 PolarHBondContact O-N 2.9Å
1529	E	27.8	Very low	28.9	Very low	198 Å²	198	132.4 Å²	132.4	93%	0.925	73%	0.731	S	S	*	*			trans	-109.5	54.8	177.1	-78.9	-173.8	162.2	0	0	113	L1527	L1527-E1529 PolarHBondContact O-N 2.98Å
1530	A	29.2	Very low	28.5	Very low	91 Å²	91	135.4 Å²	135.4	75%	0.752	75%	0.749	S	S	*	*			trans	-137.8	96.2	168.9	0	0	0	0	0	110.7	E1528	E1528-A1530 VanDerWaalsContact C-N 3.31Å; E1528-A1530 PolarHBondContact O-N 2.9Å
1531	E	27.5	Very low	28.2	Very low	185.6 Å²	185.6	134.8 Å²	134.8	87%	0.867	77%	0.768	S	S	*	*			trans	-63.9	142.2	168.1	-75.6	-148.5	143.3	0	0	111	P1533	E1531-P1533 VanDerWaalsContact O-CD 3.22Å; E1531-P1533 WeakPolarHBondContact O-CD 3.36Å
1532	P	28.7	Very low	27.8	Very low	116.4 Å²	116.4	131.5 Å²	131.5	76%	0.756	77%	0.771	S	S	*	*			trans	-80.5	124	-178.6	30.4	-32.6	0	0	0	112.1	S1534	P1532-S1534 PolarHBondContact O-N 3.08Å; P1532-S1534 VanDerWaalsContact O-N 3.11Å
1533	P	30.4	Very low	27.7	Very low	127.8 Å²	127.8	136.5 Å²	136.5	83%	0.83	79%	0.789	S	S	*	*			trans	-74.1	129.1	175.8	30	-33.6	0	0	0	111	E1531 A1535	E1531-P1533 VanDerWaalsContact O-CD 3.22Å; E1531-P1533 WeakPolarHBondContact O-CD 3.36Å; P1533-A1535 PolarHBondContact O-N 2.92Å
1534	S	25	Very low	27.5	Very low	123.6 Å²	123.6	132.6 Å²	132.6	86%	0.864	79%	0.794	S	S	*	*			trans	-88.7	108.6	179.2	47	0	0	0	0	112.1	P1532	P1532-S1534 PolarHBondContact O-N 3.08Å; P1532-S1534 VanDerWaalsContact O-N 3.11Å
1535	A	28.4	Very low	27.3	Very low	94.2 Å²	94.2	136.9 Å²	136.9	78%	0.779	81%	0.81	S	S	*	*			trans	-157.8	123	163.9	0	0	0	0	0	111.4	P1533 F1537	P1533-A1535 PolarHBondContact O-N 2.92Å; A1535-F1537 PolarHBondContact O-N 3.45Å
1536	A	24.6	Very low	27.1	Very low	90.4 Å²	90.4	137.6 Å²	137.6	75%	0.747	81%	0.813	S	S	*	*			trans	-71.4	128.5	169.9	0	0	0	0	0	113.2
1537	F	25.7	Very low	27	Very low	198.8 Å²	198.8	133.4 Å²	133.4	87%	0.872	80%	0.802	S	S	*	*			trans	-142.4	120.1	141.6	-104.1	-83.1	0	0	0	110.3	A1535 L1539	A1535-F1537 PolarHBondContact O-N 3.45Å; F1537-L1539 PolarHBondContact O-N 3.23Å; F1537-L1539 VanDerWaalsContact O-N 3.15Å
1538	H	23.6	Very low	27	Very low	174 Å²	174	131.4 Å²	131.4	81%	0.806	79%	0.79	S	S	*	*			trans	-61.4	131.4	163.1	-80.2	-103	0	0	0	112.6
1539	L	28.4	Very low	27.1	Very low	162.6 Å²	162.6	125.6 Å²	125.6	85%	0.851	76%	0.762	S	S	*	*			trans	-132.6	119.3	156.4	-86.5	165	0	0	0	109.5	F1537	F1537-L1539 PolarHBondContact O-N 3.23Å; F1537-L1539 VanDerWaalsContact O-N 3.15Å
1540	T	24.3	Very low	27.4	Very low	136.4 Å²	136.4	121.2 Å²	121.2	84%	0.837	74%	0.742	S	S	*	*			trans	-95	129	150.3	46.1	0	0	0	0	111.3
1541	G	25.7	Very low	27.5	Very low	78.6 Å²	78.6	118.8 Å²	118.8	81%	0.81	73%	0.725	S	S	*	*			trans	151.9	134.5	167.9	0	0	0	0	0	112.1
1542	A	24.9	Very low	27.8	Very low	96 Å²	96	111.8 Å²	111.8	79%	0.793	69%	0.694	S	S	*	*			trans	-91	122.2	171.3	0	0	0	0	0	111.4
1543	D	27.7	Very low	28.1	Very low	164.2 Å²	164.2	109.4 Å²	109.4	88%	0.878	67%	0.672	S	S	*	*			trans	-161	138.6	142.9	-94.4	-34.6	0	0	0	110.3	L1545	D1543-L1545 PolarHBondContact O-N 2.96Å
1544	G	25.7	Very low	28.3	Very low	75.2 Å²	75.2	107.2 Å²	107.2	78%	0.775	66%	0.655	S	S	*	*			trans	-60.3	122.1	-175.3	0	0	0	0	0	115.6	P1546	G1544-P1546 WeakPolarHBondContact O-CD 3.22Å
1545	L	25.5	Very low	28.5	Very low	159.4 Å²	159.4	104.8 Å²	104.8	84%	0.835	64%	0.638	S	S	*	*			trans	-74.4	127.4	166.2	-125.3	83.3	0	0	0	110.5	D1543 V1547	D1543-L1545 PolarHBondContact O-N 2.96Å; L1545-V1547 VanDerWaalsContact C-N 3.31Å; L1545-V1547 HydrophobicContact CD2-CG2 3.97Å; L1545-V1547 HydrophobicContact CG-CG2 4.19Å; L1545-V1547 PolarHBondContact O-N 3.18Å
1546	P	25.7	Very low	28.6	Very low	97.8 Å²	97.8	107.2 Å²	107.2	64%	0.635	63%	0.634	S	S	*	*			trans	-75.7	103.6	-178.5	21.5	-22.8	0	0	0	111.7	G1544 M1548	G1544-P1546 WeakPolarHBondContact O-CD 3.22Å; P1546-M1548 PolarHBondContact O-N 2.98Å
1547	V	28.5	Very low	29	Very low	96.4 Å²	96.4	106.4 Å²	106.4	58%	0.584	62%	0.622	S	S	*	*			trans	-78.1	104.6	176.7	-178.2	0	0	0	0	110.1	L1545 F1549 H1550	L1545-V1547 VanDerWaalsContact C-N 3.31Å; L1545-V1547 HydrophobicContact CD2-CG2 3.97Å; L1545-V1547 HydrophobicContact CG-CG2 4.19Å; L1545-V1547 PolarHBondContact O-N 3.18Å; V1547-F1549 VanDerWaalsContact C-N 3.35Å; V1547-F1549 PolarHBondContact O-N 3.14Å; V1547-H1550 PolarHBondContact O-N 3.34Å; V1547-H1550 VanDerWaalsContact O-N 3.09Å
1548	M	30.2	Very low	29.5	Very low	112.6 Å²	112.6	100.4 Å²	100.4	56%	0.555	60%	0.599	S	S	*	*			trans	-74.2	65.7	176.6	-72.5	-123.7	-121.8	0	0	113	P1546 H1550 G1551 S1693 T1764 Q1767	P1546-M1548 PolarHBondContact O-N 2.98Å; M1548-H1550 VanDerWaalsContact C-N 3.27Å; M1548-H1550 PolarHBondContact O-N 3.11Å; M1548-H1550 VanDerWaalsContact O-N 3.11Å; M1548-G1551 PolarHBondContact O-N 3.24Å; M1548-S1693 WeakPolarHBondContact CE-OG 3.11Å; M1548-T1764 HydrophobicContact CE-CG2 4.45Å; M1548-Q1767 HydrophobicContact CE-CB 4.3Å; M1548-Q1767 PolarHBondContact SD-OE1 3.46Å
1549	F	32.2	Very low	30	Very low	58.8 Å²	58.8	96.3 Å²	96.3	26%	0.258	59%	0.59	S	S	.	*	T	Hydrogen-bonded Turn	trans	-67.1	-6.6	179.4	-123.6	-88.3	0	0	0	114.6	V1547 G1551 L1552 F1553 Y1686 F1754 G1756 K1760	V1547-F1549 VanDerWaalsContact C-N 3.35Å; V1547-F1549 PolarHBondContact O-N 3.14Å; F1549-G1551 VanDerWaalsContact C-N 3.35Å; F1549-G1551 PolarHBondContact O-N 3.33Å; F1549-L1552 HydrophobicContact CD1-CD1 3.99Å; F1549-L1552 HydrophobicContact CD2-CD1 4.42Å; F1549-L1552 HydrophobicContact CE1-CD1 4.32Å; F1549-L1552 HydrophobicContact CE2-CD1 4.45Å; F1549-L1552 PolarHBondContact O-N 3.4Å; F1549-F1553 WeakPolarHBondContact O-CD2 3.37Å; F1549-Y1686 WeakPolarHBondContact CD2-OH 3.46Å; F1549-Y1686 WeakPolarHBondContact CE2-OH 3.46Å; F1549-Y1686 WeakPolarHBondContact CG-OH 3.45Å; F1549-F1754 HydrophobicContact CE1-CE1 4.1Å; F1549-F1754 HydrophobicContact CE1-CZ 4.32Å; F1549-F1754 HydrophobicContact CZ-CE1 4.26Å; F1549-G1756 WeakPolarHBondContact CZ-O 3.46Å; F1549-K1760 HydrophobicContact CD1-CD 4.25Å; F1549-K1760 HydrophobicContact CD2-CB 4.22Å; F1549-K1760 HydrophobicContact CD2-CD 4.2Å; F1549-K1760 HydrophobicContact CD2-CG 4.07Å; F1549-K1760 HydrophobicContact CE1-CB 4.25Å; F1549-K1760 HydrophobicContact CE1-CD 4.26Å; F1549-K1760 HydrophobicContact CE1-CG 4.34Å; F1549-K1760 HydrophobicContact CE2-CB 3.78Å; F1549-K1760 VanDerWaalsContact CE2-CB 3.48Å; F1549-K1760 HydrophobicContact CE2-CD 4.02Å; F1549-K1760 VanDerWaalsContact CE2-CD 3.47Å; F1549-K1760 HydrophobicContact CE2-CG 3.65Å; F1549-K1760 HydrophobicContact CG-CD 4.34Å; F1549-K1760 HydrophobicContact CG-CG 4.4Å; F1549-K1760 HydrophobicContact CZ-CB 3.67Å; F1549-K1760 HydrophobicContact CZ-CD 4.17Å; F1549-K1760 HydrophobicContact CZ-CG 3.98Å
1550	H	33.5	Very low	30.2	Very low	106.4 Å²	106.4	91.4 Å²	91.4	49%	0.493	58%	0.579	S	S	.	*	T	Hydrogen-bonded Turn	trans	-75.7	-18.6	173.7	-105.9	34.8	0	0	0	114.1	V1547 M1548 L1552 F1553 V1554 R1639 F1692 S1693	V1547-H1550 PolarHBondContact O-N 3.34Å; V1547-H1550 VanDerWaalsContact O-N 3.09Å; M1548-H1550 VanDerWaalsContact C-N 3.27Å; M1548-H1550 PolarHBondContact O-N 3.11Å; M1548-H1550 VanDerWaalsContact O-N 3.11Å; H1550-L1552 PolarHBondContact O-N 3.41Å; H1550-L1552 VanDerWaalsContact O-N 3.13Å; H1550-F1553 CarbonylContact O-C 3.52Å; H1550-F1553 PolarHBondContact O-N 2.88Å; H1550-V1554 WeakPolarHBondContact O-CB 3.44Å; H1550-V1554 VanDerWaalsContact O-CG2 3.28Å; H1550-V1554 WeakPolarHBondContact O-CG2 3.47Å; H1550-R1639 PolarHBondContact CE1-NH1 2.88Å; H1550-R1639 PolarHBondContact NE2-NH1 2.97Å; H1550-R1639 VanDerWaalsContact NE2-NH1 3.16Å; H1550-F1692 AromaticContact CD2-CD1 3.85Å; H1550-S1693 PolarHBondContact CD2-N 3.3Å; H1550-S1693 PolarHBondContact NE2-N 3Å; H1550-S1693 VanDerWaalsContact NE2-N 3.13Å
1551	G	30.6	Very low	30.7	Very low	39.4 Å²	39.4	91.2 Å²	91.2	41%	0.406	57%	0.567	S	S	.	*	T	Hydrogen-bonded Turn	trans	-77.1	-34.8	-179.9	0	0	0	0	0	114.1	M1548 F1549 F1553 V1554 S1555 Y1763	M1548-G1551 PolarHBondContact O-N 3.24Å; F1549-G1551 VanDerWaalsContact C-N 3.35Å; F1549-G1551 PolarHBondContact O-N 3.33Å; G1551-F1553 VanDerWaalsContact C-N 3.3Å; G1551-F1553 PolarHBondContact O-N 3.12Å; G1551-V1554 PolarHBondContact O-N 3.05Å; G1551-S1555 WeakPolarHBondContact O-CB 3.45Å; G1551-S1555 PolarHBondContact O-N 3.06Å; G1551-S1555 VanDerWaalsContact O-N 3.07Å; G1551-Y1763 WeakPolarHBondContact O-CE2 3.39Å; G1551-Y1763 PolarHBondContact O-OH 3.39Å
1552	L	33.8	Very low	31.2	Very low	39.8 Å²	39.8	91.4 Å²	91.4	21%	0.208	55%	0.549	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-20	-172.2	-82.7	155.4	0	0	0	114.9	F1549 H1550 I1630 F1754 F1755 L1759 Y1763	F1549-L1552 HydrophobicContact CD1-CD1 3.99Å; F1549-L1552 HydrophobicContact CD2-CD1 4.42Å; F1549-L1552 HydrophobicContact CE1-CD1 4.32Å; F1549-L1552 HydrophobicContact CE2-CD1 4.45Å; F1549-L1552 PolarHBondContact O-N 3.4Å; H1550-L1552 PolarHBondContact O-N 3.41Å; H1550-L1552 VanDerWaalsContact O-N 3.13Å; L1552-I1630 HydrophobicContact CD2-CD1 4.27Å; L1552-I1630 HydrophobicContact CD2-CG1 4.13Å; L1552-F1754 HydrophobicContact CD1-CZ 4.07Å; L1552-F1755 HydrophobicContact CD2-CE2 3.82Å; L1552-F1755 HydrophobicContact CD2-CZ 4.41Å; L1552-L1759 HydrophobicContact CD2-CB 4.04Å; L1552-L1759 HydrophobicContact CD2-CD1 3.78Å; L1552-Y1763 HydrophobicContact CD1-CD1 4.06Å; L1552-Y1763 HydrophobicContact CD1-CD2 3.59Å; L1552-Y1763 HydrophobicContact CD1-CE1 4.26Å; L1552-Y1763 HydrophobicContact CD1-CE2 3.85Å; L1552-Y1763 HydrophobicContact CD1-CG 3.72Å; L1552-Y1763 HydrophobicContact CD2-CD2 3.59Å; L1552-Y1763 HydrophobicContact CD2-CE1 4.05Å; L1552-Y1763 HydrophobicContact CD2-CE2 3.57Å; L1552-Y1763 HydrophobicContact CG-CD2 3.5Å; L1552-Y1763 HydrophobicContact CG-CE1 4.45Å; L1552-Y1763 HydrophobicContact CG-CE2 3.36Å; L1552-Y1763 HydrophobicContact CG-CG 4.13Å
1553	F	36.3	Very low	31.8	Very low	65.4 Å²	65.4	95.7 Å²	95.7	29%	0.287	55%	0.553	S	S	.	*	T	Hydrogen-bonded Turn	trans	-116.9	19	-179.8	-73.6	-71.1	0	0	0	114.3	F1549 H1550 G1551 S1555 Y1609 I1630 T1638 L1759 Y1763	F1549-F1553 WeakPolarHBondContact O-CD2 3.37Å; H1550-F1553 CarbonylContact O-C 3.52Å; H1550-F1553 PolarHBondContact O-N 2.88Å; G1551-F1553 VanDerWaalsContact C-N 3.3Å; G1551-F1553 PolarHBondContact O-N 3.12Å; F1553-S1555 PolarHBondContact O-N 3.12Å; F1553-Y1609 HydrophobicContact CE1-CE1 4.46Å; F1553-Y1609 WeakPolarHBondContact CE1-OH 3.19Å; F1553-I1630 HydrophobicContact CD1-CD1 4.41Å; F1553-I1630 HydrophobicContact CD1-CG2 3.94Å; F1553-I1630 VanDerWaalsContact CD1-CG2 3.4Å; F1553-I1630 HydrophobicContact CE1-CB 4.27Å; F1553-I1630 HydrophobicContact CE1-CD1 3.66Å; F1553-I1630 HydrophobicContact CE1-CG1 3.73Å; F1553-I1630 HydrophobicContact CE1-CG2 3.58Å; F1553-I1630 HydrophobicContact CE2-CD1 4.29Å; F1553-I1630 HydrophobicContact CZ-CD1 3.82Å; F1553-I1630 HydrophobicContact CZ-CG1 4.14Å; F1553-I1630 HydrophobicContact CZ-CG2 4.3Å; F1553-T1638 HydrophobicContact CE1-CG2 3.49Å; F1553-T1638 VanDerWaalsContact CE1-CG2 3.49Å; F1553-T1638 HydrophobicContact CZ-CG2 3.59Å; F1553-L1759 HydrophobicContact CE2-CD1 4.46Å; F1553-L1759 HydrophobicContact CZ-CD1 4.09Å; F1553-Y1763 HydrophobicContact CE2-CE2 4.47Å
1554	V	33.6	Very low	32.1	Very low	80.6 Å²	80.6	95.4 Å²	95.4	49%	0.488	55%	0.546	S	S	.	.			trans	-115	41.6	-177	-172.9	0	0	0	0	112	H1550 G1551 E1556 S1557 L1619 F1692	H1550-V1554 WeakPolarHBondContact O-CB 3.44Å; H1550-V1554 VanDerWaalsContact O-CG2 3.28Å; H1550-V1554 WeakPolarHBondContact O-CG2 3.47Å; G1551-V1554 PolarHBondContact O-N 3.05Å; V1554-E1556 PolarHBondContact O-N 2.59Å; V1554-S1557 WeakPolarHBondContact CG1-OG 3.25Å; V1554-L1619 HydrophobicContact CB-CD1 3.89Å; V1554-L1619 HydrophobicContact CB-CG 4.41Å; V1554-L1619 HydrophobicContact CG1-CD1 3.93Å; V1554-L1619 HydrophobicContact CG1-CG 4.2Å; V1554-L1619 HydrophobicContact CG2-CD1 3.82Å; V1554-L1619 HydrophobicContact CG2-CD2 4.19Å; V1554-L1619 HydrophobicContact CG2-CG 3.97Å; V1554-F1692 HydrophobicContact CG1-CZ 4.3Å
1555	S	29.9	Very low	32.5	Very low	73 Å²	73	95 Å²	95	51%	0.51	53%	0.531	S	S	.	.			trans	-79.7	137.4	175.3	-164.7	0	0	0	0	112	G1551 F1553 S1557	G1551-S1555 WeakPolarHBondContact O-CB 3.45Å; G1551-S1555 PolarHBondContact O-N 3.06Å; G1551-S1555 VanDerWaalsContact O-N 3.07Å; F1553-S1555 PolarHBondContact O-N 3.12Å; S1555-S1557 VanDerWaalsContact C-N 3.31Å; S1555-S1557 PolarHBondContact O-N 3.06Å; S1555-S1557 VanDerWaalsContact O-N 3.11Å; S1555-S1557 PolarHBondContact O-OG 3.48Å; S1555-S1557 PolarHBondContact OG-N 2.98Å; S1555-S1557 PolarHBondContact OG-OG 2.93Å
1556	E	30.9	Very low	33.1	Very low	145.4 Å²	145.4	91.9 Å²	91.9	68%	0.679	53%	0.529	S	S	*	.	G	3₁₀ helix	trans	-27.6	-19.1	-176.8	-67.1	-178	114.1	0	0	117.8	V1554 L1558 S1559	V1554-E1556 PolarHBondContact O-N 2.59Å; E1556-L1558 VanDerWaalsContact C-N 3.31Å; E1556-L1558 PolarHBondContact O-N 3.16Å; E1556-S1559 VanDerWaalsContact O-CB 3.29Å; E1556-S1559 WeakPolarHBondContact O-CB 3.32Å; E1556-S1559 PolarHBondContact O-N 3.18Å; E1556-S1559 VanDerWaalsContact O-N 3.08Å; E1556-S1559 PolarHBondContact O-OG 3.14Å
1557	S	32.9	Very low	34.2	Very low	72.6 Å²	72.6	90.1 Å²	90.1	51%	0.508	52%	0.516	S	S	.	.	G	3₁₀ helix	trans	-71.8	-19.3	-171.3	64.3	0	0	0	0	115.5	V1554 S1555 S1559 L1619	V1554-S1557 WeakPolarHBondContact CG1-OG 3.25Å; S1555-S1557 VanDerWaalsContact C-N 3.31Å; S1555-S1557 PolarHBondContact O-N 3.06Å; S1555-S1557 VanDerWaalsContact O-N 3.11Å; S1555-S1557 PolarHBondContact O-OG 3.48Å; S1555-S1557 PolarHBondContact OG-N 2.98Å; S1555-S1557 PolarHBondContact OG-OG 2.93Å; S1557-S1559 VanDerWaalsContact C-N 3.26Å; S1557-S1559 PolarHBondContact O-N 3.19Å; S1557-S1559 VanDerWaalsContact O-N 3.15Å; S1557-L1619 WeakPolarHBondContact OG-CD1 3.46Å; S1557-L1619 WeakPolarHBondContact OG-CG 3.12Å
1558	L	36.3	Very low	35.5	Very low	74.8 Å²	74.8	90.4 Å²	90.4	39%	0.392	51%	0.513	S	S	.	.	G	3₁₀ helix	trans	-70	-9.2	178.8	-87.8	160.6	0	0	0	114.5	E1556 G1560 F1561 L1562 L1619 R1640	E1556-L1558 VanDerWaalsContact C-N 3.31Å; E1556-L1558 PolarHBondContact O-N 3.16Å; L1558-G1560 VanDerWaalsContact C-N 3.3Å; L1558-G1560 PolarHBondContact O-N 3.11Å; L1558-F1561 PolarHBondContact O-N 2.96Å; L1558-L1562 HydrophobicContact CB-CD1 4.34Å; L1558-L1562 HydrophobicContact CD2-CD1 3.96Å; L1558-L1562 HydrophobicContact CD2-CD2 3.92Å; L1558-L1562 HydrophobicContact CD2-CG 4.34Å; L1558-L1562 VanDerWaalsContact O-CD1 3.25Å; L1558-L1562 WeakPolarHBondContact O-CD1 3.45Å; L1558-L1562 VanDerWaalsContact O-CG 3.29Å; L1558-L1562 WeakPolarHBondContact O-CG 3.43Å; L1558-L1619 HydrophobicContact CD1-CD1 4.22Å; L1558-L1619 HydrophobicContact CD2-CD1 4.13Å; L1558-L1619 HydrophobicContact CG-CD1 4.17Å; L1558-R1640 VanDerWaalsContact CB-NH2 3.31Å; L1558-R1640 PolarHBondContact O-NH2 3.15Å
1559	S	33.4	Very low	36.9	Very low	86.4 Å²	86.4	86.2 Å²	86.2	60%	0.604	49%	0.492	S	S	*	.	G	3₁₀ helix	trans	-71.9	-21.4	-172.2	58.3	0	0	0	0	115	K1517 E1556 S1557 F1561	K1517-S1559 PolarHBondContact NZ-O 3.41Å; E1556-S1559 VanDerWaalsContact O-CB 3.29Å; E1556-S1559 WeakPolarHBondContact O-CB 3.32Å; E1556-S1559 PolarHBondContact O-N 3.18Å; E1556-S1559 VanDerWaalsContact O-N 3.08Å; E1556-S1559 PolarHBondContact O-OG 3.14Å; S1557-S1559 VanDerWaalsContact C-N 3.26Å; S1557-S1559 PolarHBondContact O-N 3.19Å; S1557-S1559 VanDerWaalsContact O-N 3.15Å; S1559-F1561 VanDerWaalsContact C-N 3.33Å; S1559-F1561 PolarHBondContact O-N 3.12Å
1560	G	33	Very low	38.4	Very low	60.6 Å²	60.6	84.6 Å²	84.6	63%	0.625	49%	0.488	S	S	*	.	G	3₁₀ helix	trans	-100.8	-10.6	-172.8	0	0	0	0	0	117.2	L1558	L1558-G1560 VanDerWaalsContact C-N 3.3Å; L1558-G1560 PolarHBondContact O-N 3.11Å
1561	F	34.3	Very low	40	Very low	132.2 Å²	132.2	84.7 Å²	84.7	58%	0.58	49%	0.492	S	S	*	.			trans	-119.8	3.2	-167.1	-112.6	-86	0	0	0	115.3	L1558 S1559 E1563 E1564 N1620	L1558-F1561 PolarHBondContact O-N 2.96Å; S1559-F1561 VanDerWaalsContact C-N 3.33Å; S1559-F1561 PolarHBondContact O-N 3.12Å; F1561-E1563 VanDerWaalsContact C-N 3.29Å; F1561-E1563 PolarHBondContact O-N 3.05Å; F1561-E1564 PolarHBondContact O-N 3.01Å; F1561-N1620 HydrophobicContact CD1-CB 4.44Å; F1561-N1620 VanDerWaalsContact CD1-ND2 3.32Å; F1561-N1620 WeakPolarHBondContact CD1-ND2 3.46Å; F1561-N1620 HydrophobicContact CD2-CB 3.83Å; F1561-N1620 HydrophobicContact CE1-CB 4.36Å; F1561-N1620 HydrophobicContact CE2-CB 3.98Å; F1561-N1620 WeakPolarHBondContact CZ-ND2 3.47Å
1562	L	36.7	Very low	42.1	Very low	82.2 Å²	82.2	84.3 Å²	84.3	43%	0.43	48%	0.479	S	S	.	.			trans	-96	16.4	-171.1	-83.1	170.4	0	0	0	115	L1558 E1564 R1639	L1558-L1562 HydrophobicContact CB-CD1 4.34Å; L1558-L1562 HydrophobicContact CD2-CD1 3.96Å; L1558-L1562 HydrophobicContact CD2-CD2 3.92Å; L1558-L1562 HydrophobicContact CD2-CG 4.34Å; L1558-L1562 VanDerWaalsContact O-CD1 3.25Å; L1558-L1562 WeakPolarHBondContact O-CD1 3.45Å; L1558-L1562 VanDerWaalsContact O-CG 3.29Å; L1558-L1562 WeakPolarHBondContact O-CG 3.43Å; L1562-E1564 VanDerWaalsContact C-N 3.28Å; L1562-R1639 PolarHBondContact O-NH2 3.05Å
1563	E	36.9	Very low	44	Very low	187 Å²	187	82.8 Å²	82.8	87%	0.874	47%	0.471	S	S	*	.	S	Bend	trans	-94.9	-17	177.7	-131.3	167.1	-164.9	0	0	113.5	F1561	F1561-E1563 VanDerWaalsContact C-N 3.29Å; F1561-E1563 PolarHBondContact O-N 3.05Å
1564	E	34	Very low	45.7	Very low	158.2 Å²	158.2	84.7 Å²	84.7	74%	0.739	48%	0.481	S	S	*	.	S	Bend	trans	-117.1	31.4	-171.3	-150.3	170.8	-149.1	0	0	114	R1244 F1561 L1562	R1244-E1564 IonicContact CZ-OE2 2.72Å; R1244-E1564 IonicContact NH1-OE2 2.76Å; R1244-E1564 IonicContact NH2-OE2 2.96Å; R1244-E1564 PolarHBondContact NH2-OE2 3Å; F1561-E1564 PolarHBondContact O-N 3.01Å; L1562-E1564 VanDerWaalsContact C-N 3.28Å
1565	S	33.2	Very low	47.7	Very low	66.8 Å²	66.8	88.4 Å²	88.4	47%	0.467	49%	0.486	S	S	.	.	S	Bend	trans	-126.3	109.5	174.5	49.1	0	0	0	0	111.4	T1567 K1631	S1565-T1567 PolarHBondContact O-N 3.13Å; S1565-T1567 PolarHBondContact OG-O 2.9Å; S1565-K1631 PolarHBondContact OG-NZ 2.98Å
1566	A	38.5	Very low	49.9	Very low	94.4 Å²	94.4	85 Å²	85	78%	0.78	46%	0.462	S	S	*	.			trans	-60.1	131	171.8	0	0	0	0	0	110.9	L1568	A1566-L1568 PolarHBondContact O-N 3.24Å
1567	T	50.2	Low	52.1	Low	58.8 Å²	58.8	80.6 Å²	80.6	36%	0.361	44%	0.442	S	S	.	.			trans	-57.1	111.9	175.8	42.4	0	0	0	0	112.1	S1565 Y1569 S1570 E1635 R1639 R1640	S1565-T1567 PolarHBondContact O-N 3.13Å; S1565-T1567 PolarHBondContact OG-O 2.9Å; T1567-Y1569 VanDerWaalsContact C-N 3.33Å; T1567-Y1569 PolarHBondContact O-N 3.27Å; T1567-Y1569 PolarHBondContact OG1-O 3.08Å; T1567-Y1569 VanDerWaalsContact OG1-O 3.13Å; T1567-S1570 VanDerWaalsContact CB-CB 3.47Å; T1567-S1570 VanDerWaalsContact CB-OG 3.25Å; T1567-S1570 WeakPolarHBondContact CB-OG 3.45Å; T1567-S1570 WeakPolarHBondContact O-CB 3.37Å; T1567-S1570 PolarHBondContact O-N 3.02Å; T1567-S1570 PolarHBondContact O-OG 3.12Å; T1567-S1570 VanDerWaalsContact OG1-CB 3.25Å; T1567-S1570 WeakPolarHBondContact OG1-CB 3.3Å; T1567-S1570 PolarHBondContact OG1-OG 2.95Å; T1567-E1635 WeakPolarHBondContact CA-OE1 3.33Å; T1567-E1635 HydrophobicContact CG2-CG 4.29Å; T1567-E1635 WeakPolarHBondContact CG2-OE1 3.45Å; T1567-R1639 VanDerWaalsContact CG2-NH1 3.33Å; T1567-R1640 VanDerWaalsContact CB-NH2 3.28Å
1568	L	54.6	Low	54	Low	102 Å²	102	79.3 Å²	79.3	53%	0.534	43%	0.433	S	S	.	.	S	Bend	trans	-67.3	-32.4	-175.5	-70.4	171.8	0	0	0	112.5	A1566 M1628 K1631 E1635 V1641	A1566-L1568 PolarHBondContact O-N 3.24Å; L1568-M1628 HydrophobicContact CD1-CE 4.01Å; L1568-M1628 HydrophobicContact CD1-SD 4.23Å; L1568-K1631 HydrophobicContact CD1-CD 4.21Å; L1568-E1635 PolarHBondContact N-OE1 2.8Å; L1568-E1635 PolarHBondContact N-OE2 3.38Å; L1568-E1635 VanDerWaalsContact N-OE2 3.12Å; L1568-V1641 HydrophobicContact CD1-CG1 4.2Å; L1568-V1641 HydrophobicContact CD2-CG1 3.93Å
1569	Y	61	Low	56.1	Low	25 Å²	25	76.5 Å²	76.5	10%	0.098	42%	0.418	C	S	.	.	S	Bend	trans	-115.9	19.3	-176.2	-52.7	-75.5	0	0	0	112.8	T1567 L1571 E1572 L1573 I1593 L1597 R1632 E1635 S1642 W1644 H1647	T1567-Y1569 VanDerWaalsContact C-N 3.33Å; T1567-Y1569 PolarHBondContact O-N 3.27Å; T1567-Y1569 PolarHBondContact OG1-O 3.08Å; T1567-Y1569 VanDerWaalsContact OG1-O 3.13Å; Y1569-L1571 VanDerWaalsContact C-N 3.32Å; Y1569-L1571 PolarHBondContact O-N 3Å; Y1569-E1572 VanDerWaalsContact CD1-OE2 3.3Å; Y1569-E1572 WeakPolarHBondContact CD1-OE2 3.36Å; Y1569-E1572 WeakPolarHBondContact O-CB 3.29Å; Y1569-E1572 PolarHBondContact O-N 3.18Å; Y1569-E1572 VanDerWaalsContact O-N 3.14Å; Y1569-L1573 WeakPolarHBondContact O-CG 3.3Å; Y1569-L1573 PolarHBondContact O-N 3Å; Y1569-I1593 HydrophobicContact CE1-CG2 4.48Å; Y1569-L1597 HydrophobicContact CE1-CD1 3.98Å; Y1569-L1597 WeakPolarHBondContact OH-CD1 3.27Å; Y1569-L1597 WeakPolarHBondContact OH-CD2 3.41Å; Y1569-R1632 HydrophobicContact CD2-CB 4.17Å; Y1569-R1632 HydrophobicContact CD2-CG 4.41Å; Y1569-R1632 HydrophobicContact CE2-CB 3.9Å; Y1569-R1632 HydrophobicContact CE2-CG 4.42Å; Y1569-E1635 PolarHBondContact N-OE2 3.22Å; Y1569-E1635 VanDerWaalsContact N-OE2 3.07Å; Y1569-S1642 PolarHBondContact OH-O 2.76Å; Y1569-W1644 HydrophobicContact CD1-CB 3.92Å; Y1569-W1644 HydrophobicContact CD1-CG 4.37Å; Y1569-W1644 HydrophobicContact CE1-CB 3.75Å; Y1569-W1644 HydrophobicContact CE1-CG 4.47Å; Y1569-H1647 HydrophobicContact CE2-CB 4.46Å; Y1569-H1647 AromaticContact CE2-CD2 3.98Å; Y1569-H1647 WeakPolarHBondContact OH-CB 3.27Å
1570	S	63.6	Low	58.3	Low	26.6 Å²	26.6	72.5 Å²	72.5	19%	0.186	39%	0.39	C	S	.	.	H	α-helix	trans	-63.3	-42.6	177.4	64.2	0	0	0	0	112.6	T1567 E1572 L1573 E1574 E1635	T1567-S1570 VanDerWaalsContact CB-CB 3.47Å; T1567-S1570 VanDerWaalsContact CB-OG 3.25Å; T1567-S1570 WeakPolarHBondContact CB-OG 3.45Å; T1567-S1570 WeakPolarHBondContact O-CB 3.37Å; T1567-S1570 PolarHBondContact O-N 3.02Å; T1567-S1570 PolarHBondContact O-OG 3.12Å; T1567-S1570 VanDerWaalsContact OG1-CB 3.25Å; T1567-S1570 WeakPolarHBondContact OG1-CB 3.3Å; T1567-S1570 PolarHBondContact OG1-OG 2.95Å; S1570-E1572 VanDerWaalsContact C-N 3.28Å; S1570-E1572 PolarHBondContact O-N 3.14Å; S1570-L1573 CarbonylContact O-C 3.45Å; S1570-L1573 PolarHBondContact O-N 3.28Å; S1570-L1573 VanDerWaalsContact O-N 3.11Å; S1570-L1573 WeakPolarHBondContact OG-CG 3.48Å; S1570-L1573 PolarHBondContact OG-N 3.46Å; S1570-E1574 VanDerWaalsContact O-CB 3.26Å; S1570-E1574 WeakPolarHBondContact O-CB 3.28Å; S1570-E1574 VanDerWaalsContact O-CG 3.28Å; S1570-E1574 WeakPolarHBondContact O-CG 3.32Å; S1570-E1574 PolarHBondContact O-N 3.16Å; S1570-E1574 PolarHBondContact OG-OE1 3.26Å; S1570-E1635 PolarHBondContact N-OE2 3.18Å
1571	L	65.7	Low	60.6	Low	108.2 Å²	108.2	72.6 Å²	72.6	57%	0.566	37%	0.372	S	S	*	.	H	α-helix	trans	-65.8	-26.4	179.7	-154.7	99.1	0	0	0	112.4	Y1569 R1575	Y1569-L1571 VanDerWaalsContact C-N 3.32Å; Y1569-L1571 PolarHBondContact O-N 3Å; L1571-R1575 WeakPolarHBondContact O-CB 3.27Å; L1571-R1575 VanDerWaalsContact O-CD 3.27Å; L1571-R1575 WeakPolarHBondContact O-CD 3.34Å; L1571-R1575 VanDerWaalsContact O-CG 3.26Å; L1571-R1575 WeakPolarHBondContact O-CG 3.41Å; L1571-R1575 PolarHBondContact O-N 3.12Å
1572	E	75.5	Confident	63.2	Low	30.6 Å²	30.6	68.3 Å²	68.3	14%	0.143	35%	0.353	C	S	.	.	H	α-helix	trans	-69	-55	168.9	177	-158.7	152	0	0	110.3	Y1569 S1570 E1574 R1575 L1576 I1593 R1632	Y1569-E1572 VanDerWaalsContact CD1-OE2 3.3Å; Y1569-E1572 WeakPolarHBondContact CD1-OE2 3.36Å; Y1569-E1572 WeakPolarHBondContact O-CB 3.29Å; Y1569-E1572 PolarHBondContact O-N 3.18Å; Y1569-E1572 VanDerWaalsContact O-N 3.14Å; S1570-E1572 VanDerWaalsContact C-N 3.28Å; S1570-E1572 PolarHBondContact O-N 3.14Å; E1572-E1574 VanDerWaalsContact C-N 3.29Å; E1572-E1574 PolarHBondContact O-N 3.27Å; E1572-R1575 CarbonylContact O-C 3.55Å; E1572-R1575 WeakPolarHBondContact O-CA 3.37Å; E1572-R1575 WeakPolarHBondContact O-CB 3.34Å; E1572-R1575 PolarHBondContact O-N 3.25Å; E1572-R1575 VanDerWaalsContact O-N 3.15Å; E1572-L1576 HydrophobicContact CG-CD1 4.09Å; E1572-L1576 WeakPolarHBondContact O-CG 3.21Å; E1572-L1576 PolarHBondContact O-N 2.86Å; E1572-L1576 WeakPolarHBondContact OE1-CD1 3.22Å; E1572-I1593 HydrophobicContact CB-CD1 4.39Å; E1572-I1593 VanDerWaalsContact CD-CD1 3.46Å; E1572-I1593 HydrophobicContact CG-CD1 3.69Å; E1572-I1593 WeakPolarHBondContact OE1-CD1 3.41Å; E1572-I1593 WeakPolarHBondContact OE2-CD1 3.3Å; E1572-R1632 VanDerWaalsContact CD-NH1 3.26Å; E1572-R1632 IonicContact OE1-CZ 2.96Å; E1572-R1632 VanDerWaalsContact OE1-CZ 3.27Å; E1572-R1632 IonicContact OE1-NH1 3.09Å; E1572-R1632 PolarHBondContact OE1-NH1 2.98Å; E1572-R1632 IonicContact OE1-NH2 3.33Å; E1572-R1632 PolarHBondContact OE1-NH2 3.14Å; E1572-R1632 IonicContact OE2-CZ 2.73Å; E1572-R1632 IonicContact OE2-NH1 3.01Å; E1572-R1632 PolarHBondContact OE2-NH1 3.08Å; E1572-R1632 IonicContact OE2-NH2 2.76Å
1573	L	73.8	Confident	65.7	Low	7.2 Å²	7.2	64.4 Å²	64.4	4%	0.038	33%	0.333	C	S	.	.	H	α-helix	trans	-63.5	-31.1	-178.1	-65.9	173.8	0	0	0	113	Y1569 S1570 R1575 L1576 Q1577 L1590 E1635 V1636 R1640 W1644	Y1569-L1573 WeakPolarHBondContact O-CG 3.3Å; Y1569-L1573 PolarHBondContact O-N 3Å; S1570-L1573 CarbonylContact O-C 3.45Å; S1570-L1573 PolarHBondContact O-N 3.28Å; S1570-L1573 VanDerWaalsContact O-N 3.11Å; S1570-L1573 WeakPolarHBondContact OG-CG 3.48Å; S1570-L1573 PolarHBondContact OG-N 3.46Å; L1573-R1575 VanDerWaalsContact C-N 3.32Å; L1573-R1575 PolarHBondContact O-N 3.22Å; L1573-L1576 HydrophobicContact CD2-CD1 4.39Å; L1573-L1576 PolarHBondContact O-N 3.18Å; L1573-Q1577 WeakPolarHBondContact O-CB 3.21Å; L1573-Q1577 WeakPolarHBondContact O-CG 2.86Å; L1573-Q1577 PolarHBondContact O-N 3.14Å; L1573-Q1577 VanDerWaalsContact O-N 3.16Å; L1573-L1590 HydrophobicContact CD2-CD1 4.43Å; L1573-L1590 HydrophobicContact CD2-CD2 4.35Å; L1573-E1635 HydrophobicContact CD1-CB 4.3Å; L1573-V1636 HydrophobicContact CD1-CG2 4.2Å; L1573-V1636 HydrophobicContact CD2-CG2 4.12Å; L1573-R1640 HydrophobicContact CD1-CB 3.93Å; L1573-R1640 HydrophobicContact CD1-CG 3.93Å; L1573-W1644 HydrophobicContact CB-CD2 4.44Å; L1573-W1644 HydrophobicContact CB-CG 4.4Å; L1573-W1644 HydrophobicContact CB-CZ2 4.36Å; L1573-W1644 HydrophobicContact CD1-CG 4.45Å; L1573-W1644 HydrophobicContact CD2-CD2 3.98Å; L1573-W1644 HydrophobicContact CD2-CE3 4.06Å; L1573-W1644 HydrophobicContact CD2-CH2 4.03Å; L1573-W1644 HydrophobicContact CD2-CZ2 3.91Å; L1573-W1644 HydrophobicContact CD2-CZ3 4.11Å; L1573-W1644 WeakPolarHBondContact O-CZ2 3.29Å; L1573-W1644 PolarHBondContact O-NE1 3.28Å
1574	E	71.9	Confident	68.3	Low	106 Å²	106	56.2 Å²	56.2	50%	0.495	30%	0.295	S	S	.	.	H	α-helix	trans	-70.3	-36.9	172.2	-73.7	172.7	-162.5	0	0	112.1	S1570 E1572 L1576 Q1577	S1570-E1574 VanDerWaalsContact O-CB 3.26Å; S1570-E1574 WeakPolarHBondContact O-CB 3.28Å; S1570-E1574 VanDerWaalsContact O-CG 3.28Å; S1570-E1574 WeakPolarHBondContact O-CG 3.32Å; S1570-E1574 PolarHBondContact O-N 3.16Å; S1570-E1574 PolarHBondContact OG-OE1 3.26Å; E1572-E1574 VanDerWaalsContact C-N 3.29Å; E1572-E1574 PolarHBondContact O-N 3.27Å; E1574-L1576 VanDerWaalsContact C-N 3.3Å; E1574-L1576 PolarHBondContact O-N 2.88Å; E1574-Q1577 WeakPolarHBondContact O-CB 3.35Å; E1574-Q1577 WeakPolarHBondContact O-CG 3.4Å; E1574-Q1577 PolarHBondContact O-N 3.28Å
1575	R	75.2	Confident	71	Confident	158.4 Å²	158.4	50.3 Å²	50.3	60%	0.598	27%	0.267	S	S	*	.	H	α-helix	trans	-70.3	-38.6	173.4	-73.6	168.5	164.8	-178.1	-0.2	112	L1571 E1572 L1573 Q1577 S1578 V1579 T2034	L1571-R1575 WeakPolarHBondContact O-CB 3.27Å; L1571-R1575 VanDerWaalsContact O-CD 3.27Å; L1571-R1575 WeakPolarHBondContact O-CD 3.34Å; L1571-R1575 VanDerWaalsContact O-CG 3.26Å; L1571-R1575 WeakPolarHBondContact O-CG 3.41Å; L1571-R1575 PolarHBondContact O-N 3.12Å; E1572-R1575 CarbonylContact O-C 3.55Å; E1572-R1575 WeakPolarHBondContact O-CA 3.37Å; E1572-R1575 WeakPolarHBondContact O-CB 3.34Å; E1572-R1575 PolarHBondContact O-N 3.25Å; E1572-R1575 VanDerWaalsContact O-N 3.15Å; L1573-R1575 VanDerWaalsContact C-N 3.32Å; L1573-R1575 PolarHBondContact O-N 3.22Å; R1575-Q1577 VanDerWaalsContact C-N 3.31Å; R1575-Q1577 PolarHBondContact O-N 2.92Å; R1575-Q1577 VanDerWaalsContact O-N 3.16Å; R1575-S1578 PolarHBondContact O-N 3.17Å; R1575-S1578 PolarHBondContact O-OG 3.26Å; R1575-V1579 WeakPolarHBondContact O-CG2 3.33Å; R1575-V1579 PolarHBondContact O-N 2.88Å; R1575-T2034 PolarHBondContact O-OG1 3.19Å; R1575-T2034 VanDerWaalsContact O-OG1 3.07Å
1576	L	76.3	Confident	73.7	Confident	1 Å²	1	47.1 Å²	47.1	1%	0.005	25%	0.245	C	C	.	.	H	α-helix	trans	-66.8	-30	175.8	-68.8	173.6	0	0	0	112.1	E1572 L1573 E1574 S1578 V1579 F1580 V1586 Q1589 L1590 W1644	E1572-L1576 HydrophobicContact CG-CD1 4.09Å; E1572-L1576 WeakPolarHBondContact O-CG 3.21Å; E1572-L1576 PolarHBondContact O-N 2.86Å; E1572-L1576 WeakPolarHBondContact OE1-CD1 3.22Å; L1573-L1576 HydrophobicContact CD2-CD1 4.39Å; L1573-L1576 PolarHBondContact O-N 3.18Å; E1574-L1576 VanDerWaalsContact C-N 3.3Å; E1574-L1576 PolarHBondContact O-N 2.88Å; L1576-S1578 VanDerWaalsContact C-N 3.28Å; L1576-S1578 PolarHBondContact O-N 3.26Å; L1576-S1578 VanDerWaalsContact O-N 3.14Å; L1576-V1579 CarbonylContact O-C 3.5Å; L1576-V1579 WeakPolarHBondContact O-CA 3.4Å; L1576-V1579 PolarHBondContact O-N 2.99Å; L1576-V1579 VanDerWaalsContact O-N 3.15Å; L1576-F1580 HydrophobicContact CB-CE2 4.49Å; L1576-F1580 WeakPolarHBondContact O-CD2 3.34Å; L1576-F1580 PolarHBondContact O-N 3.06Å; L1576-F1580 VanDerWaalsContact O-N 3.12Å; L1576-V1586 HydrophobicContact CD1-CG1 4.39Å; L1576-V1586 HydrophobicContact CD2-CB 4.5Å; L1576-V1586 HydrophobicContact CD2-CG1 4.38Å; L1576-V1586 HydrophobicContact CD2-CG2 4.33Å; L1576-Q1589 HydrophobicContact CD2-CB 3.81Å; L1576-Q1589 HydrophobicContact CD2-CG 4.45Å; L1576-Q1589 VanDerWaalsContact CD2-OE1 3.32Å; L1576-L1590 HydrophobicContact CD1-CD2 3.58Å; L1576-L1590 HydrophobicContact CD1-CG 3.94Å; L1576-W1644 HydrophobicContact CB-CH2 4.17Å; L1576-W1644 HydrophobicContact CB-CZ2 3.86Å; L1576-W1644 HydrophobicContact CD1-CH2 4.39Å
1577	Q	76.6	Confident	76.2	Confident	53.8 Å²	53.8	42.6 Å²	42.6	25%	0.251	21%	0.208	S	C	.	.	H	α-helix	trans	-57.7	-33.5	176.9	-166	172.5	-7.5	0	0	113.3	L1573 E1574 R1575 V1579 W1644 L1648	L1573-Q1577 WeakPolarHBondContact O-CB 3.21Å; L1573-Q1577 WeakPolarHBondContact O-CG 2.86Å; L1573-Q1577 PolarHBondContact O-N 3.14Å; L1573-Q1577 VanDerWaalsContact O-N 3.16Å; E1574-Q1577 WeakPolarHBondContact O-CB 3.35Å; E1574-Q1577 WeakPolarHBondContact O-CG 3.4Å; E1574-Q1577 PolarHBondContact O-N 3.28Å; R1575-Q1577 VanDerWaalsContact C-N 3.31Å; R1575-Q1577 PolarHBondContact O-N 2.92Å; R1575-Q1577 VanDerWaalsContact O-N 3.16Å; Q1577-V1579 VanDerWaalsContact C-N 3.34Å; Q1577-W1644 HydrophobicContact CB-CZ2 3.75Å; Q1577-W1644 HydrophobicContact CG-CZ2 3.94Å; Q1577-L1648 HydrophobicContact CB-CD2 3.7Å; Q1577-L1648 HydrophobicContact CG-CD1 4.4Å; Q1577-L1648 HydrophobicContact CG-CD2 3.55Å; Q1577-L1648 VanDerWaalsContact CG-CD2 3.46Å; Q1577-L1648 HydrophobicContact CG-CG 4.12Å
1578	S	73.7	Confident	78.2	Confident	45.8 Å²	45.8	41.5 Å²	41.5	32%	0.32	20%	0.198	S	C	.	.	H	α-helix	trans	-79.4	-21.6	177.8	54.3	0	0	0	0	113.8	R1575 L1576 D2032 T2034	R1575-S1578 PolarHBondContact O-N 3.17Å; R1575-S1578 PolarHBondContact O-OG 3.26Å; L1576-S1578 VanDerWaalsContact C-N 3.28Å; L1576-S1578 PolarHBondContact O-N 3.26Å; L1576-S1578 VanDerWaalsContact O-N 3.14Å; S1578-D2032 WeakPolarHBondContact CB-OD2 3.29Å; S1578-T2034 WeakPolarHBondContact OG-CG2 3.18Å; S1578-T2034 PolarHBondContact OG-OG1 3Å
1579	V	80.4	Confident	79.8	Confident	14.8 Å²	14.8	39.2 Å²	39.2	9%	0.09	19%	0.185	C	C	.	.	H	α-helix	trans	-96.2	-6	-175.9	-172	0	0	0	0	112.2	R1575 L1576 Q1577 Y1581 F1582 E1585 V1586 T2034 V2035 P2059	R1575-V1579 WeakPolarHBondContact O-CG2 3.33Å; R1575-V1579 PolarHBondContact O-N 2.88Å; L1576-V1579 CarbonylContact O-C 3.5Å; L1576-V1579 WeakPolarHBondContact O-CA 3.4Å; L1576-V1579 PolarHBondContact O-N 2.99Å; L1576-V1579 VanDerWaalsContact O-N 3.15Å; Q1577-V1579 VanDerWaalsContact C-N 3.34Å; V1579-Y1581 PolarHBondContact O-N 3.03Å; V1579-F1582 HydrophobicContact CG1-CB 4.37Å; V1579-F1582 HydrophobicContact CG1-CD2 4.44Å; V1579-F1582 PolarHBondContact O-N 3.08Å; V1579-E1585 HydrophobicContact CG1-CB 4.1Å; V1579-E1585 HydrophobicContact CG1-CG 3.74Å; V1579-V1586 HydrophobicContact CB-CG2 4.31Å; V1579-V1586 HydrophobicContact CG1-CG2 4.26Å; V1579-T2034 VanDerWaalsContact CG2-OG1 3.27Å; V1579-T2034 WeakPolarHBondContact CG2-OG1 3.46Å; V1579-V2035 HydrophobicContact CG2-CB 4.07Å; V1579-V2035 HydrophobicContact CG2-CG2 3.69Å; V1579-P2059 HydrophobicContact CG1-CG 4.32Å
1580	F	79.8	Confident	81.1	Confident	3.6 Å²	3.6	38.2 Å²	38.2	2%	0.016	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-13.6	-171.2	-127.4	-80.4	0	0	0	116.6	L1576 F1582 V1586 W1644 L1648 M1661 F1664 I1665 A1668	L1576-F1580 HydrophobicContact CB-CE2 4.49Å; L1576-F1580 WeakPolarHBondContact O-CD2 3.34Å; L1576-F1580 PolarHBondContact O-N 3.06Å; L1576-F1580 VanDerWaalsContact O-N 3.12Å; F1580-F1582 PolarHBondContact O-N 3.12Å; F1580-V1586 HydrophobicContact CB-CG2 4.49Å; F1580-V1586 HydrophobicContact CD1-CG2 4.41Å; F1580-V1586 HydrophobicContact CD2-CG1 4.15Å; F1580-V1586 HydrophobicContact CD2-CG2 4.06Å; F1580-V1586 HydrophobicContact CE1-CG1 4.02Å; F1580-V1586 HydrophobicContact CE2-CB 4.45Å; F1580-V1586 HydrophobicContact CE2-CG1 3.8Å; F1580-V1586 HydrophobicContact CE2-CG2 4.33Å; F1580-V1586 HydrophobicContact CG-CG2 4.35Å; F1580-V1586 HydrophobicContact CZ-CG1 4.15Å; F1580-W1644 AromaticContact CD2-CH2 3.87Å; F1580-W1644 HydrophobicContact CD2-CH2 4.08Å; F1580-W1644 HydrophobicContact CD2-CZ2 4.37Å; F1580-W1644 AromaticContact CE2-CH2 3.51Å; F1580-W1644 HydrophobicContact CE2-CH2 3.51Å; F1580-W1644 AromaticContact CE2-CZ2 3.36Å; F1580-W1644 HydrophobicContact CE2-CZ2 4.03Å; F1580-W1644 AromaticContact CE2-CZ3 3.76Å; F1580-W1644 HydrophobicContact CE2-CZ3 4.05Å; F1580-W1644 AromaticContact CZ-CH2 3.23Å; F1580-W1644 HydrophobicContact CZ-CH2 3.77Å; F1580-W1644 AromaticContact CZ-CZ2 3.77Å; F1580-W1644 HydrophobicContact CZ-CZ2 3.77Å; F1580-W1644 AromaticContact CZ-CZ3 3.7Å; F1580-W1644 HydrophobicContact CZ-CZ3 3.98Å; F1580-L1648 HydrophobicContact CD2-CD1 3.9Å; F1580-L1648 HydrophobicContact CD2-CD2 4.05Å; F1580-L1648 HydrophobicContact CE1-CD1 4.01Å; F1580-L1648 HydrophobicContact CE2-CD1 3.4Å; F1580-L1648 VanDerWaalsContact CE2-CD1 3.43Å; F1580-L1648 HydrophobicContact CE2-CD2 4.09Å; F1580-L1648 HydrophobicContact CE2-CG 4.36Å; F1580-L1648 HydrophobicContact CG-CD1 4.35Å; F1580-L1648 HydrophobicContact CZ-CD1 3.8Å; F1580-M1661 HydrophobicContact CB-CE 4.19Å; F1580-M1661 HydrophobicContact CB-SD 4.15Å; F1580-M1661 HydrophobicContact CD1-CE 4.46Å; F1580-M1661 HydrophobicContact CD1-SD 3.87Å; F1580-M1661 VanDerWaalsContact CD1-SD 3.59Å; F1580-M1661 HydrophobicContact CE1-SD 4.29Å; F1580-M1661 HydrophobicContact CG-CE 4.48Å; F1580-M1661 HydrophobicContact CG-SD 4.12Å; F1580-F1664 HydrophobicContact CD1-CB 4.11Å; F1580-F1664 HydrophobicContact CE1-CB 4.12Å; F1580-F1664 WeakPolarHBondContact O-CB 3.4Å; F1580-F1664 WeakPolarHBondContact O-CG 3.4Å; F1580-I1665 HydrophobicContact CD1-CG1 4.17Å; F1580-I1665 HydrophobicContact CE1-CB 4.19Å; F1580-I1665 HydrophobicContact CE1-CG1 3.52Å; F1580-I1665 VanDerWaalsContact CE1-CG1 3.41Å; F1580-I1665 HydrophobicContact CZ-CB 4.4Å; F1580-I1665 HydrophobicContact CZ-CG1 3.85Å; F1580-A1668 HydrophobicContact CE1-CB 4.37Å; F1580-A1668 HydrophobicContact CZ-CB 4.16Å
1581	Y	81.8	Confident	82.4	Confident	62.8 Å²	62.8	37.5 Å²	37.5	25%	0.246	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-20	168.5	-57.8	-71.3	0	0	0	113	V1579 P1583 Q1652 M1661 F1664 F1904 W1926 L1927	V1579-Y1581 PolarHBondContact O-N 3.03Å; Y1581-P1583 VanDerWaalsContact C-CD 3.47Å; Y1581-P1583 WeakPolarHBondContact O-CD 3.39Å; Y1581-Q1652 PolarHBondContact OH-OE1 3.45Å; Y1581-M1661 HydrophobicContact CE1-CE 4.35Å; Y1581-F1664 HydrophobicContact CD1-CD2 4.39Å; Y1581-F1664 AromaticContact CD1-CE2 3.78Å; Y1581-F1664 HydrophobicContact CD1-CE2 3.78Å; Y1581-F1664 HydrophobicContact CD1-CZ 4.21Å; Y1581-F1664 HydrophobicContact CE1-CE2 4.34Å; Y1581-F1664 WeakPolarHBondContact O-CE1 3.22Å; Y1581-F1904 VanDerWaalsContact O-CZ 3.23Å; Y1581-F1904 WeakPolarHBondContact O-CZ 3.42Å; Y1581-W1926 HydrophobicContact CD1-CH2 4.39Å; Y1581-W1926 HydrophobicContact CD1-CZ2 4.35Å; Y1581-W1926 AromaticContact CE1-CH2 3.6Å; Y1581-W1926 HydrophobicContact CE1-CH2 3.76Å; Y1581-W1926 AromaticContact CE1-CZ2 3.84Å; Y1581-W1926 HydrophobicContact CE1-CZ2 3.84Å; Y1581-W1926 AromaticContact CE1-CZ3 3.68Å; Y1581-W1926 HydrophobicContact CE1-CZ3 3.68Å; Y1581-L1927 HydrophobicContact CD1-CD2 3.69Å; Y1581-L1927 HydrophobicContact CE1-CD2 3.84Å; Y1581-L1927 HydrophobicContact CG-CD2 4.25Å
1582	F	88.7	Confident	83.5	Confident	40.4 Å²	40.4	34.6 Å²	34.6	18%	0.177	17%	0.168	C	C	.	.	S	Bend	trans	-109.6	81.6	172.4	-60.3	-84.1	0	0	0	109.6	V1579 F1580 E1584 E1585 V1586 S1891 I1893 F1904 Y2026 C2030 P2059	V1579-F1582 HydrophobicContact CG1-CB 4.37Å; V1579-F1582 HydrophobicContact CG1-CD2 4.44Å; V1579-F1582 PolarHBondContact O-N 3.08Å; F1580-F1582 PolarHBondContact O-N 3.12Å; F1582-E1584 PolarHBondContact O-N 3.04Å; F1582-E1585 HydrophobicContact CB-CB 3.91Å; F1582-E1585 WeakPolarHBondContact O-CB 3.34Å; F1582-E1585 PolarHBondContact O-N 3.19Å; F1582-E1585 VanDerWaalsContact O-N 3.13Å; F1582-V1586 PolarHBondContact O-N 3.28Å; F1582-V1586 VanDerWaalsContact O-N 3.14Å; F1582-S1891 VanDerWaalsContact CD1-O 3.27Å; F1582-S1891 WeakPolarHBondContact CD1-O 3.33Å; F1582-I1893 HydrophobicContact CZ-CD1 4.06Å; F1582-I1893 HydrophobicContact CZ-CG1 4.18Å; F1582-F1904 HydrophobicContact CD1-CE2 4.11Å; F1582-F1904 HydrophobicContact CD1-CZ 4.18Å; F1582-F1904 HydrophobicContact CE1-CD2 4.49Å; F1582-F1904 AromaticContact CE1-CE2 3.59Å; F1582-F1904 HydrophobicContact CE1-CE2 3.59Å; F1582-F1904 HydrophobicContact CE1-CZ 4.08Å; F1582-F1904 HydrophobicContact CE2-CE2 4.29Å; F1582-F1904 HydrophobicContact CZ-CD2 4.42Å; F1582-F1904 AromaticContact CZ-CE2 3.7Å; F1582-F1904 HydrophobicContact CZ-CE2 3.7Å; F1582-Y2026 HydrophobicContact CD2-CE2 4.45Å; F1582-Y2026 HydrophobicContact CE2-CD2 4.47Å; F1582-Y2026 AromaticContact CE2-CE2 3.44Å; F1582-Y2026 HydrophobicContact CE2-CE2 3.44Å; F1582-Y2026 VanDerWaalsContact CE2-CE2 3.44Å; F1582-Y2026 AromaticContact CE2-CZ 3.74Å; F1582-Y2026 WeakPolarHBondContact CE2-OH 3.23Å; F1582-Y2026 HydrophobicContact CZ-CD2 4.41Å; F1582-Y2026 AromaticContact CZ-CE2 3.68Å; F1582-Y2026 HydrophobicContact CZ-CE2 3.68Å; F1582-C2030 VanDerWaalsContact CE2-SG 3.53Å; F1582-P2059 HydrophobicContact CB-CG 3.9Å; F1582-P2059 VanDerWaalsContact CD1-CD 3.49Å; F1582-P2059 HydrophobicContact CD1-CG 3.87Å; F1582-P2059 HydrophobicContact CD2-CG 3.5Å; F1582-P2059 VanDerWaalsContact CD2-CG 3.5Å; F1582-P2059 HydrophobicContact CE1-CG 4.25Å; F1582-P2059 HydrophobicContact CE2-CG 3.9Å; F1582-P2059 HydrophobicContact CG-CG 3.48Å; F1582-P2059 VanDerWaalsContact CG-CG 3.45Å; F1582-P2059 HydrophobicContact CZ-CG 4.26Å
1583	P	88.4	Confident	84.1	Confident	0.8 Å²	0.8	35.9 Å²	35.9	1%	0.005	18%	0.175	C	C	.	.	H	α-helix	trans	-64.7	-25.6	-174.2	24.9	-33.9	0	0	0	113.5	Y1581 V1586 A1587 F1664 R1667 A1668	Y1581-P1583 VanDerWaalsContact C-CD 3.47Å; Y1581-P1583 WeakPolarHBondContact O-CD 3.39Å; P1583-V1586 PolarHBondContact O-N 3.3Å; P1583-A1587 WeakPolarHBondContact O-CB 3.21Å; P1583-A1587 PolarHBondContact O-N 3.35Å; P1583-A1587 VanDerWaalsContact O-N 3.1Å; P1583-F1664 HydrophobicContact CB-CB 4.3Å; P1583-F1664 VanDerWaalsContact CB-O 3.27Å; P1583-F1664 WeakPolarHBondContact CB-O 3.28Å; P1583-F1664 HydrophobicContact CG-CB 4.45Å; P1583-F1664 HydrophobicContact CG-CD1 4.21Å; P1583-R1667 HydrophobicContact CB-CB 4.2Å; P1583-R1667 HydrophobicContact CB-CG 4.16Å; P1583-R1667 HydrophobicContact CG-CB 4.09Å; P1583-R1667 HydrophobicContact CG-CG 3.72Å; P1583-A1668 HydrophobicContact CB-CB 3.96Å
1584	E	92	Very high	84.7	Confident	15.4 Å²	15.4	35.6 Å²	35.6	7%	0.072	17%	0.173	C	C	.	.	H	α-helix	trans	-65.8	-45.3	172.6	-64.3	75.8	-154.5	0	0	111.9	F1582 V1586 A1587 F1588 R1667 T1671 G1889 C1890 S1891	F1582-E1584 PolarHBondContact O-N 3.04Å; E1584-V1586 VanDerWaalsContact C-N 3.33Å; E1584-V1586 PolarHBondContact O-N 3.1Å; E1584-A1587 WeakPolarHBondContact O-CB 3.37Å; E1584-A1587 PolarHBondContact O-N 3.1Å; E1584-A1587 VanDerWaalsContact O-N 3.14Å; E1584-F1588 HydrophobicContact CB-CE1 4.28Å; E1584-F1588 HydrophobicContact CB-CE2 4.04Å; E1584-F1588 HydrophobicContact CB-CZ 4.06Å; E1584-F1588 WeakPolarHBondContact O-CB 3.17Å; E1584-F1588 WeakPolarHBondContact O-CD1 3.25Å; E1584-F1588 VanDerWaalsContact O-CD2 3.29Å; E1584-F1588 WeakPolarHBondContact O-CD2 3.31Å; E1584-F1588 VanDerWaalsContact O-CG 3.25Å; E1584-F1588 WeakPolarHBondContact O-CG 3.21Å; E1584-F1588 PolarHBondContact O-N 3.21Å; E1584-R1667 IonicContact OE1-CZ 3.4Å; E1584-R1667 IonicContact OE1-NE 3.1Å; E1584-R1667 PolarHBondContact OE1-NE 3.34Å; E1584-R1667 IonicContact OE1-NH2 3.23Å; E1584-R1667 PolarHBondContact OE1-NH2 3.28Å; E1584-R1667 IonicContact OE2-NH2 3.24Å; E1584-T1671 HydrophobicContact CB-CG2 4.23Å; E1584-T1671 HydrophobicContact CG-CG2 3.98Å; E1584-G1889 WeakPolarHBondContact CG-O 3.34Å; E1584-C1890 HydrophobicContact CG-CB 4.28Å; E1584-S1891 WeakPolarHBondContact OE2-CB 3.28Å; E1584-S1891 PolarHBondContact OE2-N 3.27Å; E1584-S1891 PolarHBondContact OE2-OG 3.11Å
1585	E	90.6	Very high	85.6	Confident	33.6 Å²	33.6	31.7 Å²	31.7	16%	0.157	15%	0.154	C	C	.	.	H	α-helix	trans	-62.2	-42.5	178.2	-175.6	62.6	-158.8	0	0	111.2	V1579 F1582 A1587 F1588 Q1589 P2059 M2061 T2062	V1579-E1585 HydrophobicContact CG1-CB 4.1Å; V1579-E1585 HydrophobicContact CG1-CG 3.74Å; F1582-E1585 HydrophobicContact CB-CB 3.91Å; F1582-E1585 WeakPolarHBondContact O-CB 3.34Å; F1582-E1585 PolarHBondContact O-N 3.19Å; F1582-E1585 VanDerWaalsContact O-N 3.13Å; E1585-A1587 VanDerWaalsContact C-N 3.34Å; E1585-A1587 PolarHBondContact O-N 3.25Å; E1585-F1588 PolarHBondContact O-N 3.32Å; E1585-Q1589 WeakPolarHBondContact O-CG 3.3Å; E1585-Q1589 PolarHBondContact O-N 3.17Å; E1585-Q1589 PolarHBondContact OE1-NE2 3.17Å; E1585-P2059 HydrophobicContact CB-CB 4.21Å; E1585-P2059 HydrophobicContact CB-CG 4.2Å; E1585-P2059 VanDerWaalsContact CD-CB 3.49Å; E1585-P2059 HydrophobicContact CG-CB 3.61Å; E1585-P2059 HydrophobicContact CG-CG 4.08Å; E1585-M2061 WeakPolarHBondContact OE1-CB 3.29Å; E1585-M2061 VanDerWaalsContact OE1-CG 3.32Å; E1585-M2061 WeakPolarHBondContact OE1-CG 3.19Å; E1585-M2061 PolarHBondContact OE1-N 3.01Å; E1585-M2061 WeakPolarHBondContact OE2-CB 3.31Å; E1585-M2061 PolarHBondContact OE2-N 3Å; E1585-T2062 WeakPolarHBondContact OE2-CB 3.39Å; E1585-T2062 PolarHBondContact OE2-N 3.29Å; E1585-T2062 PolarHBondContact OE2-OG1 2.94Å
1586	V	89.1	Confident	86.3	Confident	0.6 Å²	0.6	29.4 Å²	29.4	0%	0.004	15%	0.154	C	C	.	.	H	α-helix	trans	-61.6	-44.4	174.6	173.6	0	0	0	0	111.1	L1576 V1579 F1580 F1582 P1583 E1584 F1588 Q1589 L1590 W1644	L1576-V1586 HydrophobicContact CD1-CG1 4.39Å; L1576-V1586 HydrophobicContact CD2-CB 4.5Å; L1576-V1586 HydrophobicContact CD2-CG1 4.38Å; L1576-V1586 HydrophobicContact CD2-CG2 4.33Å; V1579-V1586 HydrophobicContact CB-CG2 4.31Å; V1579-V1586 HydrophobicContact CG1-CG2 4.26Å; F1580-V1586 HydrophobicContact CB-CG2 4.49Å; F1580-V1586 HydrophobicContact CD1-CG2 4.41Å; F1580-V1586 HydrophobicContact CD2-CG1 4.15Å; F1580-V1586 HydrophobicContact CD2-CG2 4.06Å; F1580-V1586 HydrophobicContact CE1-CG1 4.02Å; F1580-V1586 HydrophobicContact CE2-CB 4.45Å; F1580-V1586 HydrophobicContact CE2-CG1 3.8Å; F1580-V1586 HydrophobicContact CE2-CG2 4.33Å; F1580-V1586 HydrophobicContact CG-CG2 4.35Å; F1580-V1586 HydrophobicContact CZ-CG1 4.15Å; F1582-V1586 PolarHBondContact O-N 3.28Å; F1582-V1586 VanDerWaalsContact O-N 3.14Å; P1583-V1586 PolarHBondContact O-N 3.3Å; E1584-V1586 VanDerWaalsContact C-N 3.33Å; E1584-V1586 PolarHBondContact O-N 3.1Å; V1586-F1588 VanDerWaalsContact C-N 3.31Å; V1586-F1588 PolarHBondContact O-N 3.16Å; V1586-Q1589 PolarHBondContact O-N 3.07Å; V1586-L1590 HydrophobicContact CG1-CD1 3.81Å; V1586-L1590 HydrophobicContact CG1-CG 4.27Å; V1586-L1590 VanDerWaalsContact O-CB 3.32Å; V1586-L1590 WeakPolarHBondContact O-CB 3.34Å; V1586-L1590 VanDerWaalsContact O-CG 3.3Å; V1586-L1590 WeakPolarHBondContact O-CG 3.39Å; V1586-L1590 PolarHBondContact O-N 3.08Å; V1586-W1644 HydrophobicContact CG1-CH2 4.42Å
1587	A	91.6	Very high	86.8	Confident	0.2 Å²	0.2	30.8 Å²	30.8	0%	0.002	16%	0.161	C	C	.	.	H	α-helix	trans	-63.5	-39	176.9	0	0	0	0	0	112.3	P1583 E1584 E1585 S1591 T1671 C1672 I1675	P1583-A1587 WeakPolarHBondContact O-CB 3.21Å; P1583-A1587 PolarHBondContact O-N 3.35Å; P1583-A1587 VanDerWaalsContact O-N 3.1Å; E1584-A1587 WeakPolarHBondContact O-CB 3.37Å; E1584-A1587 PolarHBondContact O-N 3.1Å; E1584-A1587 VanDerWaalsContact O-N 3.14Å; E1585-A1587 VanDerWaalsContact C-N 3.34Å; E1585-A1587 PolarHBondContact O-N 3.25Å; A1587-S1591 VanDerWaalsContact O-CB 3.26Å; A1587-S1591 WeakPolarHBondContact O-CB 3.34Å; A1587-S1591 PolarHBondContact O-N 3.04Å; A1587-S1591 PolarHBondContact O-OG 2.96Å; A1587-T1671 HydrophobicContact CB-CG2 3.68Å; A1587-T1671 VanDerWaalsContact CB-OG1 3.24Å; A1587-T1671 WeakPolarHBondContact CB-OG1 3.36Å; A1587-C1672 VanDerWaalsContact CB-SG 3.55Å; A1587-I1675 HydrophobicContact CB-CD1 4.3Å
1588	F	91.6	Very high	87.4	Confident	34 Å²	34	28.4 Å²	28.4	15%	0.149	15%	0.15	C	C	.	.	H	α-helix	trans	-65.8	-45.7	176.4	-63.9	-33.6	0	0	0	112	E1584 E1585 V1586 S1591 A1592 T1671 I1675 R1885 M2061 V2065	E1584-F1588 HydrophobicContact CB-CE1 4.28Å; E1584-F1588 HydrophobicContact CB-CE2 4.04Å; E1584-F1588 HydrophobicContact CB-CZ 4.06Å; E1584-F1588 WeakPolarHBondContact O-CB 3.17Å; E1584-F1588 WeakPolarHBondContact O-CD1 3.25Å; E1584-F1588 VanDerWaalsContact O-CD2 3.29Å; E1584-F1588 WeakPolarHBondContact O-CD2 3.31Å; E1584-F1588 VanDerWaalsContact O-CG 3.25Å; E1584-F1588 WeakPolarHBondContact O-CG 3.21Å; E1584-F1588 PolarHBondContact O-N 3.21Å; E1585-F1588 PolarHBondContact O-N 3.32Å; V1586-F1588 VanDerWaalsContact C-N 3.31Å; V1586-F1588 PolarHBondContact O-N 3.16Å; F1588-S1591 PolarHBondContact O-N 3.14Å; F1588-A1592 WeakPolarHBondContact O-CB 3.23Å; F1588-A1592 PolarHBondContact O-N 3.16Å; F1588-T1671 HydrophobicContact CD1-CG2 4.24Å; F1588-T1671 HydrophobicContact CE1-CG2 3.76Å; F1588-T1671 HydrophobicContact CZ-CG2 4.45Å; F1588-I1675 HydrophobicContact CD1-CD1 3.81Å; F1588-I1675 HydrophobicContact CD1-CG1 4.5Å; F1588-I1675 HydrophobicContact CE1-CD1 4.09Å; F1588-I1675 VanDerWaalsContact CE1-CD1 3.46Å; F1588-I1675 HydrophobicContact CE1-CG1 4.08Å; F1588-I1675 HydrophobicContact CE1-CG2 4.06Å; F1588-R1885 HydrophobicContact CE1-CG 4.03Å; F1588-R1885 VanDerWaalsContact CG-NH1 3.26Å; F1588-R1885 HydrophobicContact CZ-CB 4.15Å; F1588-R1885 HydrophobicContact CZ-CG 4.11Å; F1588-M2061 HydrophobicContact CB-CB 4.47Å; F1588-M2061 HydrophobicContact CB-CE 3.89Å; F1588-M2061 HydrophobicContact CB-CG 4.23Å; F1588-M2061 HydrophobicContact CB-SD 3.51Å; F1588-M2061 VanDerWaalsContact CB-SD 3.51Å; F1588-M2061 HydrophobicContact CD2-CB 4.23Å; F1588-V2065 HydrophobicContact CD2-CG2 4.33Å; F1588-V2065 HydrophobicContact CE2-CB 4.4Å; F1588-V2065 HydrophobicContact CE2-CG1 4.32Å; F1588-V2065 HydrophobicContact CE2-CG2 4.23Å; F1588-V2065 HydrophobicContact CZ-CG1 4.4Å
1589	Q	88.9	Confident	88.2	Confident	55.4 Å²	55.4	28.6 Å²	28.6	26%	0.259	14%	0.144	S	C	.	.	H	α-helix	trans	-68.3	-42.2	179.8	-69.7	-174	26.5	0	0	112.5	L1576 E1585 V1586 S1591 A1592 I1593 M2061	L1576-Q1589 HydrophobicContact CD2-CB 3.81Å; L1576-Q1589 HydrophobicContact CD2-CG 4.45Å; L1576-Q1589 VanDerWaalsContact CD2-OE1 3.32Å; E1585-Q1589 WeakPolarHBondContact O-CG 3.3Å; E1585-Q1589 PolarHBondContact O-N 3.17Å; E1585-Q1589 PolarHBondContact OE1-NE2 3.17Å; V1586-Q1589 PolarHBondContact O-N 3.07Å; Q1589-S1591 VanDerWaalsContact C-N 3.32Å; Q1589-S1591 PolarHBondContact O-N 3.21Å; Q1589-A1592 PolarHBondContact O-N 3.16Å; Q1589-I1593 PolarHBondContact O-N 3.11Å; Q1589-M2061 HydrophobicContact CG-SD 4.06Å
1590	L	88	Confident	88.5	Confident	4 Å²	4	31.4 Å²	31.4	2%	0.021	17%	0.165	C	C	.	.	H	α-helix	trans	-58.9	-46.6	172.9	-88.6	158.5	0	0	0	111.1	L1573 L1576 V1586 A1592 I1593 E1594 R1632 W1644 I1684	L1573-L1590 HydrophobicContact CD2-CD1 4.43Å; L1573-L1590 HydrophobicContact CD2-CD2 4.35Å; L1576-L1590 HydrophobicContact CD1-CD2 3.58Å; L1576-L1590 HydrophobicContact CD1-CG 3.94Å; V1586-L1590 HydrophobicContact CG1-CD1 3.81Å; V1586-L1590 HydrophobicContact CG1-CG 4.27Å; V1586-L1590 VanDerWaalsContact O-CB 3.32Å; V1586-L1590 WeakPolarHBondContact O-CB 3.34Å; V1586-L1590 VanDerWaalsContact O-CG 3.3Å; V1586-L1590 WeakPolarHBondContact O-CG 3.39Å; V1586-L1590 PolarHBondContact O-N 3.08Å; L1590-A1592 PolarHBondContact O-N 2.85Å; L1590-I1593 PolarHBondContact O-N 3.02Å; L1590-E1594 WeakPolarHBondContact CG-OE1 3.5Å; L1590-E1594 WeakPolarHBondContact O-CB 3.34Å; L1590-E1594 VanDerWaalsContact O-CG 3.31Å; L1590-E1594 WeakPolarHBondContact O-CG 3.26Å; L1590-E1594 PolarHBondContact O-N 3.21Å; L1590-R1632 PolarHBondContact O-NH2 3.27Å; L1590-W1644 HydrophobicContact CD1-CZ3 4.49Å; L1590-I1684 HydrophobicContact CD1-CD1 4.45Å; L1590-I1684 HydrophobicContact CD2-CD1 4.08Å
1591	S	90.8	Very high	89	Confident	11 Å²	11	31.5 Å²	31.5	8%	0.077	17%	0.165	C	C	.	.	H	α-helix	trans	-67.2	-35.3	-178.5	-56.1	0	0	0	0	112.9	A1587 F1588 Q1589 I1593 E1594 Y1595 I1675 N1677 I1752	A1587-S1591 VanDerWaalsContact O-CB 3.26Å; A1587-S1591 WeakPolarHBondContact O-CB 3.34Å; A1587-S1591 PolarHBondContact O-N 3.04Å; A1587-S1591 PolarHBondContact O-OG 2.96Å; F1588-S1591 PolarHBondContact O-N 3.14Å; Q1589-S1591 VanDerWaalsContact C-N 3.32Å; Q1589-S1591 PolarHBondContact O-N 3.21Å; S1591-I1593 VanDerWaalsContact C-N 3.33Å; S1591-I1593 PolarHBondContact O-N 3.06Å; S1591-E1594 PolarHBondContact O-N 3.24Å; S1591-Y1595 VanDerWaalsContact O-CB 3.28Å; S1591-Y1595 WeakPolarHBondContact O-CB 3.33Å; S1591-Y1595 PolarHBondContact O-N 3.35Å; S1591-I1675 WeakPolarHBondContact OG-CD1 3.4Å; S1591-N1677 WeakPolarHBondContact CA-ND2 3.13Å; S1591-N1677 VanDerWaalsContact OG-CB 3.3Å; S1591-N1677 WeakPolarHBondContact OG-CB 3.31Å; S1591-N1677 PolarHBondContact OG-ND2 2.92Å; S1591-I1752 VanDerWaalsContact O-CD1 3.25Å; S1591-I1752 WeakPolarHBondContact O-CD1 3.39Å
1592	A	89.4	Confident	89.4	Confident	48.2 Å²	48.2	31.1 Å²	31.1	40%	0.398	17%	0.171	S	C	.	.	H	α-helix	trans	-60.5	-45.9	175.1	0	0	0	0	0	111.6	F1588 Q1589 L1590 Y1595 D1596 M2061	F1588-A1592 WeakPolarHBondContact O-CB 3.23Å; F1588-A1592 PolarHBondContact O-N 3.16Å; Q1589-A1592 PolarHBondContact O-N 3.16Å; L1590-A1592 PolarHBondContact O-N 2.85Å; A1592-Y1595 PolarHBondContact O-N 3.04Å; A1592-D1596 PolarHBondContact O-N 3.07Å; A1592-D1596 VanDerWaalsContact O-N 3.13Å; A1592-M2061 HydrophobicContact CB-CE 4.39Å
1593	I	86.8	Confident	89.4	Confident	56 Å²	56	29.9 Å²	29.9	29%	0.287	17%	0.168	S	C	.	.	H	α-helix	trans	-73.7	-36.1	-178.3	-63.6	169.7	0	0	0	111.2	Y1569 E1572 Q1589 L1590 S1591 Y1595 D1596 L1597	Y1569-I1593 HydrophobicContact CE1-CG2 4.48Å; E1572-I1593 HydrophobicContact CB-CD1 4.39Å; E1572-I1593 VanDerWaalsContact CD-CD1 3.46Å; E1572-I1593 HydrophobicContact CG-CD1 3.69Å; E1572-I1593 WeakPolarHBondContact OE1-CD1 3.41Å; E1572-I1593 WeakPolarHBondContact OE2-CD1 3.3Å; Q1589-I1593 PolarHBondContact O-N 3.11Å; L1590-I1593 PolarHBondContact O-N 3.02Å; S1591-I1593 VanDerWaalsContact C-N 3.33Å; S1591-I1593 PolarHBondContact O-N 3.06Å; I1593-Y1595 VanDerWaalsContact C-N 3.31Å; I1593-Y1595 PolarHBondContact O-N 2.94Å; I1593-D1596 PolarHBondContact O-N 3.34Å; I1593-L1597 HydrophobicContact CG2-CD1 3.93Å; I1593-L1597 HydrophobicContact CG2-CG 4.44Å; I1593-L1597 WeakPolarHBondContact O-CB 3.36Å; I1593-L1597 WeakPolarHBondContact O-CD1 3.26Å; I1593-L1597 VanDerWaalsContact O-CG 3.26Å; I1593-L1597 WeakPolarHBondContact O-CG 3.37Å; I1593-L1597 PolarHBondContact O-N 3.24Å; I1593-L1597 VanDerWaalsContact O-N 3.13Å
1594	E	87.7	Confident	89.4	Confident	1.2 Å²	1.2	33.8 Å²	33.8	1%	0.006	19%	0.187	C	C	.	.	H	α-helix	trans	-68.3	-34.9	174.1	-74.8	167.8	-143.1	0	0	112.9	L1590 S1591 L1597 V1598 R1632 N1677 N1679 G1680 I1752	L1590-E1594 WeakPolarHBondContact CG-OE1 3.5Å; L1590-E1594 WeakPolarHBondContact O-CB 3.34Å; L1590-E1594 VanDerWaalsContact O-CG 3.31Å; L1590-E1594 WeakPolarHBondContact O-CG 3.26Å; L1590-E1594 PolarHBondContact O-N 3.21Å; S1591-E1594 PolarHBondContact O-N 3.24Å; E1594-L1597 PolarHBondContact O-N 3.16Å; E1594-V1598 WeakPolarHBondContact O-CB 3.4Å; E1594-V1598 VanDerWaalsContact O-CG2 3.31Å; E1594-V1598 WeakPolarHBondContact O-CG2 3.4Å; E1594-V1598 PolarHBondContact O-N 3.23Å; E1594-R1632 VanDerWaalsContact CG-NE 3.32Å; E1594-R1632 IonicContact OE1-CZ 3.12Å; E1594-R1632 IonicContact OE1-NE 3Å; E1594-R1632 PolarHBondContact OE1-NE 2.7Å; E1594-R1632 IonicContact OE1-NH2 3.1Å; E1594-R1632 PolarHBondContact OE1-NH2 3.42Å; E1594-N1677 PolarHBondContact OE2-ND2 3.22Å; E1594-N1677 PolarHBondContact OE2-OD1 3.17Å; E1594-N1677 VanDerWaalsContact OE2-OD1 3.04Å; E1594-N1679 PolarHBondContact OE2-ND2 2.96Å; E1594-G1680 WeakPolarHBondContact OE2-CA 3.33Å; E1594-G1680 PolarHBondContact OE2-N 2.88Å; E1594-G1680 VanDerWaalsContact OE2-N 3.12Å; E1594-I1752 HydrophobicContact CB-CD1 4.06Å; E1594-I1752 HydrophobicContact CB-CG2 4.37Å
1595	Y	91	Very high	89.2	Confident	24.8 Å²	24.8	34.6 Å²	34.6	10%	0.097	19%	0.191	C	C	.	.	H	α-helix	trans	-59.9	-53.6	174.5	-175.5	-91.5	0	0	0	110.4	S1591 A1592 I1593 L1597 V1598 Y1599 R1750 I1752 S1837 H1841	S1591-Y1595 VanDerWaalsContact O-CB 3.28Å; S1591-Y1595 WeakPolarHBondContact O-CB 3.33Å; S1591-Y1595 PolarHBondContact O-N 3.35Å; A1592-Y1595 PolarHBondContact O-N 3.04Å; I1593-Y1595 VanDerWaalsContact C-N 3.31Å; I1593-Y1595 PolarHBondContact O-N 2.94Å; Y1595-L1597 VanDerWaalsContact C-N 3.3Å; Y1595-L1597 PolarHBondContact O-N 2.96Å; Y1595-V1598 PolarHBondContact O-N 3Å; Y1595-Y1599 AromaticContact CD1-CD2 3.97Å; Y1595-Y1599 HydrophobicContact CD1-CD2 4.02Å; Y1595-Y1599 AromaticContact CD2-CD2 3.58Å; Y1595-Y1599 HydrophobicContact CD2-CD2 3.58Å; Y1595-Y1599 VanDerWaalsContact CD2-CD2 3.47Å; Y1595-Y1599 AromaticContact CD2-CE2 3.45Å; Y1595-Y1599 HydrophobicContact CD2-CE2 3.45Å; Y1595-Y1599 VanDerWaalsContact CD2-CE2 3.44Å; Y1595-Y1599 HydrophobicContact CD2-CG 4.36Å; Y1595-Y1599 AromaticContact CE1-CD2 3.93Å; Y1595-Y1599 HydrophobicContact CE1-CD2 3.99Å; Y1595-Y1599 HydrophobicContact CE1-CE2 4.41Å; Y1595-Y1599 HydrophobicContact CE2-CD1 4.4Å; Y1595-Y1599 AromaticContact CE2-CD2 3.55Å; Y1595-Y1599 HydrophobicContact CE2-CD2 3.55Å; Y1595-Y1599 VanDerWaalsContact CE2-CD2 3.48Å; Y1595-Y1599 HydrophobicContact CE2-CE1 4.32Å; Y1595-Y1599 AromaticContact CE2-CE2 3.31Å; Y1595-Y1599 HydrophobicContact CE2-CE2 3.31Å; Y1595-Y1599 HydrophobicContact CE2-CG 4.01Å; Y1595-Y1599 AromaticContact CE2-CZ 3.83Å; Y1595-Y1599 AromaticContact CG-CD2 3.83Å; Y1595-Y1599 HydrophobicContact CG-CD2 3.88Å; Y1595-Y1599 HydrophobicContact CG-CE2 4.22Å; Y1595-Y1599 AromaticContact CZ-CD2 3.76Å; Y1595-Y1599 AromaticContact CZ-CE2 3.85Å; Y1595-Y1599 WeakPolarHBondContact O-CB 3.39Å; Y1595-Y1599 VanDerWaalsContact O-CD2 3.28Å; Y1595-Y1599 WeakPolarHBondContact O-CD2 3.35Å; Y1595-Y1599 PolarHBondContact O-N 3.28Å; Y1595-R1750 HydrophobicContact CD2-CB 3.81Å; Y1595-R1750 HydrophobicContact CD2-CG 4.27Å; Y1595-R1750 HydrophobicContact CE2-CB 3.62Å; Y1595-R1750 HydrophobicContact CE2-CG 3.78Å; Y1595-I1752 HydrophobicContact CD2-CD1 4.42Å; Y1595-I1752 HydrophobicContact CD2-CG1 4.14Å; Y1595-S1837 WeakPolarHBondContact OH-CB 3.32Å; Y1595-S1837 PolarHBondContact OH-OG 2.91Å; Y1595-S1837 VanDerWaalsContact OH-OG 3.06Å; Y1595-H1841 PolarHBondContact OH-NE2 3.43Å; Y1595-H1841 VanDerWaalsContact OH-NE2 3.15Å
1596	D	88.9	Confident	89.2	Confident	109.2 Å²	109.2	33 Å²	33	58%	0.584	18%	0.184	S	C	*	.	H	α-helix	trans	-59.7	-40.1	178.5	-70.7	-11.1	0	0	0	111.9	A1592 I1593 S1600	A1592-D1596 PolarHBondContact O-N 3.07Å; A1592-D1596 VanDerWaalsContact O-N 3.13Å; I1593-D1596 PolarHBondContact O-N 3.34Å; D1596-S1600 VanDerWaalsContact O-CB 3.23Å; D1596-S1600 WeakPolarHBondContact O-CB 3.37Å; D1596-S1600 PolarHBondContact O-N 3Å; D1596-S1600 VanDerWaalsContact O-N 3.08Å; D1596-S1600 PolarHBondContact O-OG 3.02Å
1597	L	86.8	Confident	89.1	Confident	31 Å²	31	33.5 Å²	33.5	16%	0.162	19%	0.187	C	C	.	.	H	α-helix	trans	-70.8	-39.9	179.3	-72.7	171.2	0	0	0	113.5	Y1569 I1593 E1594 Y1595 Y1599 S1600 I1601 M1628 L1629 R1632	Y1569-L1597 HydrophobicContact CE1-CD1 3.98Å; Y1569-L1597 WeakPolarHBondContact OH-CD1 3.27Å; Y1569-L1597 WeakPolarHBondContact OH-CD2 3.41Å; I1593-L1597 HydrophobicContact CG2-CD1 3.93Å; I1593-L1597 HydrophobicContact CG2-CG 4.44Å; I1593-L1597 WeakPolarHBondContact O-CB 3.36Å; I1593-L1597 WeakPolarHBondContact O-CD1 3.26Å; I1593-L1597 VanDerWaalsContact O-CG 3.26Å; I1593-L1597 WeakPolarHBondContact O-CG 3.37Å; I1593-L1597 PolarHBondContact O-N 3.24Å; I1593-L1597 VanDerWaalsContact O-N 3.13Å; E1594-L1597 PolarHBondContact O-N 3.16Å; Y1595-L1597 VanDerWaalsContact C-N 3.3Å; Y1595-L1597 PolarHBondContact O-N 2.96Å; L1597-Y1599 PolarHBondContact O-N 3.3Å; L1597-S1600 PolarHBondContact O-N 3.44Å; L1597-S1600 PolarHBondContact O-OG 3Å; L1597-I1601 WeakPolarHBondContact O-CD1 3.27Å; L1597-I1601 VanDerWaalsContact O-CG1 3.31Å; L1597-I1601 WeakPolarHBondContact O-CG1 3.4Å; L1597-M1628 HydrophobicContact CD2-CE 3.89Å; L1597-L1629 HydrophobicContact CB-CD2 3.99Å; L1597-R1632 VanDerWaalsContact CD1-CD 3.5Å
1598	V	88.6	Confident	88.8	Confident	3.2 Å²	3.2	35.4 Å²	35.4	2%	0.019	20%	0.199	C	C	.	.	H	α-helix	trans	-72.5	-45.4	178.5	171.5	0	0	0	0	110.6	E1594 Y1595 S1600 I1601 L1629 I1752	E1594-V1598 WeakPolarHBondContact O-CB 3.4Å; E1594-V1598 VanDerWaalsContact O-CG2 3.31Å; E1594-V1598 WeakPolarHBondContact O-CG2 3.4Å; E1594-V1598 PolarHBondContact O-N 3.23Å; Y1595-V1598 PolarHBondContact O-N 3Å; V1598-S1600 VanDerWaalsContact C-N 3.33Å; V1598-S1600 PolarHBondContact O-N 2.95Å; V1598-I1601 PolarHBondContact O-N 3.07Å; V1598-L1629 HydrophobicContact CG2-CD1 4.16Å; V1598-L1629 HydrophobicContact CG2-CD2 3.75Å; V1598-I1752 HydrophobicContact CB-CG2 4.38Å; V1598-I1752 HydrophobicContact CG2-CG2 3.94Å
1599	Y	90.6	Very high	88.5	Confident	50.4 Å²	50.4	33.8 Å²	33.8	20%	0.198	19%	0.192	C	C	.	.	H	α-helix	trans	-79.6	-12.2	-175.1	-72.3	-72.2	0	0	0	114.7	Y1595 L1597 I1601 P1751 F1833 H1834	Y1595-Y1599 AromaticContact CD1-CD2 3.97Å; Y1595-Y1599 HydrophobicContact CD1-CD2 4.02Å; Y1595-Y1599 AromaticContact CD2-CD2 3.58Å; Y1595-Y1599 HydrophobicContact CD2-CD2 3.58Å; Y1595-Y1599 VanDerWaalsContact CD2-CD2 3.47Å; Y1595-Y1599 AromaticContact CD2-CE2 3.45Å; Y1595-Y1599 HydrophobicContact CD2-CE2 3.45Å; Y1595-Y1599 VanDerWaalsContact CD2-CE2 3.44Å; Y1595-Y1599 HydrophobicContact CD2-CG 4.36Å; Y1595-Y1599 AromaticContact CE1-CD2 3.93Å; Y1595-Y1599 HydrophobicContact CE1-CD2 3.99Å; Y1595-Y1599 HydrophobicContact CE1-CE2 4.41Å; Y1595-Y1599 HydrophobicContact CE2-CD1 4.4Å; Y1595-Y1599 AromaticContact CE2-CD2 3.55Å; Y1595-Y1599 HydrophobicContact CE2-CD2 3.55Å; Y1595-Y1599 VanDerWaalsContact CE2-CD2 3.48Å; Y1595-Y1599 HydrophobicContact CE2-CE1 4.32Å; Y1595-Y1599 AromaticContact CE2-CE2 3.31Å; Y1595-Y1599 HydrophobicContact CE2-CE2 3.31Å; Y1595-Y1599 HydrophobicContact CE2-CG 4.01Å; Y1595-Y1599 AromaticContact CE2-CZ 3.83Å; Y1595-Y1599 AromaticContact CG-CD2 3.83Å; Y1595-Y1599 HydrophobicContact CG-CD2 3.88Å; Y1595-Y1599 HydrophobicContact CG-CE2 4.22Å; Y1595-Y1599 AromaticContact CZ-CD2 3.76Å; Y1595-Y1599 AromaticContact CZ-CE2 3.85Å; Y1595-Y1599 WeakPolarHBondContact O-CB 3.39Å; Y1595-Y1599 VanDerWaalsContact O-CD2 3.28Å; Y1595-Y1599 WeakPolarHBondContact O-CD2 3.35Å; Y1595-Y1599 PolarHBondContact O-N 3.28Å; L1597-Y1599 PolarHBondContact O-N 3.3Å; Y1599-I1601 VanDerWaalsContact C-N 3.29Å; Y1599-I1601 PolarHBondContact O-N 2.85Å; Y1599-P1751 WeakPolarHBondContact CE2-O 3.26Å; Y1599-P1751 PolarHBondContact OH-O 3.01Å; Y1599-F1833 HydrophobicContact CE1-CB 4.08Å; Y1599-F1833 VanDerWaalsContact CE1-O 3.23Å; Y1599-F1833 WeakPolarHBondContact CE1-O 3.21Å; Y1599-F1833 PolarHBondContact OH-O 2.81Å; Y1599-H1834 AromaticContact CD1-CE1 3.91Å; Y1599-H1834 AromaticContact CD1-ND1 3.8Å
1600	S	87.8	Confident	88.3	Confident	74.2 Å²	74.2	31.2 Å²	31.2	52%	0.519	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-10.4	170.5	62.6	0	0	0	0	114.5	D1596 L1597 V1598 Q1625	D1596-S1600 VanDerWaalsContact O-CB 3.23Å; D1596-S1600 WeakPolarHBondContact O-CB 3.37Å; D1596-S1600 PolarHBondContact O-N 3Å; D1596-S1600 VanDerWaalsContact O-N 3.08Å; D1596-S1600 PolarHBondContact O-OG 3.02Å; L1597-S1600 PolarHBondContact O-N 3.44Å; L1597-S1600 PolarHBondContact O-OG 3Å; V1598-S1600 VanDerWaalsContact C-N 3.33Å; V1598-S1600 PolarHBondContact O-N 2.95Å; S1600-Q1625 PolarHBondContact O-NE2 3.02Å; S1600-Q1625 VanDerWaalsContact O-NE2 3.11Å
1601	I	90.4	Very high	88	Confident	4.4 Å²	4.4	33.2 Å²	33.2	2%	0.023	19%	0.19	C	C	.	.	S	Bend	trans	-97.6	134.6	-175.3	-63.5	174.4	0	0	0	109.6	L1597 V1598 Y1599 D1605 Y1606 Q1625 V1626 L1629 H1834	L1597-I1601 WeakPolarHBondContact O-CD1 3.27Å; L1597-I1601 VanDerWaalsContact O-CG1 3.31Å; L1597-I1601 WeakPolarHBondContact O-CG1 3.4Å; V1598-I1601 PolarHBondContact O-N 3.07Å; Y1599-I1601 VanDerWaalsContact C-N 3.29Å; Y1599-I1601 PolarHBondContact O-N 2.85Å; I1601-D1605 HydrophobicContact CG2-CB 3.63Å; I1601-Y1606 HydrophobicContact CG2-CD2 4.25Å; I1601-Y1606 HydrophobicContact CG2-CE2 3.8Å; I1601-Q1625 HydrophobicContact CB-CB 4.48Å; I1601-Q1625 HydrophobicContact CD1-CB 4.2Å; I1601-Q1625 HydrophobicContact CG1-CB 3.79Å; I1601-Q1625 HydrophobicContact CG2-CB 4.35Å; I1601-V1626 HydrophobicContact CG2-CG2 3.74Å; I1601-L1629 HydrophobicContact CD1-CD1 3.62Å; I1601-L1629 VanDerWaalsContact CD1-CD1 3.5Å; I1601-L1629 HydrophobicContact CD1-CD2 4.28Å; I1601-L1629 HydrophobicContact CD1-CG 3.6Å; I1601-L1629 VanDerWaalsContact CD1-CG 3.47Å; I1601-H1834 PolarHBondContact O-CE1 2.83Å
1602	S	89.3	Confident	87.5	Confident	54.8 Å²	54.8	33.3 Å²	33.3	38%	0.383	19%	0.19	S	C	.	.			trans	-74.7	145.1	177	179.5	0	0	0	0	110.9	M1604 D1605	S1602-M1604 PolarHBondContact O-N 3.11Å; S1602-M1604 VanDerWaalsContact O-N 3.11Å; S1602-M1604 PolarHBondContact OG-N 3.19Å; S1602-D1605 WeakPolarHBondContact CB-OD2 3.34Å; S1602-D1605 PolarHBondContact N-OD2 2.91Å; S1602-D1605 VanDerWaalsContact O-CB 3.24Å; S1602-D1605 WeakPolarHBondContact O-CB 3.38Å; S1602-D1605 PolarHBondContact O-N 3.15Å
1603	P	89.8	Confident	86.9	Confident	15.8 Å²	15.8	32.7 Å²	32.7	10%	0.103	18%	0.181	C	C	.	.	H	α-helix	trans	-51.2	-34.4	169.2	-28.9	35.8	0	0	0	113.4	D1605 Y1606 L1827 L1830 E1831	P1603-D1605 VanDerWaalsContact C-N 3.28Å; P1603-D1605 PolarHBondContact O-N 3.06Å; P1603-Y1606 WeakPolarHBondContact O-CB 3.43Å; P1603-Y1606 PolarHBondContact O-N 3Å; P1603-L1827 VanDerWaalsContact C-CD2 3.5Å; P1603-L1827 HydrophobicContact CB-CD2 3.82Å; P1603-L1827 VanDerWaalsContact O-CD2 3.24Å; P1603-L1827 WeakPolarHBondContact O-CD2 3.3Å; P1603-L1830 HydrophobicContact CB-CB 4.5Å; P1603-L1830 HydrophobicContact CB-CD2 3.88Å; P1603-L1830 HydrophobicContact CB-CG 4.26Å; P1603-L1830 HydrophobicContact CG-CD2 4.26Å; P1603-L1830 HydrophobicContact CG-CG 4.23Å; P1603-E1831 WeakPolarHBondContact CG-OE2 3.4Å
1604	M	87	Confident	86.6	Confident	81.6 Å²	81.6	33.2 Å²	33.2	40%	0.402	18%	0.183	S	C	.	.	H	α-helix	trans	-68.6	-22.1	176.5	-70.4	-62	-79.5	0	0	114	S835 W836 S1602 Y1606 V1607 T1608 L1827	S835-M1604 WeakPolarHBondContact OG-CE 3.47Å; W836-M1604 HydrophobicContact CB-CE 4.16Å; S1602-M1604 PolarHBondContact O-N 3.11Å; S1602-M1604 VanDerWaalsContact O-N 3.11Å; S1602-M1604 PolarHBondContact OG-N 3.19Å; M1604-Y1606 PolarHBondContact O-N 3.16Å; M1604-V1607 PolarHBondContact O-N 3.09Å; M1604-T1608 WeakPolarHBondContact O-CB 3.37Å; M1604-T1608 PolarHBondContact O-N 3.03Å; M1604-T1608 PolarHBondContact O-OG1 2.98Å; M1604-T1608 VanDerWaalsContact O-OG1 3.08Å; M1604-L1827 HydrophobicContact CE-CD1 4.31Å; M1604-L1827 HydrophobicContact SD-CD1 3.88Å; M1604-L1827 VanDerWaalsContact SD-CD1 3.57Å
1605	D	88.7	Confident	86	Confident	32 Å²	32	37.2 Å²	37.2	17%	0.171	21%	0.205	C	C	.	.	H	α-helix	trans	-65.2	-27.7	174.4	-73.5	-46.9	0	0	0	111.2	I1601 S1602 P1603 T1608 Y1609 S1624 Q1625 V1626	I1601-D1605 HydrophobicContact CG2-CB 3.63Å; S1602-D1605 WeakPolarHBondContact CB-OD2 3.34Å; S1602-D1605 PolarHBondContact N-OD2 2.91Å; S1602-D1605 VanDerWaalsContact O-CB 3.24Å; S1602-D1605 WeakPolarHBondContact O-CB 3.38Å; S1602-D1605 PolarHBondContact O-N 3.15Å; P1603-D1605 VanDerWaalsContact C-N 3.28Å; P1603-D1605 PolarHBondContact O-N 3.06Å; D1605-T1608 PolarHBondContact O-N 3.09Å; D1605-Y1609 VanDerWaalsContact O-CB 3.29Å; D1605-Y1609 WeakPolarHBondContact O-CB 3.31Å; D1605-Y1609 PolarHBondContact O-N 2.99Å; D1605-S1624 VanDerWaalsContact O-CB 3.31Å; D1605-S1624 WeakPolarHBondContact O-CB 3.32Å; D1605-S1624 PolarHBondContact O-OG 3.04Å; D1605-Q1625 PolarHBondContact OD1-N 3.03Å; D1605-Q1625 PolarHBondContact OD2-NE2 3.19Å; D1605-V1626 HydrophobicContact CB-CG2 4.09Å
1606	Y	89.7	Confident	85.2	Confident	1 Å²	1	44.2 Å²	44.2	0%	0.004	24%	0.239	C	C	.	.	H	α-helix	trans	-68.7	-43.7	176.3	-72.6	-107.1	0	0	0	112	I1601 P1603 M1604 Y1609 V1610 V1626 L1629 F1755 F1758 L1759 L1830	I1601-Y1606 HydrophobicContact CG2-CD2 4.25Å; I1601-Y1606 HydrophobicContact CG2-CE2 3.8Å; P1603-Y1606 WeakPolarHBondContact O-CB 3.43Å; P1603-Y1606 PolarHBondContact O-N 3Å; M1604-Y1606 PolarHBondContact O-N 3.16Å; Y1606-Y1609 WeakPolarHBondContact O-CB 3.34Å; Y1606-Y1609 PolarHBondContact O-N 3.04Å; Y1606-V1610 WeakPolarHBondContact O-CG2 3.38Å; Y1606-V1610 PolarHBondContact O-N 3.13Å; Y1606-V1610 VanDerWaalsContact O-N 3.11Å; Y1606-V1626 HydrophobicContact CD1-CG1 4.48Å; Y1606-V1626 HydrophobicContact CD1-CG2 4.16Å; Y1606-V1626 HydrophobicContact CD2-CG2 3.76Å; Y1606-V1626 HydrophobicContact CE1-CG1 4.46Å; Y1606-V1626 HydrophobicContact CE1-CG2 4.33Å; Y1606-V1626 HydrophobicContact CE2-CG2 3.94Å; Y1606-V1626 HydrophobicContact CG-CG2 3.88Å; Y1606-L1629 WeakPolarHBondContact OH-CD1 3.47Å; Y1606-F1755 HydrophobicContact CE1-CB 3.98Å; Y1606-F1755 WeakPolarHBondContact OH-CB 3.44Å; Y1606-F1758 HydrophobicContact CD1-CB 4.35Å; Y1606-F1758 HydrophobicContact CE1-CB 4.43Å; Y1606-F1758 HydrophobicContact CE1-CD2 4.47Å; Y1606-L1759 HydrophobicContact CD1-CD2 3.8Å; Y1606-L1759 HydrophobicContact CD1-CG 4.07Å; Y1606-L1759 HydrophobicContact CE1-CG 4.44Å; Y1606-L1830 HydrophobicContact CD1-CD2 4.49Å; Y1606-L1830 HydrophobicContact CD2-CD2 3.61Å; Y1606-L1830 HydrophobicContact CE1-CD2 4.49Å; Y1606-L1830 HydrophobicContact CE2-CD2 3.59Å; Y1606-L1830 HydrophobicContact CG-CD2 4.12Å
1607	V	88.4	Confident	84.2	Confident	10.2 Å²	10.2	40.4 Å²	40.4	6%	0.062	22%	0.219	C	C	.	.	H	α-helix	trans	-64.6	-45.8	174.5	-178.9	0	0	0	0	110.1	M1604 Y1609 V1610 I1611 L1762 F1766 I1823 L1827	M1604-V1607 PolarHBondContact O-N 3.09Å; V1607-Y1609 VanDerWaalsContact C-N 3.28Å; V1607-Y1609 PolarHBondContact O-N 3.28Å; V1607-V1610 PolarHBondContact O-N 3.18Å; V1607-I1611 HydrophobicContact CG1-CD1 3.73Å; V1607-I1611 HydrophobicContact CG1-CG1 4.35Å; V1607-I1611 WeakPolarHBondContact O-CD1 3.21Å; V1607-I1611 VanDerWaalsContact O-CG1 3.31Å; V1607-I1611 WeakPolarHBondContact O-CG1 3.42Å; V1607-I1611 PolarHBondContact O-N 3.07Å; V1607-I1611 VanDerWaalsContact O-N 3.09Å; V1607-L1762 HydrophobicContact CG2-CD1 4.26Å; V1607-L1762 HydrophobicContact CG2-CD2 4.16Å; V1607-F1766 HydrophobicContact CG1-CE2 4.2Å; V1607-F1766 HydrophobicContact CG1-CZ 4.02Å; V1607-I1823 HydrophobicContact CG2-CG2 3.91Å; V1607-L1827 HydrophobicContact CG2-CD1 4.18Å; V1607-L1827 HydrophobicContact CG2-CD2 3.99Å; V1607-L1827 HydrophobicContact CG2-CG 4.34Å
1608	T	84.5	Confident	83.3	Confident	40.8 Å²	40.8	46.8 Å²	46.8	25%	0.25	24%	0.241	S	C	.	.	H	α-helix	trans	-57.1	-42.5	176.1	-56.3	0	0	0	0	111.6	M1604 D1605 C1612 P1623	M1604-T1608 WeakPolarHBondContact O-CB 3.37Å; M1604-T1608 PolarHBondContact O-N 3.03Å; M1604-T1608 PolarHBondContact O-OG1 2.98Å; M1604-T1608 VanDerWaalsContact O-OG1 3.08Å; D1605-T1608 PolarHBondContact O-N 3.09Å; T1608-C1612 WeakPolarHBondContact O-CB 3.31Å; T1608-C1612 PolarHBondContact O-N 3.14Å; T1608-C1612 VanDerWaalsContact O-N 3.1Å; T1608-C1612 PolarHBondContact O-SG 2.92Å; T1608-C1612 VanDerWaalsContact O-SG 3.37Å; T1608-P1623 HydrophobicContact CG2-CG 4.23Å
1609	Y	86.3	Confident	82.2	Confident	1.6 Å²	1.6	48.1 Å²	48.1	1%	0.006	25%	0.248	C	C	.	.	H	α-helix	trans	-60	-52.9	177.4	179.8	-97	0	0	0	111.8	F1553 D1605 Y1606 V1607 I1611 C1612 D1613 L1619 N1622 S1624 V1626 R1627 I1630 L1759 Y1763	F1553-Y1609 HydrophobicContact CE1-CE1 4.46Å; F1553-Y1609 WeakPolarHBondContact CE1-OH 3.19Å; D1605-Y1609 VanDerWaalsContact O-CB 3.29Å; D1605-Y1609 WeakPolarHBondContact O-CB 3.31Å; D1605-Y1609 PolarHBondContact O-N 2.99Å; Y1606-Y1609 WeakPolarHBondContact O-CB 3.34Å; Y1606-Y1609 PolarHBondContact O-N 3.04Å; V1607-Y1609 VanDerWaalsContact C-N 3.28Å; V1607-Y1609 PolarHBondContact O-N 3.28Å; Y1609-I1611 VanDerWaalsContact C-N 3.31Å; Y1609-I1611 PolarHBondContact O-N 3Å; Y1609-C1612 PolarHBondContact O-N 3.05Å; Y1609-D1613 HydrophobicContact CE1-CB 4.44Å; Y1609-D1613 WeakPolarHBondContact O-CB 3.31Å; Y1609-D1613 PolarHBondContact O-N 3.34Å; Y1609-L1619 HydrophobicContact CE2-CD2 3.76Å; Y1609-L1619 WeakPolarHBondContact OH-CD2 3.31Å; Y1609-N1622 VanDerWaalsContact CD2-ND2 3.3Å; Y1609-N1622 WeakPolarHBondContact CD2-ND2 3.31Å; Y1609-N1622 WeakPolarHBondContact CE2-ND2 3.4Å; Y1609-N1622 PolarHBondContact O-ND2 3.23Å; Y1609-S1624 WeakPolarHBondContact CB-OG 3.34Å; Y1609-V1626 HydrophobicContact CD1-CG1 4.22Å; Y1609-V1626 HydrophobicContact CD2-CB 4.23Å; Y1609-V1626 HydrophobicContact CD2-CG1 4.18Å; Y1609-V1626 HydrophobicContact CG-CB 4.1Å; Y1609-V1626 HydrophobicContact CG-CG1 4.04Å; Y1609-R1627 HydrophobicContact CE2-CB 4.42Å; Y1609-I1630 HydrophobicContact CD1-CD1 4.19Å; Y1609-I1630 HydrophobicContact CD2-CD1 4.3Å; Y1609-I1630 HydrophobicContact CE1-CD1 3.49Å; Y1609-I1630 HydrophobicContact CE1-CG1 4.36Å; Y1609-I1630 HydrophobicContact CE2-CD1 3.63Å; Y1609-I1630 HydrophobicContact CE2-CG1 4.08Å; Y1609-I1630 WeakPolarHBondContact OH-CD1 3.33Å; Y1609-L1759 HydrophobicContact CD1-CD1 4.41Å; Y1609-L1759 HydrophobicContact CD1-CD2 3.86Å; Y1609-L1759 HydrophobicContact CE1-CD1 4.35Å; Y1609-L1759 HydrophobicContact CE1-CD2 4.39Å; Y1609-Y1763 WeakPolarHBondContact CE1-OH 3.4Å
1610	V	84.3	Confident	81.1	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-63.1	-41.2	-177.6	171.7	0	0	0	0	111.4	Y1606 V1607 C1612 D1613 L1614 L1759 L1762 Y1763 F1766	Y1606-V1610 WeakPolarHBondContact O-CG2 3.38Å; Y1606-V1610 PolarHBondContact O-N 3.13Å; Y1606-V1610 VanDerWaalsContact O-N 3.11Å; V1607-V1610 PolarHBondContact O-N 3.18Å; V1610-C1612 PolarHBondContact O-N 3.24Å; V1610-D1613 PolarHBondContact O-N 3.02Å; V1610-L1614 HydrophobicContact CG1-CD1 3.73Å; V1610-L1614 HydrophobicContact CG1-CG 4.26Å; V1610-L1614 WeakPolarHBondContact O-CB 3.25Å; V1610-L1614 VanDerWaalsContact O-CG 3.26Å; V1610-L1614 WeakPolarHBondContact O-CG 3.21Å; V1610-L1614 PolarHBondContact O-N 3.02Å; V1610-L1759 HydrophobicContact CG2-CD2 3.81Å; V1610-L1762 HydrophobicContact CG1-CB 4.47Å; V1610-L1762 HydrophobicContact CG2-CB 3.99Å; V1610-L1762 HydrophobicContact CG2-CD1 4.34Å; V1610-Y1763 HydrophobicContact CB-CE1 4.45Å; V1610-Y1763 HydrophobicContact CG1-CD1 3.82Å; V1610-Y1763 HydrophobicContact CG1-CD2 4.36Å; V1610-Y1763 HydrophobicContact CG1-CE1 3.98Å; V1610-Y1763 HydrophobicContact CG1-CE2 4.47Å; V1610-Y1763 HydrophobicContact CG1-CG 4.22Å; V1610-Y1763 HydrophobicContact CG2-CD1 4.41Å; V1610-Y1763 HydrophobicContact CG2-CD2 4.21Å; V1610-Y1763 HydrophobicContact CG2-CE1 4.35Å; V1610-Y1763 HydrophobicContact CG2-CE2 4Å; V1610-Y1763 HydrophobicContact CG2-CG 4.46Å; V1610-F1766 HydrophobicContact CG1-CB 4.36Å; V1610-F1766 HydrophobicContact CG1-CD2 3.7Å; V1610-F1766 HydrophobicContact CG1-CE2 4.27Å; V1610-F1766 HydrophobicContact CG1-CG 4.21Å
1611	I	81.4	Confident	80.2	Confident	45.8 Å²	45.8	49.3 Å²	49.3	24%	0.235	25%	0.251	C	S	.	.	H	α-helix	trans	-62.6	-46.4	176.4	-67.6	167.8	0	0	0	110.9	A839 F1187 V1607 Y1609 D1613 L1614 N1615 F1766	A839-I1611 HydrophobicContact CB-CD1 3.3Å; A839-I1611 HydrophobicContact CB-CG1 3.77Å; F1187-I1611 HydrophobicContact CE1-CG2 4.18Å; F1187-I1611 HydrophobicContact CZ-CG2 3.97Å; V1607-I1611 HydrophobicContact CG1-CD1 3.73Å; V1607-I1611 HydrophobicContact CG1-CG1 4.35Å; V1607-I1611 WeakPolarHBondContact O-CD1 3.21Å; V1607-I1611 VanDerWaalsContact O-CG1 3.31Å; V1607-I1611 WeakPolarHBondContact O-CG1 3.42Å; V1607-I1611 PolarHBondContact O-N 3.07Å; V1607-I1611 VanDerWaalsContact O-N 3.09Å; Y1609-I1611 VanDerWaalsContact C-N 3.31Å; Y1609-I1611 PolarHBondContact O-N 3Å; I1611-D1613 VanDerWaalsContact C-N 3.32Å; I1611-D1613 PolarHBondContact O-N 2.95Å; I1611-L1614 PolarHBondContact O-N 3.48Å; I1611-N1615 WeakPolarHBondContact CG2-ND2 3.23Å; I1611-N1615 WeakPolarHBondContact O-CB 3.34Å; I1611-N1615 VanDerWaalsContact O-CG 3.26Å; I1611-N1615 PolarHBondContact O-N 3.34Å; I1611-N1615 VanDerWaalsContact O-N 3.1Å; I1611-N1615 PolarHBondContact O-ND2 3.13Å; I1611-N1615 VanDerWaalsContact O-ND2 3.11Å; I1611-F1766 HydrophobicContact CD1-CE1 4.15Å; I1611-F1766 HydrophobicContact CD1-CZ 3.88Å; I1611-F1766 HydrophobicContact CG1-CE1 3.78Å; I1611-F1766 HydrophobicContact CG1-CE2 4.42Å; I1611-F1766 HydrophobicContact CG1-CZ 3.81Å
1612	C	80.1	Confident	79.3	Confident	13.4 Å²	13.4	49.1 Å²	49.1	9%	0.091	25%	0.25	C	S	.	.	H	α-helix	trans	-62.7	-42.9	178.1	-73.6	0	0	0	0	111.8	T1608 Y1609 V1610 N1615 Q1616 V1617 N1622	T1608-C1612 WeakPolarHBondContact O-CB 3.31Å; T1608-C1612 PolarHBondContact O-N 3.14Å; T1608-C1612 VanDerWaalsContact O-N 3.1Å; T1608-C1612 PolarHBondContact O-SG 2.92Å; T1608-C1612 VanDerWaalsContact O-SG 3.37Å; Y1609-C1612 PolarHBondContact O-N 3.05Å; V1610-C1612 PolarHBondContact O-N 3.24Å; C1612-N1615 CarbonylContact O-C 3.52Å; C1612-N1615 PolarHBondContact O-N 2.94Å; C1612-Q1616 PolarHBondContact O-N 3.19Å; C1612-Q1616 VanDerWaalsContact O-N 3.17Å; C1612-V1617 HydrophobicContact CB-CB 4.02Å; C1612-V1617 HydrophobicContact CB-CG1 4.41Å; C1612-V1617 HydrophobicContact CB-CG2 4.26Å; C1612-V1617 VanDerWaalsContact O-CB 3.25Å; C1612-V1617 WeakPolarHBondContact O-CB 3.33Å; C1612-V1617 VanDerWaalsContact O-CG2 3.32Å; C1612-V1617 WeakPolarHBondContact O-CG2 3.38Å; C1612-V1617 PolarHBondContact O-N 3.18Å; C1612-N1622 HydrophobicContact CB-CB 4.37Å; C1612-N1622 VanDerWaalsContact CB-ND2 3.29Å; C1612-N1622 WeakPolarHBondContact CB-ND2 3.3Å
1613	D	77.9	Confident	78.6	Confident	35.8 Å²	35.8	50.1 Å²	50.1	19%	0.191	26%	0.256	C	S	.	.	H	α-helix	trans	-67.3	-44.2	-179.6	-171.3	65.7	0	0	0	112.6	Y1609 V1610 I1611 N1615 Q1616 Y1763	Y1609-D1613 HydrophobicContact CE1-CB 4.44Å; Y1609-D1613 WeakPolarHBondContact O-CB 3.31Å; Y1609-D1613 PolarHBondContact O-N 3.34Å; V1610-D1613 PolarHBondContact O-N 3.02Å; I1611-D1613 VanDerWaalsContact C-N 3.32Å; I1611-D1613 PolarHBondContact O-N 2.95Å; D1613-N1615 VanDerWaalsContact C-N 3.26Å; D1613-N1615 PolarHBondContact O-N 3.12Å; D1613-Q1616 WeakPolarHBondContact O-CA 3.46Å; D1613-Q1616 PolarHBondContact O-N 3.33Å; D1613-Y1763 HydrophobicContact CB-CE1 4.47Å; D1613-Y1763 WeakPolarHBondContact CB-OH 3.48Å; D1613-Y1763 VanDerWaalsContact CG-OH 3.25Å; D1613-Y1763 VanDerWaalsContact OD2-CE1 3.25Å; D1613-Y1763 WeakPolarHBondContact OD2-CE1 3.37Å; D1613-Y1763 VanDerWaalsContact OD2-CZ 3.23Å; D1613-Y1763 PolarHBondContact OD2-OH 3.15Å; D1613-Y1763 VanDerWaalsContact OD2-OH 3.05Å
1614	L	79	Confident	78.2	Confident	65 Å²	65	49.4 Å²	49.4	34%	0.34	25%	0.251	S	S	.	.	H	α-helix	trans	-62	-31.2	173.9	-71.4	172.4	0	0	0	112.6	V1610 I1611 Q1616 Y1763 F1766 Q1767	V1610-L1614 HydrophobicContact CG1-CD1 3.73Å; V1610-L1614 HydrophobicContact CG1-CG 4.26Å; V1610-L1614 WeakPolarHBondContact O-CB 3.25Å; V1610-L1614 VanDerWaalsContact O-CG 3.26Å; V1610-L1614 WeakPolarHBondContact O-CG 3.21Å; V1610-L1614 PolarHBondContact O-N 3.02Å; I1611-L1614 PolarHBondContact O-N 3.48Å; L1614-Q1616 VanDerWaalsContact C-N 3.3Å; L1614-Q1616 PolarHBondContact O-N 3.23Å; L1614-Y1763 HydrophobicContact CD2-CD1 4.12Å; L1614-Y1763 HydrophobicContact CD2-CE1 4.27Å; L1614-Y1763 HydrophobicContact CG-CD1 4.3Å; L1614-Y1763 HydrophobicContact CG-CE1 4.25Å; L1614-F1766 HydrophobicContact CD1-CB 3.58Å; L1614-F1766 HydrophobicContact CD1-CD1 4.37Å; L1614-F1766 HydrophobicContact CD1-CG 4.03Å; L1614-Q1767 HydrophobicContact CD2-CG 4.27Å
1615	N	75.2	Confident	78	Confident	86.2 Å²	86.2	49.6 Å²	49.6	46%	0.461	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	14.4	172.4	-71.3	-53.6	0	0	0	113.5	F1187 N1191 I1611 C1612 D1613 V1617	F1187-N1615 HydrophobicContact CD1-CB 3.86Å; F1187-N1615 HydrophobicContact CE1-CB 4.05Å; N1191-N1615 PolarHBondContact ND2-O 3.36Å; N1191-N1615 PolarHBondContact ND2-OD1 3.5Å; I1611-N1615 WeakPolarHBondContact CG2-ND2 3.23Å; I1611-N1615 WeakPolarHBondContact O-CB 3.34Å; I1611-N1615 VanDerWaalsContact O-CG 3.26Å; I1611-N1615 PolarHBondContact O-N 3.34Å; I1611-N1615 VanDerWaalsContact O-N 3.1Å; I1611-N1615 PolarHBondContact O-ND2 3.13Å; I1611-N1615 VanDerWaalsContact O-ND2 3.11Å; C1612-N1615 CarbonylContact O-C 3.52Å; C1612-N1615 PolarHBondContact O-N 2.94Å; D1613-N1615 VanDerWaalsContact C-N 3.26Å; D1613-N1615 PolarHBondContact O-N 3.12Å; N1615-V1617 HydrophobicContact CB-CG2 4.43Å; N1615-V1617 PolarHBondContact O-N 3.21Å; N1615-V1617 VanDerWaalsContact O-N 3.14Å
1616	Q	73.7	Confident	77.8	Confident	172.8 Å²	172.8	48.1 Å²	48.1	81%	0.807	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.7	23.5	176.1	-52.2	-176.3	8.8	0	0	114.6	C1612 D1613 L1614 R1618	C1612-Q1616 PolarHBondContact O-N 3.19Å; C1612-Q1616 VanDerWaalsContact O-N 3.17Å; D1613-Q1616 WeakPolarHBondContact O-CA 3.46Å; D1613-Q1616 PolarHBondContact O-N 3.33Å; L1614-Q1616 VanDerWaalsContact C-N 3.3Å; L1614-Q1616 PolarHBondContact O-N 3.23Å; Q1616-R1618 PolarHBondContact O-N 3.25Å; Q1616-R1618 VanDerWaalsContact O-N 3.09Å
1617	V	69.4	Low	77.4	Confident	29.4 Å²	29.4	51.8 Å²	51.8	18%	0.178	26%	0.257	C	S	.	.			trans	-68.5	116.7	173.5	-179.4	0	0	0	0	108.7	I1186 F1187 A1190 C1612 N1615 L1619 L1621 N1622	I1186-V1617 WeakPolarHBondContact O-CG2 3.35Å; F1187-V1617 HydrophobicContact CD1-CG2 4.3Å; A1190-V1617 HydrophobicContact CB-CB 4.38Å; A1190-V1617 HydrophobicContact CB-CG1 3.8Å; A1190-V1617 HydrophobicContact CB-CG2 4.31Å; C1612-V1617 HydrophobicContact CB-CB 4.02Å; C1612-V1617 HydrophobicContact CB-CG1 4.41Å; C1612-V1617 HydrophobicContact CB-CG2 4.26Å; C1612-V1617 VanDerWaalsContact O-CB 3.25Å; C1612-V1617 WeakPolarHBondContact O-CB 3.33Å; C1612-V1617 VanDerWaalsContact O-CG2 3.32Å; C1612-V1617 WeakPolarHBondContact O-CG2 3.38Å; C1612-V1617 PolarHBondContact O-N 3.18Å; N1615-V1617 HydrophobicContact CB-CG2 4.43Å; N1615-V1617 PolarHBondContact O-N 3.21Å; N1615-V1617 VanDerWaalsContact O-N 3.14Å; V1617-L1619 PolarHBondContact O-N 3.06Å; V1617-L1621 HydrophobicContact CG1-CB 4.11Å; V1617-N1622 HydrophobicContact CG1-CB 4.13Å
1618	R	66.4	Low	77	Confident	164.2 Å²	164.2	54.4 Å²	54.4	62%	0.62	27%	0.269	S	S	*	.			trans	-52.8	138.2	-179.5	-58.2	179.9	-176.1	159.7	2.6	110.9	Q1616 N1620 L1621 N1622	Q1616-R1618 PolarHBondContact O-N 3.25Å; Q1616-R1618 VanDerWaalsContact O-N 3.09Å; R1618-N1620 VanDerWaalsContact CB-OD1 3.23Å; R1618-N1620 WeakPolarHBondContact CB-OD1 3.39Å; R1618-N1620 PolarHBondContact O-N 3.35Å; R1618-N1620 VanDerWaalsContact O-N 3.08Å; R1618-L1621 HydrophobicContact CB-CB 4.45Å; R1618-L1621 HydrophobicContact CB-CD1 4.24Å; R1618-L1621 HydrophobicContact CB-CG 4.39Å; R1618-L1621 HydrophobicContact CG-CD1 4.39Å; R1618-L1621 CarbonylContact O-C 3.38Å; R1618-L1621 WeakPolarHBondContact O-CA 3.39Å; R1618-L1621 WeakPolarHBondContact O-CB 3.34Å; R1618-L1621 PolarHBondContact O-N 3.12Å; R1618-N1622 PolarHBondContact O-N 3.01Å; R1618-N1622 VanDerWaalsContact O-N 3.16Å
1619	L	67.1	Low	76.9	Confident	30 Å²	30	52.5 Å²	52.5	16%	0.157	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.2	-31.6	-175.6	-84.5	162.1	0	0	0	115.2	V1554 S1557 L1558 Y1609 V1617 L1621 N1622 R1627 I1630 K1631	V1554-L1619 HydrophobicContact CB-CD1 3.89Å; V1554-L1619 HydrophobicContact CB-CG 4.41Å; V1554-L1619 HydrophobicContact CG1-CD1 3.93Å; V1554-L1619 HydrophobicContact CG1-CG 4.2Å; V1554-L1619 HydrophobicContact CG2-CD1 3.82Å; V1554-L1619 HydrophobicContact CG2-CD2 4.19Å; V1554-L1619 HydrophobicContact CG2-CG 3.97Å; S1557-L1619 WeakPolarHBondContact OG-CD1 3.46Å; S1557-L1619 WeakPolarHBondContact OG-CG 3.12Å; L1558-L1619 HydrophobicContact CD1-CD1 4.22Å; L1558-L1619 HydrophobicContact CD2-CD1 4.13Å; L1558-L1619 HydrophobicContact CG-CD1 4.17Å; Y1609-L1619 HydrophobicContact CE2-CD2 3.76Å; Y1609-L1619 WeakPolarHBondContact OH-CD2 3.31Å; V1617-L1619 PolarHBondContact O-N 3.06Å; L1619-L1621 VanDerWaalsContact C-N 3.31Å; L1619-L1621 PolarHBondContact O-N 3.39Å; L1619-N1622 PolarHBondContact O-N 3.19Å; L1619-R1627 HydrophobicContact CG-CB 4.47Å; L1619-I1630 HydrophobicContact CD1-CG2 4.04Å; L1619-K1631 HydrophobicContact CD2-CG 4.23Å
1620	N	66.4	Low	76.6	Confident	68.2 Å²	68.2	52.9 Å²	52.9	37%	0.365	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-23.4	177.3	23.4	-29.6	0	0	0	113.6	F1561 R1618 R1627 K1631	F1561-N1620 HydrophobicContact CD1-CB 4.44Å; F1561-N1620 VanDerWaalsContact CD1-ND2 3.32Å; F1561-N1620 WeakPolarHBondContact CD1-ND2 3.46Å; F1561-N1620 HydrophobicContact CD2-CB 3.83Å; F1561-N1620 HydrophobicContact CE1-CB 4.36Å; F1561-N1620 HydrophobicContact CE2-CB 3.98Å; F1561-N1620 WeakPolarHBondContact CZ-ND2 3.47Å; R1618-N1620 VanDerWaalsContact CB-OD1 3.23Å; R1618-N1620 WeakPolarHBondContact CB-OD1 3.39Å; R1618-N1620 PolarHBondContact O-N 3.35Å; R1618-N1620 VanDerWaalsContact O-N 3.08Å; N1620-R1627 PolarHBondContact O-NH1 3.07Å; N1620-R1627 VanDerWaalsContact O-NH1 3.1Å; N1620-K1631 PolarHBondContact OD1-NZ 3Å; N1620-K1631 VanDerWaalsContact OD1-NZ 3.08Å
1621	L	69.2	Low	76.2	Confident	81.6 Å²	81.6	55.7 Å²	55.7	43%	0.427	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.3	-16.4	179.2	-61	170	0	0	0	112.3	R1189 A1190 V1617 R1618 L1619 P1623	R1189-L1621 HydrophobicContact CB-CB 4.21Å; R1189-L1621 HydrophobicContact CB-CD1 4.33Å; R1189-L1621 HydrophobicContact CB-CD2 4.36Å; R1189-L1621 WeakPolarHBondContact O-CD1 3.08Å; A1190-L1621 HydrophobicContact CB-CB 4.06Å; A1190-L1621 HydrophobicContact CB-CD1 3.78Å; V1617-L1621 HydrophobicContact CG1-CB 4.11Å; R1618-L1621 HydrophobicContact CB-CB 4.45Å; R1618-L1621 HydrophobicContact CB-CD1 4.24Å; R1618-L1621 HydrophobicContact CB-CG 4.39Å; R1618-L1621 HydrophobicContact CG-CD1 4.39Å; R1618-L1621 CarbonylContact O-C 3.38Å; R1618-L1621 WeakPolarHBondContact O-CA 3.39Å; R1618-L1621 WeakPolarHBondContact O-CB 3.34Å; R1618-L1621 PolarHBondContact O-N 3.12Å; L1619-L1621 VanDerWaalsContact C-N 3.31Å; L1619-L1621 PolarHBondContact O-N 3.39Å; L1621-P1623 WeakPolarHBondContact O-CD 3.44Å
1622	N	71.2	Confident	75.9	Confident	0.2 Å²	0.2	53.7 Å²	53.7	0%	0.001	26%	0.261	C	S	.	.			trans	-61.5	123.4	173.8	-171.9	-32.2	0	0	0	109.3	Y1609 C1612 V1617 R1618 L1619 S1624 R1627	Y1609-N1622 VanDerWaalsContact CD2-ND2 3.3Å; Y1609-N1622 WeakPolarHBondContact CD2-ND2 3.31Å; Y1609-N1622 WeakPolarHBondContact CE2-ND2 3.4Å; Y1609-N1622 PolarHBondContact O-ND2 3.23Å; C1612-N1622 HydrophobicContact CB-CB 4.37Å; C1612-N1622 VanDerWaalsContact CB-ND2 3.29Å; C1612-N1622 WeakPolarHBondContact CB-ND2 3.3Å; V1617-N1622 HydrophobicContact CG1-CB 4.13Å; R1618-N1622 PolarHBondContact O-N 3.01Å; R1618-N1622 VanDerWaalsContact O-N 3.16Å; L1619-N1622 PolarHBondContact O-N 3.19Å; N1622-S1624 VanDerWaalsContact C-N 3.29Å; N1622-S1624 PolarHBondContact O-N 3.23Å; N1622-S1624 VanDerWaalsContact OD1-CB 3.29Å; N1622-S1624 WeakPolarHBondContact OD1-CB 3.29Å; N1622-S1624 PolarHBondContact OD1-N 3.14Å; N1622-S1624 VanDerWaalsContact OD1-N 3.11Å; N1622-R1627 VanDerWaalsContact O-CD 3.28Å; N1622-R1627 WeakPolarHBondContact O-CD 3.3Å; N1622-R1627 PolarHBondContact O-NH1 3.16Å
1623	P	76.1	Confident	75.7	Confident	77.2 Å²	77.2	53.9 Å²	53.9	50%	0.501	26%	0.261	S	S	.	.			trans	-75.4	-19.7	-176.4	30.6	-35.9	0	0	0	113.3	T1608 L1621 Q1625	T1608-P1623 HydrophobicContact CG2-CG 4.23Å; L1621-P1623 WeakPolarHBondContact O-CD 3.44Å; P1623-Q1625 PolarHBondContact O-N 2.89Å
1624	S	79.7	Confident	75.2	Confident	0.4 Å²	0.4	53.2 Å²	53.2	0%	0.003	26%	0.26	C	S	.	.			trans	-63.3	135.6	-175.7	170.9	0	0	0	0	112.5	D1605 Y1609 N1622 V1626 R1627	D1605-S1624 VanDerWaalsContact O-CB 3.31Å; D1605-S1624 WeakPolarHBondContact O-CB 3.32Å; D1605-S1624 PolarHBondContact O-OG 3.04Å; Y1609-S1624 WeakPolarHBondContact CB-OG 3.34Å; N1622-S1624 VanDerWaalsContact C-N 3.29Å; N1622-S1624 PolarHBondContact O-N 3.23Å; N1622-S1624 VanDerWaalsContact OD1-CB 3.29Å; N1622-S1624 WeakPolarHBondContact OD1-CB 3.29Å; N1622-S1624 PolarHBondContact OD1-N 3.14Å; N1622-S1624 VanDerWaalsContact OD1-N 3.11Å; S1624-V1626 PolarHBondContact O-N 3.19Å; S1624-V1626 WeakPolarHBondContact OG-CB 3.18Å; S1624-V1626 WeakPolarHBondContact OG-CG2 3.41Å; S1624-V1626 PolarHBondContact OG-N 3.08Å; S1624-V1626 VanDerWaalsContact OG-N 3.15Å; S1624-R1627 WeakPolarHBondContact O-CB 3.35Å; S1624-R1627 VanDerWaalsContact O-CD 3.27Å; S1624-R1627 WeakPolarHBondContact O-CD 3.35Å; S1624-R1627 WeakPolarHBondContact O-CG 3.38Å; S1624-R1627 PolarHBondContact O-N 2.93Å
1625	Q	84	Confident	74.7	Confident	86.6 Å²	86.6	51.1 Å²	51.1	41%	0.405	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-18.6	175.7	-61.6	-153.8	67.7	0	0	113.4	S1600 I1601 D1605 P1623 R1627 M1628	S1600-Q1625 PolarHBondContact O-NE2 3.02Å; S1600-Q1625 VanDerWaalsContact O-NE2 3.11Å; I1601-Q1625 HydrophobicContact CB-CB 4.48Å; I1601-Q1625 HydrophobicContact CD1-CB 4.2Å; I1601-Q1625 HydrophobicContact CG1-CB 3.79Å; I1601-Q1625 HydrophobicContact CG2-CB 4.35Å; D1605-Q1625 PolarHBondContact OD1-N 3.03Å; D1605-Q1625 PolarHBondContact OD2-NE2 3.19Å; P1623-Q1625 PolarHBondContact O-N 2.89Å; Q1625-R1627 PolarHBondContact O-N 3.37Å; Q1625-M1628 VanDerWaalsContact O-CB 3.26Å; Q1625-M1628 WeakPolarHBondContact O-CB 3.37Å; Q1625-M1628 WeakPolarHBondContact O-CG 3.21Å; Q1625-M1628 PolarHBondContact O-N 3.1Å; Q1625-M1628 PolarHBondContact OE1-SD 2.99Å; Q1625-M1628 VanDerWaalsContact OE1-SD 3.36Å
1626	V	84.1	Confident	74	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-56.8	-24.9	175.5	177.3	0	0	0	0	112.2	I1601 D1605 Y1606 Y1609 S1624 M1628 L1629 I1630 L1759	I1601-V1626 HydrophobicContact CG2-CG2 3.74Å; D1605-V1626 HydrophobicContact CB-CG2 4.09Å; Y1606-V1626 HydrophobicContact CD1-CG1 4.48Å; Y1606-V1626 HydrophobicContact CD1-CG2 4.16Å; Y1606-V1626 HydrophobicContact CD2-CG2 3.76Å; Y1606-V1626 HydrophobicContact CE1-CG1 4.46Å; Y1606-V1626 HydrophobicContact CE1-CG2 4.33Å; Y1606-V1626 HydrophobicContact CE2-CG2 3.94Å; Y1606-V1626 HydrophobicContact CG-CG2 3.88Å; Y1609-V1626 HydrophobicContact CD1-CG1 4.22Å; Y1609-V1626 HydrophobicContact CD2-CB 4.23Å; Y1609-V1626 HydrophobicContact CD2-CG1 4.18Å; Y1609-V1626 HydrophobicContact CG-CB 4.1Å; Y1609-V1626 HydrophobicContact CG-CG1 4.04Å; S1624-V1626 PolarHBondContact O-N 3.19Å; S1624-V1626 WeakPolarHBondContact OG-CB 3.18Å; S1624-V1626 WeakPolarHBondContact OG-CG2 3.41Å; S1624-V1626 PolarHBondContact OG-N 3.08Å; S1624-V1626 VanDerWaalsContact OG-N 3.15Å; V1626-M1628 PolarHBondContact O-N 3.15Å; V1626-M1628 VanDerWaalsContact O-N 3.1Å; V1626-L1629 WeakPolarHBondContact O-CB 3.3Å; V1626-L1629 PolarHBondContact O-N 3.22Å; V1626-L1629 VanDerWaalsContact O-N 3.12Å; V1626-I1630 HydrophobicContact CG1-CD1 4Å; V1626-I1630 HydrophobicContact CG1-CG1 4.31Å; V1626-I1630 WeakPolarHBondContact O-CG1 3.32Å; V1626-I1630 PolarHBondContact O-N 3.15Å; V1626-I1630 VanDerWaalsContact O-N 3.09Å; V1626-L1759 HydrophobicContact CG1-CD1 4.12Å; V1626-L1759 HydrophobicContact CG1-CD2 4.34Å
1627	R	80.8	Confident	73.4	Confident	77.8 Å²	77.8	39.1 Å²	39.1	29%	0.294	19%	0.19	S	C	.	.	H	α-helix	trans	-55.3	-25	171.1	77.3	-166	-179.6	160.8	5	113.5	Y1609 L1619 N1620 N1622 S1624 Q1625 K1631	Y1609-R1627 HydrophobicContact CE2-CB 4.42Å; L1619-R1627 HydrophobicContact CG-CB 4.47Å; N1620-R1627 PolarHBondContact O-NH1 3.07Å; N1620-R1627 VanDerWaalsContact O-NH1 3.1Å; N1622-R1627 VanDerWaalsContact O-CD 3.28Å; N1622-R1627 WeakPolarHBondContact O-CD 3.3Å; N1622-R1627 PolarHBondContact O-NH1 3.16Å; S1624-R1627 WeakPolarHBondContact O-CB 3.35Å; S1624-R1627 VanDerWaalsContact O-CD 3.27Å; S1624-R1627 WeakPolarHBondContact O-CD 3.35Å; S1624-R1627 WeakPolarHBondContact O-CG 3.38Å; S1624-R1627 PolarHBondContact O-N 2.93Å; Q1625-R1627 PolarHBondContact O-N 3.37Å; R1627-K1631 VanDerWaalsContact O-CB 3.25Å; R1627-K1631 WeakPolarHBondContact O-CB 3.29Å; R1627-K1631 WeakPolarHBondContact O-CD 3.32Å; R1627-K1631 VanDerWaalsContact O-CG 3.28Å; R1627-K1631 WeakPolarHBondContact O-CG 3.41Å; R1627-K1631 PolarHBondContact O-N 3.22Å; R1627-K1631 VanDerWaalsContact O-N 3.1Å
1628	M	80.7	Confident	72.5	Confident	65 Å²	65	39.7 Å²	39.7	32%	0.32	19%	0.194	S	C	.	.	H	α-helix	trans	-74.7	-43.9	176.3	-62.9	-102.1	-26.8	0	0	111.7	L1568 L1597 Q1625 V1626 I1630 K1631 R1632	L1568-M1628 HydrophobicContact CD1-CE 4.01Å; L1568-M1628 HydrophobicContact CD1-SD 4.23Å; L1597-M1628 HydrophobicContact CD2-CE 3.89Å; Q1625-M1628 VanDerWaalsContact O-CB 3.26Å; Q1625-M1628 WeakPolarHBondContact O-CB 3.37Å; Q1625-M1628 WeakPolarHBondContact O-CG 3.21Å; Q1625-M1628 PolarHBondContact O-N 3.1Å; Q1625-M1628 PolarHBondContact OE1-SD 2.99Å; Q1625-M1628 VanDerWaalsContact OE1-SD 3.36Å; V1626-M1628 PolarHBondContact O-N 3.15Å; V1626-M1628 VanDerWaalsContact O-N 3.1Å; M1628-I1630 VanDerWaalsContact C-N 3.32Å; M1628-I1630 PolarHBondContact O-N 3.27Å; M1628-K1631 PolarHBondContact O-N 3.06Å; M1628-K1631 VanDerWaalsContact O-N 3.13Å; M1628-R1632 WeakPolarHBondContact O-CB 3.46Å; M1628-R1632 PolarHBondContact O-N 3.18Å
1629	L	82.6	Confident	71.4	Confident	1.8 Å²	1.8	37 Å²	37	1%	0.009	18%	0.184	C	C	.	.	H	α-helix	trans	-60.4	-44.4	172.1	-68.2	176.2	0	0	0	110.9	L1597 V1598 I1601 Y1606 V1626 K1631 R1632 F1633 F1755	L1597-L1629 HydrophobicContact CB-CD2 3.99Å; V1598-L1629 HydrophobicContact CG2-CD1 4.16Å; V1598-L1629 HydrophobicContact CG2-CD2 3.75Å; I1601-L1629 HydrophobicContact CD1-CD1 3.62Å; I1601-L1629 VanDerWaalsContact CD1-CD1 3.5Å; I1601-L1629 HydrophobicContact CD1-CD2 4.28Å; I1601-L1629 HydrophobicContact CD1-CG 3.6Å; I1601-L1629 VanDerWaalsContact CD1-CG 3.47Å; Y1606-L1629 WeakPolarHBondContact OH-CD1 3.47Å; V1626-L1629 WeakPolarHBondContact O-CB 3.3Å; V1626-L1629 PolarHBondContact O-N 3.22Å; V1626-L1629 VanDerWaalsContact O-N 3.12Å; L1629-K1631 VanDerWaalsContact C-N 3.31Å; L1629-K1631 PolarHBondContact O-N 3.19Å; L1629-R1632 PolarHBondContact O-N 3.23Å; L1629-R1632 VanDerWaalsContact O-N 3.16Å; L1629-F1633 VanDerWaalsContact O-CB 3.27Å; L1629-F1633 WeakPolarHBondContact O-CB 3.36Å; L1629-F1633 PolarHBondContact O-N 3.16Å; L1629-F1755 HydrophobicContact CB-CD1 4.1Å; L1629-F1755 HydrophobicContact CB-CD2 4.39Å; L1629-F1755 HydrophobicContact CB-CE1 4.07Å; L1629-F1755 HydrophobicContact CB-CE2 4.37Å; L1629-F1755 HydrophobicContact CB-CG 4.29Å; L1629-F1755 HydrophobicContact CB-CZ 4.21Å; L1629-F1755 HydrophobicContact CD1-CB 3.95Å; L1629-F1755 HydrophobicContact CD1-CD1 4.22Å; L1629-F1755 HydrophobicContact CD1-CD2 4.39Å; L1629-F1755 HydrophobicContact CD1-CG 3.97Å; L1629-F1755 HydrophobicContact CD2-CD1 4.44Å
1630	I	80	Confident	70.2	Confident	9.4 Å²	9.4	41.5 Å²	41.5	5%	0.048	20%	0.199	C	C	.	.	H	α-helix	trans	-64	-38.7	177.8	-66.1	176.2	0	0	0	111.5	L1552 F1553 Y1609 L1619 V1626 M1628 A1634 F1755 L1759	L1552-I1630 HydrophobicContact CD2-CD1 4.27Å; L1552-I1630 HydrophobicContact CD2-CG1 4.13Å; F1553-I1630 HydrophobicContact CD1-CD1 4.41Å; F1553-I1630 HydrophobicContact CD1-CG2 3.94Å; F1553-I1630 VanDerWaalsContact CD1-CG2 3.4Å; F1553-I1630 HydrophobicContact CE1-CB 4.27Å; F1553-I1630 HydrophobicContact CE1-CD1 3.66Å; F1553-I1630 HydrophobicContact CE1-CG1 3.73Å; F1553-I1630 HydrophobicContact CE1-CG2 3.58Å; F1553-I1630 HydrophobicContact CE2-CD1 4.29Å; F1553-I1630 HydrophobicContact CZ-CD1 3.82Å; F1553-I1630 HydrophobicContact CZ-CG1 4.14Å; F1553-I1630 HydrophobicContact CZ-CG2 4.3Å; Y1609-I1630 HydrophobicContact CD1-CD1 4.19Å; Y1609-I1630 HydrophobicContact CD2-CD1 4.3Å; Y1609-I1630 HydrophobicContact CE1-CD1 3.49Å; Y1609-I1630 HydrophobicContact CE1-CG1 4.36Å; Y1609-I1630 HydrophobicContact CE2-CD1 3.63Å; Y1609-I1630 HydrophobicContact CE2-CG1 4.08Å; Y1609-I1630 WeakPolarHBondContact OH-CD1 3.33Å; L1619-I1630 HydrophobicContact CD1-CG2 4.04Å; V1626-I1630 HydrophobicContact CG1-CD1 4Å; V1626-I1630 HydrophobicContact CG1-CG1 4.31Å; V1626-I1630 WeakPolarHBondContact O-CG1 3.32Å; V1626-I1630 PolarHBondContact O-N 3.15Å; V1626-I1630 VanDerWaalsContact O-N 3.09Å; M1628-I1630 VanDerWaalsContact C-N 3.32Å; M1628-I1630 PolarHBondContact O-N 3.27Å; I1630-A1634 VanDerWaalsContact O-CB 3.25Å; I1630-A1634 WeakPolarHBondContact O-CB 3.23Å; I1630-A1634 PolarHBondContact O-N 3.19Å; I1630-F1755 HydrophobicContact CD1-CD2 4.17Å; I1630-F1755 HydrophobicContact CD1-CE2 3.27Å; I1630-F1755 HydrophobicContact CD1-CZ 3.81Å; I1630-F1755 HydrophobicContact CG1-CE2 3.81Å; I1630-F1755 HydrophobicContact CG1-CZ 4.29Å; I1630-L1759 HydrophobicContact CD1-CD1 4.06Å; I1630-L1759 HydrophobicContact CG1-CD1 4.45Å
1631	K	75.6	Confident	69	Low	59 Å²	59	40.4 Å²	40.4	26%	0.257	20%	0.195	S	C	.	.	H	α-helix	trans	-65.1	-44.4	173.5	-114	176.6	-179.8	-176.6	0	111.6	S1565 L1568 L1619 N1620 R1627 M1628 L1629 A1634 E1635	S1565-K1631 PolarHBondContact OG-NZ 2.98Å; L1568-K1631 HydrophobicContact CD1-CD 4.21Å; L1619-K1631 HydrophobicContact CD2-CG 4.23Å; N1620-K1631 PolarHBondContact OD1-NZ 3Å; N1620-K1631 VanDerWaalsContact OD1-NZ 3.08Å; R1627-K1631 VanDerWaalsContact O-CB 3.25Å; R1627-K1631 WeakPolarHBondContact O-CB 3.29Å; R1627-K1631 WeakPolarHBondContact O-CD 3.32Å; R1627-K1631 VanDerWaalsContact O-CG 3.28Å; R1627-K1631 WeakPolarHBondContact O-CG 3.41Å; R1627-K1631 PolarHBondContact O-N 3.22Å; R1627-K1631 VanDerWaalsContact O-N 3.1Å; M1628-K1631 PolarHBondContact O-N 3.06Å; M1628-K1631 VanDerWaalsContact O-N 3.13Å; L1629-K1631 VanDerWaalsContact C-N 3.31Å; L1629-K1631 PolarHBondContact O-N 3.19Å; K1631-A1634 WeakPolarHBondContact O-CA 3.46Å; K1631-A1634 WeakPolarHBondContact O-CB 3.3Å; K1631-A1634 PolarHBondContact O-N 3.3Å; K1631-A1634 VanDerWaalsContact O-N 3.13Å; K1631-E1635 VanDerWaalsContact CE-OE1 3.26Å; K1631-E1635 WeakPolarHBondContact CE-OE1 3.49Å; K1631-E1635 WeakPolarHBondContact O-CB 3.38Å; K1631-E1635 WeakPolarHBondContact O-CG 3.42Å; K1631-E1635 PolarHBondContact O-N 3.31Å
1632	R	75	Confident	68.1	Low	4.2 Å²	4.2	37.8 Å²	37.8	2%	0.016	18%	0.183	C	C	.	.	H	α-helix	trans	-61.1	-54.4	175.7	-177.9	176.7	179.4	90.7	-3	111.2	Y1569 E1572 L1590 E1594 L1597 M1628 L1629 A1634 E1635 V1636	Y1569-R1632 HydrophobicContact CD2-CB 4.17Å; Y1569-R1632 HydrophobicContact CD2-CG 4.41Å; Y1569-R1632 HydrophobicContact CE2-CB 3.9Å; Y1569-R1632 HydrophobicContact CE2-CG 4.42Å; E1572-R1632 VanDerWaalsContact CD-NH1 3.26Å; E1572-R1632 IonicContact OE1-CZ 2.96Å; E1572-R1632 VanDerWaalsContact OE1-CZ 3.27Å; E1572-R1632 IonicContact OE1-NH1 3.09Å; E1572-R1632 PolarHBondContact OE1-NH1 2.98Å; E1572-R1632 IonicContact OE1-NH2 3.33Å; E1572-R1632 PolarHBondContact OE1-NH2 3.14Å; E1572-R1632 IonicContact OE2-CZ 2.73Å; E1572-R1632 IonicContact OE2-NH1 3.01Å; E1572-R1632 PolarHBondContact OE2-NH1 3.08Å; E1572-R1632 IonicContact OE2-NH2 2.76Å; L1590-R1632 PolarHBondContact O-NH2 3.27Å; E1594-R1632 VanDerWaalsContact CG-NE 3.32Å; E1594-R1632 IonicContact OE1-CZ 3.12Å; E1594-R1632 IonicContact OE1-NE 3Å; E1594-R1632 PolarHBondContact OE1-NE 2.7Å; E1594-R1632 IonicContact OE1-NH2 3.1Å; E1594-R1632 PolarHBondContact OE1-NH2 3.42Å; L1597-R1632 VanDerWaalsContact CD1-CD 3.5Å; M1628-R1632 WeakPolarHBondContact O-CB 3.46Å; M1628-R1632 PolarHBondContact O-N 3.18Å; L1629-R1632 PolarHBondContact O-N 3.23Å; L1629-R1632 VanDerWaalsContact O-N 3.16Å; R1632-A1634 VanDerWaalsContact C-N 3.28Å; R1632-A1634 PolarHBondContact O-N 3.19Å; R1632-E1635 CarbonylContact O-C 3.46Å; R1632-E1635 WeakPolarHBondContact O-CB 3.11Å; R1632-E1635 PolarHBondContact O-N 3.03Å; R1632-V1636 HydrophobicContact CG-CG2 4.15Å; R1632-V1636 WeakPolarHBondContact O-CB 3.39Å; R1632-V1636 VanDerWaalsContact O-CG2 3.31Å; R1632-V1636 WeakPolarHBondContact O-CG2 3.19Å; R1632-V1636 PolarHBondContact O-N 2.95Å
1633	F	76	Confident	67.6	Low	16.8 Å²	16.8	38.2 Å²	38.2	7%	0.074	19%	0.186	C	C	.	.	H	α-helix	trans	-53.9	-40.2	176.4	-173.4	-86	0	0	0	111.6	L1629 V1636 S1637 T1638 E1683 Y1686 F1754 F1755	L1629-F1633 VanDerWaalsContact O-CB 3.27Å; L1629-F1633 WeakPolarHBondContact O-CB 3.36Å; L1629-F1633 PolarHBondContact O-N 3.16Å; F1633-V1636 PolarHBondContact O-N 3.19Å; F1633-S1637 VanDerWaalsContact CD1-OG 3.23Å; F1633-S1637 WeakPolarHBondContact CD1-OG 3.31Å; F1633-S1637 VanDerWaalsContact CE1-OG 3.26Å; F1633-S1637 WeakPolarHBondContact CE1-OG 3.24Å; F1633-S1637 VanDerWaalsContact CZ-OG 3.27Å; F1633-S1637 WeakPolarHBondContact CZ-OG 3.36Å; F1633-S1637 VanDerWaalsContact O-CB 3.25Å; F1633-S1637 WeakPolarHBondContact O-CB 3.41Å; F1633-S1637 PolarHBondContact O-N 3.17Å; F1633-S1637 PolarHBondContact O-OG 3.04Å; F1633-T1638 HydrophobicContact CD1-CG2 3.89Å; F1633-T1638 HydrophobicContact CE1-CG2 4.01Å; F1633-T1638 PolarHBondContact O-OG1 3.44Å; F1633-E1683 HydrophobicContact CB-CG 4.42Å; F1633-E1683 HydrophobicContact CD2-CB 4.18Å; F1633-E1683 HydrophobicContact CD2-CG 3.33Å; F1633-E1683 WeakPolarHBondContact CD2-OE1 3.27Å; F1633-E1683 HydrophobicContact CE2-CB 4.42Å; F1633-E1683 HydrophobicContact CE2-CG 3.66Å; F1633-E1683 VanDerWaalsContact CE2-CG 3.45Å; F1633-E1683 HydrophobicContact CG-CG 4.1Å; F1633-E1683 HydrophobicContact CZ-CG 4.46Å; F1633-Y1686 HydrophobicContact CE2-CD2 4.34Å; F1633-Y1686 AromaticContact CZ-CD2 3.8Å; F1633-Y1686 HydrophobicContact CZ-CD2 3.8Å; F1633-Y1686 HydrophobicContact CZ-CE2 4.35Å; F1633-Y1686 AromaticContact CZ-CG 4Å; F1633-Y1686 HydrophobicContact CZ-CG 4.21Å; F1633-F1754 HydrophobicContact CD2-CE2 4.16Å; F1633-F1754 HydrophobicContact CE2-CD2 4.38Å; F1633-F1754 AromaticContact CE2-CE2 3.57Å; F1633-F1754 HydrophobicContact CE2-CE2 3.57Å; F1633-F1754 VanDerWaalsContact CE2-CE2 3.5Å; F1633-F1754 HydrophobicContact CE2-CZ 4.16Å; F1633-F1754 HydrophobicContact CZ-CE2 4.19Å; F1633-F1754 HydrophobicContact CZ-CZ 4.43Å; F1633-F1755 HydrophobicContact CB-CE1 3.9Å; F1633-F1755 HydrophobicContact CB-CZ 3.71Å; F1633-F1755 AromaticContact CD2-CE1 3.7Å; F1633-F1755 HydrophobicContact CD2-CE1 3.79Å; F1633-F1755 AromaticContact CD2-CZ 3.88Å; F1633-F1755 HydrophobicContact CD2-CZ 3.94Å; F1633-F1755 HydrophobicContact CG-CE1 4.1Å; F1633-F1755 AromaticContact CG-CZ 3.84Å; F1633-F1755 HydrophobicContact CG-CZ 3.88Å
1634	A	67.8	Low	67.2	Low	21.2 Å²	21.2	35.4 Å²	35.4	18%	0.175	17%	0.165	C	C	.	.	H	α-helix	trans	-67.8	-41.7	175.9	0	0	0	0	0	113.2	I1630 K1631 R1632 T1638 R1639	I1630-A1634 VanDerWaalsContact O-CB 3.25Å; I1630-A1634 WeakPolarHBondContact O-CB 3.23Å; I1630-A1634 PolarHBondContact O-N 3.19Å; K1631-A1634 WeakPolarHBondContact O-CA 3.46Å; K1631-A1634 WeakPolarHBondContact O-CB 3.3Å; K1631-A1634 PolarHBondContact O-N 3.3Å; K1631-A1634 VanDerWaalsContact O-N 3.13Å; R1632-A1634 VanDerWaalsContact C-N 3.28Å; R1632-A1634 PolarHBondContact O-N 3.19Å; A1634-T1638 VanDerWaalsContact CA-CG2 3.49Å; A1634-T1638 VanDerWaalsContact CA-OG1 3.23Å; A1634-T1638 WeakPolarHBondContact CA-OG1 3.41Å; A1634-T1638 HydrophobicContact CB-CG2 4.06Å; A1634-T1638 WeakPolarHBondContact CB-OG1 3.45Å; A1634-T1638 CarbonylContact O-C 3.56Å; A1634-T1638 PolarHBondContact O-N 3.08Å; A1634-T1638 PolarHBondContact O-OG1 3.1Å; A1634-R1639 HydrophobicContact CB-CB 4.5Å; A1634-R1639 WeakPolarHBondContact O-CB 3.43Å; A1634-R1639 PolarHBondContact O-N 3.11Å
1635	E	66.8	Low	66.7	Low	20.6 Å²	20.6	35.5 Å²	35.5	10%	0.096	17%	0.166	C	C	.	.	H	α-helix	trans	-65.4	-39.3	177.1	-87.4	176.4	-168.1	0	0	111.9	T1567 L1568 Y1569 S1570 L1573 K1631 R1632 R1639 R1640 W1644	T1567-E1635 WeakPolarHBondContact CA-OE1 3.33Å; T1567-E1635 HydrophobicContact CG2-CG 4.29Å; T1567-E1635 WeakPolarHBondContact CG2-OE1 3.45Å; L1568-E1635 PolarHBondContact N-OE1 2.8Å; L1568-E1635 PolarHBondContact N-OE2 3.38Å; L1568-E1635 VanDerWaalsContact N-OE2 3.12Å; Y1569-E1635 PolarHBondContact N-OE2 3.22Å; Y1569-E1635 VanDerWaalsContact N-OE2 3.07Å; S1570-E1635 PolarHBondContact N-OE2 3.18Å; L1573-E1635 HydrophobicContact CD1-CB 4.3Å; K1631-E1635 VanDerWaalsContact CE-OE1 3.26Å; K1631-E1635 WeakPolarHBondContact CE-OE1 3.49Å; K1631-E1635 WeakPolarHBondContact O-CB 3.38Å; K1631-E1635 WeakPolarHBondContact O-CG 3.42Å; K1631-E1635 PolarHBondContact O-N 3.31Å; R1632-E1635 CarbonylContact O-C 3.46Å; R1632-E1635 WeakPolarHBondContact O-CB 3.11Å; R1632-E1635 PolarHBondContact O-N 3.03Å; E1635-R1639 IonicContact OE1-NH1 3.26Å; E1635-R1639 PolarHBondContact OE1-NH1 3.26Å; E1635-R1640 HydrophobicContact CG-CG 4.3Å; E1635-R1640 WeakPolarHBondContact O-CA 3.46Å; E1635-R1640 WeakPolarHBondContact O-CB 3.31Å; E1635-R1640 WeakPolarHBondContact O-CG 3.37Å; E1635-R1640 PolarHBondContact O-N 3.46Å; E1635-R1640 IonicContact OE1-CZ 2.84Å; E1635-R1640 IonicContact OE1-NH1 3.85Å; E1635-R1640 PolarHBondContact OE1-NH1 3.43Å; E1635-R1640 IonicContact OE1-NH2 3.99Å; E1635-R1640 PolarHBondContact OE1-NH2 2.99Å; E1635-W1644 WeakPolarHBondContact O-CB 3.39Å; E1635-W1644 PolarHBondContact O-N 3.41Å
1636	V	61.5	Low	65.9	Low	2.6 Å²	2.6	32.2 Å²	32.2	2%	0.016	15%	0.152	C	C	.	.	H	α-helix	trans	-76.9	-58.5	177.5	-179.3	0	0	0	0	111.5	L1573 R1632 F1633 T1638 R1640 V1641 S1643 W1644 V1645 E1683	L1573-V1636 HydrophobicContact CD1-CG2 4.2Å; L1573-V1636 HydrophobicContact CD2-CG2 4.12Å; R1632-V1636 HydrophobicContact CG-CG2 4.15Å; R1632-V1636 WeakPolarHBondContact O-CB 3.39Å; R1632-V1636 VanDerWaalsContact O-CG2 3.31Å; R1632-V1636 WeakPolarHBondContact O-CG2 3.19Å; R1632-V1636 PolarHBondContact O-N 2.95Å; F1633-V1636 PolarHBondContact O-N 3.19Å; V1636-T1638 PolarHBondContact O-N 3.46Å; V1636-R1640 CarbonylContact O-C 3.58Å; V1636-R1640 PolarHBondContact O-N 3.19Å; V1636-V1641 HydrophobicContact CB-CG2 4.4Å; V1636-V1641 HydrophobicContact CG1-CG2 3.42Å; V1636-V1641 VanDerWaalsContact CG1-CG2 3.42Å; V1636-V1641 WeakPolarHBondContact O-CB 3.29Å; V1636-V1641 WeakPolarHBondContact O-CG2 3.48Å; V1636-V1641 PolarHBondContact O-N 2.92Å; V1636-S1643 WeakPolarHBondContact O-CB 3.43Å; V1636-S1643 PolarHBondContact O-OG 2.9Å; V1636-W1644 HydrophobicContact CG1-CE3 4.32Å; V1636-W1644 PolarHBondContact O-N 2.93Å; V1636-V1645 HydrophobicContact CG1-CG2 4.37Å; V1636-E1683 HydrophobicContact CB-CB 4.37Å; V1636-E1683 VanDerWaalsContact CB-OE2 3.25Å; V1636-E1683 WeakPolarHBondContact CB-OE2 3.18Å; V1636-E1683 HydrophobicContact CG1-CB 3.95Å; V1636-E1683 WeakPolarHBondContact CG1-OE2 3.35Å; V1636-E1683 VanDerWaalsContact CG2-OE2 3.26Å; V1636-E1683 WeakPolarHBondContact CG2-OE2 3.3Å
1637	S	60.7	Low	65.2	Low	4.8 Å²	4.8	34.2 Å²	34.2	3%	0.034	16%	0.161	C	C	.	.	H	α-helix	trans	-93.1	-34.6	-165.3	74.6	0	0	0	0	115.6	F1633 S1642 S1643 E1683 G1687	F1633-S1637 VanDerWaalsContact CD1-OG 3.23Å; F1633-S1637 WeakPolarHBondContact CD1-OG 3.31Å; F1633-S1637 VanDerWaalsContact CE1-OG 3.26Å; F1633-S1637 WeakPolarHBondContact CE1-OG 3.24Å; F1633-S1637 VanDerWaalsContact CZ-OG 3.27Å; F1633-S1637 WeakPolarHBondContact CZ-OG 3.36Å; F1633-S1637 VanDerWaalsContact O-CB 3.25Å; F1633-S1637 WeakPolarHBondContact O-CB 3.41Å; F1633-S1637 PolarHBondContact O-N 3.17Å; F1633-S1637 PolarHBondContact O-OG 3.04Å; S1637-S1642 PolarHBondContact O-N 3.03Å; S1637-S1643 WeakPolarHBondContact O-CB 3.43Å; S1637-E1683 WeakPolarHBondContact CB-O 3.37Å; S1637-G1687 VanDerWaalsContact O-CA 3.25Å; S1637-G1687 WeakPolarHBondContact O-CA 3.32Å
1638	T	51	Low	64.9	Low	42 Å²	42	30.6 Å²	30.6	26%	0.258	15%	0.147	S	C	.	.			trans	-115.5	22.4	-156.6	42.7	0	0	0	0	117.7	F1553 F1633 A1634 V1636 R1640 V1641 R1690	F1553-T1638 HydrophobicContact CE1-CG2 3.49Å; F1553-T1638 VanDerWaalsContact CE1-CG2 3.49Å; F1553-T1638 HydrophobicContact CZ-CG2 3.59Å; F1633-T1638 HydrophobicContact CD1-CG2 3.89Å; F1633-T1638 HydrophobicContact CE1-CG2 4.01Å; F1633-T1638 PolarHBondContact O-OG1 3.44Å; A1634-T1638 VanDerWaalsContact CA-CG2 3.49Å; A1634-T1638 VanDerWaalsContact CA-OG1 3.23Å; A1634-T1638 WeakPolarHBondContact CA-OG1 3.41Å; A1634-T1638 HydrophobicContact CB-CG2 4.06Å; A1634-T1638 WeakPolarHBondContact CB-OG1 3.45Å; A1634-T1638 CarbonylContact O-C 3.56Å; A1634-T1638 PolarHBondContact O-N 3.08Å; A1634-T1638 PolarHBondContact O-OG1 3.1Å; V1636-T1638 PolarHBondContact O-N 3.46Å; T1638-R1640 VanDerWaalsContact C-N 3.25Å; T1638-R1640 PolarHBondContact O-N 3.11Å; T1638-V1641 PolarHBondContact O-N 3.16Å; T1638-R1690 PolarHBondContact O-NH1 2.81Å; T1638-R1690 PolarHBondContact O-NH2 3.43Å
1639	R	44.1	Very low	64.6	Low	108.4 Å²	108.4	27.5 Å²	27.5	41%	0.409	13%	0.132	S	C	.	.	S	Bend	trans	-89.9	44.3	178.8	-162.9	173.8	-179.3	-176.4	-1.1	114.3	H1550 L1562 T1567 A1634 E1635 S1643	H1550-R1639 PolarHBondContact CE1-NH1 2.88Å; H1550-R1639 PolarHBondContact NE2-NH1 2.97Å; H1550-R1639 VanDerWaalsContact NE2-NH1 3.16Å; L1562-R1639 PolarHBondContact O-NH2 3.05Å; T1567-R1639 VanDerWaalsContact CG2-NH1 3.33Å; A1634-R1639 HydrophobicContact CB-CB 4.5Å; A1634-R1639 WeakPolarHBondContact O-CB 3.43Å; A1634-R1639 PolarHBondContact O-N 3.11Å; E1635-R1639 IonicContact OE1-NH1 3.26Å; E1635-R1639 PolarHBondContact OE1-NH1 3.26Å; R1639-S1643 WeakPolarHBondContact O-CB 3.47Å
1640	R	41.7	Very low	64.1	Low	123.6 Å²	123.6	29.4 Å²	29.4	47%	0.466	14%	0.142	S	C	.	.	S	Bend	trans	-110.4	70.6	147.6	-73.9	-167.5	179	156.1	7.5	112.2	L1558 T1567 L1573 E1635 V1636 T1638 S1642 S1643 W1644	L1558-R1640 VanDerWaalsContact CB-NH2 3.31Å; L1558-R1640 PolarHBondContact O-NH2 3.15Å; T1567-R1640 VanDerWaalsContact CB-NH2 3.28Å; L1573-R1640 HydrophobicContact CD1-CB 3.93Å; L1573-R1640 HydrophobicContact CD1-CG 3.93Å; E1635-R1640 HydrophobicContact CG-CG 4.3Å; E1635-R1640 WeakPolarHBondContact O-CA 3.46Å; E1635-R1640 WeakPolarHBondContact O-CB 3.31Å; E1635-R1640 WeakPolarHBondContact O-CG 3.37Å; E1635-R1640 PolarHBondContact O-N 3.46Å; E1635-R1640 IonicContact OE1-CZ 2.84Å; E1635-R1640 IonicContact OE1-NH1 3.85Å; E1635-R1640 PolarHBondContact OE1-NH1 3.43Å; E1635-R1640 IonicContact OE1-NH2 3.99Å; E1635-R1640 PolarHBondContact OE1-NH2 2.99Å; V1636-R1640 CarbonylContact O-C 3.58Å; V1636-R1640 PolarHBondContact O-N 3.19Å; T1638-R1640 VanDerWaalsContact C-N 3.25Å; T1638-R1640 PolarHBondContact O-N 3.11Å; R1640-S1642 VanDerWaalsContact C-N 3.35Å; R1640-S1642 PolarHBondContact O-N 3.12Å; R1640-S1642 VanDerWaalsContact O-N 3.12Å; R1640-S1643 CarbonylContact O-C 3.6Å; R1640-S1643 WeakPolarHBondContact O-CA 3.41Å; R1640-S1643 WeakPolarHBondContact O-CB 3.3Å; R1640-S1643 PolarHBondContact O-N 2.94Å; R1640-W1644 WeakPolarHBondContact O-CA 3.43Å; R1640-W1644 WeakPolarHBondContact O-CB 3.28Å; R1640-W1644 PolarHBondContact O-N 2.7Å
1641	V	40.7	Very low	63.7	Low	46 Å²	46	30.7 Å²	30.7	28%	0.279	15%	0.152	S	C	.	.	S	Bend	trans	48.7	-31.6	173	-171.3	0	0	0	0	113.9	L1568 V1636 T1638 S1643 W1644 V1645 R1690	L1568-V1641 HydrophobicContact CD1-CG1 4.2Å; L1568-V1641 HydrophobicContact CD2-CG1 3.93Å; V1636-V1641 HydrophobicContact CB-CG2 4.4Å; V1636-V1641 HydrophobicContact CG1-CG2 3.42Å; V1636-V1641 VanDerWaalsContact CG1-CG2 3.42Å; V1636-V1641 WeakPolarHBondContact O-CB 3.29Å; V1636-V1641 WeakPolarHBondContact O-CG2 3.48Å; V1636-V1641 PolarHBondContact O-N 2.92Å; T1638-V1641 PolarHBondContact O-N 3.16Å; V1641-S1643 PolarHBondContact O-N 3.21Å; V1641-W1644 HydrophobicContact CG2-CE3 4.48Å; V1641-W1644 PolarHBondContact O-N 3.32Å; V1641-W1644 VanDerWaalsContact O-N 3.11Å; V1641-V1645 HydrophobicContact CG1-CG2 3.61Å; V1641-V1645 WeakPolarHBondContact O-CA 3.47Å; V1641-V1645 WeakPolarHBondContact O-CB 3.45Å; V1641-V1645 WeakPolarHBondContact O-CG2 3.41Å; V1641-V1645 PolarHBondContact O-N 3.02Å; V1641-R1690 PolarHBondContact O-NH1 3.14Å
1642	S	50.2	Low	63.5	Low	25.4 Å²	25.4	29.1 Å²	29.1	18%	0.178	15%	0.145	C	C	.	.	S	Bend	trans	-113.4	115.6	168.7	62.6	0	0	0	0	111.4	W1508 Q1512 Y1569 S1637 R1640 T1646 G1687	W1508-S1642 VanDerWaalsContact CH2-OG 3.29Å; W1508-S1642 WeakPolarHBondContact CH2-OG 3.36Å; Q1512-S1642 PolarHBondContact NE2-OG 3.42Å; Y1569-S1642 PolarHBondContact OH-O 2.76Å; S1637-S1642 PolarHBondContact O-N 3.03Å; R1640-S1642 VanDerWaalsContact C-N 3.35Å; R1640-S1642 PolarHBondContact O-N 3.12Å; R1640-S1642 VanDerWaalsContact O-N 3.12Å; S1642-T1646 VanDerWaalsContact O-CB 3.31Å; S1642-T1646 WeakPolarHBondContact O-CB 3.25Å; S1642-T1646 PolarHBondContact O-N 2.7Å; S1642-T1646 PolarHBondContact O-OG1 2.88Å; S1642-G1687 WeakPolarHBondContact CA-O 3.09Å; S1642-G1687 VanDerWaalsContact CB-O 3.29Å; S1642-G1687 WeakPolarHBondContact CB-O 3.5Å; S1642-G1687 PolarHBondContact OG-O 2.79Å; S1642-G1687 VanDerWaalsContact OG-O 3.07Å
1643	S	59.8	Low	63.3	Low	9.4 Å²	9.4	32.8 Å²	32.8	7%	0.066	17%	0.17	C	C	.	.			trans	-58	155	174.5	151.2	0	0	0	0	111.1	W1508 V1636 S1637 R1639 R1640 V1641 V1645 T1646 H1647 G1687	W1508-S1643 VanDerWaalsContact CE3-OG 3.32Å; W1508-S1643 WeakPolarHBondContact CZ3-OG 3.49Å; V1636-S1643 WeakPolarHBondContact O-CB 3.43Å; V1636-S1643 PolarHBondContact O-OG 2.9Å; S1637-S1643 WeakPolarHBondContact O-CB 3.43Å; R1639-S1643 WeakPolarHBondContact O-CB 3.47Å; R1640-S1643 CarbonylContact O-C 3.6Å; R1640-S1643 WeakPolarHBondContact O-CA 3.41Å; R1640-S1643 WeakPolarHBondContact O-CB 3.3Å; R1640-S1643 PolarHBondContact O-N 2.94Å; V1641-S1643 PolarHBondContact O-N 3.21Å; S1643-V1645 PolarHBondContact O-N 3.23Å; S1643-V1645 VanDerWaalsContact O-N 3.13Å; S1643-V1645 VanDerWaalsContact OG-CB 3.31Å; S1643-V1645 WeakPolarHBondContact OG-CB 3.27Å; S1643-V1645 WeakPolarHBondContact OG-CG2 3.39Å; S1643-V1645 PolarHBondContact OG-N 3.01Å; S1643-V1645 VanDerWaalsContact OG-N 3.16Å; S1643-T1646 PolarHBondContact N-OG1 3.14Å; S1643-T1646 VanDerWaalsContact N-OG1 3.11Å; S1643-T1646 CarbonylContact O-C 3.54Å; S1643-T1646 WeakPolarHBondContact O-CA 3.39Å; S1643-T1646 VanDerWaalsContact O-CB 3.3Å; S1643-T1646 WeakPolarHBondContact O-CB 3.34Å; S1643-T1646 PolarHBondContact O-N 3.11Å; S1643-T1646 VanDerWaalsContact OG-CB 3.3Å; S1643-T1646 WeakPolarHBondContact OG-CB 3.33Å; S1643-T1646 PolarHBondContact OG-N 2.88Å; S1643-T1646 VanDerWaalsContact OG-N 3.13Å; S1643-T1646 PolarHBondContact OG-OG1 3.35Å; S1643-H1647 VanDerWaalsContact O-CB 3.28Å; S1643-H1647 WeakPolarHBondContact O-CB 3.43Å; S1643-H1647 PolarHBondContact O-N 3Å; S1643-G1687 WeakPolarHBondContact CB-O 3.36Å; S1643-G1687 WeakPolarHBondContact OG-CA 3.49Å
1644	W	68.4	Low	63.1	Low	18 Å²	18	34.1 Å²	34.1	7%	0.068	18%	0.181	C	C	.	.	H	α-helix	trans	-56.5	-41.3	174.7	172.2	70.5	0	0	0	111.2	Y1569 L1573 L1576 Q1577 F1580 V1586 L1590 E1635 V1636 R1640 V1641 T1646 H1647 L1648	Y1569-W1644 HydrophobicContact CD1-CB 3.92Å; Y1569-W1644 HydrophobicContact CD1-CG 4.37Å; Y1569-W1644 HydrophobicContact CE1-CB 3.75Å; Y1569-W1644 HydrophobicContact CE1-CG 4.47Å; L1573-W1644 HydrophobicContact CB-CD2 4.44Å; L1573-W1644 HydrophobicContact CB-CG 4.4Å; L1573-W1644 HydrophobicContact CB-CZ2 4.36Å; L1573-W1644 HydrophobicContact CD1-CG 4.45Å; L1573-W1644 HydrophobicContact CD2-CD2 3.98Å; L1573-W1644 HydrophobicContact CD2-CE3 4.06Å; L1573-W1644 HydrophobicContact CD2-CH2 4.03Å; L1573-W1644 HydrophobicContact CD2-CZ2 3.91Å; L1573-W1644 HydrophobicContact CD2-CZ3 4.11Å; L1573-W1644 WeakPolarHBondContact O-CZ2 3.29Å; L1573-W1644 PolarHBondContact O-NE1 3.28Å; L1576-W1644 HydrophobicContact CB-CH2 4.17Å; L1576-W1644 HydrophobicContact CB-CZ2 3.86Å; L1576-W1644 HydrophobicContact CD1-CH2 4.39Å; Q1577-W1644 HydrophobicContact CB-CZ2 3.75Å; Q1577-W1644 HydrophobicContact CG-CZ2 3.94Å; F1580-W1644 AromaticContact CD2-CH2 3.87Å; F1580-W1644 HydrophobicContact CD2-CH2 4.08Å; F1580-W1644 HydrophobicContact CD2-CZ2 4.37Å; F1580-W1644 AromaticContact CE2-CH2 3.51Å; F1580-W1644 HydrophobicContact CE2-CH2 3.51Å; F1580-W1644 AromaticContact CE2-CZ2 3.36Å; F1580-W1644 HydrophobicContact CE2-CZ2 4.03Å; F1580-W1644 AromaticContact CE2-CZ3 3.76Å; F1580-W1644 HydrophobicContact CE2-CZ3 4.05Å; F1580-W1644 AromaticContact CZ-CH2 3.23Å; F1580-W1644 HydrophobicContact CZ-CH2 3.77Å; F1580-W1644 AromaticContact CZ-CZ2 3.77Å; F1580-W1644 HydrophobicContact CZ-CZ2 3.77Å; F1580-W1644 AromaticContact CZ-CZ3 3.7Å; F1580-W1644 HydrophobicContact CZ-CZ3 3.98Å; V1586-W1644 HydrophobicContact CG1-CH2 4.42Å; L1590-W1644 HydrophobicContact CD1-CZ3 4.49Å; E1635-W1644 WeakPolarHBondContact O-CB 3.39Å; E1635-W1644 PolarHBondContact O-N 3.41Å; V1636-W1644 HydrophobicContact CG1-CE3 4.32Å; V1636-W1644 PolarHBondContact O-N 2.93Å; R1640-W1644 WeakPolarHBondContact O-CA 3.43Å; R1640-W1644 WeakPolarHBondContact O-CB 3.28Å; R1640-W1644 PolarHBondContact O-N 2.7Å; V1641-W1644 HydrophobicContact CG2-CE3 4.48Å; V1641-W1644 PolarHBondContact O-N 3.32Å; V1641-W1644 VanDerWaalsContact O-N 3.11Å; W1644-T1646 VanDerWaalsContact C-N 3.33Å; W1644-T1646 PolarHBondContact O-N 3.05Å; W1644-H1647 CarbonylContact O-C 3.57Å; W1644-H1647 WeakPolarHBondContact O-CA 3.37Å; W1644-H1647 WeakPolarHBondContact O-CB 3.34Å; W1644-H1647 PolarHBondContact O-N 3.01Å; W1644-H1647 VanDerWaalsContact O-N 3.09Å; W1644-L1648 HydrophobicContact CD2-CD1 3.93Å; W1644-L1648 HydrophobicContact CD2-CG 4.42Å; W1644-L1648 HydrophobicContact CE3-CD1 4.16Å; W1644-L1648 HydrophobicContact CG-CD1 4.49Å; W1644-L1648 HydrophobicContact CH2-CD1 4.21Å; W1644-L1648 HydrophobicContact CZ2-CD1 3.92Å; W1644-L1648 HydrophobicContact CZ3-CD1 4.31Å; W1644-L1648 WeakPolarHBondContact O-CA 3.41Å; W1644-L1648 WeakPolarHBondContact O-CB 3.38Å; W1644-L1648 VanDerWaalsContact O-CG 3.31Å; W1644-L1648 WeakPolarHBondContact O-CG 3.27Å; W1644-L1648 PolarHBondContact O-N 3.17Å
1645	V	69.1	Low	63.2	Low	2 Å²	2	37.9 Å²	37.9	1%	0.012	20%	0.195	C	C	.	.	H	α-helix	trans	-58	-45.8	170.8	179.2	0	0	0	0	112	V1636 V1641 S1643 H1647 L1648 I1649 I1665 I1684 L1688	V1636-V1645 HydrophobicContact CG1-CG2 4.37Å; V1641-V1645 HydrophobicContact CG1-CG2 3.61Å; V1641-V1645 WeakPolarHBondContact O-CA 3.47Å; V1641-V1645 WeakPolarHBondContact O-CB 3.45Å; V1641-V1645 WeakPolarHBondContact O-CG2 3.41Å; V1641-V1645 PolarHBondContact O-N 3.02Å; S1643-V1645 PolarHBondContact O-N 3.23Å; S1643-V1645 VanDerWaalsContact O-N 3.13Å; S1643-V1645 VanDerWaalsContact OG-CB 3.31Å; S1643-V1645 WeakPolarHBondContact OG-CB 3.27Å; S1643-V1645 WeakPolarHBondContact OG-CG2 3.39Å; S1643-V1645 PolarHBondContact OG-N 3.01Å; S1643-V1645 VanDerWaalsContact OG-N 3.16Å; V1645-H1647 VanDerWaalsContact C-N 3.32Å; V1645-H1647 PolarHBondContact O-N 2.82Å; V1645-L1648 PolarHBondContact O-N 3.07Å; V1645-I1649 HydrophobicContact CG1-CD1 3.57Å; V1645-I1649 HydrophobicContact CG1-CG1 4.38Å; V1645-I1649 WeakPolarHBondContact O-CB 3.45Å; V1645-I1649 VanDerWaalsContact O-CG1 3.23Å; V1645-I1649 WeakPolarHBondContact O-CG1 3.31Å; V1645-I1649 PolarHBondContact O-N 2.94Å; V1645-I1665 HydrophobicContact CB-CD1 4.21Å; V1645-I1665 HydrophobicContact CG1-CB 4.42Å; V1645-I1665 HydrophobicContact CG1-CD1 3.87Å; V1645-I1665 HydrophobicContact CG1-CG1 4.2Å; V1645-I1665 HydrophobicContact CG1-CG2 3.56Å; V1645-I1665 VanDerWaalsContact CG1-CG2 3.45Å; V1645-I1665 HydrophobicContact CG2-CD1 3.98Å; V1645-I1665 HydrophobicContact CG2-CG1 4.48Å; V1645-I1665 HydrophobicContact CG2-CG2 3.9Å; V1645-I1684 HydrophobicContact CG2-CG2 4.43Å; V1645-L1688 HydrophobicContact CG1-CD2 3.64Å; V1645-L1688 HydrophobicContact CG1-CG 3.92Å
1646	T	66.8	Low	63.5	Low	17.6 Å²	17.6	40.4 Å²	40.4	11%	0.108	21%	0.207	C	C	.	.	H	α-helix	trans	-65.1	-38.5	176.1	-51.1	0	0	0	0	111.4	W1508 S1642 S1643 W1644 L1648 I1649 L1650 L1705	W1508-T1646 HydrophobicContact CH2-CG2 3.44Å; W1508-T1646 VanDerWaalsContact CH2-CG2 3.44Å; W1508-T1646 HydrophobicContact CZ2-CG2 3.57Å; S1642-T1646 VanDerWaalsContact O-CB 3.31Å; S1642-T1646 WeakPolarHBondContact O-CB 3.25Å; S1642-T1646 PolarHBondContact O-N 2.7Å; S1642-T1646 PolarHBondContact O-OG1 2.88Å; S1643-T1646 PolarHBondContact N-OG1 3.14Å; S1643-T1646 VanDerWaalsContact N-OG1 3.11Å; S1643-T1646 CarbonylContact O-C 3.54Å; S1643-T1646 WeakPolarHBondContact O-CA 3.39Å; S1643-T1646 VanDerWaalsContact O-CB 3.3Å; S1643-T1646 WeakPolarHBondContact O-CB 3.34Å; S1643-T1646 PolarHBondContact O-N 3.11Å; S1643-T1646 VanDerWaalsContact OG-CB 3.3Å; S1643-T1646 WeakPolarHBondContact OG-CB 3.33Å; S1643-T1646 PolarHBondContact OG-N 2.88Å; S1643-T1646 VanDerWaalsContact OG-N 3.13Å; S1643-T1646 PolarHBondContact OG-OG1 3.35Å; W1644-T1646 VanDerWaalsContact C-N 3.33Å; W1644-T1646 PolarHBondContact O-N 3.05Å; T1646-L1648 VanDerWaalsContact C-N 3.35Å; T1646-L1648 PolarHBondContact O-N 2.99Å; T1646-I1649 PolarHBondContact O-N 3.37Å; T1646-L1650 HydrophobicContact CG2-CD1 3.77Å; T1646-L1650 HydrophobicContact CG2-CG 4.23Å; T1646-L1650 VanDerWaalsContact O-CB 3.24Å; T1646-L1650 WeakPolarHBondContact O-CB 3.36Å; T1646-L1650 VanDerWaalsContact O-CG 3.26Å; T1646-L1650 WeakPolarHBondContact O-CG 3.33Å; T1646-L1650 PolarHBondContact O-N 3.07Å; T1646-L1705 HydrophobicContact CG2-CD1 4.2Å; T1646-L1705 HydrophobicContact CG2-CD2 4.43Å; T1646-L1705 HydrophobicContact CG2-CG 4.28Å
1647	H	69	Low	64.2	Low	43.2 Å²	43.2	41.1 Å²	41.1	20%	0.2	21%	0.211	C	C	.	.	H	α-helix	trans	-66.4	-44.2	176.3	179.4	-92.4	0	0	0	111.9	M1505 W1508 Y1569 S1643 W1644 V1645 I1649 L1650 S1651	M1505-H1647 WeakPolarHBondContact CG-NE2 3.46Å; W1508-H1647 HydrophobicContact CH2-CB 3.88Å; W1508-H1647 AromaticContact CH2-CD2 3.65Å; W1508-H1647 HydrophobicContact CZ3-CB 4.36Å; W1508-H1647 AromaticContact CZ3-CD2 3.69Å; Y1569-H1647 HydrophobicContact CE2-CB 4.46Å; Y1569-H1647 AromaticContact CE2-CD2 3.98Å; Y1569-H1647 WeakPolarHBondContact OH-CB 3.27Å; S1643-H1647 VanDerWaalsContact O-CB 3.28Å; S1643-H1647 WeakPolarHBondContact O-CB 3.43Å; S1643-H1647 PolarHBondContact O-N 3Å; W1644-H1647 CarbonylContact O-C 3.57Å; W1644-H1647 WeakPolarHBondContact O-CA 3.37Å; W1644-H1647 WeakPolarHBondContact O-CB 3.34Å; W1644-H1647 PolarHBondContact O-N 3.01Å; W1644-H1647 VanDerWaalsContact O-N 3.09Å; V1645-H1647 VanDerWaalsContact C-N 3.32Å; V1645-H1647 PolarHBondContact O-N 2.82Å; H1647-I1649 VanDerWaalsContact C-N 3.29Å; H1647-I1649 PolarHBondContact O-N 3.21Å; H1647-L1650 PolarHBondContact O-N 2.98Å; H1647-L1650 VanDerWaalsContact O-N 3.14Å; H1647-S1651 WeakPolarHBondContact O-CA 3.44Å; H1647-S1651 VanDerWaalsContact O-CB 3.23Å; H1647-S1651 WeakPolarHBondContact O-CB 3.33Å; H1647-S1651 PolarHBondContact O-N 3.05Å; H1647-S1651 PolarHBondContact O-OG 3.13Å
1648	L	75	Confident	65	Low	1.2 Å²	1.2	43.1 Å²	43.1	1%	0.006	22%	0.217	C	C	.	.	H	α-helix	trans	-53.9	-45.6	175.5	-77.3	174.2	0	0	0	111.4	Q1577 F1580 W1644 V1645 T1646 S1651 Q1652 M1661 I1665	Q1577-L1648 HydrophobicContact CB-CD2 3.7Å; Q1577-L1648 HydrophobicContact CG-CD1 4.4Å; Q1577-L1648 HydrophobicContact CG-CD2 3.55Å; Q1577-L1648 VanDerWaalsContact CG-CD2 3.46Å; Q1577-L1648 HydrophobicContact CG-CG 4.12Å; F1580-L1648 HydrophobicContact CD2-CD1 3.9Å; F1580-L1648 HydrophobicContact CD2-CD2 4.05Å; F1580-L1648 HydrophobicContact CE1-CD1 4.01Å; F1580-L1648 HydrophobicContact CE2-CD1 3.4Å; F1580-L1648 VanDerWaalsContact CE2-CD1 3.43Å; F1580-L1648 HydrophobicContact CE2-CD2 4.09Å; F1580-L1648 HydrophobicContact CE2-CG 4.36Å; F1580-L1648 HydrophobicContact CG-CD1 4.35Å; F1580-L1648 HydrophobicContact CZ-CD1 3.8Å; W1644-L1648 HydrophobicContact CD2-CD1 3.93Å; W1644-L1648 HydrophobicContact CD2-CG 4.42Å; W1644-L1648 HydrophobicContact CE3-CD1 4.16Å; W1644-L1648 HydrophobicContact CG-CD1 4.49Å; W1644-L1648 HydrophobicContact CH2-CD1 4.21Å; W1644-L1648 HydrophobicContact CZ2-CD1 3.92Å; W1644-L1648 HydrophobicContact CZ3-CD1 4.31Å; W1644-L1648 WeakPolarHBondContact O-CA 3.41Å; W1644-L1648 WeakPolarHBondContact O-CB 3.38Å; W1644-L1648 VanDerWaalsContact O-CG 3.31Å; W1644-L1648 WeakPolarHBondContact O-CG 3.27Å; W1644-L1648 PolarHBondContact O-N 3.17Å; V1645-L1648 PolarHBondContact O-N 3.07Å; T1646-L1648 VanDerWaalsContact C-N 3.35Å; T1646-L1648 PolarHBondContact O-N 2.99Å; L1648-S1651 PolarHBondContact O-OG 3.23Å; L1648-S1651 VanDerWaalsContact O-OG 3.11Å; L1648-Q1652 VanDerWaalsContact O-CG 3.31Å; L1648-Q1652 WeakPolarHBondContact O-CG 3.34Å; L1648-Q1652 PolarHBondContact O-NE2 3.03Å; L1648-M1661 HydrophobicContact CB-CG 4.15Å; L1648-M1661 HydrophobicContact CB-SD 4.25Å; L1648-M1661 HydrophobicContact CD1-SD 4.35Å; L1648-M1661 HydrophobicContact CD2-CE 4.16Å; L1648-M1661 HydrophobicContact CD2-SD 3.94Å; L1648-M1661 HydrophobicContact CG-SD 4.43Å; L1648-I1665 HydrophobicContact CB-CD1 4.32Å; L1648-I1665 HydrophobicContact CD1-CD1 4.45Å
1649	I	74	Confident	66.3	Low	0.4 Å²	0.4	44.4 Å²	44.4	0%	0.002	22%	0.218	C	C	.	.	H	α-helix	trans	-66.9	-57.4	176.1	-60.6	164	0	0	0	109.9	V1645 T1646 H1647 S1651 Q1652 R1658 M1661 L1662 I1665 L1688 L1705 F1708	V1645-I1649 HydrophobicContact CG1-CD1 3.57Å; V1645-I1649 HydrophobicContact CG1-CG1 4.38Å; V1645-I1649 WeakPolarHBondContact O-CB 3.45Å; V1645-I1649 VanDerWaalsContact O-CG1 3.23Å; V1645-I1649 WeakPolarHBondContact O-CG1 3.31Å; V1645-I1649 PolarHBondContact O-N 2.94Å; T1646-I1649 PolarHBondContact O-N 3.37Å; H1647-I1649 VanDerWaalsContact C-N 3.29Å; H1647-I1649 PolarHBondContact O-N 3.21Å; I1649-S1651 VanDerWaalsContact C-N 3.27Å; I1649-S1651 PolarHBondContact O-N 2.96Å; I1649-S1651 VanDerWaalsContact O-N 3.15Å; I1649-Q1652 VanDerWaalsContact O-CB 3.3Å; I1649-Q1652 WeakPolarHBondContact O-CB 3.48Å; I1649-Q1652 WeakPolarHBondContact O-CG 3.48Å; I1649-Q1652 PolarHBondContact O-N 3.21Å; I1649-Q1652 VanDerWaalsContact O-N 3.12Å; I1649-R1658 HydrophobicContact CG2-CB 4.01Å; I1649-R1658 HydrophobicContact CG2-CG 4.36Å; I1649-R1658 WeakPolarHBondContact O-CD 3.36Å; I1649-R1658 VanDerWaalsContact O-CG 3.31Å; I1649-R1658 WeakPolarHBondContact O-CG 3.33Å; I1649-R1658 PolarHBondContact O-NE 3.38Å; I1649-M1661 HydrophobicContact CG1-CB 4.37Å; I1649-M1661 HydrophobicContact CG1-CG 4.3Å; I1649-L1662 HydrophobicContact CD1-CB 4.28Å; I1649-L1662 HydrophobicContact CD1-CD1 3.85Å; I1649-L1662 HydrophobicContact CD1-CG 4.27Å; I1649-L1662 HydrophobicContact CG1-CB 4.32Å; I1649-I1665 HydrophobicContact CD1-CD1 4Å; I1649-I1665 HydrophobicContact CG1-CD1 3.67Å; I1649-I1665 VanDerWaalsContact CG1-CD1 3.48Å; I1649-L1688 HydrophobicContact CD1-CD2 4.03Å; I1649-L1705 HydrophobicContact CB-CD2 4.28Å; I1649-L1705 HydrophobicContact CD1-CD1 3.94Å; I1649-L1705 HydrophobicContact CD1-CD2 4.06Å; I1649-L1705 HydrophobicContact CG2-CD2 3.8Å; I1649-F1708 HydrophobicContact CG2-CD2 4.27Å; I1649-F1708 HydrophobicContact CG2-CG 4.35Å
1650	L	72.5	Confident	67.9	Low	41.4 Å²	41.4	39.5 Å²	39.5	22%	0.217	20%	0.2	C	C	.	.	H	α-helix	trans	-67.7	-22.2	-171.8	-66.2	179.3	0	0	0	114.5	M1505 W1508 T1646 H1647 Q1652 R1658 K1704 L1705 F1708	M1505-L1650 HydrophobicContact CG-CB 4.39Å; W1508-L1650 HydrophobicContact CD2-CD1 4.48Å; W1508-L1650 HydrophobicContact CD2-CD2 3.86Å; W1508-L1650 VanDerWaalsContact CE2-CD2 3.42Å; W1508-L1650 HydrophobicContact CE3-CD1 3.9Å; W1508-L1650 HydrophobicContact CE3-CD2 4.14Å; W1508-L1650 HydrophobicContact CG-CD2 4.44Å; W1508-L1650 HydrophobicContact CH2-CD1 3.22Å; W1508-L1650 HydrophobicContact CH2-CD2 3.25Å; W1508-L1650 HydrophobicContact CH2-CG 3.8Å; W1508-L1650 HydrophobicContact CZ2-CD1 4.27Å; W1508-L1650 HydrophobicContact CZ2-CD2 3.07Å; W1508-L1650 HydrophobicContact CZ2-CG 4.12Å; W1508-L1650 HydrophobicContact CZ3-CD1 3.25Å; W1508-L1650 HydrophobicContact CZ3-CD2 3.9Å; W1508-L1650 HydrophobicContact CZ3-CG 4.16Å; T1646-L1650 HydrophobicContact CG2-CD1 3.77Å; T1646-L1650 HydrophobicContact CG2-CG 4.23Å; T1646-L1650 VanDerWaalsContact O-CB 3.24Å; T1646-L1650 WeakPolarHBondContact O-CB 3.36Å; T1646-L1650 VanDerWaalsContact O-CG 3.26Å; T1646-L1650 WeakPolarHBondContact O-CG 3.33Å; T1646-L1650 PolarHBondContact O-N 3.07Å; H1647-L1650 PolarHBondContact O-N 2.98Å; H1647-L1650 VanDerWaalsContact O-N 3.14Å; L1650-Q1652 VanDerWaalsContact C-N 3.35Å; L1650-Q1652 PolarHBondContact O-N 3.13Å; L1650-R1658 PolarHBondContact O-NE 2.85Å; L1650-K1704 HydrophobicContact CD1-CD 4.28Å; L1650-L1705 HydrophobicContact CD2-CD2 4.17Å; L1650-L1705 HydrophobicContact CG-CD2 4.38Å; L1650-F1708 HydrophobicContact CD2-CE2 4.33Å
1651	S	71.3	Confident	69.8	Low	37.4 Å²	37.4	33.8 Å²	33.8	26%	0.262	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-14.7	176.9	61.2	0	0	0	0	113.7	H1647 L1648 I1649	H1647-S1651 WeakPolarHBondContact O-CA 3.44Å; H1647-S1651 VanDerWaalsContact O-CB 3.23Å; H1647-S1651 WeakPolarHBondContact O-CB 3.33Å; H1647-S1651 PolarHBondContact O-N 3.05Å; H1647-S1651 PolarHBondContact O-OG 3.13Å; L1648-S1651 PolarHBondContact O-OG 3.23Å; L1648-S1651 VanDerWaalsContact O-OG 3.11Å; I1649-S1651 VanDerWaalsContact C-N 3.27Å; I1649-S1651 PolarHBondContact O-N 2.96Å; I1649-S1651 VanDerWaalsContact O-N 3.15Å
1652	Q	73	Confident	71.8	Confident	24.4 Å²	24.4	31.7 Å²	31.7	11%	0.114	17%	0.165	C	C	.	.			trans	-70.2	143.1	177.3	-54.4	-51.8	-48.1	0	0	111.9	Y1581 L1648 I1649 L1650 D1657 R1658 M1661	Y1581-Q1652 PolarHBondContact OH-OE1 3.45Å; L1648-Q1652 VanDerWaalsContact O-CG 3.31Å; L1648-Q1652 WeakPolarHBondContact O-CG 3.34Å; L1648-Q1652 PolarHBondContact O-NE2 3.03Å; I1649-Q1652 VanDerWaalsContact O-CB 3.3Å; I1649-Q1652 WeakPolarHBondContact O-CB 3.48Å; I1649-Q1652 WeakPolarHBondContact O-CG 3.48Å; I1649-Q1652 PolarHBondContact O-N 3.21Å; I1649-Q1652 VanDerWaalsContact O-N 3.12Å; L1650-Q1652 VanDerWaalsContact C-N 3.35Å; L1650-Q1652 PolarHBondContact O-N 3.13Å; Q1652-D1657 HydrophobicContact CB-CB 3.64Å; Q1652-D1657 HydrophobicContact CG-CB 4.2Å; Q1652-R1658 HydrophobicContact CB-CB 4.43Å; Q1652-R1658 HydrophobicContact CB-CG 3.83Å; Q1652-R1658 HydrophobicContact CG-CG 4.44Å; Q1652-R1658 VanDerWaalsContact O-CZ 3.26Å; Q1652-R1658 PolarHBondContact O-NE 3.19Å; Q1652-R1658 PolarHBondContact O-NH2 3.11Å; Q1652-M1661 HydrophobicContact CG-CB 3.96Å; Q1652-M1661 HydrophobicContact CG-CG 4.18Å
1653	P	70.8	Confident	73.4	Confident	82.6 Å²	82.6	30.8 Å²	30.8	54%	0.536	16%	0.159	S	C	.	.	S	Bend	trans	-75.4	-47.8	-170.9	23.6	-26.1	0	0	0	113.7	V1468 D1657 R1658	V1468-P1653 HydrophobicContact CB-CB 4.43Å; V1468-P1653 WeakPolarHBondContact O-CB 3.41Å; P1653-D1657 WeakPolarHBondContact CD-OD2 3.34Å; P1653-D1657 HydrophobicContact CG-CB 4.41Å; P1653-D1657 VanDerWaalsContact CG-OD2 3.29Å; P1653-D1657 WeakPolarHBondContact CG-OD2 3.36Å; P1653-R1658 PolarHBondContact O-NH2 3.18Å
1654	S	70.9	Confident	74.7	Confident	44 Å²	44	30.6 Å²	30.6	31%	0.308	16%	0.157	S	C	.	.	S	Bend	trans	-93	160.4	179.8	130	0	0	0	0	112.5	E1656 D1657 R1658	S1654-E1656 VanDerWaalsContact C-N 3.3Å; S1654-E1656 PolarHBondContact O-N 3.13Å; S1654-E1656 PolarHBondContact OG-N 3.13Å; S1654-E1656 VanDerWaalsContact OG-N 3.15Å; S1654-D1657 WeakPolarHBondContact CA-OD2 3.4Å; S1654-D1657 VanDerWaalsContact CB-CG 3.45Å; S1654-D1657 VanDerWaalsContact CB-OD1 3.32Å; S1654-D1657 WeakPolarHBondContact CB-OD1 3.4Å; S1654-D1657 VanDerWaalsContact CB-OD2 3.28Å; S1654-D1657 WeakPolarHBondContact CB-OD2 3.39Å; S1654-D1657 PolarHBondContact N-OD2 3.25Å; S1654-D1657 VanDerWaalsContact N-OD2 3.12Å; S1654-D1657 WeakPolarHBondContact O-CB 3.09Å; S1654-D1657 PolarHBondContact O-N 3.1Å; S1654-D1657 PolarHBondContact OG-N 3.32Å; S1654-D1657 PolarHBondContact OG-OD1 3.16Å; S1654-D1657 PolarHBondContact OG-OD2 3.11Å; S1654-R1658 VanDerWaalsContact O-CG 3.29Å; S1654-R1658 WeakPolarHBondContact O-CG 3.22Å; S1654-R1658 PolarHBondContact O-N 3Å; S1654-R1658 VanDerWaalsContact O-N 3.14Å
1655	H	70.8	Confident	75.5	Confident	101 Å²	101	29.8 Å²	29.8	47%	0.468	15%	0.154	S	C	.	.	H	α-helix	trans	-64.3	-32.9	171.8	-140.8	-88.4	0	0	0	112.2	D1657 R1658 R1659 F1708	H1655-D1657 VanDerWaalsContact C-N 3.33Å; H1655-R1658 WeakPolarHBondContact O-CB 3.29Å; H1655-R1658 PolarHBondContact O-N 2.9Å; H1655-R1659 PolarHBondContact O-N 3.18Å; H1655-R1659 VanDerWaalsContact O-N 3.1Å; H1655-F1708 HydrophobicContact CB-CE1 4.09Å; H1655-F1708 AromaticContact CD2-CD1 3.68Å; H1655-F1708 AromaticContact CD2-CE1 3.36Å; H1655-F1708 VanDerWaalsContact CD2-CE1 3.43Å; H1655-F1708 WeakPolarHBondContact CD2-CE1 3.41Å; H1655-F1708 AromaticContact CE1-CD1 3.65Å; H1655-F1708 AromaticContact CE1-CE1 3.83Å; H1655-F1708 AromaticContact CE1-CZ 3.82Å; H1655-F1708 AromaticContact CG-CD1 3.99Å; H1655-F1708 AromaticContact CG-CE1 3.77Å; H1655-F1708 AromaticContact ND1-CE1 3.37Å; H1655-F1708 WeakPolarHBondContact ND1-CE1 3.42Å; H1655-F1708 AromaticContact ND1-CZ 3.56Å; H1655-F1708 AromaticContact NE2-CD1 3.5Å; H1655-F1708 WeakPolarHBondContact NE2-CD1 3.41Å; H1655-F1708 AromaticContact NE2-CE1 3.54Å; H1655-F1708 WeakPolarHBondContact NE2-CE1 3.42Å
1656	E	73.3	Confident	76.3	Confident	72.6 Å²	72.6	29.8 Å²	29.8	34%	0.339	15%	0.154	S	C	.	.	H	α-helix	trans	-68.8	-43.4	178.1	-171.4	58.4	-157.8	0	0	111.1	S1654 R1658 R1659 N1660	S1654-E1656 VanDerWaalsContact C-N 3.3Å; S1654-E1656 PolarHBondContact O-N 3.13Å; S1654-E1656 PolarHBondContact OG-N 3.13Å; S1654-E1656 VanDerWaalsContact OG-N 3.15Å; E1656-R1658 VanDerWaalsContact C-N 3.29Å; E1656-R1658 PolarHBondContact O-N 2.92Å; E1656-R1659 VanDerWaalsContact CD-NH2 3.34Å; E1656-R1659 WeakPolarHBondContact O-CB 3.34Å; E1656-R1659 PolarHBondContact O-N 2.99Å; E1656-R1659 VanDerWaalsContact O-N 3.11Å; E1656-R1659 WeakPolarHBondContact OE1-CD 3.11Å; E1656-R1659 IonicContact OE1-CZ 3.27Å; E1656-R1659 VanDerWaalsContact OE1-CZ 3.22Å; E1656-R1659 IonicContact OE1-NE 3.4Å; E1656-R1659 PolarHBondContact OE1-NE 3.34Å; E1656-R1659 IonicContact OE1-NH1 3.75Å; E1656-R1659 PolarHBondContact OE1-NH1 3.37Å; E1656-R1659 IonicContact OE1-NH2 3.17Å; E1656-R1659 PolarHBondContact OE1-NH2 3.22Å; E1656-R1659 VanDerWaalsContact OE2-CD 3.22Å; E1656-R1659 WeakPolarHBondContact OE2-CD 3.41Å; E1656-R1659 IonicContact OE2-CZ 3.15Å; E1656-R1659 IonicContact OE2-NE 2.92Å; E1656-R1659 PolarHBondContact OE2-NE 3.07Å; E1656-R1659 IonicContact OE2-NH1 3.23Å; E1656-R1659 PolarHBondContact OE2-NH1 3.14Å; E1656-R1659 IonicContact OE2-NH2 2.68Å; E1656-R1659 PolarHBondContact OE2-NH2 2.9Å; E1656-N1660 WeakPolarHBondContact O-CB 3.3Å; E1656-N1660 VanDerWaalsContact O-CG 3.28Å; E1656-N1660 PolarHBondContact O-N 3.11Å; E1656-N1660 PolarHBondContact O-ND2 3.09Å; E1656-N1660 PolarHBondContact OE1-ND2 2.92Å; E1656-N1660 PolarHBondContact OE1-OD1 3.19Å
1657	D	75.7	Confident	77.3	Confident	18.4 Å²	18.4	31.4 Å²	31.4	10%	0.098	16%	0.158	C	C	.	.	H	α-helix	trans	-60.2	-38.6	176	-47.9	-18.7	0	0	0	111.4	Q1652 P1653 S1654 H1655 N1660 M1661 W1926	Q1652-D1657 HydrophobicContact CB-CB 3.64Å; Q1652-D1657 HydrophobicContact CG-CB 4.2Å; P1653-D1657 WeakPolarHBondContact CD-OD2 3.34Å; P1653-D1657 HydrophobicContact CG-CB 4.41Å; P1653-D1657 VanDerWaalsContact CG-OD2 3.29Å; P1653-D1657 WeakPolarHBondContact CG-OD2 3.36Å; S1654-D1657 WeakPolarHBondContact CA-OD2 3.4Å; S1654-D1657 VanDerWaalsContact CB-CG 3.45Å; S1654-D1657 VanDerWaalsContact CB-OD1 3.32Å; S1654-D1657 WeakPolarHBondContact CB-OD1 3.4Å; S1654-D1657 VanDerWaalsContact CB-OD2 3.28Å; S1654-D1657 WeakPolarHBondContact CB-OD2 3.39Å; S1654-D1657 PolarHBondContact N-OD2 3.25Å; S1654-D1657 VanDerWaalsContact N-OD2 3.12Å; S1654-D1657 WeakPolarHBondContact O-CB 3.09Å; S1654-D1657 PolarHBondContact O-N 3.1Å; S1654-D1657 PolarHBondContact OG-N 3.32Å; S1654-D1657 PolarHBondContact OG-OD1 3.16Å; S1654-D1657 PolarHBondContact OG-OD2 3.11Å; H1655-D1657 VanDerWaalsContact C-N 3.33Å; D1657-N1660 PolarHBondContact O-N 3Å; D1657-M1661 VanDerWaalsContact O-CB 3.26Å; D1657-M1661 WeakPolarHBondContact O-CB 3.29Å; D1657-M1661 PolarHBondContact O-N 3.02Å; D1657-W1926 HydrophobicContact CB-CZ2 4.16Å; D1657-W1926 VanDerWaalsContact CG-CZ2 3.44Å; D1657-W1926 VanDerWaalsContact OD1-CE2 3.23Å; D1657-W1926 WeakPolarHBondContact OD1-CH2 3.23Å; D1657-W1926 WeakPolarHBondContact OD1-CZ2 3.31Å; D1657-W1926 PolarHBondContact OD1-NE1 2.98Å
1658	R	77.4	Confident	78.3	Confident	45.4 Å²	45.4	29.4 Å²	29.4	17%	0.171	15%	0.149	C	C	.	.	H	α-helix	trans	-63.1	-43.3	175.2	-66	-174.8	-174	140.8	14.8	112	I1649 L1650 Q1652 P1653 S1654 H1655 E1656 N1660 L1662 F1708	I1649-R1658 HydrophobicContact CG2-CB 4.01Å; I1649-R1658 HydrophobicContact CG2-CG 4.36Å; I1649-R1658 WeakPolarHBondContact O-CD 3.36Å; I1649-R1658 VanDerWaalsContact O-CG 3.31Å; I1649-R1658 WeakPolarHBondContact O-CG 3.33Å; I1649-R1658 PolarHBondContact O-NE 3.38Å; L1650-R1658 PolarHBondContact O-NE 2.85Å; Q1652-R1658 HydrophobicContact CB-CB 4.43Å; Q1652-R1658 HydrophobicContact CB-CG 3.83Å; Q1652-R1658 HydrophobicContact CG-CG 4.44Å; Q1652-R1658 VanDerWaalsContact O-CZ 3.26Å; Q1652-R1658 PolarHBondContact O-NE 3.19Å; Q1652-R1658 PolarHBondContact O-NH2 3.11Å; P1653-R1658 PolarHBondContact O-NH2 3.18Å; S1654-R1658 VanDerWaalsContact O-CG 3.29Å; S1654-R1658 WeakPolarHBondContact O-CG 3.22Å; S1654-R1658 PolarHBondContact O-N 3Å; S1654-R1658 VanDerWaalsContact O-N 3.14Å; H1655-R1658 WeakPolarHBondContact O-CB 3.29Å; H1655-R1658 PolarHBondContact O-N 2.9Å; E1656-R1658 VanDerWaalsContact C-N 3.29Å; E1656-R1658 PolarHBondContact O-N 2.92Å; R1658-N1660 VanDerWaalsContact C-N 3.35Å; R1658-L1662 WeakPolarHBondContact O-CB 3.38Å; R1658-L1662 PolarHBondContact O-N 3.13Å; R1658-L1662 VanDerWaalsContact O-N 3.13Å; R1658-F1708 HydrophobicContact CB-CD1 3.68Å; R1658-F1708 HydrophobicContact CB-CD2 4.48Å; R1658-F1708 HydrophobicContact CB-CE1 3.62Å; R1658-F1708 HydrophobicContact CB-CE2 4.46Å; R1658-F1708 HydrophobicContact CB-CG 4.25Å; R1658-F1708 HydrophobicContact CB-CZ 4.16Å; R1658-F1708 VanDerWaalsContact CD-CE1 3.41Å; R1658-F1708 VanDerWaalsContact CD-CZ 3.45Å; R1658-F1708 HydrophobicContact CG-CD1 4.48Å; R1658-F1708 HydrophobicContact CG-CE1 4.1Å; R1658-F1708 HydrophobicContact CG-CZ 4.29Å
1659	R	77.3	Confident	79.1	Confident	70.8 Å²	70.8	29.3 Å²	29.3	27%	0.267	15%	0.149	S	C	.	.	H	α-helix	trans	-63.6	-44.9	175.5	-178	-169.6	112.9	-149.3	4.2	110.8	H1655 E1656 L1662 C1663 S1711 L1712	H1655-R1659 PolarHBondContact O-N 3.18Å; H1655-R1659 VanDerWaalsContact O-N 3.1Å; E1656-R1659 VanDerWaalsContact CD-NH2 3.34Å; E1656-R1659 WeakPolarHBondContact O-CB 3.34Å; E1656-R1659 PolarHBondContact O-N 2.99Å; E1656-R1659 VanDerWaalsContact O-N 3.11Å; E1656-R1659 WeakPolarHBondContact OE1-CD 3.11Å; E1656-R1659 IonicContact OE1-CZ 3.27Å; E1656-R1659 VanDerWaalsContact OE1-CZ 3.22Å; E1656-R1659 IonicContact OE1-NE 3.4Å; E1656-R1659 PolarHBondContact OE1-NE 3.34Å; E1656-R1659 IonicContact OE1-NH1 3.75Å; E1656-R1659 PolarHBondContact OE1-NH1 3.37Å; E1656-R1659 IonicContact OE1-NH2 3.17Å; E1656-R1659 PolarHBondContact OE1-NH2 3.22Å; E1656-R1659 VanDerWaalsContact OE2-CD 3.22Å; E1656-R1659 WeakPolarHBondContact OE2-CD 3.41Å; E1656-R1659 IonicContact OE2-CZ 3.15Å; E1656-R1659 IonicContact OE2-NE 2.92Å; E1656-R1659 PolarHBondContact OE2-NE 3.07Å; E1656-R1659 IonicContact OE2-NH1 3.23Å; E1656-R1659 PolarHBondContact OE2-NH1 3.14Å; E1656-R1659 IonicContact OE2-NH2 2.68Å; E1656-R1659 PolarHBondContact OE2-NH2 2.9Å; R1659-L1662 WeakPolarHBondContact O-CB 3.41Å; R1659-L1662 PolarHBondContact O-N 3.02Å; R1659-C1663 PolarHBondContact O-N 3.01Å; R1659-C1663 PolarHBondContact O-SG 3.09Å; R1659-S1711 VanDerWaalsContact CD-O 3.22Å; R1659-S1711 WeakPolarHBondContact CD-O 3.42Å; R1659-S1711 VanDerWaalsContact CD-OG 3.25Å; R1659-S1711 WeakPolarHBondContact CD-OG 3.31Å; R1659-S1711 WeakPolarHBondContact CG-OG 3.45Å; R1659-S1711 PolarHBondContact NE-O 3.22Å; R1659-S1711 PolarHBondContact NH2-O 3.11Å; R1659-L1712 HydrophobicContact CG-CD2 4.39Å
1660	N	78.6	Confident	79.9	Confident	4.6 Å²	4.6	31 Å²	31	3%	0.025	16%	0.157	C	C	.	.	H	α-helix	trans	-66.5	-43.8	179.9	-66.7	-20.8	0	0	0	111.6	E1656 D1657 R1658 L1662 C1663 F1664 F1923 W1926	E1656-N1660 WeakPolarHBondContact O-CB 3.3Å; E1656-N1660 VanDerWaalsContact O-CG 3.28Å; E1656-N1660 PolarHBondContact O-N 3.11Å; E1656-N1660 PolarHBondContact O-ND2 3.09Å; E1656-N1660 PolarHBondContact OE1-ND2 2.92Å; E1656-N1660 PolarHBondContact OE1-OD1 3.19Å; D1657-N1660 PolarHBondContact O-N 3Å; R1658-N1660 VanDerWaalsContact C-N 3.35Å; N1660-L1662 VanDerWaalsContact C-N 3.32Å; N1660-L1662 PolarHBondContact O-N 3.18Å; N1660-C1663 WeakPolarHBondContact O-CA 3.39Å; N1660-C1663 VanDerWaalsContact O-CB 3.31Å; N1660-C1663 WeakPolarHBondContact O-CB 3.32Å; N1660-C1663 PolarHBondContact O-N 3.1Å; N1660-C1663 VanDerWaalsContact O-N 3.11Å; N1660-F1664 HydrophobicContact CB-CE2 4.22Å; N1660-F1664 HydrophobicContact CB-CZ 4.44Å; N1660-F1664 VanDerWaalsContact O-CD2 3.22Å; N1660-F1664 WeakPolarHBondContact O-CD2 3.34Å; N1660-F1664 VanDerWaalsContact O-CG 3.32Å; N1660-F1664 WeakPolarHBondContact O-CG 3.4Å; N1660-F1664 PolarHBondContact O-N 3.08Å; N1660-F1923 HydrophobicContact CB-CD1 4.24Å; N1660-F1923 VanDerWaalsContact OD1-CD1 3.3Å; N1660-F1923 WeakPolarHBondContact OD1-CD1 3.3Å; N1660-F1923 WeakPolarHBondContact OD1-CE1 3.37Å; N1660-W1926 VanDerWaalsContact ND2-CD1 3.29Å; N1660-W1926 PolarHBondContact ND2-NE1 3.25Å
1661	M	82.4	Confident	80.8	Confident	4.6 Å²	4.6	29.6 Å²	29.6	2%	0.023	15%	0.15	C	C	.	.	H	α-helix	trans	-57.8	-43.7	172.7	-175.1	53.8	62.5	0	0	111.7	F1580 Y1581 L1648 I1649 Q1652 D1657 C1663 F1664 I1665	F1580-M1661 HydrophobicContact CB-CE 4.19Å; F1580-M1661 HydrophobicContact CB-SD 4.15Å; F1580-M1661 HydrophobicContact CD1-CE 4.46Å; F1580-M1661 HydrophobicContact CD1-SD 3.87Å; F1580-M1661 VanDerWaalsContact CD1-SD 3.59Å; F1580-M1661 HydrophobicContact CE1-SD 4.29Å; F1580-M1661 HydrophobicContact CG-CE 4.48Å; F1580-M1661 HydrophobicContact CG-SD 4.12Å; Y1581-M1661 HydrophobicContact CE1-CE 4.35Å; L1648-M1661 HydrophobicContact CB-CG 4.15Å; L1648-M1661 HydrophobicContact CB-SD 4.25Å; L1648-M1661 HydrophobicContact CD1-SD 4.35Å; L1648-M1661 HydrophobicContact CD2-CE 4.16Å; L1648-M1661 HydrophobicContact CD2-SD 3.94Å; L1648-M1661 HydrophobicContact CG-SD 4.43Å; I1649-M1661 HydrophobicContact CG1-CB 4.37Å; I1649-M1661 HydrophobicContact CG1-CG 4.3Å; Q1652-M1661 HydrophobicContact CG-CB 3.96Å; Q1652-M1661 HydrophobicContact CG-CG 4.18Å; D1657-M1661 VanDerWaalsContact O-CB 3.26Å; D1657-M1661 WeakPolarHBondContact O-CB 3.29Å; D1657-M1661 PolarHBondContact O-N 3.02Å; M1661-C1663 VanDerWaalsContact C-N 3.33Å; M1661-C1663 PolarHBondContact O-N 3.07Å; M1661-F1664 PolarHBondContact O-N 3.03Å; M1661-I1665 HydrophobicContact CG-CD1 3.92Å; M1661-I1665 HydrophobicContact CG-CG1 4.46Å; M1661-I1665 VanDerWaalsContact O-CD1 3.24Å; M1661-I1665 WeakPolarHBondContact O-CD1 3.27Å; M1661-I1665 VanDerWaalsContact O-CG1 3.23Å; M1661-I1665 WeakPolarHBondContact O-CG1 3.35Å; M1661-I1665 PolarHBondContact O-N 3.22Å; M1661-I1665 VanDerWaalsContact O-N 3.1Å; M1661-I1665 HydrophobicContact SD-CD1 4.27Å; M1661-I1665 HydrophobicContact SD-CG1 4.36Å
1662	L	81.3	Confident	81.8	Confident	0.4 Å²	0.4	27.8 Å²	27.8	0%	0.002	14%	0.137	C	C	.	.	H	α-helix	trans	-62.3	-38.6	174	-179.3	58.2	0	0	0	112.5	I1649 R1658 R1659 N1660 I1665 V1666 L1688 F1708 W1709 L1712	I1649-L1662 HydrophobicContact CD1-CB 4.28Å; I1649-L1662 HydrophobicContact CD1-CD1 3.85Å; I1649-L1662 HydrophobicContact CD1-CG 4.27Å; I1649-L1662 HydrophobicContact CG1-CB 4.32Å; R1658-L1662 WeakPolarHBondContact O-CB 3.38Å; R1658-L1662 PolarHBondContact O-N 3.13Å; R1658-L1662 VanDerWaalsContact O-N 3.13Å; R1659-L1662 WeakPolarHBondContact O-CB 3.41Å; R1659-L1662 PolarHBondContact O-N 3.02Å; N1660-L1662 VanDerWaalsContact C-N 3.32Å; N1660-L1662 PolarHBondContact O-N 3.18Å; L1662-I1665 PolarHBondContact O-N 3.25Å; L1662-V1666 HydrophobicContact CD1-CG2 4.47Å; L1662-V1666 WeakPolarHBondContact O-CG2 3.35Å; L1662-V1666 PolarHBondContact O-N 3.12Å; L1662-V1666 VanDerWaalsContact O-N 3.09Å; L1662-L1688 HydrophobicContact CD1-CD1 4.46Å; L1662-L1688 HydrophobicContact CD1-CD2 3.75Å; L1662-F1708 HydrophobicContact CD2-CB 4.27Å; L1662-W1709 HydrophobicContact CD1-CH2 4Å; L1662-W1709 HydrophobicContact CD1-CZ2 3.94Å; L1662-W1709 HydrophobicContact CD1-CZ3 4.43Å; L1662-W1709 HydrophobicContact CD2-CD2 4.11Å; L1662-W1709 HydrophobicContact CD2-CE3 4.26Å; L1662-W1709 HydrophobicContact CD2-CG 4.38Å; L1662-W1709 HydrophobicContact CD2-CZ2 4.4Å; L1662-W1709 HydrophobicContact CD2-CZ3 4.45Å; L1662-L1712 HydrophobicContact CB-CD2 4.29Å; L1662-L1712 HydrophobicContact CD2-CD1 3.66Å; L1662-L1712 HydrophobicContact CD2-CD2 4.18Å; L1662-L1712 HydrophobicContact CD2-CG 3.93Å; L1662-L1712 HydrophobicContact CG-CD1 3.99Å; L1662-L1712 HydrophobicContact CG-CD2 4.15Å; L1662-L1712 HydrophobicContact CG-CG 4.37Å
1663	C	83.5	Confident	82.7	Confident	7.6 Å²	7.6	27.3 Å²	27.3	5%	0.051	13%	0.134	C	C	.	.	H	α-helix	trans	-61.6	-45.7	172.2	-65.3	0	0	0	0	112.2	R1659 N1660 M1661 I1665 V1666 R1667 L1712 N1716 F1923	R1659-C1663 PolarHBondContact O-N 3.01Å; R1659-C1663 PolarHBondContact O-SG 3.09Å; N1660-C1663 WeakPolarHBondContact O-CA 3.39Å; N1660-C1663 VanDerWaalsContact O-CB 3.31Å; N1660-C1663 WeakPolarHBondContact O-CB 3.32Å; N1660-C1663 PolarHBondContact O-N 3.1Å; N1660-C1663 VanDerWaalsContact O-N 3.11Å; M1661-C1663 VanDerWaalsContact C-N 3.33Å; M1661-C1663 PolarHBondContact O-N 3.07Å; C1663-I1665 VanDerWaalsContact C-N 3.31Å; C1663-I1665 PolarHBondContact O-N 3.05Å; C1663-V1666 PolarHBondContact O-N 3.13Å; C1663-R1667 VanDerWaalsContact O-CB 3.26Å; C1663-R1667 WeakPolarHBondContact O-CB 3.39Å; C1663-R1667 PolarHBondContact O-N 3.34Å; C1663-L1712 WeakPolarHBondContact SG-CD2 3.32Å; C1663-N1716 PolarHBondContact SG-ND2 3.13Å; C1663-F1923 HydrophobicContact CB-CE1 3.98Å; C1663-F1923 HydrophobicContact CB-CE2 4.14Å; C1663-F1923 HydrophobicContact CB-CZ 3.6Å; C1663-F1923 VanDerWaalsContact CB-CZ 3.43Å
1664	F	86.8	Confident	83.6	Confident	5.4 Å²	5.4	24 Å²	24	2%	0.024	11%	0.112	C	C	.	.	H	α-helix	trans	-62.5	-38.5	177.4	-64.6	-54.1	0	0	0	111.7	F1580 Y1581 P1583 N1660 M1661 R1667 A1668 F1923	F1580-F1664 HydrophobicContact CD1-CB 4.11Å; F1580-F1664 HydrophobicContact CE1-CB 4.12Å; F1580-F1664 WeakPolarHBondContact O-CB 3.4Å; F1580-F1664 WeakPolarHBondContact O-CG 3.4Å; Y1581-F1664 HydrophobicContact CD1-CD2 4.39Å; Y1581-F1664 AromaticContact CD1-CE2 3.78Å; Y1581-F1664 HydrophobicContact CD1-CE2 3.78Å; Y1581-F1664 HydrophobicContact CD1-CZ 4.21Å; Y1581-F1664 HydrophobicContact CE1-CE2 4.34Å; Y1581-F1664 WeakPolarHBondContact O-CE1 3.22Å; P1583-F1664 HydrophobicContact CB-CB 4.3Å; P1583-F1664 VanDerWaalsContact CB-O 3.27Å; P1583-F1664 WeakPolarHBondContact CB-O 3.28Å; P1583-F1664 HydrophobicContact CG-CB 4.45Å; P1583-F1664 HydrophobicContact CG-CD1 4.21Å; N1660-F1664 HydrophobicContact CB-CE2 4.22Å; N1660-F1664 HydrophobicContact CB-CZ 4.44Å; N1660-F1664 VanDerWaalsContact O-CD2 3.22Å; N1660-F1664 WeakPolarHBondContact O-CD2 3.34Å; N1660-F1664 VanDerWaalsContact O-CG 3.32Å; N1660-F1664 WeakPolarHBondContact O-CG 3.4Å; N1660-F1664 PolarHBondContact O-N 3.08Å; M1661-F1664 PolarHBondContact O-N 3.03Å; F1664-R1667 CarbonylContact O-C 3.59Å; F1664-R1667 PolarHBondContact O-N 2.98Å; F1664-A1668 WeakPolarHBondContact O-CB 3.25Å; F1664-A1668 PolarHBondContact O-N 3.29Å; F1664-F1923 AromaticContact CE1-CD2 3.8Å; F1664-F1923 HydrophobicContact CE1-CD2 3.87Å; F1664-F1923 HydrophobicContact CE1-CE2 4.24Å; F1664-F1923 HydrophobicContact CE1-CG 4.28Å; F1664-F1923 HydrophobicContact CE2-CD2 4.42Å; F1664-F1923 HydrophobicContact CZ-CB 4.15Å; F1664-F1923 HydrophobicContact CZ-CD1 4.33Å; F1664-F1923 AromaticContact CZ-CD2 3.78Å; F1664-F1923 HydrophobicContact CZ-CD2 3.93Å; F1664-F1923 HydrophobicContact CZ-CE2 4.45Å; F1664-F1923 AromaticContact CZ-CG 3.86Å; F1664-F1923 HydrophobicContact CZ-CG 4.09Å
1665	I	85.4	Confident	84.6	Confident	0.6 Å²	0.6	22.4 Å²	22.4	0%	0.003	10%	0.1	C	C	.	.	H	α-helix	trans	-65.8	-45.6	177.5	-67.1	158.7	0	0	0	111.5	F1580 V1645 L1648 I1649 M1661 L1662 C1663 R1667 A1668 A1669 I1684 L1688	F1580-I1665 HydrophobicContact CD1-CG1 4.17Å; F1580-I1665 HydrophobicContact CE1-CB 4.19Å; F1580-I1665 HydrophobicContact CE1-CG1 3.52Å; F1580-I1665 VanDerWaalsContact CE1-CG1 3.41Å; F1580-I1665 HydrophobicContact CZ-CB 4.4Å; F1580-I1665 HydrophobicContact CZ-CG1 3.85Å; V1645-I1665 HydrophobicContact CB-CD1 4.21Å; V1645-I1665 HydrophobicContact CG1-CB 4.42Å; V1645-I1665 HydrophobicContact CG1-CD1 3.87Å; V1645-I1665 HydrophobicContact CG1-CG1 4.2Å; V1645-I1665 HydrophobicContact CG1-CG2 3.56Å; V1645-I1665 VanDerWaalsContact CG1-CG2 3.45Å; V1645-I1665 HydrophobicContact CG2-CD1 3.98Å; V1645-I1665 HydrophobicContact CG2-CG1 4.48Å; V1645-I1665 HydrophobicContact CG2-CG2 3.9Å; L1648-I1665 HydrophobicContact CB-CD1 4.32Å; L1648-I1665 HydrophobicContact CD1-CD1 4.45Å; I1649-I1665 HydrophobicContact CD1-CD1 4Å; I1649-I1665 HydrophobicContact CG1-CD1 3.67Å; I1649-I1665 VanDerWaalsContact CG1-CD1 3.48Å; M1661-I1665 HydrophobicContact CG-CD1 3.92Å; M1661-I1665 HydrophobicContact CG-CG1 4.46Å; M1661-I1665 VanDerWaalsContact O-CD1 3.24Å; M1661-I1665 WeakPolarHBondContact O-CD1 3.27Å; M1661-I1665 VanDerWaalsContact O-CG1 3.23Å; M1661-I1665 WeakPolarHBondContact O-CG1 3.35Å; M1661-I1665 PolarHBondContact O-N 3.22Å; M1661-I1665 VanDerWaalsContact O-N 3.1Å; M1661-I1665 HydrophobicContact SD-CD1 4.27Å; M1661-I1665 HydrophobicContact SD-CG1 4.36Å; L1662-I1665 PolarHBondContact O-N 3.25Å; C1663-I1665 VanDerWaalsContact C-N 3.31Å; C1663-I1665 PolarHBondContact O-N 3.05Å; I1665-R1667 VanDerWaalsContact C-N 3.27Å; I1665-R1667 PolarHBondContact O-N 3.07Å; I1665-A1668 PolarHBondContact O-N 3.14Å; I1665-A1669 PolarHBondContact O-N 3.11Å; I1665-I1684 HydrophobicContact CG2-CG2 3.62Å; I1665-I1684 VanDerWaalsContact CG2-CG2 3.46Å; I1665-L1688 HydrophobicContact CG2-CD1 3.95Å; I1665-L1688 HydrophobicContact CG2-CD2 4.14Å; I1665-L1688 HydrophobicContact CG2-CG 4.15Å
1666	V	86.1	Confident	85.5	Confident	2 Å²	2	17.6 Å²	17.6	1%	0.012	8%	0.078	C	C	.	.	H	α-helix	trans	-61.9	-39.1	175.6	172.1	0	0	0	0	110.6	L1662 C1663 A1669 E1670 L1688 K1719 F1720	L1662-V1666 HydrophobicContact CD1-CG2 4.47Å; L1662-V1666 WeakPolarHBondContact O-CG2 3.35Å; L1662-V1666 PolarHBondContact O-N 3.12Å; L1662-V1666 VanDerWaalsContact O-N 3.09Å; C1663-V1666 PolarHBondContact O-N 3.13Å; V1666-A1669 WeakPolarHBondContact O-CB 3.46Å; V1666-A1669 PolarHBondContact O-N 3.15Å; V1666-E1670 WeakPolarHBondContact O-CB 3.44Å; V1666-E1670 PolarHBondContact O-N 3.12Å; V1666-L1688 HydrophobicContact CG2-CD1 4.19Å; V1666-K1719 HydrophobicContact CG1-CB 4.27Å; V1666-F1720 HydrophobicContact CG1-CB 4.1Å; V1666-F1720 HydrophobicContact CG2-CB 4.23Å; V1666-F1720 HydrophobicContact CG2-CD2 4.29Å; V1666-F1720 HydrophobicContact CG2-CG 4.47Å
1667	R	88.4	Confident	86.4	Confident	51.8 Å²	51.8	14.2 Å²	14.2	20%	0.195	6%	0.062	C	C	.	.	H	α-helix	trans	-66.8	-37.7	176	-173.5	168.6	168	111.4	26.8	112.7	P1583 E1584 C1663 F1664 I1665 A1669 E1670 T1671 H1906	P1583-R1667 HydrophobicContact CB-CB 4.2Å; P1583-R1667 HydrophobicContact CB-CG 4.16Å; P1583-R1667 HydrophobicContact CG-CB 4.09Å; P1583-R1667 HydrophobicContact CG-CG 3.72Å; E1584-R1667 IonicContact OE1-CZ 3.4Å; E1584-R1667 IonicContact OE1-NE 3.1Å; E1584-R1667 PolarHBondContact OE1-NE 3.34Å; E1584-R1667 IonicContact OE1-NH2 3.23Å; E1584-R1667 PolarHBondContact OE1-NH2 3.28Å; E1584-R1667 IonicContact OE2-NH2 3.24Å; C1663-R1667 VanDerWaalsContact O-CB 3.26Å; C1663-R1667 WeakPolarHBondContact O-CB 3.39Å; C1663-R1667 PolarHBondContact O-N 3.34Å; F1664-R1667 CarbonylContact O-C 3.59Å; F1664-R1667 PolarHBondContact O-N 2.98Å; I1665-R1667 VanDerWaalsContact C-N 3.27Å; I1665-R1667 PolarHBondContact O-N 3.07Å; R1667-A1669 VanDerWaalsContact C-N 3.3Å; R1667-A1669 PolarHBondContact O-N 2.95Å; R1667-E1670 WeakPolarHBondContact O-CB 3.4Å; R1667-E1670 PolarHBondContact O-N 3.04Å; R1667-T1671 WeakPolarHBondContact O-CG2 3.38Å; R1667-T1671 PolarHBondContact O-N 3.17Å; R1667-T1671 PolarHBondContact O-OG1 3.35Å; R1667-T1671 VanDerWaalsContact O-OG1 3.08Å; R1667-H1906 PolarHBondContact NH1-CE1 3.15Å; R1667-H1906 PolarHBondContact NH1-ND1 3.02Å; R1667-H1906 PolarHBondContact NH2-CD2 3.19Å; R1667-H1906 PolarHBondContact NH2-CE1 3.21Å; R1667-H1906 PolarHBondContact NH2-NE2 3.48Å
1668	A	90.5	Very high	87.2	Confident	0 Å²	0	13.5 Å²	13.5	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-64.1	-39.6	174.1	0	0	0	0	0	111.9	F1580 P1583 F1664 I1665 T1671 C1672 I1684	F1580-A1668 HydrophobicContact CE1-CB 4.37Å; F1580-A1668 HydrophobicContact CZ-CB 4.16Å; P1583-A1668 HydrophobicContact CB-CB 3.96Å; F1664-A1668 WeakPolarHBondContact O-CB 3.25Å; F1664-A1668 PolarHBondContact O-N 3.29Å; I1665-A1668 PolarHBondContact O-N 3.14Å; A1668-T1671 VanDerWaalsContact CA-OG1 3.3Å; A1668-T1671 WeakPolarHBondContact CA-OG1 3.33Å; A1668-T1671 PolarHBondContact O-N 3.02Å; A1668-T1671 PolarHBondContact O-OG1 3.36Å; A1668-C1672 WeakPolarHBondContact O-CB 3.23Å; A1668-C1672 PolarHBondContact O-N 2.98Å; A1668-C1672 PolarHBondContact O-SG 3.07Å; A1668-C1672 VanDerWaalsContact O-SG 3.36Å; A1668-I1684 HydrophobicContact CB-CD1 4.34Å
1669	A	90.2	Very high	87.8	Confident	0.6 Å²	0.6	11.3 Å²	11.3	1%	0.005	5%	0.05	C	C	.	.	H	α-helix	trans	-64.6	-41.2	172.9	0	0	0	0	0	112.2	I1665 V1666 R1667 T1671 C1672 W1673 I1684 L1685	I1665-A1669 PolarHBondContact O-N 3.11Å; V1666-A1669 WeakPolarHBondContact O-CB 3.46Å; V1666-A1669 PolarHBondContact O-N 3.15Å; R1667-A1669 VanDerWaalsContact C-N 3.3Å; R1667-A1669 PolarHBondContact O-N 2.95Å; A1669-T1671 VanDerWaalsContact C-N 3.35Å; A1669-C1672 PolarHBondContact O-N 3.07Å; A1669-W1673 WeakPolarHBondContact O-CB 3.37Å; A1669-W1673 PolarHBondContact O-N 2.94Å; A1669-I1684 HydrophobicContact CB-CB 4.11Å; A1669-I1684 HydrophobicContact CB-CD1 4.32Å; A1669-I1684 HydrophobicContact CB-CG2 3.83Å; A1669-L1685 HydrophobicContact CB-CD2 4.45Å; A1669-L1685 HydrophobicContact CB-CG 4.42Å
1670	E	90.9	Very high	88.3	Confident	36.4 Å²	36.4	8 Å²	8	17%	0.17	4%	0.037	C	C	.	.	H	α-helix	trans	-61.8	-43.1	173.8	-178.9	173.4	-143.4	0	0	111.7	V1666 R1667 W1673 N1674 K1719 L1723	V1666-E1670 WeakPolarHBondContact O-CB 3.44Å; V1666-E1670 PolarHBondContact O-N 3.12Å; R1667-E1670 WeakPolarHBondContact O-CB 3.4Å; R1667-E1670 PolarHBondContact O-N 3.04Å; E1670-W1673 WeakPolarHBondContact O-CB 3.33Å; E1670-W1673 PolarHBondContact O-N 3.07Å; E1670-N1674 WeakPolarHBondContact O-CB 3.35Å; E1670-N1674 VanDerWaalsContact O-CG 3.26Å; E1670-N1674 PolarHBondContact O-N 3.31Å; E1670-N1674 PolarHBondContact O-ND2 2.97Å; E1670-N1674 VanDerWaalsContact O-ND2 3.17Å; E1670-N1674 PolarHBondContact O-OD1 3.11Å; E1670-K1719 VanDerWaalsContact CD-NZ 3.26Å; E1670-K1719 VanDerWaalsContact OE1-CE 3.24Å; E1670-K1719 WeakPolarHBondContact OE1-CE 3.24Å; E1670-K1719 IonicContact OE1-NZ 3.3Å; E1670-K1719 PolarHBondContact OE1-NZ 3.16Å; E1670-K1719 WeakPolarHBondContact OE2-CD 3.31Å; E1670-K1719 IonicContact OE2-NZ 3.08Å; E1670-K1719 PolarHBondContact OE2-NZ 3.23Å; E1670-L1723 HydrophobicContact CB-CD1 4.04Å
1671	T	91.8	Very high	88.9	Confident	11 Å²	11	7.8 Å²	7.8	7%	0.067	4%	0.036	C	C	.	.	H	α-helix	trans	-66.8	-41.7	176.6	-16.4	0	0	0	0	112.1	E1584 A1587 F1588 R1667 A1668 A1669 W1673 N1674 I1675	E1584-T1671 HydrophobicContact CB-CG2 4.23Å; E1584-T1671 HydrophobicContact CG-CG2 3.98Å; A1587-T1671 HydrophobicContact CB-CG2 3.68Å; A1587-T1671 VanDerWaalsContact CB-OG1 3.24Å; A1587-T1671 WeakPolarHBondContact CB-OG1 3.36Å; F1588-T1671 HydrophobicContact CD1-CG2 4.24Å; F1588-T1671 HydrophobicContact CE1-CG2 3.76Å; F1588-T1671 HydrophobicContact CZ-CG2 4.45Å; R1667-T1671 WeakPolarHBondContact O-CG2 3.38Å; R1667-T1671 PolarHBondContact O-N 3.17Å; R1667-T1671 PolarHBondContact O-OG1 3.35Å; R1667-T1671 VanDerWaalsContact O-OG1 3.08Å; A1668-T1671 VanDerWaalsContact CA-OG1 3.3Å; A1668-T1671 WeakPolarHBondContact CA-OG1 3.33Å; A1668-T1671 PolarHBondContact O-N 3.02Å; A1668-T1671 PolarHBondContact O-OG1 3.36Å; A1669-T1671 VanDerWaalsContact C-N 3.35Å; T1671-W1673 VanDerWaalsContact C-N 3.33Å; T1671-W1673 PolarHBondContact O-N 3.3Å; T1671-N1674 PolarHBondContact O-N 3Å; T1671-N1674 VanDerWaalsContact O-N 3.15Å; T1671-I1675 HydrophobicContact CG2-CG2 4.45Å; T1671-I1675 VanDerWaalsContact O-CD1 3.24Å; T1671-I1675 WeakPolarHBondContact O-CD1 3.41Å; T1671-I1675 WeakPolarHBondContact O-CG1 3.34Å; T1671-I1675 PolarHBondContact O-N 3.05Å; T1671-I1675 VanDerWaalsContact O-N 3.07Å
1672	C	92.8	Very high	89	Confident	0 Å²	0	7.6 Å²	7.6	0%	0	4%	0.035	C	C	.	.	H	α-helix	trans	-57.2	-46.4	172.6	-73.9	0	0	0	0	111.7	A1587 A1668 A1669 N1674 I1675 G1676 N1677 A1681	A1587-C1672 VanDerWaalsContact CB-SG 3.55Å; A1668-C1672 WeakPolarHBondContact O-CB 3.23Å; A1668-C1672 PolarHBondContact O-N 2.98Å; A1668-C1672 PolarHBondContact O-SG 3.07Å; A1668-C1672 VanDerWaalsContact O-SG 3.36Å; A1669-C1672 PolarHBondContact O-N 3.07Å; C1672-N1674 PolarHBondContact O-N 3.04Å; C1672-I1675 WeakPolarHBondContact O-CG1 3.39Å; C1672-I1675 PolarHBondContact O-N 3.36Å; C1672-G1676 PolarHBondContact O-N 3.11Å; C1672-N1677 CarbonylContact C-O 3.51Å; C1672-N1677 HydrophobicContact CB-CB 4.23Å; C1672-N1677 CarbonylContact O-C 3.46Å; C1672-N1677 WeakPolarHBondContact O-CA 3.37Å; C1672-N1677 WeakPolarHBondContact O-CB 3.29Å; C1672-N1677 PolarHBondContact O-N 3.22Å; C1672-A1681 HydrophobicContact CB-CB 3.85Å
1673	W	91.8	Very high	89.1	Confident	12.6 Å²	12.6	7.6 Å²	7.6	5%	0.048	4%	0.035	C	C	.	.	H	α-helix	trans	-59.9	-45.5	175.3	166.2	-101.1	0	0	0	112.2	A1669 E1670 T1671 I1675 G1676 F1678 A1681 L1723 I1726 L1727 L1736 A1739 Q1862	A1669-W1673 WeakPolarHBondContact O-CB 3.37Å; A1669-W1673 PolarHBondContact O-N 2.94Å; E1670-W1673 WeakPolarHBondContact O-CB 3.33Å; E1670-W1673 PolarHBondContact O-N 3.07Å; T1671-W1673 VanDerWaalsContact C-N 3.33Å; T1671-W1673 PolarHBondContact O-N 3.3Å; W1673-I1675 VanDerWaalsContact C-N 3.33Å; W1673-I1675 PolarHBondContact O-N 3Å; W1673-G1676 PolarHBondContact O-N 2.94Å; W1673-G1676 VanDerWaalsContact O-N 3.12Å; W1673-F1678 AromaticContact CE3-CD1 3.63Å; W1673-F1678 HydrophobicContact CE3-CD1 3.63Å; W1673-F1678 AromaticContact CE3-CE1 3.8Å; W1673-F1678 HydrophobicContact CE3-CE1 3.8Å; W1673-F1678 HydrophobicContact CH2-CE1 4.29Å; W1673-F1678 AromaticContact CZ3-CD1 3.57Å; W1673-F1678 HydrophobicContact CZ3-CD1 3.57Å; W1673-F1678 VanDerWaalsContact CZ3-CD1 3.49Å; W1673-F1678 AromaticContact CZ3-CE1 3.59Å; W1673-F1678 HydrophobicContact CZ3-CE1 3.59Å; W1673-A1681 HydrophobicContact CB-CB 4.23Å; W1673-L1723 HydrophobicContact CB-CD2 3.86Å; W1673-L1723 VanDerWaalsContact CD1-CD2 3.46Å; W1673-L1723 HydrophobicContact CD2-CD2 3.99Å; W1673-L1723 HydrophobicContact CG-CD2 3.52Å; W1673-L1723 VanDerWaalsContact CG-CD2 3.46Å; W1673-I1726 HydrophobicContact CE3-CG2 4.43Å; W1673-I1726 HydrophobicContact CH2-CG2 3.36Å; W1673-I1726 VanDerWaalsContact CH2-CG2 3.43Å; W1673-I1726 HydrophobicContact CZ2-CD1 4.33Å; W1673-I1726 HydrophobicContact CZ2-CG2 3.92Å; W1673-I1726 HydrophobicContact CZ3-CG2 3.69Å; W1673-L1727 HydrophobicContact CE3-CD1 4.01Å; W1673-L1727 HydrophobicContact CE3-CD2 3.92Å; W1673-L1727 HydrophobicContact CE3-CG 4.14Å; W1673-L1727 HydrophobicContact CZ3-CD2 3.77Å; W1673-L1727 HydrophobicContact CZ3-CG 4.23Å; W1673-L1736 HydrophobicContact CH2-CB 4.46Å; W1673-L1736 HydrophobicContact CH2-CD1 4.42Å; W1673-L1736 HydrophobicContact CZ3-CD1 3.92Å; W1673-A1739 HydrophobicContact CH2-CB 3.9Å; W1673-A1739 HydrophobicContact CZ2-CB 4.15Å; W1673-A1739 HydrophobicContact CZ3-CB 4.43Å; W1673-Q1862 VanDerWaalsContact CD1-OE1 3.28Å; W1673-Q1862 VanDerWaalsContact NE1-CD 3.31Å
1674	N	90.4	Very high	89.1	Confident	13.6 Å²	13.6	7.5 Å²	7.5	7%	0.073	3%	0.034	C	C	.	.	H	α-helix	trans	-63.4	-38.9	-179.4	-72.4	-22.3	0	0	0	112.9	E1670 T1671 C1672 G1676 Q1862 Q1884 H1888	E1670-N1674 WeakPolarHBondContact O-CB 3.35Å; E1670-N1674 VanDerWaalsContact O-CG 3.26Å; E1670-N1674 PolarHBondContact O-N 3.31Å; E1670-N1674 PolarHBondContact O-ND2 2.97Å; E1670-N1674 VanDerWaalsContact O-ND2 3.17Å; E1670-N1674 PolarHBondContact O-OD1 3.11Å; T1671-N1674 PolarHBondContact O-N 3Å; T1671-N1674 VanDerWaalsContact O-N 3.15Å; C1672-N1674 PolarHBondContact O-N 3.04Å; N1674-G1676 VanDerWaalsContact C-N 3.31Å; N1674-G1676 PolarHBondContact O-N 3.23Å; N1674-Q1862 PolarHBondContact OD1-OE1 3.16Å; N1674-Q1884 VanDerWaalsContact O-CD 3.27Å; N1674-Q1884 WeakPolarHBondContact O-CG 3.48Å; N1674-Q1884 PolarHBondContact O-NE2 2.94Å; N1674-Q1884 VanDerWaalsContact O-NE2 3.12Å; N1674-Q1884 PolarHBondContact O-OE1 2.68Å; N1674-H1888 VanDerWaalsContact CG-CE1 3.44Å; N1674-H1888 PolarHBondContact ND2-ND1 3.2Å; N1674-H1888 VanDerWaalsContact ND2-ND1 3.14Å; N1674-H1888 PolarHBondContact OD1-CE1 3.12Å; N1674-H1888 VanDerWaalsContact OD1-CE1 3.31Å
1675	I	90.4	Very high	88.9	Confident	10.8 Å²	10.8	7.3 Å²	7.3	6%	0.055	3%	0.033	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.1	1.3	178.6	56.2	-177.1	0	0	0	113.6	A1587 F1588 S1591 T1671 C1672 W1673 N1677 R1885	A1587-I1675 HydrophobicContact CB-CD1 4.3Å; F1588-I1675 HydrophobicContact CD1-CD1 3.81Å; F1588-I1675 HydrophobicContact CD1-CG1 4.5Å; F1588-I1675 HydrophobicContact CE1-CD1 4.09Å; F1588-I1675 VanDerWaalsContact CE1-CD1 3.46Å; F1588-I1675 HydrophobicContact CE1-CG1 4.08Å; F1588-I1675 HydrophobicContact CE1-CG2 4.06Å; S1591-I1675 WeakPolarHBondContact OG-CD1 3.4Å; T1671-I1675 HydrophobicContact CG2-CG2 4.45Å; T1671-I1675 VanDerWaalsContact O-CD1 3.24Å; T1671-I1675 WeakPolarHBondContact O-CD1 3.41Å; T1671-I1675 WeakPolarHBondContact O-CG1 3.34Å; T1671-I1675 PolarHBondContact O-N 3.05Å; T1671-I1675 VanDerWaalsContact O-N 3.07Å; C1672-I1675 WeakPolarHBondContact O-CG1 3.39Å; C1672-I1675 PolarHBondContact O-N 3.36Å; W1673-I1675 VanDerWaalsContact C-N 3.33Å; W1673-I1675 PolarHBondContact O-N 3Å; I1675-N1677 HydrophobicContact CG1-CB 4.32Å; I1675-R1885 HydrophobicContact CG2-CG 3.92Å
1676	G	90.1	Very high	88.4	Confident	0 Å²	0	10 Å²	10	0%	0	4%	0.044	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.8	13	-178.7	0	0	0	0	0	114.7	C1672 W1673 N1674 F1678 P1751 I1752	C1672-G1676 PolarHBondContact O-N 3.11Å; W1673-G1676 PolarHBondContact O-N 2.94Å; W1673-G1676 VanDerWaalsContact O-N 3.12Å; N1674-G1676 VanDerWaalsContact C-N 3.31Å; N1674-G1676 PolarHBondContact O-N 3.23Å; G1676-F1678 VanDerWaalsContact C-N 3.3Å; G1676-F1678 WeakPolarHBondContact O-CD2 3.4Å; G1676-F1678 PolarHBondContact O-N 2.91Å; G1676-F1678 VanDerWaalsContact O-N 3.11Å; G1676-P1751 CarbonylContact O-C 3.58Å; G1676-P1751 WeakPolarHBondContact O-CA 3.41Å; G1676-I1752 PolarHBondContact O-N 3.14Å
1677	N	92.6	Very high	87.7	Confident	1.2 Å²	1.2	10.2 Å²	10.2	1%	0.006	5%	0.046	C	C	.	.	B	Isolated β-bridge	trans	-82.9	81.2	166.3	-175	4.1	0	0	0	110.5	S1591 E1594 C1672 I1675 N1679 G1680 A1681 I1752	S1591-N1677 WeakPolarHBondContact CA-ND2 3.13Å; S1591-N1677 VanDerWaalsContact OG-CB 3.3Å; S1591-N1677 WeakPolarHBondContact OG-CB 3.31Å; S1591-N1677 PolarHBondContact OG-ND2 2.92Å; E1594-N1677 PolarHBondContact OE2-ND2 3.22Å; E1594-N1677 PolarHBondContact OE2-OD1 3.17Å; E1594-N1677 VanDerWaalsContact OE2-OD1 3.04Å; C1672-N1677 CarbonylContact C-O 3.51Å; C1672-N1677 HydrophobicContact CB-CB 4.23Å; C1672-N1677 CarbonylContact O-C 3.46Å; C1672-N1677 WeakPolarHBondContact O-CA 3.37Å; C1672-N1677 WeakPolarHBondContact O-CB 3.29Å; C1672-N1677 PolarHBondContact O-N 3.22Å; I1675-N1677 HydrophobicContact CG1-CB 4.32Å; N1677-N1679 VanDerWaalsContact C-N 3.27Å; N1677-N1679 PolarHBondContact O-N 3Å; N1677-N1679 WeakPolarHBondContact OD1-CA 3.4Å; N1677-N1679 WeakPolarHBondContact OD1-CB 3.38Å; N1677-N1679 PolarHBondContact OD1-N 3.14Å; N1677-N1679 VanDerWaalsContact OD1-N 3.12Å; N1677-G1680 PolarHBondContact ND2-N 3.08Å; N1677-G1680 PolarHBondContact OD1-N 3.17Å; N1677-A1681 WeakPolarHBondContact O-CB 3.35Å; N1677-A1681 PolarHBondContact O-N 3.23Å; N1677-I1752 HydrophobicContact CB-CB 4.41Å; N1677-I1752 HydrophobicContact CB-CD1 4.05Å
1678	F	91.9	Very high	86.9	Confident	3.2 Å²	3.2	8.2 Å²	8.2	1%	0.014	4%	0.04	C	C	.	.	H	α-helix	trans	-68.5	-27.8	176.6	-50.8	-62.5	0	0	0	111.9	W1673 G1676 T1682 L1736 A1739 P1751 I1752 I1861	W1673-F1678 AromaticContact CE3-CD1 3.63Å; W1673-F1678 HydrophobicContact CE3-CD1 3.63Å; W1673-F1678 AromaticContact CE3-CE1 3.8Å; W1673-F1678 HydrophobicContact CE3-CE1 3.8Å; W1673-F1678 HydrophobicContact CH2-CE1 4.29Å; W1673-F1678 AromaticContact CZ3-CD1 3.57Å; W1673-F1678 HydrophobicContact CZ3-CD1 3.57Å; W1673-F1678 VanDerWaalsContact CZ3-CD1 3.49Å; W1673-F1678 AromaticContact CZ3-CE1 3.59Å; W1673-F1678 HydrophobicContact CZ3-CE1 3.59Å; G1676-F1678 VanDerWaalsContact C-N 3.3Å; G1676-F1678 WeakPolarHBondContact O-CD2 3.4Å; G1676-F1678 PolarHBondContact O-N 2.91Å; G1676-F1678 VanDerWaalsContact O-N 3.11Å; F1678-T1682 VanDerWaalsContact O-CB 3.27Å; F1678-T1682 WeakPolarHBondContact O-CB 3.26Å; F1678-T1682 PolarHBondContact O-N 2.98Å; F1678-T1682 VanDerWaalsContact O-N 3.12Å; F1678-T1682 PolarHBondContact O-OG1 3.08Å; F1678-L1736 HydrophobicContact CB-CD1 4.39Å; F1678-L1736 HydrophobicContact CD1-CD1 3.7Å; F1678-L1736 HydrophobicContact CD2-CD1 4.43Å; F1678-L1736 HydrophobicContact CE1-CD1 4.04Å; F1678-L1736 HydrophobicContact CG-CD1 3.95Å; F1678-L1736 HydrophobicContact CZ-CD1 4.47Å; F1678-A1739 HydrophobicContact CE1-CB 4.06Å; F1678-A1739 HydrophobicContact CZ-CB 4.09Å; F1678-P1751 HydrophobicContact CE2-CB 4.48Å; F1678-I1752 WeakPolarHBondContact CA-O 3.44Å; F1678-I1752 WeakPolarHBondContact CB-O 3.42Å; F1678-I1752 PolarHBondContact N-O 3.11Å; F1678-I1861 HydrophobicContact CZ-CG2 4.4Å
1679	N	90.5	Very high	85.7	Confident	0.2 Å²	0.2	9.3 Å²	9.3	0%	0.001	5%	0.047	C	C	.	.	H	α-helix	trans	-66.4	-61.6	176.3	-175.5	71.5	0	0	0	112	E1594 N1677 A1681 T1682 E1683 I1752 F1754 F1755	E1594-N1679 PolarHBondContact OE2-ND2 2.96Å; N1677-N1679 VanDerWaalsContact C-N 3.27Å; N1677-N1679 PolarHBondContact O-N 3Å; N1677-N1679 WeakPolarHBondContact OD1-CA 3.4Å; N1677-N1679 WeakPolarHBondContact OD1-CB 3.38Å; N1677-N1679 PolarHBondContact OD1-N 3.14Å; N1677-N1679 VanDerWaalsContact OD1-N 3.12Å; N1679-A1681 VanDerWaalsContact C-N 3.3Å; N1679-A1681 PolarHBondContact O-N 2.97Å; N1679-T1682 CarbonylContact O-C 3.55Å; N1679-T1682 WeakPolarHBondContact O-CA 3.35Å; N1679-T1682 VanDerWaalsContact O-CB 3.31Å; N1679-T1682 WeakPolarHBondContact O-CB 3.26Å; N1679-T1682 PolarHBondContact O-N 2.96Å; N1679-E1683 PolarHBondContact ND2-OE1 3.11Å; N1679-E1683 VanDerWaalsContact O-CG 3.25Å; N1679-E1683 WeakPolarHBondContact O-CG 3.44Å; N1679-E1683 PolarHBondContact O-N 3.27Å; N1679-I1752 HydrophobicContact CB-CB 4.44Å; N1679-I1752 HydrophobicContact CB-CG2 3.85Å; N1679-I1752 PolarHBondContact N-O 3.01Å; N1679-I1752 VanDerWaalsContact N-O 3.1Å; N1679-F1754 WeakPolarHBondContact OD1-CD2 3.47Å; N1679-F1755 WeakPolarHBondContact OD1-CD1 3.4Å; N1679-F1755 WeakPolarHBondContact OD1-CE1 3.28Å
1680	G	88.1	Confident	83.9	Confident	0.6 Å²	0.6	14.5 Å²	14.5	1%	0.006	7%	0.066	C	C	.	.	H	α-helix	trans	-60.8	-36.6	-178.1	0	0	0	0	0	113	E1594 N1677 T1682 E1683 I1684	E1594-G1680 WeakPolarHBondContact OE2-CA 3.33Å; E1594-G1680 PolarHBondContact OE2-N 2.88Å; E1594-G1680 VanDerWaalsContact OE2-N 3.12Å; N1677-G1680 PolarHBondContact ND2-N 3.08Å; N1677-G1680 PolarHBondContact OD1-N 3.17Å; G1680-T1682 VanDerWaalsContact C-N 3.34Å; G1680-T1682 PolarHBondContact O-N 3.09Å; G1680-E1683 PolarHBondContact O-N 3.16Å; G1680-I1684 VanDerWaalsContact O-CG1 3.29Å; G1680-I1684 WeakPolarHBondContact O-CG1 3.4Å; G1680-I1684 PolarHBondContact O-N 3.2Å; G1680-I1684 VanDerWaalsContact O-N 3.08Å
1681	A	90	Very high	81.5	Confident	0.2 Å²	0.2	18.5 Å²	18.5	0%	0.002	8%	0.084	C	C	.	.	H	α-helix	trans	-59.2	-46.1	171	0	0	0	0	0	111.3	C1672 W1673 N1677 N1679 I1684 L1685 L1727	C1672-A1681 HydrophobicContact CB-CB 3.85Å; W1673-A1681 HydrophobicContact CB-CB 4.23Å; N1677-A1681 WeakPolarHBondContact O-CB 3.35Å; N1677-A1681 PolarHBondContact O-N 3.23Å; N1679-A1681 VanDerWaalsContact C-N 3.3Å; N1679-A1681 PolarHBondContact O-N 2.97Å; A1681-I1684 PolarHBondContact O-N 2.96Å; A1681-L1685 WeakPolarHBondContact O-CB 3.35Å; A1681-L1685 WeakPolarHBondContact O-CD1 3.39Å; A1681-L1685 WeakPolarHBondContact O-CG 3.28Å; A1681-L1685 PolarHBondContact O-N 3.29Å; A1681-L1727 HydrophobicContact CB-CD1 3.69Å
1682	T	85.6	Confident	78.7	Confident	0.8 Å²	0.8	24.8 Å²	24.8	1%	0.005	11%	0.11	C	C	.	.	H	α-helix	trans	-65.8	-40.1	177.8	-59.5	0	0	0	0	112	F1678 N1679 G1680 I1684 L1685 Y1686 L1728 F1754	F1678-T1682 VanDerWaalsContact O-CB 3.27Å; F1678-T1682 WeakPolarHBondContact O-CB 3.26Å; F1678-T1682 PolarHBondContact O-N 2.98Å; F1678-T1682 VanDerWaalsContact O-N 3.12Å; F1678-T1682 PolarHBondContact O-OG1 3.08Å; N1679-T1682 CarbonylContact O-C 3.55Å; N1679-T1682 WeakPolarHBondContact O-CA 3.35Å; N1679-T1682 VanDerWaalsContact O-CB 3.31Å; N1679-T1682 WeakPolarHBondContact O-CB 3.26Å; N1679-T1682 PolarHBondContact O-N 2.96Å; G1680-T1682 VanDerWaalsContact C-N 3.34Å; G1680-T1682 PolarHBondContact O-N 3.09Å; T1682-I1684 PolarHBondContact O-N 2.99Å; T1682-L1685 PolarHBondContact O-N 3.06Å; T1682-Y1686 HydrophobicContact CG2-CD2 3.53Å; T1682-Y1686 VanDerWaalsContact CG2-CD2 3.45Å; T1682-Y1686 HydrophobicContact CG2-CE2 3.54Å; T1682-Y1686 VanDerWaalsContact CG2-CE2 3.47Å; T1682-Y1686 WeakPolarHBondContact O-CB 3.39Å; T1682-Y1686 VanDerWaalsContact O-CD2 3.29Å; T1682-Y1686 WeakPolarHBondContact O-CD2 3.43Å; T1682-Y1686 PolarHBondContact O-N 3.31Å; T1682-L1728 HydrophobicContact CG2-CD2 4.14Å; T1682-F1754 HydrophobicContact CG2-CD1 3.92Å; T1682-F1754 HydrophobicContact CG2-CD2 3.8Å; T1682-F1754 HydrophobicContact CG2-CE1 3.87Å; T1682-F1754 HydrophobicContact CG2-CE2 3.75Å; T1682-F1754 HydrophobicContact CG2-CG 3.9Å; T1682-F1754 HydrophobicContact CG2-CZ 3.79Å
1683	E	83.5	Confident	75.9	Confident	1.2 Å²	1.2	28.6 Å²	28.6	1%	0.006	14%	0.137	C	C	.	.	H	α-helix	trans	-60.6	-46.8	176	-72	-169.2	-164.9	0	0	112.5	F1633 V1636 S1637 N1679 G1680 Y1686 G1687	F1633-E1683 HydrophobicContact CB-CG 4.42Å; F1633-E1683 HydrophobicContact CD2-CB 4.18Å; F1633-E1683 HydrophobicContact CD2-CG 3.33Å; F1633-E1683 WeakPolarHBondContact CD2-OE1 3.27Å; F1633-E1683 HydrophobicContact CE2-CB 4.42Å; F1633-E1683 HydrophobicContact CE2-CG 3.66Å; F1633-E1683 VanDerWaalsContact CE2-CG 3.45Å; F1633-E1683 HydrophobicContact CG-CG 4.1Å; F1633-E1683 HydrophobicContact CZ-CG 4.46Å; V1636-E1683 HydrophobicContact CB-CB 4.37Å; V1636-E1683 VanDerWaalsContact CB-OE2 3.25Å; V1636-E1683 WeakPolarHBondContact CB-OE2 3.18Å; V1636-E1683 HydrophobicContact CG1-CB 3.95Å; V1636-E1683 WeakPolarHBondContact CG1-OE2 3.35Å; V1636-E1683 VanDerWaalsContact CG2-OE2 3.26Å; V1636-E1683 WeakPolarHBondContact CG2-OE2 3.3Å; S1637-E1683 WeakPolarHBondContact CB-O 3.37Å; N1679-E1683 PolarHBondContact ND2-OE1 3.11Å; N1679-E1683 VanDerWaalsContact O-CG 3.25Å; N1679-E1683 WeakPolarHBondContact O-CG 3.44Å; N1679-E1683 PolarHBondContact O-N 3.27Å; G1680-E1683 PolarHBondContact O-N 3.16Å; E1683-Y1686 PolarHBondContact O-N 3.08Å; E1683-G1687 PolarHBondContact O-N 2.84Å
1684	I	83.2	Confident	73	Confident	4.6 Å²	4.6	36.1 Å²	36.1	2%	0.024	17%	0.172	C	C	.	.	H	α-helix	trans	-64.5	-44.4	177.5	-64.1	165	0	0	0	110.3	L1590 V1645 I1665 A1668 A1669 G1680 A1681 T1682 G1687 L1688	L1590-I1684 HydrophobicContact CD1-CD1 4.45Å; L1590-I1684 HydrophobicContact CD2-CD1 4.08Å; V1645-I1684 HydrophobicContact CG2-CG2 4.43Å; I1665-I1684 HydrophobicContact CG2-CG2 3.62Å; I1665-I1684 VanDerWaalsContact CG2-CG2 3.46Å; A1668-I1684 HydrophobicContact CB-CD1 4.34Å; A1669-I1684 HydrophobicContact CB-CB 4.11Å; A1669-I1684 HydrophobicContact CB-CD1 4.32Å; A1669-I1684 HydrophobicContact CB-CG2 3.83Å; G1680-I1684 VanDerWaalsContact O-CG1 3.29Å; G1680-I1684 WeakPolarHBondContact O-CG1 3.4Å; G1680-I1684 PolarHBondContact O-N 3.2Å; G1680-I1684 VanDerWaalsContact O-N 3.08Å; A1681-I1684 PolarHBondContact O-N 2.96Å; T1682-I1684 PolarHBondContact O-N 2.99Å; I1684-G1687 CarbonylContact O-C 3.59Å; I1684-G1687 WeakPolarHBondContact O-CA 3.22Å; I1684-G1687 PolarHBondContact O-N 2.96Å; I1684-G1687 VanDerWaalsContact O-N 3.15Å; I1684-L1688 HydrophobicContact CG2-CD1 4.32Å; I1684-L1688 WeakPolarHBondContact O-CG 3.3Å; I1684-L1688 PolarHBondContact O-N 3.15Å; I1684-L1688 VanDerWaalsContact O-N 3.09Å
1685	L	82.3	Confident	70.2	Confident	1.4 Å²	1.4	40.2 Å²	40.2	1%	0.007	20%	0.201	C	C	.	.	H	α-helix	trans	-65.7	-40.3	179.6	-69.9	170	0	0	0	112.6	A1669 A1681 T1682 G1687 L1688 S1689 F1720 L1723 L1727 L1728	A1669-L1685 HydrophobicContact CB-CD2 4.45Å; A1669-L1685 HydrophobicContact CB-CG 4.42Å; A1681-L1685 WeakPolarHBondContact O-CB 3.35Å; A1681-L1685 WeakPolarHBondContact O-CD1 3.39Å; A1681-L1685 WeakPolarHBondContact O-CG 3.28Å; A1681-L1685 PolarHBondContact O-N 3.29Å; T1682-L1685 PolarHBondContact O-N 3.06Å; L1685-G1687 VanDerWaalsContact C-N 3.3Å; L1685-G1687 PolarHBondContact O-N 3.18Å; L1685-L1688 PolarHBondContact O-N 3.18Å; L1685-S1689 WeakPolarHBondContact O-CA 3.39Å; L1685-S1689 VanDerWaalsContact O-CB 3.27Å; L1685-S1689 WeakPolarHBondContact O-CB 3.35Å; L1685-S1689 PolarHBondContact O-N 3.28Å; L1685-S1689 PolarHBondContact O-OG 3.23Å; L1685-F1720 HydrophobicContact CD2-CD2 3.62Å; L1685-F1720 HydrophobicContact CD2-CE2 3.6Å; L1685-L1723 HydrophobicContact CD1-CB 3.93Å; L1685-L1723 HydrophobicContact CD2-CB 4.27Å; L1685-L1727 HydrophobicContact CD1-CB 4.12Å; L1685-L1727 HydrophobicContact CD1-CD1 3.57Å; L1685-L1727 HydrophobicContact CD1-CG 4.43Å; L1685-L1728 HydrophobicContact CB-CD1 4.22Å; L1685-L1728 HydrophobicContact CB-CD2 4.32Å; L1685-L1728 HydrophobicContact CB-CG 4.36Å
1686	Y	75.6	Confident	67.5	Low	58.8 Å²	58.8	46.7 Å²	46.7	23%	0.231	24%	0.236	C	C	.	.	H	α-helix	trans	-64	-35.4	171.2	-90.8	-70.2	0	0	0	112	F1549 F1633 T1682 E1683 L1688 S1689 R1690 L1728 F1754	F1549-Y1686 WeakPolarHBondContact CD2-OH 3.46Å; F1549-Y1686 WeakPolarHBondContact CE2-OH 3.46Å; F1549-Y1686 WeakPolarHBondContact CG-OH 3.45Å; F1633-Y1686 HydrophobicContact CE2-CD2 4.34Å; F1633-Y1686 AromaticContact CZ-CD2 3.8Å; F1633-Y1686 HydrophobicContact CZ-CD2 3.8Å; F1633-Y1686 HydrophobicContact CZ-CE2 4.35Å; F1633-Y1686 AromaticContact CZ-CG 4Å; F1633-Y1686 HydrophobicContact CZ-CG 4.21Å; T1682-Y1686 HydrophobicContact CG2-CD2 3.53Å; T1682-Y1686 VanDerWaalsContact CG2-CD2 3.45Å; T1682-Y1686 HydrophobicContact CG2-CE2 3.54Å; T1682-Y1686 VanDerWaalsContact CG2-CE2 3.47Å; T1682-Y1686 WeakPolarHBondContact O-CB 3.39Å; T1682-Y1686 VanDerWaalsContact O-CD2 3.29Å; T1682-Y1686 WeakPolarHBondContact O-CD2 3.43Å; T1682-Y1686 PolarHBondContact O-N 3.31Å; E1683-Y1686 PolarHBondContact O-N 3.08Å; Y1686-L1688 VanDerWaalsContact C-N 3.3Å; Y1686-L1688 PolarHBondContact O-N 3.02Å; Y1686-S1689 WeakPolarHBondContact CA-OG 3.16Å; Y1686-S1689 PolarHBondContact O-N 3.17Å; Y1686-S1689 VanDerWaalsContact O-O 3.06Å; Y1686-R1690 WeakPolarHBondContact O-CB 3.28Å; Y1686-R1690 PolarHBondContact O-N 3.18Å; Y1686-L1728 HydrophobicContact CD1-CD2 4.42Å; Y1686-L1728 HydrophobicContact CD2-CD2 3.62Å; Y1686-L1728 HydrophobicContact CE1-CD2 4.26Å; Y1686-L1728 HydrophobicContact CE2-CD2 3.45Å; Y1686-L1728 VanDerWaalsContact CE2-CD2 3.47Å; Y1686-L1728 HydrophobicContact CG-CD2 4.14Å; Y1686-F1754 HydrophobicContact CE2-CE1 4.37Å; Y1686-F1754 HydrophobicContact CE2-CZ 4.32Å
1687	G	70.2	Confident	64.9	Low	5.6 Å²	5.6	53.9 Å²	53.9	6%	0.058	26%	0.263	C	S	.	.	H	α-helix	trans	-63.4	-30	174	0	0	0	0	0	114	S1637 S1642 S1643 E1683 I1684 L1685	S1637-G1687 VanDerWaalsContact O-CA 3.25Å; S1637-G1687 WeakPolarHBondContact O-CA 3.32Å; S1642-G1687 WeakPolarHBondContact CA-O 3.09Å; S1642-G1687 VanDerWaalsContact CB-O 3.29Å; S1642-G1687 WeakPolarHBondContact CB-O 3.5Å; S1642-G1687 PolarHBondContact OG-O 2.79Å; S1642-G1687 VanDerWaalsContact OG-O 3.07Å; S1643-G1687 WeakPolarHBondContact CB-O 3.36Å; S1643-G1687 WeakPolarHBondContact OG-CA 3.49Å; E1683-G1687 PolarHBondContact O-N 2.84Å; I1684-G1687 CarbonylContact O-C 3.59Å; I1684-G1687 WeakPolarHBondContact O-CA 3.22Å; I1684-G1687 PolarHBondContact O-N 2.96Å; I1684-G1687 VanDerWaalsContact O-N 3.15Å; L1685-G1687 VanDerWaalsContact C-N 3.3Å; L1685-G1687 PolarHBondContact O-N 3.18Å
1688	L	72.6	Confident	62.1	Low	10 Å²	10	60.4 Å²	60.4	5%	0.052	30%	0.297	C	S	.	.	H	α-helix	trans	-87	-38	174.6	-69.7	175.7	0	0	0	113.4	V1645 I1649 L1662 I1665 V1666 I1684 L1685 Y1686 R1690 S1701 W1709 F1720	V1645-L1688 HydrophobicContact CG1-CD2 3.64Å; V1645-L1688 HydrophobicContact CG1-CG 3.92Å; I1649-L1688 HydrophobicContact CD1-CD2 4.03Å; L1662-L1688 HydrophobicContact CD1-CD1 4.46Å; L1662-L1688 HydrophobicContact CD1-CD2 3.75Å; I1665-L1688 HydrophobicContact CG2-CD1 3.95Å; I1665-L1688 HydrophobicContact CG2-CD2 4.14Å; I1665-L1688 HydrophobicContact CG2-CG 4.15Å; V1666-L1688 HydrophobicContact CG2-CD1 4.19Å; I1684-L1688 HydrophobicContact CG2-CD1 4.32Å; I1684-L1688 WeakPolarHBondContact O-CG 3.3Å; I1684-L1688 PolarHBondContact O-N 3.15Å; I1684-L1688 VanDerWaalsContact O-N 3.09Å; L1685-L1688 PolarHBondContact O-N 3.18Å; Y1686-L1688 VanDerWaalsContact C-N 3.3Å; Y1686-L1688 PolarHBondContact O-N 3.02Å; L1688-R1690 VanDerWaalsContact C-N 3.35Å; L1688-R1690 PolarHBondContact O-N 2.94Å; L1688-S1701 WeakPolarHBondContact O-CB 3.39Å; L1688-S1701 PolarHBondContact O-OG 2.87Å; L1688-W1709 HydrophobicContact CB-CH2 4.4Å; L1688-W1709 HydrophobicContact CB-CZ2 4.25Å; L1688-W1709 HydrophobicContact CD1-CH2 4.28Å; L1688-W1709 HydrophobicContact CD2-CH2 4.39Å; L1688-W1709 HydrophobicContact CD2-CZ2 4.13Å; L1688-F1720 HydrophobicContact CB-CE2 3.66Å; L1688-F1720 HydrophobicContact CB-CZ 3.98Å; L1688-F1720 HydrophobicContact CD1-CD2 3.89Å; L1688-F1720 HydrophobicContact CD1-CE2 3.59Å; L1688-F1720 VanDerWaalsContact CD1-CE2 3.5Å; L1688-F1720 HydrophobicContact CD1-CZ 4.46Å; L1688-F1720 HydrophobicContact CG-CE2 4.29Å
1689	S	64.3	Low	59.4	Low	22.4 Å²	22.4	63.9 Å²	63.9	16%	0.157	32%	0.321	C	S	.	.	H	α-helix	trans	-91.2	60.2	-169	-43.1	0	0	0	0	113.2	L1685 Y1686 K1691 F1720 L1728	L1685-S1689 WeakPolarHBondContact O-CA 3.39Å; L1685-S1689 VanDerWaalsContact O-CB 3.27Å; L1685-S1689 WeakPolarHBondContact O-CB 3.35Å; L1685-S1689 PolarHBondContact O-N 3.28Å; L1685-S1689 PolarHBondContact O-OG 3.23Å; Y1686-S1689 WeakPolarHBondContact CA-OG 3.16Å; Y1686-S1689 PolarHBondContact O-N 3.17Å; Y1686-S1689 VanDerWaalsContact O-O 3.06Å; S1689-K1691 PolarHBondContact O-N 3.01Å; S1689-F1720 VanDerWaalsContact OG-CZ 3.3Å; S1689-F1720 WeakPolarHBondContact OG-CZ 3.38Å; S1689-L1728 WeakPolarHBondContact OG-CD1 3.39Å
1690	R	52.6	Low	56.8	Low	109 Å²	109	66.5 Å²	66.5	41%	0.411	33%	0.332	S	S	.	.			trans	-77	73.2	-177.9	-138.8	-177.1	-173.7	-177.1	1.7	112.9	T1638 V1641 Y1686 L1688 F1692 S1701 S1702	T1638-R1690 PolarHBondContact O-NH1 2.81Å; T1638-R1690 PolarHBondContact O-NH2 3.43Å; V1641-R1690 PolarHBondContact O-NH1 3.14Å; Y1686-R1690 WeakPolarHBondContact O-CB 3.28Å; Y1686-R1690 PolarHBondContact O-N 3.18Å; L1688-R1690 VanDerWaalsContact C-N 3.35Å; L1688-R1690 PolarHBondContact O-N 2.94Å; R1690-F1692 PolarHBondContact O-N 3.34Å; R1690-F1692 VanDerWaalsContact O-N 3.14Å; R1690-S1701 PolarHBondContact N-OG 3.38Å; R1690-S1701 PolarHBondContact O-OG 2.97Å; R1690-S1702 PolarHBondContact NH1-OG 2.9Å
1691	K	41.8	Very low	54.6	Low	122.2 Å²	122.2	68.2 Å²	68.2	53%	0.531	34%	0.344	S	S	.	.			trans	-99.2	96.6	171.5	-143.2	-179.9	180	175.1	0	111.4	S1689 S1693 C1699 F1700 S1701	S1689-K1691 PolarHBondContact O-N 3.01Å; K1691-S1693 PolarHBondContact O-N 3.05Å; K1691-C1699 WeakPolarHBondContact CD-O 3.42Å; K1691-C1699 WeakPolarHBondContact CE-O 3.41Å; K1691-C1699 PolarHBondContact NZ-O 2.94Å; K1691-C1699 PolarHBondContact NZ-SG 2.85Å; K1691-F1700 PolarHBondContact NZ-O 3.49Å; K1691-S1701 VanDerWaalsContact CB-OG 3.28Å; K1691-S1701 WeakPolarHBondContact CB-OG 3.31Å; K1691-S1701 WeakPolarHBondContact CD-OG 3.45Å; K1691-S1701 WeakPolarHBondContact CG-OG 3.32Å; K1691-S1701 PolarHBondContact N-OG 3.11Å; K1691-S1701 VanDerWaalsContact N-OG 3.16Å; K1691-S1701 PolarHBondContact NZ-OG 2.95Å
1692	F	32.6	Very low	52.5	Low	142.6 Å²	142.6	69.9 Å²	69.9	63%	0.625	36%	0.356	S	S	*	.			trans	-91.4	137.3	165.7	-101.4	-88.3	0	0	0	110.8	H1550 V1554 R1690 H1694 C1695 N1696 C1699	H1550-F1692 AromaticContact CD2-CD1 3.85Å; V1554-F1692 HydrophobicContact CG1-CZ 4.3Å; R1690-F1692 PolarHBondContact O-N 3.34Å; R1690-F1692 VanDerWaalsContact O-N 3.14Å; F1692-H1694 PolarHBondContact O-N 3.48Å; F1692-C1695 VanDerWaalsContact CE1-C 3.48Å; F1692-C1695 HydrophobicContact CE1-CB 4.13Å; F1692-C1695 WeakPolarHBondContact CE1-O 3.49Å; F1692-C1695 WeakPolarHBondContact CZ-O 3.32Å; F1692-N1696 WeakPolarHBondContact CZ-O 3.31Å; F1692-C1699 HydrophobicContact CE2-CB 4.33Å; F1692-C1699 HydrophobicContact CZ-CB 3.9Å
1693	S	33.2	Very low	50.7	Low	79.4 Å²	79.4	77.6 Å²	77.6	56%	0.555	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	122.3	173.1	-171	0	0	0	0	112.7	M1548 H1550 K1691	M1548-S1693 WeakPolarHBondContact CE-OG 3.11Å; H1550-S1693 PolarHBondContact CD2-N 3.3Å; H1550-S1693 PolarHBondContact NE2-N 3Å; H1550-S1693 VanDerWaalsContact NE2-N 3.13Å; K1691-S1693 PolarHBondContact O-N 3.05Å
1694	H	32	Very low	49.2	Very low	169.4 Å²	169.4	82.7 Å²	82.7	78%	0.784	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	116.1	22.5	179.1	-84.4	63.2	0	0	0	119.3	F1692	F1692-H1694 PolarHBondContact O-N 3.48Å
1695	C	31	Very low	48	Very low	101.6 Å²	101.6	82.9 Å²	82.9	69%	0.686	42%	0.415	S	S	*	.	S	Bend	trans	-138	130.2	168.9	-83.3	0	0	0	0	113.7	F1692 W1697 C1699 F1700	F1692-C1695 VanDerWaalsContact CE1-C 3.48Å; F1692-C1695 HydrophobicContact CE1-CB 4.13Å; F1692-C1695 WeakPolarHBondContact CE1-O 3.49Å; F1692-C1695 WeakPolarHBondContact CZ-O 3.32Å; C1695-W1697 PolarHBondContact O-N 3.24Å; C1695-C1699 HydrophobicContact CB-CB 4.2Å; C1695-F1700 VanDerWaalsContact O-CE2 3.24Å; C1695-F1700 WeakPolarHBondContact O-CE2 3.38Å
1696	N	33.7	Very low	47	Very low	147.2 Å²	147.2	87.5 Å²	87.5	79%	0.787	44%	0.436	S	S	*	.			trans	-48.2	129.3	179.6	-150.3	-4.1	0	0	0	113.8	F1692 L1698 C1699	F1692-N1696 WeakPolarHBondContact CZ-O 3.31Å; N1696-L1698 PolarHBondContact O-N 3.18Å; N1696-C1699 PolarHBondContact O-N 3.14Å; N1696-C1699 VanDerWaalsContact O-N 3.08Å
1697	W	35	Very low	46.2	Very low	150.4 Å²	150.4	87.7 Å²	87.7	57%	0.57	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	1.5	-168.3	-155.4	78.9	0	0	0	114.6	C1695 C1699 F1700 M1721	C1695-W1697 PolarHBondContact O-N 3.24Å; W1697-C1699 PolarHBondContact O-N 3.33Å; W1697-F1700 VanDerWaalsContact C-CD2 3.47Å; W1697-F1700 VanDerWaalsContact CA-CE2 3.42Å; W1697-F1700 HydrophobicContact CB-CD2 4.17Å; W1697-F1700 HydrophobicContact CB-CE2 4.22Å; W1697-F1700 AromaticContact CD1-CE2 3.86Å; W1697-F1700 AromaticContact CD1-CZ 3.91Å; W1697-F1700 HydrophobicContact CD2-CB 4.47Å; W1697-F1700 AromaticContact CD2-CD1 3.95Å; W1697-F1700 HydrophobicContact CD2-CD1 3.95Å; W1697-F1700 HydrophobicContact CD2-CD2 4.24Å; W1697-F1700 HydrophobicContact CD2-CE1 4.14Å; W1697-F1700 AromaticContact CD2-CE2 3.78Å; W1697-F1700 HydrophobicContact CD2-CE2 4.1Å; W1697-F1700 AromaticContact CD2-CG 3.89Å; W1697-F1700 HydrophobicContact CD2-CG 3.89Å; W1697-F1700 HydrophobicContact CD2-CZ 4.24Å; W1697-F1700 AromaticContact CE2-CE1 3.88Å; W1697-F1700 AromaticContact CE2-CE2 3.41Å; W1697-F1700 VanDerWaalsContact CE2-CE2 3.47Å; W1697-F1700 AromaticContact CE2-CZ 3.81Å; W1697-F1700 HydrophobicContact CE3-CB 3.9Å; W1697-F1700 HydrophobicContact CE3-CD1 4.02Å; W1697-F1700 HydrophobicContact CE3-CD2 4.34Å; W1697-F1700 AromaticContact CE3-CG 3.82Å; W1697-F1700 HydrophobicContact CE3-CG 3.82Å; W1697-F1700 AromaticContact CG-CD2 4Å; W1697-F1700 HydrophobicContact CG-CD2 4Å; W1697-F1700 AromaticContact CG-CE2 3.9Å; W1697-F1700 HydrophobicContact CG-CE2 3.9Å; W1697-F1700 HydrophobicContact CG-CG 4.3Å; W1697-F1700 HydrophobicContact CG-CZ 4.14Å; W1697-F1700 HydrophobicContact CH2-CD1 4.28Å; W1697-F1700 HydrophobicContact CH2-CE2 4.42Å; W1697-F1700 HydrophobicContact CZ2-CD1 4.2Å; W1697-F1700 HydrophobicContact CZ2-CD2 4.34Å; W1697-F1700 HydrophobicContact CZ2-CE1 4.21Å; W1697-F1700 AromaticContact CZ2-CE2 3.56Å; W1697-F1700 HydrophobicContact CZ2-CE2 3.56Å; W1697-F1700 VanDerWaalsContact CZ2-CE2 3.41Å; W1697-F1700 AromaticContact CZ2-CZ 3.85Å; W1697-F1700 HydrophobicContact CZ2-CZ 3.85Å; W1697-F1700 HydrophobicContact CZ3-CB 4.23Å; W1697-F1700 HydrophobicContact CZ3-CD1 4.19Å; W1697-F1700 HydrophobicContact CZ3-CG 4.31Å; W1697-F1700 AromaticContact NE1-CE2 3.65Å; W1697-F1700 AromaticContact NE1-CZ 3.74Å; W1697-F1700 VanDerWaalsContact O-CB 3.29Å; W1697-F1700 WeakPolarHBondContact O-CB 3.38Å; W1697-F1700 VanDerWaalsContact O-CD2 3.28Å; W1697-F1700 WeakPolarHBondContact O-CD2 3.4Å; W1697-F1700 VanDerWaalsContact O-CE2 3.22Å; W1697-F1700 WeakPolarHBondContact O-CE2 3.21Å; W1697-F1700 PolarHBondContact O-N 3.22Å; W1697-M1721 HydrophobicContact CD2-CE 3.99Å; W1697-M1721 HydrophobicContact CE3-CE 4.21Å; W1697-M1721 HydrophobicContact CH2-CE 3.86Å; W1697-M1721 HydrophobicContact CH2-CG 4.18Å; W1697-M1721 HydrophobicContact CH2-SD 3.76Å; W1697-M1721 HydrophobicContact CZ2-CE 3.65Å; W1697-M1721 VanDerWaalsContact CZ2-CE 3.48Å; W1697-M1721 HydrophobicContact CZ2-CG 3.83Å; W1697-M1721 HydrophobicContact CZ2-SD 3.2Å; W1697-M1721 WeakPolarHBondContact CZ2-SD 3.43Å; W1697-M1721 HydrophobicContact CZ3-CE 4.2Å; W1697-M1721 HydrophobicContact CZ3-CG 4.29Å; W1697-M1721 PolarHBondContact NE1-SD 3.14Å
1698	L	34.9	Very low	45.8	Very low	137.2 Å²	137.2	87.8 Å²	87.8	72%	0.718	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	3.9	-179.3	-93.7	149.4	0	0	0	114.8	N1696 F1700 Q1706 M1721	N1696-L1698 PolarHBondContact O-N 3.18Å; L1698-F1700 HydrophobicContact CB-CE2 4.34Å; L1698-F1700 VanDerWaalsContact O-CD2 3.27Å; L1698-F1700 WeakPolarHBondContact O-CD2 3.34Å; L1698-F1700 PolarHBondContact O-N 2.94Å; L1698-Q1706 PolarHBondContact O-NE2 3.32Å; L1698-M1721 HydrophobicContact CD1-SD 4.45Å; L1698-M1721 HydrophobicContact CD2-CE 3.77Å; L1698-M1721 HydrophobicContact CD2-SD 3.58Å; L1698-M1721 VanDerWaalsContact CD2-SD 3.58Å; L1698-M1721 HydrophobicContact CG-SD 4.46Å
1699	C	34.2	Very low	45.5	Very low	76.2 Å²	76.2	88.6 Å²	88.6	52%	0.515	45%	0.446	S	S	.	.			trans	-96.1	51.7	-173.3	-121.2	0	0	0	0	113.6	K1691 F1692 C1695 N1696 W1697 S1701	K1691-C1699 WeakPolarHBondContact CD-O 3.42Å; K1691-C1699 WeakPolarHBondContact CE-O 3.41Å; K1691-C1699 PolarHBondContact NZ-O 2.94Å; K1691-C1699 PolarHBondContact NZ-SG 2.85Å; F1692-C1699 HydrophobicContact CE2-CB 4.33Å; F1692-C1699 HydrophobicContact CZ-CB 3.9Å; C1695-C1699 HydrophobicContact CB-CB 4.2Å; N1696-C1699 PolarHBondContact O-N 3.14Å; N1696-C1699 VanDerWaalsContact O-N 3.08Å; W1697-C1699 PolarHBondContact O-N 3.33Å; C1699-S1701 PolarHBondContact O-N 3.34Å; C1699-S1701 PolarHBondContact O-OG 3.32Å; C1699-S1701 VanDerWaalsContact O-OG 3.08Å; C1699-S1701 VanDerWaalsContact SG-CB 3.55Å; C1699-S1701 PolarHBondContact SG-OG 3.4Å
1700	F	37.1	Very low	45.4	Very low	56.4 Å²	56.4	93.1 Å²	93.1	25%	0.247	47%	0.468	C	S	.	.			trans	-70.1	83.8	179.7	-83.4	-96.2	0	0	0	114.2	K1691 C1695 W1697 L1698 S1702 W1709 F1720 M1721	K1691-F1700 PolarHBondContact NZ-O 3.49Å; C1695-F1700 VanDerWaalsContact O-CE2 3.24Å; C1695-F1700 WeakPolarHBondContact O-CE2 3.38Å; W1697-F1700 VanDerWaalsContact C-CD2 3.47Å; W1697-F1700 VanDerWaalsContact CA-CE2 3.42Å; W1697-F1700 HydrophobicContact CB-CD2 4.17Å; W1697-F1700 HydrophobicContact CB-CE2 4.22Å; W1697-F1700 AromaticContact CD1-CE2 3.86Å; W1697-F1700 AromaticContact CD1-CZ 3.91Å; W1697-F1700 HydrophobicContact CD2-CB 4.47Å; W1697-F1700 AromaticContact CD2-CD1 3.95Å; W1697-F1700 HydrophobicContact CD2-CD1 3.95Å; W1697-F1700 HydrophobicContact CD2-CD2 4.24Å; W1697-F1700 HydrophobicContact CD2-CE1 4.14Å; W1697-F1700 AromaticContact CD2-CE2 3.78Å; W1697-F1700 HydrophobicContact CD2-CE2 4.1Å; W1697-F1700 AromaticContact CD2-CG 3.89Å; W1697-F1700 HydrophobicContact CD2-CG 3.89Å; W1697-F1700 HydrophobicContact CD2-CZ 4.24Å; W1697-F1700 AromaticContact CE2-CE1 3.88Å; W1697-F1700 AromaticContact CE2-CE2 3.41Å; W1697-F1700 VanDerWaalsContact CE2-CE2 3.47Å; W1697-F1700 AromaticContact CE2-CZ 3.81Å; W1697-F1700 HydrophobicContact CE3-CB 3.9Å; W1697-F1700 HydrophobicContact CE3-CD1 4.02Å; W1697-F1700 HydrophobicContact CE3-CD2 4.34Å; W1697-F1700 AromaticContact CE3-CG 3.82Å; W1697-F1700 HydrophobicContact CE3-CG 3.82Å; W1697-F1700 AromaticContact CG-CD2 4Å; W1697-F1700 HydrophobicContact CG-CD2 4Å; W1697-F1700 AromaticContact CG-CE2 3.9Å; W1697-F1700 HydrophobicContact CG-CE2 3.9Å; W1697-F1700 HydrophobicContact CG-CG 4.3Å; W1697-F1700 HydrophobicContact CG-CZ 4.14Å; W1697-F1700 HydrophobicContact CH2-CD1 4.28Å; W1697-F1700 HydrophobicContact CH2-CE2 4.42Å; W1697-F1700 HydrophobicContact CZ2-CD1 4.2Å; W1697-F1700 HydrophobicContact CZ2-CD2 4.34Å; W1697-F1700 HydrophobicContact CZ2-CE1 4.21Å; W1697-F1700 AromaticContact CZ2-CE2 3.56Å; W1697-F1700 HydrophobicContact CZ2-CE2 3.56Å; W1697-F1700 VanDerWaalsContact CZ2-CE2 3.41Å; W1697-F1700 AromaticContact CZ2-CZ 3.85Å; W1697-F1700 HydrophobicContact CZ2-CZ 3.85Å; W1697-F1700 HydrophobicContact CZ3-CB 4.23Å; W1697-F1700 HydrophobicContact CZ3-CD1 4.19Å; W1697-F1700 HydrophobicContact CZ3-CG 4.31Å; W1697-F1700 AromaticContact NE1-CE2 3.65Å; W1697-F1700 AromaticContact NE1-CZ 3.74Å; W1697-F1700 VanDerWaalsContact O-CB 3.29Å; W1697-F1700 WeakPolarHBondContact O-CB 3.38Å; W1697-F1700 VanDerWaalsContact O-CD2 3.28Å; W1697-F1700 WeakPolarHBondContact O-CD2 3.4Å; W1697-F1700 VanDerWaalsContact O-CE2 3.22Å; W1697-F1700 WeakPolarHBondContact O-CE2 3.21Å; W1697-F1700 PolarHBondContact O-N 3.22Å; L1698-F1700 HydrophobicContact CB-CE2 4.34Å; L1698-F1700 VanDerWaalsContact O-CD2 3.27Å; L1698-F1700 WeakPolarHBondContact O-CD2 3.34Å; L1698-F1700 PolarHBondContact O-N 2.94Å; F1700-S1702 PolarHBondContact O-N 3.07Å; F1700-W1709 HydrophobicContact CD1-CB 4.24Å; F1700-W1709 AromaticContact CD1-CD2 3.98Å; F1700-W1709 HydrophobicContact CD1-CD2 3.98Å; F1700-W1709 HydrophobicContact CD1-CE3 4.18Å; F1700-W1709 AromaticContact CD1-CG 3.97Å; F1700-W1709 HydrophobicContact CD1-CG 3.97Å; F1700-W1709 HydrophobicContact CE1-CD2 4.25Å; F1700-W1709 AromaticContact CE1-CE3 3.98Å; F1700-W1709 HydrophobicContact CE1-CE3 3.98Å; F1700-F1720 HydrophobicContact CD1-CE1 4.49Å; F1700-F1720 AromaticContact CE1-CE1 3.89Å; F1700-F1720 HydrophobicContact CE1-CE1 4.12Å; F1700-F1720 HydrophobicContact CE1-CZ 4.48Å; F1700-F1720 HydrophobicContact CZ-CE1 4.4Å; F1700-M1721 HydrophobicContact CE1-CE 3.57Å; F1700-M1721 HydrophobicContact CE2-CE 4.27Å; F1700-M1721 HydrophobicContact CE2-SD 4.42Å; F1700-M1721 HydrophobicContact CZ-CE 3.31Å; F1700-M1721 HydrophobicContact CZ-SD 3.73Å
1701	S	41.4	Very low	46.1	Very low	36 Å²	36	89.9 Å²	89.9	25%	0.252	46%	0.462	S	S	.	.	S	Bend	trans	-73	88.6	-175.4	-56	0	0	0	0	113.8	L1688 R1690 K1691 C1699 E1703 L1705 W1709	L1688-S1701 WeakPolarHBondContact O-CB 3.39Å; L1688-S1701 PolarHBondContact O-OG 2.87Å; R1690-S1701 PolarHBondContact N-OG 3.38Å; R1690-S1701 PolarHBondContact O-OG 2.97Å; K1691-S1701 VanDerWaalsContact CB-OG 3.28Å; K1691-S1701 WeakPolarHBondContact CB-OG 3.31Å; K1691-S1701 WeakPolarHBondContact CD-OG 3.45Å; K1691-S1701 WeakPolarHBondContact CG-OG 3.32Å; K1691-S1701 PolarHBondContact N-OG 3.11Å; K1691-S1701 VanDerWaalsContact N-OG 3.16Å; K1691-S1701 PolarHBondContact NZ-OG 2.95Å; C1699-S1701 PolarHBondContact O-N 3.34Å; C1699-S1701 PolarHBondContact O-OG 3.32Å; C1699-S1701 VanDerWaalsContact O-OG 3.08Å; C1699-S1701 VanDerWaalsContact SG-CB 3.55Å; C1699-S1701 PolarHBondContact SG-OG 3.4Å; S1701-E1703 PolarHBondContact O-N 3.22Å; S1701-L1705 WeakPolarHBondContact O-CB 3.42Å; S1701-W1709 PolarHBondContact OG-NE1 2.83Å
1702	S	46.5	Very low	47.5	Very low	36.2 Å²	36.2	84.4 Å²	84.4	25%	0.253	44%	0.439	S	S	.	.			trans	-27.4	127.1	156.5	148.4	0	0	0	0	111.3	R1690 F1700 K1704 L1705 Q1706	R1690-S1702 PolarHBondContact NH1-OG 2.9Å; F1700-S1702 PolarHBondContact O-N 3.07Å; S1702-K1704 CarbonylContact O-C 3.57Å; S1702-K1704 VanDerWaalsContact O-C 3.29Å; S1702-K1704 PolarHBondContact O-N 3.08Å; S1702-K1704 WeakPolarHBondContact OG-CB 3.38Å; S1702-K1704 PolarHBondContact OG-N 3.04Å; S1702-L1705 CarbonylContact O-C 3.45Å; S1702-L1705 PolarHBondContact O-N 3.33Å; S1702-L1705 VanDerWaalsContact OG-CB 3.32Å; S1702-L1705 WeakPolarHBondContact OG-CB 3.48Å; S1702-L1705 VanDerWaalsContact OG-CG 3.27Å; S1702-L1705 WeakPolarHBondContact OG-CG 3.43Å; S1702-L1705 PolarHBondContact OG-N 3.08Å; S1702-Q1706 PolarHBondContact O-N 2.98Å
1703	E	46.4	Very low	49.5	Very low	161.2 Å²	161.2	79.9 Å²	79.9	75%	0.753	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.3	-29.8	171.2	-62.3	173.6	142.2	0	0	111.7	Q1512 S1701 L1705 P1707	Q1512-E1703 PolarHBondContact NE2-O 3.49Å; Q1512-E1703 VanDerWaalsContact NE2-O 3.15Å; Q1512-E1703 PolarHBondContact OE1-O 2.82Å; S1701-E1703 PolarHBondContact O-N 3.22Å; E1703-L1705 VanDerWaalsContact C-N 3.29Å; E1703-L1705 PolarHBondContact O-N 3.42Å; E1703-P1707 WeakPolarHBondContact O-CD 3.28Å
1704	K	52.8	Low	51.4	Low	109 Å²	109	79.2 Å²	79.2	47%	0.474	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-31.6	175.2	-59.8	-176	178.7	-177.7	0	114.4	W1508 Q1512 L1650 S1702 F1708	W1508-K1704 VanDerWaalsContact CH2-CA 3.46Å; W1508-K1704 HydrophobicContact CH2-CB 3.03Å; W1508-K1704 HydrophobicContact CH2-CD 3.31Å; W1508-K1704 HydrophobicContact CH2-CG 3.02Å; W1508-K1704 HydrophobicContact CZ2-CB 3.36Å; W1508-K1704 HydrophobicContact CZ2-CD 4.45Å; W1508-K1704 HydrophobicContact CZ2-CG 3.76Å; W1508-K1704 WeakPolarHBondContact CZ2-O 3.27Å; W1508-K1704 HydrophobicContact CZ3-CB 3.98Å; W1508-K1704 HydrophobicContact CZ3-CD 3.44Å; W1508-K1704 VanDerWaalsContact CZ3-CD 3.44Å; W1508-K1704 HydrophobicContact CZ3-CG 3.42Å; W1508-K1704 VanDerWaalsContact CZ3-CG 3.42Å; Q1512-K1704 PolarHBondContact NE2-O 2.83Å; Q1512-K1704 VanDerWaalsContact NE2-O 3.15Å; L1650-K1704 HydrophobicContact CD1-CD 4.28Å; S1702-K1704 CarbonylContact O-C 3.57Å; S1702-K1704 VanDerWaalsContact O-C 3.29Å; S1702-K1704 PolarHBondContact O-N 3.08Å; S1702-K1704 WeakPolarHBondContact OG-CB 3.38Å; S1702-K1704 PolarHBondContact OG-N 3.04Å; K1704-F1708 VanDerWaalsContact O-CE2 3.26Å; K1704-F1708 WeakPolarHBondContact O-CE2 3.28Å
1705	L	58.5	Low	53.5	Low	9 Å²	9	75.3 Å²	75.3	5%	0.047	41%	0.409	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.3	-18.9	-178.8	-67.2	-179.2	0	0	0	114.2	T1646 I1649 L1650 S1701 S1702 E1703 P1707 F1708 W1709	T1646-L1705 HydrophobicContact CG2-CD1 4.2Å; T1646-L1705 HydrophobicContact CG2-CD2 4.43Å; T1646-L1705 HydrophobicContact CG2-CG 4.28Å; I1649-L1705 HydrophobicContact CB-CD2 4.28Å; I1649-L1705 HydrophobicContact CD1-CD1 3.94Å; I1649-L1705 HydrophobicContact CD1-CD2 4.06Å; I1649-L1705 HydrophobicContact CG2-CD2 3.8Å; L1650-L1705 HydrophobicContact CD2-CD2 4.17Å; L1650-L1705 HydrophobicContact CG-CD2 4.38Å; S1701-L1705 WeakPolarHBondContact O-CB 3.42Å; S1702-L1705 CarbonylContact O-C 3.45Å; S1702-L1705 PolarHBondContact O-N 3.33Å; S1702-L1705 VanDerWaalsContact OG-CB 3.32Å; S1702-L1705 WeakPolarHBondContact OG-CB 3.48Å; S1702-L1705 VanDerWaalsContact OG-CG 3.27Å; S1702-L1705 WeakPolarHBondContact OG-CG 3.43Å; S1702-L1705 PolarHBondContact OG-N 3.08Å; E1703-L1705 VanDerWaalsContact C-N 3.29Å; E1703-L1705 PolarHBondContact O-N 3.42Å; L1705-P1707 VanDerWaalsContact C-CD 3.42Å; L1705-P1707 VanDerWaalsContact C-N 3.3Å; L1705-P1707 WeakPolarHBondContact O-CD 3.5Å; L1705-P1707 VanDerWaalsContact O-N 3.12Å; L1705-F1708 HydrophobicContact CB-CD2 4.4Å; L1705-F1708 HydrophobicContact CD2-CD2 3.98Å; L1705-F1708 HydrophobicContact CD2-CE2 4.35Å; L1705-F1708 WeakPolarHBondContact O-CB 3.31Å; L1705-F1708 PolarHBondContact O-N 3.05Å; L1705-W1709 VanDerWaalsContact O-CD1 3.3Å; L1705-W1709 PolarHBondContact O-N 3.19Å; L1705-W1709 VanDerWaalsContact O-N 3.12Å
1706	Q	60.5	Low	55.7	Low	97.2 Å²	97.2	71.9 Å²	71.9	45%	0.454	38%	0.384	S	S	.	.	H	α-helix	trans	-47.8	-41.7	-179.2	-167.8	-175.8	10.6	0	0	114.1	L1698 S1702 F1708 W1709 L1710	L1698-Q1706 PolarHBondContact O-NE2 3.32Å; S1702-Q1706 PolarHBondContact O-N 2.98Å; Q1706-F1708 VanDerWaalsContact C-N 3.32Å; Q1706-F1708 PolarHBondContact O-N 3.08Å; Q1706-W1709 PolarHBondContact O-N 3.1Å; Q1706-L1710 HydrophobicContact CG-CD1 4.3Å; Q1706-L1710 VanDerWaalsContact O-CG 3.26Å; Q1706-L1710 WeakPolarHBondContact O-CG 3.31Å; Q1706-L1710 PolarHBondContact O-N 3.12Å
1707	P	58.8	Low	57.7	Low	63.2 Å²	63.2	68 Å²	68	41%	0.41	36%	0.36	S	S	.	.	H	α-helix	trans	-61.9	-36.9	177.2	-23.1	34.9	0	0	0	113.7	E1703 L1705 L1710 S1711	E1703-P1707 WeakPolarHBondContact O-CD 3.28Å; L1705-P1707 VanDerWaalsContact C-CD 3.42Å; L1705-P1707 VanDerWaalsContact C-N 3.3Å; L1705-P1707 WeakPolarHBondContact O-CD 3.5Å; L1705-P1707 VanDerWaalsContact O-N 3.12Å; P1707-L1710 PolarHBondContact O-N 3.32Å; P1707-S1711 PolarHBondContact O-N 3.17Å; P1707-S1711 VanDerWaalsContact O-N 3.14Å
1708	F	61.9	Low	59.9	Low	8.2 Å²	8.2	68.1 Å²	68.1	4%	0.036	36%	0.36	C	S	.	.	H	α-helix	trans	-75	-38.7	-178.7	-51.4	-66	0	0	0	111.5	W1508 I1649 L1650 H1655 R1658 L1662 K1704 L1705 Q1706 L1710 S1711 L1712	W1508-F1708 AromaticContact NE1-CE2 3.8Å; W1508-F1708 AromaticContact NE1-CZ 3.98Å; I1649-F1708 HydrophobicContact CG2-CD2 4.27Å; I1649-F1708 HydrophobicContact CG2-CG 4.35Å; L1650-F1708 HydrophobicContact CD2-CE2 4.33Å; H1655-F1708 HydrophobicContact CB-CE1 4.09Å; H1655-F1708 AromaticContact CD2-CD1 3.68Å; H1655-F1708 AromaticContact CD2-CE1 3.36Å; H1655-F1708 VanDerWaalsContact CD2-CE1 3.43Å; H1655-F1708 WeakPolarHBondContact CD2-CE1 3.41Å; H1655-F1708 AromaticContact CE1-CD1 3.65Å; H1655-F1708 AromaticContact CE1-CE1 3.83Å; H1655-F1708 AromaticContact CE1-CZ 3.82Å; H1655-F1708 AromaticContact CG-CD1 3.99Å; H1655-F1708 AromaticContact CG-CE1 3.77Å; H1655-F1708 AromaticContact ND1-CE1 3.37Å; H1655-F1708 WeakPolarHBondContact ND1-CE1 3.42Å; H1655-F1708 AromaticContact ND1-CZ 3.56Å; H1655-F1708 AromaticContact NE2-CD1 3.5Å; H1655-F1708 WeakPolarHBondContact NE2-CD1 3.41Å; H1655-F1708 AromaticContact NE2-CE1 3.54Å; H1655-F1708 WeakPolarHBondContact NE2-CE1 3.42Å; R1658-F1708 HydrophobicContact CB-CD1 3.68Å; R1658-F1708 HydrophobicContact CB-CD2 4.48Å; R1658-F1708 HydrophobicContact CB-CE1 3.62Å; R1658-F1708 HydrophobicContact CB-CE2 4.46Å; R1658-F1708 HydrophobicContact CB-CG 4.25Å; R1658-F1708 HydrophobicContact CB-CZ 4.16Å; R1658-F1708 VanDerWaalsContact CD-CE1 3.41Å; R1658-F1708 VanDerWaalsContact CD-CZ 3.45Å; R1658-F1708 HydrophobicContact CG-CD1 4.48Å; R1658-F1708 HydrophobicContact CG-CE1 4.1Å; R1658-F1708 HydrophobicContact CG-CZ 4.29Å; L1662-F1708 HydrophobicContact CD2-CB 4.27Å; K1704-F1708 VanDerWaalsContact O-CE2 3.26Å; K1704-F1708 WeakPolarHBondContact O-CE2 3.28Å; L1705-F1708 HydrophobicContact CB-CD2 4.4Å; L1705-F1708 HydrophobicContact CD2-CD2 3.98Å; L1705-F1708 HydrophobicContact CD2-CE2 4.35Å; L1705-F1708 WeakPolarHBondContact O-CB 3.31Å; L1705-F1708 PolarHBondContact O-N 3.05Å; Q1706-F1708 VanDerWaalsContact C-N 3.32Å; Q1706-F1708 PolarHBondContact O-N 3.08Å; F1708-L1710 VanDerWaalsContact C-N 3.3Å; F1708-L1710 PolarHBondContact O-N 2.95Å; F1708-S1711 WeakPolarHBondContact CA-OG 3.36Å; F1708-S1711 WeakPolarHBondContact O-CA 3.39Å; F1708-S1711 WeakPolarHBondContact O-CB 3.39Å; F1708-S1711 PolarHBondContact O-N 3.24Å; F1708-S1711 VanDerWaalsContact O-N 3.12Å; F1708-S1711 PolarHBondContact O-OG 3.11Å; F1708-S1711 VanDerWaalsContact O-OG 3.11Å; F1708-L1712 PolarHBondContact O-N 3.19Å; F1708-L1712 VanDerWaalsContact O-N 3.13Å
1709	W	66	Low	62.1	Low	25.6 Å²	25.6	65 Å²	65	10%	0.097	34%	0.341	C	S	.	.	H	α-helix	trans	-60.8	-37.1	172.5	-73.4	105.8	0	0	0	111.9	L1662 L1688 F1700 S1701 L1705 Q1706 S1711 L1712 K1717 F1720	L1662-W1709 HydrophobicContact CD1-CH2 4Å; L1662-W1709 HydrophobicContact CD1-CZ2 3.94Å; L1662-W1709 HydrophobicContact CD1-CZ3 4.43Å; L1662-W1709 HydrophobicContact CD2-CD2 4.11Å; L1662-W1709 HydrophobicContact CD2-CE3 4.26Å; L1662-W1709 HydrophobicContact CD2-CG 4.38Å; L1662-W1709 HydrophobicContact CD2-CZ2 4.4Å; L1662-W1709 HydrophobicContact CD2-CZ3 4.45Å; L1688-W1709 HydrophobicContact CB-CH2 4.4Å; L1688-W1709 HydrophobicContact CB-CZ2 4.25Å; L1688-W1709 HydrophobicContact CD1-CH2 4.28Å; L1688-W1709 HydrophobicContact CD2-CH2 4.39Å; L1688-W1709 HydrophobicContact CD2-CZ2 4.13Å; F1700-W1709 HydrophobicContact CD1-CB 4.24Å; F1700-W1709 AromaticContact CD1-CD2 3.98Å; F1700-W1709 HydrophobicContact CD1-CD2 3.98Å; F1700-W1709 HydrophobicContact CD1-CE3 4.18Å; F1700-W1709 AromaticContact CD1-CG 3.97Å; F1700-W1709 HydrophobicContact CD1-CG 3.97Å; F1700-W1709 HydrophobicContact CE1-CD2 4.25Å; F1700-W1709 AromaticContact CE1-CE3 3.98Å; F1700-W1709 HydrophobicContact CE1-CE3 3.98Å; S1701-W1709 PolarHBondContact OG-NE1 2.83Å; L1705-W1709 VanDerWaalsContact O-CD1 3.3Å; L1705-W1709 PolarHBondContact O-N 3.19Å; L1705-W1709 VanDerWaalsContact O-N 3.12Å; Q1706-W1709 PolarHBondContact O-N 3.1Å; W1709-S1711 VanDerWaalsContact C-N 3.29Å; W1709-S1711 PolarHBondContact O-N 2.86Å; W1709-L1712 HydrophobicContact CD2-CD1 4.33Å; W1709-L1712 HydrophobicContact CE3-CD1 3.51Å; W1709-L1712 VanDerWaalsContact CE3-CD1 3.48Å; W1709-L1712 HydrophobicContact CZ3-CD1 3.73Å; W1709-L1712 PolarHBondContact O-N 3.22Å; W1709-K1717 VanDerWaalsContact O-CE 3.28Å; W1709-K1717 WeakPolarHBondContact O-CE 3.27Å; W1709-K1717 PolarHBondContact O-NZ 2.99Å; W1709-F1720 HydrophobicContact CE3-CD1 4.39Å; W1709-F1720 HydrophobicContact CE3-CE1 4.48Å; W1709-F1720 HydrophobicContact CH2-CB 4.5Å; W1709-F1720 AromaticContact CH2-CD1 3.61Å; W1709-F1720 HydrophobicContact CH2-CD1 3.76Å; W1709-F1720 VanDerWaalsContact CH2-CD1 3.49Å; W1709-F1720 AromaticContact CH2-CD2 3.74Å; W1709-F1720 HydrophobicContact CH2-CD2 4.02Å; W1709-F1720 AromaticContact CH2-CE1 3.52Å; W1709-F1720 HydrophobicContact CH2-CE1 3.63Å; W1709-F1720 VanDerWaalsContact CH2-CE1 3.41Å; W1709-F1720 AromaticContact CH2-CE2 3.82Å; W1709-F1720 HydrophobicContact CH2-CE2 3.91Å; W1709-F1720 AromaticContact CH2-CG 3.79Å; W1709-F1720 HydrophobicContact CH2-CG 3.79Å; W1709-F1720 AromaticContact CH2-CZ 3.63Å; W1709-F1720 HydrophobicContact CH2-CZ 3.7Å; W1709-F1720 VanDerWaalsContact CH2-CZ 3.42Å; W1709-F1720 HydrophobicContact CZ2-CE1 4.26Å; W1709-F1720 HydrophobicContact CZ2-CE2 4.32Å; W1709-F1720 HydrophobicContact CZ2-CZ 4.2Å; W1709-F1720 HydrophobicContact CZ3-CB 4.18Å; W1709-F1720 AromaticContact CZ3-CD1 3.59Å; W1709-F1720 HydrophobicContact CZ3-CD1 3.59Å; W1709-F1720 VanDerWaalsContact CZ3-CD1 3.44Å; W1709-F1720 HydrophobicContact CZ3-CD2 4.32Å; W1709-F1720 AromaticContact CZ3-CE1 3.79Å; W1709-F1720 HydrophobicContact CZ3-CE1 3.84Å; W1709-F1720 HydrophobicContact CZ3-CE2 4.33Å; W1709-F1720 AromaticContact CZ3-CG 3.81Å; W1709-F1720 HydrophobicContact CZ3-CG 3.91Å; W1709-F1720 HydrophobicContact CZ3-CZ 4.34Å
1710	L	63.1	Low	64.4	Low	117.8 Å²	117.8	61.8 Å²	61.8	62%	0.617	32%	0.318	S	S	*	.	H	α-helix	trans	-64.2	-38	173.2	-69.4	172.3	0	0	0	112	Q1706 P1707 F1708 L1712 K1717	Q1706-L1710 HydrophobicContact CG-CD1 4.3Å; Q1706-L1710 VanDerWaalsContact O-CG 3.26Å; Q1706-L1710 WeakPolarHBondContact O-CG 3.31Å; Q1706-L1710 PolarHBondContact O-N 3.12Å; P1707-L1710 PolarHBondContact O-N 3.32Å; F1708-L1710 VanDerWaalsContact C-N 3.3Å; F1708-L1710 PolarHBondContact O-N 2.95Å; L1710-L1712 PolarHBondContact O-N 3.05Å; L1710-K1717 PolarHBondContact O-NZ 3.04Å
1711	S	67.4	Low	66.5	Low	42 Å²	42	62.1 Å²	62.1	29%	0.294	32%	0.321	S	S	.	.	H	α-helix	trans	-76.7	-14.6	-178.6	74.5	0	0	0	0	116.1	R1659 P1707 F1708 W1709	R1659-S1711 VanDerWaalsContact CD-O 3.22Å; R1659-S1711 WeakPolarHBondContact CD-O 3.42Å; R1659-S1711 VanDerWaalsContact CD-OG 3.25Å; R1659-S1711 WeakPolarHBondContact CD-OG 3.31Å; R1659-S1711 WeakPolarHBondContact CG-OG 3.45Å; R1659-S1711 PolarHBondContact NE-O 3.22Å; R1659-S1711 PolarHBondContact NH2-O 3.11Å; P1707-S1711 PolarHBondContact O-N 3.17Å; P1707-S1711 VanDerWaalsContact O-N 3.14Å; F1708-S1711 WeakPolarHBondContact CA-OG 3.36Å; F1708-S1711 WeakPolarHBondContact O-CA 3.39Å; F1708-S1711 WeakPolarHBondContact O-CB 3.39Å; F1708-S1711 PolarHBondContact O-N 3.24Å; F1708-S1711 VanDerWaalsContact O-N 3.12Å; F1708-S1711 PolarHBondContact O-OG 3.11Å; F1708-S1711 VanDerWaalsContact O-OG 3.11Å; W1709-S1711 VanDerWaalsContact C-N 3.29Å; W1709-S1711 PolarHBondContact O-N 2.86Å
1712	L	70.8	Confident	68.6	Low	6.6 Å²	6.6	64.4 Å²	64.4	4%	0.035	33%	0.331	C	S	.	.	S	Bend	trans	-60.8	149.3	175.4	-77.3	176.5	0	0	0	112	R1659 L1662 C1663 F1708 W1709 L1710 N1716 K1717	R1659-L1712 HydrophobicContact CG-CD2 4.39Å; L1662-L1712 HydrophobicContact CB-CD2 4.29Å; L1662-L1712 HydrophobicContact CD2-CD1 3.66Å; L1662-L1712 HydrophobicContact CD2-CD2 4.18Å; L1662-L1712 HydrophobicContact CD2-CG 3.93Å; L1662-L1712 HydrophobicContact CG-CD1 3.99Å; L1662-L1712 HydrophobicContact CG-CD2 4.15Å; L1662-L1712 HydrophobicContact CG-CG 4.37Å; C1663-L1712 WeakPolarHBondContact SG-CD2 3.32Å; F1708-L1712 PolarHBondContact O-N 3.19Å; F1708-L1712 VanDerWaalsContact O-N 3.13Å; W1709-L1712 HydrophobicContact CD2-CD1 4.33Å; W1709-L1712 HydrophobicContact CE3-CD1 3.51Å; W1709-L1712 VanDerWaalsContact CE3-CD1 3.48Å; W1709-L1712 HydrophobicContact CZ3-CD1 3.73Å; W1709-L1712 PolarHBondContact O-N 3.22Å; L1710-L1712 PolarHBondContact O-N 3.05Å; L1712-N1716 HydrophobicContact CD2-CB 4.34Å; L1712-K1717 HydrophobicContact CB-CD 4.44Å; L1712-K1717 HydrophobicContact CB-CG 3.94Å; L1712-K1717 HydrophobicContact CD1-CG 4.39Å; L1712-K1717 VanDerWaalsContact O-CE 3.23Å; L1712-K1717 WeakPolarHBondContact O-CE 3.36Å; L1712-K1717 PolarHBondContact O-NZ 3.13Å
1713	S	73.6	Confident	70.4	Confident	48.6 Å²	48.6	63.1 Å²	63.1	34%	0.34	32%	0.321	S	S	.	.			trans	-60	153.6	169.2	61.1	0	0	0	0	111.3	D1715 N1716 K1717	S1713-D1715 PolarHBondContact O-N 2.98Å; S1713-N1716 PolarHBondContact O-N 3.36Å; S1713-N1716 WeakPolarHBondContact OG-CB 3.45Å; S1713-N1716 VanDerWaalsContact OG-CG 3.28Å; S1713-N1716 PolarHBondContact OG-N 3.13Å; S1713-N1716 PolarHBondContact OG-ND2 3.3Å; S1713-N1716 PolarHBondContact OG-OD1 2.9Å; S1713-K1717 WeakPolarHBondContact O-CD 3.25Å; S1713-K1717 WeakPolarHBondContact O-CE 3.46Å; S1713-K1717 WeakPolarHBondContact O-CG 3.33Å; S1713-K1717 PolarHBondContact O-N 3.26Å; S1713-K1717 VanDerWaalsContact O-N 3.12Å
1714	A	73.3	Confident	72.1	Confident	64 Å²	64	56 Å²	56	53%	0.529	29%	0.289	S	S	.	.	H	α-helix	trans	-57.2	-36.4	176.4	0	0	0	0	0	111.7	K1717 R1718	A1714-K1717 WeakPolarHBondContact O-CB 3.26Å; A1714-K1717 PolarHBondContact O-N 2.98Å; A1714-R1718 WeakPolarHBondContact O-CB 3.29Å; A1714-R1718 VanDerWaalsContact O-CG 3.28Å; A1714-R1718 WeakPolarHBondContact O-CG 3.49Å; A1714-R1718 PolarHBondContact O-N 3.16Å
1715	D	75.8	Confident	73.6	Confident	88.6 Å²	88.6	57.5 Å²	57.5	47%	0.474	30%	0.297	S	S	.	.	H	α-helix	trans	-71.9	-40.6	-176.9	-50.4	-54.1	0	0	0	112.4	S1713 K1717 R1718 K1719	S1713-D1715 PolarHBondContact O-N 2.98Å; D1715-K1717 VanDerWaalsContact C-N 3.31Å; D1715-K1717 PolarHBondContact O-N 3.23Å; D1715-R1718 PolarHBondContact O-N 3.1Å; D1715-R1718 IonicContact OD1-CZ 3.11Å; D1715-R1718 IonicContact OD1-NH1 3.51Å; D1715-R1718 PolarHBondContact OD1-NH1 2.78Å; D1715-R1718 IonicContact OD1-NH2 2.82Å; D1715-K1719 WeakPolarHBondContact O-CB 3.22Å; D1715-K1719 WeakPolarHBondContact O-CG 3.36Å; D1715-K1719 PolarHBondContact O-N 3.15Å
1716	N	78	Confident	74.7	Confident	28.8 Å²	28.8	57.8 Å²	57.8	15%	0.154	30%	0.299	C	S	.	.	H	α-helix	trans	-68.6	-33.8	175.7	-71.2	-7.2	0	0	0	111.6	C1663 L1712 S1713 F1720	C1663-N1716 PolarHBondContact SG-ND2 3.13Å; L1712-N1716 HydrophobicContact CD2-CB 4.34Å; S1713-N1716 PolarHBondContact O-N 3.36Å; S1713-N1716 WeakPolarHBondContact OG-CB 3.45Å; S1713-N1716 VanDerWaalsContact OG-CG 3.28Å; S1713-N1716 PolarHBondContact OG-N 3.13Å; S1713-N1716 PolarHBondContact OG-ND2 3.3Å; S1713-N1716 PolarHBondContact OG-OD1 2.9Å; N1716-F1720 WeakPolarHBondContact O-CB 3.32Å; N1716-F1720 PolarHBondContact O-N 3.05Å; N1716-F1720 VanDerWaalsContact O-N 3.12Å
1717	K	76.8	Confident	75.8	Confident	66.6 Å²	66.6	53.9 Å²	53.9	29%	0.29	28%	0.281	S	S	.	.	H	α-helix	trans	-63.2	-46	170.2	-69.2	170.8	-170.6	168	0	111.2	W1709 L1710 L1712 S1713 A1714 D1715 K1719 F1720 M1721	W1709-K1717 VanDerWaalsContact O-CE 3.28Å; W1709-K1717 WeakPolarHBondContact O-CE 3.27Å; W1709-K1717 PolarHBondContact O-NZ 2.99Å; L1710-K1717 PolarHBondContact O-NZ 3.04Å; L1712-K1717 HydrophobicContact CB-CD 4.44Å; L1712-K1717 HydrophobicContact CB-CG 3.94Å; L1712-K1717 HydrophobicContact CD1-CG 4.39Å; L1712-K1717 VanDerWaalsContact O-CE 3.23Å; L1712-K1717 WeakPolarHBondContact O-CE 3.36Å; L1712-K1717 PolarHBondContact O-NZ 3.13Å; S1713-K1717 WeakPolarHBondContact O-CD 3.25Å; S1713-K1717 WeakPolarHBondContact O-CE 3.46Å; S1713-K1717 WeakPolarHBondContact O-CG 3.33Å; S1713-K1717 PolarHBondContact O-N 3.26Å; S1713-K1717 VanDerWaalsContact O-N 3.12Å; A1714-K1717 WeakPolarHBondContact O-CB 3.26Å; A1714-K1717 PolarHBondContact O-N 2.98Å; D1715-K1717 VanDerWaalsContact C-N 3.31Å; D1715-K1717 PolarHBondContact O-N 3.23Å; K1717-K1719 PolarHBondContact O-N 2.87Å; K1717-F1720 PolarHBondContact O-N 3.04Å; K1717-M1721 VanDerWaalsContact O-CB 3.31Å; K1717-M1721 WeakPolarHBondContact O-CB 3.42Å; K1717-M1721 VanDerWaalsContact O-CG 3.27Å; K1717-M1721 WeakPolarHBondContact O-CG 3.37Å; K1717-M1721 PolarHBondContact O-N 3.2Å
1718	R	80.3	Confident	76.7	Confident	151 Å²	151	52.3 Å²	52.3	57%	0.57	27%	0.269	S	S	*	.	H	α-helix	trans	-61.2	-46.9	177.5	-134.6	174.7	-140.7	149.8	-4.9	111.9	A1714 D1715 F1720 M1721 N1722	A1714-R1718 WeakPolarHBondContact O-CB 3.29Å; A1714-R1718 VanDerWaalsContact O-CG 3.28Å; A1714-R1718 WeakPolarHBondContact O-CG 3.49Å; A1714-R1718 PolarHBondContact O-N 3.16Å; D1715-R1718 PolarHBondContact O-N 3.1Å; D1715-R1718 IonicContact OD1-CZ 3.11Å; D1715-R1718 IonicContact OD1-NH1 3.51Å; D1715-R1718 PolarHBondContact OD1-NH1 2.78Å; D1715-R1718 IonicContact OD1-NH2 2.82Å; R1718-F1720 PolarHBondContact O-N 3.09Å; R1718-M1721 VanDerWaalsContact O-CB 3.31Å; R1718-M1721 WeakPolarHBondContact O-CB 3.36Å; R1718-M1721 PolarHBondContact O-N 3Å; R1718-M1721 VanDerWaalsContact O-N 3.15Å; R1718-N1722 WeakPolarHBondContact O-CB 3.43Å; R1718-N1722 PolarHBondContact O-N 2.97Å; R1718-N1722 PolarHBondContact O-OD1 3.08Å
1719	K	81.6	Confident	77.2	Confident	73.8 Å²	73.8	54.8 Å²	54.8	32%	0.321	29%	0.288	S	S	.	.	H	α-helix	trans	-55.2	-51.6	175.2	-74.3	169	173.5	-110.6	0	111.7	V1666 E1670 D1715 K1717 M1721 N1722 L1723	V1666-K1719 HydrophobicContact CG1-CB 4.27Å; E1670-K1719 VanDerWaalsContact CD-NZ 3.26Å; E1670-K1719 VanDerWaalsContact OE1-CE 3.24Å; E1670-K1719 WeakPolarHBondContact OE1-CE 3.24Å; E1670-K1719 IonicContact OE1-NZ 3.3Å; E1670-K1719 PolarHBondContact OE1-NZ 3.16Å; E1670-K1719 WeakPolarHBondContact OE2-CD 3.31Å; E1670-K1719 IonicContact OE2-NZ 3.08Å; E1670-K1719 PolarHBondContact OE2-NZ 3.23Å; D1715-K1719 WeakPolarHBondContact O-CB 3.22Å; D1715-K1719 WeakPolarHBondContact O-CG 3.36Å; D1715-K1719 PolarHBondContact O-N 3.15Å; K1717-K1719 PolarHBondContact O-N 2.87Å; K1719-M1721 VanDerWaalsContact C-N 3.31Å; K1719-M1721 PolarHBondContact O-N 3.22Å; K1719-N1722 PolarHBondContact O-N 2.97Å; K1719-L1723 WeakPolarHBondContact O-CB 3.4Å; K1719-L1723 VanDerWaalsContact O-CG 3.29Å; K1719-L1723 WeakPolarHBondContact O-CG 3.38Å; K1719-L1723 PolarHBondContact O-N 3.11Å; K1719-L1723 VanDerWaalsContact O-N 3.1Å
1720	F	81.7	Confident	77.2	Confident	7.8 Å²	7.8	60.7 Å²	60.7	3%	0.034	32%	0.316	C	S	.	.	H	α-helix	trans	-61	-41.4	177.5	174.9	-104	0	0	0	112.6	V1666 L1685 L1688 S1689 F1700 W1709 N1716 K1717 R1718 S1724	V1666-F1720 HydrophobicContact CG1-CB 4.1Å; V1666-F1720 HydrophobicContact CG2-CB 4.23Å; V1666-F1720 HydrophobicContact CG2-CD2 4.29Å; V1666-F1720 HydrophobicContact CG2-CG 4.47Å; L1685-F1720 HydrophobicContact CD2-CD2 3.62Å; L1685-F1720 HydrophobicContact CD2-CE2 3.6Å; L1688-F1720 HydrophobicContact CB-CE2 3.66Å; L1688-F1720 HydrophobicContact CB-CZ 3.98Å; L1688-F1720 HydrophobicContact CD1-CD2 3.89Å; L1688-F1720 HydrophobicContact CD1-CE2 3.59Å; L1688-F1720 VanDerWaalsContact CD1-CE2 3.5Å; L1688-F1720 HydrophobicContact CD1-CZ 4.46Å; L1688-F1720 HydrophobicContact CG-CE2 4.29Å; S1689-F1720 VanDerWaalsContact OG-CZ 3.3Å; S1689-F1720 WeakPolarHBondContact OG-CZ 3.38Å; F1700-F1720 HydrophobicContact CD1-CE1 4.49Å; F1700-F1720 AromaticContact CE1-CE1 3.89Å; F1700-F1720 HydrophobicContact CE1-CE1 4.12Å; F1700-F1720 HydrophobicContact CE1-CZ 4.48Å; F1700-F1720 HydrophobicContact CZ-CE1 4.4Å; W1709-F1720 HydrophobicContact CE3-CD1 4.39Å; W1709-F1720 HydrophobicContact CE3-CE1 4.48Å; W1709-F1720 HydrophobicContact CH2-CB 4.5Å; W1709-F1720 AromaticContact CH2-CD1 3.61Å; W1709-F1720 HydrophobicContact CH2-CD1 3.76Å; W1709-F1720 VanDerWaalsContact CH2-CD1 3.49Å; W1709-F1720 AromaticContact CH2-CD2 3.74Å; W1709-F1720 HydrophobicContact CH2-CD2 4.02Å; W1709-F1720 AromaticContact CH2-CE1 3.52Å; W1709-F1720 HydrophobicContact CH2-CE1 3.63Å; W1709-F1720 VanDerWaalsContact CH2-CE1 3.41Å; W1709-F1720 AromaticContact CH2-CE2 3.82Å; W1709-F1720 HydrophobicContact CH2-CE2 3.91Å; W1709-F1720 AromaticContact CH2-CG 3.79Å; W1709-F1720 HydrophobicContact CH2-CG 3.79Å; W1709-F1720 AromaticContact CH2-CZ 3.63Å; W1709-F1720 HydrophobicContact CH2-CZ 3.7Å; W1709-F1720 VanDerWaalsContact CH2-CZ 3.42Å; W1709-F1720 HydrophobicContact CZ2-CE1 4.26Å; W1709-F1720 HydrophobicContact CZ2-CE2 4.32Å; W1709-F1720 HydrophobicContact CZ2-CZ 4.2Å; W1709-F1720 HydrophobicContact CZ3-CB 4.18Å; W1709-F1720 AromaticContact CZ3-CD1 3.59Å; W1709-F1720 HydrophobicContact CZ3-CD1 3.59Å; W1709-F1720 VanDerWaalsContact CZ3-CD1 3.44Å; W1709-F1720 HydrophobicContact CZ3-CD2 4.32Å; W1709-F1720 AromaticContact CZ3-CE1 3.79Å; W1709-F1720 HydrophobicContact CZ3-CE1 3.84Å; W1709-F1720 HydrophobicContact CZ3-CE2 4.33Å; W1709-F1720 AromaticContact CZ3-CG 3.81Å; W1709-F1720 HydrophobicContact CZ3-CG 3.91Å; W1709-F1720 HydrophobicContact CZ3-CZ 4.34Å; N1716-F1720 WeakPolarHBondContact O-CB 3.32Å; N1716-F1720 PolarHBondContact O-N 3.05Å; N1716-F1720 VanDerWaalsContact O-N 3.12Å; K1717-F1720 PolarHBondContact O-N 3.04Å; R1718-F1720 PolarHBondContact O-N 3.09Å; F1720-S1724 VanDerWaalsContact O-CB 3.27Å; F1720-S1724 WeakPolarHBondContact O-CB 3.38Å; F1720-S1724 PolarHBondContact O-N 3.29Å; F1720-S1724 PolarHBondContact O-OG 3.08Å
1721	M	82	Confident	77.4	Confident	63 Å²	63	60.8 Å²	60.8	31%	0.31	31%	0.314	S	S	.	.	H	α-helix	trans	-61.9	-53	176.8	-82.7	-80.7	-96.3	0	0	112	W1697 L1698 F1700 K1717 R1718 K1719 L1723 S1724 E1725	W1697-M1721 HydrophobicContact CD2-CE 3.99Å; W1697-M1721 HydrophobicContact CE3-CE 4.21Å; W1697-M1721 HydrophobicContact CH2-CE 3.86Å; W1697-M1721 HydrophobicContact CH2-CG 4.18Å; W1697-M1721 HydrophobicContact CH2-SD 3.76Å; W1697-M1721 HydrophobicContact CZ2-CE 3.65Å; W1697-M1721 VanDerWaalsContact CZ2-CE 3.48Å; W1697-M1721 HydrophobicContact CZ2-CG 3.83Å; W1697-M1721 HydrophobicContact CZ2-SD 3.2Å; W1697-M1721 WeakPolarHBondContact CZ2-SD 3.43Å; W1697-M1721 HydrophobicContact CZ3-CE 4.2Å; W1697-M1721 HydrophobicContact CZ3-CG 4.29Å; W1697-M1721 PolarHBondContact NE1-SD 3.14Å; L1698-M1721 HydrophobicContact CD1-SD 4.45Å; L1698-M1721 HydrophobicContact CD2-CE 3.77Å; L1698-M1721 HydrophobicContact CD2-SD 3.58Å; L1698-M1721 VanDerWaalsContact CD2-SD 3.58Å; L1698-M1721 HydrophobicContact CG-SD 4.46Å; F1700-M1721 HydrophobicContact CE1-CE 3.57Å; F1700-M1721 HydrophobicContact CE2-CE 4.27Å; F1700-M1721 HydrophobicContact CE2-SD 4.42Å; F1700-M1721 HydrophobicContact CZ-CE 3.31Å; F1700-M1721 HydrophobicContact CZ-SD 3.73Å; K1717-M1721 VanDerWaalsContact O-CB 3.31Å; K1717-M1721 WeakPolarHBondContact O-CB 3.42Å; K1717-M1721 VanDerWaalsContact O-CG 3.27Å; K1717-M1721 WeakPolarHBondContact O-CG 3.37Å; K1717-M1721 PolarHBondContact O-N 3.2Å; R1718-M1721 VanDerWaalsContact O-CB 3.31Å; R1718-M1721 WeakPolarHBondContact O-CB 3.36Å; R1718-M1721 PolarHBondContact O-N 3Å; R1718-M1721 VanDerWaalsContact O-N 3.15Å; K1719-M1721 VanDerWaalsContact C-N 3.31Å; K1719-M1721 PolarHBondContact O-N 3.22Å; M1721-L1723 VanDerWaalsContact C-N 3.32Å; M1721-L1723 PolarHBondContact O-N 2.93Å; M1721-S1724 WeakPolarHBondContact O-CA 3.44Å; M1721-S1724 WeakPolarHBondContact O-CB 3.12Å; M1721-S1724 PolarHBondContact O-N 3.1Å; M1721-S1724 VanDerWaalsContact O-N 3.12Å; M1721-S1724 PolarHBondContact O-OG 3.44Å; M1721-E1725 WeakPolarHBondContact O-CB 3.36Å; M1721-E1725 PolarHBondContact O-N 3.1Å
1722	N	84.8	Confident	77.6	Confident	84.4 Å²	84.4	60.8 Å²	60.8	45%	0.451	31%	0.313	S	S	.	.	H	α-helix	trans	-58.2	-49	-179.7	-105.1	28.2	0	0	0	110.8	R1718 K1719 S1724 E1725 I1726	R1718-N1722 WeakPolarHBondContact O-CB 3.43Å; R1718-N1722 PolarHBondContact O-N 2.97Å; R1718-N1722 PolarHBondContact O-OD1 3.08Å; K1719-N1722 PolarHBondContact O-N 2.97Å; N1722-S1724 VanDerWaalsContact C-N 3.31Å; N1722-S1724 PolarHBondContact O-N 3.26Å; N1722-E1725 PolarHBondContact O-N 3.04Å; N1722-E1725 VanDerWaalsContact O-N 3.13Å; N1722-I1726 HydrophobicContact CB-CD1 4.47Å; N1722-I1726 WeakPolarHBondContact O-CB 3.43Å; N1722-I1726 VanDerWaalsContact O-CD1 3.29Å; N1722-I1726 WeakPolarHBondContact O-CD1 3.37Å; N1722-I1726 VanDerWaalsContact O-CG1 3.24Å; N1722-I1726 WeakPolarHBondContact O-CG1 3.25Å; N1722-I1726 PolarHBondContact O-N 2.9Å; N1722-I1726 WeakPolarHBondContact OD1-CD1 3.33Å
1723	L	84.7	Confident	78	Confident	8.4 Å²	8.4	61.4 Å²	61.4	4%	0.044	32%	0.318	C	S	.	.	H	α-helix	trans	-61.2	-38.6	177.3	-70	173.2	0	0	0	112.5	E1670 W1673 L1685 K1719 M1721 I1726 L1727	E1670-L1723 HydrophobicContact CB-CD1 4.04Å; W1673-L1723 HydrophobicContact CB-CD2 3.86Å; W1673-L1723 VanDerWaalsContact CD1-CD2 3.46Å; W1673-L1723 HydrophobicContact CD2-CD2 3.99Å; W1673-L1723 HydrophobicContact CG-CD2 3.52Å; W1673-L1723 VanDerWaalsContact CG-CD2 3.46Å; L1685-L1723 HydrophobicContact CD1-CB 3.93Å; L1685-L1723 HydrophobicContact CD2-CB 4.27Å; K1719-L1723 WeakPolarHBondContact O-CB 3.4Å; K1719-L1723 VanDerWaalsContact O-CG 3.29Å; K1719-L1723 WeakPolarHBondContact O-CG 3.38Å; K1719-L1723 PolarHBondContact O-N 3.11Å; K1719-L1723 VanDerWaalsContact O-N 3.1Å; M1721-L1723 VanDerWaalsContact C-N 3.32Å; M1721-L1723 PolarHBondContact O-N 2.93Å; L1723-I1726 PolarHBondContact O-N 3.11Å; L1723-L1727 WeakPolarHBondContact O-CB 3.28Å; L1723-L1727 PolarHBondContact O-N 3.07Å
1724	S	82.4	Confident	78.4	Confident	11.4 Å²	11.4	63 Å²	63	8%	0.08	33%	0.325	C	S	.	.	H	α-helix	trans	-67	-38.6	176.8	-50.9	0	0	0	0	112.4	F1720 M1721 N1722 I1726 L1728	F1720-S1724 VanDerWaalsContact O-CB 3.27Å; F1720-S1724 WeakPolarHBondContact O-CB 3.38Å; F1720-S1724 PolarHBondContact O-N 3.29Å; F1720-S1724 PolarHBondContact O-OG 3.08Å; M1721-S1724 WeakPolarHBondContact O-CA 3.44Å; M1721-S1724 WeakPolarHBondContact O-CB 3.12Å; M1721-S1724 PolarHBondContact O-N 3.1Å; M1721-S1724 VanDerWaalsContact O-N 3.12Å; M1721-S1724 PolarHBondContact O-OG 3.44Å; N1722-S1724 VanDerWaalsContact C-N 3.31Å; N1722-S1724 PolarHBondContact O-N 3.26Å; S1724-I1726 VanDerWaalsContact C-N 3.35Å; S1724-L1728 WeakPolarHBondContact O-CA 3.34Å; S1724-L1728 VanDerWaalsContact O-CB 3.23Å; S1724-L1728 WeakPolarHBondContact O-CB 3.33Å; S1724-L1728 WeakPolarHBondContact O-CG 3.19Å; S1724-L1728 PolarHBondContact O-N 3.06Å
1725	E	82.8	Confident	79	Confident	140.8 Å²	140.8	64.3 Å²	64.3	66%	0.658	32%	0.32	S	S	*	.	H	α-helix	trans	-67	-41.9	175.5	-173.9	171.3	-176.4	0	0	111.4	M1721 N1722 S1729	M1721-E1725 WeakPolarHBondContact O-CB 3.36Å; M1721-E1725 PolarHBondContact O-N 3.1Å; N1722-E1725 PolarHBondContact O-N 3.04Å; N1722-E1725 VanDerWaalsContact O-N 3.13Å; E1725-S1729 VanDerWaalsContact O-CB 3.3Å; E1725-S1729 WeakPolarHBondContact O-CB 3.37Å
1726	I	82.7	Confident	79.5	Confident	15.4 Å²	15.4	61 Å²	61	8%	0.079	30%	0.303	C	S	.	.	H	α-helix	trans	-67.1	-44.5	-180	-68.7	165	0	0	0	112.3	W1673 N1722 L1723 S1724 S1733 E1735 L1736	W1673-I1726 HydrophobicContact CE3-CG2 4.43Å; W1673-I1726 HydrophobicContact CH2-CG2 3.36Å; W1673-I1726 VanDerWaalsContact CH2-CG2 3.43Å; W1673-I1726 HydrophobicContact CZ2-CD1 4.33Å; W1673-I1726 HydrophobicContact CZ2-CG2 3.92Å; W1673-I1726 HydrophobicContact CZ3-CG2 3.69Å; N1722-I1726 HydrophobicContact CB-CD1 4.47Å; N1722-I1726 WeakPolarHBondContact O-CB 3.43Å; N1722-I1726 VanDerWaalsContact O-CD1 3.29Å; N1722-I1726 WeakPolarHBondContact O-CD1 3.37Å; N1722-I1726 VanDerWaalsContact O-CG1 3.24Å; N1722-I1726 WeakPolarHBondContact O-CG1 3.25Å; N1722-I1726 PolarHBondContact O-N 2.9Å; N1722-I1726 WeakPolarHBondContact OD1-CD1 3.33Å; L1723-I1726 PolarHBondContact O-N 3.11Å; S1724-I1726 VanDerWaalsContact C-N 3.35Å; I1726-S1733 WeakPolarHBondContact CA-OG 3.33Å; I1726-S1733 WeakPolarHBondContact CG2-OG 3.25Å; I1726-S1733 WeakPolarHBondContact O-CB 3.34Å; I1726-S1733 PolarHBondContact O-OG 3.17Å; I1726-S1733 VanDerWaalsContact O-OG 3.12Å; I1726-E1735 HydrophobicContact CD1-CB 4.17Å; I1726-E1735 HydrophobicContact CD1-CG 4.4Å; I1726-E1735 VanDerWaalsContact CD1-OE2 3.24Å; I1726-E1735 WeakPolarHBondContact CD1-OE2 3.38Å; I1726-E1735 HydrophobicContact CG1-CB 4.26Å; I1726-E1735 HydrophobicContact CG1-CG 4.42Å; I1726-E1735 WeakPolarHBondContact CG1-OE2 3.34Å; I1726-E1735 HydrophobicContact CG2-CB 4.36Å; I1726-L1736 HydrophobicContact CG2-CB 4.33Å
1727	L	82.9	Confident	79.9	Confident	15.4 Å²	15.4	64.2 Å²	64.2	8%	0.081	31%	0.312	C	S	.	.	H	α-helix	trans	-101.4	-26.9	-169.3	-69.9	170.8	0	0	0	114.8	W1673 A1681 L1685 L1723 L1736	W1673-L1727 HydrophobicContact CE3-CD1 4.01Å; W1673-L1727 HydrophobicContact CE3-CD2 3.92Å; W1673-L1727 HydrophobicContact CE3-CG 4.14Å; W1673-L1727 HydrophobicContact CZ3-CD2 3.77Å; W1673-L1727 HydrophobicContact CZ3-CG 4.23Å; A1681-L1727 HydrophobicContact CB-CD1 3.69Å; L1685-L1727 HydrophobicContact CD1-CB 4.12Å; L1685-L1727 HydrophobicContact CD1-CD1 3.57Å; L1685-L1727 HydrophobicContact CD1-CG 4.43Å; L1723-L1727 WeakPolarHBondContact O-CB 3.28Å; L1723-L1727 PolarHBondContact O-N 3.07Å; L1727-L1736 HydrophobicContact CD2-CD1 4.09Å; L1727-L1736 HydrophobicContact CD2-CD2 4.45Å
1728	L	78.4	Confident	80.3	Confident	30.4 Å²	30.4	66.7 Å²	66.7	16%	0.159	32%	0.323	C	S	.	.	S	Bend	trans	-103.2	8.4	-177.6	-47.4	-179.4	0	0	0	113.5	T1682 L1685 Y1686 S1689 S1724	T1682-L1728 HydrophobicContact CG2-CD2 4.14Å; L1685-L1728 HydrophobicContact CB-CD1 4.22Å; L1685-L1728 HydrophobicContact CB-CD2 4.32Å; L1685-L1728 HydrophobicContact CB-CG 4.36Å; Y1686-L1728 HydrophobicContact CD1-CD2 4.42Å; Y1686-L1728 HydrophobicContact CD2-CD2 3.62Å; Y1686-L1728 HydrophobicContact CE1-CD2 4.26Å; Y1686-L1728 HydrophobicContact CE2-CD2 3.45Å; Y1686-L1728 VanDerWaalsContact CE2-CD2 3.47Å; Y1686-L1728 HydrophobicContact CG-CD2 4.14Å; S1689-L1728 WeakPolarHBondContact OG-CD1 3.39Å; S1724-L1728 WeakPolarHBondContact O-CA 3.34Å; S1724-L1728 VanDerWaalsContact O-CB 3.23Å; S1724-L1728 WeakPolarHBondContact O-CB 3.33Å; S1724-L1728 WeakPolarHBondContact O-CG 3.19Å; S1724-L1728 PolarHBondContact O-N 3.06Å
1729	S	72.7	Confident	80.6	Confident	61 Å²	61	59.5 Å²	59.5	43%	0.427	30%	0.296	S	S	.	.	S	Bend	trans	-60.6	152.8	171.9	171.4	0	0	0	0	111.9	E1725 E1731	E1725-S1729 VanDerWaalsContact O-CB 3.3Å; E1725-S1729 WeakPolarHBondContact O-CB 3.37Å; S1729-E1731 VanDerWaalsContact C-N 3.3Å; S1729-E1731 VanDerWaalsContact CB-O 3.26Å; S1729-E1731 WeakPolarHBondContact CB-O 3.3Å; S1729-E1731 PolarHBondContact O-N 3.1Å; S1729-E1731 PolarHBondContact OG-N 3.22Å; S1729-E1731 PolarHBondContact OG-O 3.16Å
1730	Q	64.7	Low	80.9	Confident	148 Å²	148	56.6 Å²	56.6	69%	0.692	29%	0.285	S	S	*	.	S	Bend	trans	-69.2	-32.7	176	-79.6	-171.3	11.9	0	0	112.6	K1760	Q1730-K1760 VanDerWaalsContact CG-NZ 3.32Å; Q1730-K1760 PolarHBondContact O-NZ 3.17Å
1731	E	68.5	Low	81.2	Confident	121.2 Å²	121.2	61.2 Å²	61.2	57%	0.566	31%	0.306	S	S	*	.	S	Bend	trans	-112	145.3	172.7	-67	-168.2	164.2	0	0	110	S1729 S1733	S1729-E1731 VanDerWaalsContact C-N 3.3Å; S1729-E1731 VanDerWaalsContact CB-O 3.26Å; S1729-E1731 WeakPolarHBondContact CB-O 3.3Å; S1729-E1731 PolarHBondContact O-N 3.1Å; S1729-E1731 PolarHBondContact OG-N 3.22Å; S1729-E1731 PolarHBondContact OG-O 3.16Å; E1731-S1733 PolarHBondContact O-N 3.25Å; E1731-S1733 VanDerWaalsContact O-N 3.14Å
1732	P	71.7	Confident	81.3	Confident	42.2 Å²	42.2	60.7 Å²	60.7	27%	0.274	30%	0.301	S	S	.	.			trans	-59.9	120.6	179.3	14.6	-20.2	0	0	0	110.3	F1139 L1736 R1737 S2180	F1139-P1732 HydrophobicContact CB-CB 4.31Å; F1139-P1732 HydrophobicContact CB-CG 3.83Å; F1139-P1732 HydrophobicContact CD1-CB 4.35Å; F1139-P1732 HydrophobicContact CD1-CG 4.35Å; F1139-P1732 HydrophobicContact CG-CB 4.23Å; F1139-P1732 HydrophobicContact CG-CG 4.22Å; P1732-L1736 HydrophobicContact CB-CD2 4.24Å; P1732-R1737 HydrophobicContact CB-CG 4.35Å; P1732-R1737 VanDerWaalsContact O-CZ 3.24Å; P1732-R1737 PolarHBondContact O-NE 3.06Å; P1732-R1737 PolarHBondContact O-NH1 3.23Å; P1732-R1737 PolarHBondContact O-NH2 3.25Å; P1732-S2180 WeakPolarHBondContact CD-O 3.36Å; P1732-S2180 WeakPolarHBondContact CG-O 3.47Å
1733	S	79.3	Confident	81.4	Confident	19.6 Å²	19.6	56.6 Å²	56.6	14%	0.137	28%	0.279	C	S	.	.			trans	-60	156	-177.5	63.1	0	0	0	0	111.8	I1726 E1731 E1735 L1736 R1737	I1726-S1733 WeakPolarHBondContact CA-OG 3.33Å; I1726-S1733 WeakPolarHBondContact CG2-OG 3.25Å; I1726-S1733 WeakPolarHBondContact O-CB 3.34Å; I1726-S1733 PolarHBondContact O-OG 3.17Å; I1726-S1733 VanDerWaalsContact O-OG 3.12Å; E1731-S1733 PolarHBondContact O-N 3.25Å; E1731-S1733 VanDerWaalsContact O-N 3.14Å; S1733-E1735 PolarHBondContact O-N 3.11Å; S1733-L1736 PolarHBondContact O-N 3.24Å; S1733-L1736 VanDerWaalsContact OG-CB 3.26Å; S1733-L1736 WeakPolarHBondContact OG-CB 3.36Å; S1733-L1736 PolarHBondContact OG-N 3.28Å; S1733-L1736 VanDerWaalsContact OG-N 3.15Å; S1733-R1737 WeakPolarHBondContact O-CG 3.37Å; S1733-R1737 PolarHBondContact O-N 3.29Å; S1733-R1737 VanDerWaalsContact O-N 3.12Å; S1733-R1737 PolarHBondContact O-NE 3.27Å; S1733-R1737 PolarHBondContact O-NH1 3.33Å
1734	T	82.5	Confident	81.6	Confident	81.4 Å²	81.4	57.8 Å²	57.8	50%	0.499	29%	0.286	S	S	.	.	H	α-helix	trans	-62.9	-28.6	176	49.4	0	0	0	0	111.8	R1737 K1738	T1734-R1737 PolarHBondContact O-N 3.39Å; T1734-K1738 WeakPolarHBondContact O-CB 3.28Å; T1734-K1738 WeakPolarHBondContact O-CD 3.46Å; T1734-K1738 VanDerWaalsContact O-CG 3.27Å; T1734-K1738 WeakPolarHBondContact O-CG 3.41Å; T1734-K1738 PolarHBondContact O-N 3.12Å; T1734-K1738 VanDerWaalsContact O-N 3.11Å
1735	E	85	Confident	81.6	Confident	90.6 Å²	90.6	59.8 Å²	59.8	42%	0.423	30%	0.299	S	S	.	.	H	α-helix	trans	-72.9	-45.4	177.3	-64.8	144.3	-162.9	0	0	111.4	I1726 S1733 R1737 K1738 A1739	I1726-E1735 HydrophobicContact CD1-CB 4.17Å; I1726-E1735 HydrophobicContact CD1-CG 4.4Å; I1726-E1735 VanDerWaalsContact CD1-OE2 3.24Å; I1726-E1735 WeakPolarHBondContact CD1-OE2 3.38Å; I1726-E1735 HydrophobicContact CG1-CB 4.26Å; I1726-E1735 HydrophobicContact CG1-CG 4.42Å; I1726-E1735 WeakPolarHBondContact CG1-OE2 3.34Å; I1726-E1735 HydrophobicContact CG2-CB 4.36Å; S1733-E1735 PolarHBondContact O-N 3.11Å; E1735-R1737 VanDerWaalsContact C-N 3.31Å; E1735-R1737 PolarHBondContact O-N 3.12Å; E1735-K1738 PolarHBondContact O-N 3.02Å; E1735-A1739 VanDerWaalsContact O-CB 3.28Å; E1735-A1739 WeakPolarHBondContact O-CB 3.26Å; E1735-A1739 PolarHBondContact O-N 3.07Å
1736	L	86.4	Confident	81.4	Confident	20.2 Å²	20.2	54.4 Å²	54.4	11%	0.106	28%	0.277	C	S	.	.	H	α-helix	trans	-58.6	-44.8	172.3	175.3	61.7	0	0	0	111.4	W1673 F1678 I1726 L1727 P1732 S1733 K1738 A1739 T1740	W1673-L1736 HydrophobicContact CH2-CB 4.46Å; W1673-L1736 HydrophobicContact CH2-CD1 4.42Å; W1673-L1736 HydrophobicContact CZ3-CD1 3.92Å; F1678-L1736 HydrophobicContact CB-CD1 4.39Å; F1678-L1736 HydrophobicContact CD1-CD1 3.7Å; F1678-L1736 HydrophobicContact CD2-CD1 4.43Å; F1678-L1736 HydrophobicContact CE1-CD1 4.04Å; F1678-L1736 HydrophobicContact CG-CD1 3.95Å; F1678-L1736 HydrophobicContact CZ-CD1 4.47Å; I1726-L1736 HydrophobicContact CG2-CB 4.33Å; L1727-L1736 HydrophobicContact CD2-CD1 4.09Å; L1727-L1736 HydrophobicContact CD2-CD2 4.45Å; P1732-L1736 HydrophobicContact CB-CD2 4.24Å; S1733-L1736 PolarHBondContact O-N 3.24Å; S1733-L1736 VanDerWaalsContact OG-CB 3.26Å; S1733-L1736 WeakPolarHBondContact OG-CB 3.36Å; S1733-L1736 PolarHBondContact OG-N 3.28Å; S1733-L1736 VanDerWaalsContact OG-N 3.15Å; L1736-K1738 VanDerWaalsContact C-N 3.34Å; L1736-K1738 PolarHBondContact O-N 2.67Å; L1736-A1739 PolarHBondContact O-N 3.13Å; L1736-A1739 VanDerWaalsContact O-N 3.12Å; L1736-T1740 VanDerWaalsContact O-CB 3.32Å; L1736-T1740 WeakPolarHBondContact O-CB 3.4Å; L1736-T1740 PolarHBondContact O-N 3.14Å; L1736-T1740 PolarHBondContact O-OG1 3.23Å; L1736-T1740 VanDerWaalsContact O-OG1 3.04Å
1737	R	85.6	Confident	81.1	Confident	95.4 Å²	95.4	55.7 Å²	55.7	36%	0.36	29%	0.294	S	S	.	.	H	α-helix	trans	-60.7	-46.4	177	-89.7	-177.8	-102.4	133.2	-11	112.1	F1139 P1732 S1733 T1734 E1735 T1740 Q1741 F2185	F1139-R1737 HydrophobicContact CB-CG 4.18Å; F1139-R1737 HydrophobicContact CD2-CG 3.94Å; F1139-R1737 HydrophobicContact CG-CG 4.48Å; P1732-R1737 HydrophobicContact CB-CG 4.35Å; P1732-R1737 VanDerWaalsContact O-CZ 3.24Å; P1732-R1737 PolarHBondContact O-NE 3.06Å; P1732-R1737 PolarHBondContact O-NH1 3.23Å; P1732-R1737 PolarHBondContact O-NH2 3.25Å; S1733-R1737 WeakPolarHBondContact O-CG 3.37Å; S1733-R1737 PolarHBondContact O-N 3.29Å; S1733-R1737 VanDerWaalsContact O-N 3.12Å; S1733-R1737 PolarHBondContact O-NE 3.27Å; S1733-R1737 PolarHBondContact O-NH1 3.33Å; T1734-R1737 PolarHBondContact O-N 3.39Å; E1735-R1737 VanDerWaalsContact C-N 3.31Å; E1735-R1737 PolarHBondContact O-N 3.12Å; R1737-T1740 PolarHBondContact O-N 3.24Å; R1737-Q1741 WeakPolarHBondContact O-CB 3.29Å; R1737-Q1741 VanDerWaalsContact O-CG 3.29Å; R1737-Q1741 WeakPolarHBondContact O-CG 3.36Å; R1737-Q1741 PolarHBondContact O-N 3.09Å; R1737-Q1741 PolarHBondContact O-OE1 2.61Å; R1737-F2185 HydrophobicContact CG-CE1 4.22Å
1738	K	85.8	Confident	81	Confident	119.8 Å²	119.8	56.4 Å²	56.4	52%	0.521	30%	0.3	S	S	.	.	H	α-helix	trans	-63.2	-43.5	175.9	-74.5	172.9	-179.3	179.5	0	112.3	T1734 E1735 L1736 T1740 Q1741 R1742	T1734-K1738 WeakPolarHBondContact O-CB 3.28Å; T1734-K1738 WeakPolarHBondContact O-CD 3.46Å; T1734-K1738 VanDerWaalsContact O-CG 3.27Å; T1734-K1738 WeakPolarHBondContact O-CG 3.41Å; T1734-K1738 PolarHBondContact O-N 3.12Å; T1734-K1738 VanDerWaalsContact O-N 3.11Å; E1735-K1738 PolarHBondContact O-N 3.02Å; L1736-K1738 VanDerWaalsContact C-N 3.34Å; L1736-K1738 PolarHBondContact O-N 2.67Å; K1738-T1740 VanDerWaalsContact C-N 3.33Å; K1738-T1740 PolarHBondContact O-N 3.09Å; K1738-Q1741 PolarHBondContact O-N 2.98Å; K1738-R1742 WeakPolarHBondContact O-CG 3.3Å; K1738-R1742 PolarHBondContact O-N 3.15Å; K1738-R1742 VanDerWaalsContact O-N 3.09Å
1739	A	86.9	Confident	81.4	Confident	0.2 Å²	0.2	55 Å²	55	0%	0.002	29%	0.293	C	S	.	.	H	α-helix	trans	-63.1	-44.8	178.2	0	0	0	0	0	111.6	W1673 F1678 E1735 L1736 Q1741 R1742 A1743 I1861	W1673-A1739 HydrophobicContact CH2-CB 3.9Å; W1673-A1739 HydrophobicContact CZ2-CB 4.15Å; W1673-A1739 HydrophobicContact CZ3-CB 4.43Å; F1678-A1739 HydrophobicContact CE1-CB 4.06Å; F1678-A1739 HydrophobicContact CZ-CB 4.09Å; E1735-A1739 VanDerWaalsContact O-CB 3.28Å; E1735-A1739 WeakPolarHBondContact O-CB 3.26Å; E1735-A1739 PolarHBondContact O-N 3.07Å; L1736-A1739 PolarHBondContact O-N 3.13Å; L1736-A1739 VanDerWaalsContact O-N 3.12Å; A1739-Q1741 VanDerWaalsContact C-N 3.34Å; A1739-Q1741 PolarHBondContact O-N 2.99Å; A1739-R1742 PolarHBondContact O-N 3.09Å; A1739-A1743 WeakPolarHBondContact O-CB 3.31Å; A1739-A1743 PolarHBondContact O-N 3.04Å; A1739-I1861 HydrophobicContact CB-CG2 4.13Å
1740	T	88.2	Confident	82.2	Confident	12.6 Å²	12.6	55.8 Å²	55.8	8%	0.077	29%	0.286	C	S	.	.	H	α-helix	trans	-60.1	-44.3	174.2	-58.6	0	0	0	0	111.6	V1138 F1139 L1736 R1737 K1738 R1742 A1743 L1744 F1833 F2185	V1138-T1740 HydrophobicContact CB-CG2 4.42Å; V1138-T1740 HydrophobicContact CG2-CG2 4.42Å; F1139-T1740 HydrophobicContact CE2-CG2 3.96Å; L1736-T1740 VanDerWaalsContact O-CB 3.32Å; L1736-T1740 WeakPolarHBondContact O-CB 3.4Å; L1736-T1740 PolarHBondContact O-N 3.14Å; L1736-T1740 PolarHBondContact O-OG1 3.23Å; L1736-T1740 VanDerWaalsContact O-OG1 3.04Å; R1737-T1740 PolarHBondContact O-N 3.24Å; K1738-T1740 VanDerWaalsContact C-N 3.33Å; K1738-T1740 PolarHBondContact O-N 3.09Å; T1740-R1742 VanDerWaalsContact C-N 3.33Å; T1740-R1742 PolarHBondContact O-N 3Å; T1740-A1743 PolarHBondContact O-N 3.19Å; T1740-L1744 HydrophobicContact CG2-CD1 3.95Å; T1740-L1744 HydrophobicContact CG2-CG 4.45Å; T1740-L1744 WeakPolarHBondContact O-CB 3.32Å; T1740-L1744 WeakPolarHBondContact O-CG 3.31Å; T1740-L1744 PolarHBondContact O-N 3.2Å; T1740-L1744 VanDerWaalsContact O-N 3.14Å; T1740-F1833 HydrophobicContact CG2-CE1 3.89Å; T1740-F1833 HydrophobicContact CG2-CE2 4.42Å; T1740-F1833 HydrophobicContact CG2-CZ 3.5Å; T1740-F1833 VanDerWaalsContact CG2-CZ 3.44Å; T1740-F2185 HydrophobicContact CG2-CB 4.48Å; T1740-F2185 HydrophobicContact CG2-CD1 3.34Å; T1740-F2185 HydrophobicContact CG2-CE1 3.61Å; T1740-F2185 HydrophobicContact CG2-CG 3.97Å; T1740-F2185 HydrophobicContact CG2-CZ 4.41Å
1741	Q	87	Confident	83.6	Confident	103.8 Å²	103.8	48.7 Å²	48.7	49%	0.485	25%	0.253	S	S	.	.	H	α-helix	trans	-62.2	-41.8	178	-135.9	174.8	-6.7	0	0	112.3	V1135 R1737 K1738 A1739 L1744 S1745 S2184	V1135-Q1741 HydrophobicContact CB-CG 4.43Å; V1135-Q1741 HydrophobicContact CG1-CG 3.87Å; R1737-Q1741 WeakPolarHBondContact O-CB 3.29Å; R1737-Q1741 VanDerWaalsContact O-CG 3.29Å; R1737-Q1741 WeakPolarHBondContact O-CG 3.36Å; R1737-Q1741 PolarHBondContact O-N 3.09Å; R1737-Q1741 PolarHBondContact O-OE1 2.61Å; K1738-Q1741 PolarHBondContact O-N 2.98Å; A1739-Q1741 VanDerWaalsContact C-N 3.34Å; A1739-Q1741 PolarHBondContact O-N 2.99Å; Q1741-L1744 PolarHBondContact O-N 2.85Å; Q1741-S1745 VanDerWaalsContact O-CB 3.3Å; Q1741-S1745 WeakPolarHBondContact O-CB 3.35Å; Q1741-S1745 PolarHBondContact O-N 3.24Å; Q1741-S1745 VanDerWaalsContact O-N 3.12Å; Q1741-S1745 PolarHBondContact O-OG 3.44Å; Q1741-S2184 PolarHBondContact NE2-O 2.94Å
1742	R	85.3	Confident	84.7	Confident	51.6 Å²	51.6	43.1 Å²	43.1	20%	0.195	23%	0.227	C	C	.	.	H	α-helix	trans	-65.6	-40.1	173.9	-70.4	-171.9	-65.2	-112.8	0.6	112.6	K1738 A1739 T1740 L1744 S1745 C1746 E1859 I1860 I1861 P1863	K1738-R1742 WeakPolarHBondContact O-CG 3.3Å; K1738-R1742 PolarHBondContact O-N 3.15Å; K1738-R1742 VanDerWaalsContact O-N 3.09Å; A1739-R1742 PolarHBondContact O-N 3.09Å; T1740-R1742 VanDerWaalsContact C-N 3.33Å; T1740-R1742 PolarHBondContact O-N 3Å; R1742-L1744 VanDerWaalsContact C-N 3.32Å; R1742-L1744 PolarHBondContact O-N 3.27Å; R1742-S1745 WeakPolarHBondContact CA-OG 3.2Å; R1742-S1745 PolarHBondContact O-N 3.15Å; R1742-S1745 VanDerWaalsContact O-N 3.1Å; R1742-S1745 PolarHBondContact O-OG 3.03Å; R1742-S1745 VanDerWaalsContact O-OG 3.07Å; R1742-C1746 PolarHBondContact O-N 2.84Å; R1742-E1859 HydrophobicContact CB-CB 4.43Å; R1742-E1859 HydrophobicContact CG-CB 4.27Å; R1742-I1860 VanDerWaalsContact CD-O 3.31Å; R1742-I1860 WeakPolarHBondContact CD-O 3.33Å; R1742-I1860 PolarHBondContact NE-O 3.06Å; R1742-I1861 VanDerWaalsContact CZ-O 3.25Å; R1742-I1861 PolarHBondContact NE-O 3.07Å; R1742-I1861 PolarHBondContact NH2-O 3.24Å; R1742-P1863 VanDerWaalsContact CZ-CD 3.48Å
1743	A	87	Confident	85.7	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-65.9	-30.1	178.1	0	0	0	0	0	113	A1739 T1740 P1751 H1836 I1861	A1739-A1743 WeakPolarHBondContact O-CB 3.31Å; A1739-A1743 PolarHBondContact O-N 3.04Å; T1740-A1743 PolarHBondContact O-N 3.19Å; A1743-P1751 HydrophobicContact CB-CB 3.9Å; A1743-P1751 HydrophobicContact CB-CG 4.36Å; A1743-H1836 PolarHBondContact O-CE1 2.82Å; A1743-I1861 HydrophobicContact CB-CD1 3.7Å; A1743-I1861 HydrophobicContact CB-CG1 3.9Å; A1743-I1861 HydrophobicContact CB-CG2 4.36Å
1744	L	87	Confident	86.2	Confident	33.8 Å²	33.8	41.6 Å²	41.6	18%	0.177	21%	0.214	C	C	.	.	H	α-helix	trans	-88.3	-17	175.9	-67.9	171.9	0	0	0	113.6	V1135 V1138 T1740 Q1741 R1742 P1751 F1833 H1836 F2185	V1135-L1744 HydrophobicContact CG1-CB 4.49Å; V1138-L1744 HydrophobicContact CG2-CD1 3.86Å; T1740-L1744 HydrophobicContact CG2-CD1 3.95Å; T1740-L1744 HydrophobicContact CG2-CG 4.45Å; T1740-L1744 WeakPolarHBondContact O-CB 3.32Å; T1740-L1744 WeakPolarHBondContact O-CG 3.31Å; T1740-L1744 PolarHBondContact O-N 3.2Å; T1740-L1744 VanDerWaalsContact O-N 3.14Å; Q1741-L1744 PolarHBondContact O-N 2.85Å; R1742-L1744 VanDerWaalsContact C-N 3.32Å; R1742-L1744 PolarHBondContact O-N 3.27Å; L1744-P1751 HydrophobicContact CD2-CG 4.08Å; L1744-F1833 HydrophobicContact CD1-CD1 4.48Å; L1744-F1833 HydrophobicContact CD1-CE1 4.18Å; L1744-F1833 HydrophobicContact CD1-CZ 4.22Å; L1744-F1833 HydrophobicContact CD2-CD1 3.92Å; L1744-F1833 HydrophobicContact CD2-CE1 4.22Å; L1744-F1833 HydrophobicContact CD2-CG 4.37Å; L1744-F1833 HydrophobicContact CG-CE1 4.38Å; L1744-H1836 HydrophobicContact CD2-CB 3.88Å; L1744-H1836 PolarHBondContact O-ND1 3.19Å; L1744-F2185 HydrophobicContact CD1-CB 4.37Å
1745	S	82.8	Confident	86.4	Confident	52 Å²	52	37.8 Å²	37.8	36%	0.364	19%	0.191	S	C	.	.	H	α-helix	trans	-79.8	-22.1	179.8	69.5	0	0	0	0	113.7	Q1741 R1742 R1856 E1859	Q1741-S1745 VanDerWaalsContact O-CB 3.3Å; Q1741-S1745 WeakPolarHBondContact O-CB 3.35Å; Q1741-S1745 PolarHBondContact O-N 3.24Å; Q1741-S1745 VanDerWaalsContact O-N 3.12Å; Q1741-S1745 PolarHBondContact O-OG 3.44Å; R1742-S1745 WeakPolarHBondContact CA-OG 3.2Å; R1742-S1745 PolarHBondContact O-N 3.15Å; R1742-S1745 VanDerWaalsContact O-N 3.1Å; R1742-S1745 PolarHBondContact O-OG 3.03Å; R1742-S1745 VanDerWaalsContact O-OG 3.07Å; S1745-R1856 PolarHBondContact O-NH1 3.45Å; S1745-E1859 WeakPolarHBondContact CB-OE2 3.29Å; S1745-E1859 PolarHBondContact OG-OE2 2.91Å
1746	C	78.4	Confident	86.3	Confident	27.6 Å²	27.6	33.6 Å²	33.6	19%	0.186	17%	0.172	C	C	.	.	S	Bend	trans	-114.9	114.5	179.6	-157.7	0	0	0	0	111.2	R1742 S1748 F1749 H1836	R1742-C1746 PolarHBondContact O-N 2.84Å; C1746-S1748 PolarHBondContact O-N 3.21Å; C1746-S1748 VanDerWaalsContact O-N 3.13Å; C1746-S1748 PolarHBondContact SG-OG 3.02Å; C1746-S1748 VanDerWaalsContact SG-OG 3.4Å; C1746-F1749 HydrophobicContact CB-CD2 3.59Å; C1746-F1749 VanDerWaalsContact CB-CD2 3.47Å; C1746-F1749 HydrophobicContact CB-CE2 3.59Å; C1746-F1749 VanDerWaalsContact CB-CE2 3.48Å; C1746-F1749 HydrophobicContact CB-CG 4.42Å; C1746-F1749 HydrophobicContact CB-CZ 4.34Å; C1746-F1749 PolarHBondContact O-N 3.07Å; C1746-H1836 PolarHBondContact O-CE1 3.2Å; C1746-H1836 VanDerWaalsContact O-CE1 3.26Å
1747	G	78	Confident	86.2	Confident	43 Å²	43	34.4 Å²	34.4	44%	0.443	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-10.9	-172.9	0	0	0	0	0	116.3	R1840	G1747-R1840 WeakPolarHBondContact O-CD 3.34Å; G1747-R1840 WeakPolarHBondContact O-CG 3.36Å; G1747-R1840 PolarHBondContact O-NE 3.48Å; G1747-R1840 VanDerWaalsContact O-NE 3.09Å
1748	S	80.5	Confident	86.4	Confident	30 Å²	30	30.2 Å²	30.2	21%	0.21	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-26.2	178.8	50.9	0	0	0	0	113.8	C1746 R1840 D1879 A1880 D1881	C1746-S1748 PolarHBondContact O-N 3.21Å; C1746-S1748 VanDerWaalsContact O-N 3.13Å; C1746-S1748 PolarHBondContact SG-OG 3.02Å; C1746-S1748 VanDerWaalsContact SG-OG 3.4Å; S1748-R1840 VanDerWaalsContact O-CZ 3.22Å; S1748-R1840 PolarHBondContact O-NE 3.29Å; S1748-R1840 VanDerWaalsContact O-NE 3.07Å; S1748-R1840 PolarHBondContact O-NH1 2.95Å; S1748-R1840 PolarHBondContact O-NH2 2.93Å; S1748-D1879 WeakPolarHBondContact CB-OD1 3.34Å; S1748-D1879 PolarHBondContact OG-OD1 3.01Å; S1748-A1880 WeakPolarHBondContact OG-CB 3.21Å; S1748-A1880 PolarHBondContact OG-N 3.39Å; S1748-A1880 VanDerWaalsContact OG-N 3.16Å; S1748-D1881 WeakPolarHBondContact O-CB 3.42Å
1749	F	86.7	Confident	86.5	Confident	0.2 Å²	0.2	24.5 Å²	24.5	0%	0.001	14%	0.138	C	C	.	.			trans	-68.7	150.5	-179.6	-66.1	-52.8	0	0	0	113	C1746 P1751 H1836 R1840 E1859 I1861 A1880 D1881 Q1884	C1746-F1749 HydrophobicContact CB-CD2 3.59Å; C1746-F1749 VanDerWaalsContact CB-CD2 3.47Å; C1746-F1749 HydrophobicContact CB-CE2 3.59Å; C1746-F1749 VanDerWaalsContact CB-CE2 3.48Å; C1746-F1749 HydrophobicContact CB-CG 4.42Å; C1746-F1749 HydrophobicContact CB-CZ 4.34Å; C1746-F1749 PolarHBondContact O-N 3.07Å; F1749-P1751 VanDerWaalsContact C-CD 3.42Å; F1749-P1751 VanDerWaalsContact O-CD 3.24Å; F1749-P1751 WeakPolarHBondContact O-CD 3.29Å; F1749-H1836 PolarHBondContact O-NE2 3.16Å; F1749-R1840 WeakPolarHBondContact O-CD 3.44Å; F1749-R1840 PolarHBondContact O-NH1 3.37Å; F1749-E1859 WeakPolarHBondContact CE2-O 3.3Å; F1749-I1861 HydrophobicContact CB-CD1 4.18Å; F1749-I1861 HydrophobicContact CD1-CD1 3.63Å; F1749-I1861 HydrophobicContact CD1-CG1 3.96Å; F1749-I1861 HydrophobicContact CD2-CD1 4.12Å; F1749-I1861 HydrophobicContact CD2-CG1 3.88Å; F1749-I1861 HydrophobicContact CE1-CD1 3.97Å; F1749-I1861 HydrophobicContact CE1-CG1 3.85Å; F1749-I1861 HydrophobicContact CE2-CD1 4.38Å; F1749-I1861 HydrophobicContact CE2-CG1 3.78Å; F1749-I1861 HydrophobicContact CG-CD1 3.73Å; F1749-I1861 HydrophobicContact CG-CG1 3.99Å; F1749-I1861 HydrophobicContact CZ-CD1 4.29Å; F1749-I1861 HydrophobicContact CZ-CG1 3.78Å; F1749-A1880 VanDerWaalsContact CE1-C 3.49Å; F1749-A1880 HydrophobicContact CE1-CB 3.96Å; F1749-A1880 WeakPolarHBondContact CE1-O 3.4Å; F1749-A1880 HydrophobicContact CE2-CB 4.07Å; F1749-A1880 HydrophobicContact CZ-CB 3.58Å; F1749-A1880 VanDerWaalsContact CZ-CB 3.49Å; F1749-D1881 HydrophobicContact CD1-CB 4.01Å; F1749-D1881 HydrophobicContact CE1-CB 4.27Å; F1749-Q1884 HydrophobicContact CE1-CB 4.32Å
1750	R	90.1	Very high	86.4	Confident	78.4 Å²	78.4	27.3 Å²	27.3	30%	0.296	15%	0.15	S	C	.	.			trans	-113	69.7	176.5	-70.2	179.4	-86.3	-101.8	-7.6	110.8	Y1595 D1881 R1885	Y1595-R1750 HydrophobicContact CD2-CB 3.81Å; Y1595-R1750 HydrophobicContact CD2-CG 4.27Å; Y1595-R1750 HydrophobicContact CE2-CB 3.62Å; Y1595-R1750 HydrophobicContact CE2-CG 3.78Å; R1750-D1881 IonicContact CZ-OD2 2.84Å; R1750-D1881 IonicContact NH1-OD2 3.68Å; R1750-D1881 IonicContact NH2-OD2 3.01Å; R1750-D1881 PolarHBondContact NH2-OD2 3.4Å; R1750-R1885 VanDerWaalsContact NH2-NH2 3.15Å
1751	P	92.1	Very high	86.3	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	16%	0.155	C	C	.	.			trans	-61.4	140.9	177.6	24.6	-31.9	0	0	0	111.1	Y1599 G1676 F1678 A1743 L1744 F1749 F1833	Y1599-P1751 WeakPolarHBondContact CE2-O 3.26Å; Y1599-P1751 PolarHBondContact OH-O 3.01Å; G1676-P1751 CarbonylContact O-C 3.58Å; G1676-P1751 WeakPolarHBondContact O-CA 3.41Å; F1678-P1751 HydrophobicContact CE2-CB 4.48Å; A1743-P1751 HydrophobicContact CB-CB 3.9Å; A1743-P1751 HydrophobicContact CB-CG 4.36Å; L1744-P1751 HydrophobicContact CD2-CG 4.08Å; F1749-P1751 VanDerWaalsContact C-CD 3.42Å; F1749-P1751 VanDerWaalsContact O-CD 3.24Å; F1749-P1751 WeakPolarHBondContact O-CD 3.29Å; P1751-F1833 HydrophobicContact CB-CD1 4.3Å; P1751-F1833 HydrophobicContact CB-CE1 4.3Å; P1751-F1833 HydrophobicContact CG-CD1 4.28Å
1752	I	92.8	Very high	86.3	Confident	2.4 Å²	2.4	23.6 Å²	23.6	1%	0.012	13%	0.133	C	C	.	.	B	Isolated β-bridge	trans	-124.4	104.1	172.7	-52.3	172.4	0	0	0	107.1	S1591 E1594 Y1595 V1598 G1676 N1677 F1678 N1679	S1591-I1752 VanDerWaalsContact O-CD1 3.25Å; S1591-I1752 WeakPolarHBondContact O-CD1 3.39Å; E1594-I1752 HydrophobicContact CB-CD1 4.06Å; E1594-I1752 HydrophobicContact CB-CG2 4.37Å; Y1595-I1752 HydrophobicContact CD2-CD1 4.42Å; Y1595-I1752 HydrophobicContact CD2-CG1 4.14Å; V1598-I1752 HydrophobicContact CB-CG2 4.38Å; V1598-I1752 HydrophobicContact CG2-CG2 3.94Å; G1676-I1752 PolarHBondContact O-N 3.14Å; N1677-I1752 HydrophobicContact CB-CB 4.41Å; N1677-I1752 HydrophobicContact CB-CD1 4.05Å; F1678-I1752 WeakPolarHBondContact CA-O 3.44Å; F1678-I1752 WeakPolarHBondContact CB-O 3.42Å; F1678-I1752 PolarHBondContact N-O 3.11Å; N1679-I1752 HydrophobicContact CB-CB 4.44Å; N1679-I1752 HydrophobicContact CB-CG2 3.85Å; N1679-I1752 PolarHBondContact N-O 3.01Å; N1679-I1752 VanDerWaalsContact N-O 3.1Å
1753	P	91.9	Very high	86.4	Confident	5.8 Å²	5.8	21.5 Å²	21.5	4%	0.038	13%	0.125	C	C	.	.			trans	-72.3	148.2	-177.7	31.4	-35.6	0	0	0	111.1	F1755 F1758 F1833	P1753-F1755 PolarHBondContact O-N 2.96Å; P1753-F1755 VanDerWaalsContact O-N 3.09Å; P1753-F1758 HydrophobicContact CB-CE2 3.77Å; P1753-F1758 HydrophobicContact CB-CZ 3.94Å; P1753-F1758 HydrophobicContact CG-CE2 3.95Å; P1753-F1758 HydrophobicContact CG-CZ 4.27Å; P1753-F1833 HydrophobicContact CB-CD1 4.12Å; P1753-F1833 HydrophobicContact CB-CD2 4.32Å; P1753-F1833 HydrophobicContact CB-CE1 3.79Å; P1753-F1833 HydrophobicContact CB-CE2 4.07Å; P1753-F1833 HydrophobicContact CB-CG 4.36Å; P1753-F1833 HydrophobicContact CB-CZ 3.76Å; P1753-F1833 HydrophobicContact CG-CB 4.37Å; P1753-F1833 HydrophobicContact CG-CD1 3.88Å; P1753-F1833 HydrophobicContact CG-CD2 4.16Å; P1753-F1833 HydrophobicContact CG-CE1 4.09Å; P1753-F1833 HydrophobicContact CG-CE2 4.37Å; P1753-F1833 HydrophobicContact CG-CG 3.92Å; P1753-F1833 HydrophobicContact CG-CZ 4.32Å
1754	F	89.5	Confident	86.3	Confident	23.8 Å²	23.8	23.9 Å²	23.9	10%	0.104	14%	0.139	C	C	.	.			trans	-70.2	105.2	173.5	173.5	-130.5	0	0	0	110.1	F1549 L1552 F1633 N1679 T1682 Y1686 G1756 T1757	F1549-F1754 HydrophobicContact CE1-CE1 4.1Å; F1549-F1754 HydrophobicContact CE1-CZ 4.32Å; F1549-F1754 HydrophobicContact CZ-CE1 4.26Å; L1552-F1754 HydrophobicContact CD1-CZ 4.07Å; F1633-F1754 HydrophobicContact CD2-CE2 4.16Å; F1633-F1754 HydrophobicContact CE2-CD2 4.38Å; F1633-F1754 AromaticContact CE2-CE2 3.57Å; F1633-F1754 HydrophobicContact CE2-CE2 3.57Å; F1633-F1754 VanDerWaalsContact CE2-CE2 3.5Å; F1633-F1754 HydrophobicContact CE2-CZ 4.16Å; F1633-F1754 HydrophobicContact CZ-CE2 4.19Å; F1633-F1754 HydrophobicContact CZ-CZ 4.43Å; N1679-F1754 WeakPolarHBondContact OD1-CD2 3.47Å; T1682-F1754 HydrophobicContact CG2-CD1 3.92Å; T1682-F1754 HydrophobicContact CG2-CD2 3.8Å; T1682-F1754 HydrophobicContact CG2-CE1 3.87Å; T1682-F1754 HydrophobicContact CG2-CE2 3.75Å; T1682-F1754 HydrophobicContact CG2-CG 3.9Å; T1682-F1754 HydrophobicContact CG2-CZ 3.79Å; Y1686-F1754 HydrophobicContact CE2-CE1 4.37Å; Y1686-F1754 HydrophobicContact CE2-CZ 4.32Å; F1754-G1756 PolarHBondContact O-N 3.23Å; F1754-G1756 VanDerWaalsContact O-N 3.15Å; F1754-T1757 HydrophobicContact CD1-CG2 3.91Å; F1754-T1757 VanDerWaalsContact CD1-OG1 3.25Å; F1754-T1757 WeakPolarHBondContact CD1-OG1 3.3Å; F1754-T1757 HydrophobicContact CE1-CG2 4.42Å; F1754-T1757 WeakPolarHBondContact O-CB 3.43Å; F1754-T1757 PolarHBondContact O-N 3.19Å; F1754-T1757 VanDerWaalsContact O-N 3.12Å; F1754-T1757 PolarHBondContact O-OG1 3.13Å; F1754-T1757 VanDerWaalsContact O-OG1 3.12Å
1755	F	87.9	Confident	86.3	Confident	1.8 Å²	1.8	22.7 Å²	22.7	1%	0.008	13%	0.133	C	C	.	.	H	α-helix	trans	-57.1	-26.6	-173.1	76	-95.5	0	0	0	113.5	L1552 Y1606 L1629 I1630 F1633 N1679 P1753 T1757 F1758 L1759	L1552-F1755 HydrophobicContact CD2-CE2 3.82Å; L1552-F1755 HydrophobicContact CD2-CZ 4.41Å; Y1606-F1755 HydrophobicContact CE1-CB 3.98Å; Y1606-F1755 WeakPolarHBondContact OH-CB 3.44Å; L1629-F1755 HydrophobicContact CB-CD1 4.1Å; L1629-F1755 HydrophobicContact CB-CD2 4.39Å; L1629-F1755 HydrophobicContact CB-CE1 4.07Å; L1629-F1755 HydrophobicContact CB-CE2 4.37Å; L1629-F1755 HydrophobicContact CB-CG 4.29Å; L1629-F1755 HydrophobicContact CB-CZ 4.21Å; L1629-F1755 HydrophobicContact CD1-CB 3.95Å; L1629-F1755 HydrophobicContact CD1-CD1 4.22Å; L1629-F1755 HydrophobicContact CD1-CD2 4.39Å; L1629-F1755 HydrophobicContact CD1-CG 3.97Å; L1629-F1755 HydrophobicContact CD2-CD1 4.44Å; I1630-F1755 HydrophobicContact CD1-CD2 4.17Å; I1630-F1755 HydrophobicContact CD1-CE2 3.27Å; I1630-F1755 HydrophobicContact CD1-CZ 3.81Å; I1630-F1755 HydrophobicContact CG1-CE2 3.81Å; I1630-F1755 HydrophobicContact CG1-CZ 4.29Å; F1633-F1755 HydrophobicContact CB-CE1 3.9Å; F1633-F1755 HydrophobicContact CB-CZ 3.71Å; F1633-F1755 AromaticContact CD2-CE1 3.7Å; F1633-F1755 HydrophobicContact CD2-CE1 3.79Å; F1633-F1755 AromaticContact CD2-CZ 3.88Å; F1633-F1755 HydrophobicContact CD2-CZ 3.94Å; F1633-F1755 HydrophobicContact CG-CE1 4.1Å; F1633-F1755 AromaticContact CG-CZ 3.84Å; F1633-F1755 HydrophobicContact CG-CZ 3.88Å; N1679-F1755 WeakPolarHBondContact OD1-CD1 3.4Å; N1679-F1755 WeakPolarHBondContact OD1-CE1 3.28Å; P1753-F1755 PolarHBondContact O-N 2.96Å; P1753-F1755 VanDerWaalsContact O-N 3.09Å; F1755-T1757 VanDerWaalsContact C-N 3.27Å; F1755-T1757 PolarHBondContact O-N 3.23Å; F1755-F1758 PolarHBondContact O-N 3.1Å; F1755-L1759 HydrophobicContact CD2-CD1 3.73Å; F1755-L1759 HydrophobicContact CD2-CG 4.42Å; F1755-L1759 HydrophobicContact CE2-CD1 3.87Å; F1755-L1759 PolarHBondContact O-N 3.19Å
1756	G	83.1	Confident	86.4	Confident	2.6 Å²	2.6	21.8 Å²	21.8	3%	0.027	12%	0.123	C	C	.	.	H	α-helix	trans	-64.6	-22.3	179.5	0	0	0	0	0	114.5	F1549 F1754 K1760	F1549-G1756 WeakPolarHBondContact CZ-O 3.46Å; F1754-G1756 PolarHBondContact O-N 3.23Å; F1754-G1756 VanDerWaalsContact O-N 3.15Å; G1756-K1760 WeakPolarHBondContact O-CB 3.31Å; G1756-K1760 PolarHBondContact O-N 3.13Å
1757	T	84.5	Confident	86.7	Confident	37 Å²	37	25.1 Å²	25.1	23%	0.227	14%	0.136	C	C	.	.	H	α-helix	trans	-68.1	-48.9	174.9	40.2	0	0	0	0	111.5	F1139 F1754 F1755 L1759 K1760 D1761 S2180 I2181	F1139-T1757 HydrophobicContact CE1-CG2 4.38Å; F1754-T1757 HydrophobicContact CD1-CG2 3.91Å; F1754-T1757 VanDerWaalsContact CD1-OG1 3.25Å; F1754-T1757 WeakPolarHBondContact CD1-OG1 3.3Å; F1754-T1757 HydrophobicContact CE1-CG2 4.42Å; F1754-T1757 WeakPolarHBondContact O-CB 3.43Å; F1754-T1757 PolarHBondContact O-N 3.19Å; F1754-T1757 VanDerWaalsContact O-N 3.12Å; F1754-T1757 PolarHBondContact O-OG1 3.13Å; F1754-T1757 VanDerWaalsContact O-OG1 3.12Å; F1755-T1757 VanDerWaalsContact C-N 3.27Å; F1755-T1757 PolarHBondContact O-N 3.23Å; T1757-L1759 VanDerWaalsContact C-N 3.29Å; T1757-L1759 PolarHBondContact O-N 3.06Å; T1757-K1760 WeakPolarHBondContact O-CA 3.32Å; T1757-K1760 VanDerWaalsContact O-CB 3.27Å; T1757-K1760 WeakPolarHBondContact O-CB 3.41Å; T1757-K1760 PolarHBondContact O-N 3.17Å; T1757-K1760 VanDerWaalsContact O-N 3.09Å; T1757-D1761 VanDerWaalsContact O-CG 3.26Å; T1757-D1761 PolarHBondContact O-N 3.28Å; T1757-D1761 VanDerWaalsContact O-N 3.14Å; T1757-S2180 WeakPolarHBondContact CG2-OG 3.47Å; T1757-I2181 HydrophobicContact CG2-CD1 3.55Å; T1757-I2181 HydrophobicContact CG2-CG1 3.66Å
1758	F	88.9	Confident	87	Confident	8 Å²	8	26.5 Å²	26.5	4%	0.035	14%	0.138	C	C	.	.	H	α-helix	trans	-63.4	-39.1	178.2	-49.3	-72.9	0	0	0	111.7	F1139 Y1606 P1753 F1755 D1761 L1762 V1826 N1829 L1830 F1833 I2181	F1139-F1758 HydrophobicContact CE1-CE1 4.41Å; Y1606-F1758 HydrophobicContact CD1-CB 4.35Å; Y1606-F1758 HydrophobicContact CE1-CB 4.43Å; Y1606-F1758 HydrophobicContact CE1-CD2 4.47Å; P1753-F1758 HydrophobicContact CB-CE2 3.77Å; P1753-F1758 HydrophobicContact CB-CZ 3.94Å; P1753-F1758 HydrophobicContact CG-CE2 3.95Å; P1753-F1758 HydrophobicContact CG-CZ 4.27Å; F1755-F1758 PolarHBondContact O-N 3.1Å; F1758-D1761 PolarHBondContact O-N 3.31Å; F1758-L1762 WeakPolarHBondContact O-CB 3.35Å; F1758-L1762 VanDerWaalsContact O-CG 3.27Å; F1758-L1762 WeakPolarHBondContact O-CG 3.34Å; F1758-L1762 PolarHBondContact O-N 3.18Å; F1758-V1826 HydrophobicContact CB-CG1 4.04Å; F1758-V1826 HydrophobicContact CD1-CG1 4.09Å; F1758-N1829 HydrophobicContact CE1-CB 4.38Å; F1758-L1830 HydrophobicContact CD1-CB 4.23Å; F1758-L1830 HydrophobicContact CD2-CD1 4.12Å; F1758-L1830 HydrophobicContact CE1-CB 4.12Å; F1758-L1830 HydrophobicContact CE1-CD1 4.38Å; F1758-L1830 HydrophobicContact CE2-CD1 3.77Å; F1758-L1830 HydrophobicContact CZ-CB 4.37Å; F1758-L1830 HydrophobicContact CZ-CD1 3.95Å; F1758-F1833 HydrophobicContact CE1-CE2 4.49Å; F1758-F1833 HydrophobicContact CZ-CD2 4.3Å; F1758-F1833 AromaticContact CZ-CE2 3.87Å; F1758-F1833 HydrophobicContact CZ-CE2 3.99Å; F1758-I2181 HydrophobicContact CD1-CD1 3.41Å; F1758-I2181 VanDerWaalsContact CD1-CD1 3.41Å; F1758-I2181 HydrophobicContact CE1-CD1 3.53Å; F1758-I2181 HydrophobicContact CG-CD1 4.06Å; F1758-I2181 HydrophobicContact CZ-CD1 4.27Å
1759	L	88.1	Confident	87.1	Confident	0.2 Å²	0.2	25.8 Å²	25.8	0%	0.001	13%	0.133	C	C	.	.	H	α-helix	trans	-61.4	-46.7	173	-69.9	-179.6	0	0	0	111.5	L1552 F1553 Y1606 Y1609 V1610 V1626 I1630 F1755 T1757 D1761 L1762 Y1763	L1552-L1759 HydrophobicContact CD2-CB 4.04Å; L1552-L1759 HydrophobicContact CD2-CD1 3.78Å; F1553-L1759 HydrophobicContact CE2-CD1 4.46Å; F1553-L1759 HydrophobicContact CZ-CD1 4.09Å; Y1606-L1759 HydrophobicContact CD1-CD2 3.8Å; Y1606-L1759 HydrophobicContact CD1-CG 4.07Å; Y1606-L1759 HydrophobicContact CE1-CG 4.44Å; Y1609-L1759 HydrophobicContact CD1-CD1 4.41Å; Y1609-L1759 HydrophobicContact CD1-CD2 3.86Å; Y1609-L1759 HydrophobicContact CE1-CD1 4.35Å; Y1609-L1759 HydrophobicContact CE1-CD2 4.39Å; V1610-L1759 HydrophobicContact CG2-CD2 3.81Å; V1626-L1759 HydrophobicContact CG1-CD1 4.12Å; V1626-L1759 HydrophobicContact CG1-CD2 4.34Å; I1630-L1759 HydrophobicContact CD1-CD1 4.06Å; I1630-L1759 HydrophobicContact CG1-CD1 4.45Å; F1755-L1759 HydrophobicContact CD2-CD1 3.73Å; F1755-L1759 HydrophobicContact CD2-CG 4.42Å; F1755-L1759 HydrophobicContact CE2-CD1 3.87Å; F1755-L1759 PolarHBondContact O-N 3.19Å; T1757-L1759 VanDerWaalsContact C-N 3.29Å; T1757-L1759 PolarHBondContact O-N 3.06Å; L1759-D1761 VanDerWaalsContact C-N 3.3Å; L1759-D1761 PolarHBondContact O-N 3.06Å; L1759-L1762 PolarHBondContact O-N 3.08Å; L1759-L1762 VanDerWaalsContact O-N 3.13Å; L1759-Y1763 HydrophobicContact CB-CD2 4.37Å; L1759-Y1763 HydrophobicContact CB-CE2 4.33Å; L1759-Y1763 WeakPolarHBondContact O-CD2 3.38Å; L1759-Y1763 PolarHBondContact O-N 2.97Å
1760	K	84.2	Confident	86.8	Confident	59.2 Å²	59.2	29.5 Å²	29.5	26%	0.257	16%	0.157	S	C	.	.	H	α-helix	trans	-56.5	-47.1	176.9	-177.4	-174.3	174.7	-176.8	0	111.8	F1549 Q1730 G1756 T1757 Y1763 T1764	F1549-K1760 HydrophobicContact CD1-CD 4.25Å; F1549-K1760 HydrophobicContact CD2-CB 4.22Å; F1549-K1760 HydrophobicContact CD2-CD 4.2Å; F1549-K1760 HydrophobicContact CD2-CG 4.07Å; F1549-K1760 HydrophobicContact CE1-CB 4.25Å; F1549-K1760 HydrophobicContact CE1-CD 4.26Å; F1549-K1760 HydrophobicContact CE1-CG 4.34Å; F1549-K1760 HydrophobicContact CE2-CB 3.78Å; F1549-K1760 VanDerWaalsContact CE2-CB 3.48Å; F1549-K1760 HydrophobicContact CE2-CD 4.02Å; F1549-K1760 VanDerWaalsContact CE2-CD 3.47Å; F1549-K1760 HydrophobicContact CE2-CG 3.65Å; F1549-K1760 HydrophobicContact CG-CD 4.34Å; F1549-K1760 HydrophobicContact CG-CG 4.4Å; F1549-K1760 HydrophobicContact CZ-CB 3.67Å; F1549-K1760 HydrophobicContact CZ-CD 4.17Å; F1549-K1760 HydrophobicContact CZ-CG 3.98Å; Q1730-K1760 VanDerWaalsContact CG-NZ 3.32Å; Q1730-K1760 PolarHBondContact O-NZ 3.17Å; G1756-K1760 WeakPolarHBondContact O-CB 3.31Å; G1756-K1760 PolarHBondContact O-N 3.13Å; T1757-K1760 WeakPolarHBondContact O-CA 3.32Å; T1757-K1760 VanDerWaalsContact O-CB 3.27Å; T1757-K1760 WeakPolarHBondContact O-CB 3.41Å; T1757-K1760 PolarHBondContact O-N 3.17Å; T1757-K1760 VanDerWaalsContact O-N 3.09Å; K1760-Y1763 PolarHBondContact O-N 3.14Å; K1760-T1764 WeakPolarHBondContact O-CB 3.31Å; K1760-T1764 PolarHBondContact O-N 3.11Å; K1760-T1764 PolarHBondContact O-OG1 3.16Å
1761	D	86	Confident	86.1	Confident	36.8 Å²	36.8	28.3 Å²	28.3	20%	0.197	16%	0.161	C	C	.	.	H	α-helix	trans	-64.9	-44.2	-179.6	-69.9	-18.2	0	0	0	110.7	T1757 F1758 L1759 T1764 I1765 V1826 L2179 S2180 I2181	T1757-D1761 VanDerWaalsContact O-CG 3.26Å; T1757-D1761 PolarHBondContact O-N 3.28Å; T1757-D1761 VanDerWaalsContact O-N 3.14Å; F1758-D1761 PolarHBondContact O-N 3.31Å; L1759-D1761 VanDerWaalsContact C-N 3.3Å; L1759-D1761 PolarHBondContact O-N 3.06Å; D1761-T1764 WeakPolarHBondContact O-CB 3.34Å; D1761-T1764 PolarHBondContact O-N 3.31Å; D1761-I1765 WeakPolarHBondContact O-CD1 3.4Å; D1761-I1765 VanDerWaalsContact O-CG1 3.26Å; D1761-I1765 WeakPolarHBondContact O-CG1 3.32Å; D1761-I1765 PolarHBondContact O-N 2.99Å; D1761-V1826 HydrophobicContact CB-CG1 4.42Å; D1761-V1826 HydrophobicContact CB-CG2 3.82Å; D1761-L2179 HydrophobicContact CB-CD2 4.37Å; D1761-S2180 VanDerWaalsContact CG-N 3.33Å; D1761-S2180 VanDerWaalsContact OD1-CB 3.28Å; D1761-S2180 WeakPolarHBondContact OD1-CB 3.41Å; D1761-S2180 PolarHBondContact OD1-N 3.16Å; D1761-S2180 PolarHBondContact OD1-OG 2.74Å; D1761-S2180 PolarHBondContact OD2-N 3.46Å; D1761-S2180 VanDerWaalsContact OD2-N 3.08Å; D1761-S2180 PolarHBondContact OD2-OG 3.14Å; D1761-S2180 VanDerWaalsContact OD2-OG 3.07Å; D1761-I2181 WeakPolarHBondContact OD2-CG1 3.14Å; D1761-I2181 PolarHBondContact OD2-N 2.73Å
1762	L	88.3	Confident	85.3	Confident	1.4 Å²	1.4	31.4 Å²	31.4	1%	0.007	18%	0.177	C	C	.	.	H	α-helix	trans	-60.5	-50.8	174.6	-72.3	173	0	0	0	112.3	V1607 V1610 F1758 L1759 T1764 I1765 F1766 I1823 V1826	V1607-L1762 HydrophobicContact CG2-CD1 4.26Å; V1607-L1762 HydrophobicContact CG2-CD2 4.16Å; V1610-L1762 HydrophobicContact CG1-CB 4.47Å; V1610-L1762 HydrophobicContact CG2-CB 3.99Å; V1610-L1762 HydrophobicContact CG2-CD1 4.34Å; F1758-L1762 WeakPolarHBondContact O-CB 3.35Å; F1758-L1762 VanDerWaalsContact O-CG 3.27Å; F1758-L1762 WeakPolarHBondContact O-CG 3.34Å; F1758-L1762 PolarHBondContact O-N 3.18Å; L1759-L1762 PolarHBondContact O-N 3.08Å; L1759-L1762 VanDerWaalsContact O-N 3.13Å; L1762-T1764 VanDerWaalsContact C-N 3.25Å; L1762-T1764 PolarHBondContact O-N 3.22Å; L1762-I1765 PolarHBondContact O-N 3.01Å; L1762-I1765 VanDerWaalsContact O-N 3.13Å; L1762-F1766 HydrophobicContact CB-CD2 4.49Å; L1762-F1766 HydrophobicContact CD2-CE2 4.47Å; L1762-F1766 WeakPolarHBondContact O-CB 3.33Å; L1762-F1766 VanDerWaalsContact O-CD2 3.29Å; L1762-F1766 WeakPolarHBondContact O-CD2 3.38Å; L1762-F1766 PolarHBondContact O-N 3.11Å; L1762-I1823 HydrophobicContact CD2-CG1 4.33Å; L1762-I1823 HydrophobicContact CD2-CG2 4.16Å; L1762-V1826 HydrophobicContact CD2-CB 4.32Å; L1762-V1826 HydrophobicContact CD2-CG1 4.28Å; L1762-V1826 HydrophobicContact CG-CG1 4.08Å
1763	Y	86.7	Confident	84.3	Confident	7.2 Å²	7.2	34.2 Å²	34.2	3%	0.028	19%	0.194	C	C	.	.	H	α-helix	trans	-56.4	-41.9	175.9	-80.4	-70.7	0	0	0	111.4	G1551 L1552 F1553 Y1609 V1610 D1613 L1614 L1759 K1760 I1765 F1766 Q1767	G1551-Y1763 WeakPolarHBondContact O-CE2 3.39Å; G1551-Y1763 PolarHBondContact O-OH 3.39Å; L1552-Y1763 HydrophobicContact CD1-CD1 4.06Å; L1552-Y1763 HydrophobicContact CD1-CD2 3.59Å; L1552-Y1763 HydrophobicContact CD1-CE1 4.26Å; L1552-Y1763 HydrophobicContact CD1-CE2 3.85Å; L1552-Y1763 HydrophobicContact CD1-CG 3.72Å; L1552-Y1763 HydrophobicContact CD2-CD2 3.59Å; L1552-Y1763 HydrophobicContact CD2-CE1 4.05Å; L1552-Y1763 HydrophobicContact CD2-CE2 3.57Å; L1552-Y1763 HydrophobicContact CG-CD2 3.5Å; L1552-Y1763 HydrophobicContact CG-CE1 4.45Å; L1552-Y1763 HydrophobicContact CG-CE2 3.36Å; L1552-Y1763 HydrophobicContact CG-CG 4.13Å; F1553-Y1763 HydrophobicContact CE2-CE2 4.47Å; Y1609-Y1763 WeakPolarHBondContact CE1-OH 3.4Å; V1610-Y1763 HydrophobicContact CB-CE1 4.45Å; V1610-Y1763 HydrophobicContact CG1-CD1 3.82Å; V1610-Y1763 HydrophobicContact CG1-CD2 4.36Å; V1610-Y1763 HydrophobicContact CG1-CE1 3.98Å; V1610-Y1763 HydrophobicContact CG1-CE2 4.47Å; V1610-Y1763 HydrophobicContact CG1-CG 4.22Å; V1610-Y1763 HydrophobicContact CG2-CD1 4.41Å; V1610-Y1763 HydrophobicContact CG2-CD2 4.21Å; V1610-Y1763 HydrophobicContact CG2-CE1 4.35Å; V1610-Y1763 HydrophobicContact CG2-CE2 4Å; V1610-Y1763 HydrophobicContact CG2-CG 4.46Å; D1613-Y1763 HydrophobicContact CB-CE1 4.47Å; D1613-Y1763 WeakPolarHBondContact CB-OH 3.48Å; D1613-Y1763 VanDerWaalsContact CG-OH 3.25Å; D1613-Y1763 VanDerWaalsContact OD2-CE1 3.25Å; D1613-Y1763 WeakPolarHBondContact OD2-CE1 3.37Å; D1613-Y1763 VanDerWaalsContact OD2-CZ 3.23Å; D1613-Y1763 PolarHBondContact OD2-OH 3.15Å; D1613-Y1763 VanDerWaalsContact OD2-OH 3.05Å; L1614-Y1763 HydrophobicContact CD2-CD1 4.12Å; L1614-Y1763 HydrophobicContact CD2-CE1 4.27Å; L1614-Y1763 HydrophobicContact CG-CD1 4.3Å; L1614-Y1763 HydrophobicContact CG-CE1 4.25Å; L1759-Y1763 HydrophobicContact CB-CD2 4.37Å; L1759-Y1763 HydrophobicContact CB-CE2 4.33Å; L1759-Y1763 WeakPolarHBondContact O-CD2 3.38Å; L1759-Y1763 PolarHBondContact O-N 2.97Å; K1760-Y1763 PolarHBondContact O-N 3.14Å; Y1763-I1765 PolarHBondContact O-N 3.39Å; Y1763-F1766 PolarHBondContact O-N 3.11Å; Y1763-Q1767 VanDerWaalsContact O-CB 3.28Å; Y1763-Q1767 WeakPolarHBondContact O-CB 3.4Å; Y1763-Q1767 VanDerWaalsContact O-CG 3.27Å; Y1763-Q1767 WeakPolarHBondContact O-CG 3.41Å; Y1763-Q1767 PolarHBondContact O-N 3.17Å
1764	T	85.8	Confident	83.1	Confident	50.6 Å²	50.6	38.3 Å²	38.3	31%	0.31	22%	0.221	S	C	.	.	H	α-helix	trans	-61.1	-48.4	177.5	-55.7	0	0	0	0	110.8	M1548 K1760 D1761 L1762 F1766 Q1767 S1768 V2177	M1548-T1764 HydrophobicContact CE-CG2 4.45Å; K1760-T1764 WeakPolarHBondContact O-CB 3.31Å; K1760-T1764 PolarHBondContact O-N 3.11Å; K1760-T1764 PolarHBondContact O-OG1 3.16Å; D1761-T1764 WeakPolarHBondContact O-CB 3.34Å; D1761-T1764 PolarHBondContact O-N 3.31Å; L1762-T1764 VanDerWaalsContact C-N 3.25Å; L1762-T1764 PolarHBondContact O-N 3.22Å; T1764-F1766 VanDerWaalsContact C-N 3.35Å; T1764-F1766 PolarHBondContact O-N 3.17Å; T1764-Q1767 PolarHBondContact O-N 3.01Å; T1764-S1768 VanDerWaalsContact O-CB 3.25Å; T1764-S1768 WeakPolarHBondContact O-CB 3.4Å; T1764-S1768 PolarHBondContact O-N 3.14Å; T1764-S1768 PolarHBondContact O-OG 3.08Å; T1764-V2177 HydrophobicContact CG2-CG1 4.19Å
1765	I	87.1	Confident	81.6	Confident	8 Å²	8	38 Å²	38	4%	0.041	22%	0.223	C	C	.	.	H	α-helix	trans	-63.8	-44.2	178	-63.3	157.4	0	0	0	111.3	V1141 D1761 L1762 Y1763 Q1767 S1768 V1769 K1819 L1822 I1823 V1826 L2179	V1141-I1765 HydrophobicContact CG1-CD1 4.22Å; D1761-I1765 WeakPolarHBondContact O-CD1 3.4Å; D1761-I1765 VanDerWaalsContact O-CG1 3.26Å; D1761-I1765 WeakPolarHBondContact O-CG1 3.32Å; D1761-I1765 PolarHBondContact O-N 2.99Å; L1762-I1765 PolarHBondContact O-N 3.01Å; L1762-I1765 VanDerWaalsContact O-N 3.13Å; Y1763-I1765 PolarHBondContact O-N 3.39Å; I1765-Q1767 VanDerWaalsContact C-N 3.31Å; I1765-Q1767 PolarHBondContact O-N 3.06Å; I1765-S1768 PolarHBondContact O-N 3.48Å; I1765-V1769 HydrophobicContact CG2-CB 4.48Å; I1765-V1769 HydrophobicContact CG2-CG2 4.33Å; I1765-V1769 WeakPolarHBondContact O-CB 3.42Å; I1765-V1769 PolarHBondContact O-N 3.16Å; I1765-V1769 VanDerWaalsContact O-N 3.08Å; I1765-K1819 HydrophobicContact CG2-CG 3.92Å; I1765-K1819 WeakPolarHBondContact O-CE 3.39Å; I1765-L1822 HydrophobicContact CD1-CB 3.87Å; I1765-L1822 HydrophobicContact CG1-CB 4.05Å; I1765-L1822 HydrophobicContact CG2-CB 4.06Å; I1765-I1823 HydrophobicContact CD1-CG1 4.42Å; I1765-I1823 HydrophobicContact CG2-CD1 4.44Å; I1765-I1823 HydrophobicContact CG2-CG1 3.87Å; I1765-V1826 HydrophobicContact CD1-CG2 3.73Å; I1765-L2179 HydrophobicContact CD1-CD1 4.06Å; I1765-L2179 HydrophobicContact CD1-CD2 3.64Å; I1765-L2179 HydrophobicContact CG1-CD2 3.38Å
1766	F	84.7	Confident	79.9	Confident	34.2 Å²	34.2	46.8 Å²	46.8	15%	0.15	27%	0.265	C	S	.	.	H	α-helix	trans	-64.5	-35	-179.2	-89.2	-77.9	0	0	0	113	A839 V1607 V1610 I1611 L1614 L1762 Y1763 T1764 K1819 I1823	A839-F1766 HydrophobicContact CB-CE1 4.37Å; A839-F1766 HydrophobicContact CB-CZ 4.12Å; V1607-F1766 HydrophobicContact CG1-CE2 4.2Å; V1607-F1766 HydrophobicContact CG1-CZ 4.02Å; V1610-F1766 HydrophobicContact CG1-CB 4.36Å; V1610-F1766 HydrophobicContact CG1-CD2 3.7Å; V1610-F1766 HydrophobicContact CG1-CE2 4.27Å; V1610-F1766 HydrophobicContact CG1-CG 4.21Å; I1611-F1766 HydrophobicContact CD1-CE1 4.15Å; I1611-F1766 HydrophobicContact CD1-CZ 3.88Å; I1611-F1766 HydrophobicContact CG1-CE1 3.78Å; I1611-F1766 HydrophobicContact CG1-CE2 4.42Å; I1611-F1766 HydrophobicContact CG1-CZ 3.81Å; L1614-F1766 HydrophobicContact CD1-CB 3.58Å; L1614-F1766 HydrophobicContact CD1-CD1 4.37Å; L1614-F1766 HydrophobicContact CD1-CG 4.03Å; L1762-F1766 HydrophobicContact CB-CD2 4.49Å; L1762-F1766 HydrophobicContact CD2-CE2 4.47Å; L1762-F1766 WeakPolarHBondContact O-CB 3.33Å; L1762-F1766 VanDerWaalsContact O-CD2 3.29Å; L1762-F1766 WeakPolarHBondContact O-CD2 3.38Å; L1762-F1766 PolarHBondContact O-N 3.11Å; Y1763-F1766 PolarHBondContact O-N 3.11Å; T1764-F1766 VanDerWaalsContact C-N 3.35Å; T1764-F1766 PolarHBondContact O-N 3.17Å; F1766-K1819 PolarHBondContact O-NZ 3.07Å; F1766-K1819 VanDerWaalsContact O-NZ 3.07Å; F1766-I1823 HydrophobicContact CD2-CD1 4.44Å; F1766-I1823 HydrophobicContact CE1-CD1 4.33Å; F1766-I1823 HydrophobicContact CE2-CD1 3.8Å; F1766-I1823 HydrophobicContact CE2-CG1 4.31Å; F1766-I1823 HydrophobicContact CZ-CD1 3.67Å
1767	Q	84.4	Confident	78.1	Confident	97.4 Å²	97.4	53.8 Å²	53.8	46%	0.455	30%	0.295	S	S	.	.	H	α-helix	trans	-88.7	-32.9	-178.7	-67.7	175.3	-0.5	0	0	114.2	M1548 L1614 Y1763 T1764 I1765	M1548-Q1767 HydrophobicContact CE-CB 4.3Å; M1548-Q1767 PolarHBondContact SD-OE1 3.46Å; L1614-Q1767 HydrophobicContact CD2-CG 4.27Å; Y1763-Q1767 VanDerWaalsContact O-CB 3.28Å; Y1763-Q1767 WeakPolarHBondContact O-CB 3.4Å; Y1763-Q1767 VanDerWaalsContact O-CG 3.27Å; Y1763-Q1767 WeakPolarHBondContact O-CG 3.41Å; Y1763-Q1767 PolarHBondContact O-N 3.17Å; T1764-Q1767 PolarHBondContact O-N 3.01Å; I1765-Q1767 VanDerWaalsContact C-N 3.31Å; I1765-Q1767 PolarHBondContact O-N 3.06Å
1768	S	83.3	Confident	76	Confident	71 Å²	71	56.6 Å²	56.6	50%	0.497	32%	0.322	S	S	.	.	H	α-helix	trans	-92.7	-27.3	-175.2	68.3	0	0	0	0	114.2	T1764 I1765 P1770 V2177	T1764-S1768 VanDerWaalsContact O-CB 3.25Å; T1764-S1768 WeakPolarHBondContact O-CB 3.4Å; T1764-S1768 PolarHBondContact O-N 3.14Å; T1764-S1768 PolarHBondContact O-OG 3.08Å; I1765-S1768 PolarHBondContact O-N 3.48Å; S1768-P1770 WeakPolarHBondContact O-CD 3.27Å; S1768-V2177 WeakPolarHBondContact OG-CG2 3.33Å
1769	V	83.2	Confident	73.8	Confident	15.2 Å²	15.2	62.7 Å²	62.7	9%	0.092	35%	0.35	C	S	.	.	S	Bend	trans	-104.3	120.3	-176.6	-171.4	0	0	0	0	109.7	I1765 S1771 N1816 K1819 L1822 V2177	I1765-V1769 HydrophobicContact CG2-CB 4.48Å; I1765-V1769 HydrophobicContact CG2-CG2 4.33Å; I1765-V1769 WeakPolarHBondContact O-CB 3.42Å; I1765-V1769 PolarHBondContact O-N 3.16Å; I1765-V1769 VanDerWaalsContact O-N 3.08Å; V1769-S1771 PolarHBondContact O-N 3.18Å; V1769-N1816 VanDerWaalsContact CG1-ND2 3.27Å; V1769-N1816 WeakPolarHBondContact CG1-ND2 3.32Å; V1769-K1819 HydrophobicContact CB-CB 4.31Å; V1769-K1819 HydrophobicContact CB-CD 4.25Å; V1769-K1819 HydrophobicContact CB-CG 4.09Å; V1769-K1819 HydrophobicContact CG1-CB 3.68Å; V1769-K1819 HydrophobicContact CG1-CD 4.28Å; V1769-K1819 HydrophobicContact CG1-CG 4.01Å; V1769-K1819 WeakPolarHBondContact O-CD 3.4Å; V1769-K1819 VanDerWaalsContact O-CE 3.29Å; V1769-K1819 WeakPolarHBondContact O-CE 3.28Å; V1769-K1819 PolarHBondContact O-NZ 2.97Å; V1769-L1822 HydrophobicContact CG2-CD1 4.14Å; V1769-V2177 HydrophobicContact CG2-CG2 3.63Å
1770	P	79.3	Confident	71.5	Confident	79.2 Å²	79.2	69.7 Å²	69.7	51%	0.514	39%	0.387	S	S	.	.			trans	-66.5	140.4	177.5	27.3	-33.6	0	0	0	110.7	S1768 L1772 N1816	S1768-P1770 WeakPolarHBondContact O-CD 3.27Å; P1770-L1772 VanDerWaalsContact C-N 3.33Å; P1770-L1772 PolarHBondContact O-N 3.15Å; P1770-N1816 VanDerWaalsContact O-CB 3.25Å; P1770-N1816 WeakPolarHBondContact O-CB 3.47Å; P1770-N1816 PolarHBondContact O-ND2 3.05Å
1771	S	75.9	Confident	69.3	Low	53 Å²	53	78.4 Å²	78.4	37%	0.371	42%	0.419	S	S	.	.	S	Bend	trans	-75.6	-22.2	-177.8	-56	0	0	0	0	113.8	V1769 N1816 K1819	V1769-S1771 PolarHBondContact O-N 3.18Å; S1771-N1816 WeakPolarHBondContact O-CB 3.34Å; S1771-N1816 PolarHBondContact O-N 3.05Å; S1771-N1816 VanDerWaalsContact O-N 3.11Å; S1771-K1819 PolarHBondContact OG-NZ 3.19Å
1772	L	76.3	Confident	66.9	Low	64.8 Å²	64.8	83.7 Å²	83.7	34%	0.339	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	139.8	-179.4	-66.2	170.3	0	0	0	110.3	P1770 I1809 F1814 L1815	P1770-L1772 VanDerWaalsContact C-N 3.33Å; P1770-L1772 PolarHBondContact O-N 3.15Å; L1772-I1809 HydrophobicContact CD1-CD1 4.44Å; L1772-F1814 CarbonylContact C-O 3.52Å; L1772-F1814 VanDerWaalsContact CA-O 3.32Å; L1772-F1814 WeakPolarHBondContact CA-O 3.26Å; L1772-L1815 HydrophobicContact CD2-CD2 4.11Å
1773	V	71.7	Confident	64.4	Low	61 Å²	61	87.2 Å²	87.2	37%	0.37	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	128.4	172	-172.9	0	0	0	0	107.9	G1775 S1813 F1814 N1816	V1773-G1775 PolarHBondContact O-N 3.05Å; V1773-S1813 CarbonylContact O-C 3.52Å; V1773-S1813 WeakPolarHBondContact O-CA 3.5Å; V1773-F1814 PolarHBondContact N-O 3.19Å; V1773-F1814 PolarHBondContact O-N 2.92Å; V1773-N1816 HydrophobicContact CG2-CB 3.93Å
1774	P	66.2	Low	61.8	Low	92.4 Å²	92.4	93.1 Å²	93.1	60%	0.6	51%	0.513	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-60.8	131	171.5	-19.3	31.3	0	0	0	110.3	E1776	P1774-E1776 PolarHBondContact O-N 3.16Å
1775	G	57.3	Low	59.3	Low	16 Å²	16	99.8 Å²	99.8	17%	0.165	54%	0.538	C	S	.	.	P	Polyproline II helix	trans	-72.7	118.1	172	0	0	0	0	0	110.4	V1773 K1777 T1812	V1773-G1775 PolarHBondContact O-N 3.05Å; G1775-K1777 PolarHBondContact O-N 3.11Å; G1775-K1777 VanDerWaalsContact O-N 3.14Å; G1775-T1812 VanDerWaalsContact CA-O 3.26Å; G1775-T1812 WeakPolarHBondContact CA-O 3.39Å; G1775-T1812 PolarHBondContact N-O 3.3Å
1776	E	53.3	Low	56.8	Low	187.2 Å²	187.2	105.6 Å²	105.6	88%	0.875	57%	0.573	S	S	*	*	P	Polyproline II helix	trans	-63.1	127.4	169.3	-68.1	-174	159	0	0	109.2	P1774 A1778	P1774-E1776 PolarHBondContact O-N 3.16Å; E1776-A1778 PolarHBondContact O-N 3.43Å; E1776-A1778 VanDerWaalsContact O-N 3.12Å
1777	K	45.8	Very low	54.2	Low	150.6 Å²	150.6	111.5 Å²	111.5	66%	0.655	60%	0.602	S	S	*	*	P	Polyproline II helix	trans	-69.4	122.9	171.5	-77.7	-173.9	163	-160.3	0	108.4	G1775 E1779	G1775-K1777 PolarHBondContact O-N 3.11Å; G1775-K1777 VanDerWaalsContact O-N 3.14Å; K1777-E1779 HydrophobicContact CB-CG 4.42Å; K1777-E1779 WeakPolarHBondContact CD-OE1 3.35Å; K1777-E1779 WeakPolarHBondContact CE-OE1 3.38Å; K1777-E1779 IonicContact NZ-OE1 2.83Å; K1777-E1779 PolarHBondContact NZ-OE1 3.07Å; K1777-E1779 IonicContact NZ-OE2 3.71Å; K1777-E1779 PolarHBondContact O-N 3.2Å
1778	A	40.2	Very low	51.6	Low	96 Å²	96	115.6 Å²	115.6	79%	0.793	62%	0.618	S	S	*	*			trans	-71.1	65.9	170.6	0	0	0	0	0	110.4	E1776 D1780	E1776-A1778 PolarHBondContact O-N 3.43Å; E1776-A1778 VanDerWaalsContact O-N 3.12Å; A1778-D1780 VanDerWaalsContact C-N 3.29Å; A1778-D1780 PolarHBondContact O-N 2.84Å
1779	E	42.5	Very low	49.2	Very low	136 Å²	136	118.7 Å²	118.7	64%	0.636	63%	0.634	S	S	*	*			trans	-101.8	107.7	173.3	-79.1	172.5	-170.5	0	0	108.9	K1777 R1781	K1777-E1779 HydrophobicContact CB-CG 4.42Å; K1777-E1779 WeakPolarHBondContact CD-OE1 3.35Å; K1777-E1779 WeakPolarHBondContact CE-OE1 3.38Å; K1777-E1779 IonicContact NZ-OE1 2.83Å; K1777-E1779 PolarHBondContact NZ-OE1 3.07Å; K1777-E1779 IonicContact NZ-OE2 3.71Å; K1777-E1779 PolarHBondContact O-N 3.2Å; E1779-R1781 PolarHBondContact O-N 3.21Å
1780	D	39.6	Very low	46.6	Very low	146.8 Å²	146.8	123.2 Å²	123.2	79%	0.785	67%	0.666	S	S	*	*			trans	30.9	91.4	167	-80.7	-21.2	0	0	0	115.9	A1778 D1782 A1783	A1778-D1780 VanDerWaalsContact C-N 3.29Å; A1778-D1780 PolarHBondContact O-N 2.84Å; D1780-D1782 VanDerWaalsContact C-N 3.27Å; D1780-D1782 PolarHBondContact O-N 3.35Å; D1780-A1783 WeakPolarHBondContact OD1-CB 3.29Å
1781	R	36.9	Very low	44.3	Very low	241.4 Å²	241.4	123.6 Å²	123.6	91%	0.911	68%	0.676	S	S	*	*			trans	-101.6	43.8	161.6	-78.2	-171	173.9	-175.6	-0.4	112.8	E1779 T1784	E1779-R1781 PolarHBondContact O-N 3.21Å; R1781-T1784 PolarHBondContact O-OG1 2.9Å
1782	D	36	Very low	42.1	Very low	148.4 Å²	148.4	126.1 Å²	126.1	79%	0.794	69%	0.693	S	S	*	*			trans	-110.7	114.2	169.1	-98.5	-39.1	0	0	0	112.8	D1780 T1784 K1785	D1780-D1782 VanDerWaalsContact C-N 3.27Å; D1780-D1782 PolarHBondContact O-N 3.35Å; D1782-T1784 PolarHBondContact O-N 3.27Å; D1782-K1785 PolarHBondContact O-N 2.79Å
1783	A	35.2	Very low	40.1	Very low	75.8 Å²	75.8	130.3 Å²	130.3	63%	0.626	72%	0.715	S	S	*	*	S	Bend	trans	48.5	83	157.4	0	0	0	0	0	117.1	D1780 K1785 V1786	D1780-A1783 WeakPolarHBondContact OD1-CB 3.29Å; A1783-K1785 PolarHBondContact O-N 3.25Å; A1783-V1786 PolarHBondContact O-N 3.42Å; A1783-V1786 VanDerWaalsContact O-N 3.13Å
1784	T	34	Very low	38.2	Very low	129.6 Å²	129.6	134.2 Å²	134.2	80%	0.795	73%	0.734	S	S	*	*			trans	69.6	109.6	135.4	50.2	0	0	0	0	119	R1781 D1782 V1786	R1781-T1784 PolarHBondContact O-OG1 2.9Å; D1782-T1784 PolarHBondContact O-N 3.27Å; T1784-V1786 PolarHBondContact O-N 2.94Å
1785	K	31.6	Very low	36.5	Very low	192.2 Å²	192.2	135.1 Å²	135.1	84%	0.836	74%	0.742	S	S	*	*			trans	39.2	98.1	147.6	-79.6	178.5	174.3	175.6	0	118.1	D1782 A1783	D1782-K1785 PolarHBondContact O-N 2.79Å; A1783-K1785 PolarHBondContact O-N 3.25Å
1786	V	34.7	Very low	35.2	Very low	128.6 Å²	128.6	139.1 Å²	139.1	78%	0.779	77%	0.767	S	S	*	*			trans	-147.4	118	145.5	179.4	0	0	0	0	112.5	A1783 T1784 K1788 T1789	A1783-V1786 PolarHBondContact O-N 3.42Å; A1783-V1786 VanDerWaalsContact O-N 3.13Å; T1784-V1786 PolarHBondContact O-N 2.94Å; V1786-K1788 PolarHBondContact O-N 3.36Å; V1786-T1789 PolarHBondContact O-N 3.24Å
1787	E	30.6	Very low	34.3	Very low	159.6 Å²	159.6	138.1 Å²	138.1	75%	0.746	77%	0.767	S	S	*	*			trans	-86.2	134.1	171.9	-117.5	173.7	157.4	0	0	114.4	T1789	E1787-T1789 PolarHBondContact O-N 3.19Å
1788	K	30.4	Very low	33.7	Very low	182.8 Å²	182.8	135.9 Å²	135.9	80%	0.795	77%	0.769	S	S	*	*			trans	-28.1	102.4	162.9	-66.1	170.7	-179.5	165.6	0	115.4	V1786	V1786-K1788 PolarHBondContact O-N 3.36Å
1789	T	32.5	Very low	33.4	Very low	135.8 Å²	135.8	137.9 Å²	137.9	83%	0.833	77%	0.766	S	S	*	*			trans	-135.6	106.1	136.4	45.1	0	0	0	0	111.2	V1786 E1787 A1791	V1786-T1789 PolarHBondContact O-N 3.24Å; E1787-T1789 PolarHBondContact O-N 3.19Å; T1789-A1791 PolarHBondContact O-N 3.22Å
1790	S	28.8	Very low	32.9	Very low	109 Å²	109	139 Å²	139	76%	0.762	77%	0.771	S	S	*	*			trans	-104.9	110.5	171.7	50.6	0	0	0	0	111.5
1791	A	29.9	Very low	32.8	Very low	88.4 Å²	88.4	137.3 Å²	137.3	73%	0.731	77%	0.77	S	S	*	*			trans	-133.3	97.9	167.3	0	0	0	0	0	111.8	T1789 I1793	T1789-A1791 PolarHBondContact O-N 3.22Å; A1791-I1793 PolarHBondContact O-N 2.68Å
1792	S	29.7	Very low	32.8	Very low	105.6 Å²	105.6	130.9 Å²	130.9	74%	0.738	76%	0.762	S	S	*	*			trans	92.9	140	131.2	54.9	0	0	0	0	114.2
1793	I	35.1	Very low	32.8	Very low	152.8 Å²	152.8	127.4 Å²	127.4	78%	0.784	75%	0.75	S	S	*	*			trans	107.3	113.7	150.7	-62.3	165.6	0	0	0	111.7	A1791	A1791-I1793 PolarHBondContact O-N 2.68Å
1794	D	32.2	Very low	32.8	Very low	143.4 Å²	143.4	132 Å²	132	77%	0.767	76%	0.756	S	S	*	*				59.6	132.6	114.9	-94.7	-17.2	0	0	0	116.7	S1796	D1794-S1796 PolarHBondContact O-N 3.14Å
1795	S	30	Very low	32.9	Very low	110.2 Å²	110.2	134.4 Å²	134.4	77%	0.771	76%	0.755	S	S	*	*			trans	-88.1	118.9	171.3	50	0	0	0	0	112.3
1796	S	30.3	Very low	33.3	Very low	100.6 Å²	100.6	130.2 Å²	130.2	70%	0.703	75%	0.751	S	S	*	*			trans	175.7	116.2	150.8	57.1	0	0	0	0	114.8	D1794	D1794-S1796 PolarHBondContact O-N 3.14Å
1797	L	34.3	Very low	33.7	Very low	165.8 Å²	165.8	131.7 Å²	131.7	87%	0.868	75%	0.749	S	S	*	*			trans	155.6	137.2	150.5	-92.5	147.2	0	0	0	113.2
1798	P	34.4	Very low	34.1	Very low	106 Å²	106	131.6 Å²	131.6	69%	0.688	75%	0.748	S	S	*	*			trans	-111.7	148.3	-152.9	36.6	-25.9	0	0	0	114.9	H1800	P1798-H1800 PolarHBondContact O-N 2.99Å
1799	D	32.3	Very low	34.8	Very low	137 Å²	137	127.9 Å²	127.9	73%	0.733	74%	0.736	S	S	*	*			trans	-68.5	94	161.7	-100.4	-31.7	0	0	0	115.8
1800	H	33.4	Very low	35.3	Very low	160 Å²	160	123.4 Å²	123.4	74%	0.741	72%	0.717	S	S	*	*			trans	-119.2	51.7	169.1	-73.4	-65.6	0	0	0	112.8	P1798 S1802 S1803	P1798-H1800 PolarHBondContact O-N 2.99Å; H1800-S1802 PolarHBondContact O-N 3.15Å; H1800-S1802 VanDerWaalsContact O-N 3.13Å; H1800-S1803 PolarHBondContact O-N 3.17Å
1801	S	37.2	Very low	36.2	Very low	109.4 Å²	109.4	124.6 Å²	124.6	77%	0.765	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.4	8.8	174.2	57.3	0	0	0	0	114.9
1802	S	36.2	Very low	37.3	Very low	107.6 Å²	107.6	124.4 Å²	124.4	75%	0.752	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.6	-10.3	178.8	59.2	0	0	0	0	115.7	H1800 F1804	H1800-S1802 PolarHBondContact O-N 3.15Å; H1800-S1802 VanDerWaalsContact O-N 3.13Å; S1802-F1804 VanDerWaalsContact C-N 3.27Å; S1802-F1804 PolarHBondContact O-N 3.21Å
1803	S	35.4	Very low	38.6	Very low	75.4 Å²	75.4	121.1 Å²	121.1	53%	0.527	69%	0.686	S	S	.	*	T	Hydrogen-bonded Turn	trans	-92.8	-9.1	-173.6	-157.9	0	0	0	0	115.7	H1800 F1805 S1806	H1800-S1803 PolarHBondContact O-N 3.17Å; S1803-F1805 VanDerWaalsContact C-N 3.25Å; S1803-F1805 PolarHBondContact O-N 2.96Å; S1803-S1806 PolarHBondContact O-N 3.4Å
1804	F	35.2	Very low	40.5	Very low	172.4 Å²	172.4	119.9 Å²	119.9	76%	0.756	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.7	-5.8	-173.6	-83.7	-76.1	0	0	0	115.4	S1802	S1802-F1804 VanDerWaalsContact C-N 3.27Å; S1802-F1804 PolarHBondContact O-N 3.21Å
1805	F	36.3	Very low	42.7	Very low	178.8 Å²	178.8	118 Å²	118	78%	0.784	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.4	-17.3	-179.5	-117.9	-90.2	0	0	0	114.6	S1803 I1809	S1803-F1805 VanDerWaalsContact C-N 3.25Å; S1803-F1805 PolarHBondContact O-N 2.96Å; F1805-I1809 HydrophobicContact CD1-CD1 3.78Å; F1805-I1809 HydrophobicContact CE1-CD1 4.02Å; F1805-I1809 WeakPolarHBondContact O-CD1 3.45Å
1806	S	41.6	Very low	45.2	Very low	105.4 Å²	105.4	113.6 Å²	113.6	74%	0.737	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.2	-22.8	-173	-76.9	0	0	0	0	114.9	S1803	S1803-S1806 PolarHBondContact O-N 3.4Å
1807	E	42.6	Very low	47.8	Very low	159.6 Å²	159.6	112.1 Å²	112.1	75%	0.746	62%	0.622	S	S	*	*	S	Bend	trans	-104.4	-5.4	-172.5	-69	-172	148.9	0	0	115.2
1808	H	39.6	Very low	50.2	Low	158.4 Å²	158.4	108.9 Å²	108.9	73%	0.733	60%	0.602	S	S	*	*			trans	-122.1	15.7	-177.8	-78.6	7	0	0	0	115.6	G1810	H1808-G1810 PolarHBondContact O-N 3.05Å; H1808-G1810 VanDerWaalsContact O-N 3.14Å
1809	I	43.4	Very low	52.7	Low	103.8 Å²	103.8	104.4 Å²	104.4	53%	0.532	57%	0.572	S	S	.	*	S	Bend	trans	-81	59.2	153.5	-58.2	173.7	0	0	0	107.4	L1772 F1805 V1811 S1813	L1772-I1809 HydrophobicContact CD1-CD1 4.44Å; F1805-I1809 HydrophobicContact CD1-CD1 3.78Å; F1805-I1809 HydrophobicContact CE1-CD1 4.02Å; F1805-I1809 WeakPolarHBondContact O-CD1 3.45Å; I1809-V1811 HydrophobicContact CG2-CB 4.29Å; I1809-V1811 HydrophobicContact CG2-CG2 3.82Å; I1809-V1811 PolarHBondContact O-N 3.22Å; I1809-S1813 PolarHBondContact O-OG 2.89Å
1810	G	42.9	Very low	55.3	Low	42.2 Å²	42.2	101.7 Å²	101.7	44%	0.435	56%	0.556	S	S	.	*			trans	-62.5	113.1	-176.9	0	0	0	0	0	111.3	H1808 T1812 S1813	H1808-G1810 PolarHBondContact O-N 3.05Å; H1808-G1810 VanDerWaalsContact O-N 3.14Å; G1810-T1812 PolarHBondContact O-N 3.28Å; G1810-S1813 PolarHBondContact O-N 3.15Å; G1810-S1813 VanDerWaalsContact O-N 3.08Å; G1810-S1813 PolarHBondContact O-OG 3.22Å
1811	V	49.1	Very low	58	Low	133.2 Å²	133.2	99.6 Å²	99.6	81%	0.807	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	11.7	-174.2	-173.2	0	0	0	0	113.6	I1809 S1813	I1809-V1811 HydrophobicContact CG2-CB 4.29Å; I1809-V1811 HydrophobicContact CG2-CG2 3.82Å; I1809-V1811 PolarHBondContact O-N 3.22Å; V1811-S1813 PolarHBondContact O-N 3.48Å
1812	T	52.4	Low	60.5	Low	84.8 Å²	84.8	96.2 Å²	96.2	52%	0.52	52%	0.52	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.3	17.5	-176	58.6	0	0	0	0	114.7	G1775 G1810 F1814	G1775-T1812 VanDerWaalsContact CA-O 3.26Å; G1775-T1812 WeakPolarHBondContact CA-O 3.39Å; G1775-T1812 PolarHBondContact N-O 3.3Å; G1810-T1812 PolarHBondContact O-N 3.28Å; T1812-F1814 VanDerWaalsContact O-CD2 3.28Å; T1812-F1814 WeakPolarHBondContact O-CD2 3.33Å; T1812-F1814 WeakPolarHBondContact O-CE2 3.4Å; T1812-F1814 PolarHBondContact O-N 3.15Å
1813	S	58.1	Low	63.1	Low	35.8 Å²	35.8	92.1 Å²	92.1	25%	0.25	49%	0.489	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	125.8	176.3	-19.3	0	0	0	0	111.7	V1773 I1809 G1810 V1811	V1773-S1813 CarbonylContact O-C 3.52Å; V1773-S1813 WeakPolarHBondContact O-CA 3.5Å; I1809-S1813 PolarHBondContact O-OG 2.89Å; G1810-S1813 PolarHBondContact O-N 3.15Å; G1810-S1813 VanDerWaalsContact O-N 3.08Å; G1810-S1813 PolarHBondContact O-OG 3.22Å; V1811-S1813 PolarHBondContact O-N 3.48Å
1814	F	74.5	Confident	65.7	Low	128.6 Å²	128.6	92.8 Å²	92.8	56%	0.564	49%	0.485	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.9	148.9	177.1	-63.2	-77.6	0	0	0	111.3	L1772 V1773 T1812 N1816	L1772-F1814 CarbonylContact C-O 3.52Å; L1772-F1814 VanDerWaalsContact CA-O 3.32Å; L1772-F1814 WeakPolarHBondContact CA-O 3.26Å; V1773-F1814 PolarHBondContact N-O 3.19Å; V1773-F1814 PolarHBondContact O-N 2.92Å; T1812-F1814 VanDerWaalsContact O-CD2 3.28Å; T1812-F1814 WeakPolarHBondContact O-CD2 3.33Å; T1812-F1814 WeakPolarHBondContact O-CE2 3.4Å; T1812-F1814 PolarHBondContact O-N 3.15Å; F1814-N1816 PolarHBondContact O-N 2.75Å
1815	L	77.5	Confident	68.4	Low	103.4 Å²	103.4	86.8 Å²	86.8	54%	0.541	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	135.9	169.4	-86.1	160.3	0	0	0	109.8	L1772 S1817 I1820	L1772-L1815 HydrophobicContact CD2-CD2 4.11Å; L1815-S1817 PolarHBondContact O-N 3.29Å; L1815-S1817 VanDerWaalsContact O-N 3.12Å; L1815-I1820 HydrophobicContact CB-CD1 4.33Å; L1815-I1820 HydrophobicContact CD2-CD1 3.17Å; L1815-I1820 HydrophobicContact CD2-CG1 3.64Å
1816	N	82.8	Confident	70.9	Confident	16.6 Å²	16.6	78.7 Å²	78.7	9%	0.089	43%	0.427	C	S	.	.			trans	-71.7	99.4	179.7	-171.4	-17.7	0	0	0	110.8	V1769 P1770 S1771 V1773 F1814 Q1818 K1819 I1820	V1769-N1816 VanDerWaalsContact CG1-ND2 3.27Å; V1769-N1816 WeakPolarHBondContact CG1-ND2 3.32Å; P1770-N1816 VanDerWaalsContact O-CB 3.25Å; P1770-N1816 WeakPolarHBondContact O-CB 3.47Å; P1770-N1816 PolarHBondContact O-ND2 3.05Å; S1771-N1816 WeakPolarHBondContact O-CB 3.34Å; S1771-N1816 PolarHBondContact O-N 3.05Å; S1771-N1816 VanDerWaalsContact O-N 3.11Å; V1773-N1816 HydrophobicContact CG2-CB 3.93Å; F1814-N1816 PolarHBondContact O-N 2.75Å; N1816-Q1818 VanDerWaalsContact C-N 3.28Å; N1816-Q1818 PolarHBondContact O-N 3.16Å; N1816-Q1818 VanDerWaalsContact OD1-CB 3.28Å; N1816-Q1818 WeakPolarHBondContact OD1-CB 3.36Å; N1816-Q1818 PolarHBondContact OD1-N 3.12Å; N1816-Q1818 VanDerWaalsContact OD1-N 3.11Å; N1816-K1819 HydrophobicContact CB-CB 4.08Å; N1816-K1819 WeakPolarHBondContact O-CB 3.36Å; N1816-K1819 PolarHBondContact O-N 3.25Å; N1816-K1819 VanDerWaalsContact O-N 3.14Å; N1816-K1819 PolarHBondContact OD1-N 3.01Å; N1816-I1820 PolarHBondContact O-N 3.16Å
1817	S	84.3	Confident	73.4	Confident	69 Å²	69	74.4 Å²	74.4	48%	0.483	40%	0.396	S	S	.	.	H	α-helix	trans	-57.1	-38	179.3	62.6	0	0	0	0	112.3	L1815 K1819 I1820 E1821	L1815-S1817 PolarHBondContact O-N 3.29Å; L1815-S1817 VanDerWaalsContact O-N 3.12Å; S1817-K1819 VanDerWaalsContact C-N 3.29Å; S1817-K1819 PolarHBondContact O-N 3.1Å; S1817-I1820 CarbonylContact O-C 3.57Å; S1817-I1820 WeakPolarHBondContact O-CA 3.42Å; S1817-I1820 WeakPolarHBondContact O-CB 3.32Å; S1817-I1820 PolarHBondContact O-N 3.08Å; S1817-I1820 VanDerWaalsContact O-N 3.09Å; S1817-E1821 WeakPolarHBondContact O-CG 3.37Å; S1817-E1821 PolarHBondContact O-N 3.31Å; S1817-E1821 PolarHBondContact OG-OE1 2.99Å
1818	Q	85.4	Confident	75.7	Confident	99 Å²	99	70.3 Å²	70.3	46%	0.463	38%	0.379	S	S	.	.	H	α-helix	trans	-61.1	-36.8	177.7	-157.8	-176.9	18.2	0	0	111.9	N1816 I1820 E1821 L1822 S2175	N1816-Q1818 VanDerWaalsContact C-N 3.28Å; N1816-Q1818 PolarHBondContact O-N 3.16Å; N1816-Q1818 VanDerWaalsContact OD1-CB 3.28Å; N1816-Q1818 WeakPolarHBondContact OD1-CB 3.36Å; N1816-Q1818 PolarHBondContact OD1-N 3.12Å; N1816-Q1818 VanDerWaalsContact OD1-N 3.11Å; Q1818-I1820 VanDerWaalsContact C-N 3.33Å; Q1818-I1820 PolarHBondContact O-N 3.04Å; Q1818-E1821 PolarHBondContact O-N 3.19Å; Q1818-L1822 HydrophobicContact CG-CD1 4.36Å; Q1818-L1822 WeakPolarHBondContact O-CB 3.23Å; Q1818-L1822 WeakPolarHBondContact O-CD1 3.37Å; Q1818-L1822 VanDerWaalsContact O-CG 3.29Å; Q1818-L1822 WeakPolarHBondContact O-CG 3.31Å; Q1818-L1822 PolarHBondContact O-N 2.87Å; Q1818-S2175 VanDerWaalsContact NE2-CB 3.3Å; Q1818-S2175 PolarHBondContact NE2-OG 3.29Å
1819	K	87.3	Confident	78.1	Confident	12.6 Å²	12.6	64.6 Å²	64.6	6%	0.055	35%	0.354	C	S	.	.	H	α-helix	trans	-64.3	-42.2	175.1	-166.6	172.3	-173.5	162.3	0	111.1	I1765 F1766 V1769 S1771 N1816 S1817 L1822 I1823	I1765-K1819 HydrophobicContact CG2-CG 3.92Å; I1765-K1819 WeakPolarHBondContact O-CE 3.39Å; F1766-K1819 PolarHBondContact O-NZ 3.07Å; F1766-K1819 VanDerWaalsContact O-NZ 3.07Å; V1769-K1819 HydrophobicContact CB-CB 4.31Å; V1769-K1819 HydrophobicContact CB-CD 4.25Å; V1769-K1819 HydrophobicContact CB-CG 4.09Å; V1769-K1819 HydrophobicContact CG1-CB 3.68Å; V1769-K1819 HydrophobicContact CG1-CD 4.28Å; V1769-K1819 HydrophobicContact CG1-CG 4.01Å; V1769-K1819 WeakPolarHBondContact O-CD 3.4Å; V1769-K1819 VanDerWaalsContact O-CE 3.29Å; V1769-K1819 WeakPolarHBondContact O-CE 3.28Å; V1769-K1819 PolarHBondContact O-NZ 2.97Å; S1771-K1819 PolarHBondContact OG-NZ 3.19Å; N1816-K1819 HydrophobicContact CB-CB 4.08Å; N1816-K1819 WeakPolarHBondContact O-CB 3.36Å; N1816-K1819 PolarHBondContact O-N 3.25Å; N1816-K1819 VanDerWaalsContact O-N 3.14Å; N1816-K1819 PolarHBondContact OD1-N 3.01Å; S1817-K1819 VanDerWaalsContact C-N 3.29Å; S1817-K1819 PolarHBondContact O-N 3.1Å; K1819-L1822 PolarHBondContact O-N 3Å; K1819-I1823 HydrophobicContact CG-CD1 4.13Å; K1819-I1823 WeakPolarHBondContact O-CB 3.16Å; K1819-I1823 WeakPolarHBondContact O-CD1 3.28Å; K1819-I1823 VanDerWaalsContact O-CG1 3.29Å; K1819-I1823 WeakPolarHBondContact O-CG1 3.29Å; K1819-I1823 PolarHBondContact O-N 3.1Å
1820	I	87.3	Confident	80.3	Confident	78.8 Å²	78.8	59.8 Å²	59.8	40%	0.404	33%	0.329	S	S	.	.	H	α-helix	trans	-65.6	-46	178.7	-59.7	171.2	0	0	0	110.2	L1815 N1816 S1817 Q1818 L1822 I1823 Q1824	L1815-I1820 HydrophobicContact CB-CD1 4.33Å; L1815-I1820 HydrophobicContact CD2-CD1 3.17Å; L1815-I1820 HydrophobicContact CD2-CG1 3.64Å; N1816-I1820 PolarHBondContact O-N 3.16Å; S1817-I1820 CarbonylContact O-C 3.57Å; S1817-I1820 WeakPolarHBondContact O-CA 3.42Å; S1817-I1820 WeakPolarHBondContact O-CB 3.32Å; S1817-I1820 PolarHBondContact O-N 3.08Å; S1817-I1820 VanDerWaalsContact O-N 3.09Å; Q1818-I1820 VanDerWaalsContact C-N 3.33Å; Q1818-I1820 PolarHBondContact O-N 3.04Å; I1820-L1822 VanDerWaalsContact C-N 3.33Å; I1820-L1822 PolarHBondContact O-N 3.14Å; I1820-I1823 PolarHBondContact O-N 3.15Å; I1820-Q1824 HydrophobicContact CG2-CG 4.33Å; I1820-Q1824 VanDerWaalsContact O-CB 3.3Å; I1820-Q1824 WeakPolarHBondContact O-CB 3.37Å; I1820-Q1824 VanDerWaalsContact O-CG 3.3Å; I1820-Q1824 WeakPolarHBondContact O-CG 3.33Å; I1820-Q1824 PolarHBondContact O-N 3Å
1821	E	88.8	Confident	82.7	Confident	116 Å²	116	60.8 Å²	60.8	54%	0.542	32%	0.323	S	S	.	.	H	α-helix	trans	-60.5	-40.3	177.5	-71.8	168.4	-158.2	0	0	112.5	S1817 Q1818 Q1824 T1825	S1817-E1821 WeakPolarHBondContact O-CG 3.37Å; S1817-E1821 PolarHBondContact O-N 3.31Å; S1817-E1821 PolarHBondContact OG-OE1 2.99Å; Q1818-E1821 PolarHBondContact O-N 3.19Å; E1821-Q1824 PolarHBondContact O-N 3.17Å; E1821-T1825 WeakPolarHBondContact O-CB 3.3Å; E1821-T1825 PolarHBondContact O-N 3.18Å; E1821-T1825 PolarHBondContact O-OG1 3.19Å
1822	L	89.7	Confident	84.6	Confident	39.2 Å²	39.2	56.8 Å²	56.8	21%	0.205	30%	0.299	C	S	.	.	H	α-helix	trans	-68.6	-42.3	176.1	-70.5	172.2	0	0	0	112.1	I1765 V1769 Q1818 K1819 I1820 Q1824 T1825 V1826 V2177 L2179	I1765-L1822 HydrophobicContact CD1-CB 3.87Å; I1765-L1822 HydrophobicContact CG1-CB 4.05Å; I1765-L1822 HydrophobicContact CG2-CB 4.06Å; V1769-L1822 HydrophobicContact CG2-CD1 4.14Å; Q1818-L1822 HydrophobicContact CG-CD1 4.36Å; Q1818-L1822 WeakPolarHBondContact O-CB 3.23Å; Q1818-L1822 WeakPolarHBondContact O-CD1 3.37Å; Q1818-L1822 VanDerWaalsContact O-CG 3.29Å; Q1818-L1822 WeakPolarHBondContact O-CG 3.31Å; Q1818-L1822 PolarHBondContact O-N 2.87Å; K1819-L1822 PolarHBondContact O-N 3Å; I1820-L1822 VanDerWaalsContact C-N 3.33Å; I1820-L1822 PolarHBondContact O-N 3.14Å; L1822-Q1824 VanDerWaalsContact C-N 3.33Å; L1822-Q1824 PolarHBondContact O-N 3.29Å; L1822-T1825 WeakPolarHBondContact O-CB 3.42Å; L1822-T1825 PolarHBondContact O-N 3.14Å; L1822-V1826 PolarHBondContact O-N 3.12Å; L1822-V1826 VanDerWaalsContact O-N 3.15Å; L1822-V2177 HydrophobicContact CD1-CB 4.31Å; L1822-V2177 HydrophobicContact CD1-CG1 4.5Å; L1822-L2179 HydrophobicContact CB-CD1 4.3Å; L1822-L2179 HydrophobicContact CD2-CD1 3.75Å; L1822-L2179 HydrophobicContact CD2-CG 4.36Å
1823	I	90.5	Very high	86.5	Confident	20.2 Å²	20.2	53.2 Å²	53.2	10%	0.104	28%	0.276	C	S	.	.	H	α-helix	trans	-61.9	-45.5	174.1	-69.7	167	0	0	0	109.9	V1607 L1762 I1765 F1766 K1819 I1820 T1825 V1826 L1827	V1607-I1823 HydrophobicContact CG2-CG2 3.91Å; L1762-I1823 HydrophobicContact CD2-CG1 4.33Å; L1762-I1823 HydrophobicContact CD2-CG2 4.16Å; I1765-I1823 HydrophobicContact CD1-CG1 4.42Å; I1765-I1823 HydrophobicContact CG2-CD1 4.44Å; I1765-I1823 HydrophobicContact CG2-CG1 3.87Å; F1766-I1823 HydrophobicContact CD2-CD1 4.44Å; F1766-I1823 HydrophobicContact CE1-CD1 4.33Å; F1766-I1823 HydrophobicContact CE2-CD1 3.8Å; F1766-I1823 HydrophobicContact CE2-CG1 4.31Å; F1766-I1823 HydrophobicContact CZ-CD1 3.67Å; K1819-I1823 HydrophobicContact CG-CD1 4.13Å; K1819-I1823 WeakPolarHBondContact O-CB 3.16Å; K1819-I1823 WeakPolarHBondContact O-CD1 3.28Å; K1819-I1823 VanDerWaalsContact O-CG1 3.29Å; K1819-I1823 WeakPolarHBondContact O-CG1 3.29Å; K1819-I1823 PolarHBondContact O-N 3.1Å; I1820-I1823 PolarHBondContact O-N 3.15Å; I1823-T1825 VanDerWaalsContact C-N 3.31Å; I1823-T1825 PolarHBondContact O-N 2.89Å; I1823-V1826 PolarHBondContact O-N 3.27Å; I1823-V1826 VanDerWaalsContact O-N 3.16Å; I1823-L1827 HydrophobicContact CG2-CD1 4.04Å; I1823-L1827 HydrophobicContact CG2-CG 4.37Å; I1823-L1827 WeakPolarHBondContact O-CG 3.37Å; I1823-L1827 PolarHBondContact O-N 3.37Å; I1823-L1827 VanDerWaalsContact O-N 3.08Å
1824	Q	90.7	Very high	88.1	Confident	91.4 Å²	91.4	52.5 Å²	52.5	43%	0.427	27%	0.268	S	S	.	.	H	α-helix	trans	-59.5	-41.3	176.8	-141.4	122.8	13.7	0	0	111.5	I1820 E1821 L1822 V1826 L1827 D1828	I1820-Q1824 HydrophobicContact CG2-CG 4.33Å; I1820-Q1824 VanDerWaalsContact O-CB 3.3Å; I1820-Q1824 WeakPolarHBondContact O-CB 3.37Å; I1820-Q1824 VanDerWaalsContact O-CG 3.3Å; I1820-Q1824 WeakPolarHBondContact O-CG 3.33Å; I1820-Q1824 PolarHBondContact O-N 3Å; E1821-Q1824 PolarHBondContact O-N 3.17Å; L1822-Q1824 VanDerWaalsContact C-N 3.33Å; L1822-Q1824 PolarHBondContact O-N 3.29Å; Q1824-V1826 VanDerWaalsContact C-N 3.3Å; Q1824-V1826 PolarHBondContact O-N 3.09Å; Q1824-V1826 VanDerWaalsContact O-N 3.16Å; Q1824-L1827 CarbonylContact O-C 3.54Å; Q1824-L1827 PolarHBondContact O-N 3.05Å; Q1824-L1827 VanDerWaalsContact O-N 3.09Å; Q1824-D1828 WeakPolarHBondContact CG-OD2 3.3Å; Q1824-D1828 PolarHBondContact NE2-OD1 3.46Å; Q1824-D1828 PolarHBondContact NE2-OD2 2.89Å; Q1824-D1828 VanDerWaalsContact O-CB 3.3Å; Q1824-D1828 WeakPolarHBondContact O-CB 3.42Å; Q1824-D1828 VanDerWaalsContact O-CG 3.27Å; Q1824-D1828 PolarHBondContact O-N 3.13Å
1825	T	91	Very high	88.8	Confident	46.6 Å²	46.6	49 Å²	49	29%	0.286	26%	0.26	S	S	.	.	H	α-helix	trans	-57.6	-40.7	175.7	-58	0	0	0	0	112.1	E1821 L1822 I1823 N1829 R2182	E1821-T1825 WeakPolarHBondContact O-CB 3.3Å; E1821-T1825 PolarHBondContact O-N 3.18Å; E1821-T1825 PolarHBondContact O-OG1 3.19Å; L1822-T1825 WeakPolarHBondContact O-CB 3.42Å; L1822-T1825 PolarHBondContact O-N 3.14Å; I1823-T1825 VanDerWaalsContact C-N 3.31Å; I1823-T1825 PolarHBondContact O-N 2.89Å; T1825-N1829 WeakPolarHBondContact O-CB 3.32Å; T1825-N1829 VanDerWaalsContact O-CG 3.23Å; T1825-N1829 PolarHBondContact O-N 3.19Å; T1825-N1829 VanDerWaalsContact O-N 3.12Å; T1825-N1829 PolarHBondContact O-ND2 3.3Å; T1825-N1829 VanDerWaalsContact O-ND2 3.1Å; T1825-N1829 PolarHBondContact O-OD1 2.97Å; T1825-R2182 WeakPolarHBondContact CG2-O 3.26Å
1826	V	90.5	Very high	89.4	Confident	7.4 Å²	7.4	45.2 Å²	45.2	5%	0.045	24%	0.24	C	C	.	.	H	α-helix	trans	-69.7	-40.4	177	-179.1	0	0	0	0	111.3	F1758 D1761 L1762 I1765 L1822 I1823 Q1824 N1829 L1830 L2179	F1758-V1826 HydrophobicContact CB-CG1 4.04Å; F1758-V1826 HydrophobicContact CD1-CG1 4.09Å; D1761-V1826 HydrophobicContact CB-CG1 4.42Å; D1761-V1826 HydrophobicContact CB-CG2 3.82Å; L1762-V1826 HydrophobicContact CD2-CB 4.32Å; L1762-V1826 HydrophobicContact CD2-CG1 4.28Å; L1762-V1826 HydrophobicContact CG-CG1 4.08Å; I1765-V1826 HydrophobicContact CD1-CG2 3.73Å; L1822-V1826 PolarHBondContact O-N 3.12Å; L1822-V1826 VanDerWaalsContact O-N 3.15Å; I1823-V1826 PolarHBondContact O-N 3.27Å; I1823-V1826 VanDerWaalsContact O-N 3.16Å; Q1824-V1826 VanDerWaalsContact C-N 3.3Å; Q1824-V1826 PolarHBondContact O-N 3.09Å; Q1824-V1826 VanDerWaalsContact O-N 3.16Å; V1826-N1829 PolarHBondContact O-N 3.15Å; V1826-L1830 PolarHBondContact O-N 3.05Å; V1826-L1830 VanDerWaalsContact O-N 3.13Å; V1826-L2179 HydrophobicContact CG2-CD1 4.21Å
1827	L	92.3	Very high	89.6	Confident	16.8 Å²	16.8	45.2 Å²	45.2	9%	0.088	24%	0.241	C	C	.	.	H	α-helix	trans	-66.2	-43.5	177	-68.1	178	0	0	0	112.3	P1603 M1604 V1607 I1823 Q1824 N1829 L1830 E1831	P1603-L1827 VanDerWaalsContact C-CD2 3.5Å; P1603-L1827 HydrophobicContact CB-CD2 3.82Å; P1603-L1827 VanDerWaalsContact O-CD2 3.24Å; P1603-L1827 WeakPolarHBondContact O-CD2 3.3Å; M1604-L1827 HydrophobicContact CE-CD1 4.31Å; M1604-L1827 HydrophobicContact SD-CD1 3.88Å; M1604-L1827 VanDerWaalsContact SD-CD1 3.57Å; V1607-L1827 HydrophobicContact CG2-CD1 4.18Å; V1607-L1827 HydrophobicContact CG2-CD2 3.99Å; V1607-L1827 HydrophobicContact CG2-CG 4.34Å; I1823-L1827 HydrophobicContact CG2-CD1 4.04Å; I1823-L1827 HydrophobicContact CG2-CG 4.37Å; I1823-L1827 WeakPolarHBondContact O-CG 3.37Å; I1823-L1827 PolarHBondContact O-N 3.37Å; I1823-L1827 VanDerWaalsContact O-N 3.08Å; Q1824-L1827 CarbonylContact O-C 3.54Å; Q1824-L1827 PolarHBondContact O-N 3.05Å; Q1824-L1827 VanDerWaalsContact O-N 3.09Å; L1827-N1829 VanDerWaalsContact C-N 3.31Å; L1827-N1829 PolarHBondContact O-N 3.22Å; L1827-L1830 CarbonylContact O-C 3.52Å; L1827-L1830 WeakPolarHBondContact O-CB 3.37Å; L1827-L1830 PolarHBondContact O-N 3.08Å; L1827-L1830 VanDerWaalsContact O-N 3.12Å; L1827-E1831 VanDerWaalsContact O-CB 3.24Å; L1827-E1831 WeakPolarHBondContact O-CB 3.38Å; L1827-E1831 PolarHBondContact O-N 3.08Å
1828	D	91.7	Very high	89.8	Confident	72.8 Å²	72.8	48 Å²	48	39%	0.389	24%	0.241	S	C	.	.	H	α-helix	trans	-60.6	-43.3	176.7	-71.9	-12.7	0	0	0	110.7	Q1824 L1830 E1831 T1832 R2186	Q1824-D1828 WeakPolarHBondContact CG-OD2 3.3Å; Q1824-D1828 PolarHBondContact NE2-OD1 3.46Å; Q1824-D1828 PolarHBondContact NE2-OD2 2.89Å; Q1824-D1828 VanDerWaalsContact O-CB 3.3Å; Q1824-D1828 WeakPolarHBondContact O-CB 3.42Å; Q1824-D1828 VanDerWaalsContact O-CG 3.27Å; Q1824-D1828 PolarHBondContact O-N 3.13Å; D1828-L1830 VanDerWaalsContact C-N 3.31Å; D1828-L1830 PolarHBondContact O-N 3.07Å; D1828-E1831 WeakPolarHBondContact O-CB 3.41Å; D1828-E1831 PolarHBondContact O-N 3.17Å; D1828-E1831 VanDerWaalsContact O-N 3.17Å; D1828-T1832 VanDerWaalsContact O-CG2 3.31Å; D1828-T1832 WeakPolarHBondContact O-CG2 3.22Å; D1828-T1832 PolarHBondContact O-N 3.12Å; D1828-R2186 IonicContact OD2-CZ 3.77Å; D1828-R2186 IonicContact OD2-NH1 3.53Å; D1828-R2186 IonicContact OD2-NH2 3.28Å; D1828-R2186 PolarHBondContact OD2-NH2 2.87Å
1829	N	89.5	Confident	89.8	Confident	37.8 Å²	37.8	46.4 Å²	46.4	20%	0.202	24%	0.24	C	C	.	.	H	α-helix	trans	-61.5	-38.7	174.9	-77.1	-38.7	0	0	0	112.3	F1758 T1825 V1826 L1827 E1831 T1832 F1833 I2181 F2185	F1758-N1829 HydrophobicContact CE1-CB 4.38Å; T1825-N1829 WeakPolarHBondContact O-CB 3.32Å; T1825-N1829 VanDerWaalsContact O-CG 3.23Å; T1825-N1829 PolarHBondContact O-N 3.19Å; T1825-N1829 VanDerWaalsContact O-N 3.12Å; T1825-N1829 PolarHBondContact O-ND2 3.3Å; T1825-N1829 VanDerWaalsContact O-ND2 3.1Å; T1825-N1829 PolarHBondContact O-OD1 2.97Å; V1826-N1829 PolarHBondContact O-N 3.15Å; L1827-N1829 VanDerWaalsContact C-N 3.31Å; L1827-N1829 PolarHBondContact O-N 3.22Å; N1829-E1831 VanDerWaalsContact C-N 3.33Å; N1829-T1832 PolarHBondContact O-N 3.22Å; N1829-T1832 PolarHBondContact O-OG1 2.97Å; N1829-F1833 VanDerWaalsContact O-CD2 3.3Å; N1829-F1833 WeakPolarHBondContact O-CD2 3.26Å; N1829-I2181 HydrophobicContact CB-CG2 3.96Å; N1829-I2181 WeakPolarHBondContact ND2-CG2 3.41Å; N1829-I2181 PolarHBondContact ND2-O 3.3Å; N1829-F2185 HydrophobicContact CB-CD2 4.37Å
1830	L	90.5	Very high	89.4	Confident	2.6 Å²	2.6	47 Å²	47	1%	0.014	24%	0.242	C	C	.	.	H	α-helix	trans	-70	-40.4	174.4	-179	58.2	0	0	0	111	P1603 Y1606 F1758 V1826 L1827 D1828 T1832 F1833 H1834	P1603-L1830 HydrophobicContact CB-CB 4.5Å; P1603-L1830 HydrophobicContact CB-CD2 3.88Å; P1603-L1830 HydrophobicContact CB-CG 4.26Å; P1603-L1830 HydrophobicContact CG-CD2 4.26Å; P1603-L1830 HydrophobicContact CG-CG 4.23Å; Y1606-L1830 HydrophobicContact CD1-CD2 4.49Å; Y1606-L1830 HydrophobicContact CD2-CD2 3.61Å; Y1606-L1830 HydrophobicContact CE1-CD2 4.49Å; Y1606-L1830 HydrophobicContact CE2-CD2 3.59Å; Y1606-L1830 HydrophobicContact CG-CD2 4.12Å; F1758-L1830 HydrophobicContact CD1-CB 4.23Å; F1758-L1830 HydrophobicContact CD2-CD1 4.12Å; F1758-L1830 HydrophobicContact CE1-CB 4.12Å; F1758-L1830 HydrophobicContact CE1-CD1 4.38Å; F1758-L1830 HydrophobicContact CE2-CD1 3.77Å; F1758-L1830 HydrophobicContact CZ-CB 4.37Å; F1758-L1830 HydrophobicContact CZ-CD1 3.95Å; V1826-L1830 PolarHBondContact O-N 3.05Å; V1826-L1830 VanDerWaalsContact O-N 3.13Å; L1827-L1830 CarbonylContact O-C 3.52Å; L1827-L1830 WeakPolarHBondContact O-CB 3.37Å; L1827-L1830 PolarHBondContact O-N 3.08Å; L1827-L1830 VanDerWaalsContact O-N 3.12Å; D1828-L1830 VanDerWaalsContact C-N 3.31Å; D1828-L1830 PolarHBondContact O-N 3.07Å; L1830-T1832 PolarHBondContact O-N 3.11Å; L1830-F1833 WeakPolarHBondContact O-CB 3.35Å; L1830-F1833 PolarHBondContact O-N 3.09Å; L1830-F1833 VanDerWaalsContact O-N 3.13Å; L1830-H1834 PolarHBondContact O-CD2 3.17Å; L1830-H1834 PolarHBondContact O-N 3.13Å
1831	E	92.1	Very high	88.5	Confident	64.8 Å²	64.8	47.5 Å²	47.5	30%	0.303	24%	0.243	S	C	.	.	H	α-helix	trans	-63.5	-25.9	178.8	-172.1	63.2	-174.2	0	0	112.6	P1603 L1827 D1828 N1829 F1833 H1834 S1835 R1838	P1603-E1831 WeakPolarHBondContact CG-OE2 3.4Å; L1827-E1831 VanDerWaalsContact O-CB 3.24Å; L1827-E1831 WeakPolarHBondContact O-CB 3.38Å; L1827-E1831 PolarHBondContact O-N 3.08Å; D1828-E1831 WeakPolarHBondContact O-CB 3.41Å; D1828-E1831 PolarHBondContact O-N 3.17Å; D1828-E1831 VanDerWaalsContact O-N 3.17Å; N1829-E1831 VanDerWaalsContact C-N 3.33Å; E1831-F1833 VanDerWaalsContact C-N 3.29Å; E1831-F1833 PolarHBondContact O-N 3.26Å; E1831-H1834 CarbonylContact O-C 3.52Å; E1831-H1834 PolarHBondContact O-N 2.87Å; E1831-H1834 VanDerWaalsContact O-N 3.16Å; E1831-H1834 WeakPolarHBondContact OE2-CB 3.36Å; E1831-H1834 IonicContact OE2-CG 2.88Å; E1831-H1834 IonicContact OE2-ND1 3.95Å; E1831-H1834 PolarHBondContact OE2-ND1 2.92Å; E1831-S1835 VanDerWaalsContact O-CB 3.24Å; E1831-S1835 WeakPolarHBondContact O-CB 3.38Å; E1831-S1835 PolarHBondContact O-N 3.16Å; E1831-S1835 PolarHBondContact O-OG 3.23Å; E1831-R1838 VanDerWaalsContact CD-NH2 3.31Å; E1831-R1838 IonicContact OE1-CZ 3.25Å; E1831-R1838 VanDerWaalsContact OE1-CZ 3.24Å; E1831-R1838 IonicContact OE1-NH1 2.92Å; E1831-R1838 PolarHBondContact OE1-NH1 3.26Å; E1831-R1838 VanDerWaalsContact OE1-NH1 3.11Å; E1831-R1838 IonicContact OE1-NH2 3.22Å; E1831-R1838 PolarHBondContact OE1-NH2 3.09Å; E1831-R1838 IonicContact OE2-CZ 2.81Å; E1831-R1838 IonicContact OE2-NH1 3.12Å; E1831-R1838 IonicContact OE2-NH2 3.52Å; E1831-R1838 PolarHBondContact OE2-NH2 3.17Å
1832	T	90.8	Very high	87.4	Confident	48.2 Å²	48.2	45.2 Å²	45.2	30%	0.296	24%	0.24	S	C	.	.	H	α-helix	trans	-59.2	-39.1	171	64.1	0	0	0	0	112.5	D1828 N1829 L1830 S1835 H1836 R2186	D1828-T1832 VanDerWaalsContact O-CG2 3.31Å; D1828-T1832 WeakPolarHBondContact O-CG2 3.22Å; D1828-T1832 PolarHBondContact O-N 3.12Å; N1829-T1832 PolarHBondContact O-N 3.22Å; N1829-T1832 PolarHBondContact O-OG1 2.97Å; L1830-T1832 PolarHBondContact O-N 3.11Å; T1832-S1835 WeakPolarHBondContact CA-OG 3.38Å; T1832-S1835 PolarHBondContact O-N 2.84Å; T1832-S1835 PolarHBondContact O-OG 2.78Å; T1832-H1836 WeakPolarHBondContact O-CB 3.31Å; T1832-H1836 PolarHBondContact O-N 3.04Å; T1832-H1836 VanDerWaalsContact O-N 3.16Å; T1832-R2186 HydrophobicContact CG2-CG 4.48Å
1833	F	91.7	Very high	85.9	Confident	9.6 Å²	9.6	49 Å²	49	4%	0.042	26%	0.26	C	S	.	.	H	α-helix	trans	-70.4	-43.1	176.3	-66.8	-90.8	0	0	0	111.2	Y1599 T1740 L1744 P1751 P1753 F1758 N1829 L1830 E1831 S1835 H1836 S1837 F2185	Y1599-F1833 HydrophobicContact CE1-CB 4.08Å; Y1599-F1833 VanDerWaalsContact CE1-O 3.23Å; Y1599-F1833 WeakPolarHBondContact CE1-O 3.21Å; Y1599-F1833 PolarHBondContact OH-O 2.81Å; T1740-F1833 HydrophobicContact CG2-CE1 3.89Å; T1740-F1833 HydrophobicContact CG2-CE2 4.42Å; T1740-F1833 HydrophobicContact CG2-CZ 3.5Å; T1740-F1833 VanDerWaalsContact CG2-CZ 3.44Å; L1744-F1833 HydrophobicContact CD1-CD1 4.48Å; L1744-F1833 HydrophobicContact CD1-CE1 4.18Å; L1744-F1833 HydrophobicContact CD1-CZ 4.22Å; L1744-F1833 HydrophobicContact CD2-CD1 3.92Å; L1744-F1833 HydrophobicContact CD2-CE1 4.22Å; L1744-F1833 HydrophobicContact CD2-CG 4.37Å; L1744-F1833 HydrophobicContact CG-CE1 4.38Å; P1751-F1833 HydrophobicContact CB-CD1 4.3Å; P1751-F1833 HydrophobicContact CB-CE1 4.3Å; P1751-F1833 HydrophobicContact CG-CD1 4.28Å; P1753-F1833 HydrophobicContact CB-CD1 4.12Å; P1753-F1833 HydrophobicContact CB-CD2 4.32Å; P1753-F1833 HydrophobicContact CB-CE1 3.79Å; P1753-F1833 HydrophobicContact CB-CE2 4.07Å; P1753-F1833 HydrophobicContact CB-CG 4.36Å; P1753-F1833 HydrophobicContact CB-CZ 3.76Å; P1753-F1833 HydrophobicContact CG-CB 4.37Å; P1753-F1833 HydrophobicContact CG-CD1 3.88Å; P1753-F1833 HydrophobicContact CG-CD2 4.16Å; P1753-F1833 HydrophobicContact CG-CE1 4.09Å; P1753-F1833 HydrophobicContact CG-CE2 4.37Å; P1753-F1833 HydrophobicContact CG-CG 3.92Å; P1753-F1833 HydrophobicContact CG-CZ 4.32Å; F1758-F1833 HydrophobicContact CE1-CE2 4.49Å; F1758-F1833 HydrophobicContact CZ-CD2 4.3Å; F1758-F1833 AromaticContact CZ-CE2 3.87Å; F1758-F1833 HydrophobicContact CZ-CE2 3.99Å; N1829-F1833 VanDerWaalsContact O-CD2 3.3Å; N1829-F1833 WeakPolarHBondContact O-CD2 3.26Å; L1830-F1833 WeakPolarHBondContact O-CB 3.35Å; L1830-F1833 PolarHBondContact O-N 3.09Å; L1830-F1833 VanDerWaalsContact O-N 3.13Å; E1831-F1833 VanDerWaalsContact C-N 3.29Å; E1831-F1833 PolarHBondContact O-N 3.26Å; F1833-S1835 VanDerWaalsContact C-N 3.32Å; F1833-S1835 PolarHBondContact O-N 3.19Å; F1833-H1836 WeakPolarHBondContact O-CB 3.29Å; F1833-H1836 PolarHBondContact O-N 3.26Å; F1833-S1837 WeakPolarHBondContact O-CB 3.45Å; F1833-S1837 PolarHBondContact O-N 3.01Å; F1833-F2185 HydrophobicContact CE2-CD2 4.1Å; F1833-F2185 HydrophobicContact CE2-CE2 4.43Å; F1833-F2185 HydrophobicContact CE2-CG 4.42Å; F1833-F2185 HydrophobicContact CZ-CD2 4.34Å; F1833-F2185 HydrophobicContact CZ-CG 4.48Å
1834	H	91.3	Very high	84.2	Confident	20.6 Å²	20.6	53.6 Å²	53.6	10%	0.095	28%	0.282	C	S	.	.	H	α-helix	trans	-65.7	-38	177.7	-73.8	-114.2	0	0	0	111.9	Y1599 I1601 L1830 E1831 H1836 S1837 R1838	Y1599-H1834 AromaticContact CD1-CE1 3.91Å; Y1599-H1834 AromaticContact CD1-ND1 3.8Å; I1601-H1834 PolarHBondContact O-CE1 2.83Å; L1830-H1834 PolarHBondContact O-CD2 3.17Å; L1830-H1834 PolarHBondContact O-N 3.13Å; E1831-H1834 CarbonylContact O-C 3.52Å; E1831-H1834 PolarHBondContact O-N 2.87Å; E1831-H1834 VanDerWaalsContact O-N 3.16Å; E1831-H1834 WeakPolarHBondContact OE2-CB 3.36Å; E1831-H1834 IonicContact OE2-CG 2.88Å; E1831-H1834 IonicContact OE2-ND1 3.95Å; E1831-H1834 PolarHBondContact OE2-ND1 2.92Å; H1834-H1836 VanDerWaalsContact C-N 3.34Å; H1834-H1836 PolarHBondContact O-N 3.26Å; H1834-S1837 WeakPolarHBondContact O-CB 3.11Å; H1834-S1837 PolarHBondContact O-N 3.22Å; H1834-R1838 VanDerWaalsContact C-NH2 3.28Å; H1834-R1838 WeakPolarHBondContact O-CB 3.44Å; H1834-R1838 VanDerWaalsContact O-CG 3.28Å; H1834-R1838 WeakPolarHBondContact O-CG 3.33Å; H1834-R1838 PolarHBondContact O-N 3.21Å; H1834-R1838 VanDerWaalsContact O-N 3.07Å; H1834-R1838 PolarHBondContact O-NE 3.27Å; H1834-R1838 PolarHBondContact O-NH2 3.31Å
1835	S	89.9	Confident	82.4	Confident	56.2 Å²	56.2	58.1 Å²	58.1	39%	0.393	30%	0.299	S	S	.	.	H	α-helix	trans	-65.6	-41.9	174.9	-111.2	0	0	0	0	111.8	E1831 T1832 F1833 R1838 S1839	E1831-S1835 VanDerWaalsContact O-CB 3.24Å; E1831-S1835 WeakPolarHBondContact O-CB 3.38Å; E1831-S1835 PolarHBondContact O-N 3.16Å; E1831-S1835 PolarHBondContact O-OG 3.23Å; T1832-S1835 WeakPolarHBondContact CA-OG 3.38Å; T1832-S1835 PolarHBondContact O-N 2.84Å; T1832-S1835 PolarHBondContact O-OG 2.78Å; F1833-S1835 VanDerWaalsContact C-N 3.32Å; F1833-S1835 PolarHBondContact O-N 3.19Å; S1835-R1838 VanDerWaalsContact N-NH2 3.14Å; S1835-R1838 PolarHBondContact O-N 3.1Å; S1835-R1838 PolarHBondContact OG-NH2 3.15Å; S1835-S1839 WeakPolarHBondContact O-CB 3.35Å; S1835-S1839 PolarHBondContact O-N 3.06Å
1836	H	89.5	Confident	79.8	Confident	23.2 Å²	23.2	58.3 Å²	58.3	11%	0.107	31%	0.311	C	S	.	.	H	α-helix	trans	-57.8	-50.7	172.4	-178.1	89.2	0	0	0	111.4	A1743 L1744 C1746 F1749 T1832 F1833 H1834 R1838 S1839 R1840	A1743-H1836 PolarHBondContact O-CE1 2.82Å; L1744-H1836 HydrophobicContact CD2-CB 3.88Å; L1744-H1836 PolarHBondContact O-ND1 3.19Å; C1746-H1836 PolarHBondContact O-CE1 3.2Å; C1746-H1836 VanDerWaalsContact O-CE1 3.26Å; F1749-H1836 PolarHBondContact O-NE2 3.16Å; T1832-H1836 WeakPolarHBondContact O-CB 3.31Å; T1832-H1836 PolarHBondContact O-N 3.04Å; T1832-H1836 VanDerWaalsContact O-N 3.16Å; F1833-H1836 WeakPolarHBondContact O-CB 3.29Å; F1833-H1836 PolarHBondContact O-N 3.26Å; H1834-H1836 VanDerWaalsContact C-N 3.34Å; H1834-H1836 PolarHBondContact O-N 3.26Å; H1836-R1838 VanDerWaalsContact C-N 3.34Å; H1836-R1838 PolarHBondContact O-N 3.17Å; H1836-S1839 WeakPolarHBondContact O-CB 3.24Å; H1836-S1839 PolarHBondContact O-N 3.06Å; H1836-S1839 VanDerWaalsContact O-N 3.16Å; H1836-R1840 WeakPolarHBondContact O-CG 3.42Å; H1836-R1840 PolarHBondContact O-N 3.16Å; H1836-R1840 VanDerWaalsContact O-N 3.11Å
1837	S	87.8	Confident	77.3	Confident	17 Å²	17	65.6 Å²	65.6	12%	0.119	35%	0.35	C	S	.	.	H	α-helix	trans	-57.4	-45.9	176.9	178.2	0	0	0	0	112.5	Y1595 F1833 H1834 S1839 R1840 H1841	Y1595-S1837 WeakPolarHBondContact OH-CB 3.32Å; Y1595-S1837 PolarHBondContact OH-OG 2.91Å; Y1595-S1837 VanDerWaalsContact OH-OG 3.06Å; F1833-S1837 WeakPolarHBondContact O-CB 3.45Å; F1833-S1837 PolarHBondContact O-N 3.01Å; H1834-S1837 WeakPolarHBondContact O-CB 3.11Å; H1834-S1837 PolarHBondContact O-N 3.22Å; S1837-S1839 PolarHBondContact O-N 3.11Å; S1837-R1840 WeakPolarHBondContact O-CB 3.43Å; S1837-R1840 PolarHBondContact O-N 3.31Å; S1837-H1841 PolarHBondContact O-CD2 2.91Å; S1837-H1841 VanDerWaalsContact O-CD2 3.3Å; S1837-H1841 PolarHBondContact O-N 2.92Å; S1837-H1841 VanDerWaalsContact O-N 3.14Å; S1837-H1841 PolarHBondContact O-ND1 3.23Å
1838	R	88.5	Confident	74.6	Confident	126.8 Å²	126.8	73.9 Å²	73.9	48%	0.478	39%	0.388	S	S	.	.	H	α-helix	trans	-64.6	-41.5	177.2	-72.1	-179.7	-59	-131.1	-1	112.6	E1831 H1834 S1835 H1836 R1840 H1841 S1842	E1831-R1838 VanDerWaalsContact CD-NH2 3.31Å; E1831-R1838 IonicContact OE1-CZ 3.25Å; E1831-R1838 VanDerWaalsContact OE1-CZ 3.24Å; E1831-R1838 IonicContact OE1-NH1 2.92Å; E1831-R1838 PolarHBondContact OE1-NH1 3.26Å; E1831-R1838 VanDerWaalsContact OE1-NH1 3.11Å; E1831-R1838 IonicContact OE1-NH2 3.22Å; E1831-R1838 PolarHBondContact OE1-NH2 3.09Å; E1831-R1838 IonicContact OE2-CZ 2.81Å; E1831-R1838 IonicContact OE2-NH1 3.12Å; E1831-R1838 IonicContact OE2-NH2 3.52Å; E1831-R1838 PolarHBondContact OE2-NH2 3.17Å; H1834-R1838 VanDerWaalsContact C-NH2 3.28Å; H1834-R1838 WeakPolarHBondContact O-CB 3.44Å; H1834-R1838 VanDerWaalsContact O-CG 3.28Å; H1834-R1838 WeakPolarHBondContact O-CG 3.33Å; H1834-R1838 PolarHBondContact O-N 3.21Å; H1834-R1838 VanDerWaalsContact O-N 3.07Å; H1834-R1838 PolarHBondContact O-NE 3.27Å; H1834-R1838 PolarHBondContact O-NH2 3.31Å; S1835-R1838 VanDerWaalsContact N-NH2 3.14Å; S1835-R1838 PolarHBondContact O-N 3.1Å; S1835-R1838 PolarHBondContact OG-NH2 3.15Å; H1836-R1838 VanDerWaalsContact C-N 3.34Å; H1836-R1838 PolarHBondContact O-N 3.17Å; R1838-R1840 VanDerWaalsContact C-N 3.28Å; R1838-R1840 PolarHBondContact O-N 3.09Å; R1838-H1841 PolarHBondContact O-N 3.05Å; R1838-H1841 VanDerWaalsContact O-N 3.16Å; R1838-S1842 PolarHBondContact O-N 3.09Å; R1838-S1842 PolarHBondContact O-OG 3.13Å
1839	S	84.1	Confident	71.8	Confident	64.8 Å²	64.8	73.5 Å²	73.5	45%	0.453	40%	0.401	S	S	.	.	H	α-helix	trans	-62.8	-29.2	177.1	-171.6	0	0	0	0	112.9	S1835 H1836 S1837 S1842 N1843	S1835-S1839 WeakPolarHBondContact O-CB 3.35Å; S1835-S1839 PolarHBondContact O-N 3.06Å; H1836-S1839 WeakPolarHBondContact O-CB 3.24Å; H1836-S1839 PolarHBondContact O-N 3.06Å; H1836-S1839 VanDerWaalsContact O-N 3.16Å; S1837-S1839 PolarHBondContact O-N 3.11Å; S1839-S1842 WeakPolarHBondContact CA-OG 3.25Å; S1839-S1842 PolarHBondContact O-OG 3.15Å; S1839-N1843 PolarHBondContact O-N 3.17Å; S1839-N1843 PolarHBondContact O-OD1 3.32Å
1840	R	79.1	Confident	69.1	Low	26.4 Å²	26.4	78.2 Å²	78.2	10%	0.1	43%	0.426	C	S	.	.	H	α-helix	trans	-68.4	-46.6	173.2	-109.2	-175.2	104.1	-93.7	-12.5	111.9	G1747 S1748 F1749 H1836 S1837 R1838 S1842 N1843 E1844	G1747-R1840 WeakPolarHBondContact O-CD 3.34Å; G1747-R1840 WeakPolarHBondContact O-CG 3.36Å; G1747-R1840 PolarHBondContact O-NE 3.48Å; G1747-R1840 VanDerWaalsContact O-NE 3.09Å; S1748-R1840 VanDerWaalsContact O-CZ 3.22Å; S1748-R1840 PolarHBondContact O-NE 3.29Å; S1748-R1840 VanDerWaalsContact O-NE 3.07Å; S1748-R1840 PolarHBondContact O-NH1 2.95Å; S1748-R1840 PolarHBondContact O-NH2 2.93Å; F1749-R1840 WeakPolarHBondContact O-CD 3.44Å; F1749-R1840 PolarHBondContact O-NH1 3.37Å; H1836-R1840 WeakPolarHBondContact O-CG 3.42Å; H1836-R1840 PolarHBondContact O-N 3.16Å; H1836-R1840 VanDerWaalsContact O-N 3.11Å; S1837-R1840 WeakPolarHBondContact O-CB 3.43Å; S1837-R1840 PolarHBondContact O-N 3.31Å; R1838-R1840 VanDerWaalsContact C-N 3.28Å; R1838-R1840 PolarHBondContact O-N 3.09Å; R1840-S1842 VanDerWaalsContact C-N 3.26Å; R1840-S1842 PolarHBondContact O-N 3.16Å; R1840-N1843 PolarHBondContact O-N 3.21Å; R1840-N1843 VanDerWaalsContact O-N 3.09Å; R1840-E1844 IonicContact CZ-OE1 2.76Å; R1840-E1844 IonicContact NH1-OE1 3.11Å; R1840-E1844 PolarHBondContact NH1-OE1 3.24Å; R1840-E1844 IonicContact NH1-OE2 2.68Å; R1840-E1844 PolarHBondContact NH1-OE2 3.34Å; R1840-E1844 VanDerWaalsContact NH1-OE2 3.14Å; R1840-E1844 IonicContact NH2-OE1 3.54Å; R1840-E1844 PolarHBondContact NH2-OE1 3.02Å; R1840-E1844 PolarHBondContact O-N 3.01Å; R1840-E1844 VanDerWaalsContact O-N 3.12Å
1841	H	69.7	Low	66.6	Low	89.4 Å²	89.4	86.4 Å²	86.4	41%	0.414	47%	0.465	S	S	.	.	H	α-helix	trans	-69.8	-23.8	-178.4	-68.1	43.6	0	0	0	113.5	Y1595 S1837 R1838 E1844 K1845	Y1595-H1841 PolarHBondContact OH-NE2 3.43Å; Y1595-H1841 VanDerWaalsContact OH-NE2 3.15Å; S1837-H1841 PolarHBondContact O-CD2 2.91Å; S1837-H1841 VanDerWaalsContact O-CD2 3.3Å; S1837-H1841 PolarHBondContact O-N 2.92Å; S1837-H1841 VanDerWaalsContact O-N 3.14Å; S1837-H1841 PolarHBondContact O-ND1 3.23Å; R1838-H1841 PolarHBondContact O-N 3.05Å; R1838-H1841 VanDerWaalsContact O-N 3.16Å; H1841-E1844 IonicContact CE1-OE2 2.99Å; H1841-E1844 IonicContact CG-OE2 3.27Å; H1841-E1844 IonicContact ND1-OE2 3.42Å; H1841-E1844 PolarHBondContact ND1-OE2 3.32Å; H1841-E1844 PolarHBondContact O-N 2.84Å; H1841-K1845 WeakPolarHBondContact O-CG 3.33Å; H1841-K1845 PolarHBondContact O-N 3.3Å
1842	S	65.2	Low	63.9	Low	68.4 Å²	68.4	88.6 Å²	88.6	48%	0.478	48%	0.483	S	S	.	.	H	α-helix	trans	-71.5	-39.3	169.5	52.7	0	0	0	0	112.1	R1838 S1839 R1840 E1844 K1845 G1846	R1838-S1842 PolarHBondContact O-N 3.09Å; R1838-S1842 PolarHBondContact O-OG 3.13Å; S1839-S1842 WeakPolarHBondContact CA-OG 3.25Å; S1839-S1842 PolarHBondContact O-OG 3.15Å; R1840-S1842 VanDerWaalsContact C-N 3.26Å; R1840-S1842 PolarHBondContact O-N 3.16Å; S1842-E1844 VanDerWaalsContact C-N 3.28Å; S1842-E1844 PolarHBondContact O-N 3.22Å; S1842-K1845 PolarHBondContact O-N 3.18Å; S1842-K1845 VanDerWaalsContact O-N 3.14Å; S1842-G1846 PolarHBondContact O-N 2.96Å
1843	N	57.3	Low	61.3	Low	118.6 Å²	118.6	91.9 Å²	91.9	63%	0.634	50%	0.498	S	S	*	.	H	α-helix	trans	-70.6	-29.4	178.6	-74.9	9.8	0	0	0	112.7	S1839 R1840 K1845 G1846	S1839-N1843 PolarHBondContact O-N 3.17Å; S1839-N1843 PolarHBondContact O-OD1 3.32Å; R1840-N1843 PolarHBondContact O-N 3.21Å; R1840-N1843 VanDerWaalsContact O-N 3.09Å; N1843-K1845 VanDerWaalsContact C-N 3.29Å; N1843-K1845 PolarHBondContact O-N 3.22Å; N1843-K1845 VanDerWaalsContact O-N 3.16Å; N1843-G1846 PolarHBondContact O-N 3.27Å
1844	E	56.1	Low	58.7	Low	117.2 Å²	117.2	95.4 Å²	95.4	55%	0.548	52%	0.524	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-12	174	-73	176.1	169.1	0	0	113.3	R1840 H1841 S1842	R1840-E1844 IonicContact CZ-OE1 2.76Å; R1840-E1844 IonicContact NH1-OE1 3.11Å; R1840-E1844 PolarHBondContact NH1-OE1 3.24Å; R1840-E1844 IonicContact NH1-OE2 2.68Å; R1840-E1844 PolarHBondContact NH1-OE2 3.34Å; R1840-E1844 VanDerWaalsContact NH1-OE2 3.14Å; R1840-E1844 IonicContact NH2-OE1 3.54Å; R1840-E1844 PolarHBondContact NH2-OE1 3.02Å; R1840-E1844 PolarHBondContact O-N 3.01Å; R1840-E1844 VanDerWaalsContact O-N 3.12Å; H1841-E1844 IonicContact CE1-OE2 2.99Å; H1841-E1844 IonicContact CG-OE2 3.27Å; H1841-E1844 IonicContact ND1-OE2 3.42Å; H1841-E1844 PolarHBondContact ND1-OE2 3.32Å; H1841-E1844 PolarHBondContact O-N 2.84Å; S1842-E1844 VanDerWaalsContact C-N 3.28Å; S1842-E1844 PolarHBondContact O-N 3.22Å
1845	K	50.9	Low	56.2	Low	184.8 Å²	184.8	98.2 Å²	98.2	80%	0.803	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.1	-3.5	-179.1	-68.8	-172.5	177	-176.6	0	114.6	H1841 S1842 N1843	H1841-K1845 WeakPolarHBondContact O-CG 3.33Å; H1841-K1845 PolarHBondContact O-N 3.3Å; S1842-K1845 PolarHBondContact O-N 3.18Å; S1842-K1845 VanDerWaalsContact O-N 3.14Å; N1843-K1845 VanDerWaalsContact C-N 3.29Å; N1843-K1845 PolarHBondContact O-N 3.22Å; N1843-K1845 VanDerWaalsContact O-N 3.16Å
1846	G	38.4	Very low	54.1	Low	51.8 Å²	51.8	103.2 Å²	103.2	53%	0.534	56%	0.556	S	S	.	*			trans	-97.9	123.8	178.2	0	0	0	0	0	111.4	S1842 N1843	S1842-G1846 PolarHBondContact O-N 2.96Å; N1843-G1846 PolarHBondContact O-N 3.27Å
1847	D	37.5	Very low	52.3	Low	159.8 Å²	159.8	105.7 Å²	105.7	86%	0.855	57%	0.574	S	S	*	*			trans	-54.9	152.2	167.2	-109.2	-30.6	0	0	0	111.4	G1849	D1847-G1849 PolarHBondContact O-N 3.08Å
1848	E	36	Very low	50.9	Low	190.8 Å²	190.8	107.2 Å²	107.2	89%	0.892	58%	0.58	S	S	*	*	S	Bend	trans	-22.5	57	173.7	-59.8	-168.5	152.2	0	0	116	D1850	E1848-D1850 PolarHBondContact O-N 3.38Å; E1848-D1850 VanDerWaalsContact O-N 3.13Å
1849	G	32.1	Very low	49.6	Very low	65 Å²	65	105.9 Å²	105.9	67%	0.67	58%	0.579	S	S	*	*			trans	-98.3	99.1	173.2	0	0	0	0	0	112.7	D1847 Q1851	D1847-G1849 PolarHBondContact O-N 3.08Å; G1849-Q1851 VanDerWaalsContact C-N 3.34Å; G1849-Q1851 PolarHBondContact O-N 3.23Å
1850	D	33.5	Very low	49.1	Very low	136 Å²	136	103.7 Å²	103.7	73%	0.727	56%	0.562	S	S	*	*			trans	-1.3	79.2	164.9	-155.6	17.5	0	0	0	114.6	E1848 T1852	E1848-D1850 PolarHBondContact O-N 3.38Å; E1848-D1850 VanDerWaalsContact O-N 3.13Å; D1850-T1852 VanDerWaalsContact C-N 3.34Å; D1850-T1852 HydrophobicContact CB-CG2 4.25Å; D1850-T1852 PolarHBondContact O-N 3.04Å; D1850-T1852 VanDerWaalsContact O-N 3.09Å; D1850-T1852 PolarHBondContact O-OG1 3.21Å; D1850-T1852 WeakPolarHBondContact OD1-CG2 3.35Å
1851	Q	38.2	Very low	48.7	Very low	174.4 Å²	174.4	102.4 Å²	102.4	82%	0.815	56%	0.557	S	S	*	*			trans	-74.3	91.9	167.3	-72.2	-170.3	24.3	0	0	110.1	G1849 D1853	G1849-Q1851 VanDerWaalsContact C-N 3.34Å; G1849-Q1851 PolarHBondContact O-N 3.23Å; Q1851-D1853 PolarHBondContact O-N 2.95Å
1852	T	34.1	Very low	49	Very low	111 Å²	111	100 Å²	100	68%	0.681	55%	0.546	S	S	*	.			trans	-71	71.3	176	46.6	0	0	0	0	111.4	D1850 S1854	D1850-T1852 VanDerWaalsContact C-N 3.34Å; D1850-T1852 HydrophobicContact CB-CG2 4.25Å; D1850-T1852 PolarHBondContact O-N 3.04Å; D1850-T1852 VanDerWaalsContact O-N 3.09Å; D1850-T1852 PolarHBondContact O-OG1 3.21Å; D1850-T1852 WeakPolarHBondContact OD1-CG2 3.35Å; T1852-S1854 VanDerWaalsContact C-N 3.28Å; T1852-S1854 WeakPolarHBondContact O-CB 3.48Å; T1852-S1854 PolarHBondContact O-N 3.06Å; T1852-S1854 PolarHBondContact O-OG 3.17Å
1853	D	36.1	Very low	49.1	Very low	117.6 Å²	117.6	100 Å²	100	63%	0.629	54%	0.544	S	S	*	.			trans	-55.6	76.5	175.5	-151	20	0	0	0	112.9	Q1851 S1855 R1856	Q1851-D1853 PolarHBondContact O-N 2.95Å; D1853-S1855 VanDerWaalsContact C-N 3.28Å; D1853-S1855 PolarHBondContact O-N 2.96Å; D1853-R1856 IonicContact OD2-CZ 3.05Å; D1853-R1856 IonicContact OD2-NE 2.9Å; D1853-R1856 PolarHBondContact OD2-NE 2.9Å; D1853-R1856 IonicContact OD2-NH2 3.68Å; D1853-R1856 PolarHBondContact OD2-NH2 3.36Å
1854	S	37.1	Very low	49.5	Very low	83.2 Å²	83.2	97.6 Å²	97.6	58%	0.582	53%	0.531	S	S	*	.			trans	-82.6	79.9	-177	67.6	0	0	0	0	112.7	T1852 R1856 R1876	T1852-S1854 VanDerWaalsContact C-N 3.28Å; T1852-S1854 WeakPolarHBondContact O-CB 3.48Å; T1852-S1854 PolarHBondContact O-N 3.06Å; T1852-S1854 PolarHBondContact O-OG 3.17Å; S1854-R1856 PolarHBondContact O-N 2.91Å; S1854-R1876 PolarHBondContact O-NH1 2.87Å; S1854-R1876 PolarHBondContact O-NH2 2.92Å
1855	S	39.6	Very low	49.5	Very low	79 Å²	79	96.2 Å²	96.2	55%	0.552	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.7	22.5	178.9	-131.3	0	0	0	0	116.3	D1853 T1857 K2335	D1853-S1855 VanDerWaalsContact C-N 3.28Å; D1853-S1855 PolarHBondContact O-N 2.96Å; S1855-T1857 PolarHBondContact O-N 3.29Å; S1855-K2335 PolarHBondContact OG-NZ 3.28Å
1856	R	45.9	Very low	49.5	Very low	162.2 Å²	162.2	94.2 Å²	94.2	61%	0.612	52%	0.524	S	S	*	.			trans	-91.4	113.2	-179	-62.5	-172	-173.9	-175.8	6.1	111.2	S1745 D1853 S1854 L1858	S1745-R1856 PolarHBondContact O-NH1 3.45Å; D1853-R1856 IonicContact OD2-CZ 3.05Å; D1853-R1856 IonicContact OD2-NE 2.9Å; D1853-R1856 PolarHBondContact OD2-NE 2.9Å; D1853-R1856 IonicContact OD2-NH2 3.68Å; D1853-R1856 PolarHBondContact OD2-NH2 3.36Å; S1854-R1856 PolarHBondContact O-N 2.91Å; R1856-L1858 PolarHBondContact O-N 3.45Å
1857	T	51.2	Low	49.8	Very low	76.4 Å²	76.4	96.9 Å²	96.9	47%	0.469	52%	0.524	S	S	.	.			trans	-58.6	139.1	162.5	-4.6	0	0	0	0	109.1	S1855 E1859 D2330 A2331	S1855-T1857 PolarHBondContact O-N 3.29Å; T1857-E1859 VanDerWaalsContact C-N 3.32Å; T1857-E1859 PolarHBondContact O-N 2.91Å; T1857-E1859 VanDerWaalsContact O-N 3.15Å; T1857-D2330 HydrophobicContact CG2-CB 4.45Å; T1857-A2331 VanDerWaalsContact OG1-CA 3.32Å; T1857-A2331 WeakPolarHBondContact OG1-CA 3.43Å; T1857-A2331 VanDerWaalsContact OG1-CB 3.23Å; T1857-A2331 WeakPolarHBondContact OG1-CB 3.36Å
1858	L	57.5	Low	50.4	Low	47 Å²	47	93.9 Å²	93.9	25%	0.246	51%	0.513	C	S	.	.			trans	-68.8	94.6	177	-109.7	137.5	0	0	0	110	R1856 I1860 L1875 A1880 M1883	R1856-L1858 PolarHBondContact O-N 3.45Å; L1858-I1860 HydrophobicContact CD2-CG1 4.27Å; L1858-I1860 PolarHBondContact O-N 3.01Å; L1858-L1875 HydrophobicContact CB-CB 4.39Å; L1858-L1875 HydrophobicContact CB-CD1 4.44Å; L1858-L1875 VanDerWaalsContact CD1-C 3.43Å; L1858-L1875 HydrophobicContact CD1-CB 3.77Å; L1858-L1875 VanDerWaalsContact CD1-CB 3.41Å; L1858-L1875 HydrophobicContact CD1-CD1 4.18Å; L1858-L1875 HydrophobicContact CD1-CG 4.42Å; L1858-L1875 VanDerWaalsContact CD1-O 3.3Å; L1858-L1875 WeakPolarHBondContact CD1-O 3.42Å; L1858-L1875 HydrophobicContact CD2-CB 4Å; L1858-L1875 HydrophobicContact CD2-CD1 3.92Å; L1858-L1875 HydrophobicContact CG-CB 4.13Å; L1858-A1880 HydrophobicContact CD1-CB 4.13Å; L1858-A1880 HydrophobicContact CD2-CB 3.74Å; L1858-A1880 HydrophobicContact CG-CB 4.04Å; L1858-M1883 HydrophobicContact CD2-CB 4.31Å; L1858-M1883 HydrophobicContact CD2-CG 4.08Å
1859	E	61.9	Low	51.3	Low	99.4 Å²	99.4	86.1 Å²	86.1	46%	0.464	48%	0.48	S	S	.	.			trans	-86.2	102.7	173.1	-72.4	-167.8	176.2	0	0	110	R1742 S1745 F1749 T1857	R1742-E1859 HydrophobicContact CB-CB 4.43Å; R1742-E1859 HydrophobicContact CG-CB 4.27Å; S1745-E1859 WeakPolarHBondContact CB-OE2 3.29Å; S1745-E1859 PolarHBondContact OG-OE2 2.91Å; F1749-E1859 WeakPolarHBondContact CE2-O 3.3Å; T1857-E1859 VanDerWaalsContact C-N 3.32Å; T1857-E1859 PolarHBondContact O-N 2.91Å; T1857-E1859 VanDerWaalsContact O-N 3.15Å
1860	I	72.7	Confident	52.7	Low	18.4 Å²	18.4	84.6 Å²	84.6	9%	0.094	46%	0.458	C	S	.	.			trans	-65	141.3	173.2	-50.2	179	0	0	0	109.8	R1742 L1858 Q1862 P1863 L1864 M1883 Q1884	R1742-I1860 VanDerWaalsContact CD-O 3.31Å; R1742-I1860 WeakPolarHBondContact CD-O 3.33Å; R1742-I1860 PolarHBondContact NE-O 3.06Å; L1858-I1860 HydrophobicContact CD2-CG1 4.27Å; L1858-I1860 PolarHBondContact O-N 3.01Å; I1860-Q1862 VanDerWaalsContact C-N 3.28Å; I1860-Q1862 WeakPolarHBondContact CD1-O 3.14Å; I1860-Q1862 WeakPolarHBondContact CG1-O 3.47Å; I1860-Q1862 VanDerWaalsContact CG2-O 3.23Å; I1860-Q1862 WeakPolarHBondContact CG2-O 3.4Å; I1860-Q1862 PolarHBondContact O-N 3.22Å; I1860-P1863 WeakPolarHBondContact O-CD 3.25Å; I1860-L1864 HydrophobicContact CD1-CG 4.44Å; I1860-M1883 HydrophobicContact CD1-CG 4.21Å; I1860-Q1884 HydrophobicContact CB-CB 4.3Å; I1860-Q1884 HydrophobicContact CB-CG 4.39Å; I1860-Q1884 HydrophobicContact CG2-CB 3.88Å; I1860-Q1884 HydrophobicContact CG2-CG 3.52Å; I1860-Q1884 VanDerWaalsContact CG2-CG 3.5Å; I1860-Q1884 VanDerWaalsContact CG2-NE2 3.26Å
1861	I	70.9	Confident	54.3	Low	0.2 Å²	0.2	79.3 Å²	79.3	0%	0.001	43%	0.431	C	S	.	.	S	Bend	trans	-55.6	-43.7	-176.5	-57.8	176.3	0	0	0	110.6	F1678 A1739 R1742 A1743 F1749 Q1884	F1678-I1861 HydrophobicContact CZ-CG2 4.4Å; A1739-I1861 HydrophobicContact CB-CG2 4.13Å; R1742-I1861 VanDerWaalsContact CZ-O 3.25Å; R1742-I1861 PolarHBondContact NE-O 3.07Å; R1742-I1861 PolarHBondContact NH2-O 3.24Å; A1743-I1861 HydrophobicContact CB-CD1 3.7Å; A1743-I1861 HydrophobicContact CB-CG1 3.9Å; A1743-I1861 HydrophobicContact CB-CG2 4.36Å; F1749-I1861 HydrophobicContact CB-CD1 4.18Å; F1749-I1861 HydrophobicContact CD1-CD1 3.63Å; F1749-I1861 HydrophobicContact CD1-CG1 3.96Å; F1749-I1861 HydrophobicContact CD2-CD1 4.12Å; F1749-I1861 HydrophobicContact CD2-CG1 3.88Å; F1749-I1861 HydrophobicContact CE1-CD1 3.97Å; F1749-I1861 HydrophobicContact CE1-CG1 3.85Å; F1749-I1861 HydrophobicContact CE2-CD1 4.38Å; F1749-I1861 HydrophobicContact CE2-CG1 3.78Å; F1749-I1861 HydrophobicContact CG-CD1 3.73Å; F1749-I1861 HydrophobicContact CG-CG1 3.99Å; F1749-I1861 HydrophobicContact CZ-CD1 4.29Å; F1749-I1861 HydrophobicContact CZ-CG1 3.78Å; I1861-Q1884 VanDerWaalsContact CB-OE1 3.27Å
1862	Q	76.2	Confident	55.8	Low	39.4 Å²	39.4	71.3 Å²	71.3	18%	0.184	39%	0.394	C	S	.	.	S	Bend	trans	-122.1	99.4	169.3	-100.5	-95.7	-31.1	0	0	110.4	W1673 N1674 I1860 L1864 Q1884 H1888	W1673-Q1862 VanDerWaalsContact CD1-OE1 3.28Å; W1673-Q1862 VanDerWaalsContact NE1-CD 3.31Å; N1674-Q1862 PolarHBondContact OD1-OE1 3.16Å; I1860-Q1862 VanDerWaalsContact C-N 3.28Å; I1860-Q1862 WeakPolarHBondContact CD1-O 3.14Å; I1860-Q1862 WeakPolarHBondContact CG1-O 3.47Å; I1860-Q1862 VanDerWaalsContact CG2-O 3.23Å; I1860-Q1862 WeakPolarHBondContact CG2-O 3.4Å; I1860-Q1862 PolarHBondContact O-N 3.22Å; Q1862-L1864 PolarHBondContact O-N 3.21Å; Q1862-Q1884 PolarHBondContact O-NE2 3.29Å; Q1862-H1888 PolarHBondContact O-CE1 2.86Å; Q1862-H1888 PolarHBondContact O-NE2 3.25Å; Q1862-H1888 VanDerWaalsContact O-NE2 3.16Å
1863	P	67.6	Low	57.5	Low	67.6 Å²	67.6	66.2 Å²	66.2	44%	0.439	36%	0.362	S	S	.	.			trans	-64.5	135.9	173.8	8.4	-7	0	0	0	110.4	R1742 I1860 T1865	R1742-P1863 VanDerWaalsContact CZ-CD 3.48Å; I1860-P1863 WeakPolarHBondContact O-CD 3.25Å; P1863-T1865 VanDerWaalsContact C-N 3.27Å; P1863-T1865 PolarHBondContact O-N 3.33Å
1864	L	66	Low	59	Low	67.8 Å²	67.8	61.8 Å²	61.8	36%	0.355	34%	0.341	S	S	.	.	S	Bend	trans	-74.6	27.4	173.4	-68.4	174.2	0	0	0	111.2	I1860 Q1862 E1866 Q1887 H1888 T1911	I1860-L1864 HydrophobicContact CD1-CG 4.44Å; Q1862-L1864 PolarHBondContact O-N 3.21Å; L1864-E1866 PolarHBondContact O-N 3.13Å; L1864-Q1887 HydrophobicContact CD1-CB 3.85Å; L1864-Q1887 WeakPolarHBondContact CD1-O 3.39Å; L1864-H1888 VanDerWaalsContact CD2-CE1 3.48Å; L1864-H1888 WeakPolarHBondContact CD2-CE1 3.42Å; L1864-H1888 WeakPolarHBondContact CD2-ND1 3.3Å; L1864-T1911 HydrophobicContact CB-CG2 3.86Å; L1864-T1911 HydrophobicContact CD1-CG2 3.84Å; L1864-T1911 HydrophobicContact CG-CG2 4.43Å
1865	T	57.2	Low	60.6	Low	87.8 Å²	87.8	58.7 Å²	58.7	54%	0.539	32%	0.318	S	S	.	.	S	Bend	trans	-109.2	95.2	-176.3	-39.4	0	0	0	0	110.5	P1863 M1867 S1869	P1863-T1865 VanDerWaalsContact C-N 3.27Å; P1863-T1865 PolarHBondContact O-N 3.33Å; T1865-M1867 VanDerWaalsContact C-N 3.26Å; T1865-M1867 WeakPolarHBondContact CB-O 3.32Å; T1865-M1867 HydrophobicContact CG2-CB 4.44Å; T1865-M1867 VanDerWaalsContact CG2-O 3.28Å; T1865-M1867 WeakPolarHBondContact CG2-O 3.44Å; T1865-M1867 PolarHBondContact O-N 3.18Å; T1865-S1869 PolarHBondContact OG1-OG 3.28Å
1866	E	51	Low	61.9	Low	143 Å²	143	61.2 Å²	61.2	67%	0.668	32%	0.315	S	S	*	.	S	Bend	trans	-66.9	0.2	176.1	-63.1	-171.8	157.3	0	0	111	L1864 T1911 R1986	L1864-E1866 PolarHBondContact O-N 3.13Å; E1866-T1911 HydrophobicContact CB-CG2 4.33Å; E1866-T1911 WeakPolarHBondContact OE2-CG2 3.34Å; E1866-T1911 PolarHBondContact OE2-OG1 2.89Å; E1866-R1986 IonicContact OE2-NH2 3.4Å
1867	M	44.5	Very low	63.2	Low	109.2 Å²	109.2	61.9 Å²	61.9	54%	0.538	32%	0.317	S	S	.	.	S	Bend	trans	-76.5	139.8	178.2	-66.9	-65.6	-84.8	0	0	111	T1865 S1869 F2327	T1865-M1867 VanDerWaalsContact C-N 3.26Å; T1865-M1867 WeakPolarHBondContact CB-O 3.32Å; T1865-M1867 HydrophobicContact CG2-CB 4.44Å; T1865-M1867 VanDerWaalsContact CG2-O 3.28Å; T1865-M1867 WeakPolarHBondContact CG2-O 3.44Å; T1865-M1867 PolarHBondContact O-N 3.18Å; M1867-S1869 PolarHBondContact O-N 3.14Å; M1867-S1869 PolarHBondContact O-OG 3.4Å; M1867-F2327 HydrophobicContact CB-CD1 4.47Å; M1867-F2327 HydrophobicContact CB-CE1 4.03Å; M1867-F2327 HydrophobicContact CB-CE2 4.43Å; M1867-F2327 HydrophobicContact CB-CZ 4.01Å; M1867-F2327 HydrophobicContact CE-CD2 3.71Å; M1867-F2327 HydrophobicContact CE-CE2 3.14Å; M1867-F2327 HydrophobicContact CE-CZ 3.9Å; M1867-F2327 HydrophobicContact CG-CE1 4.48Å; M1867-F2327 HydrophobicContact CG-CE2 4.06Å; M1867-F2327 HydrophobicContact CG-CZ 3.97Å; M1867-F2327 HydrophobicContact SD-CD2 3.55Å; M1867-F2327 VanDerWaalsContact SD-CD2 3.55Å; M1867-F2327 HydrophobicContact SD-CE2 3.4Å; M1867-F2327 WeakPolarHBondContact SD-CE2 3.46Å; M1867-F2327 HydrophobicContact SD-CG 4.26Å; M1867-F2327 HydrophobicContact SD-CZ 3.93Å
1868	P	49.4	Very low	64.4	Low	95.6 Å²	95.6	58.6 Å²	58.6	62%	0.621	30%	0.297	S	S	*	.			trans	-60.9	99.9	174.5	17.5	-21.8	0	0	0	109.3	F2327 D2330	P1868-F2327 HydrophobicContact CG-CB 4.01Å; P1868-F2327 WeakPolarHBondContact O-CD1 3.31Å; P1868-D2330 VanDerWaalsContact CB-OD2 3.27Å; P1868-D2330 WeakPolarHBondContact CB-OD2 3.12Å
1869	S	55.6	Low	65.7	Low	28.4 Å²	28.4	58.4 Å²	58.4	20%	0.199	30%	0.296	C	S	.	.	P	Polyproline II helix	trans	-81.3	131	174.2	-78	0	0	0	0	107.6	T1865 M1867 T1871 T1912	T1865-S1869 PolarHBondContact OG1-OG 3.28Å; M1867-S1869 PolarHBondContact O-N 3.14Å; M1867-S1869 PolarHBondContact O-OG 3.4Å; S1869-T1871 PolarHBondContact O-N 3.27Å; S1869-T1871 VanDerWaalsContact O-N 3.12Å; S1869-T1912 WeakPolarHBondContact OG-CG2 3.22Å
1870	P	60.2	Low	66.7	Low	32.2 Å²	32.2	53.7 Å²	53.7	21%	0.209	27%	0.274	C	S	.	.	P	Polyproline II helix	trans	-61.4	125.7	179.1	24.5	-31.7	0	0	0	109.1	L1872 Y2095 L2096 L2099 F2249	P1870-L1872 PolarHBondContact O-N 2.89Å; P1870-L1872 VanDerWaalsContact O-N 3.11Å; P1870-Y2095 HydrophobicContact CB-CE1 4.46Å; P1870-Y2095 VanDerWaalsContact CD-CE1 3.47Å; P1870-Y2095 HydrophobicContact CG-CD1 3.66Å; P1870-Y2095 VanDerWaalsContact CG-CD1 3.47Å; P1870-Y2095 HydrophobicContact CG-CE1 3.72Å; P1870-Y2095 VanDerWaalsContact CG-CE1 3.42Å; P1870-Y2095 HydrophobicContact CG-CG 4.48Å; P1870-L2096 HydrophobicContact CB-CD2 3.93Å; P1870-L2096 HydrophobicContact CG-CD2 4.14Å; P1870-L2096 WeakPolarHBondContact O-CD2 3.39Å; P1870-L2099 HydrophobicContact CG-CD1 4.08Å; P1870-F2249 HydrophobicContact CB-CB 4.19Å; P1870-F2249 HydrophobicContact CB-CD1 4.04Å; P1870-F2249 HydrophobicContact CB-CD2 4.32Å; P1870-F2249 HydrophobicContact CB-CG 4.09Å; P1870-F2249 HydrophobicContact CG-CB 3.78Å; P1870-F2249 HydrophobicContact CG-CD1 3.84Å; P1870-F2249 HydrophobicContact CG-CD2 4.18Å; P1870-F2249 HydrophobicContact CG-CG 3.78Å
1871	T	67.2	Low	67.3	Low	26.2 Å²	26.2	53 Å²	53	16%	0.161	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-80.8	141.7	172.6	37.2	0	0	0	0	109.1	S1869 M1873 L1875 T1911 T1912 C1913 R2092	S1869-T1871 PolarHBondContact O-N 3.27Å; S1869-T1871 VanDerWaalsContact O-N 3.12Å; T1871-M1873 VanDerWaalsContact CB-O 3.32Å; T1871-M1873 WeakPolarHBondContact CB-O 3.3Å; T1871-M1873 HydrophobicContact CG2-CB 3.98Å; T1871-M1873 PolarHBondContact O-N 2.98Å; T1871-M1873 VanDerWaalsContact O-N 3.13Å; T1871-M1873 PolarHBondContact OG1-O 3.03Å; T1871-L1875 HydrophobicContact CG2-CD1 3.9Å; T1871-L1875 HydrophobicContact CG2-CD2 4.32Å; T1871-L1875 HydrophobicContact CG2-CG 4.11Å; T1871-T1911 PolarHBondContact OG1-O 2.87Å; T1871-T1912 CarbonylContact C-O 3.58Å; T1871-T1912 WeakPolarHBondContact OG1-CA 3.48Å; T1871-C1913 HydrophobicContact CG2-CB 4.38Å; T1871-R2092 WeakPolarHBondContact O-CD 3.35Å; T1871-R2092 PolarHBondContact O-NE 3.41Å; T1871-R2092 PolarHBondContact O-NH2 3.49Å; T1871-R2092 PolarHBondContact OG1-NH2 3.37Å
1872	L	69.3	Low	68.1	Low	6.2 Å²	6.2	54 Å²	54	3%	0.032	28%	0.276	C	S	.	.	S	Bend	trans	-65.4	-21	174.7	-164.9	74.2	0	0	0	112.2	P1870 T1912 T2007 L2077 Q2080 L2088 F2089 R2092 K2093 L2096 F2249 I2345	P1870-L1872 PolarHBondContact O-N 2.89Å; P1870-L1872 VanDerWaalsContact O-N 3.11Å; L1872-T1912 WeakPolarHBondContact CB-O 3.35Å; L1872-T1912 PolarHBondContact N-O 2.98Å; L1872-T2007 HydrophobicContact CD2-CG2 3.8Å; L1872-L2077 HydrophobicContact CD2-CD2 3.96Å; L1872-L2077 HydrophobicContact CG-CD2 4.24Å; L1872-Q2080 PolarHBondContact O-NE2 3.41Å; L1872-L2088 HydrophobicContact CD1-CD1 4.23Å; L1872-L2088 HydrophobicContact CD1-CD2 4.14Å; L1872-L2088 HydrophobicContact CD1-CG 3.99Å; L1872-L2088 HydrophobicContact CD2-CD1 4.32Å; L1872-L2088 HydrophobicContact CD2-CD2 3.82Å; L1872-L2088 HydrophobicContact CD2-CG 4.39Å; L1872-L2088 HydrophobicContact CG-CD2 4.41Å; L1872-F2089 HydrophobicContact CD1-CD2 4.44Å; L1872-F2089 HydrophobicContact CD1-CE2 3.88Å; L1872-F2089 HydrophobicContact CD1-CZ 4.22Å; L1872-F2089 HydrophobicContact CD2-CE2 4.42Å; L1872-F2089 HydrophobicContact CD2-CZ 4.16Å; L1872-F2089 HydrophobicContact CG-CE2 3.95Å; L1872-F2089 HydrophobicContact CG-CZ 4.13Å; L1872-R2092 HydrophobicContact CD1-CB 4.4Å; L1872-R2092 VanDerWaalsContact O-CD 3.23Å; L1872-R2092 WeakPolarHBondContact O-CD 3.36Å; L1872-R2092 PolarHBondContact O-NE 2.7Å; L1872-K2093 HydrophobicContact CD1-CB 3.99Å; L1872-L2096 HydrophobicContact CB-CD1 3.89Å; L1872-L2096 HydrophobicContact CD1-CD1 4.13Å; L1872-L2096 HydrophobicContact CG-CD1 4.43Å; L1872-F2249 HydrophobicContact CD1-CD1 4.07Å; L1872-F2249 HydrophobicContact CD1-CE1 3.15Å; L1872-F2249 HydrophobicContact CD1-CZ 3.43Å; L1872-F2249 VanDerWaalsContact CD1-CZ 3.43Å; L1872-F2249 HydrophobicContact CD2-CE1 3.93Å; L1872-F2249 HydrophobicContact CG-CD1 4.45Å; L1872-F2249 HydrophobicContact CG-CE1 3.83Å; L1872-I2345 HydrophobicContact CD2-CD1 3.7Å; L1872-I2345 HydrophobicContact CD2-CG1 4.18Å
1873	M	69.8	Low	68.6	Low	3.4 Å²	3.4	52.2 Å²	52.2	2%	0.017	27%	0.268	C	S	.	.	S	Bend	trans	-124.3	158.2	-172.9	72.2	-174.8	-48.6	0	0	111.8	T1871 L1875 I1878 C1913 I2073 E2076 L2077 R2092	T1871-M1873 VanDerWaalsContact CB-O 3.32Å; T1871-M1873 WeakPolarHBondContact CB-O 3.3Å; T1871-M1873 HydrophobicContact CG2-CB 3.98Å; T1871-M1873 PolarHBondContact O-N 2.98Å; T1871-M1873 VanDerWaalsContact O-N 3.13Å; T1871-M1873 PolarHBondContact OG1-O 3.03Å; M1873-L1875 HydrophobicContact CB-CD2 3.78Å; M1873-L1875 HydrophobicContact CB-CG 4.38Å; M1873-L1875 HydrophobicContact CG-CD2 3.89Å; M1873-L1875 PolarHBondContact O-N 3.45Å; M1873-L1875 HydrophobicContact SD-CD2 3.83Å; M1873-L1875 WeakPolarHBondContact SD-CD2 3.39Å; M1873-I1878 HydrophobicContact CE-CD1 3.84Å; M1873-I1878 HydrophobicContact SD-CD1 3.82Å; M1873-I1878 WeakPolarHBondContact SD-CD1 3.46Å; M1873-C1913 HydrophobicContact CE-CB 3.87Å; M1873-C1913 HydrophobicContact CG-CB 4.29Å; M1873-C1913 HydrophobicContact SD-CB 4.06Å; M1873-I2073 HydrophobicContact CE-CG2 4.12Å; M1873-I2073 VanDerWaalsContact CE-O 3.31Å; M1873-I2073 WeakPolarHBondContact CE-O 3.37Å; M1873-I2073 HydrophobicContact SD-CG2 3.96Å; M1873-E2076 HydrophobicContact CB-CG 4.47Å; M1873-E2076 HydrophobicContact CE-CB 3.32Å; M1873-E2076 HydrophobicContact CE-CG 3.27Å; M1873-E2076 VanDerWaalsContact CE-CG 3.43Å; M1873-E2076 HydrophobicContact CG-CB 4.24Å; M1873-E2076 HydrophobicContact CG-CG 3.53Å; M1873-E2076 HydrophobicContact SD-CB 3.87Å; M1873-E2076 HydrophobicContact SD-CG 3.83Å; M1873-L2077 HydrophobicContact CB-CD2 4.12Å; M1873-L2077 HydrophobicContact CE-CD1 4.07Å; M1873-L2077 HydrophobicContact CE-CD2 4.04Å; M1873-L2077 HydrophobicContact CE-CG 3.73Å; M1873-L2077 HydrophobicContact SD-CD1 4.4Å; M1873-L2077 HydrophobicContact SD-CD2 3.85Å; M1873-L2077 HydrophobicContact SD-CG 3.79Å; M1873-R2092 PolarHBondContact O-NH2 3.05Å
1874	S	68.4	Low	69.5	Low	24.6 Å²	24.6	49 Å²	49	17%	0.172	25%	0.247	C	C	.	.			trans	-78.7	114.6	172.4	175	0	0	0	0	108.9	R1876 E2076	S1874-R1876 VanDerWaalsContact C-N 3.33Å; S1874-R1876 PolarHBondContact O-N 3.17Å; S1874-R1876 PolarHBondContact OG-NE 3.28Å; S1874-E2076 WeakPolarHBondContact O-CG 3.42Å
1875	L	69.7	Low	70.7	Confident	18.2 Å²	18.2	47.4 Å²	47.4	10%	0.095	24%	0.236	C	C	.	.			trans	-79.3	-2.2	-178	-55.3	-174.3	0	0	0	113.9	L1858 T1871 M1873 R1877 I1878 M1883	L1858-L1875 HydrophobicContact CB-CB 4.39Å; L1858-L1875 HydrophobicContact CB-CD1 4.44Å; L1858-L1875 VanDerWaalsContact CD1-C 3.43Å; L1858-L1875 HydrophobicContact CD1-CB 3.77Å; L1858-L1875 VanDerWaalsContact CD1-CB 3.41Å; L1858-L1875 HydrophobicContact CD1-CD1 4.18Å; L1858-L1875 HydrophobicContact CD1-CG 4.42Å; L1858-L1875 VanDerWaalsContact CD1-O 3.3Å; L1858-L1875 WeakPolarHBondContact CD1-O 3.42Å; L1858-L1875 HydrophobicContact CD2-CB 4Å; L1858-L1875 HydrophobicContact CD2-CD1 3.92Å; L1858-L1875 HydrophobicContact CG-CB 4.13Å; T1871-L1875 HydrophobicContact CG2-CD1 3.9Å; T1871-L1875 HydrophobicContact CG2-CD2 4.32Å; T1871-L1875 HydrophobicContact CG2-CG 4.11Å; M1873-L1875 HydrophobicContact CB-CD2 3.78Å; M1873-L1875 HydrophobicContact CB-CG 4.38Å; M1873-L1875 HydrophobicContact CG-CD2 3.89Å; M1873-L1875 PolarHBondContact O-N 3.45Å; M1873-L1875 HydrophobicContact SD-CD2 3.83Å; M1873-L1875 WeakPolarHBondContact SD-CD2 3.39Å; L1875-R1877 VanDerWaalsContact C-N 3.27Å; L1875-R1877 PolarHBondContact O-N 3.05Å; L1875-R1877 VanDerWaalsContact O-N 3.14Å; L1875-I1878 HydrophobicContact CD2-CD1 3.99Å; L1875-I1878 WeakPolarHBondContact O-CB 3.38Å; L1875-I1878 PolarHBondContact O-N 3.13Å; L1875-M1883 HydrophobicContact CD1-CE 4.48Å; L1875-M1883 HydrophobicContact CD1-CG 4.35Å; L1875-M1883 HydrophobicContact CD1-SD 4.46Å; L1875-M1883 HydrophobicContact CD2-CE 3.95Å
1876	R	67.5	Low	72.3	Confident	131.4 Å²	131.4	43.4 Å²	43.4	50%	0.496	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55	-27.1	-172.8	-70.2	-175.5	-144.5	-179.3	-5.1	115.3	S1854 S1874 D2334 M2337	S1854-R1876 PolarHBondContact O-NH1 2.87Å; S1854-R1876 PolarHBondContact O-NH2 2.92Å; S1874-R1876 VanDerWaalsContact C-N 3.33Å; S1874-R1876 PolarHBondContact O-N 3.17Å; S1874-R1876 PolarHBondContact OG-NE 3.28Å; R1876-D2334 PolarHBondContact NE-O 2.94Å; R1876-D2334 VanDerWaalsContact NE-O 3.17Å; R1876-D2334 PolarHBondContact NH2-O 3.33Å; R1876-D2334 VanDerWaalsContact NH2-O 3.12Å; R1876-M2337 PolarHBondContact NH2-SD 2.9Å
1877	R	72.7	Confident	74	Confident	176.8 Å²	176.8	37.3 Å²	37.3	67%	0.667	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.1	0.1	-177.8	-70.3	-177.6	-151.2	-152	-3.7	113.8	L1875 E2076	L1875-R1877 VanDerWaalsContact C-N 3.27Å; L1875-R1877 PolarHBondContact O-N 3.05Å; L1875-R1877 VanDerWaalsContact O-N 3.14Å; R1877-E2076 WeakPolarHBondContact CD-OE2 3.49Å; R1877-E2076 IonicContact CZ-OE1 3.81Å; R1877-E2076 IonicContact CZ-OE2 3.31Å; R1877-E2076 IonicContact NE-OE1 3.41Å; R1877-E2076 IonicContact NE-OE2 3.29Å; R1877-E2076 PolarHBondContact NE-OE2 3.17Å; R1877-E2076 IonicContact NH2-OE1 3.03Å; R1877-E2076 PolarHBondContact NH2-OE1 3.07Å; R1877-E2076 IonicContact NH2-OE2 2.7Å; R1877-E2076 PolarHBondContact NH2-OE2 2.99Å
1878	I	78.1	Confident	76.1	Confident	8.6 Å²	8.6	33.7 Å²	33.7	4%	0.044	17%	0.165	C	C	.	.	S	Bend	trans	-103.2	137.2	-177	-56.6	171.8	0	0	0	108.6	M1873 L1875 A1880 M1883 Q2072 I2073 E2076	M1873-I1878 HydrophobicContact CE-CD1 3.84Å; M1873-I1878 HydrophobicContact SD-CD1 3.82Å; M1873-I1878 WeakPolarHBondContact SD-CD1 3.46Å; L1875-I1878 HydrophobicContact CD2-CD1 3.99Å; L1875-I1878 WeakPolarHBondContact O-CB 3.38Å; L1875-I1878 PolarHBondContact O-N 3.13Å; I1878-A1880 PolarHBondContact O-N 3.09Å; I1878-A1880 VanDerWaalsContact O-N 3.09Å; I1878-M1883 HydrophobicContact CB-CE 4.38Å; I1878-M1883 HydrophobicContact CD1-CE 3.97Å; I1878-M1883 HydrophobicContact CG2-CB 4.43Å; I1878-M1883 HydrophobicContact CG2-CE 3.71Å; I1878-Q2072 HydrophobicContact CG1-CB 4.37Å; I1878-Q2072 HydrophobicContact CG2-CB 4.33Å; I1878-I2073 HydrophobicContact CD1-CG1 3.91Å; I1878-E2076 HydrophobicContact CD1-CB 4.37Å; I1878-E2076 HydrophobicContact CD1-CG 4.49Å
1879	D	83.7	Confident	78.1	Confident	41.4 Å²	41.4	29.4 Å²	29.4	22%	0.221	14%	0.138	C	C	.	.			trans	-61	121.7	175.5	-173.2	-32.2	0	0	0	110.5	S1748 D1881 L1882 M1883 Q2072	S1748-D1879 WeakPolarHBondContact CB-OD1 3.34Å; S1748-D1879 PolarHBondContact OG-OD1 3.01Å; D1879-D1881 VanDerWaalsContact C-N 3.28Å; D1879-D1881 PolarHBondContact O-N 3.09Å; D1879-D1881 WeakPolarHBondContact OD1-CA 3.24Å; D1879-D1881 VanDerWaalsContact OD1-CB 3.27Å; D1879-D1881 WeakPolarHBondContact OD1-CB 3.34Å; D1879-D1881 PolarHBondContact OD1-N 3.25Å; D1879-L1882 HydrophobicContact CB-CB 4.16Å; D1879-L1882 HydrophobicContact CB-CD1 4Å; D1879-L1882 HydrophobicContact CB-CG 4Å; D1879-L1882 PolarHBondContact O-N 3.17Å; D1879-L1882 VanDerWaalsContact O-N 3.12Å; D1879-L1882 PolarHBondContact OD1-N 3.39Å; D1879-L1882 VanDerWaalsContact OD1-N 3.13Å; D1879-M1883 WeakPolarHBondContact O-CB 3.34Å; D1879-M1883 PolarHBondContact O-N 3.16Å; D1879-Q2072 VanDerWaalsContact N-OE1 3.13Å
1880	A	82.5	Confident	79.9	Confident	1.4 Å²	1.4	28.3 Å²	28.3	1%	0.012	13%	0.13	C	C	.	.	H	α-helix	trans	-61.8	-31.7	-179.9	0	0	0	0	0	113.1	S1748 F1749 L1858 I1878 M1883 Q1884	S1748-A1880 WeakPolarHBondContact OG-CB 3.21Å; S1748-A1880 PolarHBondContact OG-N 3.39Å; S1748-A1880 VanDerWaalsContact OG-N 3.16Å; F1749-A1880 VanDerWaalsContact CE1-C 3.49Å; F1749-A1880 HydrophobicContact CE1-CB 3.96Å; F1749-A1880 WeakPolarHBondContact CE1-O 3.4Å; F1749-A1880 HydrophobicContact CE2-CB 4.07Å; F1749-A1880 HydrophobicContact CZ-CB 3.58Å; F1749-A1880 VanDerWaalsContact CZ-CB 3.49Å; L1858-A1880 HydrophobicContact CD1-CB 4.13Å; L1858-A1880 HydrophobicContact CD2-CB 3.74Å; L1858-A1880 HydrophobicContact CG-CB 4.04Å; I1878-A1880 PolarHBondContact O-N 3.09Å; I1878-A1880 VanDerWaalsContact O-N 3.09Å; A1880-M1883 PolarHBondContact O-N 3.43Å; A1880-Q1884 VanDerWaalsContact O-CB 3.26Å; A1880-Q1884 WeakPolarHBondContact O-CB 3.33Å; A1880-Q1884 PolarHBondContact O-N 3.14Å
1881	D	86	Confident	81.4	Confident	4.2 Å²	4.2	27.4 Å²	27.4	2%	0.022	12%	0.124	C	C	.	.	H	α-helix	trans	-69	-43.2	176.7	-173.9	50.3	0	0	0	110.7	S1748 F1749 R1750 D1879 Q1884 R1885	S1748-D1881 WeakPolarHBondContact O-CB 3.42Å; F1749-D1881 HydrophobicContact CD1-CB 4.01Å; F1749-D1881 HydrophobicContact CE1-CB 4.27Å; R1750-D1881 IonicContact CZ-OD2 2.84Å; R1750-D1881 IonicContact NH1-OD2 3.68Å; R1750-D1881 IonicContact NH2-OD2 3.01Å; R1750-D1881 PolarHBondContact NH2-OD2 3.4Å; D1879-D1881 VanDerWaalsContact C-N 3.28Å; D1879-D1881 PolarHBondContact O-N 3.09Å; D1879-D1881 WeakPolarHBondContact OD1-CA 3.24Å; D1879-D1881 VanDerWaalsContact OD1-CB 3.27Å; D1879-D1881 WeakPolarHBondContact OD1-CB 3.34Å; D1879-D1881 PolarHBondContact OD1-N 3.25Å; D1881-Q1884 WeakPolarHBondContact O-CB 3.36Å; D1881-Q1884 PolarHBondContact O-N 3.05Å; D1881-R1885 WeakPolarHBondContact O-CD 3.14Å; D1881-R1885 VanDerWaalsContact O-CG 3.26Å; D1881-R1885 WeakPolarHBondContact O-CG 3.3Å; D1881-R1885 PolarHBondContact O-N 3.06Å; D1881-R1885 VanDerWaalsContact O-N 3.11Å; D1881-R1885 IonicContact OD1-CZ 3.58Å; D1881-R1885 VanDerWaalsContact OD1-CZ 3.24Å; D1881-R1885 IonicContact OD1-NE 3.25Å; D1881-R1885 PolarHBondContact OD1-NE 3.02Å; D1881-R1885 IonicContact OD1-NH2 2.99Å; D1881-R1885 PolarHBondContact OD1-NH2 3.18Å; D1881-R1885 IonicContact OD2-CZ 3.37Å; D1881-R1885 VanDerWaalsContact OD2-CZ 3.25Å; D1881-R1885 IonicContact OD2-NE 2.96Å; D1881-R1885 PolarHBondContact OD2-NE 3.33Å; D1881-R1885 IonicContact OD2-NH2 3.32Å; D1881-R1885 PolarHBondContact OD2-NH2 3.18Å
1882	L	87.7	Confident	82.6	Confident	20.4 Å²	20.4	26.1 Å²	26.1	11%	0.107	12%	0.117	C	C	.	.	H	α-helix	trans	-65.2	-45.2	173.6	-65.7	-179.9	0	0	0	111.4	D1879 Q1884 R1885 L1886 V2065 D2068	D1879-L1882 HydrophobicContact CB-CB 4.16Å; D1879-L1882 HydrophobicContact CB-CD1 4Å; D1879-L1882 HydrophobicContact CB-CG 4Å; D1879-L1882 PolarHBondContact O-N 3.17Å; D1879-L1882 VanDerWaalsContact O-N 3.12Å; D1879-L1882 PolarHBondContact OD1-N 3.39Å; D1879-L1882 VanDerWaalsContact OD1-N 3.13Å; L1882-Q1884 VanDerWaalsContact C-N 3.31Å; L1882-Q1884 PolarHBondContact O-N 2.91Å; L1882-R1885 PolarHBondContact O-N 3.26Å; L1882-R1885 VanDerWaalsContact O-N 3.11Å; L1882-L1886 WeakPolarHBondContact O-CB 3.44Å; L1882-L1886 VanDerWaalsContact O-CG 3.31Å; L1882-L1886 WeakPolarHBondContact O-CG 3.32Å; L1882-L1886 PolarHBondContact O-N 3.01Å; L1882-V2065 HydrophobicContact CD2-CB 4.42Å; L1882-V2065 HydrophobicContact CD2-CG1 4.08Å; L1882-V2065 HydrophobicContact CD2-CG2 4.37Å; L1882-D2068 HydrophobicContact CD1-CB 4.37Å
1883	M	85.9	Confident	83.7	Confident	1.8 Å²	1.8	25.9 Å²	25.9	1%	0.009	12%	0.115	C	C	.	.	H	α-helix	trans	-57.1	-45.3	176.8	-177.1	58.2	56.5	0	0	111.6	L1858 I1860 L1875 I1878 D1879 A1880 R1885 L1886 Q1887 L1909 I2073	L1858-M1883 HydrophobicContact CD2-CB 4.31Å; L1858-M1883 HydrophobicContact CD2-CG 4.08Å; I1860-M1883 HydrophobicContact CD1-CG 4.21Å; L1875-M1883 HydrophobicContact CD1-CE 4.48Å; L1875-M1883 HydrophobicContact CD1-CG 4.35Å; L1875-M1883 HydrophobicContact CD1-SD 4.46Å; L1875-M1883 HydrophobicContact CD2-CE 3.95Å; I1878-M1883 HydrophobicContact CB-CE 4.38Å; I1878-M1883 HydrophobicContact CD1-CE 3.97Å; I1878-M1883 HydrophobicContact CG2-CB 4.43Å; I1878-M1883 HydrophobicContact CG2-CE 3.71Å; D1879-M1883 WeakPolarHBondContact O-CB 3.34Å; D1879-M1883 PolarHBondContact O-N 3.16Å; A1880-M1883 PolarHBondContact O-N 3.43Å; M1883-R1885 VanDerWaalsContact C-N 3.34Å; M1883-R1885 PolarHBondContact O-N 3.01Å; M1883-L1886 PolarHBondContact O-N 3.03Å; M1883-Q1887 HydrophobicContact CG-CG 4.47Å; M1883-Q1887 WeakPolarHBondContact O-CB 3.36Å; M1883-Q1887 WeakPolarHBondContact O-CG 3.32Å; M1883-Q1887 PolarHBondContact O-N 2.98Å; M1883-Q1887 HydrophobicContact SD-CG 4.06Å; M1883-Q1887 PolarHBondContact SD-NE2 3.01Å; M1883-Q1887 VanDerWaalsContact SD-NE2 3.41Å; M1883-L1909 HydrophobicContact CE-CD2 4.26Å; M1883-L1909 HydrophobicContact SD-CD2 3.64Å; M1883-L1909 VanDerWaalsContact SD-CD2 3.51Å; M1883-I2073 HydrophobicContact CE-CD1 3.83Å; M1883-I2073 HydrophobicContact CE-CG1 3.87Å; M1883-I2073 HydrophobicContact SD-CD1 4.39Å
1884	Q	87.2	Confident	84.9	Confident	0.8 Å²	0.8	25.9 Å²	25.9	0%	0.004	12%	0.115	C	C	.	.	H	α-helix	trans	-60.5	-46.8	176.6	-176	152.6	-29	0	0	112	N1674 F1749 I1860 I1861 Q1862 A1880 D1881 L1882 L1886 Q1887 H1888	N1674-Q1884 VanDerWaalsContact O-CD 3.27Å; N1674-Q1884 WeakPolarHBondContact O-CG 3.48Å; N1674-Q1884 PolarHBondContact O-NE2 2.94Å; N1674-Q1884 VanDerWaalsContact O-NE2 3.12Å; N1674-Q1884 PolarHBondContact O-OE1 2.68Å; F1749-Q1884 HydrophobicContact CE1-CB 4.32Å; I1860-Q1884 HydrophobicContact CB-CB 4.3Å; I1860-Q1884 HydrophobicContact CB-CG 4.39Å; I1860-Q1884 HydrophobicContact CG2-CB 3.88Å; I1860-Q1884 HydrophobicContact CG2-CG 3.52Å; I1860-Q1884 VanDerWaalsContact CG2-CG 3.5Å; I1860-Q1884 VanDerWaalsContact CG2-NE2 3.26Å; I1861-Q1884 VanDerWaalsContact CB-OE1 3.27Å; Q1862-Q1884 PolarHBondContact O-NE2 3.29Å; A1880-Q1884 VanDerWaalsContact O-CB 3.26Å; A1880-Q1884 WeakPolarHBondContact O-CB 3.33Å; A1880-Q1884 PolarHBondContact O-N 3.14Å; D1881-Q1884 WeakPolarHBondContact O-CB 3.36Å; D1881-Q1884 PolarHBondContact O-N 3.05Å; L1882-Q1884 VanDerWaalsContact C-N 3.31Å; L1882-Q1884 PolarHBondContact O-N 2.91Å; Q1884-L1886 VanDerWaalsContact C-N 3.32Å; Q1884-L1886 PolarHBondContact O-N 3.08Å; Q1884-Q1887 PolarHBondContact O-N 3.14Å; Q1884-H1888 PolarHBondContact NE2-CD2 3.43Å; Q1884-H1888 PolarHBondContact NE2-NE2 3.36Å; Q1884-H1888 WeakPolarHBondContact O-CB 3.44Å; Q1884-H1888 PolarHBondContact O-CD2 2.98Å; Q1884-H1888 VanDerWaalsContact O-CD2 3.26Å; Q1884-H1888 PolarHBondContact O-N 3.18Å; Q1884-H1888 VanDerWaalsContact O-N 3.1Å
1885	R	90.5	Very high	86	Confident	33.4 Å²	33.4	25.6 Å²	25.6	13%	0.126	11%	0.11	C	C	.	.	H	α-helix	trans	-62.2	-42.1	178.4	-68.4	169	-165.2	-121	-0.7	111.7	F1588 I1675 R1750 D1881 L1882 M1883 G1889 V2065	F1588-R1885 HydrophobicContact CE1-CG 4.03Å; F1588-R1885 VanDerWaalsContact CG-NH1 3.26Å; F1588-R1885 HydrophobicContact CZ-CB 4.15Å; F1588-R1885 HydrophobicContact CZ-CG 4.11Å; I1675-R1885 HydrophobicContact CG2-CG 3.92Å; R1750-R1885 VanDerWaalsContact NH2-NH2 3.15Å; D1881-R1885 WeakPolarHBondContact O-CD 3.14Å; D1881-R1885 VanDerWaalsContact O-CG 3.26Å; D1881-R1885 WeakPolarHBondContact O-CG 3.3Å; D1881-R1885 PolarHBondContact O-N 3.06Å; D1881-R1885 VanDerWaalsContact O-N 3.11Å; D1881-R1885 IonicContact OD1-CZ 3.58Å; D1881-R1885 VanDerWaalsContact OD1-CZ 3.24Å; D1881-R1885 IonicContact OD1-NE 3.25Å; D1881-R1885 PolarHBondContact OD1-NE 3.02Å; D1881-R1885 IonicContact OD1-NH2 2.99Å; D1881-R1885 PolarHBondContact OD1-NH2 3.18Å; D1881-R1885 IonicContact OD2-CZ 3.37Å; D1881-R1885 VanDerWaalsContact OD2-CZ 3.25Å; D1881-R1885 IonicContact OD2-NE 2.96Å; D1881-R1885 PolarHBondContact OD2-NE 3.33Å; D1881-R1885 IonicContact OD2-NH2 3.32Å; D1881-R1885 PolarHBondContact OD2-NH2 3.18Å; L1882-R1885 PolarHBondContact O-N 3.26Å; L1882-R1885 VanDerWaalsContact O-N 3.11Å; M1883-R1885 VanDerWaalsContact C-N 3.34Å; M1883-R1885 PolarHBondContact O-N 3.01Å; R1885-G1889 WeakPolarHBondContact O-CA 3.33Å; R1885-G1889 PolarHBondContact O-N 2.98Å; R1885-G1889 VanDerWaalsContact O-N 3.09Å; R1885-V2065 HydrophobicContact CB-CG1 3.8Å; R1885-V2065 HydrophobicContact CG-CG1 4.24Å
1886	L	90.2	Very high	86.9	Confident	4.4 Å²	4.4	26.4 Å²	26.4	2%	0.023	11%	0.114	C	C	.	.	H	α-helix	trans	-64.5	-43.5	177.9	-73.9	177.5	0	0	0	112.8	L1882 M1883 Q1884 G1889 H1908 L1909 L2066 L2070 I2073	L1882-L1886 WeakPolarHBondContact O-CB 3.44Å; L1882-L1886 VanDerWaalsContact O-CG 3.31Å; L1882-L1886 WeakPolarHBondContact O-CG 3.32Å; L1882-L1886 PolarHBondContact O-N 3.01Å; M1883-L1886 PolarHBondContact O-N 3.03Å; Q1884-L1886 VanDerWaalsContact C-N 3.32Å; Q1884-L1886 PolarHBondContact O-N 3.08Å; L1886-G1889 PolarHBondContact O-N 3.24Å; L1886-H1908 CarbonylContact O-C 3.55Å; L1886-H1908 WeakPolarHBondContact O-CA 3.34Å; L1886-L1909 HydrophobicContact CB-CB 3.88Å; L1886-L1909 HydrophobicContact CB-CD2 3.99Å; L1886-L1909 HydrophobicContact CD1-CD2 4.22Å; L1886-L1909 WeakPolarHBondContact O-CB 3.46Å; L1886-L1909 PolarHBondContact O-N 3.07Å; L1886-L2066 HydrophobicContact CD2-CD2 3.75Å; L1886-L2070 HydrophobicContact CD1-CD2 4.43Å; L1886-L2070 HydrophobicContact CD2-CD2 4.13Å; L1886-L2070 HydrophobicContact CD2-CG 4.31Å; L1886-I2073 HydrophobicContact CD1-CD1 3.49Å; L1886-I2073 VanDerWaalsContact CD1-CD1 3.47Å
1887	Q	88.3	Confident	87.6	Confident	14.4 Å²	14.4	22.9 Å²	22.9	7%	0.067	11%	0.109	C	C	.	.	H	α-helix	trans	-71.2	-41.2	-177.5	-73.6	-173.5	-4.1	0	0	112.6	L1864 M1883 Q1884 G1889 L1909 T1911	L1864-Q1887 HydrophobicContact CD1-CB 3.85Å; L1864-Q1887 WeakPolarHBondContact CD1-O 3.39Å; M1883-Q1887 HydrophobicContact CG-CG 4.47Å; M1883-Q1887 WeakPolarHBondContact O-CB 3.36Å; M1883-Q1887 WeakPolarHBondContact O-CG 3.32Å; M1883-Q1887 PolarHBondContact O-N 2.98Å; M1883-Q1887 HydrophobicContact SD-CG 4.06Å; M1883-Q1887 PolarHBondContact SD-NE2 3.01Å; M1883-Q1887 VanDerWaalsContact SD-NE2 3.41Å; Q1884-Q1887 PolarHBondContact O-N 3.14Å; Q1887-G1889 VanDerWaalsContact C-N 3.28Å; Q1887-G1889 PolarHBondContact O-N 3.05Å; Q1887-L1909 WeakPolarHBondContact CA-O 3.23Å; Q1887-L1909 HydrophobicContact CG-CB 4.43Å; Q1887-L1909 HydrophobicContact CG-CD2 4.2Å; Q1887-L1909 HydrophobicContact CG-CG 4.42Å; Q1887-T1911 PolarHBondContact NE2-O 3.41Å
1888	H	88.1	Confident	88.1	Confident	34.6 Å²	34.6	21.9 Å²	21.9	16%	0.16	11%	0.112	C	C	.	.	H	α-helix	trans	-70	-26.3	172.6	-75.9	-78.7	0	0	0	112.5	N1674 Q1862 L1864 Q1884 H1906	N1674-H1888 VanDerWaalsContact CG-CE1 3.44Å; N1674-H1888 PolarHBondContact ND2-ND1 3.2Å; N1674-H1888 VanDerWaalsContact ND2-ND1 3.14Å; N1674-H1888 PolarHBondContact OD1-CE1 3.12Å; N1674-H1888 VanDerWaalsContact OD1-CE1 3.31Å; Q1862-H1888 PolarHBondContact O-CE1 2.86Å; Q1862-H1888 PolarHBondContact O-NE2 3.25Å; Q1862-H1888 VanDerWaalsContact O-NE2 3.16Å; L1864-H1888 VanDerWaalsContact CD2-CE1 3.48Å; L1864-H1888 WeakPolarHBondContact CD2-CE1 3.42Å; L1864-H1888 WeakPolarHBondContact CD2-ND1 3.3Å; Q1884-H1888 PolarHBondContact NE2-CD2 3.43Å; Q1884-H1888 PolarHBondContact NE2-NE2 3.36Å; Q1884-H1888 WeakPolarHBondContact O-CB 3.44Å; Q1884-H1888 PolarHBondContact O-CD2 2.98Å; Q1884-H1888 VanDerWaalsContact O-CD2 3.26Å; Q1884-H1888 PolarHBondContact O-N 3.18Å; Q1884-H1888 VanDerWaalsContact O-N 3.1Å; H1888-H1906 PolarHBondContact O-CE1 3.12Å; H1888-H1906 VanDerWaalsContact O-CE1 3.31Å; H1888-H1906 PolarHBondContact O-NE2 3.21Å
1889	G	90.5	Very high	88.5	Confident	4.6 Å²	4.6	24.5 Å²	24.5	5%	0.047	13%	0.128	C	C	.	.			trans	85.2	166.4	172.4	0	0	0	0	0	114.7	E1584 R1885 L1886 Q1887 H1906 L1907	E1584-G1889 WeakPolarHBondContact CG-O 3.34Å; R1885-G1889 WeakPolarHBondContact O-CA 3.33Å; R1885-G1889 PolarHBondContact O-N 2.98Å; R1885-G1889 VanDerWaalsContact O-N 3.09Å; L1886-G1889 PolarHBondContact O-N 3.24Å; Q1887-G1889 VanDerWaalsContact C-N 3.28Å; Q1887-G1889 PolarHBondContact O-N 3.05Å; G1889-H1906 WeakPolarHBondContact CA-NE2 3.44Å; G1889-H1906 PolarHBondContact O-CE1 3.11Å; G1889-L1907 CarbonylContact C-O 3.46Å; G1889-L1907 WeakPolarHBondContact CA-O 3.35Å
1890	C	93.2	Very high	88.7	Confident	6.2 Å²	6.2	24.7 Å²	24.7	4%	0.042	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	149.7	-176.8	-64	0	0	0	0	112	E1584 H1906 L1907 T2062 L2066	E1584-C1890 HydrophobicContact CG-CB 4.28Å; C1890-H1906 PolarHBondContact N-CE1 2.84Å; C1890-H1906 PolarHBondContact N-NE2 2.85Å; C1890-H1906 PolarHBondContact O-CD2 3.23Å; C1890-L1907 PolarHBondContact N-O 3.13Å; C1890-L1907 PolarHBondContact O-N 3.02Å; C1890-T2062 HydrophobicContact CB-CG2 3.72Å; C1890-L2066 HydrophobicContact CB-CD1 4.13Å; C1890-L2066 HydrophobicContact CB-CD2 4.19Å; C1890-L2066 HydrophobicContact CB-CG 4.31Å
1891	S	92.2	Very high	89	Confident	11.8 Å²	11.8	32.1 Å²	32.1	8%	0.083	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	128.9	170	-60.5	0	0	0	0	110.7	F1582 E1584 C1905	F1582-S1891 VanDerWaalsContact CD1-O 3.27Å; F1582-S1891 WeakPolarHBondContact CD1-O 3.33Å; E1584-S1891 WeakPolarHBondContact OE2-CB 3.28Å; E1584-S1891 PolarHBondContact OE2-N 3.27Å; E1584-S1891 PolarHBondContact OE2-OG 3.11Å; S1891-C1905 WeakPolarHBondContact CA-O 3.42Å
1892	V	93.3	Very high	89.3	Confident	0.4 Å²	0.4	32.8 Å²	32.8	0%	0.002	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	160.6	-179.3	-57.6	0	0	0	0	110.6	C1905 L1907 F2056 A2058 L2066	V1892-C1905 HydrophobicContact CG2-CB 4.4Å; V1892-C1905 PolarHBondContact N-O 3.2Å; V1892-C1905 CarbonylContact O-C 3.58Å; V1892-C1905 WeakPolarHBondContact O-CA 3.46Å; V1892-C1905 PolarHBondContact O-N 3.09Å; V1892-C1905 VanDerWaalsContact O-O 3.06Å; V1892-L1907 HydrophobicContact CG1-CB 4.23Å; V1892-L1907 HydrophobicContact CG1-CD2 4.32Å; V1892-L1907 HydrophobicContact CG2-CB 3.62Å; V1892-L1907 HydrophobicContact CG2-CD2 4.32Å; V1892-F2056 HydrophobicContact CB-CD1 4.43Å; V1892-F2056 HydrophobicContact CG2-CD1 3.78Å; V1892-F2056 HydrophobicContact CG2-CE1 4.36Å; V1892-F2056 HydrophobicContact CG2-CG 4.46Å; V1892-A2058 HydrophobicContact CG1-CB 4.12Å; V1892-L2066 HydrophobicContact CG1-CD1 3.5Å; V1892-L2066 VanDerWaalsContact CG1-CD1 3.44Å
1893	I	92.9	Very high	89.4	Confident	0.6 Å²	0.6	32 Å²	32	0%	0.003	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	116.5	170.3	-60.2	165.6	0	0	0	107.9	F1582 A1903 F1904 V2025 Y2026 H2029 F2056 V2057	F1582-I1893 HydrophobicContact CZ-CD1 4.06Å; F1582-I1893 HydrophobicContact CZ-CG1 4.18Å; I1893-A1903 CarbonylContact C-O 3.49Å; I1893-A1903 WeakPolarHBondContact CA-O 3.39Å; I1893-F1904 HydrophobicContact CG1-CD2 3.96Å; I1893-F1904 HydrophobicContact CG1-CE2 4.44Å; I1893-V2025 HydrophobicContact CG2-CG1 4.16Å; I1893-Y2026 HydrophobicContact CD1-CD2 3.89Å; I1893-Y2026 HydrophobicContact CD1-CE2 4.38Å; I1893-H2029 HydrophobicContact CD1-CB 3.91Å; I1893-H2029 HydrophobicContact CG1-CB 4.43Å; I1893-F2056 CarbonylContact O-C 3.54Å; I1893-F2056 VanDerWaalsContact O-CA 3.29Å; I1893-F2056 WeakPolarHBondContact O-CA 3.36Å; I1893-V2057 HydrophobicContact CB-CB 4.23Å; I1893-V2057 WeakPolarHBondContact CB-O 3.38Å; I1893-V2057 PolarHBondContact N-O 3.11Å; I1893-V2057 PolarHBondContact O-N 3.06Å
1894	Y	93.5	Very high	89.6	Confident	3.2 Å²	3.2	32.4 Å²	32.4	1%	0.013	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	132.7	168.8	172.5	-125.4	0	0	0	109.4	E1896 S1902 A1903 W1918 M1999 V2054 F2056	Y1894-E1896 HydrophobicContact CE1-CB 4.3Å; Y1894-S1902 CarbonylContact O-C 3.53Å; Y1894-S1902 VanDerWaalsContact O-CA 3.23Å; Y1894-S1902 WeakPolarHBondContact O-CA 3.39Å; Y1894-S1902 VanDerWaalsContact O-CB 3.29Å; Y1894-S1902 WeakPolarHBondContact O-CB 3.3Å; Y1894-A1903 PolarHBondContact N-O 3.2Å; Y1894-A1903 PolarHBondContact O-N 3.32Å; Y1894-W1918 AromaticContact CD1-NE1 3.83Å; Y1894-W1918 HydrophobicContact CD2-CZ2 4.4Å; Y1894-W1918 AromaticContact CE2-CZ2 3.96Å; Y1894-W1918 HydrophobicContact CE2-CZ2 4.14Å; Y1894-W1918 AromaticContact CG-NE1 3.89Å; Y1894-M1999 HydrophobicContact CD1-SD 4Å; Y1894-M1999 HydrophobicContact CE1-CG 4.42Å; Y1894-M1999 HydrophobicContact CE1-SD 3.81Å; Y1894-V2054 HydrophobicContact CD2-CG1 3.99Å; Y1894-V2054 HydrophobicContact CE2-CB 4.13Å; Y1894-V2054 HydrophobicContact CE2-CG1 3.93Å; Y1894-V2054 HydrophobicContact CE2-CG2 4.4Å; Y1894-F2056 HydrophobicContact CD2-CD1 4.32Å; Y1894-F2056 AromaticContact CD2-CE1 3.83Å; Y1894-F2056 HydrophobicContact CD2-CE1 3.89Å; Y1894-F2056 HydrophobicContact CD2-CZ 4.3Å; Y1894-F2056 HydrophobicContact CG-CE1 4.38Å
1895	Y	91.5	Very high	89.8	Confident	18 Å²	18	32.4 Å²	32.4	7%	0.071	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	129.8	176.2	-177.4	-102.9	0	0	0	111.3	C1897 R1901 F2020 V2025 Y2055	Y1895-C1897 HydrophobicContact CE1-CB 4.3Å; Y1895-C1897 VanDerWaalsContact CE1-SG 3.59Å; Y1895-R1901 VanDerWaalsContact CD2-O 3.28Å; Y1895-R1901 WeakPolarHBondContact CD2-O 3.36Å; Y1895-F2020 AromaticContact CD1-CD1 3.78Å; Y1895-F2020 HydrophobicContact CD1-CD1 3.78Å; Y1895-F2020 AromaticContact CD1-CD2 3.91Å; Y1895-F2020 HydrophobicContact CD1-CD2 4.06Å; Y1895-F2020 AromaticContact CD1-CE1 3.55Å; Y1895-F2020 HydrophobicContact CD1-CE1 3.55Å; Y1895-F2020 VanDerWaalsContact CD1-CE1 3.4Å; Y1895-F2020 AromaticContact CD1-CE2 3.86Å; Y1895-F2020 HydrophobicContact CD1-CE2 3.86Å; Y1895-F2020 AromaticContact CD1-CG 3.95Å; Y1895-F2020 HydrophobicContact CD1-CG 4.01Å; Y1895-F2020 AromaticContact CD1-CZ 3.59Å; Y1895-F2020 HydrophobicContact CD1-CZ 3.59Å; Y1895-F2020 HydrophobicContact CE1-CB 3.95Å; Y1895-F2020 AromaticContact CE1-CD1 3.31Å; Y1895-F2020 HydrophobicContact CE1-CD1 3.31Å; Y1895-F2020 AromaticContact CE1-CD2 3.77Å; Y1895-F2020 HydrophobicContact CE1-CD2 3.84Å; Y1895-F2020 AromaticContact CE1-CE1 3.61Å; Y1895-F2020 HydrophobicContact CE1-CE1 3.61Å; Y1895-F2020 HydrophobicContact CE1-CE2 4.12Å; Y1895-F2020 AromaticContact CE1-CG 3.42Å; Y1895-F2020 HydrophobicContact CE1-CG 3.42Å; Y1895-F2020 VanDerWaalsContact CE1-CG 3.48Å; Y1895-F2020 AromaticContact CE1-CZ 3.97Å; Y1895-F2020 HydrophobicContact CE1-CZ 4.01Å; Y1895-F2020 HydrophobicContact CE2-CD2 4.41Å; Y1895-F2020 HydrophobicContact CG-CD2 4.48Å; Y1895-F2020 HydrophobicContact CG-CE1 4.29Å; Y1895-F2020 HydrophobicContact CG-CE2 4.23Å; Y1895-F2020 HydrophobicContact CG-CZ 4.27Å; Y1895-F2020 AromaticContact CZ-CD2 3.99Å; Y1895-F2020 AromaticContact CZ-CG 3.8Å; Y1895-F2020 WeakPolarHBondContact OH-CB 3.47Å; Y1895-V2025 HydrophobicContact CD2-CG1 3.91Å; Y1895-V2025 HydrophobicContact CD2-CG2 3.79Å; Y1895-V2025 HydrophobicContact CE2-CG1 4.46Å; Y1895-V2025 HydrophobicContact CE2-CG2 3.66Å; Y1895-V2025 HydrophobicContact CG-CG1 4.37Å; Y1895-V2025 HydrophobicContact CG-CG2 4.37Å; Y1895-Y2055 PolarHBondContact N-O 2.91Å
1896	E	88.7	Confident	89.8	Confident	36.8 Å²	36.8	32.4 Å²	32.4	17%	0.172	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	106.1	178.3	-175.3	175.3	-117.2	0	0	109.6	Y1894 E1898 T1899 A1900 R1901 M1999	Y1894-E1896 HydrophobicContact CE1-CB 4.3Å; E1896-E1898 VanDerWaalsContact C-N 3.33Å; E1896-E1898 HydrophobicContact CG-CB 4.49Å; E1896-E1898 PolarHBondContact O-N 3.25Å; E1896-T1899 HydrophobicContact CG-CG2 4.37Å; E1896-T1899 PolarHBondContact O-N 2.89Å; E1896-T1899 WeakPolarHBondContact OE2-CB 3.4Å; E1896-T1899 VanDerWaalsContact OE2-CG2 3.27Å; E1896-T1899 WeakPolarHBondContact OE2-CG2 3.35Å; E1896-T1899 PolarHBondContact OE2-OG1 3.22Å; E1896-A1900 VanDerWaalsContact O-CA 3.31Å; E1896-A1900 WeakPolarHBondContact O-CA 3.27Å; E1896-A1900 PolarHBondContact O-N 3.23Å; E1896-R1901 PolarHBondContact N-O 3.09Å; E1896-R1901 PolarHBondContact O-N 3.02Å; E1896-M1999 HydrophobicContact CB-SD 3.95Å; E1896-M1999 WeakPolarHBondContact OE2-CG 3.48Å
1897	C	83.6	Confident	90	Very high	58 Å²	58	32.3 Å²	32.3	39%	0.392	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-37.3	-176.5	-61.6	0	0	0	0	112.9	Y1895 T1899 A1900 Y2055	Y1895-C1897 HydrophobicContact CE1-CB 4.3Å; Y1895-C1897 VanDerWaalsContact CE1-SG 3.59Å; C1897-T1899 VanDerWaalsContact C-N 3.3Å; C1897-T1899 PolarHBondContact O-N 3.09Å; C1897-A1900 PolarHBondContact O-N 3.28Å; C1897-Y2055 VanDerWaalsContact SG-CD2 3.51Å; C1897-Y2055 WeakPolarHBondContact SG-CD2 3.42Å; C1897-Y2055 VanDerWaalsContact SG-CE2 3.51Å; C1897-Y2055 WeakPolarHBondContact SG-CE2 3.3Å
1898	E	82.8	Confident	90.2	Very high	155.2 Å²	155.2	33.6 Å²	33.6	73%	0.725	17%	0.173	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-35	-176.7	-64.3	173.9	-151.2	0	0	112.7	E1896 R1997	E1896-E1898 VanDerWaalsContact C-N 3.33Å; E1896-E1898 HydrophobicContact CG-CB 4.49Å; E1896-E1898 PolarHBondContact O-N 3.25Å; E1898-R1997 IonicContact OE1-CZ 3.45Å; E1898-R1997 IonicContact OE1-NH1 2.71Å; E1898-R1997 IonicContact OE1-NH2 3.12Å; E1898-R1997 PolarHBondContact OE1-NH2 2.87Å
1899	T	86.8	Confident	90.3	Very high	62.4 Å²	62.4	32.1 Å²	32.1	38%	0.383	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.9	-4.7	-178.2	67.8	0	0	0	0	113.3	E1896 C1897 R1901	E1896-T1899 HydrophobicContact CG-CG2 4.37Å; E1896-T1899 PolarHBondContact O-N 2.89Å; E1896-T1899 WeakPolarHBondContact OE2-CB 3.4Å; E1896-T1899 VanDerWaalsContact OE2-CG2 3.27Å; E1896-T1899 WeakPolarHBondContact OE2-CG2 3.35Å; E1896-T1899 PolarHBondContact OE2-OG1 3.22Å; C1897-T1899 VanDerWaalsContact C-N 3.3Å; C1897-T1899 PolarHBondContact O-N 3.09Å; T1899-R1901 WeakPolarHBondContact O-CG 3.25Å; T1899-R1901 PolarHBondContact O-N 3.09Å; T1899-R1901 VanDerWaalsContact O-N 3.13Å; T1899-R1901 WeakPolarHBondContact OG1-CB 3.27Å; T1899-R1901 WeakPolarHBondContact OG1-CD 3.38Å; T1899-R1901 VanDerWaalsContact OG1-CG 3.29Å; T1899-R1901 WeakPolarHBondContact OG1-CG 3.44Å; T1899-R1901 PolarHBondContact OG1-N 3.05Å
1900	A	86.1	Confident	90.1	Very high	46.6 Å²	46.6	32.6 Å²	32.6	39%	0.385	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.5	23.2	-170.1	0	0	0	0	0	114.3	E1896 C1897 R2028	E1896-A1900 VanDerWaalsContact O-CA 3.31Å; E1896-A1900 WeakPolarHBondContact O-CA 3.27Å; E1896-A1900 PolarHBondContact O-N 3.23Å; C1897-A1900 PolarHBondContact O-N 3.28Å; A1900-R2028 PolarHBondContact O-NH1 3.2Å; A1900-R2028 VanDerWaalsContact O-NH1 3.08Å
1901	R	90	Very high	89.4	Confident	156.6 Å²	156.6	33.7 Å²	33.7	59%	0.591	18%	0.175	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-91	153.3	179.5	-63.1	175.3	165.3	-177.4	-0.8	110.7	Y1895 E1896 T1899 M1999	Y1895-R1901 VanDerWaalsContact CD2-O 3.28Å; Y1895-R1901 WeakPolarHBondContact CD2-O 3.36Å; E1896-R1901 PolarHBondContact N-O 3.09Å; E1896-R1901 PolarHBondContact O-N 3.02Å; T1899-R1901 WeakPolarHBondContact O-CG 3.25Å; T1899-R1901 PolarHBondContact O-N 3.09Å; T1899-R1901 VanDerWaalsContact O-N 3.13Å; T1899-R1901 WeakPolarHBondContact OG1-CB 3.27Å; T1899-R1901 WeakPolarHBondContact OG1-CD 3.38Å; T1899-R1901 VanDerWaalsContact OG1-CG 3.29Å; T1899-R1901 WeakPolarHBondContact OG1-CG 3.44Å; T1899-R1901 PolarHBondContact OG1-N 3.05Å; R1901-M1999 HydrophobicContact CB-CE 3.52Å; R1901-M1999 VanDerWaalsContact CB-CE 3.44Å; R1901-M1999 HydrophobicContact CB-SD 4.08Å
1902	S	91.1	Very high	88.6	Confident	18 Å²	18	33.7 Å²	33.7	13%	0.126	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	144.4	173.3	52.3	0	0	0	0	111.4	Y1894 M1999 H2029	Y1894-S1902 CarbonylContact O-C 3.53Å; Y1894-S1902 VanDerWaalsContact O-CA 3.23Å; Y1894-S1902 WeakPolarHBondContact O-CA 3.39Å; Y1894-S1902 VanDerWaalsContact O-CB 3.29Å; Y1894-S1902 WeakPolarHBondContact O-CB 3.3Å; S1902-M1999 VanDerWaalsContact CA-CE 3.41Å; S1902-H2029 WeakPolarHBondContact CB-NE2 3.41Å; S1902-H2029 PolarHBondContact OG-NE2 3.14Å
1903	A	90	Very high	88.2	Confident	4.2 Å²	4.2	33.7 Å²	33.7	4%	0.035	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	139.9	177.5	0	0	0	0	0	110.8	I1893 Y1894 C1905 K1920 M1999	I1893-A1903 CarbonylContact C-O 3.49Å; I1893-A1903 WeakPolarHBondContact CA-O 3.39Å; Y1894-A1903 PolarHBondContact N-O 3.2Å; Y1894-A1903 PolarHBondContact O-N 3.32Å; A1903-C1905 PolarHBondContact O-N 3.17Å; A1903-C1905 PolarHBondContact O-SG 3.08Å; A1903-C1905 VanDerWaalsContact O-SG 3.32Å; A1903-K1920 HydrophobicContact CB-CD 4.47Å; A1903-K1920 HydrophobicContact CB-CG 4.47Å; A1903-M1999 HydrophobicContact CB-CE 3.8Å; A1903-M1999 VanDerWaalsContact CB-CE 3.49Å; A1903-M1999 HydrophobicContact CB-CG 4.28Å; A1903-M1999 WeakPolarHBondContact CB-O 3.38Å
1904	F	90.4	Very high	87.6	Confident	10 Å²	10	34.5 Å²	34.5	4%	0.044	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	116.7	175.2	-167.9	-87.2	0	0	0	109.7	Y1581 F1582 I1893 S1921 F1923 S1924 L1927 H2029	Y1581-F1904 VanDerWaalsContact O-CZ 3.23Å; Y1581-F1904 WeakPolarHBondContact O-CZ 3.42Å; F1582-F1904 HydrophobicContact CD1-CE2 4.11Å; F1582-F1904 HydrophobicContact CD1-CZ 4.18Å; F1582-F1904 HydrophobicContact CE1-CD2 4.49Å; F1582-F1904 AromaticContact CE1-CE2 3.59Å; F1582-F1904 HydrophobicContact CE1-CE2 3.59Å; F1582-F1904 HydrophobicContact CE1-CZ 4.08Å; F1582-F1904 HydrophobicContact CE2-CE2 4.29Å; F1582-F1904 HydrophobicContact CZ-CD2 4.42Å; F1582-F1904 AromaticContact CZ-CE2 3.7Å; F1582-F1904 HydrophobicContact CZ-CE2 3.7Å; I1893-F1904 HydrophobicContact CG1-CD2 3.96Å; I1893-F1904 HydrophobicContact CG1-CE2 4.44Å; F1904-S1921 WeakPolarHBondContact O-CB 3.36Å; F1904-S1921 PolarHBondContact O-N 3.1Å; F1904-F1923 HydrophobicContact CD1-CZ 4.39Å; F1904-S1924 PolarHBondContact N-OG 3.01Å; F1904-S1924 PolarHBondContact O-OG 3.44Å; F1904-S1924 VanDerWaalsContact O-OG 3.06Å; F1904-L1927 HydrophobicContact CB-CD1 3.97Å; F1904-L1927 HydrophobicContact CD1-CD1 4.01Å; F1904-L1927 HydrophobicContact CD2-CD1 3.97Å; F1904-L1927 HydrophobicContact CE2-CD1 4.39Å; F1904-L1927 HydrophobicContact CG-CD1 3.81Å; F1904-H2029 HydrophobicContact CD2-CB 4.39Å
1905	C	91.7	Very high	87.3	Confident	0.2 Å²	0.2	35.4 Å²	35.4	0%	0.001	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	157.2	-167	-64	0	0	0	0	111.9	S1891 V1892 A1903 W1918 Q1919	S1891-C1905 WeakPolarHBondContact CA-O 3.42Å; V1892-C1905 HydrophobicContact CG2-CB 4.4Å; V1892-C1905 PolarHBondContact N-O 3.2Å; V1892-C1905 CarbonylContact O-C 3.58Å; V1892-C1905 WeakPolarHBondContact O-CA 3.46Å; V1892-C1905 PolarHBondContact O-N 3.09Å; V1892-C1905 VanDerWaalsContact O-O 3.06Å; A1903-C1905 PolarHBondContact O-N 3.17Å; A1903-C1905 PolarHBondContact O-SG 3.08Å; A1903-C1905 VanDerWaalsContact O-SG 3.32Å; C1905-W1918 HydrophobicContact CB-CB 4.24Å; C1905-Q1919 CarbonylContact C-O 3.51Å; C1905-Q1919 VanDerWaalsContact CA-O 3.31Å; C1905-Q1919 WeakPolarHBondContact CA-O 3.31Å; C1905-Q1919 WeakPolarHBondContact CB-O 3.44Å
1906	H	91.5	Very high	87.4	Confident	34.2 Å²	34.2	34.7 Å²	34.7	16%	0.158	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	113.5	167	-173.1	-102.8	0	0	0	109.5	R1667 H1888 G1889 C1890 H1908 W1918 Q1919	R1667-H1906 PolarHBondContact NH1-CE1 3.15Å; R1667-H1906 PolarHBondContact NH1-ND1 3.02Å; R1667-H1906 PolarHBondContact NH2-CD2 3.19Å; R1667-H1906 PolarHBondContact NH2-CE1 3.21Å; R1667-H1906 PolarHBondContact NH2-NE2 3.48Å; H1888-H1906 PolarHBondContact O-CE1 3.12Å; H1888-H1906 VanDerWaalsContact O-CE1 3.31Å; H1888-H1906 PolarHBondContact O-NE2 3.21Å; G1889-H1906 WeakPolarHBondContact CA-NE2 3.44Å; G1889-H1906 PolarHBondContact O-CE1 3.11Å; C1890-H1906 PolarHBondContact N-CE1 2.84Å; C1890-H1906 PolarHBondContact N-NE2 2.85Å; C1890-H1906 PolarHBondContact O-CD2 3.23Å; H1906-H1908 AromaticContact CD2-ND1 3.97Å; H1906-W1918 VanDerWaalsContact O-CA 3.28Å; H1906-W1918 WeakPolarHBondContact O-CA 3.38Å; H1906-Q1919 HydrophobicContact CB-CG 4.29Å; H1906-Q1919 PolarHBondContact N-O 3.25Å; H1906-Q1919 PolarHBondContact O-N 3.25Å; H1906-Q1919 VanDerWaalsContact O-N 3.1Å
1907	L	94.2	Very high	87.5	Confident	2.6 Å²	2.6	34.1 Å²	34.1	1%	0.014	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	128.8	-179.6	179.6	70.8	0	0	0	109.8	G1889 C1890 V1892 I1916 K1917 W1918 F2040 F2056 L2066	G1889-L1907 CarbonylContact C-O 3.46Å; G1889-L1907 WeakPolarHBondContact CA-O 3.35Å; C1890-L1907 PolarHBondContact N-O 3.13Å; C1890-L1907 PolarHBondContact O-N 3.02Å; V1892-L1907 HydrophobicContact CG1-CB 4.23Å; V1892-L1907 HydrophobicContact CG1-CD2 4.32Å; V1892-L1907 HydrophobicContact CG2-CB 3.62Å; V1892-L1907 HydrophobicContact CG2-CD2 4.32Å; L1907-I1916 HydrophobicContact CD1-CB 4.22Å; L1907-I1916 HydrophobicContact CD1-CD1 4.47Å; L1907-I1916 HydrophobicContact CD1-CG2 3.5Å; L1907-I1916 VanDerWaalsContact CD1-CG2 3.49Å; L1907-I1916 HydrophobicContact CG-CG2 4Å; L1907-K1917 WeakPolarHBondContact CA-O 3.29Å; L1907-W1918 HydrophobicContact CB-CB 4.36Å; L1907-W1918 HydrophobicContact CD1-CB 3.96Å; L1907-W1918 HydrophobicContact CD1-CE3 4.31Å; L1907-F2040 HydrophobicContact CD2-CZ 3.97Å; L1907-F2056 HydrophobicContact CD1-CE1 4.1Å; L1907-F2056 HydrophobicContact CD1-CE2 4.23Å; L1907-F2056 HydrophobicContact CD1-CZ 4.22Å; L1907-F2056 HydrophobicContact CD2-CD2 4.44Å; L1907-F2056 HydrophobicContact CD2-CE2 4.41Å; L1907-L2066 HydrophobicContact CD2-CD1 4.24Å; L1907-L2066 HydrophobicContact CD2-CD2 4.13Å
1908	H	92	Very high	87.9	Confident	42 Å²	42	31.3 Å²	31.3	19%	0.194	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	155.3	177.5	62.3	-70.5	0	0	0	111.8	L1886 H1906 I1916 K1917	L1886-H1908 CarbonylContact O-C 3.55Å; L1886-H1908 WeakPolarHBondContact O-CA 3.34Å; H1906-H1908 AromaticContact CD2-ND1 3.97Å; H1908-I1916 WeakPolarHBondContact O-CA 3.4Å; H1908-I1916 WeakPolarHBondContact O-CG2 3.46Å; H1908-K1917 PolarHBondContact N-O 2.98Å; H1908-K1917 PolarHBondContact ND1-O 3.18Å; H1908-K1917 VanDerWaalsContact ND1-O 3.14Å; H1908-K1917 PolarHBondContact O-N 3.08Å
1909	L	90.8	Very high	88.3	Confident	2.2 Å²	2.2	28.5 Å²	28.5	1%	0.012	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	136.1	170.2	178.8	71	0	0	0	109.5	M1883 L1886 Q1887 I1916 L2006 L2070 I2073	M1883-L1909 HydrophobicContact CE-CD2 4.26Å; M1883-L1909 HydrophobicContact SD-CD2 3.64Å; M1883-L1909 VanDerWaalsContact SD-CD2 3.51Å; L1886-L1909 HydrophobicContact CB-CB 3.88Å; L1886-L1909 HydrophobicContact CB-CD2 3.99Å; L1886-L1909 HydrophobicContact CD1-CD2 4.22Å; L1886-L1909 WeakPolarHBondContact O-CB 3.46Å; L1886-L1909 PolarHBondContact O-N 3.07Å; Q1887-L1909 WeakPolarHBondContact CA-O 3.23Å; Q1887-L1909 HydrophobicContact CG-CB 4.43Å; Q1887-L1909 HydrophobicContact CG-CD2 4.2Å; Q1887-L1909 HydrophobicContact CG-CG 4.42Å; L1909-I1916 HydrophobicContact CD1-CG2 4.01Å; L1909-L2006 HydrophobicContact CD1-CD1 3.51Å; L1909-L2006 VanDerWaalsContact CD1-CD1 3.48Å; L1909-L2070 HydrophobicContact CD1-CD2 4.35Å; L1909-I2073 HydrophobicContact CD1-CD1 4.23Å; L1909-I2073 HydrophobicContact CD2-CD1 3.37Å; L1909-I2073 VanDerWaalsContact CD2-CD1 3.46Å; L1909-I2073 HydrophobicContact CG-CD1 4.41Å
1910	D	85.2	Confident	88.2	Confident	16 Å²	16	28.9 Å²	28.9	9%	0.086	14%	0.142	C	C	.	.			trans	-66.5	149	172.8	-175.9	70.7	0	0	0	112.3	T1912 C1913 Y1915 R1986	D1910-T1912 PolarHBondContact O-N 3.34Å; D1910-T1912 VanDerWaalsContact O-N 3.11Å; D1910-T1912 VanDerWaalsContact OD2-CB 3.27Å; D1910-T1912 WeakPolarHBondContact OD2-CB 3.29Å; D1910-T1912 WeakPolarHBondContact OD2-CG2 3.23Å; D1910-T1912 PolarHBondContact OD2-N 3.19Å; D1910-T1912 PolarHBondContact OD2-OG1 2.99Å; D1910-C1913 WeakPolarHBondContact O-CA 3.39Å; D1910-C1913 PolarHBondContact O-N 3.14Å; D1910-Y1915 HydrophobicContact CB-CD1 4.13Å; D1910-Y1915 HydrophobicContact CB-CD2 3.86Å; D1910-Y1915 HydrophobicContact CB-CE1 3.94Å; D1910-Y1915 HydrophobicContact CB-CE2 3.56Å; D1910-Y1915 HydrophobicContact CB-CG 4.18Å; D1910-Y1915 VanDerWaalsContact CB-CZ 3.47Å; D1910-Y1915 WeakPolarHBondContact CB-O 3.35Å; D1910-Y1915 VanDerWaalsContact CG-CE2 3.48Å; D1910-Y1915 VanDerWaalsContact CG-CZ 3.44Å; D1910-Y1915 VanDerWaalsContact CG-OH 3.27Å; D1910-Y1915 PolarHBondContact N-O 3.1Å; D1910-Y1915 VanDerWaalsContact N-O 3.1Å; D1910-Y1915 WeakPolarHBondContact OD1-CE2 3.5Å; D1910-Y1915 PolarHBondContact OD1-OH 3.24Å; D1910-Y1915 WeakPolarHBondContact OD2-CE1 3.39Å; D1910-Y1915 PolarHBondContact OD2-OH 3.01Å; D1910-R1986 IonicContact OD1-CZ 3.63Å; D1910-R1986 IonicContact OD1-NH1 2.87Å; D1910-R1986 PolarHBondContact OD1-NH1 2.67Å; D1910-R1986 IonicContact OD1-NH2 2.84Å; D1910-R1986 PolarHBondContact OD1-NH2 2.85Å; D1910-R1986 IonicContact OD2-NH1 2.84Å; D1910-R1986 IonicContact OD2-NH2 2.72Å; D1910-R1986 PolarHBondContact OD2-NH2 2.93Å
1911	T	78.2	Confident	87.7	Confident	29.6 Å²	29.6	27.5 Å²	27.5	18%	0.182	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-26.5	179.1	53.4	0	0	0	0	113.7	L1864 E1866 T1871 Q1887 C1913	L1864-T1911 HydrophobicContact CB-CG2 3.86Å; L1864-T1911 HydrophobicContact CD1-CG2 3.84Å; L1864-T1911 HydrophobicContact CG-CG2 4.43Å; E1866-T1911 HydrophobicContact CB-CG2 4.33Å; E1866-T1911 WeakPolarHBondContact OE2-CG2 3.34Å; E1866-T1911 PolarHBondContact OE2-OG1 2.89Å; T1871-T1911 PolarHBondContact OG1-O 2.87Å; Q1887-T1911 PolarHBondContact NE2-O 3.41Å; T1911-C1913 VanDerWaalsContact C-N 3.29Å; T1911-C1913 PolarHBondContact O-N 3.36Å
1912	T	76.6	Confident	86.4	Confident	10.4 Å²	10.4	26.5 Å²	26.5	6%	0.064	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-4.7	175.7	69.4	0	0	0	0	113.7	S1869 T1871 L1872 D1910 S1914 L2096	S1869-T1912 WeakPolarHBondContact OG-CG2 3.22Å; T1871-T1912 CarbonylContact C-O 3.58Å; T1871-T1912 WeakPolarHBondContact OG1-CA 3.48Å; L1872-T1912 WeakPolarHBondContact CB-O 3.35Å; L1872-T1912 PolarHBondContact N-O 2.98Å; D1910-T1912 PolarHBondContact O-N 3.34Å; D1910-T1912 VanDerWaalsContact O-N 3.11Å; D1910-T1912 VanDerWaalsContact OD2-CB 3.27Å; D1910-T1912 WeakPolarHBondContact OD2-CB 3.29Å; D1910-T1912 WeakPolarHBondContact OD2-CG2 3.23Å; D1910-T1912 PolarHBondContact OD2-N 3.19Å; D1910-T1912 PolarHBondContact OD2-OG1 2.99Å; T1912-S1914 VanDerWaalsContact C-N 3.25Å; T1912-S1914 PolarHBondContact O-N 3.04Å; T1912-S1914 VanDerWaalsContact O-N 3.16Å; T1912-S1914 VanDerWaalsContact OG1-CB 3.26Å; T1912-S1914 WeakPolarHBondContact OG1-CB 3.3Å; T1912-S1914 PolarHBondContact OG1-N 3.21Å; T1912-S1914 PolarHBondContact OG1-OG 3.21Å; T1912-L2096 HydrophobicContact CG2-CD2 3.81Å
1913	C	83.6	Confident	84.8	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.139	C	C	.	.	S	Bend	trans	55.2	30.8	-172.2	-55.6	0	0	0	0	113.6	T1871 M1873 D1910 T1911 L2006 I2073	T1871-C1913 HydrophobicContact CG2-CB 4.38Å; M1873-C1913 HydrophobicContact CE-CB 3.87Å; M1873-C1913 HydrophobicContact CG-CB 4.29Å; M1873-C1913 HydrophobicContact SD-CB 4.06Å; D1910-C1913 WeakPolarHBondContact O-CA 3.39Å; D1910-C1913 PolarHBondContact O-N 3.14Å; T1911-C1913 VanDerWaalsContact C-N 3.29Å; T1911-C1913 PolarHBondContact O-N 3.36Å; C1913-L2006 WeakPolarHBondContact O-CD1 3.42Å; C1913-I2073 HydrophobicContact CB-CG2 4.41Å
1914	S	81.2	Confident	82.7	Confident	18.6 Å²	18.6	28.4 Å²	28.4	13%	0.13	14%	0.144	C	C	.	.	S	Bend	trans	-96.6	-27.3	-177.9	49.5	0	0	0	0	114	T1912 L2006	T1912-S1914 VanDerWaalsContact C-N 3.25Å; T1912-S1914 PolarHBondContact O-N 3.04Å; T1912-S1914 VanDerWaalsContact O-N 3.16Å; T1912-S1914 VanDerWaalsContact OG1-CB 3.26Å; T1912-S1914 WeakPolarHBondContact OG1-CB 3.3Å; T1912-S1914 PolarHBondContact OG1-N 3.21Å; T1912-S1914 PolarHBondContact OG1-OG 3.21Å; S1914-L2006 PolarHBondContact O-N 3.26Å
1915	Y	87.4	Confident	80.3	Confident	21.6 Å²	21.6	32 Å²	32	9%	0.085	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	158.4	179.3	58.8	-98	0	0	0	112.4	D1910 K1917 R1986 L2003 I2004	D1910-Y1915 HydrophobicContact CB-CD1 4.13Å; D1910-Y1915 HydrophobicContact CB-CD2 3.86Å; D1910-Y1915 HydrophobicContact CB-CE1 3.94Å; D1910-Y1915 HydrophobicContact CB-CE2 3.56Å; D1910-Y1915 HydrophobicContact CB-CG 4.18Å; D1910-Y1915 VanDerWaalsContact CB-CZ 3.47Å; D1910-Y1915 WeakPolarHBondContact CB-O 3.35Å; D1910-Y1915 VanDerWaalsContact CG-CE2 3.48Å; D1910-Y1915 VanDerWaalsContact CG-CZ 3.44Å; D1910-Y1915 VanDerWaalsContact CG-OH 3.27Å; D1910-Y1915 PolarHBondContact N-O 3.1Å; D1910-Y1915 VanDerWaalsContact N-O 3.1Å; D1910-Y1915 WeakPolarHBondContact OD1-CE2 3.5Å; D1910-Y1915 PolarHBondContact OD1-OH 3.24Å; D1910-Y1915 WeakPolarHBondContact OD2-CE1 3.39Å; D1910-Y1915 PolarHBondContact OD2-OH 3.01Å; Y1915-K1917 HydrophobicContact CD2-CB 4.25Å; Y1915-K1917 HydrophobicContact CE2-CB 4.11Å; Y1915-R1986 HydrophobicContact CE1-CG 4.32Å; Y1915-R1986 PolarHBondContact OH-NE 3.16Å; Y1915-R1986 PolarHBondContact OH-NH1 3.15Å; Y1915-R1986 VanDerWaalsContact OH-NH1 3.13Å; Y1915-R1986 PolarHBondContact OH-NH2 3.42Å; Y1915-L2003 VanDerWaalsContact CB-CD2 3.47Å; Y1915-L2003 HydrophobicContact CD1-CD1 4.35Å; Y1915-L2003 HydrophobicContact CD1-CD2 4.43Å; Y1915-L2003 HydrophobicContact CD2-CD1 3.43Å; Y1915-L2003 VanDerWaalsContact CD2-CD1 3.45Å; Y1915-L2003 HydrophobicContact CD2-CD2 3.93Å; Y1915-L2003 HydrophobicContact CD2-CG 3.7Å; Y1915-L2003 VanDerWaalsContact CD2-CG 3.46Å; Y1915-L2003 HydrophobicContact CE1-CD1 4.39Å; Y1915-L2003 HydrophobicContact CE2-CD1 3.6Å; Y1915-L2003 VanDerWaalsContact CE2-CD1 3.46Å; Y1915-L2003 HydrophobicContact CE2-CG 4.07Å; Y1915-L2003 HydrophobicContact CG-CD1 3.87Å; Y1915-L2003 HydrophobicContact CG-CD2 3.73Å; Y1915-L2003 HydrophobicContact CG-CG 3.98Å; Y1915-I2004 CarbonylContact C-O 3.54Å; Y1915-I2004 VanDerWaalsContact CA-O 3.23Å; Y1915-I2004 WeakPolarHBondContact CA-O 3.39Å; Y1915-I2004 VanDerWaalsContact CB-O 3.26Å; Y1915-I2004 WeakPolarHBondContact CB-O 3.32Å
1916	I	92.5	Very high	77.8	Confident	4.4 Å²	4.4	34.4 Å²	34.4	2%	0.023	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	137.9	164.9	18.3	171.1	0	0	0	108.6	L1907 H1908 L1909 L2003 I2004 L2006 V2042 L2070	L1907-I1916 HydrophobicContact CD1-CB 4.22Å; L1907-I1916 HydrophobicContact CD1-CD1 4.47Å; L1907-I1916 HydrophobicContact CD1-CG2 3.5Å; L1907-I1916 VanDerWaalsContact CD1-CG2 3.49Å; L1907-I1916 HydrophobicContact CG-CG2 4Å; H1908-I1916 WeakPolarHBondContact O-CA 3.4Å; H1908-I1916 WeakPolarHBondContact O-CG2 3.46Å; L1909-I1916 HydrophobicContact CD1-CG2 4.01Å; I1916-L2003 CarbonylContact O-C 3.58Å; I1916-L2003 VanDerWaalsContact O-CA 3.27Å; I1916-L2003 WeakPolarHBondContact O-CA 3.42Å; I1916-I2004 HydrophobicContact CD1-CB 4.38Å; I1916-I2004 HydrophobicContact CD1-CD1 4.39Å; I1916-I2004 HydrophobicContact CG1-CB 3.97Å; I1916-I2004 PolarHBondContact N-O 3.02Å; I1916-I2004 PolarHBondContact O-N 3.21Å; I1916-L2006 HydrophobicContact CD1-CD2 3.85Å; I1916-L2006 HydrophobicContact CG1-CD1 4.43Å; I1916-L2006 HydrophobicContact CG1-CD2 3.79Å; I1916-L2006 HydrophobicContact CG1-CG 4.1Å; I1916-L2006 HydrophobicContact CG2-CD2 4.06Å; I1916-V2042 HydrophobicContact CD1-CG1 4.42Å; I1916-V2042 HydrophobicContact CD1-CG2 4.4Å; I1916-L2070 HydrophobicContact CD1-CD1 3.82Å; I1916-L2070 HydrophobicContact CD1-CD2 3.65Å; I1916-L2070 HydrophobicContact CD1-CG 4.4Å; I1916-L2070 HydrophobicContact CG1-CD2 4.06Å; I1916-L2070 HydrophobicContact CG2-CD1 4.44Å; I1916-L2070 HydrophobicContact CG2-CD2 3.54Å
1917	K	91.2	Very high	75.5	Confident	22.8 Å²	22.8	33.7 Å²	33.7	10%	0.099	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	134.9	177.8	178.6	176.1	178	179.8	0	110.3	L1907 H1908 Y1915 D1982 G2002 L2003	L1907-K1917 WeakPolarHBondContact CA-O 3.29Å; H1908-K1917 PolarHBondContact N-O 2.98Å; H1908-K1917 PolarHBondContact ND1-O 3.18Å; H1908-K1917 VanDerWaalsContact ND1-O 3.14Å; H1908-K1917 PolarHBondContact O-N 3.08Å; Y1915-K1917 HydrophobicContact CD2-CB 4.25Å; Y1915-K1917 HydrophobicContact CE2-CB 4.11Å; K1917-D1982 IonicContact NZ-OD1 3.49Å; K1917-D1982 PolarHBondContact NZ-OD1 2.99Å; K1917-D1982 IonicContact NZ-OD2 3.22Å; K1917-D1982 PolarHBondContact NZ-OD2 3.06Å; K1917-G2002 CarbonylContact C-O 3.52Å; K1917-G2002 VanDerWaalsContact CA-O 3.31Å; K1917-G2002 WeakPolarHBondContact CA-O 3.32Å; K1917-G2002 WeakPolarHBondContact CG-O 3.24Å; K1917-L2003 HydrophobicContact CB-CD1 3.68Å; K1917-L2003 HydrophobicContact CB-CG 4.48Å; K1917-L2003 HydrophobicContact CD-CD1 4.29Å; K1917-L2003 HydrophobicContact CG-CD1 4.01Å
1918	W	93.2	Very high	72.8	Confident	0.2 Å²	0.2	37.1 Å²	37.1	0%	0.001	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	148.1	165.2	65.7	96.5	0	0	0	111.2	Y1894 C1905 H1906 L1907 R1997 S1998 D2001 G2002 I2004 V2054 F2056	Y1894-W1918 AromaticContact CD1-NE1 3.83Å; Y1894-W1918 HydrophobicContact CD2-CZ2 4.4Å; Y1894-W1918 AromaticContact CE2-CZ2 3.96Å; Y1894-W1918 HydrophobicContact CE2-CZ2 4.14Å; Y1894-W1918 AromaticContact CG-NE1 3.89Å; C1905-W1918 HydrophobicContact CB-CB 4.24Å; H1906-W1918 VanDerWaalsContact O-CA 3.28Å; H1906-W1918 WeakPolarHBondContact O-CA 3.38Å; L1907-W1918 HydrophobicContact CB-CB 4.36Å; L1907-W1918 HydrophobicContact CD1-CB 3.96Å; L1907-W1918 HydrophobicContact CD1-CE3 4.31Å; W1918-R1997 HydrophobicContact CH2-CG 4.28Å; W1918-R1997 HydrophobicContact CZ2-CB 4.39Å; W1918-R1997 HydrophobicContact CZ2-CG 4.32Å; W1918-S1998 PolarHBondContact NE1-O 3.35Å; W1918-D2001 CarbonylContact O-C 3.52Å; W1918-D2001 VanDerWaalsContact O-CA 3.28Å; W1918-D2001 WeakPolarHBondContact O-CA 3.39Å; W1918-G2002 VanDerWaalsContact CE2-CA 3.42Å; W1918-G2002 PolarHBondContact N-O 2.92Å; W1918-G2002 PolarHBondContact O-N 3.27Å; W1918-I2004 HydrophobicContact CH2-CD1 3.78Å; W1918-I2004 HydrophobicContact CH2-CG1 3.87Å; W1918-I2004 HydrophobicContact CZ3-CB 4.49Å; W1918-I2004 HydrophobicContact CZ3-CD1 3.64Å; W1918-I2004 HydrophobicContact CZ3-CG1 3.73Å; W1918-V2054 HydrophobicContact CH2-CG1 4.47Å; W1918-F2056 HydrophobicContact CB-CE1 4.42Å; W1918-F2056 AromaticContact CD2-CE1 3.98Å; W1918-F2056 HydrophobicContact CD2-CE1 4.12Å; W1918-F2056 AromaticContact CD2-CZ 3.93Å; W1918-F2056 HydrophobicContact CD2-CZ 3.97Å; W1918-F2056 HydrophobicContact CE3-CE1 4.27Å; W1918-F2056 AromaticContact CE3-CZ 3.76Å; W1918-F2056 HydrophobicContact CE3-CZ 3.76Å; W1918-F2056 HydrophobicContact CG-CE1 4.21Å; W1918-F2056 HydrophobicContact CG-CZ 4.46Å; W1918-F2056 HydrophobicContact CH2-CZ 4.45Å; W1918-F2056 AromaticContact CZ3-CZ 3.99Å; W1918-F2056 HydrophobicContact CZ3-CZ 4.08Å
1919	Q	89.6	Confident	70.1	Confident	95.6 Å²	95.6	40.3 Å²	40.3	45%	0.447	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	133.4	172.8	144.1	178.3	-36.6	0	0	109.2	C1905 H1906 S1921 E2000 D2001	C1905-Q1919 CarbonylContact C-O 3.51Å; C1905-Q1919 VanDerWaalsContact CA-O 3.31Å; C1905-Q1919 WeakPolarHBondContact CA-O 3.31Å; C1905-Q1919 WeakPolarHBondContact CB-O 3.44Å; H1906-Q1919 HydrophobicContact CB-CG 4.29Å; H1906-Q1919 PolarHBondContact N-O 3.25Å; H1906-Q1919 PolarHBondContact O-N 3.25Å; H1906-Q1919 VanDerWaalsContact O-N 3.1Å; Q1919-S1921 PolarHBondContact O-N 3.15Å; Q1919-E2000 CarbonylContact C-O 3.54Å; Q1919-D2001 HydrophobicContact CB-CB 4.45Å; Q1919-D2001 HydrophobicContact CG-CB 4.41Å
1920	K	86.6	Confident	67.3	Low	70.6 Å²	70.6	44.9 Å²	44.9	31%	0.307	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.1	127.3	175.9	179.1	179	175.3	-175.1	0	108.8	A1903 N1922 S1924 M1999 E2000	A1903-K1920 HydrophobicContact CB-CD 4.47Å; A1903-K1920 HydrophobicContact CB-CG 4.47Å; K1920-N1922 PolarHBondContact O-N 2.95Å; K1920-S1924 VanDerWaalsContact CE-OG 3.24Å; K1920-S1924 WeakPolarHBondContact CE-OG 3.15Å; K1920-S1924 WeakPolarHBondContact CG-OG 3.37Å; K1920-M1999 WeakPolarHBondContact CD-O 3.34Å; K1920-E2000 WeakPolarHBondContact CA-O 3.3Å; K1920-E2000 HydrophobicContact CB-CB 4.48Å; K1920-E2000 WeakPolarHBondContact CB-O 3.4Å; K1920-E2000 HydrophobicContact CD-CB 4.3Å; K1920-E2000 HydrophobicContact CD-CG 4.21Å; K1920-E2000 PolarHBondContact N-O 3.1Å; K1920-E2000 IonicContact NZ-OE1 2.74Å; K1920-E2000 PolarHBondContact NZ-OE1 3.23Å
1921	S	75.5	Confident	64.8	Low	18.4 Å²	18.4	49.1 Å²	49.1	13%	0.129	27%	0.274	C	S	.	.			trans	-72.7	127.7	177.7	-131.8	0	0	0	0	109.2	F1904 Q1919 F1923 S1924	F1904-S1921 WeakPolarHBondContact O-CB 3.36Å; F1904-S1921 PolarHBondContact O-N 3.1Å; Q1919-S1921 PolarHBondContact O-N 3.15Å; S1921-F1923 PolarHBondContact O-N 3.12Å; S1921-F1923 WeakPolarHBondContact OG-CD2 3.31Å; S1921-S1924 VanDerWaalsContact O-CB 3.25Å; S1921-S1924 WeakPolarHBondContact O-CB 3.4Å; S1921-S1924 PolarHBondContact O-N 3.18Å; S1921-S1924 PolarHBondContact O-OG 3.18Å
1922	N	61.9	Low	62.4	Low	134.6 Å²	134.6	51 Å²	51	72%	0.72	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-4.6	175.9	-73.1	-17.5	0	0	0	112	K1920 S1924 S1925	K1920-N1922 PolarHBondContact O-N 2.95Å; N1922-S1924 VanDerWaalsContact C-N 3.27Å; N1922-S1924 PolarHBondContact O-N 3.22Å; N1922-S1924 VanDerWaalsContact O-N 3.14Å; N1922-S1925 PolarHBondContact O-N 3.33Å; N1922-S1925 PolarHBondContact O-OG 3.16Å
1923	F	58.1	Low	60	Low	42.4 Å²	42.4	60.8 Å²	60.8	19%	0.186	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-14.8	172.1	-50.5	-57.7	0	0	0	113.6	N1660 C1663 F1664 F1904 S1921 S1925 W1926 L1927	N1660-F1923 HydrophobicContact CB-CD1 4.24Å; N1660-F1923 VanDerWaalsContact OD1-CD1 3.3Å; N1660-F1923 WeakPolarHBondContact OD1-CD1 3.3Å; N1660-F1923 WeakPolarHBondContact OD1-CE1 3.37Å; C1663-F1923 HydrophobicContact CB-CE1 3.98Å; C1663-F1923 HydrophobicContact CB-CE2 4.14Å; C1663-F1923 HydrophobicContact CB-CZ 3.6Å; C1663-F1923 VanDerWaalsContact CB-CZ 3.43Å; F1664-F1923 AromaticContact CE1-CD2 3.8Å; F1664-F1923 HydrophobicContact CE1-CD2 3.87Å; F1664-F1923 HydrophobicContact CE1-CE2 4.24Å; F1664-F1923 HydrophobicContact CE1-CG 4.28Å; F1664-F1923 HydrophobicContact CE2-CD2 4.42Å; F1664-F1923 HydrophobicContact CZ-CB 4.15Å; F1664-F1923 HydrophobicContact CZ-CD1 4.33Å; F1664-F1923 AromaticContact CZ-CD2 3.78Å; F1664-F1923 HydrophobicContact CZ-CD2 3.93Å; F1664-F1923 HydrophobicContact CZ-CE2 4.45Å; F1664-F1923 AromaticContact CZ-CG 3.86Å; F1664-F1923 HydrophobicContact CZ-CG 4.09Å; F1904-F1923 HydrophobicContact CD1-CZ 4.39Å; S1921-F1923 PolarHBondContact O-N 3.12Å; S1921-F1923 WeakPolarHBondContact OG-CD2 3.31Å; F1923-S1925 VanDerWaalsContact C-N 3.31Å; F1923-S1925 PolarHBondContact O-N 3.17Å; F1923-W1926 AromaticContact CD1-CE3 3.82Å; F1923-W1926 HydrophobicContact CD1-CE3 3.82Å; F1923-W1926 HydrophobicContact CD1-CH2 4.26Å; F1923-W1926 AromaticContact CD1-CZ3 3.63Å; F1923-W1926 HydrophobicContact CD1-CZ3 3.63Å; F1923-W1926 HydrophobicContact CE1-CE3 4.39Å; F1923-W1926 HydrophobicContact CE1-CH2 4.13Å; F1923-W1926 AromaticContact CE1-CZ3 3.73Å; F1923-W1926 HydrophobicContact CE1-CZ3 3.73Å; F1923-W1926 CarbonylContact O-C 3.46Å; F1923-W1926 VanDerWaalsContact O-CA 3.31Å; F1923-W1926 WeakPolarHBondContact O-CA 3.3Å; F1923-W1926 VanDerWaalsContact O-CB 3.22Å; F1923-W1926 WeakPolarHBondContact O-CB 3.25Å; F1923-W1926 PolarHBondContact O-N 2.91Å; F1923-W1926 PolarHBondContact O-NE1 3.21Å; F1923-L1927 PolarHBondContact O-N 3.2Å
1924	S	45.4	Very low	57.2	Low	20.2 Å²	20.2	64.6 Å²	64.6	14%	0.141	38%	0.381	C	S	.	.	H	α-helix	trans	-68.6	-27.3	-178	-36.4	0	0	0	0	114.1	F1904 K1920 S1921 N1922 W1926 L1927 T1928	F1904-S1924 PolarHBondContact N-OG 3.01Å; F1904-S1924 PolarHBondContact O-OG 3.44Å; F1904-S1924 VanDerWaalsContact O-OG 3.06Å; K1920-S1924 VanDerWaalsContact CE-OG 3.24Å; K1920-S1924 WeakPolarHBondContact CE-OG 3.15Å; K1920-S1924 WeakPolarHBondContact CG-OG 3.37Å; S1921-S1924 VanDerWaalsContact O-CB 3.25Å; S1921-S1924 WeakPolarHBondContact O-CB 3.4Å; S1921-S1924 PolarHBondContact O-N 3.18Å; S1921-S1924 PolarHBondContact O-OG 3.18Å; N1922-S1924 VanDerWaalsContact C-N 3.27Å; N1922-S1924 PolarHBondContact O-N 3.22Å; N1922-S1924 VanDerWaalsContact O-N 3.14Å; S1924-W1926 VanDerWaalsContact C-N 3.26Å; S1924-W1926 PolarHBondContact O-N 3.23Å; S1924-W1926 VanDerWaalsContact O-N 3.15Å; S1924-L1927 PolarHBondContact O-N 3.15Å; S1924-L1927 VanDerWaalsContact O-N 3.12Å; S1924-T1928 PolarHBondContact O-N 3.44Å; S1924-T1928 PolarHBondContact O-OG1 3.16Å
1925	S	40.8	Very low	54.5	Low	86.2 Å²	86.2	67.5 Å²	67.5	60%	0.603	41%	0.414	S	S	*	.	H	α-helix	trans	-67.6	-20.7	-176.2	116.4	0	0	0	0	113.2	N1922 F1923 L1927 T1928 T1929	N1922-S1925 PolarHBondContact O-N 3.33Å; N1922-S1925 PolarHBondContact O-OG 3.16Å; F1923-S1925 VanDerWaalsContact C-N 3.31Å; F1923-S1925 PolarHBondContact O-N 3.17Å; S1925-L1927 VanDerWaalsContact C-N 3.34Å; S1925-T1928 PolarHBondContact O-OG1 3.11Å; S1925-T1929 WeakPolarHBondContact O-CG2 3.36Å
1926	W	38.8	Very low	51.6	Low	49.6 Å²	49.6	71.1 Å²	71.1	19%	0.188	45%	0.448	C	S	.	.	H	α-helix	trans	-89.8	-36.4	178.5	114.4	-4.4	0	0	0	112.6	Y1581 D1657 N1660 F1923 S1924 T1928 T1929 T1930	Y1581-W1926 HydrophobicContact CD1-CH2 4.39Å; Y1581-W1926 HydrophobicContact CD1-CZ2 4.35Å; Y1581-W1926 AromaticContact CE1-CH2 3.6Å; Y1581-W1926 HydrophobicContact CE1-CH2 3.76Å; Y1581-W1926 AromaticContact CE1-CZ2 3.84Å; Y1581-W1926 HydrophobicContact CE1-CZ2 3.84Å; Y1581-W1926 AromaticContact CE1-CZ3 3.68Å; Y1581-W1926 HydrophobicContact CE1-CZ3 3.68Å; D1657-W1926 HydrophobicContact CB-CZ2 4.16Å; D1657-W1926 VanDerWaalsContact CG-CZ2 3.44Å; D1657-W1926 VanDerWaalsContact OD1-CE2 3.23Å; D1657-W1926 WeakPolarHBondContact OD1-CH2 3.23Å; D1657-W1926 WeakPolarHBondContact OD1-CZ2 3.31Å; D1657-W1926 PolarHBondContact OD1-NE1 2.98Å; N1660-W1926 VanDerWaalsContact ND2-CD1 3.29Å; N1660-W1926 PolarHBondContact ND2-NE1 3.25Å; F1923-W1926 AromaticContact CD1-CE3 3.82Å; F1923-W1926 HydrophobicContact CD1-CE3 3.82Å; F1923-W1926 HydrophobicContact CD1-CH2 4.26Å; F1923-W1926 AromaticContact CD1-CZ3 3.63Å; F1923-W1926 HydrophobicContact CD1-CZ3 3.63Å; F1923-W1926 HydrophobicContact CE1-CE3 4.39Å; F1923-W1926 HydrophobicContact CE1-CH2 4.13Å; F1923-W1926 AromaticContact CE1-CZ3 3.73Å; F1923-W1926 HydrophobicContact CE1-CZ3 3.73Å; F1923-W1926 CarbonylContact O-C 3.46Å; F1923-W1926 VanDerWaalsContact O-CA 3.31Å; F1923-W1926 WeakPolarHBondContact O-CA 3.3Å; F1923-W1926 VanDerWaalsContact O-CB 3.22Å; F1923-W1926 WeakPolarHBondContact O-CB 3.25Å; F1923-W1926 PolarHBondContact O-N 2.91Å; F1923-W1926 PolarHBondContact O-NE1 3.21Å; S1924-W1926 VanDerWaalsContact C-N 3.26Å; S1924-W1926 PolarHBondContact O-N 3.23Å; S1924-W1926 VanDerWaalsContact O-N 3.15Å; W1926-T1928 VanDerWaalsContact C-N 3.29Å; W1926-T1928 PolarHBondContact O-N 3.27Å; W1926-T1928 VanDerWaalsContact O-N 3.13Å; W1926-T1929 PolarHBondContact O-N 2.9Å; W1926-T1929 VanDerWaalsContact O-N 3.14Å; W1926-T1929 PolarHBondContact O-OG1 3.22Å; W1926-T1930 HydrophobicContact CZ2-CG2 4.33Å
1927	L	42	Very low	48.5	Very low	19.4 Å²	19.4	78 Å²	78	10%	0.102	49%	0.485	C	S	.	.	H	α-helix	trans	-62.6	-36.2	178.9	-68.8	172.5	0	0	0	112.2	Y1581 F1904 F1923 S1924 S1925 T1929 T1930 H2029	Y1581-L1927 HydrophobicContact CD1-CD2 3.69Å; Y1581-L1927 HydrophobicContact CE1-CD2 3.84Å; Y1581-L1927 HydrophobicContact CG-CD2 4.25Å; F1904-L1927 HydrophobicContact CB-CD1 3.97Å; F1904-L1927 HydrophobicContact CD1-CD1 4.01Å; F1904-L1927 HydrophobicContact CD2-CD1 3.97Å; F1904-L1927 HydrophobicContact CE2-CD1 4.39Å; F1904-L1927 HydrophobicContact CG-CD1 3.81Å; F1923-L1927 PolarHBondContact O-N 3.2Å; S1924-L1927 PolarHBondContact O-N 3.15Å; S1924-L1927 VanDerWaalsContact O-N 3.12Å; S1925-L1927 VanDerWaalsContact C-N 3.34Å; L1927-T1929 VanDerWaalsContact C-N 3.3Å; L1927-T1929 PolarHBondContact O-N 3Å; L1927-T1929 VanDerWaalsContact O-N 3.14Å; L1927-T1930 PolarHBondContact O-OG1 2.84Å; L1927-H2029 HydrophobicContact CD1-CB 4.22Å; L1927-H2029 WeakPolarHBondContact CD2-O 3.31Å
1928	T	37.9	Very low	45.4	Very low	74 Å²	74	84.1 Å²	84.1	45%	0.454	52%	0.519	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.1	6.4	177.7	52.3	0	0	0	0	113.6	S1924 S1925 W1926 T1930 V1931	S1924-T1928 PolarHBondContact O-N 3.44Å; S1924-T1928 PolarHBondContact O-OG1 3.16Å; S1925-T1928 PolarHBondContact O-OG1 3.11Å; W1926-T1928 VanDerWaalsContact C-N 3.29Å; W1926-T1928 PolarHBondContact O-N 3.27Å; W1926-T1928 VanDerWaalsContact O-N 3.13Å; T1928-T1930 PolarHBondContact O-N 2.97Å; T1928-V1931 WeakPolarHBondContact OG1-CG2 3.47Å
1929	T	34.5	Very low	42.4	Very low	109.6 Å²	109.6	92.2 Å²	92.2	67%	0.672	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89	-9	-176.2	55.4	0	0	0	0	114.9	S1925 W1926 L1927	S1925-T1929 WeakPolarHBondContact O-CG2 3.36Å; W1926-T1929 PolarHBondContact O-N 2.9Å; W1926-T1929 VanDerWaalsContact O-N 3.14Å; W1926-T1929 PolarHBondContact O-OG1 3.22Å; L1927-T1929 VanDerWaalsContact C-N 3.3Å; L1927-T1929 PolarHBondContact O-N 3Å; L1927-T1929 VanDerWaalsContact O-N 3.14Å
1930	T	33.4	Very low	39.4	Very low	99.2 Å²	99.2	95.2 Å²	95.2	61%	0.609	58%	0.58	S	S	*	*	S	Bend	trans	-104.8	-6.7	-172.3	51.4	0	0	0	0	115	W1926 L1927 T1928 G1932	W1926-T1930 HydrophobicContact CZ2-CG2 4.33Å; L1927-T1930 PolarHBondContact O-OG1 2.84Å; T1928-T1930 PolarHBondContact O-N 2.97Å; T1930-G1932 PolarHBondContact O-N 2.92Å
1931	V	31.5	Very low	36.7	Very low	102.8 Å²	102.8	97.1 Å²	97.1	62%	0.623	60%	0.6	S	S	*	*	S	Bend	trans	-116.4	90.5	179.2	-172.1	0	0	0	0	110	T1928	T1928-V1931 WeakPolarHBondContact OG1-CG2 3.47Å
1932	G	29.2	Very low	34.3	Very low	71.2 Å²	71.2	104.3 Å²	104.3	73%	0.734	64%	0.636	S	S	*	*			trans	131.4	39.7	167.2	0	0	0	0	0	117.9	T1930 G1934	T1930-G1932 PolarHBondContact O-N 2.92Å; G1932-G1934 VanDerWaalsContact C-N 3.3Å; G1932-G1934 PolarHBondContact O-N 3.11Å
1933	K	25.7	Very low	32.6	Very low	215.6 Å²	215.6	102.7 Å²	102.7	94%	0.937	64%	0.636	S	S	*	*			trans	-120.7	83.8	160.2	-82.9	-168.3	175	-177.5	0	110.8
1934	G	24.5	Very low	31.1	Very low	79 Å²	79	107.1 Å²	107.1	81%	0.814	67%	0.666	S	S	*	*			trans	-141.4	111	165.1	0	0	0	0	0	109.4	G1932	G1932-G1934 VanDerWaalsContact C-N 3.3Å; G1932-G1934 PolarHBondContact O-N 3.11Å
1935	G	24.3	Very low	30.3	Very low	80 Å²	80	112.6 Å²	112.6	83%	0.825	70%	0.698	S	S	*	*	S	Bend	trans	97.5	75.6	168.8	0	0	0	0	0	115.8
1936	A	27.4	Very low	29.6	Very low	97 Å²	97	111.7 Å²	111.7	80%	0.802	70%	0.703	S	S	*	*			trans	-164.9	89	143.4	0	0	0	0	0	108	N1938	A1936-N1938 VanDerWaalsContact C-N 3.27Å; A1936-N1938 PolarHBondContact O-N 2.77Å
1937	D	27.2	Very low	29.1	Very low	149.2 Å²	149.2	114.8 Å²	114.8	80%	0.798	73%	0.732	S	S	*	*			trans	-70.3	141.1	169.6	-67.8	-49.6	0	0	0	110.3
1938	N	26.7	Very low	28.3	Very low	151 Å²	151	121.7 Å²	121.7	81%	0.807	76%	0.764	S	S	*	*			trans	70	89.6	162.4	-62.1	-36.8	0	0	0	115.6	A1936 D1940	A1936-N1938 VanDerWaalsContact C-N 3.27Å; A1936-N1938 PolarHBondContact O-N 2.77Å; N1938-D1940 PolarHBondContact O-N 2.8Å
1939	L	28.8	Very low	27.6	Very low	171.6 Å²	171.6	123.8 Å²	123.8	90%	0.898	78%	0.781	S	S	*	*			trans	-135.4	116.4	136.9	-90.6	159.2	0	0	0	109	P1941	L1939-P1941 VanDerWaalsContact O-CD 3.3Å; L1939-P1941 WeakPolarHBondContact O-CD 3.46Å
1940	D	26.8	Very low	27.2	Very low	156.8 Å²	156.8	127.4 Å²	127.4	84%	0.839	79%	0.787	S	S	*	*			trans	-79.2	140	175.4	-90	-47.4	0	0	0	111.8	N1938 L1942	N1938-D1940 PolarHBondContact O-N 2.8Å; D1940-L1942 PolarHBondContact O-N 3.37Å
1941	P	30.4	Very low	26.7	Very low	111 Å²	111	131.9 Å²	131.9	72%	0.721	80%	0.801	S	S	*	*			trans	-92.5	120.7	-178.7	34.6	-29.3	0	0	0	111.2	L1939	L1939-P1941 VanDerWaalsContact O-CD 3.3Å; L1939-P1941 WeakPolarHBondContact O-CD 3.46Å
1942	L	24.9	Very low	26.6	Very low	170 Å²	170	131.8 Å²	131.8	89%	0.89	81%	0.811	S	S	*	*			trans	-169.5	118.6	163.5	-141.4	79.9	0	0	0	113.8	D1940	D1940-L1942 PolarHBondContact O-N 3.37Å
1943	S	26.9	Very low	26.3	Very low	101.4 Å²	101.4	133.9 Å²	133.9	71%	0.709	82%	0.815	S	S	*	*			trans	137	106.2	148.4	65.6	0	0	0	0	114.9	V1945	S1943-V1945 PolarHBondContact O-N 3.49Å
1944	T	26.2	Very low	26.4	Very low	135 Å²	135	128.8 Å²	128.8	83%	0.828	81%	0.806	S	S	*	*			trans	45.5	122.5	132.7	9.1	0	0	0	0	116.9
1945	V	29.4	Very low	26.4	Very low	134.4 Å²	134.4	130.6 Å²	130.6	82%	0.815	81%	0.806	S	S	*	*				-136.9	116.3	112.5	-176.1	0	0	0	0	108.4	S1943 S1947	S1943-V1945 PolarHBondContact O-N 3.49Å; V1945-S1947 PolarHBondContact O-N 3Å
1946	G	25.2	Very low	26.7	Very low	68.6 Å²	68.6	132.1 Å²	132.1	71%	0.707	80%	0.804	S	S	*	*				85.2	106.9	89.1	0	0	0	0	0	110.8
1947	S	28.4	Very low	26.5	Very low	113.2 Å²	113.2	136.3 Å²	136.3	79%	0.792	81%	0.807	S	S	*	*			trans	-141.6	116.6	155.6	-122.8	0	0	0	0	108.1	V1945 C1949	V1945-S1947 PolarHBondContact O-N 3Å; S1947-C1949 PolarHBondContact O-N 3.35Å; S1947-C1949 VanDerWaalsContact O-N 3.12Å
1948	E	25.3	Very low	26.7	Very low	164.4 Å²	164.4	136.9 Å²	136.9	77%	0.768	81%	0.809	S	S	*	*			trans	-36.6	126.1	144.6	-73.2	178.1	179.4	0	0	112.1	K1950	E1948-K1950 PolarHBondContact O-N 3.36Å; E1948-K1950 VanDerWaalsContact O-N 3.09Å
1949	C	22.8	Very low	26.8	Very low	119.8 Å²	119.8	136.8 Å²	136.8	81%	0.809	81%	0.809	S	S	*	*				-110	127.2	122.3	-88.8	0	0	0	0	111.5	S1947 E1951	S1947-C1949 PolarHBondContact O-N 3.35Å; S1947-C1949 VanDerWaalsContact O-N 3.12Å; C1949-E1951 PolarHBondContact O-N 3.14Å
1950	K	26.3	Very low	26.5	Very low	185 Å²	185	132.9 Å²	132.9	80%	0.804	80%	0.802	S	S	*	*			trans	-50.2	110.9	169.2	-71.4	172.5	179.6	171.1	0	112.8	E1948 A1952	E1948-K1950 PolarHBondContact O-N 3.36Å; E1948-K1950 VanDerWaalsContact O-N 3.09Å; K1950-A1952 PolarHBondContact O-N 3.11Å
1951	E	23.7	Very low	26.5	Very low	192.4 Å²	192.4	136.6 Å²	136.6	90%	0.899	80%	0.804	S	S	*	*			trans	-39.9	120.9	137.4	-64.2	-179	148.8	0	0	112.9	C1949	C1949-E1951 PolarHBondContact O-N 3.14Å
1952	A	27.6	Very low	26.3	Very low	101.8 Å²	101.8	141 Å²	141	84%	0.841	81%	0.812	S	S	*	*			trans	-124.3	118.4	161.8	0	0	0	0	0	108.9	K1950 S1954	K1950-A1952 PolarHBondContact O-N 3.11Å; A1952-S1954 PolarHBondContact O-N 2.89Å
1953	S	24	Very low	26.5	Very low	114.6 Å²	114.6	139.5 Å²	139.5	80%	0.801	81%	0.809	S	S	*	*			trans	-86.7	132.4	168.5	49.8	0	0	0	0	114.1
1954	S	28.2	Very low	26.4	Very low	109 Å²	109	145.8 Å²	145.8	76%	0.762	82%	0.817	S	S	*	*			trans	176.1	109.4	151.3	52.1	0	0	0	0	110.7	A1952	A1952-S1954 PolarHBondContact O-N 2.89Å
1955	S	24.7	Very low	26.4	Very low	116.8 Å²	116.8	143.8 Å²	143.8	82%	0.817	81%	0.814	S	S	*	*				62.3	102.5	86.9	64.6	0	0	0	0	114.3
1956	S	29.2	Very low	26.3	Very low	112 Å²	112	143.6 Å²	143.6	78%	0.783	81%	0.814	S	S	*	*			trans	-158	106.5	146.7	177.4	0	0	0	0	108	L1958	S1956-L1958 PolarHBondContact O-N 3.16Å
1957	E	24.5	Very low	26.4	Very low	185 Å²	185	146.1 Å²	146.1	86%	0.864	82%	0.821	S	S	*	*			trans	-54.9	136.4	147.4	-70.4	179.3	125.5	0	0	110.2
1958	L	29.9	Very low	26.3	Very low	160.2 Å²	160.2	144.4 Å²	144.4	84%	0.839	82%	0.82	S	S	*	*			trans	-165.7	114.6	150	-93.1	158.7	0	0	0	112.5	S1956	S1956-L1958 PolarHBondContact O-N 3.16Å
1959	D	28.6	Very low	26.3	Very low	149 Å²	149	145.4 Å²	145.4	80%	0.797	83%	0.825	S	S	*	*			trans	-14.1	123.9	157.3	-108.1	-25.4	0	0	0	117.6	R1961	D1959-R1961 PolarHBondContact O-N 2.8Å; D1959-R1961 VanDerWaalsContact O-N 3.12Å
1960	A	24.4	Very low	26.4	Very low	91.2 Å²	91.2	145 Å²	145	75%	0.754	82%	0.821	S	S	*	*			trans	-88.4	106.3	161.2	0	0	0	0	0	113
1961	R	25.8	Very low	26.4	Very low	234 Å²	234	141.8 Å²	141.8	88%	0.883	82%	0.819	S	S	*	*			trans	-167.6	115.8	151.3	-92.2	167.4	-179.3	-177.8	1.4	114.2	D1959	D1959-R1961 PolarHBondContact O-N 2.8Å; D1959-R1961 VanDerWaalsContact O-N 3.12Å
1962	K	26.5	Very low	26.5	Very low	204 Å²	204	138.2 Å²	138.2	89%	0.887	81%	0.81	S	S	*	*			trans	121.5	121.8	138.7	-104.1	174.8	175.7	174.3	0	113.3	R1964	K1962-R1964 PolarHBondContact O-N 3.41Å
1963	V	28.9	Very low	26.4	Very low	136.8 Å²	136.8	140.2 Å²	140.2	83%	0.829	81%	0.806	S	S	*	*			trans	-126.8	118.7	142.2	179.7	0	0	0	0	109.1
1964	R	25.6	Very low	26.3	Very low	234.4 Å²	234.4	139.3 Å²	139.3	89%	0.885	80%	0.8	S	S	*	*			trans	-92.7	118.1	149.4	-168.3	179	-173.2	173	2.3	112.1	K1962 T1966	K1962-R1964 PolarHBondContact O-N 3.41Å; R1964-T1966 PolarHBondContact O-N 2.83Å
1965	A	24.6	Very low	26.3	Very low	92.6 Å²	92.6	138.7 Å²	138.7	77%	0.765	80%	0.796	S	S	*	*			trans	3.6	120.3	162.3	0	0	0	0	0	116.9
1966	T	29	Very low	26.4	Very low	131.8 Å²	131.8	137.7 Å²	137.7	81%	0.809	79%	0.788	S	S	*	*			trans	-137.1	126.3	146.2	43	0	0	0	0	110.2	R1964 G1968	R1964-T1966 PolarHBondContact O-N 2.83Å; T1966-G1968 PolarHBondContact O-N 3.14Å
1967	S	27.2	Very low	26.4	Very low	120.6 Å²	120.6	137.8 Å²	137.8	84%	0.843	79%	0.789	S	S	*	*			trans	1.9	114.7	163.4	56.8	0	0	0	0	117.9	Q1969	S1967-Q1969 PolarHBondContact O-N 3.39Å
1968	G	24.8	Very low	26.9	Very low	76.2 Å²	76.2	132.9 Å²	132.9	79%	0.786	77%	0.772	S	S	*	*			trans	-89.6	113.3	153.5	0	0	0	0	0	114.9	T1966	T1966-G1968 PolarHBondContact O-N 3.14Å
1969	Q	25.8	Very low	27.3	Very low	186.6 Å²	186.6	128.2 Å²	128.2	87%	0.872	75%	0.752	S	S	*	*			trans	-98	141.1	159.9	-87.7	-178.8	-47.8	0	0	111.6	S1967	S1967-Q1969 PolarHBondContact O-N 3.39Å
1970	P	25.2	Very low	27.7	Very low	110.6 Å²	110.6	124.7 Å²	124.7	72%	0.718	74%	0.744	S	S	*	*			trans	-72.7	137.8	175.2	29.9	-31.8	0	0	0	110.5	V1972	P1970-V1972 PolarHBondContact O-N 3.09Å; P1970-V1972 VanDerWaalsContact O-N 3.13Å
1971	P	26.8	Very low	28.8	Very low	117.2 Å²	117.2	125 Å²	125	76%	0.761	73%	0.733	S	S	*	*			trans	-73	121.4	-178	28.4	-32.1	0	0	0	110.7	L1973	P1971-L1973 HydrophobicContact CB-CD2 4.43Å; P1971-L1973 HydrophobicContact CB-CG 4.17Å; P1971-L1973 HydrophobicContact CG-CD1 4.35Å; P1971-L1973 HydrophobicContact CG-CG 4.29Å; P1971-L1973 PolarHBondContact O-N 3.2Å; P1971-L1973 VanDerWaalsContact O-N 3.14Å
1972	V	24.9	Very low	30	Very low	117 Å²	117	115.7 Å²	115.7	71%	0.709	70%	0.701	S	S	*	*			trans	-68.1	114	172.2	178.2	0	0	0	0	108.6	P1970 S1974	P1970-V1972 PolarHBondContact O-N 3.09Å; P1970-V1972 VanDerWaalsContact O-N 3.13Å; V1972-S1974 PolarHBondContact O-N 3.26Å
1973	L	25	Very low	31.1	Very low	144.6 Å²	144.6	109.7 Å²	109.7	76%	0.757	68%	0.675	S	S	*	*			trans	-72.1	105.7	179	-71.4	165.5	0	0	0	110.9	P1971 S1975	P1971-L1973 HydrophobicContact CB-CD2 4.43Å; P1971-L1973 HydrophobicContact CB-CG 4.17Å; P1971-L1973 HydrophobicContact CG-CD1 4.35Å; P1971-L1973 HydrophobicContact CG-CG 4.29Å; P1971-L1973 PolarHBondContact O-N 3.2Å; P1971-L1973 VanDerWaalsContact O-N 3.14Å; L1973-S1975 VanDerWaalsContact C-N 3.31Å; L1973-S1975 PolarHBondContact O-N 3.09Å; L1973-S1975 VanDerWaalsContact O-N 3.1Å
1974	S	23.5	Very low	32.2	Very low	96.6 Å²	96.6	105.9 Å²	105.9	68%	0.676	65%	0.654	S	S	*	*			trans	-73.1	98.1	167.6	56.7	0	0	0	0	110	V1972 S1976 N2104	V1972-S1974 PolarHBondContact O-N 3.26Å; S1974-S1976 PolarHBondContact O-N 3.14Å; S1974-S1976 VanDerWaalsContact O-N 3.15Å; S1974-N2104 PolarHBondContact OG-OD1 2.73Å
1975	S	26.5	Very low	33.6	Very low	96.4 Å²	96.4	96.9 Å²	96.9	67%	0.674	62%	0.622	S	S	*	*			trans	-49.6	122.9	164.9	54.8	0	0	0	0	110.4	L1973 S1977	L1973-S1975 VanDerWaalsContact C-N 3.31Å; L1973-S1975 PolarHBondContact O-N 3.09Å; L1973-S1975 VanDerWaalsContact O-N 3.1Å; S1975-S1977 PolarHBondContact O-N 3.32Å
1976	S	28.2	Very low	35	Very low	95.2 Å²	95.2	95.2 Å²	95.2	67%	0.666	60%	0.596	S	S	*	*			trans	-49.4	129.8	162.9	47.4	0	0	0	0	110.3	S1974 T1978	S1974-S1976 PolarHBondContact O-N 3.14Å; S1974-S1976 VanDerWaalsContact O-N 3.15Å; S1976-T1978 VanDerWaalsContact C-N 3.33Å; S1976-T1978 PolarHBondContact O-N 3.15Å; S1976-T1978 PolarHBondContact O-OG1 3.07Å
1977	S	28.2	Very low	36	Very low	113.4 Å²	113.4	92.9 Å²	92.9	79%	0.793	58%	0.577	S	S	*	*			trans	-68	68.1	-175.1	56.1	0	0	0	0	112.9	S1975 S1979	S1975-S1977 PolarHBondContact O-N 3.32Å; S1977-S1979 VanDerWaalsContact C-N 3.33Å; S1977-S1979 PolarHBondContact O-N 3Å; S1977-S1979 VanDerWaalsContact O-N 3.09Å
1978	T	35.4	Very low	37.1	Very low	82 Å²	82	93.1 Å²	93.1	50%	0.503	56%	0.563	S	S	.	*			trans	-72.3	54.8	171.7	48.5	0	0	0	0	110.4	S1976 D1982	S1976-T1978 VanDerWaalsContact C-N 3.33Å; S1976-T1978 PolarHBondContact O-N 3.15Å; S1976-T1978 PolarHBondContact O-OG1 3.07Å; T1978-D1982 WeakPolarHBondContact O-CB 3.34Å; T1978-D1982 PolarHBondContact O-N 3.36Å
1979	S	38.4	Very low	38.4	Very low	61 Å²	61	90.5 Å²	90.5	43%	0.427	53%	0.531	S	S	.	.			trans	-63.9	179.2	178	62.1	0	0	0	0	111.7	S1977 D1981 D1982 F1983	S1977-S1979 VanDerWaalsContact C-N 3.33Å; S1977-S1979 PolarHBondContact O-N 3Å; S1977-S1979 VanDerWaalsContact O-N 3.09Å; S1979-D1981 VanDerWaalsContact C-N 3.33Å; S1979-D1981 PolarHBondContact O-N 3.08Å; S1979-D1981 VanDerWaalsContact O-N 3.1Å; S1979-D1981 PolarHBondContact OG-OD2 2.66Å; S1979-D1981 VanDerWaalsContact OG-OD2 3.1Å; S1979-D1982 WeakPolarHBondContact O-CB 3.48Å; S1979-D1982 PolarHBondContact O-N 2.98Å; S1979-F1983 PolarHBondContact O-N 3.25Å; S1979-F1983 VanDerWaalsContact O-N 3.14Å
1980	A	36.7	Very low	39.7	Very low	75.6 Å²	75.6	85.6 Å²	85.6	63%	0.625	51%	0.51	S	S	*	.	H	α-helix	trans	-60.7	-29.4	-179.5	0	0	0	0	0	113.1	D1982 F1983 S1984	A1980-D1982 VanDerWaalsContact C-N 3.29Å; A1980-D1982 PolarHBondContact O-N 3.16Å; A1980-F1983 WeakPolarHBondContact O-CB 3.23Å; A1980-F1983 PolarHBondContact O-N 3.07Å; A1980-F1983 VanDerWaalsContact O-N 3.17Å; A1980-S1984 PolarHBondContact O-N 2.84Å; A1980-S1984 VanDerWaalsContact O-N 3.13Å; A1980-S1984 PolarHBondContact O-OG 3.17Å
1981	D	48.4	Very low	41.2	Very low	99.2 Å²	99.2	84.4 Å²	84.4	53%	0.53	51%	0.505	S	S	.	.	H	α-helix	trans	-66.1	-37.4	175.5	-100.9	-3.7	0	0	0	112.4	S1979 F1983 S1984 K1985	S1979-D1981 VanDerWaalsContact C-N 3.33Å; S1979-D1981 PolarHBondContact O-N 3.08Å; S1979-D1981 VanDerWaalsContact O-N 3.1Å; S1979-D1981 PolarHBondContact OG-OD2 2.66Å; S1979-D1981 VanDerWaalsContact OG-OD2 3.1Å; D1981-F1983 VanDerWaalsContact C-N 3.26Å; D1981-F1983 PolarHBondContact O-N 2.98Å; D1981-S1984 PolarHBondContact O-N 3.04Å; D1981-K1985 VanDerWaalsContact O-CB 3.32Å; D1981-K1985 WeakPolarHBondContact O-CB 3.32Å; D1981-K1985 WeakPolarHBondContact O-CD 3.5Å; D1981-K1985 VanDerWaalsContact O-CG 3.29Å; D1981-K1985 WeakPolarHBondContact O-CG 3.33Å; D1981-K1985 PolarHBondContact O-N 3.14Å; D1981-K1985 VanDerWaalsContact O-N 3.14Å; D1981-K1985 WeakPolarHBondContact OD2-CE 3.34Å; D1981-K1985 IonicContact OD2-NZ 2.66Å; D1981-K1985 PolarHBondContact OD2-NZ 2.83Å
1982	D	51.4	Low	43	Very low	38.4 Å²	38.4	80.7 Å²	80.7	21%	0.205	49%	0.488	C	S	.	.	H	α-helix	trans	-65.1	-32.7	177.5	-97.5	-3.9	0	0	0	112	K1917 T1978 S1979 A1980 K1985 R1986	K1917-D1982 IonicContact NZ-OD1 3.49Å; K1917-D1982 PolarHBondContact NZ-OD1 2.99Å; K1917-D1982 IonicContact NZ-OD2 3.22Å; K1917-D1982 PolarHBondContact NZ-OD2 3.06Å; T1978-D1982 WeakPolarHBondContact O-CB 3.34Å; T1978-D1982 PolarHBondContact O-N 3.36Å; S1979-D1982 WeakPolarHBondContact O-CB 3.48Å; S1979-D1982 PolarHBondContact O-N 2.98Å; A1980-D1982 VanDerWaalsContact C-N 3.29Å; A1980-D1982 PolarHBondContact O-N 3.16Å; D1982-K1985 PolarHBondContact O-N 3.14Å; D1982-R1986 WeakPolarHBondContact O-CB 3.24Å; D1982-R1986 WeakPolarHBondContact O-CD 3.3Å; D1982-R1986 VanDerWaalsContact O-CG 3.26Å; D1982-R1986 WeakPolarHBondContact O-CG 3.38Å; D1982-R1986 PolarHBondContact O-N 3.12Å; D1982-R1986 VanDerWaalsContact O-N 3.09Å; D1982-R1986 PolarHBondContact O-NE 2.76Å; D1982-R1986 VanDerWaalsContact O-NE 3.13Å; D1982-R1986 IonicContact OD2-CZ 3.81Å; D1982-R1986 IonicContact OD2-NE 2.68Å; D1982-R1986 IonicContact OD2-NH2 2.72Å; D1982-R1986 PolarHBondContact OD2-NH2 2.96Å
1983	F	48.9	Very low	45.5	Very low	78.2 Å²	78.2	78.7 Å²	78.7	34%	0.343	47%	0.472	S	S	.	.	H	α-helix	trans	-73.7	-43.8	174.4	-175.3	-112.6	0	0	0	111.8	S1979 A1980 D1981 K1985 R1986 I1987 A2101 L2106	S1979-F1983 PolarHBondContact O-N 3.25Å; S1979-F1983 VanDerWaalsContact O-N 3.14Å; A1980-F1983 WeakPolarHBondContact O-CB 3.23Å; A1980-F1983 PolarHBondContact O-N 3.07Å; A1980-F1983 VanDerWaalsContact O-N 3.17Å; D1981-F1983 VanDerWaalsContact C-N 3.26Å; D1981-F1983 PolarHBondContact O-N 2.98Å; F1983-K1985 VanDerWaalsContact C-N 3.31Å; F1983-K1985 PolarHBondContact O-N 2.84Å; F1983-R1986 PolarHBondContact O-N 3.06Å; F1983-R1986 VanDerWaalsContact O-N 3.14Å; F1983-I1987 HydrophobicContact CD1-CD1 3.77Å; F1983-I1987 HydrophobicContact CD1-CG1 4.37Å; F1983-I1987 HydrophobicContact CD2-CD1 4.41Å; F1983-I1987 HydrophobicContact CD2-CG1 4.45Å; F1983-I1987 HydrophobicContact CE1-CD1 3.27Å; F1983-I1987 VanDerWaalsContact CE1-CD1 3.48Å; F1983-I1987 HydrophobicContact CE1-CG1 4.1Å; F1983-I1987 HydrophobicContact CE2-CD1 4.23Å; F1983-I1987 HydrophobicContact CE2-CG1 4.18Å; F1983-I1987 HydrophobicContact CG-CD1 4.34Å; F1983-I1987 HydrophobicContact CZ-CD1 3.53Å; F1983-I1987 HydrophobicContact CZ-CG1 4.01Å; F1983-I1987 WeakPolarHBondContact O-CG1 3.26Å; F1983-I1987 PolarHBondContact O-N 3.2Å; F1983-A2101 HydrophobicContact CB-CB 4.35Å; F1983-A2101 HydrophobicContact CD2-CB 3.71Å; F1983-A2101 HydrophobicContact CE1-CB 3.66Å; F1983-A2101 HydrophobicContact CE2-CB 4.25Å; F1983-A2101 HydrophobicContact CG-CB 4.25Å; F1983-A2101 HydrophobicContact CZ-CB 4.2Å; F1983-L2106 HydrophobicContact CE2-CD1 4.01Å; F1983-L2106 HydrophobicContact CE2-CD2 3.52Å; F1983-L2106 HydrophobicContact CE2-CG 3.89Å; F1983-L2106 HydrophobicContact CZ-CD2 3.32Å; F1983-L2106 HydrophobicContact CZ-CG 4.14Å
1984	S	51	Low	48.2	Very low	56.4 Å²	56.4	73.1 Å²	73.1	39%	0.394	45%	0.445	S	S	.	.	H	α-helix	trans	-59.5	-37.3	175	-131.2	0	0	0	0	112.1	A1980 D1981 I1987 K1988	A1980-S1984 PolarHBondContact O-N 2.84Å; A1980-S1984 VanDerWaalsContact O-N 3.13Å; A1980-S1984 PolarHBondContact O-OG 3.17Å; D1981-S1984 PolarHBondContact O-N 3.04Å; S1984-I1987 PolarHBondContact O-N 3.13Å; S1984-K1988 WeakPolarHBondContact O-CB 3.31Å; S1984-K1988 WeakPolarHBondContact O-CD 3.49Å; S1984-K1988 VanDerWaalsContact O-CG 3.24Å; S1984-K1988 WeakPolarHBondContact O-CG 3.42Å; S1984-K1988 PolarHBondContact O-N 3.11Å; S1984-K1988 VanDerWaalsContact O-N 3.16Å
1985	K	55.8	Low	51.2	Low	45.6 Å²	45.6	69.3 Å²	69.3	20%	0.198	42%	0.419	C	S	.	.	H	α-helix	trans	-68.3	-44.2	174.4	-70.9	168.4	-175.9	175	0	111.7	D1981 D1982 F1983 I1987 K1988 L1989 Y1996 D2001	D1981-K1985 VanDerWaalsContact O-CB 3.32Å; D1981-K1985 WeakPolarHBondContact O-CB 3.32Å; D1981-K1985 WeakPolarHBondContact O-CD 3.5Å; D1981-K1985 VanDerWaalsContact O-CG 3.29Å; D1981-K1985 WeakPolarHBondContact O-CG 3.33Å; D1981-K1985 PolarHBondContact O-N 3.14Å; D1981-K1985 VanDerWaalsContact O-N 3.14Å; D1981-K1985 WeakPolarHBondContact OD2-CE 3.34Å; D1981-K1985 IonicContact OD2-NZ 2.66Å; D1981-K1985 PolarHBondContact OD2-NZ 2.83Å; D1982-K1985 PolarHBondContact O-N 3.14Å; F1983-K1985 VanDerWaalsContact C-N 3.31Å; F1983-K1985 PolarHBondContact O-N 2.84Å; K1985-I1987 PolarHBondContact O-N 3.1Å; K1985-K1988 WeakPolarHBondContact O-CB 3.39Å; K1985-K1988 PolarHBondContact O-N 3.2Å; K1985-K1988 VanDerWaalsContact O-N 3.15Å; K1985-L1989 VanDerWaalsContact O-CD1 3.32Å; K1985-L1989 WeakPolarHBondContact O-CD1 3.45Å; K1985-L1989 WeakPolarHBondContact O-CG 3.46Å; K1985-L1989 PolarHBondContact O-N 3.05Å; K1985-L1989 VanDerWaalsContact O-N 3.11Å; K1985-Y1996 HydrophobicContact CD-CD1 4.47Å; K1985-Y1996 HydrophobicContact CD-CE1 4.34Å; K1985-D2001 WeakPolarHBondContact CE-OD2 3.32Å; K1985-D2001 IonicContact NZ-OD2 3.5Å; K1985-D2001 PolarHBondContact NZ-OD2 3.17Å
1986	R	53.3	Low	53.9	Low	57.4 Å²	57.4	69.3 Å²	69.3	22%	0.217	41%	0.405	C	S	.	.	H	α-helix	trans	-60.6	-43.9	174.3	-93.9	-175.9	-146.9	-142.3	4.1	112.3	E1866 D1910 Y1915 D1982 F1983 K1988 L1989 L1990	E1866-R1986 IonicContact OE2-NH2 3.4Å; D1910-R1986 IonicContact OD1-CZ 3.63Å; D1910-R1986 IonicContact OD1-NH1 2.87Å; D1910-R1986 PolarHBondContact OD1-NH1 2.67Å; D1910-R1986 IonicContact OD1-NH2 2.84Å; D1910-R1986 PolarHBondContact OD1-NH2 2.85Å; D1910-R1986 IonicContact OD2-NH1 2.84Å; D1910-R1986 IonicContact OD2-NH2 2.72Å; D1910-R1986 PolarHBondContact OD2-NH2 2.93Å; Y1915-R1986 HydrophobicContact CE1-CG 4.32Å; Y1915-R1986 PolarHBondContact OH-NE 3.16Å; Y1915-R1986 PolarHBondContact OH-NH1 3.15Å; Y1915-R1986 VanDerWaalsContact OH-NH1 3.13Å; Y1915-R1986 PolarHBondContact OH-NH2 3.42Å; D1982-R1986 WeakPolarHBondContact O-CB 3.24Å; D1982-R1986 WeakPolarHBondContact O-CD 3.3Å; D1982-R1986 VanDerWaalsContact O-CG 3.26Å; D1982-R1986 WeakPolarHBondContact O-CG 3.38Å; D1982-R1986 PolarHBondContact O-N 3.12Å; D1982-R1986 VanDerWaalsContact O-N 3.09Å; D1982-R1986 PolarHBondContact O-NE 2.76Å; D1982-R1986 VanDerWaalsContact O-NE 3.13Å; D1982-R1986 IonicContact OD2-CZ 3.81Å; D1982-R1986 IonicContact OD2-NE 2.68Å; D1982-R1986 IonicContact OD2-NH2 2.72Å; D1982-R1986 PolarHBondContact OD2-NH2 2.96Å; F1983-R1986 PolarHBondContact O-N 3.06Å; F1983-R1986 VanDerWaalsContact O-N 3.14Å; R1986-K1988 VanDerWaalsContact C-N 3.29Å; R1986-K1988 PolarHBondContact O-N 3Å; R1986-L1989 WeakPolarHBondContact O-CA 3.39Å; R1986-L1989 VanDerWaalsContact O-CB 3.25Å; R1986-L1989 WeakPolarHBondContact O-CB 3.37Å; R1986-L1989 PolarHBondContact O-N 3.16Å; R1986-L1990 WeakPolarHBondContact O-CG 3.27Å; R1986-L1990 PolarHBondContact O-N 2.85Å; R1986-L1990 VanDerWaalsContact O-N 3.13Å
1987	I	49.8	Very low	56.6	Low	82 Å²	82	68.8 Å²	68.8	42%	0.421	39%	0.388	S	S	.	.	H	α-helix	trans	-61.1	-38.6	175.4	-71.1	176.2	0	0	0	111.7	F1983 S1984 K1985 L1989 L1990 S1991	F1983-I1987 HydrophobicContact CD1-CD1 3.77Å; F1983-I1987 HydrophobicContact CD1-CG1 4.37Å; F1983-I1987 HydrophobicContact CD2-CD1 4.41Å; F1983-I1987 HydrophobicContact CD2-CG1 4.45Å; F1983-I1987 HydrophobicContact CE1-CD1 3.27Å; F1983-I1987 VanDerWaalsContact CE1-CD1 3.48Å; F1983-I1987 HydrophobicContact CE1-CG1 4.1Å; F1983-I1987 HydrophobicContact CE2-CD1 4.23Å; F1983-I1987 HydrophobicContact CE2-CG1 4.18Å; F1983-I1987 HydrophobicContact CG-CD1 4.34Å; F1983-I1987 HydrophobicContact CZ-CD1 3.53Å; F1983-I1987 HydrophobicContact CZ-CG1 4.01Å; F1983-I1987 WeakPolarHBondContact O-CG1 3.26Å; F1983-I1987 PolarHBondContact O-N 3.2Å; S1984-I1987 PolarHBondContact O-N 3.13Å; K1985-I1987 PolarHBondContact O-N 3.1Å; I1987-L1989 VanDerWaalsContact C-N 3.31Å; I1987-L1989 PolarHBondContact O-N 3.06Å; I1987-L1990 HydrophobicContact CB-CD1 4.47Å; I1987-L1990 HydrophobicContact CG1-CD1 4.33Å; I1987-L1990 VanDerWaalsContact O-CB 3.28Å; I1987-L1990 WeakPolarHBondContact O-CB 3.41Å; I1987-L1990 PolarHBondContact O-N 3.18Å; I1987-L1990 VanDerWaalsContact O-N 3.11Å; I1987-S1991 PolarHBondContact O-N 3.13Å
1988	K	50.3	Low	59.4	Low	124.8 Å²	124.8	64.6 Å²	64.6	54%	0.543	36%	0.359	S	S	.	.	H	α-helix	trans	-63.9	-27.5	175.1	-73.8	172.7	-176.7	176	0	112.6	S1984 K1985 R1986 S1991 I1993	S1984-K1988 WeakPolarHBondContact O-CB 3.31Å; S1984-K1988 WeakPolarHBondContact O-CD 3.49Å; S1984-K1988 VanDerWaalsContact O-CG 3.24Å; S1984-K1988 WeakPolarHBondContact O-CG 3.42Å; S1984-K1988 PolarHBondContact O-N 3.11Å; S1984-K1988 VanDerWaalsContact O-N 3.16Å; K1985-K1988 WeakPolarHBondContact O-CB 3.39Å; K1985-K1988 PolarHBondContact O-N 3.2Å; K1985-K1988 VanDerWaalsContact O-N 3.15Å; R1986-K1988 VanDerWaalsContact C-N 3.29Å; R1986-K1988 PolarHBondContact O-N 3Å; K1988-S1991 WeakPolarHBondContact O-CB 3.31Å; K1988-S1991 PolarHBondContact O-N 3.05Å; K1988-S1991 PolarHBondContact O-OG 3.41Å; K1988-I1993 HydrophobicContact CB-CD1 4.46Å; K1988-I1993 VanDerWaalsContact O-CD1 3.31Å; K1988-I1993 WeakPolarHBondContact O-CD1 3.24Å; K1988-I1993 WeakPolarHBondContact O-CG1 3.49Å
1989	L	53.5	Low	61.7	Low	21.8 Å²	21.8	62.6 Å²	62.6	11%	0.114	34%	0.344	C	S	.	.	H	α-helix	trans	-74.5	-34	174	-65.3	162.7	0	0	0	112.3	K1985 R1986 I1987 S1991 G1992 I1993 L2003 V2005	K1985-L1989 VanDerWaalsContact O-CD1 3.32Å; K1985-L1989 WeakPolarHBondContact O-CD1 3.45Å; K1985-L1989 WeakPolarHBondContact O-CG 3.46Å; K1985-L1989 PolarHBondContact O-N 3.05Å; K1985-L1989 VanDerWaalsContact O-N 3.11Å; R1986-L1989 WeakPolarHBondContact O-CA 3.39Å; R1986-L1989 VanDerWaalsContact O-CB 3.25Å; R1986-L1989 WeakPolarHBondContact O-CB 3.37Å; R1986-L1989 PolarHBondContact O-N 3.16Å; I1987-L1989 VanDerWaalsContact C-N 3.31Å; I1987-L1989 PolarHBondContact O-N 3.06Å; L1989-S1991 PolarHBondContact O-N 3.12Å; L1989-S1991 VanDerWaalsContact O-N 3.15Å; L1989-G1992 PolarHBondContact O-N 3.12Å; L1989-G1992 VanDerWaalsContact O-N 3.09Å; L1989-I1993 HydrophobicContact CD2-CB 4.48Å; L1989-I1993 HydrophobicContact CD2-CG2 4.44Å; L1989-I1993 WeakPolarHBondContact CD2-O 3.43Å; L1989-I1993 PolarHBondContact O-N 3.19Å; L1989-L2003 HydrophobicContact CD1-CB 4.25Å; L1989-L2003 HydrophobicContact CD1-CD1 3.64Å; L1989-L2003 HydrophobicContact CD1-CD2 3.35Å; L1989-L2003 HydrophobicContact CD1-CG 4.04Å; L1989-L2003 HydrophobicContact CD2-CD2 3.97Å; L1989-L2003 HydrophobicContact CG-CD2 4.22Å; L1989-V2005 HydrophobicContact CB-CG2 4.2Å; L1989-V2005 HydrophobicContact CD1-CG2 3.66Å; L1989-V2005 VanDerWaalsContact CD1-CG2 3.49Å; L1989-V2005 HydrophobicContact CD2-CG2 3.77Å; L1989-V2005 VanDerWaalsContact CD2-CG2 3.5Å; L1989-V2005 HydrophobicContact CG-CG2 4.17Å
1990	L	52	Low	63.8	Low	83.6 Å²	83.6	65.4 Å²	65.4	44%	0.438	35%	0.351	S	S	.	.	H	α-helix	trans	-60.3	-20.3	172.3	-63.7	173.8	0	0	0	112.7	R1986 I1987 G1992 L2096 D2097	R1986-L1990 WeakPolarHBondContact O-CG 3.27Å; R1986-L1990 PolarHBondContact O-N 2.85Å; R1986-L1990 VanDerWaalsContact O-N 3.13Å; I1987-L1990 HydrophobicContact CB-CD1 4.47Å; I1987-L1990 HydrophobicContact CG1-CD1 4.33Å; I1987-L1990 VanDerWaalsContact O-CB 3.28Å; I1987-L1990 WeakPolarHBondContact O-CB 3.41Å; I1987-L1990 PolarHBondContact O-N 3.18Å; I1987-L1990 VanDerWaalsContact O-N 3.11Å; L1990-G1992 PolarHBondContact O-N 2.96Å; L1990-G1992 VanDerWaalsContact O-N 3.14Å; L1990-L2096 HydrophobicContact CD1-CB 4.36Å; L1990-L2096 HydrophobicContact CD2-CD1 3.83Å; L1990-D2097 VanDerWaalsContact CD1-CA 3.49Å; L1990-D2097 HydrophobicContact CD1-CB 3.88Å; L1990-D2097 WeakPolarHBondContact CD1-O 3.44Å; L1990-D2097 HydrophobicContact CD2-CB 3.79Å; L1990-D2097 VanDerWaalsContact CD2-CB 3.43Å; L1990-D2097 WeakPolarHBondContact CD2-O 3.47Å; L1990-D2097 WeakPolarHBondContact CD2-OD1 3.23Å; L1990-D2097 HydrophobicContact CG-CB 4.43Å
1991	S	56.4	Low	66.3	Low	86.2 Å²	86.2	63 Å²	63	60%	0.603	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.5	7	173.2	78.2	0	0	0	0	114.7	I1987 K1988 L1989 I1993	I1987-S1991 PolarHBondContact O-N 3.13Å; K1988-S1991 WeakPolarHBondContact O-CB 3.31Å; K1988-S1991 PolarHBondContact O-N 3.05Å; K1988-S1991 PolarHBondContact O-OG 3.41Å; L1989-S1991 PolarHBondContact O-N 3.12Å; L1989-S1991 VanDerWaalsContact O-N 3.15Å; S1991-I1993 WeakPolarHBondContact OG-CD1 3.37Å; S1991-I1993 WeakPolarHBondContact OG-CG1 3.28Å
1992	G	66.3	Low	68.3	Low	39.4 Å²	39.4	58.4 Å²	58.4	41%	0.406	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.4	11.7	177	0	0	0	0	0	114.8	L1989 L1990 Y2008	L1989-G1992 PolarHBondContact O-N 3.12Å; L1989-G1992 VanDerWaalsContact O-N 3.09Å; L1990-G1992 PolarHBondContact O-N 2.96Å; L1990-G1992 VanDerWaalsContact O-N 3.14Å; G1992-Y2008 PolarHBondContact O-OH 2.93Å
1993	I	76	Confident	70.2	Confident	75.4 Å²	75.4	57.2 Å²	57.2	39%	0.387	30%	0.296	S	S	.	.			trans	-76.7	125.7	176.3	-61.7	175.6	0	0	0	108.8	K1988 L1989 S1991 A1995	K1988-I1993 HydrophobicContact CB-CD1 4.46Å; K1988-I1993 VanDerWaalsContact O-CD1 3.31Å; K1988-I1993 WeakPolarHBondContact O-CD1 3.24Å; K1988-I1993 WeakPolarHBondContact O-CG1 3.49Å; L1989-I1993 HydrophobicContact CD2-CB 4.48Å; L1989-I1993 HydrophobicContact CD2-CG2 4.44Å; L1989-I1993 WeakPolarHBondContact CD2-O 3.43Å; L1989-I1993 PolarHBondContact O-N 3.19Å; S1991-I1993 WeakPolarHBondContact OG-CD1 3.37Å; S1991-I1993 WeakPolarHBondContact OG-CG1 3.28Å; I1993-A1995 VanDerWaalsContact CG2-O 3.28Å; I1993-A1995 WeakPolarHBondContact CG2-O 3.41Å; I1993-A1995 PolarHBondContact O-N 3.02Å
1994	P	81.8	Confident	72.2	Confident	27.4 Å²	27.4	53.4 Å²	53.4	18%	0.178	28%	0.28	C	S	.	.			trans	-72.5	-29.9	-173.1	18.6	-23.3	0	0	0	113.9	V2005 Y2008 Y2044	P1994-V2005 WeakPolarHBondContact O-CB 3.49Å; P1994-V2005 PolarHBondContact O-N 2.99Å; P1994-Y2008 VanDerWaalsContact CA-CD2 3.49Å; P1994-Y2008 HydrophobicContact CB-CD1 4.09Å; P1994-Y2008 HydrophobicContact CB-CD2 3.94Å; P1994-Y2008 HydrophobicContact CB-CE1 4.49Å; P1994-Y2008 HydrophobicContact CB-CE2 4.42Å; P1994-Y2008 HydrophobicContact CB-CG 3.67Å; P1994-Y2008 HydrophobicContact CG-CD1 3.86Å; P1994-Y2008 HydrophobicContact CG-CE1 4.08Å; P1994-Y2008 HydrophobicContact CG-CG 4.21Å; P1994-Y2044 HydrophobicContact CB-CD2 4.11Å; P1994-Y2044 HydrophobicContact CB-CE2 4.4Å; P1994-Y2044 HydrophobicContact CG-CD2 4.37Å; P1994-Y2044 HydrophobicContact CG-CE2 4.32Å
1995	A	85.8	Confident	74	Confident	15.8 Å²	15.8	51.5 Å²	51.5	13%	0.131	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.4	156.4	-179.8	0	0	0	0	0	112.5	I1993 L2003 I2004 Y2044	I1993-A1995 VanDerWaalsContact CG2-O 3.28Å; I1993-A1995 WeakPolarHBondContact CG2-O 3.41Å; I1993-A1995 PolarHBondContact O-N 3.02Å; A1995-L2003 CarbonylContact C-O 3.57Å; A1995-L2003 WeakPolarHBondContact CA-O 3.38Å; A1995-L2003 VanDerWaalsContact CB-O 3.31Å; A1995-L2003 WeakPolarHBondContact CB-O 3.33Å; A1995-I2004 HydrophobicContact CB-CB 4.3Å; A1995-I2004 HydrophobicContact CB-CG1 3.74Å; A1995-I2004 HydrophobicContact CB-CG2 4.46Å; A1995-Y2044 HydrophobicContact CB-CD2 3.98Å; A1995-Y2044 HydrophobicContact CB-CE1 4.37Å; A1995-Y2044 HydrophobicContact CB-CE2 3.34Å
1996	Y	84.7	Confident	75.7	Confident	96.6 Å²	96.6	49.5 Å²	49.5	38%	0.379	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	126.4	163.7	173.7	-103.1	0	0	0	108.3	K1985 D2001 G2002 L2003	K1985-Y1996 HydrophobicContact CD-CD1 4.47Å; K1985-Y1996 HydrophobicContact CD-CE1 4.34Å; Y1996-D2001 WeakPolarHBondContact CE1-OD1 3.35Å; Y1996-G2002 CarbonylContact O-C 3.44Å; Y1996-G2002 WeakPolarHBondContact O-CA 3.41Å; Y1996-L2003 PolarHBondContact N-O 3.13Å; Y1996-L2003 PolarHBondContact O-N 3.15Å
1997	R	85.2	Confident	77.2	Confident	84.6 Å²	84.6	48.6 Å²	48.6	32%	0.319	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	129.5	179.3	-48.1	-171.9	-77.1	177	9.4	110.2	E1898 W1918 Y2044 T2053 V2054	E1898-R1997 IonicContact OE1-CZ 3.45Å; E1898-R1997 IonicContact OE1-NH1 2.71Å; E1898-R1997 IonicContact OE1-NH2 3.12Å; E1898-R1997 PolarHBondContact OE1-NH2 2.87Å; W1918-R1997 HydrophobicContact CH2-CG 4.28Å; W1918-R1997 HydrophobicContact CZ2-CB 4.39Å; W1918-R1997 HydrophobicContact CZ2-CG 4.32Å; R1997-Y2044 VanDerWaalsContact CD-OH 3.24Å; R1997-Y2044 WeakPolarHBondContact CD-OH 3.22Å; R1997-Y2044 VanDerWaalsContact CZ-OH 3.24Å; R1997-Y2044 PolarHBondContact NE-OH 3.28Å; R1997-Y2044 PolarHBondContact NH1-OH 3.47Å; R1997-T2053 PolarHBondContact NH1-O 2.92Å; R1997-V2054 VanDerWaalsContact CD-CG1 3.48Å; R1997-V2054 HydrophobicContact CG-CG2 4.37Å
1998	S	85.8	Confident	79.1	Confident	25.6 Å²	25.6	47.4 Å²	47.4	18%	0.179	25%	0.249	C	C	.	.			trans	-144	160.7	167.6	113.4	0	0	0	0	108.9	W1918 E2000 D2001	W1918-S1998 PolarHBondContact NE1-O 3.35Å; S1998-E2000 PolarHBondContact O-N 3.16Å; S1998-E2000 PolarHBondContact OG-N 2.99Å; S1998-D2001 CarbonylContact C-O 3.55Å; S1998-D2001 VanDerWaalsContact CA-O 3.27Å; S1998-D2001 WeakPolarHBondContact CA-O 3.31Å; S1998-D2001 VanDerWaalsContact CB-O 3.25Å; S1998-D2001 WeakPolarHBondContact CB-O 3.32Å; S1998-D2001 WeakPolarHBondContact CB-OD1 3.39Å; S1998-D2001 PolarHBondContact N-O 3.26Å; S1998-D2001 VanDerWaalsContact O-O 3.06Å; S1998-D2001 PolarHBondContact OG-N 3.26Å; S1998-D2001 VanDerWaalsContact OG-N 3.08Å; S1998-D2001 PolarHBondContact OG-O 3.3Å; S1998-D2001 VanDerWaalsContact OG-O 3.1Å; S1998-D2001 PolarHBondContact OG-OD1 3.23Å
1999	M	83.5	Confident	81.1	Confident	38.8 Å²	38.8	41.9 Å²	41.9	19%	0.191	23%	0.226	C	C	.	.	S	Bend	trans	-70	-15.1	174.3	-94	-57	-79.3	0	0	112.9	Y1894 E1896 R1901 S1902 A1903 K1920	Y1894-M1999 HydrophobicContact CD1-SD 4Å; Y1894-M1999 HydrophobicContact CE1-CG 4.42Å; Y1894-M1999 HydrophobicContact CE1-SD 3.81Å; E1896-M1999 HydrophobicContact CB-SD 3.95Å; E1896-M1999 WeakPolarHBondContact OE2-CG 3.48Å; R1901-M1999 HydrophobicContact CB-CE 3.52Å; R1901-M1999 VanDerWaalsContact CB-CE 3.44Å; R1901-M1999 HydrophobicContact CB-SD 4.08Å; S1902-M1999 VanDerWaalsContact CA-CE 3.41Å; A1903-M1999 HydrophobicContact CB-CE 3.8Å; A1903-M1999 VanDerWaalsContact CB-CE 3.49Å; A1903-M1999 HydrophobicContact CB-CG 4.28Å; A1903-M1999 WeakPolarHBondContact CB-O 3.38Å; K1920-M1999 WeakPolarHBondContact CD-O 3.34Å
2000	E	83.3	Confident	82.8	Confident	121.6 Å²	121.6	42.8 Å²	42.8	57%	0.568	23%	0.229	S	C	*	.	S	Bend	trans	-102.8	-28.5	180	-57.1	-156.8	141.1	0	0	112.7	Q1919 K1920 S1998	Q1919-E2000 CarbonylContact C-O 3.54Å; K1920-E2000 WeakPolarHBondContact CA-O 3.3Å; K1920-E2000 HydrophobicContact CB-CB 4.48Å; K1920-E2000 WeakPolarHBondContact CB-O 3.4Å; K1920-E2000 HydrophobicContact CD-CB 4.3Å; K1920-E2000 HydrophobicContact CD-CG 4.21Å; K1920-E2000 PolarHBondContact N-O 3.1Å; K1920-E2000 IonicContact NZ-OE1 2.74Å; K1920-E2000 PolarHBondContact NZ-OE1 3.23Å; S1998-E2000 PolarHBondContact O-N 3.16Å; S1998-E2000 PolarHBondContact OG-N 2.99Å
2001	D	88.7	Confident	84.7	Confident	24.2 Å²	24.2	39.7 Å²	39.7	13%	0.129	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.9	157.8	-178.1	67.4	-28.7	0	0	0	111	W1918 Q1919 K1985 Y1996 S1998	W1918-D2001 CarbonylContact O-C 3.52Å; W1918-D2001 VanDerWaalsContact O-CA 3.28Å; W1918-D2001 WeakPolarHBondContact O-CA 3.39Å; Q1919-D2001 HydrophobicContact CB-CB 4.45Å; Q1919-D2001 HydrophobicContact CG-CB 4.41Å; K1985-D2001 WeakPolarHBondContact CE-OD2 3.32Å; K1985-D2001 IonicContact NZ-OD2 3.5Å; K1985-D2001 PolarHBondContact NZ-OD2 3.17Å; Y1996-D2001 WeakPolarHBondContact CE1-OD1 3.35Å; S1998-D2001 CarbonylContact C-O 3.55Å; S1998-D2001 VanDerWaalsContact CA-O 3.27Å; S1998-D2001 WeakPolarHBondContact CA-O 3.31Å; S1998-D2001 VanDerWaalsContact CB-O 3.25Å; S1998-D2001 WeakPolarHBondContact CB-O 3.32Å; S1998-D2001 WeakPolarHBondContact CB-OD1 3.39Å; S1998-D2001 PolarHBondContact N-O 3.26Å; S1998-D2001 VanDerWaalsContact O-O 3.06Å; S1998-D2001 PolarHBondContact OG-N 3.26Å; S1998-D2001 VanDerWaalsContact OG-N 3.08Å; S1998-D2001 PolarHBondContact OG-O 3.3Å; S1998-D2001 VanDerWaalsContact OG-O 3.1Å; S1998-D2001 PolarHBondContact OG-OD1 3.23Å
2002	G	90.4	Very high	86.5	Confident	2.2 Å²	2.2	36.4 Å²	36.4	2%	0.023	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-168.8	165.4	172.8	0	0	0	0	0	112.9	K1917 W1918 Y1996	K1917-G2002 CarbonylContact C-O 3.52Å; K1917-G2002 VanDerWaalsContact CA-O 3.31Å; K1917-G2002 WeakPolarHBondContact CA-O 3.32Å; K1917-G2002 WeakPolarHBondContact CG-O 3.24Å; W1918-G2002 VanDerWaalsContact CE2-CA 3.42Å; W1918-G2002 PolarHBondContact N-O 2.92Å; W1918-G2002 PolarHBondContact O-N 3.27Å; Y1996-G2002 CarbonylContact O-C 3.44Å; Y1996-G2002 WeakPolarHBondContact O-CA 3.41Å
2003	L	91.1	Very high	87.6	Confident	12.6 Å²	12.6	38 Å²	38	7%	0.066	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	128.4	-171.9	-170.4	147.9	0	0	0	109	Y1915 I1916 K1917 L1989 A1995 Y1996 V2005	Y1915-L2003 VanDerWaalsContact CB-CD2 3.47Å; Y1915-L2003 HydrophobicContact CD1-CD1 4.35Å; Y1915-L2003 HydrophobicContact CD1-CD2 4.43Å; Y1915-L2003 HydrophobicContact CD2-CD1 3.43Å; Y1915-L2003 VanDerWaalsContact CD2-CD1 3.45Å; Y1915-L2003 HydrophobicContact CD2-CD2 3.93Å; Y1915-L2003 HydrophobicContact CD2-CG 3.7Å; Y1915-L2003 VanDerWaalsContact CD2-CG 3.46Å; Y1915-L2003 HydrophobicContact CE1-CD1 4.39Å; Y1915-L2003 HydrophobicContact CE2-CD1 3.6Å; Y1915-L2003 VanDerWaalsContact CE2-CD1 3.46Å; Y1915-L2003 HydrophobicContact CE2-CG 4.07Å; Y1915-L2003 HydrophobicContact CG-CD1 3.87Å; Y1915-L2003 HydrophobicContact CG-CD2 3.73Å; Y1915-L2003 HydrophobicContact CG-CG 3.98Å; I1916-L2003 CarbonylContact O-C 3.58Å; I1916-L2003 VanDerWaalsContact O-CA 3.27Å; I1916-L2003 WeakPolarHBondContact O-CA 3.42Å; K1917-L2003 HydrophobicContact CB-CD1 3.68Å; K1917-L2003 HydrophobicContact CB-CG 4.48Å; K1917-L2003 HydrophobicContact CD-CD1 4.29Å; K1917-L2003 HydrophobicContact CG-CD1 4.01Å; L1989-L2003 HydrophobicContact CD1-CB 4.25Å; L1989-L2003 HydrophobicContact CD1-CD1 3.64Å; L1989-L2003 HydrophobicContact CD1-CD2 3.35Å; L1989-L2003 HydrophobicContact CD1-CG 4.04Å; L1989-L2003 HydrophobicContact CD2-CD2 3.97Å; L1989-L2003 HydrophobicContact CG-CD2 4.22Å; A1995-L2003 CarbonylContact C-O 3.57Å; A1995-L2003 WeakPolarHBondContact CA-O 3.38Å; A1995-L2003 VanDerWaalsContact CB-O 3.31Å; A1995-L2003 WeakPolarHBondContact CB-O 3.33Å; Y1996-L2003 PolarHBondContact N-O 3.13Å; Y1996-L2003 PolarHBondContact O-N 3.15Å; L2003-V2005 HydrophobicContact CD2-CG2 4.01Å
2004	I	92	Very high	88.4	Confident	0.4 Å²	0.4	37.8 Å²	37.8	0%	0.002	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	125.7	173.6	-63.8	162	0	0	0	109	Y1915 I1916 W1918 A1995 L2006 V2009 V2042 Y2044 V2054	Y1915-I2004 CarbonylContact C-O 3.54Å; Y1915-I2004 VanDerWaalsContact CA-O 3.23Å; Y1915-I2004 WeakPolarHBondContact CA-O 3.39Å; Y1915-I2004 VanDerWaalsContact CB-O 3.26Å; Y1915-I2004 WeakPolarHBondContact CB-O 3.32Å; I1916-I2004 HydrophobicContact CD1-CB 4.38Å; I1916-I2004 HydrophobicContact CD1-CD1 4.39Å; I1916-I2004 HydrophobicContact CG1-CB 3.97Å; I1916-I2004 PolarHBondContact N-O 3.02Å; I1916-I2004 PolarHBondContact O-N 3.21Å; W1918-I2004 HydrophobicContact CH2-CD1 3.78Å; W1918-I2004 HydrophobicContact CH2-CG1 3.87Å; W1918-I2004 HydrophobicContact CZ3-CB 4.49Å; W1918-I2004 HydrophobicContact CZ3-CD1 3.64Å; W1918-I2004 HydrophobicContact CZ3-CG1 3.73Å; A1995-I2004 HydrophobicContact CB-CB 4.3Å; A1995-I2004 HydrophobicContact CB-CG1 3.74Å; A1995-I2004 HydrophobicContact CB-CG2 4.46Å; I2004-L2006 PolarHBondContact O-N 3.03Å; I2004-V2009 HydrophobicContact CG2-CG2 3.43Å; I2004-V2009 VanDerWaalsContact CG2-CG2 3.44Å; I2004-V2042 HydrophobicContact CD1-CB 4.44Å; I2004-V2042 HydrophobicContact CD1-CG1 4.26Å; I2004-Y2044 HydrophobicContact CD1-CD1 3.96Å; I2004-Y2044 HydrophobicContact CD1-CE1 3.96Å; I2004-Y2044 HydrophobicContact CG1-CD1 4.26Å; I2004-Y2044 HydrophobicContact CG1-CE1 4.19Å; I2004-Y2044 HydrophobicContact CG2-CD1 4.17Å; I2004-Y2044 HydrophobicContact CG2-CD2 4.37Å; I2004-Y2044 HydrophobicContact CG2-CG 3.96Å; I2004-V2054 HydrophobicContact CD1-CB 4.26Å; I2004-V2054 HydrophobicContact CD1-CG1 4.37Å; I2004-V2054 HydrophobicContact CD1-CG2 3.91Å; I2004-V2054 VanDerWaalsContact CD1-CG2 3.45Å
2005	V	89	Confident	88.5	Confident	15.6 Å²	15.6	37.4 Å²	37.4	10%	0.095	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	123.1	177	174.3	0	0	0	0	109.3	L1989 P1994 L2003 T2007 Y2008	L1989-V2005 HydrophobicContact CB-CG2 4.2Å; L1989-V2005 HydrophobicContact CD1-CG2 3.66Å; L1989-V2005 VanDerWaalsContact CD1-CG2 3.49Å; L1989-V2005 HydrophobicContact CD2-CG2 3.77Å; L1989-V2005 VanDerWaalsContact CD2-CG2 3.5Å; L1989-V2005 HydrophobicContact CG-CG2 4.17Å; P1994-V2005 WeakPolarHBondContact O-CB 3.49Å; P1994-V2005 PolarHBondContact O-N 2.99Å; L2003-V2005 HydrophobicContact CD2-CG2 4.01Å; V2005-T2007 VanDerWaalsContact C-N 3.26Å; V2005-T2007 VanDerWaalsContact CG1-OG1 3.26Å; V2005-T2007 WeakPolarHBondContact CG1-OG1 3.31Å; V2005-T2007 PolarHBondContact O-N 3.05Å; V2005-T2007 VanDerWaalsContact O-N 3.14Å; V2005-Y2008 HydrophobicContact CB-CD2 3.83Å; V2005-Y2008 HydrophobicContact CB-CE2 4.36Å; V2005-Y2008 HydrophobicContact CG1-CD2 3.75Å; V2005-Y2008 HydrophobicContact CG1-CE2 4.05Å; V2005-Y2008 PolarHBondContact O-N 3.06Å
2006	L	90	Very high	88.1	Confident	3.4 Å²	3.4	43.4 Å²	43.4	2%	0.018	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-63.7	-27.5	-170.4	-74.7	172.6	0	0	0	113.5	L1909 C1913 S1914 I1916 I2004 Y2008 V2009 L2070 I2073 L2074 L2077	L1909-L2006 HydrophobicContact CD1-CD1 3.51Å; L1909-L2006 VanDerWaalsContact CD1-CD1 3.48Å; C1913-L2006 WeakPolarHBondContact O-CD1 3.42Å; S1914-L2006 PolarHBondContact O-N 3.26Å; I1916-L2006 HydrophobicContact CD1-CD2 3.85Å; I1916-L2006 HydrophobicContact CG1-CD1 4.43Å; I1916-L2006 HydrophobicContact CG1-CD2 3.79Å; I1916-L2006 HydrophobicContact CG1-CG 4.1Å; I1916-L2006 HydrophobicContact CG2-CD2 4.06Å; I2004-L2006 PolarHBondContact O-N 3.03Å; L2006-Y2008 PolarHBondContact O-N 3.09Å; L2006-Y2008 VanDerWaalsContact O-N 3.11Å; L2006-V2009 HydrophobicContact CD2-CG2 4.23Å; L2006-V2009 WeakPolarHBondContact O-CB 3.36Å; L2006-V2009 PolarHBondContact O-N 3.1Å; L2006-V2009 VanDerWaalsContact O-N 3.1Å; L2006-L2070 HydrophobicContact CD2-CD2 4.39Å; L2006-I2073 HydrophobicContact CD1-CG2 3.89Å; L2006-L2074 HydrophobicContact CB-CD2 4.32Å; L2006-L2074 HydrophobicContact CD2-CD2 4.18Å; L2006-L2074 WeakPolarHBondContact O-CD2 3.29Å; L2006-L2077 HydrophobicContact CB-CD1 3.72Å; L2006-L2077 HydrophobicContact CD1-CD1 4.42Å
2007	T	85.6	Confident	87.5	Confident	39.4 Å²	39.4	41 Å²	41	24%	0.242	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-65.7	-15.3	176	62.3	0	0	0	0	113.8	L1872 V2005 Y2081 F2089 K2093	L1872-T2007 HydrophobicContact CD2-CG2 3.8Å; V2005-T2007 VanDerWaalsContact C-N 3.26Å; V2005-T2007 VanDerWaalsContact CG1-OG1 3.26Å; V2005-T2007 WeakPolarHBondContact CG1-OG1 3.31Å; V2005-T2007 PolarHBondContact O-N 3.05Å; V2005-T2007 VanDerWaalsContact O-N 3.14Å; T2007-Y2081 WeakPolarHBondContact CB-OH 3.31Å; T2007-Y2081 HydrophobicContact CG2-CE2 4.01Å; T2007-Y2081 VanDerWaalsContact CG2-OH 3.23Å; T2007-Y2081 WeakPolarHBondContact CG2-OH 3.37Å; T2007-F2089 HydrophobicContact CG2-CE1 4.34Å; T2007-F2089 HydrophobicContact CG2-CZ 4.04Å; T2007-K2093 HydrophobicContact CG2-CD 4.27Å; T2007-K2093 PolarHBondContact OG1-NZ 2.92Å
2008	Y	88.8	Confident	86.6	Confident	56.4 Å²	56.4	41.5 Å²	41.5	22%	0.221	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-102.7	-2.9	175.2	-63.5	-80.1	0	0	0	112.9	G1992 P1994 V2005 L2006 K2010 Y2044 G2045	G1992-Y2008 PolarHBondContact O-OH 2.93Å; P1994-Y2008 VanDerWaalsContact CA-CD2 3.49Å; P1994-Y2008 HydrophobicContact CB-CD1 4.09Å; P1994-Y2008 HydrophobicContact CB-CD2 3.94Å; P1994-Y2008 HydrophobicContact CB-CE1 4.49Å; P1994-Y2008 HydrophobicContact CB-CE2 4.42Å; P1994-Y2008 HydrophobicContact CB-CG 3.67Å; P1994-Y2008 HydrophobicContact CG-CD1 3.86Å; P1994-Y2008 HydrophobicContact CG-CE1 4.08Å; P1994-Y2008 HydrophobicContact CG-CG 4.21Å; V2005-Y2008 HydrophobicContact CB-CD2 3.83Å; V2005-Y2008 HydrophobicContact CB-CE2 4.36Å; V2005-Y2008 HydrophobicContact CG1-CD2 3.75Å; V2005-Y2008 HydrophobicContact CG1-CE2 4.05Å; V2005-Y2008 PolarHBondContact O-N 3.06Å; L2006-Y2008 PolarHBondContact O-N 3.09Å; L2006-Y2008 VanDerWaalsContact O-N 3.11Å; Y2008-K2010 PolarHBondContact O-N 3.29Å; Y2008-Y2044 CarbonylContact O-C 3.56Å; Y2008-Y2044 WeakPolarHBondContact O-CA 3.37Å; Y2008-Y2044 VanDerWaalsContact O-CB 3.3Å; Y2008-Y2044 WeakPolarHBondContact O-CB 3.43Å; Y2008-G2045 PolarHBondContact O-N 3.26Å
2009	V	92.5	Very high	86.2	Confident	9.8 Å²	9.8	46.4 Å²	46.4	6%	0.059	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	126.6	178.2	178	0	0	0	0	109.6	I2004 L2006 V2012 V2042 V2043 L2074	I2004-V2009 HydrophobicContact CG2-CG2 3.43Å; I2004-V2009 VanDerWaalsContact CG2-CG2 3.44Å; L2006-V2009 HydrophobicContact CD2-CG2 4.23Å; L2006-V2009 WeakPolarHBondContact O-CB 3.36Å; L2006-V2009 PolarHBondContact O-N 3.1Å; L2006-V2009 VanDerWaalsContact O-N 3.1Å; V2009-V2012 HydrophobicContact CG1-CG2 3.95Å; V2009-V2042 HydrophobicContact CG1-CG1 3.75Å; V2009-V2042 HydrophobicContact CG2-CG1 4.01Å; V2009-V2043 CarbonylContact C-O 3.51Å; V2009-V2043 WeakPolarHBondContact CA-O 3.44Å; V2009-L2074 HydrophobicContact CB-CD1 4.36Å; V2009-L2074 HydrophobicContact CB-CD2 3.69Å; V2009-L2074 HydrophobicContact CG1-CD1 3.57Å; V2009-L2074 HydrophobicContact CG1-CD2 3.82Å; V2009-L2074 HydrophobicContact CG1-CG 4.36Å
2010	K	90	Very high	86.3	Confident	39.6 Å²	39.6	45.5 Å²	45.5	17%	0.172	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	-45.6	-176.7	-65.4	176	169.1	-177.6	0	111.4	Y2008 V2043 T2047 L2048 D2050 N2051 K2078	Y2008-K2010 PolarHBondContact O-N 3.29Å; K2010-V2043 HydrophobicContact CB-CG1 4.4Å; K2010-V2043 HydrophobicContact CD-CG1 4.44Å; K2010-V2043 PolarHBondContact N-O 3Å; K2010-T2047 VanDerWaalsContact CE-O 3.3Å; K2010-T2047 WeakPolarHBondContact CE-O 3.31Å; K2010-T2047 PolarHBondContact NZ-O 2.94Å; K2010-L2048 PolarHBondContact NZ-O 3.27Å; K2010-D2050 WeakPolarHBondContact CE-O 3.33Å; K2010-D2050 PolarHBondContact NZ-O 3.2Å; K2010-N2051 VanDerWaalsContact CD-OD1 3.27Å; K2010-N2051 WeakPolarHBondContact CD-OD1 3.33Å; K2010-N2051 PolarHBondContact NZ-OD1 3.33Å; K2010-K2078 WeakPolarHBondContact O-CE 3.35Å; K2010-K2078 PolarHBondContact O-NZ 2.91Å
2011	S	91.1	Very high	86.4	Confident	18.6 Å²	18.6	44.5 Å²	44.5	13%	0.13	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	158.6	176.2	58.8	0	0	0	0	112.5	E2013 V2043 R2484	S2011-E2013 WeakPolarHBondContact CB-OE1 3.34Å; S2011-E2013 PolarHBondContact OG-OE1 2.98Å; S2011-V2043 PolarHBondContact N-O 2.96Å; S2011-V2043 PolarHBondContact O-N 3.27Å; S2011-V2043 WeakPolarHBondContact OG-CG2 3.34Å; S2011-R2484 VanDerWaalsContact OG-CZ 3.22Å; S2011-R2484 PolarHBondContact OG-NH1 3.25Å; S2011-R2484 PolarHBondContact OG-NH2 3.23Å
2012	V	94.1	Very high	86.5	Confident	16.4 Å²	16.4	44.6 Å²	44.6	10%	0.099	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	120.4	171.3	174.4	0	0	0	0	106.7	V2009 F2040 S2041 V2042 T2067 L2070 L2074	V2009-V2012 HydrophobicContact CG1-CG2 3.95Å; V2012-F2040 HydrophobicContact CG1-CD2 4.32Å; V2012-S2041 WeakPolarHBondContact CA-O 3.36Å; V2012-V2042 HydrophobicContact CG1-CG2 4.43Å; V2012-V2042 HydrophobicContact CG2-CB 4.43Å; V2012-V2042 HydrophobicContact CG2-CG1 4.09Å; V2012-V2042 HydrophobicContact CG2-CG2 4.13Å; V2012-T2067 HydrophobicContact CG1-CG2 3.97Å; V2012-L2070 HydrophobicContact CB-CB 4.45Å; V2012-L2070 HydrophobicContact CG1-CB 4.24Å; V2012-L2070 HydrophobicContact CG1-CD1 4.34Å; V2012-L2070 HydrophobicContact CG2-CB 4.24Å; V2012-L2070 HydrophobicContact CG2-CD1 4.46Å; V2012-L2074 HydrophobicContact CB-CD1 4.2Å; V2012-L2074 HydrophobicContact CG2-CD1 3.51Å; V2012-L2074 VanDerWaalsContact CG2-CD1 3.47Å
2013	E	90.5	Very high	86.4	Confident	73.2 Å²	73.2	48.2 Å²	48.2	34%	0.342	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	141	-170.1	-68.5	174	-153	0	0	111.1	S2011 C2015 F2040 S2041 R2484 R2529	S2011-E2013 WeakPolarHBondContact CB-OE1 3.34Å; S2011-E2013 PolarHBondContact OG-OE1 2.98Å; E2013-C2015 PolarHBondContact O-N 3.32Å; E2013-F2040 CarbonylContact O-C 3.52Å; E2013-F2040 VanDerWaalsContact O-CA 3.26Å; E2013-F2040 WeakPolarHBondContact O-CA 3.31Å; E2013-F2040 WeakPolarHBondContact O-CB 3.35Å; E2013-S2041 PolarHBondContact N-O 3.2Å; E2013-S2041 VanDerWaalsContact N-O 3.1Å; E2013-S2041 PolarHBondContact O-N 3.14Å; E2013-S2041 PolarHBondContact O-OG 3.12Å; E2013-R2484 IonicContact OE1-NH1 3.78Å; E2013-R2529 IonicContact OE2-CZ 3.28Å; E2013-R2529 IonicContact OE2-NH1 3.04Å; E2013-R2529 PolarHBondContact OE2-NH1 3.27Å; E2013-R2529 IonicContact OE2-NH2 2.86Å; E2013-R2529 PolarHBondContact OE2-NH2 2.66Å
2014	I	91.8	Very high	86.2	Confident	70.6 Å²	70.6	49.2 Å²	49.2	36%	0.362	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	125.4	167.4	-61.5	176.9	0	0	0	107.8	N2016 K2038 C2039 T2067	I2014-N2016 PolarHBondContact O-N 3.12Å; I2014-K2038 HydrophobicContact CD1-CD 4.4Å; I2014-K2038 HydrophobicContact CG2-CB 4.43Å; I2014-K2038 HydrophobicContact CG2-CD 4.33Å; I2014-C2039 WeakPolarHBondContact CA-O 3.26Å; I2014-T2067 HydrophobicContact CG1-CG2 3.86Å
2015	C	84.6	Confident	86	Confident	20.8 Å²	20.8	49.3 Å²	49.3	14%	0.141	27%	0.269	C	S	.	.			trans	-123.1	132.6	-175.3	48.7	0	0	0	0	111.6	E2013 N2017 P2018 C2039 S2041	E2013-C2015 PolarHBondContact O-N 3.32Å; C2015-N2017 VanDerWaalsContact C-N 3.33Å; C2015-N2017 PolarHBondContact O-N 2.82Å; C2015-P2018 HydrophobicContact CB-CB 4.34Å; C2015-P2018 HydrophobicContact CB-CG 4.5Å; C2015-C2039 HydrophobicContact CB-CB 4.11Å; C2015-C2039 PolarHBondContact N-O 3.2Å; C2015-C2039 WeakPolarHBondContact O-CB 3.3Å; C2015-C2039 VanDerWaalsContact O-O 3.12Å; C2015-S2041 WeakPolarHBondContact SG-CB 3.23Å; C2015-S2041 PolarHBondContact SG-OG 3.04Å; C2015-S2041 VanDerWaalsContact SG-OG 3.32Å
2016	N	77.4	Confident	86	Confident	141.2 Å²	141.2	49 Å²	49	76%	0.755	27%	0.266	S	S	*	.			trans	-92.3	78.5	166.8	-66.3	-20.1	0	0	0	108	I2014 P2018	I2014-N2016 PolarHBondContact O-N 3.12Å; N2016-P2018 WeakPolarHBondContact O-CD 3.37Å
2017	N	71	Confident	85.9	Confident	46.8 Å²	46.8	53.7 Å²	53.7	25%	0.25	29%	0.288	S	S	.	.			trans	-90.1	114.5	178.8	-156.7	-23.2	0	0	0	109.6	C2015 D2019 F2020 Y2055	C2015-N2017 VanDerWaalsContact C-N 3.33Å; C2015-N2017 PolarHBondContact O-N 2.82Å; N2017-D2019 VanDerWaalsContact C-N 3.27Å; N2017-D2019 PolarHBondContact ND2-OD2 3.09Å; N2017-D2019 PolarHBondContact O-N 3.13Å; N2017-D2019 VanDerWaalsContact OD1-CB 3.23Å; N2017-D2019 WeakPolarHBondContact OD1-CB 3.31Å; N2017-D2019 PolarHBondContact OD1-N 2.9Å; N2017-D2019 PolarHBondContact OD1-OD2 3.15Å; N2017-D2019 VanDerWaalsContact OD1-OD2 3.09Å; N2017-F2020 HydrophobicContact CB-CD1 4.13Å; N2017-F2020 HydrophobicContact CB-CE1 3.81Å; N2017-F2020 HydrophobicContact CB-CZ 4.16Å; N2017-F2020 VanDerWaalsContact O-O 3.08Å; N2017-Y2055 HydrophobicContact CB-CE1 4.36Å; N2017-Y2055 WeakPolarHBondContact ND2-CE1 2.98Å; N2017-Y2055 VanDerWaalsContact ND2-CZ 3.31Å; N2017-Y2055 PolarHBondContact ND2-OH 3.23Å
2018	P	68.1	Low	85.9	Confident	93.8 Å²	93.8	57.8 Å²	57.8	61%	0.609	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-15.9	174.8	30.7	-35.8	0	0	0	113.7	C2015 N2016 F2020 I2022 C2039	C2015-P2018 HydrophobicContact CB-CB 4.34Å; C2015-P2018 HydrophobicContact CB-CG 4.5Å; N2016-P2018 WeakPolarHBondContact O-CD 3.37Å; P2018-F2020 VanDerWaalsContact C-N 3.27Å; P2018-F2020 HydrophobicContact CB-CD1 3.99Å; P2018-F2020 HydrophobicContact CB-CE1 3.72Å; P2018-F2020 HydrophobicContact CB-CZ 4.1Å; P2018-F2020 HydrophobicContact CG-CE1 4.27Å; P2018-F2020 HydrophobicContact CG-CE2 4.37Å; P2018-F2020 HydrophobicContact CG-CZ 4.19Å; P2018-F2020 PolarHBondContact O-N 3.13Å; P2018-I2022 HydrophobicContact CG-CD1 3.8Å; P2018-I2022 HydrophobicContact CG-CG1 3.56Å; P2018-C2039 HydrophobicContact CG-CB 4.35Å
2019	D	77.1	Confident	85.6	Confident	129 Å²	129	56.6 Å²	56.6	69%	0.69	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-15.8	-174.9	-57.8	-34.7	0	0	0	113.5	N2017	N2017-D2019 VanDerWaalsContact C-N 3.27Å; N2017-D2019 PolarHBondContact ND2-OD2 3.09Å; N2017-D2019 PolarHBondContact O-N 3.13Å; N2017-D2019 VanDerWaalsContact OD1-CB 3.23Å; N2017-D2019 WeakPolarHBondContact OD1-CB 3.31Å; N2017-D2019 PolarHBondContact OD1-N 2.9Å; N2017-D2019 PolarHBondContact OD1-OD2 3.15Å; N2017-D2019 VanDerWaalsContact OD1-OD2 3.09Å
2020	F	84.1	Confident	85	Confident	19.4 Å²	19.4	56.7 Å²	56.7	9%	0.085	30%	0.296	C	S	.	.	S	Bend	trans	-147.1	147.6	179.5	65.2	-89.2	0	0	0	112.2	Y1895 N2017 P2018 I2022 V2025 Y2055 V2057	Y1895-F2020 AromaticContact CD1-CD1 3.78Å; Y1895-F2020 HydrophobicContact CD1-CD1 3.78Å; Y1895-F2020 AromaticContact CD1-CD2 3.91Å; Y1895-F2020 HydrophobicContact CD1-CD2 4.06Å; Y1895-F2020 AromaticContact CD1-CE1 3.55Å; Y1895-F2020 HydrophobicContact CD1-CE1 3.55Å; Y1895-F2020 VanDerWaalsContact CD1-CE1 3.4Å; Y1895-F2020 AromaticContact CD1-CE2 3.86Å; Y1895-F2020 HydrophobicContact CD1-CE2 3.86Å; Y1895-F2020 AromaticContact CD1-CG 3.95Å; Y1895-F2020 HydrophobicContact CD1-CG 4.01Å; Y1895-F2020 AromaticContact CD1-CZ 3.59Å; Y1895-F2020 HydrophobicContact CD1-CZ 3.59Å; Y1895-F2020 HydrophobicContact CE1-CB 3.95Å; Y1895-F2020 AromaticContact CE1-CD1 3.31Å; Y1895-F2020 HydrophobicContact CE1-CD1 3.31Å; Y1895-F2020 AromaticContact CE1-CD2 3.77Å; Y1895-F2020 HydrophobicContact CE1-CD2 3.84Å; Y1895-F2020 AromaticContact CE1-CE1 3.61Å; Y1895-F2020 HydrophobicContact CE1-CE1 3.61Å; Y1895-F2020 HydrophobicContact CE1-CE2 4.12Å; Y1895-F2020 AromaticContact CE1-CG 3.42Å; Y1895-F2020 HydrophobicContact CE1-CG 3.42Å; Y1895-F2020 VanDerWaalsContact CE1-CG 3.48Å; Y1895-F2020 AromaticContact CE1-CZ 3.97Å; Y1895-F2020 HydrophobicContact CE1-CZ 4.01Å; Y1895-F2020 HydrophobicContact CE2-CD2 4.41Å; Y1895-F2020 HydrophobicContact CG-CD2 4.48Å; Y1895-F2020 HydrophobicContact CG-CE1 4.29Å; Y1895-F2020 HydrophobicContact CG-CE2 4.23Å; Y1895-F2020 HydrophobicContact CG-CZ 4.27Å; Y1895-F2020 AromaticContact CZ-CD2 3.99Å; Y1895-F2020 AromaticContact CZ-CG 3.8Å; Y1895-F2020 WeakPolarHBondContact OH-CB 3.47Å; N2017-F2020 HydrophobicContact CB-CD1 4.13Å; N2017-F2020 HydrophobicContact CB-CE1 3.81Å; N2017-F2020 HydrophobicContact CB-CZ 4.16Å; N2017-F2020 VanDerWaalsContact O-O 3.08Å; P2018-F2020 VanDerWaalsContact C-N 3.27Å; P2018-F2020 HydrophobicContact CB-CD1 3.99Å; P2018-F2020 HydrophobicContact CB-CE1 3.72Å; P2018-F2020 HydrophobicContact CB-CZ 4.1Å; P2018-F2020 HydrophobicContact CG-CE1 4.27Å; P2018-F2020 HydrophobicContact CG-CE2 4.37Å; P2018-F2020 HydrophobicContact CG-CZ 4.19Å; P2018-F2020 PolarHBondContact O-N 3.13Å; F2020-I2022 HydrophobicContact CD2-CG1 4.49Å; F2020-I2022 HydrophobicContact CE2-CG1 4.12Å; F2020-I2022 PolarHBondContact O-N 2.92Å; F2020-I2022 VanDerWaalsContact O-N 3.13Å; F2020-V2025 HydrophobicContact CD2-CB 4.45Å; F2020-V2025 HydrophobicContact CD2-CG2 3.79Å; F2020-V2025 HydrophobicContact CE2-CG2 4.3Å; F2020-Y2055 HydrophobicContact CE1-CD1 4.3Å; F2020-Y2055 HydrophobicContact CE1-CD2 4.47Å; F2020-Y2055 AromaticContact CE1-CG 3.96Å; F2020-Y2055 HydrophobicContact CE1-CG 4.25Å; F2020-Y2055 HydrophobicContact CZ-CD1 4.39Å; F2020-Y2055 HydrophobicContact CZ-CG 4.33Å; F2020-V2057 HydrophobicContact CE2-CG2 4.35Å
2021	D	87.1	Confident	84	Confident	100.8 Å²	100.8	60.8 Å²	60.8	54%	0.539	33%	0.325	S	S	.	.			trans	-75.5	108.3	176.5	-179.1	-10.8	0	0	0	110.7	L2023 A2024 V2025	D2021-L2023 VanDerWaalsContact C-N 3.28Å; D2021-L2023 PolarHBondContact O-N 3.1Å; D2021-L2023 WeakPolarHBondContact OD1-CA 3.28Å; D2021-L2023 WeakPolarHBondContact OD1-CB 3.29Å; D2021-L2023 PolarHBondContact OD1-N 3.34Å; D2021-A2024 HydrophobicContact CB-CB 3.75Å; D2021-A2024 PolarHBondContact O-N 3.13Å; D2021-A2024 PolarHBondContact OD1-N 3.1Å; D2021-A2024 VanDerWaalsContact OD1-N 3.13Å; D2021-A2024 WeakPolarHBondContact OD2-CB 3.42Å; D2021-V2025 WeakPolarHBondContact O-CG2 3.39Å; D2021-V2025 PolarHBondContact O-N 3.07Å
2022	I	89.1	Confident	82.9	Confident	26.2 Å²	26.2	64.2 Å²	64.2	13%	0.134	34%	0.342	C	S	.	.	H	α-helix	trans	-57.3	-41	178.5	-58	171.1	0	0	0	111	P2018 F2020 V2025 Y2026 P2037 C2039 V2057	P2018-I2022 HydrophobicContact CG-CD1 3.8Å; P2018-I2022 HydrophobicContact CG-CG1 3.56Å; F2020-I2022 HydrophobicContact CD2-CG1 4.49Å; F2020-I2022 HydrophobicContact CE2-CG1 4.12Å; F2020-I2022 PolarHBondContact O-N 2.92Å; F2020-I2022 VanDerWaalsContact O-N 3.13Å; I2022-V2025 PolarHBondContact O-N 3.07Å; I2022-Y2026 WeakPolarHBondContact O-CB 3.38Å; I2022-Y2026 PolarHBondContact O-N 3.15Å; I2022-P2037 HydrophobicContact CG2-CB 4.33Å; I2022-P2037 HydrophobicContact CG2-CG 4.3Å; I2022-C2039 HydrophobicContact CD1-CB 3.63Å; I2022-C2039 HydrophobicContact CG1-CB 3.94Å; I2022-C2039 HydrophobicContact CG2-CB 4.24Å; I2022-V2057 HydrophobicContact CG2-CG1 3.8Å; I2022-V2057 HydrophobicContact CG2-CG2 4.34Å
2023	L	88.3	Confident	81.7	Confident	77.6 Å²	77.6	66.5 Å²	66.5	41%	0.406	36%	0.356	S	S	.	.	H	α-helix	trans	-68.8	-42.5	-179.5	-136.4	101.9	0	0	0	110.3	D2021 V2025 Y2026 Q2027 T2033 P2037	D2021-L2023 VanDerWaalsContact C-N 3.28Å; D2021-L2023 PolarHBondContact O-N 3.1Å; D2021-L2023 WeakPolarHBondContact OD1-CA 3.28Å; D2021-L2023 WeakPolarHBondContact OD1-CB 3.29Å; D2021-L2023 PolarHBondContact OD1-N 3.34Å; L2023-V2025 VanDerWaalsContact C-N 3.33Å; L2023-V2025 PolarHBondContact O-N 3.01Å; L2023-Y2026 PolarHBondContact O-N 3.13Å; L2023-Q2027 HydrophobicContact CD1-CG 4.44Å; L2023-Q2027 HydrophobicContact CG-CG 4.46Å; L2023-Q2027 VanDerWaalsContact O-CB 3.26Å; L2023-Q2027 WeakPolarHBondContact O-CB 3.38Å; L2023-Q2027 VanDerWaalsContact O-CG 3.25Å; L2023-Q2027 WeakPolarHBondContact O-CG 3.35Å; L2023-Q2027 PolarHBondContact O-N 3.1Å; L2023-T2033 HydrophobicContact CD1-CG2 4.01Å; L2023-P2037 HydrophobicContact CD1-CG 4.02Å; L2023-P2037 HydrophobicContact CD2-CG 3.72Å; L2023-P2037 HydrophobicContact CG-CG 4.36Å
2024	A	87.9	Confident	81	Confident	33.8 Å²	33.8	67 Å²	67	28%	0.279	36%	0.364	S	S	.	.	H	α-helix	trans	-63.2	-38.7	175.4	0	0	0	0	0	112.3	D2021 Q2027 R2028	D2021-A2024 HydrophobicContact CB-CB 3.75Å; D2021-A2024 PolarHBondContact O-N 3.13Å; D2021-A2024 PolarHBondContact OD1-N 3.1Å; D2021-A2024 VanDerWaalsContact OD1-N 3.13Å; D2021-A2024 WeakPolarHBondContact OD2-CB 3.42Å; A2024-Q2027 PolarHBondContact O-N 3.03Å; A2024-R2028 WeakPolarHBondContact O-CG 3.42Å; A2024-R2028 PolarHBondContact O-N 2.97Å
2025	V	88.4	Confident	80.5	Confident	2.6 Å²	2.6	65.3 Å²	65.3	2%	0.016	36%	0.357	C	S	.	.	H	α-helix	trans	-66	-42.8	174.7	172.7	0	0	0	0	111.2	I1893 Y1895 F2020 D2021 I2022 L2023 Q2027 R2028 H2029 V2057	I1893-V2025 HydrophobicContact CG2-CG1 4.16Å; Y1895-V2025 HydrophobicContact CD2-CG1 3.91Å; Y1895-V2025 HydrophobicContact CD2-CG2 3.79Å; Y1895-V2025 HydrophobicContact CE2-CG1 4.46Å; Y1895-V2025 HydrophobicContact CE2-CG2 3.66Å; Y1895-V2025 HydrophobicContact CG-CG1 4.37Å; Y1895-V2025 HydrophobicContact CG-CG2 4.37Å; F2020-V2025 HydrophobicContact CD2-CB 4.45Å; F2020-V2025 HydrophobicContact CD2-CG2 3.79Å; F2020-V2025 HydrophobicContact CE2-CG2 4.3Å; D2021-V2025 WeakPolarHBondContact O-CG2 3.39Å; D2021-V2025 PolarHBondContact O-N 3.07Å; I2022-V2025 PolarHBondContact O-N 3.07Å; L2023-V2025 VanDerWaalsContact C-N 3.33Å; L2023-V2025 PolarHBondContact O-N 3.01Å; V2025-Q2027 VanDerWaalsContact C-N 3.35Å; V2025-Q2027 PolarHBondContact O-N 2.87Å; V2025-R2028 WeakPolarHBondContact O-CB 3.3Å; V2025-R2028 PolarHBondContact O-N 3.11Å; V2025-H2029 PolarHBondContact O-CD2 2.77Å; V2025-V2057 HydrophobicContact CG1-CG2 4.37Å
2026	Y	89.1	Confident	80.6	Confident	9.4 Å²	9.4	67.6 Å²	67.6	4%	0.037	37%	0.372	C	S	.	.	H	α-helix	trans	-63.7	-44.1	177.4	-171.4	-102	0	0	0	112	F1582 I1893 I2022 L2023 R2028 H2029 C2030 D2032 T2033 P2037 V2057 P2059	F1582-Y2026 HydrophobicContact CD2-CE2 4.45Å; F1582-Y2026 HydrophobicContact CE2-CD2 4.47Å; F1582-Y2026 AromaticContact CE2-CE2 3.44Å; F1582-Y2026 HydrophobicContact CE2-CE2 3.44Å; F1582-Y2026 VanDerWaalsContact CE2-CE2 3.44Å; F1582-Y2026 AromaticContact CE2-CZ 3.74Å; F1582-Y2026 WeakPolarHBondContact CE2-OH 3.23Å; F1582-Y2026 HydrophobicContact CZ-CD2 4.41Å; F1582-Y2026 AromaticContact CZ-CE2 3.68Å; F1582-Y2026 HydrophobicContact CZ-CE2 3.68Å; I1893-Y2026 HydrophobicContact CD1-CD2 3.89Å; I1893-Y2026 HydrophobicContact CD1-CE2 4.38Å; I2022-Y2026 WeakPolarHBondContact O-CB 3.38Å; I2022-Y2026 PolarHBondContact O-N 3.15Å; L2023-Y2026 PolarHBondContact O-N 3.13Å; Y2026-R2028 VanDerWaalsContact C-N 3.26Å; Y2026-R2028 PolarHBondContact O-N 3.14Å; Y2026-R2028 VanDerWaalsContact O-N 3.14Å; Y2026-H2029 PolarHBondContact O-N 3.08Å; Y2026-H2029 VanDerWaalsContact O-N 3.08Å; Y2026-C2030 HydrophobicContact CD1-CB 4.15Å; Y2026-C2030 HydrophobicContact CD2-CB 4.49Å; Y2026-C2030 HydrophobicContact CE1-CB 3.78Å; Y2026-C2030 HydrophobicContact CE2-CB 4.19Å; Y2026-C2030 PolarHBondContact O-N 3Å; Y2026-D2032 WeakPolarHBondContact CE1-O 3.33Å; Y2026-T2033 HydrophobicContact CD1-CG2 4.04Å; Y2026-T2033 HydrophobicContact CE1-CG2 4.1Å; Y2026-P2037 HydrophobicContact CD1-CB 4.15Å; Y2026-P2037 HydrophobicContact CD1-CG 4.05Å; Y2026-P2037 HydrophobicContact CD2-CB 3.57Å; Y2026-P2037 VanDerWaalsContact CD2-CB 3.49Å; Y2026-P2037 HydrophobicContact CD2-CG 4.29Å; Y2026-P2037 HydrophobicContact CE1-CB 4.47Å; Y2026-P2037 HydrophobicContact CE2-CB 4.02Å; Y2026-P2037 HydrophobicContact CG-CB 3.64Å; Y2026-P2037 HydrophobicContact CG-CG 3.83Å; Y2026-V2057 HydrophobicContact CD2-CG1 4.13Å; Y2026-P2059 HydrophobicContact CE2-CG 4.41Å
2027	Q	87.2	Confident	81.2	Confident	101.6 Å²	101.6	61.9 Å²	61.9	48%	0.475	34%	0.342	S	S	.	.	H	α-helix	trans	-64.8	-20	179.3	-75.2	174.3	-1.7	0	0	114.2	L2023 A2024 V2025 H2029 C2030 T2033	L2023-Q2027 HydrophobicContact CD1-CG 4.44Å; L2023-Q2027 HydrophobicContact CG-CG 4.46Å; L2023-Q2027 VanDerWaalsContact O-CB 3.26Å; L2023-Q2027 WeakPolarHBondContact O-CB 3.38Å; L2023-Q2027 VanDerWaalsContact O-CG 3.25Å; L2023-Q2027 WeakPolarHBondContact O-CG 3.35Å; L2023-Q2027 PolarHBondContact O-N 3.1Å; A2024-Q2027 PolarHBondContact O-N 3.03Å; V2025-Q2027 VanDerWaalsContact C-N 3.35Å; V2025-Q2027 PolarHBondContact O-N 2.87Å; Q2027-H2029 VanDerWaalsContact C-N 3.28Å; Q2027-H2029 PolarHBondContact O-N 3.4Å; Q2027-C2030 CarbonylContact C-O 3.51Å; Q2027-C2030 VanDerWaalsContact CA-O 3.28Å; Q2027-C2030 WeakPolarHBondContact CA-O 3.21Å; Q2027-C2030 VanDerWaalsContact O-O 3.1Å; Q2027-T2033 HydrophobicContact CG-CG2 3.84Å
2028	R	85.5	Confident	82.2	Confident	126 Å²	126	62.5 Å²	62.5	48%	0.475	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-23.9	171.9	-70.6	169.9	-170.8	-173.7	1.5	113.1	A1900 A2024 V2025 Y2026	A1900-R2028 PolarHBondContact O-NH1 3.2Å; A1900-R2028 VanDerWaalsContact O-NH1 3.08Å; A2024-R2028 WeakPolarHBondContact O-CG 3.42Å; A2024-R2028 PolarHBondContact O-N 2.97Å; V2025-R2028 WeakPolarHBondContact O-CB 3.3Å; V2025-R2028 PolarHBondContact O-N 3.11Å; Y2026-R2028 VanDerWaalsContact C-N 3.26Å; Y2026-R2028 PolarHBondContact O-N 3.14Å; Y2026-R2028 VanDerWaalsContact O-N 3.14Å
2029	H	82.6	Confident	83.4	Confident	30.6 Å²	30.6	58 Å²	58	14%	0.142	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.8	-20.5	-177.2	-62	-85.6	0	0	0	113	I1893 S1902 F1904 L1927 V2025 Y2026 Q2027	I1893-H2029 HydrophobicContact CD1-CB 3.91Å; I1893-H2029 HydrophobicContact CG1-CB 4.43Å; S1902-H2029 WeakPolarHBondContact CB-NE2 3.41Å; S1902-H2029 PolarHBondContact OG-NE2 3.14Å; F1904-H2029 HydrophobicContact CD2-CB 4.39Å; L1927-H2029 HydrophobicContact CD1-CB 4.22Å; L1927-H2029 WeakPolarHBondContact CD2-O 3.31Å; V2025-H2029 PolarHBondContact O-CD2 2.77Å; Y2026-H2029 PolarHBondContact O-N 3.08Å; Y2026-H2029 VanDerWaalsContact O-N 3.08Å; Q2027-H2029 VanDerWaalsContact C-N 3.28Å; Q2027-H2029 PolarHBondContact O-N 3.4Å
2030	C	79.3	Confident	84.3	Confident	12.4 Å²	12.4	51.9 Å²	51.9	8%	0.084	28%	0.281	C	S	.	.			trans	-130.6	129.4	-176.4	-63.7	0	0	0	0	111.1	F1582 Y2026 Q2027	F1582-C2030 VanDerWaalsContact CE2-SG 3.53Å; Y2026-C2030 HydrophobicContact CD1-CB 4.15Å; Y2026-C2030 HydrophobicContact CD2-CB 4.49Å; Y2026-C2030 HydrophobicContact CE1-CB 3.78Å; Y2026-C2030 HydrophobicContact CE2-CB 4.19Å; Y2026-C2030 PolarHBondContact O-N 3Å; Q2027-C2030 CarbonylContact C-O 3.51Å; Q2027-C2030 VanDerWaalsContact CA-O 3.28Å; Q2027-C2030 WeakPolarHBondContact CA-O 3.21Å; Q2027-C2030 VanDerWaalsContact O-O 3.1Å
2031	T	69.1	Low	84.7	Confident	127 Å²	127	51.6 Å²	51.6	78%	0.779	28%	0.281	S	S	*	.	S	Bend	trans	-81.2	-22.3	-178.3	49.9	0	0	0	0	114.1
2032	D	68.8	Low	85.1	Confident	89 Å²	89	46.8 Å²	46.8	48%	0.476	26%	0.255	S	S	.	.			trans	-118.6	125.8	-174.5	-148.3	-22	0	0	0	110.3	S1578 Y2026 T2034	S1578-D2032 WeakPolarHBondContact CB-OD2 3.29Å; Y2026-D2032 WeakPolarHBondContact CE1-O 3.33Å; D2032-T2034 VanDerWaalsContact CG-OG1 3.3Å; D2032-T2034 PolarHBondContact O-N 3.33Å; D2032-T2034 VanDerWaalsContact OD1-CB 3.26Å; D2032-T2034 WeakPolarHBondContact OD1-CB 3.27Å; D2032-T2034 VanDerWaalsContact OD1-CG2 3.24Å; D2032-T2034 WeakPolarHBondContact OD1-CG2 3.41Å; D2032-T2034 PolarHBondContact OD1-N 2.86Å; D2032-T2034 PolarHBondContact OD1-OG1 2.9Å; D2032-T2034 PolarHBondContact OD2-OG1 3.21Å
2033	T	68.5	Low	85.3	Confident	64.2 Å²	64.2	46.2 Å²	46.2	39%	0.394	25%	0.253	S	S	.	.			trans	-112.7	41.4	-174.7	56.9	0	0	0	0	112.1	L2023 Y2026 Q2027 V2035	L2023-T2033 HydrophobicContact CD1-CG2 4.01Å; Y2026-T2033 HydrophobicContact CD1-CG2 4.04Å; Y2026-T2033 HydrophobicContact CE1-CG2 4.1Å; Q2027-T2033 HydrophobicContact CG-CG2 3.84Å; T2033-V2035 PolarHBondContact O-N 3.14Å
2034	T	75.6	Confident	85.5	Confident	85 Å²	85	43 Å²	43	52%	0.521	24%	0.236	S	C	.	.	S	Bend	trans	-69.2	-27.6	176.5	56.9	0	0	0	0	113.1	R1575 S1578 V1579 D2032	R1575-T2034 PolarHBondContact O-OG1 3.19Å; R1575-T2034 VanDerWaalsContact O-OG1 3.07Å; S1578-T2034 WeakPolarHBondContact OG-CG2 3.18Å; S1578-T2034 PolarHBondContact OG-OG1 3Å; V1579-T2034 VanDerWaalsContact CG2-OG1 3.27Å; V1579-T2034 WeakPolarHBondContact CG2-OG1 3.46Å; D2032-T2034 VanDerWaalsContact CG-OG1 3.3Å; D2032-T2034 PolarHBondContact O-N 3.33Å; D2032-T2034 VanDerWaalsContact OD1-CB 3.26Å; D2032-T2034 WeakPolarHBondContact OD1-CB 3.27Å; D2032-T2034 VanDerWaalsContact OD1-CG2 3.24Å; D2032-T2034 WeakPolarHBondContact OD1-CG2 3.41Å; D2032-T2034 PolarHBondContact OD1-N 2.86Å; D2032-T2034 PolarHBondContact OD1-OG1 2.9Å; D2032-T2034 PolarHBondContact OD2-OG1 3.21Å
2035	V	80.6	Confident	85.5	Confident	34 Å²	34	41.7 Å²	41.7	21%	0.206	23%	0.225	C	C	.	.	S	Bend	trans	-107.9	128	175.3	-179	0	0	0	0	108.5	V1579 T2033 P2059 E2060	V1579-V2035 HydrophobicContact CG2-CB 4.07Å; V1579-V2035 HydrophobicContact CG2-CG2 3.69Å; T2033-V2035 PolarHBondContact O-N 3.14Å; V2035-P2059 HydrophobicContact CG1-CB 3.98Å; V2035-E2060 HydrophobicContact CG1-CB 4.45Å
2036	P	87	Confident	85.3	Confident	70.2 Å²	70.2	43.7 Å²	43.7	46%	0.456	25%	0.247	S	C	.	.			trans	-66.2	132.2	179.8	26.8	-34	0	0	0	110.8	E2060	P2036-E2060 HydrophobicContact CG-CB 4.33Å; P2036-E2060 VanDerWaalsContact CG-OE2 3.32Å; P2036-E2060 WeakPolarHBondContact CG-OE2 3.37Å; P2036-E2060 WeakPolarHBondContact O-CB 3.32Å; P2036-E2060 PolarHBondContact O-N 3.12Å
2037	P	90.6	Very high	85	Confident	20 Å²	20	46.2 Å²	46.2	13%	0.13	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	146.8	171.6	32.2	-33.8	0	0	0	111.1	I2022 L2023 Y2026 V2057 A2058	I2022-P2037 HydrophobicContact CG2-CB 4.33Å; I2022-P2037 HydrophobicContact CG2-CG 4.3Å; L2023-P2037 HydrophobicContact CD1-CG 4.02Å; L2023-P2037 HydrophobicContact CD2-CG 3.72Å; L2023-P2037 HydrophobicContact CG-CG 4.36Å; Y2026-P2037 HydrophobicContact CD1-CB 4.15Å; Y2026-P2037 HydrophobicContact CD1-CG 4.05Å; Y2026-P2037 HydrophobicContact CD2-CB 3.57Å; Y2026-P2037 VanDerWaalsContact CD2-CB 3.49Å; Y2026-P2037 HydrophobicContact CD2-CG 4.29Å; Y2026-P2037 HydrophobicContact CE1-CB 4.47Å; Y2026-P2037 HydrophobicContact CE2-CB 4.02Å; Y2026-P2037 HydrophobicContact CG-CB 3.64Å; Y2026-P2037 HydrophobicContact CG-CG 3.83Å; P2037-V2057 HydrophobicContact CB-CG1 3.98Å; P2037-A2058 CarbonylContact C-O 3.56Å; P2037-A2058 WeakPolarHBondContact CA-O 3.41Å
2038	K	92.1	Very high	84.7	Confident	59.8 Å²	59.8	45.4 Å²	45.4	26%	0.26	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	146.5	168.3	-69.3	-160.5	178.1	169.9	0	109.7	I2014 V2057 A2058 E2060 A2063	I2014-K2038 HydrophobicContact CD1-CD 4.4Å; I2014-K2038 HydrophobicContact CG2-CB 4.43Å; I2014-K2038 HydrophobicContact CG2-CD 4.33Å; K2038-V2057 WeakPolarHBondContact O-CA 3.3Å; K2038-A2058 PolarHBondContact N-O 3.13Å; K2038-A2058 PolarHBondContact O-N 3.28Å; K2038-A2058 VanDerWaalsContact O-O 3.11Å; K2038-E2060 HydrophobicContact CD-CB 4.37Å; K2038-E2060 HydrophobicContact CD-CG 4.17Å; K2038-E2060 WeakPolarHBondContact CE-OE1 3.31Å; K2038-E2060 HydrophobicContact CG-CB 4.06Å; K2038-E2060 HydrophobicContact CG-CG 4.22Å; K2038-E2060 IonicContact NZ-OE1 3.42Å; K2038-E2060 PolarHBondContact NZ-OE1 3.02Å; K2038-A2063 HydrophobicContact CB-CB 3.77Å; K2038-A2063 HydrophobicContact CD-CB 4.44Å
2039	C	94	Very high	84.6	Confident	0.4 Å²	0.4	42.4 Å²	42.4	0%	0.003	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	140.4	168.8	-173.8	0	0	0	0	109.3	I2014 C2015 P2018 I2022 F2056 V2057	I2014-C2039 WeakPolarHBondContact CA-O 3.26Å; C2015-C2039 HydrophobicContact CB-CB 4.11Å; C2015-C2039 PolarHBondContact N-O 3.2Å; C2015-C2039 WeakPolarHBondContact O-CB 3.3Å; C2015-C2039 VanDerWaalsContact O-O 3.12Å; P2018-C2039 HydrophobicContact CG-CB 4.35Å; I2022-C2039 HydrophobicContact CD1-CB 3.63Å; I2022-C2039 HydrophobicContact CG1-CB 3.94Å; I2022-C2039 HydrophobicContact CG2-CB 4.24Å; C2039-F2056 CarbonylContact C-O 3.56Å; C2039-F2056 VanDerWaalsContact CA-O 3.28Å; C2039-F2056 WeakPolarHBondContact CA-O 3.4Å; C2039-F2056 PolarHBondContact SG-O 3.31Å; C2039-F2056 VanDerWaalsContact SG-O 3.33Å; C2039-V2057 HydrophobicContact CB-CG2 4.16Å
2040	F	94.8	Very high	84.8	Confident	0.2 Å²	0.2	43.3 Å²	43.3	0%	0.001	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	148.4	167.5	69.5	-89.2	0	0	0	110.6	L1907 V2012 E2013 V2042 F2056 A2063 L2066 T2067	L1907-F2040 HydrophobicContact CD2-CZ 3.97Å; V2012-F2040 HydrophobicContact CG1-CD2 4.32Å; E2013-F2040 CarbonylContact O-C 3.52Å; E2013-F2040 VanDerWaalsContact O-CA 3.26Å; E2013-F2040 WeakPolarHBondContact O-CA 3.31Å; E2013-F2040 WeakPolarHBondContact O-CB 3.35Å; F2040-V2042 HydrophobicContact CD2-CG2 4.36Å; F2040-V2042 HydrophobicContact CE2-CG2 4.22Å; F2040-F2056 HydrophobicContact CD1-CB 4.04Å; F2040-F2056 HydrophobicContact CD2-CB 4.36Å; F2040-F2056 HydrophobicContact CD2-CD2 4.28Å; F2040-F2056 HydrophobicContact CE1-CB 3.5Å; F2040-F2056 VanDerWaalsContact CE1-CB 3.46Å; F2040-F2056 HydrophobicContact CE1-CG 4.42Å; F2040-F2056 HydrophobicContact CE2-CB 3.87Å; F2040-F2056 AromaticContact CE2-CD2 3.56Å; F2040-F2056 HydrophobicContact CE2-CD2 3.56Å; F2040-F2056 HydrophobicContact CE2-CE2 4.46Å; F2040-F2056 HydrophobicContact CE2-CG 4.07Å; F2040-F2056 HydrophobicContact CG-CB 4.44Å; F2040-F2056 HydrophobicContact CZ-CB 3.41Å; F2040-F2056 VanDerWaalsContact CZ-CB 3.41Å; F2040-F2056 AromaticContact CZ-CD2 3.8Å; F2040-F2056 HydrophobicContact CZ-CD2 3.8Å; F2040-F2056 AromaticContact CZ-CG 3.84Å; F2040-F2056 HydrophobicContact CZ-CG 3.84Å; F2040-F2056 PolarHBondContact N-O 3.21Å; F2040-F2056 PolarHBondContact O-N 2.96Å; F2040-A2063 HydrophobicContact CD1-CB 4.24Å; F2040-L2066 HydrophobicContact CE1-CB 4.3Å; F2040-L2066 HydrophobicContact CE1-CD1 3.85Å; F2040-L2066 HydrophobicContact CZ-CB 4.12Å; F2040-L2066 HydrophobicContact CZ-CD1 3.85Å; F2040-T2067 HydrophobicContact CB-CG2 3.34Å; F2040-T2067 VanDerWaalsContact CB-CG2 3.43Å; F2040-T2067 HydrophobicContact CD1-CG2 4.16Å; F2040-T2067 HydrophobicContact CD2-CG2 3.83Å; F2040-T2067 HydrophobicContact CG-CG2 3.53Å; F2040-T2067 VanDerWaalsContact CG-CG2 3.48Å
2041	S	93.5	Very high	85.2	Confident	11.8 Å²	11.8	45.3 Å²	45.3	8%	0.083	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	144.9	179.1	59.4	0	0	0	0	111.3	V2012 E2013 C2015 V2054	V2012-S2041 WeakPolarHBondContact CA-O 3.36Å; E2013-S2041 PolarHBondContact N-O 3.2Å; E2013-S2041 VanDerWaalsContact N-O 3.1Å; E2013-S2041 PolarHBondContact O-N 3.14Å; E2013-S2041 PolarHBondContact O-OG 3.12Å; C2015-S2041 WeakPolarHBondContact SG-CB 3.23Å; C2015-S2041 PolarHBondContact SG-OG 3.04Å; C2015-S2041 VanDerWaalsContact SG-OG 3.32Å; S2041-V2054 CarbonylContact C-O 3.46Å; S2041-V2054 VanDerWaalsContact CA-O 3.27Å; S2041-V2054 WeakPolarHBondContact CA-O 3.41Å
2042	V	94.5	Very high	86.2	Confident	0.2 Å²	0.2	44.6 Å²	44.6	0%	0.001	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	115.3	170	-176.1	0	0	0	0	107.7	I1916 I2004 V2009 V2012 F2040 T2053 V2054 F2056	I1916-V2042 HydrophobicContact CD1-CG1 4.42Å; I1916-V2042 HydrophobicContact CD1-CG2 4.4Å; I2004-V2042 HydrophobicContact CD1-CB 4.44Å; I2004-V2042 HydrophobicContact CD1-CG1 4.26Å; V2009-V2042 HydrophobicContact CG1-CG1 3.75Å; V2009-V2042 HydrophobicContact CG2-CG1 4.01Å; V2012-V2042 HydrophobicContact CG1-CG2 4.43Å; V2012-V2042 HydrophobicContact CG2-CB 4.43Å; V2012-V2042 HydrophobicContact CG2-CG1 4.09Å; V2012-V2042 HydrophobicContact CG2-CG2 4.13Å; F2040-V2042 HydrophobicContact CD2-CG2 4.36Å; F2040-V2042 HydrophobicContact CE2-CG2 4.22Å; V2042-T2053 WeakPolarHBondContact O-CA 3.27Å; V2042-V2054 HydrophobicContact CB-CG2 3.7Å; V2042-V2054 HydrophobicContact CG2-CG2 4.25Å; V2042-V2054 PolarHBondContact N-O 3.19Å; V2042-V2054 PolarHBondContact O-N 2.87Å; V2042-V2054 VanDerWaalsContact O-N 3.14Å; V2042-F2056 HydrophobicContact CG2-CD2 4.23Å; V2042-F2056 HydrophobicContact CG2-CE2 4.06Å
2043	V	92.8	Very high	87.3	Confident	14.2 Å²	14.2	42.5 Å²	42.5	9%	0.086	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	127.5	177.8	-175.1	0	0	0	0	109	V2009 K2010 S2011 N2051 Y2052 T2053 E2481	V2009-V2043 CarbonylContact C-O 3.51Å; V2009-V2043 WeakPolarHBondContact CA-O 3.44Å; K2010-V2043 HydrophobicContact CB-CG1 4.4Å; K2010-V2043 HydrophobicContact CD-CG1 4.44Å; K2010-V2043 PolarHBondContact N-O 3Å; S2011-V2043 PolarHBondContact N-O 2.96Å; S2011-V2043 PolarHBondContact O-N 3.27Å; S2011-V2043 WeakPolarHBondContact OG-CG2 3.34Å; V2043-N2051 HydrophobicContact CG1-CB 4.36Å; V2043-Y2052 CarbonylContact C-O 3.48Å; V2043-Y2052 VanDerWaalsContact CA-O 3.31Å; V2043-Y2052 WeakPolarHBondContact CA-O 3.37Å; V2043-T2053 HydrophobicContact CG2-CG2 4.27Å; V2043-E2481 HydrophobicContact CG1-CG 4.07Å
2044	Y	93.1	Very high	88.4	Confident	11 Å²	11	39.5 Å²	39.5	4%	0.043	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	157.4	-178.1	71.6	-87.6	0	0	0	113.2	P1994 A1995 R1997 I2004 Y2008 Y2052 V2054	P1994-Y2044 HydrophobicContact CB-CD2 4.11Å; P1994-Y2044 HydrophobicContact CB-CE2 4.4Å; P1994-Y2044 HydrophobicContact CG-CD2 4.37Å; P1994-Y2044 HydrophobicContact CG-CE2 4.32Å; A1995-Y2044 HydrophobicContact CB-CD2 3.98Å; A1995-Y2044 HydrophobicContact CB-CE1 4.37Å; A1995-Y2044 HydrophobicContact CB-CE2 3.34Å; R1997-Y2044 VanDerWaalsContact CD-OH 3.24Å; R1997-Y2044 WeakPolarHBondContact CD-OH 3.22Å; R1997-Y2044 VanDerWaalsContact CZ-OH 3.24Å; R1997-Y2044 PolarHBondContact NE-OH 3.28Å; R1997-Y2044 PolarHBondContact NH1-OH 3.47Å; I2004-Y2044 HydrophobicContact CD1-CD1 3.96Å; I2004-Y2044 HydrophobicContact CD1-CE1 3.96Å; I2004-Y2044 HydrophobicContact CG1-CD1 4.26Å; I2004-Y2044 HydrophobicContact CG1-CE1 4.19Å; I2004-Y2044 HydrophobicContact CG2-CD1 4.17Å; I2004-Y2044 HydrophobicContact CG2-CD2 4.37Å; I2004-Y2044 HydrophobicContact CG2-CG 3.96Å; Y2008-Y2044 CarbonylContact O-C 3.56Å; Y2008-Y2044 WeakPolarHBondContact O-CA 3.37Å; Y2008-Y2044 VanDerWaalsContact O-CB 3.3Å; Y2008-Y2044 WeakPolarHBondContact O-CB 3.43Å; Y2044-Y2052 WeakPolarHBondContact CD1-O 3.31Å; Y2044-Y2052 HydrophobicContact CD2-CD2 4.35Å; Y2044-Y2052 AromaticContact CE2-CD2 3.91Å; Y2044-Y2052 HydrophobicContact CE2-CD2 3.93Å; Y2044-Y2052 HydrophobicContact CE2-CG 4.13Å; Y2044-Y2052 VanDerWaalsContact CZ-CB 3.47Å; Y2044-Y2052 PolarHBondContact N-O 2.93Å; Y2044-Y2052 PolarHBondContact O-N 3.35Å; Y2044-V2054 HydrophobicContact CE1-CG1 4.13Å; Y2044-V2054 HydrophobicContact CE1-CG2 3.97Å
2045	G	89.1	Confident	89.3	Confident	6 Å²	6	37.3 Å²	37.3	6%	0.062	21%	0.211	C	C	.	.			trans	172.5	161.1	174.8	0	0	0	0	0	114	Y2008 D2050	Y2008-G2045 PolarHBondContact O-N 3.26Å; G2045-D2050 WeakPolarHBondContact CA-O 3.28Å
2046	G	82.8	Confident	89.9	Confident	45 Å²	45	35.8 Å²	35.8	46%	0.464	20%	0.202	S	C	.	.	S	Bend	trans	-83.1	-30.3	-177.2	0	0	0	0	0	114.5	D2050	G2046-D2050 PolarHBondContact N-OD2 3.16Å
2047	T	82.8	Confident	90.3	Very high	61.4 Å²	61.4	32.4 Å²	32.4	38%	0.377	18%	0.18	S	C	.	.	S	Bend	trans	-116	173	179.4	67.8	0	0	0	0	111.4	K2010 T2049 D2050	K2010-T2047 VanDerWaalsContact CE-O 3.3Å; K2010-T2047 WeakPolarHBondContact CE-O 3.31Å; K2010-T2047 PolarHBondContact NZ-O 2.94Å; T2047-T2049 PolarHBondContact O-N 3.32Å; T2047-T2049 PolarHBondContact OG1-N 3.05Å; T2047-T2049 PolarHBondContact OG1-OG1 3.08Å; T2047-T2049 VanDerWaalsContact OG1-OG1 3.06Å; T2047-D2050 WeakPolarHBondContact CB-OD2 3.32Å; T2047-D2050 WeakPolarHBondContact CG2-OD2 3.39Å; T2047-D2050 PolarHBondContact N-OD2 3.08Å; T2047-D2050 PolarHBondContact O-N 3.07Å; T2047-D2050 WeakPolarHBondContact OG1-CB 3.36Å; T2047-D2050 PolarHBondContact OG1-N 3.26Å; T2047-D2050 VanDerWaalsContact OG1-N 3.13Å; T2047-D2050 PolarHBondContact OG1-OD1 3.22Å; T2047-D2050 PolarHBondContact OG1-OD2 2.99Å
2048	L	81.4	Confident	90.4	Very high	85.6 Å²	85.6	31.5 Å²	31.5	45%	0.448	17%	0.174	S	C	.	.	S	Bend	trans	-59.5	-36	174.1	-133.2	109.3	0	0	0	112	K2010 N2051 L2482 Q2485 I2486 M2488 T2489 Y2875	K2010-L2048 PolarHBondContact NZ-O 3.27Å; L2048-N2051 PolarHBondContact O-ND2 2.95Å; L2048-L2482 HydrophobicContact CD2-CD1 4.24Å; L2048-L2482 HydrophobicContact CG-CD1 4.11Å; L2048-Q2485 HydrophobicContact CD1-CB 3.73Å; L2048-Q2485 HydrophobicContact CG-CB 4.16Å; L2048-I2486 HydrophobicContact CD2-CG1 3.94Å; L2048-M2488 HydrophobicContact CD1-CB 4.02Å; L2048-T2489 HydrophobicContact CD1-CG2 3.8Å; L2048-Y2875 WeakPolarHBondContact CD2-O 3.29Å
2049	T	84.6	Confident	90.4	Very high	62.2 Å²	62.2	29.3 Å²	29.3	38%	0.382	17%	0.166	S	C	.	.	S	Bend	trans	-82.7	-29	-176.8	47.4	0	0	0	0	113.6	T2047 N2051 T2470 L2482 Q2876	T2047-T2049 PolarHBondContact O-N 3.32Å; T2047-T2049 PolarHBondContact OG1-N 3.05Å; T2047-T2049 PolarHBondContact OG1-OG1 3.08Å; T2047-T2049 VanDerWaalsContact OG1-OG1 3.06Å; T2049-N2051 VanDerWaalsContact C-ND2 3.29Å; T2049-N2051 PolarHBondContact O-N 3.13Å; T2049-N2051 VanDerWaalsContact O-N 3.13Å; T2049-N2051 PolarHBondContact O-ND2 3.01Å; T2049-T2470 VanDerWaalsContact CG2-O 3.27Å; T2049-T2470 WeakPolarHBondContact CG2-O 3.44Å; T2049-L2482 HydrophobicContact CG2-CD1 4.28Å; T2049-Q2876 HydrophobicContact CG2-CB 3.57Å
2050	D	85.4	Confident	90.3	Very high	49.6 Å²	49.6	32.8 Å²	32.8	27%	0.265	18%	0.182	S	C	.	.			trans	-70.2	106.4	177.3	-61.8	-28.4	0	0	0	110.4	K2010 G2045 G2046 T2047 Y2052	K2010-D2050 WeakPolarHBondContact CE-O 3.33Å; K2010-D2050 PolarHBondContact NZ-O 3.2Å; G2045-D2050 WeakPolarHBondContact CA-O 3.28Å; G2046-D2050 PolarHBondContact N-OD2 3.16Å; T2047-D2050 WeakPolarHBondContact CB-OD2 3.32Å; T2047-D2050 WeakPolarHBondContact CG2-OD2 3.39Å; T2047-D2050 PolarHBondContact N-OD2 3.08Å; T2047-D2050 PolarHBondContact O-N 3.07Å; T2047-D2050 WeakPolarHBondContact OG1-CB 3.36Å; T2047-D2050 PolarHBondContact OG1-N 3.26Å; T2047-D2050 VanDerWaalsContact OG1-N 3.13Å; T2047-D2050 PolarHBondContact OG1-OD1 3.22Å; T2047-D2050 PolarHBondContact OG1-OD2 2.99Å; D2050-Y2052 HydrophobicContact CB-CD2 4.4Å; D2050-Y2052 HydrophobicContact CB-CE2 3.97Å
2051	N	88.3	Confident	90.1	Very high	55.4 Å²	55.4	37.4 Å²	37.4	30%	0.296	21%	0.205	S	C	.	.			trans	-128.9	75	-178.9	-66.6	-55.9	0	0	0	110.4	K2010 V2043 L2048 T2049 E2481 Q2485	K2010-N2051 VanDerWaalsContact CD-OD1 3.27Å; K2010-N2051 WeakPolarHBondContact CD-OD1 3.33Å; K2010-N2051 PolarHBondContact NZ-OD1 3.33Å; V2043-N2051 HydrophobicContact CG1-CB 4.36Å; L2048-N2051 PolarHBondContact O-ND2 2.95Å; T2049-N2051 VanDerWaalsContact C-ND2 3.29Å; T2049-N2051 PolarHBondContact O-N 3.13Å; T2049-N2051 VanDerWaalsContact O-N 3.13Å; T2049-N2051 PolarHBondContact O-ND2 3.01Å; N2051-E2481 HydrophobicContact CB-CB 4.22Å; N2051-E2481 HydrophobicContact CB-CG 3.71Å; N2051-E2481 WeakPolarHBondContact OD1-CG 3.43Å; N2051-Q2485 WeakPolarHBondContact OD1-CG 3.14Å
2052	Y	90.7	Very high	90.1	Very high	111.8 Å²	111.8	37.7 Å²	37.7	44%	0.438	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	135.8	175	-56.5	-74	0	0	0	109.9	V2043 Y2044 D2050	V2043-Y2052 CarbonylContact C-O 3.48Å; V2043-Y2052 VanDerWaalsContact CA-O 3.31Å; V2043-Y2052 WeakPolarHBondContact CA-O 3.37Å; Y2044-Y2052 WeakPolarHBondContact CD1-O 3.31Å; Y2044-Y2052 HydrophobicContact CD2-CD2 4.35Å; Y2044-Y2052 AromaticContact CE2-CD2 3.91Å; Y2044-Y2052 HydrophobicContact CE2-CD2 3.93Å; Y2044-Y2052 HydrophobicContact CE2-CG 4.13Å; Y2044-Y2052 VanDerWaalsContact CZ-CB 3.47Å; Y2044-Y2052 PolarHBondContact N-O 2.93Å; Y2044-Y2052 PolarHBondContact O-N 3.35Å; D2050-Y2052 HydrophobicContact CB-CD2 4.4Å; D2050-Y2052 HydrophobicContact CB-CE2 3.97Å
2053	T	90.6	Very high	90.1	Very high	43.6 Å²	43.6	37.7 Å²	37.7	27%	0.267	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	139.3	179	-39.2	0	0	0	0	110.8	R1997 V2042 V2043 Y2055	R1997-T2053 PolarHBondContact NH1-O 2.92Å; V2042-T2053 WeakPolarHBondContact O-CA 3.27Å; V2043-T2053 HydrophobicContact CG2-CG2 4.27Å; T2053-Y2055 HydrophobicContact CG2-CD2 4.41Å; T2053-Y2055 HydrophobicContact CG2-CE1 3.93Å; T2053-Y2055 HydrophobicContact CG2-CE2 3.78Å; T2053-Y2055 VanDerWaalsContact CG2-CZ 3.49Å; T2053-Y2055 WeakPolarHBondContact OG1-CE2 3.46Å; T2053-Y2055 PolarHBondContact OG1-OH 3.31Å
2054	V	91.9	Very high	90.1	Very high	1.6 Å²	1.6	38.7 Å²	38.7	1%	0.01	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	141	168.3	-154.7	0	0	0	0	109.2	Y1894 W1918 R1997 I2004 S2041 V2042 Y2044 F2056	Y1894-V2054 HydrophobicContact CD2-CG1 3.99Å; Y1894-V2054 HydrophobicContact CE2-CB 4.13Å; Y1894-V2054 HydrophobicContact CE2-CG1 3.93Å; Y1894-V2054 HydrophobicContact CE2-CG2 4.4Å; W1918-V2054 HydrophobicContact CH2-CG1 4.47Å; R1997-V2054 VanDerWaalsContact CD-CG1 3.48Å; R1997-V2054 HydrophobicContact CG-CG2 4.37Å; I2004-V2054 HydrophobicContact CD1-CB 4.26Å; I2004-V2054 HydrophobicContact CD1-CG1 4.37Å; I2004-V2054 HydrophobicContact CD1-CG2 3.91Å; I2004-V2054 VanDerWaalsContact CD1-CG2 3.45Å; S2041-V2054 CarbonylContact C-O 3.46Å; S2041-V2054 VanDerWaalsContact CA-O 3.27Å; S2041-V2054 WeakPolarHBondContact CA-O 3.41Å; V2042-V2054 HydrophobicContact CB-CG2 3.7Å; V2042-V2054 HydrophobicContact CG2-CG2 4.25Å; V2042-V2054 PolarHBondContact N-O 3.19Å; V2042-V2054 PolarHBondContact O-N 2.87Å; V2042-V2054 VanDerWaalsContact O-N 3.14Å; Y2044-V2054 HydrophobicContact CE1-CG1 4.13Å; Y2044-V2054 HydrophobicContact CE1-CG2 3.97Å; V2054-F2056 HydrophobicContact CB-CE2 4.37Å; V2054-F2056 HydrophobicContact CG1-CD2 4.09Å; V2054-F2056 HydrophobicContact CG1-CE1 4.24Å; V2054-F2056 HydrophobicContact CG1-CE2 3.44Å; V2054-F2056 VanDerWaalsContact CG1-CE2 3.44Å; V2054-F2056 HydrophobicContact CG1-CZ 3.53Å; V2054-F2056 VanDerWaalsContact CG1-CZ 3.48Å; V2054-F2056 HydrophobicContact CG2-CD2 4.44Å; V2054-F2056 HydrophobicContact CG2-CE2 3.64Å; V2054-F2056 HydrophobicContact CG2-CZ 4.21Å
2055	Y	93.9	Very high	90.1	Very high	40.2 Å²	40.2	39.3 Å²	39.3	16%	0.158	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	133.8	-177.7	-61.6	-85.2	0	0	0	111.1	Y1895 C1897 N2017 F2020 T2053	Y1895-Y2055 PolarHBondContact N-O 2.91Å; C1897-Y2055 VanDerWaalsContact SG-CD2 3.51Å; C1897-Y2055 WeakPolarHBondContact SG-CD2 3.42Å; C1897-Y2055 VanDerWaalsContact SG-CE2 3.51Å; C1897-Y2055 WeakPolarHBondContact SG-CE2 3.3Å; N2017-Y2055 HydrophobicContact CB-CE1 4.36Å; N2017-Y2055 WeakPolarHBondContact ND2-CE1 2.98Å; N2017-Y2055 VanDerWaalsContact ND2-CZ 3.31Å; N2017-Y2055 PolarHBondContact ND2-OH 3.23Å; F2020-Y2055 HydrophobicContact CE1-CD1 4.3Å; F2020-Y2055 HydrophobicContact CE1-CD2 4.47Å; F2020-Y2055 AromaticContact CE1-CG 3.96Å; F2020-Y2055 HydrophobicContact CE1-CG 4.25Å; F2020-Y2055 HydrophobicContact CZ-CD1 4.39Å; F2020-Y2055 HydrophobicContact CZ-CG 4.33Å; T2053-Y2055 HydrophobicContact CG2-CD2 4.41Å; T2053-Y2055 HydrophobicContact CG2-CE1 3.93Å; T2053-Y2055 HydrophobicContact CG2-CE2 3.78Å; T2053-Y2055 VanDerWaalsContact CG2-CZ 3.49Å; T2053-Y2055 WeakPolarHBondContact OG1-CE2 3.46Å; T2053-Y2055 PolarHBondContact OG1-OH 3.31Å
2056	F	95	Very high	90.3	Very high	0.8 Å²	0.8	39.2 Å²	39.2	0%	0.004	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	138.2	173.6	-63.1	-76.3	0	0	0	109.9	V1892 I1893 Y1894 L1907 W1918 C2039 F2040 V2042 V2054	V1892-F2056 HydrophobicContact CB-CD1 4.43Å; V1892-F2056 HydrophobicContact CG2-CD1 3.78Å; V1892-F2056 HydrophobicContact CG2-CE1 4.36Å; V1892-F2056 HydrophobicContact CG2-CG 4.46Å; I1893-F2056 CarbonylContact O-C 3.54Å; I1893-F2056 VanDerWaalsContact O-CA 3.29Å; I1893-F2056 WeakPolarHBondContact O-CA 3.36Å; Y1894-F2056 HydrophobicContact CD2-CD1 4.32Å; Y1894-F2056 AromaticContact CD2-CE1 3.83Å; Y1894-F2056 HydrophobicContact CD2-CE1 3.89Å; Y1894-F2056 HydrophobicContact CD2-CZ 4.3Å; Y1894-F2056 HydrophobicContact CG-CE1 4.38Å; L1907-F2056 HydrophobicContact CD1-CE1 4.1Å; L1907-F2056 HydrophobicContact CD1-CE2 4.23Å; L1907-F2056 HydrophobicContact CD1-CZ 4.22Å; L1907-F2056 HydrophobicContact CD2-CD2 4.44Å; L1907-F2056 HydrophobicContact CD2-CE2 4.41Å; W1918-F2056 HydrophobicContact CB-CE1 4.42Å; W1918-F2056 AromaticContact CD2-CE1 3.98Å; W1918-F2056 HydrophobicContact CD2-CE1 4.12Å; W1918-F2056 AromaticContact CD2-CZ 3.93Å; W1918-F2056 HydrophobicContact CD2-CZ 3.97Å; W1918-F2056 HydrophobicContact CE3-CE1 4.27Å; W1918-F2056 AromaticContact CE3-CZ 3.76Å; W1918-F2056 HydrophobicContact CE3-CZ 3.76Å; W1918-F2056 HydrophobicContact CG-CE1 4.21Å; W1918-F2056 HydrophobicContact CG-CZ 4.46Å; W1918-F2056 HydrophobicContact CH2-CZ 4.45Å; W1918-F2056 AromaticContact CZ3-CZ 3.99Å; W1918-F2056 HydrophobicContact CZ3-CZ 4.08Å; C2039-F2056 CarbonylContact C-O 3.56Å; C2039-F2056 VanDerWaalsContact CA-O 3.28Å; C2039-F2056 WeakPolarHBondContact CA-O 3.4Å; C2039-F2056 PolarHBondContact SG-O 3.31Å; C2039-F2056 VanDerWaalsContact SG-O 3.33Å; F2040-F2056 HydrophobicContact CD1-CB 4.04Å; F2040-F2056 HydrophobicContact CD2-CB 4.36Å; F2040-F2056 HydrophobicContact CD2-CD2 4.28Å; F2040-F2056 HydrophobicContact CE1-CB 3.5Å; F2040-F2056 VanDerWaalsContact CE1-CB 3.46Å; F2040-F2056 HydrophobicContact CE1-CG 4.42Å; F2040-F2056 HydrophobicContact CE2-CB 3.87Å; F2040-F2056 AromaticContact CE2-CD2 3.56Å; F2040-F2056 HydrophobicContact CE2-CD2 3.56Å; F2040-F2056 HydrophobicContact CE2-CE2 4.46Å; F2040-F2056 HydrophobicContact CE2-CG 4.07Å; F2040-F2056 HydrophobicContact CG-CB 4.44Å; F2040-F2056 HydrophobicContact CZ-CB 3.41Å; F2040-F2056 VanDerWaalsContact CZ-CB 3.41Å; F2040-F2056 AromaticContact CZ-CD2 3.8Å; F2040-F2056 HydrophobicContact CZ-CD2 3.8Å; F2040-F2056 AromaticContact CZ-CG 3.84Å; F2040-F2056 HydrophobicContact CZ-CG 3.84Å; F2040-F2056 PolarHBondContact N-O 3.21Å; F2040-F2056 PolarHBondContact O-N 2.96Å; V2042-F2056 HydrophobicContact CG2-CD2 4.23Å; V2042-F2056 HydrophobicContact CG2-CE2 4.06Å; V2054-F2056 HydrophobicContact CB-CE2 4.37Å; V2054-F2056 HydrophobicContact CG1-CD2 4.09Å; V2054-F2056 HydrophobicContact CG1-CE1 4.24Å; V2054-F2056 HydrophobicContact CG1-CE2 3.44Å; V2054-F2056 VanDerWaalsContact CG1-CE2 3.44Å; V2054-F2056 HydrophobicContact CG1-CZ 3.53Å; V2054-F2056 VanDerWaalsContact CG1-CZ 3.48Å; V2054-F2056 HydrophobicContact CG2-CD2 4.44Å; V2054-F2056 HydrophobicContact CG2-CE2 3.64Å; V2054-F2056 HydrophobicContact CG2-CZ 4.21Å
2057	V	93.7	Very high	90.9	Very high	0.2 Å²	0.2	37.3 Å²	37.3	0%	0.001	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	129.3	175	-176.6	0	0	0	0	108.9	I1893 F2020 I2022 V2025 Y2026 P2037 K2038 C2039	I1893-V2057 HydrophobicContact CB-CB 4.23Å; I1893-V2057 WeakPolarHBondContact CB-O 3.38Å; I1893-V2057 PolarHBondContact N-O 3.11Å; I1893-V2057 PolarHBondContact O-N 3.06Å; F2020-V2057 HydrophobicContact CE2-CG2 4.35Å; I2022-V2057 HydrophobicContact CG2-CG1 3.8Å; I2022-V2057 HydrophobicContact CG2-CG2 4.34Å; V2025-V2057 HydrophobicContact CG1-CG2 4.37Å; Y2026-V2057 HydrophobicContact CD2-CG1 4.13Å; P2037-V2057 HydrophobicContact CB-CG1 3.98Å; K2038-V2057 WeakPolarHBondContact O-CA 3.3Å; C2039-V2057 HydrophobicContact CB-CG2 4.16Å
2058	A	93.4	Very high	91.3	Very high	0.4 Å²	0.4	38.2 Å²	38.2	0%	0.003	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	163.4	179.4	0	0	0	0	0	110.5	V1892 P2037 K2038 T2062 A2063	V1892-A2058 HydrophobicContact CG1-CB 4.12Å; P2037-A2058 CarbonylContact C-O 3.56Å; P2037-A2058 WeakPolarHBondContact CA-O 3.41Å; K2038-A2058 PolarHBondContact N-O 3.13Å; K2038-A2058 PolarHBondContact O-N 3.28Å; K2038-A2058 VanDerWaalsContact O-O 3.11Å; A2058-T2062 HydrophobicContact CB-CG2 4.04Å; A2058-A2063 HydrophobicContact CB-CB 4.26Å
2059	P	92.5	Very high	91.8	Very high	13.8 Å²	13.8	34.1 Å²	34.1	9%	0.09	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.5	153.1	169.5	-21.8	33.3	0	0	0	111.6	V1579 F1582 E1585 Y2026 V2035 M2061 T2062 A2063	V1579-P2059 HydrophobicContact CG1-CG 4.32Å; F1582-P2059 HydrophobicContact CB-CG 3.9Å; F1582-P2059 VanDerWaalsContact CD1-CD 3.49Å; F1582-P2059 HydrophobicContact CD1-CG 3.87Å; F1582-P2059 HydrophobicContact CD2-CG 3.5Å; F1582-P2059 VanDerWaalsContact CD2-CG 3.5Å; F1582-P2059 HydrophobicContact CE1-CG 4.25Å; F1582-P2059 HydrophobicContact CE2-CG 3.9Å; F1582-P2059 HydrophobicContact CG-CG 3.48Å; F1582-P2059 VanDerWaalsContact CG-CG 3.45Å; F1582-P2059 HydrophobicContact CZ-CG 4.26Å; E1585-P2059 HydrophobicContact CB-CB 4.21Å; E1585-P2059 HydrophobicContact CB-CG 4.2Å; E1585-P2059 VanDerWaalsContact CD-CB 3.49Å; E1585-P2059 HydrophobicContact CG-CB 3.61Å; E1585-P2059 HydrophobicContact CG-CG 4.08Å; Y2026-P2059 HydrophobicContact CE2-CG 4.41Å; V2035-P2059 HydrophobicContact CG1-CB 3.98Å; P2059-M2061 VanDerWaalsContact C-N 3.33Å; P2059-M2061 PolarHBondContact O-N 3.08Å; P2059-M2061 VanDerWaalsContact O-N 3.13Å; P2059-T2062 WeakPolarHBondContact O-CA 3.44Å; P2059-T2062 WeakPolarHBondContact O-CB 3.29Å; P2059-T2062 PolarHBondContact O-N 3.19Å; P2059-A2063 WeakPolarHBondContact O-CB 3.16Å; P2059-A2063 PolarHBondContact O-N 3Å
2060	E	91.2	Very high	92.3	Very high	74.4 Å²	74.4	31.3 Å²	31.3	35%	0.348	16%	0.16	S	C	.	.	H	α-helix	trans	-49.1	-51.1	-170.6	170.5	159.7	-139.1	0	0	115.2	V2035 P2036 K2038 T2062 A2063 S2064	V2035-E2060 HydrophobicContact CG1-CB 4.45Å; P2036-E2060 HydrophobicContact CG-CB 4.33Å; P2036-E2060 VanDerWaalsContact CG-OE2 3.32Å; P2036-E2060 WeakPolarHBondContact CG-OE2 3.37Å; P2036-E2060 WeakPolarHBondContact O-CB 3.32Å; P2036-E2060 PolarHBondContact O-N 3.12Å; K2038-E2060 HydrophobicContact CD-CB 4.37Å; K2038-E2060 HydrophobicContact CD-CG 4.17Å; K2038-E2060 WeakPolarHBondContact CE-OE1 3.31Å; K2038-E2060 HydrophobicContact CG-CB 4.06Å; K2038-E2060 HydrophobicContact CG-CG 4.22Å; K2038-E2060 IonicContact NZ-OE1 3.42Å; K2038-E2060 PolarHBondContact NZ-OE1 3.02Å; E2060-T2062 VanDerWaalsContact C-N 3.33Å; E2060-T2062 PolarHBondContact O-N 3.21Å; E2060-A2063 PolarHBondContact O-N 2.99Å; E2060-S2064 WeakPolarHBondContact O-CB 3.5Å; E2060-S2064 PolarHBondContact O-N 3.12Å; E2060-S2064 PolarHBondContact O-OG 3.06Å
2061	M	91.3	Very high	92.6	Very high	96.8 Å²	96.8	30.5 Å²	30.5	48%	0.477	16%	0.16	S	C	.	.	H	α-helix	trans	-69.1	-39	-177.6	-77.3	-100.6	-74.6	0	0	111.8	E1585 F1588 Q1589 A1592 P2059 A2063 S2064 V2065	E1585-M2061 WeakPolarHBondContact OE1-CB 3.29Å; E1585-M2061 VanDerWaalsContact OE1-CG 3.32Å; E1585-M2061 WeakPolarHBondContact OE1-CG 3.19Å; E1585-M2061 PolarHBondContact OE1-N 3.01Å; E1585-M2061 WeakPolarHBondContact OE2-CB 3.31Å; E1585-M2061 PolarHBondContact OE2-N 3Å; F1588-M2061 HydrophobicContact CB-CB 4.47Å; F1588-M2061 HydrophobicContact CB-CE 3.89Å; F1588-M2061 HydrophobicContact CB-CG 4.23Å; F1588-M2061 HydrophobicContact CB-SD 3.51Å; F1588-M2061 VanDerWaalsContact CB-SD 3.51Å; F1588-M2061 HydrophobicContact CD2-CB 4.23Å; Q1589-M2061 HydrophobicContact CG-SD 4.06Å; A1592-M2061 HydrophobicContact CB-CE 4.39Å; P2059-M2061 VanDerWaalsContact C-N 3.33Å; P2059-M2061 PolarHBondContact O-N 3.08Å; P2059-M2061 VanDerWaalsContact O-N 3.13Å; M2061-A2063 VanDerWaalsContact C-N 3.34Å; M2061-A2063 PolarHBondContact O-N 3.42Å; M2061-S2064 PolarHBondContact O-N 3.12Å; M2061-V2065 WeakPolarHBondContact O-CB 3.27Å; M2061-V2065 VanDerWaalsContact O-CG2 3.3Å; M2061-V2065 WeakPolarHBondContact O-CG2 3.41Å; M2061-V2065 PolarHBondContact O-N 3.09Å; M2061-V2065 VanDerWaalsContact O-N 3.08Å
2062	T	93.3	Very high	92.7	Very high	16.8 Å²	16.8	31.1 Å²	31.1	10%	0.103	16%	0.161	C	C	.	.	H	α-helix	trans	-63.1	-45.1	176.1	-57.9	0	0	0	0	111.2	E1585 C1890 A2058 P2059 E2060 S2064 V2065 L2066	E1585-T2062 WeakPolarHBondContact OE2-CB 3.39Å; E1585-T2062 PolarHBondContact OE2-N 3.29Å; E1585-T2062 PolarHBondContact OE2-OG1 2.94Å; C1890-T2062 HydrophobicContact CB-CG2 3.72Å; A2058-T2062 HydrophobicContact CB-CG2 4.04Å; P2059-T2062 WeakPolarHBondContact O-CA 3.44Å; P2059-T2062 WeakPolarHBondContact O-CB 3.29Å; P2059-T2062 PolarHBondContact O-N 3.19Å; E2060-T2062 VanDerWaalsContact C-N 3.33Å; E2060-T2062 PolarHBondContact O-N 3.21Å; T2062-S2064 VanDerWaalsContact C-N 3.32Å; T2062-S2064 PolarHBondContact O-N 3.17Å; T2062-V2065 PolarHBondContact O-N 3.18Å; T2062-L2066 HydrophobicContact CG2-CD1 4.02Å; T2062-L2066 HydrophobicContact CG2-CG 4.45Å; T2062-L2066 WeakPolarHBondContact O-CB 3.32Å; T2062-L2066 WeakPolarHBondContact O-CD1 3.34Å; T2062-L2066 VanDerWaalsContact O-CG 3.29Å; T2062-L2066 WeakPolarHBondContact O-CG 3.27Å; T2062-L2066 PolarHBondContact O-N 3.22Å
2063	A	94.1	Very high	92.6	Very high	0.4 Å²	0.4	25.8 Å²	25.8	0%	0.003	14%	0.14	C	C	.	.	H	α-helix	trans	-61	-44.8	176.7	0	0	0	0	0	111.5	K2038 F2040 A2058 P2059 E2060 M2061 L2066 T2067	K2038-A2063 HydrophobicContact CB-CB 3.77Å; K2038-A2063 HydrophobicContact CD-CB 4.44Å; F2040-A2063 HydrophobicContact CD1-CB 4.24Å; A2058-A2063 HydrophobicContact CB-CB 4.26Å; P2059-A2063 WeakPolarHBondContact O-CB 3.16Å; P2059-A2063 PolarHBondContact O-N 3Å; E2060-A2063 PolarHBondContact O-N 2.99Å; M2061-A2063 VanDerWaalsContact C-N 3.34Å; M2061-A2063 PolarHBondContact O-N 3.42Å; A2063-L2066 PolarHBondContact O-N 3.24Å; A2063-T2067 WeakPolarHBondContact O-CB 3.28Å; A2063-T2067 VanDerWaalsContact O-CG2 3.28Å; A2063-T2067 WeakPolarHBondContact O-CG2 3.24Å; A2063-T2067 PolarHBondContact O-N 3.2Å; A2063-T2067 PolarHBondContact O-OG1 3.16Å; A2063-T2067 VanDerWaalsContact O-OG1 3.07Å
2064	S	93.3	Very high	92.6	Very high	34.8 Å²	34.8	24 Å²	24	24%	0.243	13%	0.129	C	C	.	.	H	α-helix	trans	-61.6	-51.1	177.5	-123.4	0	0	0	0	111.7	E2060 M2061 T2062 L2066 T2067 D2068	E2060-S2064 WeakPolarHBondContact O-CB 3.5Å; E2060-S2064 PolarHBondContact O-N 3.12Å; E2060-S2064 PolarHBondContact O-OG 3.06Å; M2061-S2064 PolarHBondContact O-N 3.12Å; T2062-S2064 VanDerWaalsContact C-N 3.32Å; T2062-S2064 PolarHBondContact O-N 3.17Å; S2064-L2066 VanDerWaalsContact C-N 3.29Å; S2064-L2066 PolarHBondContact O-N 2.99Å; S2064-L2066 VanDerWaalsContact O-N 3.11Å; S2064-T2067 WeakPolarHBondContact CA-OG1 3.41Å; S2064-T2067 PolarHBondContact O-N 2.83Å; S2064-T2067 VanDerWaalsContact O-N 3.15Å; S2064-T2067 PolarHBondContact O-OG1 3.11Å; S2064-T2067 VanDerWaalsContact O-OG1 3.12Å; S2064-D2068 VanDerWaalsContact C-OD2 3.28Å; S2064-D2068 WeakPolarHBondContact CB-OD2 3.09Å; S2064-D2068 VanDerWaalsContact O-CB 3.27Å; S2064-D2068 WeakPolarHBondContact O-CB 3.45Å; S2064-D2068 PolarHBondContact O-N 2.88Å; S2064-D2068 PolarHBondContact OG-OD2 3.43Å
2065	V	92.2	Very high	92.4	Very high	24.4 Å²	24.4	28.7 Å²	28.7	15%	0.148	15%	0.154	C	C	.	.	H	α-helix	trans	-56.2	-42.1	178.5	167.5	0	0	0	0	111.9	F1588 L1882 R1885 M2061 T2062 G2069	F1588-V2065 HydrophobicContact CD2-CG2 4.33Å; F1588-V2065 HydrophobicContact CE2-CB 4.4Å; F1588-V2065 HydrophobicContact CE2-CG1 4.32Å; F1588-V2065 HydrophobicContact CE2-CG2 4.23Å; F1588-V2065 HydrophobicContact CZ-CG1 4.4Å; L1882-V2065 HydrophobicContact CD2-CB 4.42Å; L1882-V2065 HydrophobicContact CD2-CG1 4.08Å; L1882-V2065 HydrophobicContact CD2-CG2 4.37Å; R1885-V2065 HydrophobicContact CB-CG1 3.8Å; R1885-V2065 HydrophobicContact CG-CG1 4.24Å; M2061-V2065 WeakPolarHBondContact O-CB 3.27Å; M2061-V2065 VanDerWaalsContact O-CG2 3.3Å; M2061-V2065 WeakPolarHBondContact O-CG2 3.41Å; M2061-V2065 PolarHBondContact O-N 3.09Å; M2061-V2065 VanDerWaalsContact O-N 3.08Å; T2062-V2065 PolarHBondContact O-N 3.18Å; V2065-G2069 WeakPolarHBondContact O-CA 3.36Å; V2065-G2069 PolarHBondContact O-N 2.92Å; V2065-G2069 VanDerWaalsContact O-N 3.09Å
2066	L	94.3	Very high	91.9	Very high	4 Å²	4	27.6 Å²	27.6	2%	0.021	15%	0.15	C	C	.	.	H	α-helix	trans	-66.6	-47.9	177.6	-72.6	169.3	0	0	0	111.9	L1886 C1890 V1892 L1907 F2040 T2062 A2063 S2064 L2070	L1886-L2066 HydrophobicContact CD2-CD2 3.75Å; C1890-L2066 HydrophobicContact CB-CD1 4.13Å; C1890-L2066 HydrophobicContact CB-CD2 4.19Å; C1890-L2066 HydrophobicContact CB-CG 4.31Å; V1892-L2066 HydrophobicContact CG1-CD1 3.5Å; V1892-L2066 VanDerWaalsContact CG1-CD1 3.44Å; L1907-L2066 HydrophobicContact CD2-CD1 4.24Å; L1907-L2066 HydrophobicContact CD2-CD2 4.13Å; F2040-L2066 HydrophobicContact CE1-CB 4.3Å; F2040-L2066 HydrophobicContact CE1-CD1 3.85Å; F2040-L2066 HydrophobicContact CZ-CB 4.12Å; F2040-L2066 HydrophobicContact CZ-CD1 3.85Å; T2062-L2066 HydrophobicContact CG2-CD1 4.02Å; T2062-L2066 HydrophobicContact CG2-CG 4.45Å; T2062-L2066 WeakPolarHBondContact O-CB 3.32Å; T2062-L2066 WeakPolarHBondContact O-CD1 3.34Å; T2062-L2066 VanDerWaalsContact O-CG 3.29Å; T2062-L2066 WeakPolarHBondContact O-CG 3.27Å; T2062-L2066 PolarHBondContact O-N 3.22Å; A2063-L2066 PolarHBondContact O-N 3.24Å; S2064-L2066 VanDerWaalsContact C-N 3.29Å; S2064-L2066 PolarHBondContact O-N 2.99Å; S2064-L2066 VanDerWaalsContact O-N 3.11Å; L2066-L2070 VanDerWaalsContact O-CB 3.27Å; L2066-L2070 WeakPolarHBondContact O-CB 3.3Å; L2066-L2070 WeakPolarHBondContact O-CD1 3.4Å; L2066-L2070 VanDerWaalsContact O-CG 3.23Å; L2066-L2070 WeakPolarHBondContact O-CG 3.37Å; L2066-L2070 PolarHBondContact O-N 3.25Å; L2066-L2070 VanDerWaalsContact O-N 3.12Å
2067	T	94.2	Very high	91.3	Very high	5.6 Å²	5.6	27.9 Å²	27.9	3%	0.034	15%	0.152	C	C	.	.	H	α-helix	trans	-68.8	-45.2	-177.7	50.8	0	0	0	0	112.2	V2012 I2014 F2040 A2063 S2064 G2069 L2070 A2071	V2012-T2067 HydrophobicContact CG1-CG2 3.97Å; I2014-T2067 HydrophobicContact CG1-CG2 3.86Å; F2040-T2067 HydrophobicContact CB-CG2 3.34Å; F2040-T2067 VanDerWaalsContact CB-CG2 3.43Å; F2040-T2067 HydrophobicContact CD1-CG2 4.16Å; F2040-T2067 HydrophobicContact CD2-CG2 3.83Å; F2040-T2067 HydrophobicContact CG-CG2 3.53Å; F2040-T2067 VanDerWaalsContact CG-CG2 3.48Å; A2063-T2067 WeakPolarHBondContact O-CB 3.28Å; A2063-T2067 VanDerWaalsContact O-CG2 3.28Å; A2063-T2067 WeakPolarHBondContact O-CG2 3.24Å; A2063-T2067 PolarHBondContact O-N 3.2Å; A2063-T2067 PolarHBondContact O-OG1 3.16Å; A2063-T2067 VanDerWaalsContact O-OG1 3.07Å; S2064-T2067 WeakPolarHBondContact CA-OG1 3.41Å; S2064-T2067 PolarHBondContact O-N 2.83Å; S2064-T2067 VanDerWaalsContact O-N 3.15Å; S2064-T2067 PolarHBondContact O-OG1 3.11Å; S2064-T2067 VanDerWaalsContact O-OG1 3.12Å; T2067-G2069 VanDerWaalsContact C-N 3.33Å; T2067-G2069 PolarHBondContact O-N 3.13Å; T2067-L2070 PolarHBondContact O-N 3.07Å; T2067-A2071 VanDerWaalsContact O-CB 3.24Å; T2067-A2071 WeakPolarHBondContact O-CB 3.42Å; T2067-A2071 PolarHBondContact O-N 3.19Å
2068	D	92.6	Very high	90.7	Very high	80.2 Å²	80.2	32.2 Å²	32.2	43%	0.429	17%	0.17	S	C	.	.	H	α-helix	trans	-66.3	-43.8	-178.3	-61.9	-24.5	0	0	0	110.6	L1882 S2064 A2071 Q2072	L1882-D2068 HydrophobicContact CD1-CB 4.37Å; S2064-D2068 VanDerWaalsContact C-OD2 3.28Å; S2064-D2068 WeakPolarHBondContact CB-OD2 3.09Å; S2064-D2068 VanDerWaalsContact O-CB 3.27Å; S2064-D2068 WeakPolarHBondContact O-CB 3.45Å; S2064-D2068 PolarHBondContact O-N 2.88Å; S2064-D2068 PolarHBondContact OG-OD2 3.43Å; D2068-A2071 PolarHBondContact O-N 3.2Å; D2068-Q2072 WeakPolarHBondContact O-CG 3.33Å; D2068-Q2072 PolarHBondContact O-N 3.27Å
2069	G	91.7	Very high	90	Very high	0 Å²	0	34 Å²	34	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-65.5	-44.4	177.3	0	0	0	0	0	112.8	V2065 T2067 A2071 Q2072 I2073	V2065-G2069 WeakPolarHBondContact O-CA 3.36Å; V2065-G2069 PolarHBondContact O-N 2.92Å; V2065-G2069 VanDerWaalsContact O-N 3.09Å; T2067-G2069 VanDerWaalsContact C-N 3.33Å; T2067-G2069 PolarHBondContact O-N 3.13Å; G2069-A2071 VanDerWaalsContact C-N 3.34Å; G2069-A2071 PolarHBondContact O-N 3.33Å; G2069-Q2072 PolarHBondContact O-N 3.28Å; G2069-I2073 WeakPolarHBondContact O-CD1 3.24Å; G2069-I2073 WeakPolarHBondContact O-CG1 3.36Å; G2069-I2073 PolarHBondContact O-N 2.98Å; G2069-I2073 VanDerWaalsContact O-N 3.13Å
2070	L	94	Very high	89.2	Confident	2.4 Å²	2.4	33.9 Å²	33.9	1%	0.013	18%	0.183	C	C	.	.	H	α-helix	trans	-67	-37.1	176	-69.9	175	0	0	0	111.8	L1886 L1909 I1916 L2006 V2012 L2066 T2067 Q2072 I2073 L2074	L1886-L2070 HydrophobicContact CD1-CD2 4.43Å; L1886-L2070 HydrophobicContact CD2-CD2 4.13Å; L1886-L2070 HydrophobicContact CD2-CG 4.31Å; L1909-L2070 HydrophobicContact CD1-CD2 4.35Å; I1916-L2070 HydrophobicContact CD1-CD1 3.82Å; I1916-L2070 HydrophobicContact CD1-CD2 3.65Å; I1916-L2070 HydrophobicContact CD1-CG 4.4Å; I1916-L2070 HydrophobicContact CG1-CD2 4.06Å; I1916-L2070 HydrophobicContact CG2-CD1 4.44Å; I1916-L2070 HydrophobicContact CG2-CD2 3.54Å; L2006-L2070 HydrophobicContact CD2-CD2 4.39Å; V2012-L2070 HydrophobicContact CB-CB 4.45Å; V2012-L2070 HydrophobicContact CG1-CB 4.24Å; V2012-L2070 HydrophobicContact CG1-CD1 4.34Å; V2012-L2070 HydrophobicContact CG2-CB 4.24Å; V2012-L2070 HydrophobicContact CG2-CD1 4.46Å; L2066-L2070 VanDerWaalsContact O-CB 3.27Å; L2066-L2070 WeakPolarHBondContact O-CB 3.3Å; L2066-L2070 WeakPolarHBondContact O-CD1 3.4Å; L2066-L2070 VanDerWaalsContact O-CG 3.23Å; L2066-L2070 WeakPolarHBondContact O-CG 3.37Å; L2066-L2070 PolarHBondContact O-N 3.25Å; L2066-L2070 VanDerWaalsContact O-N 3.12Å; T2067-L2070 PolarHBondContact O-N 3.07Å; L2070-Q2072 PolarHBondContact O-N 3.07Å; L2070-I2073 HydrophobicContact CD2-CD1 4.46Å; L2070-I2073 PolarHBondContact O-N 3.24Å; L2070-L2074 WeakPolarHBondContact O-CB 3.31Å; L2070-L2074 WeakPolarHBondContact O-CD1 3.43Å; L2070-L2074 VanDerWaalsContact O-CG 3.26Å; L2070-L2074 WeakPolarHBondContact O-CG 3.35Å; L2070-L2074 PolarHBondContact O-N 3.18Å
2071	A	92.2	Very high	88.3	Confident	32.4 Å²	32.4	34.5 Å²	34.5	27%	0.268	18%	0.183	S	C	.	.	H	α-helix	trans	-62.3	-42.9	175.3	0	0	0	0	0	111.9	T2067 D2068 G2069 I2073 L2074 N2075	T2067-A2071 VanDerWaalsContact O-CB 3.24Å; T2067-A2071 WeakPolarHBondContact O-CB 3.42Å; T2067-A2071 PolarHBondContact O-N 3.19Å; D2068-A2071 PolarHBondContact O-N 3.2Å; G2069-A2071 VanDerWaalsContact C-N 3.34Å; G2069-A2071 PolarHBondContact O-N 3.33Å; A2071-I2073 VanDerWaalsContact C-N 3.34Å; A2071-I2073 PolarHBondContact O-N 3.35Å; A2071-L2074 PolarHBondContact O-N 3.19Å; A2071-N2075 WeakPolarHBondContact O-CB 3.33Å; A2071-N2075 PolarHBondContact O-N 3.19Å; A2071-N2075 PolarHBondContact O-ND2 3.1Å
2072	Q	89.9	Confident	87.4	Confident	69.2 Å²	69.2	33.9 Å²	33.9	32%	0.323	19%	0.188	S	C	.	.	H	α-helix	trans	-60.2	-44.7	174.2	-72.8	-177.6	29.4	0	0	112	I1878 D1879 D2068 G2069 L2070 L2074 N2075 E2076	I1878-Q2072 HydrophobicContact CG1-CB 4.37Å; I1878-Q2072 HydrophobicContact CG2-CB 4.33Å; D1879-Q2072 VanDerWaalsContact N-OE1 3.13Å; D2068-Q2072 WeakPolarHBondContact O-CG 3.33Å; D2068-Q2072 PolarHBondContact O-N 3.27Å; G2069-Q2072 PolarHBondContact O-N 3.28Å; L2070-Q2072 PolarHBondContact O-N 3.07Å; Q2072-L2074 PolarHBondContact O-N 2.97Å; Q2072-N2075 PolarHBondContact O-N 3.1Å; Q2072-E2076 PolarHBondContact O-N 3.03Å; Q2072-E2076 VanDerWaalsContact O-N 3.09Å
2073	I	89.3	Confident	86.3	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-61.2	-45.8	176.5	-71.4	164.2	0	0	0	111.3	M1873 I1878 M1883 L1886 L1909 C1913 L2006 G2069 L2070 A2071 N2075 E2076 L2077	M1873-I2073 HydrophobicContact CE-CG2 4.12Å; M1873-I2073 VanDerWaalsContact CE-O 3.31Å; M1873-I2073 WeakPolarHBondContact CE-O 3.37Å; M1873-I2073 HydrophobicContact SD-CG2 3.96Å; I1878-I2073 HydrophobicContact CD1-CG1 3.91Å; M1883-I2073 HydrophobicContact CE-CD1 3.83Å; M1883-I2073 HydrophobicContact CE-CG1 3.87Å; M1883-I2073 HydrophobicContact SD-CD1 4.39Å; L1886-I2073 HydrophobicContact CD1-CD1 3.49Å; L1886-I2073 VanDerWaalsContact CD1-CD1 3.47Å; L1909-I2073 HydrophobicContact CD1-CD1 4.23Å; L1909-I2073 HydrophobicContact CD2-CD1 3.37Å; L1909-I2073 VanDerWaalsContact CD2-CD1 3.46Å; L1909-I2073 HydrophobicContact CG-CD1 4.41Å; C1913-I2073 HydrophobicContact CB-CG2 4.41Å; L2006-I2073 HydrophobicContact CD1-CG2 3.89Å; G2069-I2073 WeakPolarHBondContact O-CD1 3.24Å; G2069-I2073 WeakPolarHBondContact O-CG1 3.36Å; G2069-I2073 PolarHBondContact O-N 2.98Å; G2069-I2073 VanDerWaalsContact O-N 3.13Å; L2070-I2073 HydrophobicContact CD2-CD1 4.46Å; L2070-I2073 PolarHBondContact O-N 3.24Å; A2071-I2073 VanDerWaalsContact C-N 3.34Å; A2071-I2073 PolarHBondContact O-N 3.35Å; I2073-N2075 VanDerWaalsContact C-N 3.33Å; I2073-N2075 PolarHBondContact O-N 3.05Å; I2073-E2076 PolarHBondContact O-N 2.96Å; I2073-L2077 HydrophobicContact CG2-CD1 4Å; I2073-L2077 HydrophobicContact CG2-CG 4.42Å; I2073-L2077 WeakPolarHBondContact O-CB 3.38Å; I2073-L2077 WeakPolarHBondContact O-CG 3.42Å; I2073-L2077 PolarHBondContact O-N 3.09Å
2074	L	90	Very high	85.1	Confident	6 Å²	6	38.8 Å²	38.8	3%	0.031	21%	0.209	C	C	.	.	H	α-helix	trans	-66.6	-35.7	-179.9	-69	169.4	0	0	0	112.2	L2006 V2009 V2012 L2070 A2071 Q2072 E2076 L2077 K2078	L2006-L2074 HydrophobicContact CB-CD2 4.32Å; L2006-L2074 HydrophobicContact CD2-CD2 4.18Å; L2006-L2074 WeakPolarHBondContact O-CD2 3.29Å; V2009-L2074 HydrophobicContact CB-CD1 4.36Å; V2009-L2074 HydrophobicContact CB-CD2 3.69Å; V2009-L2074 HydrophobicContact CG1-CD1 3.57Å; V2009-L2074 HydrophobicContact CG1-CD2 3.82Å; V2009-L2074 HydrophobicContact CG1-CG 4.36Å; V2012-L2074 HydrophobicContact CB-CD1 4.2Å; V2012-L2074 HydrophobicContact CG2-CD1 3.51Å; V2012-L2074 VanDerWaalsContact CG2-CD1 3.47Å; L2070-L2074 WeakPolarHBondContact O-CB 3.31Å; L2070-L2074 WeakPolarHBondContact O-CD1 3.43Å; L2070-L2074 VanDerWaalsContact O-CG 3.26Å; L2070-L2074 WeakPolarHBondContact O-CG 3.35Å; L2070-L2074 PolarHBondContact O-N 3.18Å; A2071-L2074 PolarHBondContact O-N 3.19Å; Q2072-L2074 PolarHBondContact O-N 2.97Å; L2074-E2076 VanDerWaalsContact C-N 3.35Å; L2074-L2077 HydrophobicContact CD2-CD1 4.45Å; L2074-L2077 PolarHBondContact O-N 3.32Å; L2074-K2078 VanDerWaalsContact O-CB 3.29Å; L2074-K2078 WeakPolarHBondContact O-CB 3.34Å; L2074-K2078 WeakPolarHBondContact O-CD 3.27Å; L2074-K2078 VanDerWaalsContact O-CG 3.23Å; L2074-K2078 WeakPolarHBondContact O-CG 3.41Å; L2074-K2078 PolarHBondContact O-N 3.08Å
2075	N	87.4	Confident	84.2	Confident	99.2 Å²	99.2	37.8 Å²	37.8	53%	0.53	20%	0.201	S	C	.	.	H	α-helix	trans	-66.3	-42.1	176.1	-72.3	-17.9	0	0	0	111.6	A2071 Q2072 I2073 K2078 A2079	A2071-N2075 WeakPolarHBondContact O-CB 3.33Å; A2071-N2075 PolarHBondContact O-N 3.19Å; A2071-N2075 PolarHBondContact O-ND2 3.1Å; Q2072-N2075 PolarHBondContact O-N 3.1Å; I2073-N2075 VanDerWaalsContact C-N 3.33Å; I2073-N2075 PolarHBondContact O-N 3.05Å; N2075-K2078 PolarHBondContact O-N 3.09Å; N2075-A2079 WeakPolarHBondContact O-CB 3.38Å; N2075-A2079 PolarHBondContact O-N 3.23Å
2076	E	83.8	Confident	83.5	Confident	17.8 Å²	17.8	42.1 Å²	42.1	8%	0.083	21%	0.214	C	C	.	.	H	α-helix	trans	-69.3	-38.6	175.5	-178.3	63.9	-154.5	0	0	111.6	M1873 S1874 R1877 I1878 Q2072 I2073 L2074 K2078 A2079 Q2080	M1873-E2076 HydrophobicContact CB-CG 4.47Å; M1873-E2076 HydrophobicContact CE-CB 3.32Å; M1873-E2076 HydrophobicContact CE-CG 3.27Å; M1873-E2076 VanDerWaalsContact CE-CG 3.43Å; M1873-E2076 HydrophobicContact CG-CB 4.24Å; M1873-E2076 HydrophobicContact CG-CG 3.53Å; M1873-E2076 HydrophobicContact SD-CB 3.87Å; M1873-E2076 HydrophobicContact SD-CG 3.83Å; S1874-E2076 WeakPolarHBondContact O-CG 3.42Å; R1877-E2076 WeakPolarHBondContact CD-OE2 3.49Å; R1877-E2076 IonicContact CZ-OE1 3.81Å; R1877-E2076 IonicContact CZ-OE2 3.31Å; R1877-E2076 IonicContact NE-OE1 3.41Å; R1877-E2076 IonicContact NE-OE2 3.29Å; R1877-E2076 PolarHBondContact NE-OE2 3.17Å; R1877-E2076 IonicContact NH2-OE1 3.03Å; R1877-E2076 PolarHBondContact NH2-OE1 3.07Å; R1877-E2076 IonicContact NH2-OE2 2.7Å; R1877-E2076 PolarHBondContact NH2-OE2 2.99Å; I1878-E2076 HydrophobicContact CD1-CB 4.37Å; I1878-E2076 HydrophobicContact CD1-CG 4.49Å; Q2072-E2076 PolarHBondContact O-N 3.03Å; Q2072-E2076 VanDerWaalsContact O-N 3.09Å; I2073-E2076 PolarHBondContact O-N 2.96Å; L2074-E2076 VanDerWaalsContact C-N 3.35Å; E2076-K2078 VanDerWaalsContact C-N 3.35Å; E2076-K2078 PolarHBondContact O-N 2.96Å; E2076-A2079 PolarHBondContact O-N 3.16Å; E2076-Q2080 VanDerWaalsContact O-CG 3.3Å; E2076-Q2080 WeakPolarHBondContact O-CG 3.36Å; E2076-Q2080 PolarHBondContact O-N 3.07Å; E2076-Q2080 PolarHBondContact OE1-NE2 3.1Å
2077	L	83.2	Confident	82.9	Confident	6.4 Å²	6.4	44.2 Å²	44.2	3%	0.034	22%	0.222	C	C	.	.	H	α-helix	trans	-60.4	-45.7	171.2	-77	171.3	0	0	0	111.7	L1872 M1873 L2006 I2073 L2074 A2079 Q2080 Y2081 F2089	L1872-L2077 HydrophobicContact CD2-CD2 3.96Å; L1872-L2077 HydrophobicContact CG-CD2 4.24Å; M1873-L2077 HydrophobicContact CB-CD2 4.12Å; M1873-L2077 HydrophobicContact CE-CD1 4.07Å; M1873-L2077 HydrophobicContact CE-CD2 4.04Å; M1873-L2077 HydrophobicContact CE-CG 3.73Å; M1873-L2077 HydrophobicContact SD-CD1 4.4Å; M1873-L2077 HydrophobicContact SD-CD2 3.85Å; M1873-L2077 HydrophobicContact SD-CG 3.79Å; L2006-L2077 HydrophobicContact CB-CD1 3.72Å; L2006-L2077 HydrophobicContact CD1-CD1 4.42Å; I2073-L2077 HydrophobicContact CG2-CD1 4Å; I2073-L2077 HydrophobicContact CG2-CG 4.42Å; I2073-L2077 WeakPolarHBondContact O-CB 3.38Å; I2073-L2077 WeakPolarHBondContact O-CG 3.42Å; I2073-L2077 PolarHBondContact O-N 3.09Å; L2074-L2077 HydrophobicContact CD2-CD1 4.45Å; L2074-L2077 PolarHBondContact O-N 3.32Å; L2077-A2079 VanDerWaalsContact C-N 3.33Å; L2077-A2079 PolarHBondContact O-N 3.07Å; L2077-Q2080 WeakPolarHBondContact O-CA 3.32Å; L2077-Q2080 WeakPolarHBondContact O-CB 3.38Å; L2077-Q2080 PolarHBondContact O-N 3Å; L2077-Q2080 VanDerWaalsContact O-N 3.12Å; L2077-Y2081 VanDerWaalsContact O-CD2 3.26Å; L2077-Y2081 WeakPolarHBondContact O-CD2 3.39Å; L2077-Y2081 PolarHBondContact O-N 3.18Å; L2077-F2089 HydrophobicContact CD2-CE2 4.32Å; L2077-F2089 HydrophobicContact CD2-CZ 4.5Å
2078	K	81.5	Confident	82.2	Confident	91.6 Å²	91.6	44.4 Å²	44.4	40%	0.398	22%	0.223	S	C	.	.	H	α-helix	trans	-60.9	-44.2	176.2	-75.8	169.4	-177.1	177.9	0	111.4	K2010 L2074 N2075 E2076 Q2080 Y2081 C2082	K2010-K2078 WeakPolarHBondContact O-CE 3.35Å; K2010-K2078 PolarHBondContact O-NZ 2.91Å; L2074-K2078 VanDerWaalsContact O-CB 3.29Å; L2074-K2078 WeakPolarHBondContact O-CB 3.34Å; L2074-K2078 WeakPolarHBondContact O-CD 3.27Å; L2074-K2078 VanDerWaalsContact O-CG 3.23Å; L2074-K2078 WeakPolarHBondContact O-CG 3.41Å; L2074-K2078 PolarHBondContact O-N 3.08Å; N2075-K2078 PolarHBondContact O-N 3.09Å; E2076-K2078 VanDerWaalsContact C-N 3.35Å; E2076-K2078 PolarHBondContact O-N 2.96Å; K2078-Q2080 VanDerWaalsContact C-N 3.27Å; K2078-Q2080 PolarHBondContact O-N 3.09Å; K2078-Y2081 WeakPolarHBondContact O-CB 3.48Å; K2078-Y2081 PolarHBondContact O-N 3.19Å; K2078-Y2081 VanDerWaalsContact O-N 3.1Å; K2078-C2082 PolarHBondContact O-N 3.22Å; K2078-C2082 VanDerWaalsContact O-N 3.12Å; K2078-C2082 PolarHBondContact O-SG 3.1Å; K2078-C2082 VanDerWaalsContact O-SG 3.41Å
2079	A	78.7	Confident	81.6	Confident	36.8 Å²	36.8	41.8 Å²	41.8	30%	0.304	21%	0.208	S	C	.	.	H	α-helix	trans	-58.1	-40.6	174.8	0	0	0	0	0	111.5	N2075 E2076 L2077 Y2081 C2082 H2083	N2075-A2079 WeakPolarHBondContact O-CB 3.38Å; N2075-A2079 PolarHBondContact O-N 3.23Å; E2076-A2079 PolarHBondContact O-N 3.16Å; L2077-A2079 VanDerWaalsContact C-N 3.33Å; L2077-A2079 PolarHBondContact O-N 3.07Å; A2079-Y2081 PolarHBondContact O-N 3.11Å; A2079-C2082 WeakPolarHBondContact O-CB 3.36Å; A2079-C2082 PolarHBondContact O-N 3.14Å; A2079-C2082 VanDerWaalsContact O-N 3.11Å; A2079-H2083 PolarHBondContact O-CD2 3.08Å; A2079-H2083 PolarHBondContact O-N 3.16Å
2080	Q	74.1	Confident	81.1	Confident	12.4 Å²	12.4	46 Å²	46	6%	0.058	22%	0.224	C	C	.	.	H	α-helix	trans	-66.4	-35.6	175.5	-69.5	-166.8	-11.4	0	0	113.6	L1872 E2076 L2077 K2078 C2082 H2083 F2089	L1872-Q2080 PolarHBondContact O-NE2 3.41Å; E2076-Q2080 VanDerWaalsContact O-CG 3.3Å; E2076-Q2080 WeakPolarHBondContact O-CG 3.36Å; E2076-Q2080 PolarHBondContact O-N 3.07Å; E2076-Q2080 PolarHBondContact OE1-NE2 3.1Å; L2077-Q2080 WeakPolarHBondContact O-CA 3.32Å; L2077-Q2080 WeakPolarHBondContact O-CB 3.38Å; L2077-Q2080 PolarHBondContact O-N 3Å; L2077-Q2080 VanDerWaalsContact O-N 3.12Å; K2078-Q2080 VanDerWaalsContact C-N 3.27Å; K2078-Q2080 PolarHBondContact O-N 3.09Å; Q2080-C2082 VanDerWaalsContact C-N 3.3Å; Q2080-C2082 PolarHBondContact O-N 3.28Å; Q2080-H2083 VanDerWaalsContact CA-CD2 3.41Å; Q2080-H2083 WeakPolarHBondContact CA-CD2 3.33Å; Q2080-H2083 WeakPolarHBondContact O-CB 3.3Å; Q2080-H2083 PolarHBondContact O-CD2 3.07Å; Q2080-H2083 VanDerWaalsContact O-CD2 3.27Å; Q2080-H2083 PolarHBondContact O-N 3.15Å; Q2080-F2089 HydrophobicContact CB-CD2 4.4Å; Q2080-F2089 HydrophobicContact CB-CE2 4.47Å; Q2080-F2089 HydrophobicContact CB-CZ 3.79Å; Q2080-F2089 VanDerWaalsContact O-CE2 3.3Å; Q2080-F2089 WeakPolarHBondContact O-CE2 3.42Å; Q2080-F2089 WeakPolarHBondContact O-CZ 3.47Å
2081	Y	73.8	Confident	80.6	Confident	86.4 Å²	86.4	46 Å²	46	34%	0.339	22%	0.224	S	C	.	.	H	α-helix	trans	-69.9	-21.7	173.7	-97.3	-83.4	0	0	0	113.3	T2007 L2077 K2078 A2079 H2083 R2086 F2089	T2007-Y2081 WeakPolarHBondContact CB-OH 3.31Å; T2007-Y2081 HydrophobicContact CG2-CE2 4.01Å; T2007-Y2081 VanDerWaalsContact CG2-OH 3.23Å; T2007-Y2081 WeakPolarHBondContact CG2-OH 3.37Å; L2077-Y2081 VanDerWaalsContact O-CD2 3.26Å; L2077-Y2081 WeakPolarHBondContact O-CD2 3.39Å; L2077-Y2081 PolarHBondContact O-N 3.18Å; K2078-Y2081 WeakPolarHBondContact O-CB 3.48Å; K2078-Y2081 PolarHBondContact O-N 3.19Å; K2078-Y2081 VanDerWaalsContact O-N 3.1Å; A2079-Y2081 PolarHBondContact O-N 3.11Å; Y2081-H2083 VanDerWaalsContact C-N 3.31Å; Y2081-H2083 PolarHBondContact O-N 3.16Å; Y2081-R2086 PolarHBondContact O-NE 3.23Å; Y2081-R2086 VanDerWaalsContact O-NE 3.08Å; Y2081-R2086 PolarHBondContact O-NH2 3.22Å; Y2081-R2086 VanDerWaalsContact O-NH2 3.08Å; Y2081-F2089 HydrophobicContact CD1-CE1 4.5Å; Y2081-F2089 HydrophobicContact CD2-CD1 4.32Å; Y2081-F2089 HydrophobicContact CD2-CE1 4.3Å; Y2081-F2089 HydrophobicContact CE1-CD1 4.44Å; Y2081-F2089 AromaticContact CE1-CE1 3.81Å; Y2081-F2089 HydrophobicContact CE1-CE1 3.99Å; Y2081-F2089 HydrophobicContact CE1-CZ 4.37Å; Y2081-F2089 HydrophobicContact CE2-CE1 4.08Å; Y2081-F2089 HydrophobicContact CE2-CE2 4.22Å; Y2081-F2089 AromaticContact CE2-CZ 3.68Å; Y2081-F2089 HydrophobicContact CE2-CZ 3.68Å; Y2081-F2089 AromaticContact CZ-CE1 3.49Å; Y2081-F2089 VanDerWaalsContact CZ-CE1 3.44Å; Y2081-F2089 AromaticContact CZ-CZ 3.56Å; Y2081-F2089 VanDerWaalsContact CZ-CZ 3.47Å; Y2081-F2089 WeakPolarHBondContact OH-CE1 3.43Å; Y2081-F2089 VanDerWaalsContact OH-CZ 3.23Å; Y2081-F2089 WeakPolarHBondContact OH-CZ 3.36Å
2082	C	70.6	Confident	80	Confident	85 Å²	85	45.6 Å²	45.6	57%	0.574	22%	0.215	S	C	*	.	H	α-helix	trans	-76.3	-17.9	174.3	-67.1	0	0	0	0	113.3	K2078 A2079 Q2080 H2084 E2443	K2078-C2082 PolarHBondContact O-N 3.22Å; K2078-C2082 VanDerWaalsContact O-N 3.12Å; K2078-C2082 PolarHBondContact O-SG 3.1Å; K2078-C2082 VanDerWaalsContact O-SG 3.41Å; A2079-C2082 WeakPolarHBondContact O-CB 3.36Å; A2079-C2082 PolarHBondContact O-N 3.14Å; A2079-C2082 VanDerWaalsContact O-N 3.11Å; Q2080-C2082 VanDerWaalsContact C-N 3.3Å; Q2080-C2082 PolarHBondContact O-N 3.28Å; C2082-H2084 PolarHBondContact O-N 3.45Å; C2082-E2443 WeakPolarHBondContact CB-OE1 3.37Å; C2082-E2443 WeakPolarHBondContact O-CG 3.48Å; C2082-E2443 VanDerWaalsContact O-OE1 3.07Å
2083	H	71.1	Confident	79.5	Confident	59 Å²	59	45.5 Å²	45.5	27%	0.273	21%	0.214	S	C	.	.	S	Bend	trans	-64.2	141.6	177	-69.7	-48.8	0	0	0	112.7	A2079 Q2080 Y2081 D2085 R2086 P2338 D2339 E2443	A2079-H2083 PolarHBondContact O-CD2 3.08Å; A2079-H2083 PolarHBondContact O-N 3.16Å; Q2080-H2083 VanDerWaalsContact CA-CD2 3.41Å; Q2080-H2083 WeakPolarHBondContact CA-CD2 3.33Å; Q2080-H2083 WeakPolarHBondContact O-CB 3.3Å; Q2080-H2083 PolarHBondContact O-CD2 3.07Å; Q2080-H2083 VanDerWaalsContact O-CD2 3.27Å; Q2080-H2083 PolarHBondContact O-N 3.15Å; Y2081-H2083 VanDerWaalsContact C-N 3.31Å; Y2081-H2083 PolarHBondContact O-N 3.16Å; H2083-D2085 VanDerWaalsContact C-N 3.34Å; H2083-D2085 PolarHBondContact O-N 2.86Å; H2083-R2086 VanDerWaalsContact O-CG 3.27Å; H2083-R2086 WeakPolarHBondContact O-CG 3.48Å; H2083-R2086 PolarHBondContact O-NE 2.97Å; H2083-P2338 HydrophobicContact CB-CB 4.12Å; H2083-P2338 VanDerWaalsContact CD2-CG 3.49Å; H2083-P2338 WeakPolarHBondContact CD2-CG 3.46Å; H2083-D2339 IonicContact CE1-OD2 3.77Å; H2083-D2339 IonicContact CG-OD2 3.44Å; H2083-D2339 IonicContact ND1-OD2 3.72Å; H2083-D2339 PolarHBondContact ND1-OD2 3.07Å; H2083-E2443 VanDerWaalsContact CA-OE1 3.29Å; H2083-E2443 WeakPolarHBondContact CA-OE1 3.44Å; H2083-E2443 PolarHBondContact N-OE1 3.2Å; H2083-E2443 VanDerWaalsContact N-OE1 3.08Å; H2083-E2443 IonicContact ND1-OE1 3.71Å; H2083-E2443 PolarHBondContact ND1-OE1 3.15Å; H2083-E2443 IonicContact ND1-OE2 3.9Å
2084	H	68.1	Low	79.2	Confident	60.2 Å²	60.2	46.7 Å²	46.7	28%	0.279	22%	0.22	S	C	.	.	S	Bend	trans	-66.8	-35.8	-178.9	-51.6	77.3	0	0	0	112.4	C2082 R2086 D2339 F2438 L2441 N2442 E2443 D2444	C2082-H2084 PolarHBondContact O-N 3.45Å; H2084-R2086 PolarHBondContact O-N 3.13Å; H2084-D2339 PolarHBondContact N-OD1 3.39Å; H2084-F2438 HydrophobicContact CB-CD2 4.12Å; H2084-F2438 HydrophobicContact CB-CE2 4.02Å; H2084-F2438 WeakPolarHBondContact O-CE2 3.45Å; H2084-L2441 HydrophobicContact CB-CD2 3.9Å; H2084-L2441 VanDerWaalsContact CD2-CA 3.41Å; H2084-L2441 WeakPolarHBondContact CD2-CA 3.09Å; H2084-L2441 WeakPolarHBondContact NE2-CA 3.15Å; H2084-L2441 WeakPolarHBondContact NE2-CB 3.48Å; H2084-N2442 PolarHBondContact CD2-N 3.33Å; H2084-N2442 VanDerWaalsContact CD2-N 3.32Å; H2084-N2442 WeakPolarHBondContact NE2-CB 3.42Å; H2084-N2442 PolarHBondContact NE2-N 2.78Å; H2084-E2443 IonicContact CD2-OE2 2.72Å; H2084-E2443 VanDerWaalsContact CE1-CB 3.41Å; H2084-E2443 WeakPolarHBondContact CE1-CB 3.23Å; H2084-E2443 WeakPolarHBondContact CE1-CG 3.29Å; H2084-E2443 PolarHBondContact CE1-N 3.28Å; H2084-E2443 IonicContact CE1-OE1 3.15Å; H2084-E2443 IonicContact CE1-OE2 3.63Å; H2084-E2443 PolarHBondContact CE1-OE2 3.4Å; H2084-E2443 IonicContact ND1-OE2 3.56Å; H2084-E2443 PolarHBondContact NE2-N 3.15Å; H2084-D2444 IonicContact CE1-OD1 3.62Å; H2084-D2444 PolarHBondContact CE1-OD1 2.68Å; H2084-D2444 IonicContact CE1-OD2 2.64Å; H2084-D2444 PolarHBondContact CE1-OD2 3.14Å; H2084-D2444 IonicContact ND1-OD2 3.13Å; H2084-D2444 IonicContact NE2-OD1 2.77Å; H2084-D2444 IonicContact NE2-OD2 2.68Å
2085	D	75.3	Confident	78.8	Confident	14 Å²	14	47.2 Å²	47.2	8%	0.075	22%	0.222	C	C	.	.			trans	-95.4	93.7	176.2	-166.5	-5.4	0	0	0	112	H2083 R2087 L2088 D2339 F2438	H2083-D2085 VanDerWaalsContact C-N 3.34Å; H2083-D2085 PolarHBondContact O-N 2.86Å; D2085-R2087 VanDerWaalsContact C-N 3.3Å; D2085-R2087 VanDerWaalsContact CG-NE 3.3Å; D2085-R2087 PolarHBondContact O-N 2.95Å; D2085-R2087 VanDerWaalsContact O-N 3.09Å; D2085-R2087 VanDerWaalsContact OD1-CB 3.25Å; D2085-R2087 WeakPolarHBondContact OD1-CB 3.38Å; D2085-R2087 VanDerWaalsContact OD1-CG 3.26Å; D2085-R2087 WeakPolarHBondContact OD1-CG 3.33Å; D2085-R2087 IonicContact OD1-CZ 3.69Å; D2085-R2087 PolarHBondContact OD1-N 3.15Å; D2085-R2087 VanDerWaalsContact OD1-N 3.09Å; D2085-R2087 IonicContact OD1-NE 3.24Å; D2085-R2087 PolarHBondContact OD1-NE 3.02Å; D2085-R2087 IonicContact OD1-NH2 2.86Å; D2085-R2087 IonicContact OD2-CZ 2.93Å; D2085-R2087 VanDerWaalsContact OD2-CZ 3.27Å; D2085-R2087 IonicContact OD2-NE 3.2Å; D2085-R2087 PolarHBondContact OD2-NE 3.3Å; D2085-R2087 VanDerWaalsContact OD2-NE 3.15Å; D2085-R2087 IonicContact OD2-NH2 3.07Å; D2085-R2087 PolarHBondContact OD2-NH2 3.09Å; D2085-L2088 PolarHBondContact O-N 2.82Å; D2085-D2339 PolarHBondContact N-OD1 2.95Å; D2085-F2438 HydrophobicContact CB-CE2 4.16Å; D2085-F2438 HydrophobicContact CB-CZ 4.29Å
2086	R	78.7	Confident	78.2	Confident	115.4 Å²	115.4	43.2 Å²	43.2	44%	0.435	20%	0.2	S	C	.	.			trans	-83.5	-1	176.7	-61	-176.5	-179.4	171.6	1.5	113.5	Y2081 H2083 H2084 L2088 F2089 W2090	Y2081-R2086 PolarHBondContact O-NE 3.23Å; Y2081-R2086 VanDerWaalsContact O-NE 3.08Å; Y2081-R2086 PolarHBondContact O-NH2 3.22Å; Y2081-R2086 VanDerWaalsContact O-NH2 3.08Å; H2083-R2086 VanDerWaalsContact O-CG 3.27Å; H2083-R2086 WeakPolarHBondContact O-CG 3.48Å; H2083-R2086 PolarHBondContact O-NE 2.97Å; H2084-R2086 PolarHBondContact O-N 3.13Å; R2086-L2088 VanDerWaalsContact C-N 3.3Å; R2086-L2088 PolarHBondContact O-N 3.08Å; R2086-F2089 WeakPolarHBondContact O-CB 3.31Å; R2086-F2089 PolarHBondContact O-N 3.05Å; R2086-F2089 VanDerWaalsContact O-N 3.11Å; R2086-W2090 WeakPolarHBondContact O-CB 3.33Å; R2086-W2090 PolarHBondContact O-N 3.08Å
2087	R	81.4	Confident	77.8	Confident	48.6 Å²	48.6	45.4 Å²	45.4	18%	0.183	21%	0.212	C	C	.	.	H	α-helix	trans	-63	-38.7	-177.6	-65.5	174.3	-68	-168.8	-1.6	111.8	D2085 W2090 L2091 L2341 L2433	D2085-R2087 VanDerWaalsContact C-N 3.3Å; D2085-R2087 VanDerWaalsContact CG-NE 3.3Å; D2085-R2087 PolarHBondContact O-N 2.95Å; D2085-R2087 VanDerWaalsContact O-N 3.09Å; D2085-R2087 VanDerWaalsContact OD1-CB 3.25Å; D2085-R2087 WeakPolarHBondContact OD1-CB 3.38Å; D2085-R2087 VanDerWaalsContact OD1-CG 3.26Å; D2085-R2087 WeakPolarHBondContact OD1-CG 3.33Å; D2085-R2087 IonicContact OD1-CZ 3.69Å; D2085-R2087 PolarHBondContact OD1-N 3.15Å; D2085-R2087 VanDerWaalsContact OD1-N 3.09Å; D2085-R2087 IonicContact OD1-NE 3.24Å; D2085-R2087 PolarHBondContact OD1-NE 3.02Å; D2085-R2087 IonicContact OD1-NH2 2.86Å; D2085-R2087 IonicContact OD2-CZ 2.93Å; D2085-R2087 VanDerWaalsContact OD2-CZ 3.27Å; D2085-R2087 IonicContact OD2-NE 3.2Å; D2085-R2087 PolarHBondContact OD2-NE 3.3Å; D2085-R2087 VanDerWaalsContact OD2-NE 3.15Å; D2085-R2087 IonicContact OD2-NH2 3.07Å; D2085-R2087 PolarHBondContact OD2-NH2 3.09Å; R2087-W2090 PolarHBondContact O-N 2.95Å; R2087-L2091 WeakPolarHBondContact O-CB 3.38Å; R2087-L2091 VanDerWaalsContact O-CG 3.27Å; R2087-L2091 WeakPolarHBondContact O-CG 3.32Å; R2087-L2091 PolarHBondContact O-N 3.27Å; R2087-L2341 HydrophobicContact CB-CD2 3.57Å; R2087-L2341 VanDerWaalsContact CB-CD2 3.48Å; R2087-L2433 VanDerWaalsContact CZ-O 3.31Å; R2087-L2433 PolarHBondContact NH1-O 2.82Å; R2087-L2433 PolarHBondContact NH2-O 3.18Å
2088	L	79.2	Confident	77.5	Confident	9.6 Å²	9.6	47.1 Å²	47.1	5%	0.05	22%	0.221	C	C	.	.	H	α-helix	trans	-66.9	-40.3	177.9	-175.3	64.1	0	0	0	112	L1872 D2085 R2086 L2091 R2092 F2249 T2253 I2333 L2336 P2338 L2341 M2342 I2345	L1872-L2088 HydrophobicContact CD1-CD1 4.23Å; L1872-L2088 HydrophobicContact CD1-CD2 4.14Å; L1872-L2088 HydrophobicContact CD1-CG 3.99Å; L1872-L2088 HydrophobicContact CD2-CD1 4.32Å; L1872-L2088 HydrophobicContact CD2-CD2 3.82Å; L1872-L2088 HydrophobicContact CD2-CG 4.39Å; L1872-L2088 HydrophobicContact CG-CD2 4.41Å; D2085-L2088 PolarHBondContact O-N 2.82Å; R2086-L2088 VanDerWaalsContact C-N 3.3Å; R2086-L2088 PolarHBondContact O-N 3.08Å; L2088-L2091 PolarHBondContact O-N 3.05Å; L2088-R2092 WeakPolarHBondContact O-CB 3.42Å; L2088-R2092 WeakPolarHBondContact O-CG 3.45Å; L2088-R2092 PolarHBondContact O-N 3.05Å; L2088-F2249 HydrophobicContact CD1-CE1 4.26Å; L2088-F2249 HydrophobicContact CD1-CZ 4.08Å; L2088-T2253 HydrophobicContact CD1-CG2 4.24Å; L2088-I2333 HydrophobicContact CD1-CG2 3.7Å; L2088-I2333 HydrophobicContact CD2-CG2 4.46Å; L2088-L2336 HydrophobicContact CD1-CD2 3.71Å; L2088-L2336 HydrophobicContact CD2-CB 3.92Å; L2088-L2336 HydrophobicContact CD2-CD2 4.07Å; L2088-L2336 HydrophobicContact CG-CD2 4.35Å; L2088-P2338 HydrophobicContact CD2-CB 4.45Å; L2088-P2338 HydrophobicContact CD2-CG 4.32Å; L2088-L2341 HydrophobicContact CD1-CD1 4.35Å; L2088-L2341 HydrophobicContact CD2-CB 4.44Å; L2088-L2341 HydrophobicContact CD2-CD2 3.21Å; L2088-L2341 HydrophobicContact CD2-CG 3.55Å; L2088-M2342 HydrophobicContact CD1-SD 3.69Å; L2088-I2345 HydrophobicContact CD1-CD1 3.66Å; L2088-I2345 HydrophobicContact CD2-CD1 4.36Å
2089	F	78.9	Confident	77	Confident	25.6 Å²	25.6	43.7 Å²	43.7	11%	0.112	21%	0.207	C	C	.	.	H	α-helix	trans	-63.6	-44.1	173.9	-166.9	-95	0	0	0	111.5	L1872 T2007 L2077 Q2080 Y2081 R2086 L2091 R2092 K2093	L1872-F2089 HydrophobicContact CD1-CD2 4.44Å; L1872-F2089 HydrophobicContact CD1-CE2 3.88Å; L1872-F2089 HydrophobicContact CD1-CZ 4.22Å; L1872-F2089 HydrophobicContact CD2-CE2 4.42Å; L1872-F2089 HydrophobicContact CD2-CZ 4.16Å; L1872-F2089 HydrophobicContact CG-CE2 3.95Å; L1872-F2089 HydrophobicContact CG-CZ 4.13Å; T2007-F2089 HydrophobicContact CG2-CE1 4.34Å; T2007-F2089 HydrophobicContact CG2-CZ 4.04Å; L2077-F2089 HydrophobicContact CD2-CE2 4.32Å; L2077-F2089 HydrophobicContact CD2-CZ 4.5Å; Q2080-F2089 HydrophobicContact CB-CD2 4.4Å; Q2080-F2089 HydrophobicContact CB-CE2 4.47Å; Q2080-F2089 HydrophobicContact CB-CZ 3.79Å; Q2080-F2089 VanDerWaalsContact O-CE2 3.3Å; Q2080-F2089 WeakPolarHBondContact O-CE2 3.42Å; Q2080-F2089 WeakPolarHBondContact O-CZ 3.47Å; Y2081-F2089 HydrophobicContact CD1-CE1 4.5Å; Y2081-F2089 HydrophobicContact CD2-CD1 4.32Å; Y2081-F2089 HydrophobicContact CD2-CE1 4.3Å; Y2081-F2089 HydrophobicContact CE1-CD1 4.44Å; Y2081-F2089 AromaticContact CE1-CE1 3.81Å; Y2081-F2089 HydrophobicContact CE1-CE1 3.99Å; Y2081-F2089 HydrophobicContact CE1-CZ 4.37Å; Y2081-F2089 HydrophobicContact CE2-CE1 4.08Å; Y2081-F2089 HydrophobicContact CE2-CE2 4.22Å; Y2081-F2089 AromaticContact CE2-CZ 3.68Å; Y2081-F2089 HydrophobicContact CE2-CZ 3.68Å; Y2081-F2089 AromaticContact CZ-CE1 3.49Å; Y2081-F2089 VanDerWaalsContact CZ-CE1 3.44Å; Y2081-F2089 AromaticContact CZ-CZ 3.56Å; Y2081-F2089 VanDerWaalsContact CZ-CZ 3.47Å; Y2081-F2089 WeakPolarHBondContact OH-CE1 3.43Å; Y2081-F2089 VanDerWaalsContact OH-CZ 3.23Å; Y2081-F2089 WeakPolarHBondContact OH-CZ 3.36Å; R2086-F2089 WeakPolarHBondContact O-CB 3.31Å; R2086-F2089 PolarHBondContact O-N 3.05Å; R2086-F2089 VanDerWaalsContact O-N 3.11Å; F2089-L2091 VanDerWaalsContact C-N 3.32Å; F2089-L2091 PolarHBondContact O-N 3.05Å; F2089-R2092 WeakPolarHBondContact O-CB 3.39Å; F2089-R2092 PolarHBondContact O-N 2.97Å; F2089-K2093 WeakPolarHBondContact O-CB 3.38Å; F2089-K2093 PolarHBondContact O-N 3.3Å
2090	W	82.5	Confident	76.2	Confident	88.6 Å²	88.6	44.3 Å²	44.3	34%	0.336	21%	0.209	S	C	.	.	H	α-helix	trans	-61.3	-41.5	174	173.4	79.7	0	0	0	112.2	R2086 R2087 R2092 K2093 L2094 F2118 F2256	R2086-W2090 WeakPolarHBondContact O-CB 3.33Å; R2086-W2090 PolarHBondContact O-N 3.08Å; R2087-W2090 PolarHBondContact O-N 2.95Å; W2090-R2092 VanDerWaalsContact C-N 3.32Å; W2090-R2092 PolarHBondContact O-N 3.06Å; W2090-K2093 PolarHBondContact O-N 3.08Å; W2090-L2094 HydrophobicContact CH2-CD2 3.67Å; W2090-L2094 HydrophobicContact CZ2-CD2 3.63Å; W2090-L2094 HydrophobicContact CZ3-CD2 4.29Å; W2090-L2094 VanDerWaalsContact O-CB 3.26Å; W2090-L2094 WeakPolarHBondContact O-CB 3.3Å; W2090-L2094 PolarHBondContact O-N 3.23Å; W2090-F2118 AromaticContact CH2-CD1 3.93Å; W2090-F2118 HydrophobicContact CH2-CD1 4.06Å; W2090-F2118 HydrophobicContact CZ3-CD1 4.36Å; W2090-F2256 HydrophobicContact CE3-CE2 4.38Å; W2090-F2256 HydrophobicContact CE3-CZ 4.45Å; W2090-F2256 HydrophobicContact CH2-CD2 4.37Å; W2090-F2256 AromaticContact CH2-CE2 3.86Å; W2090-F2256 HydrophobicContact CH2-CE2 3.91Å; W2090-F2256 HydrophobicContact CH2-CZ 4.42Å; W2090-F2256 AromaticContact CZ3-CD2 3.85Å; W2090-F2256 HydrophobicContact CZ3-CD2 3.85Å; W2090-F2256 HydrophobicContact CZ3-CE1 4.42Å; W2090-F2256 AromaticContact CZ3-CE2 3.4Å; W2090-F2256 HydrophobicContact CZ3-CE2 3.4Å; W2090-F2256 VanDerWaalsContact CZ3-CE2 3.44Å; W2090-F2256 AromaticContact CZ3-CZ 3.74Å; W2090-F2256 HydrophobicContact CZ3-CZ 3.81Å
2091	L	83.7	Confident	75.2	Confident	1.8 Å²	1.8	46.2 Å²	46.2	1%	0.009	23%	0.228	C	C	.	.	H	α-helix	trans	-64.3	-41.5	174.9	-75	169.4	0	0	0	112.3	R2087 L2088 F2089 L2094 Y2095 F2118 F2249 F2252 T2253 F2256 L2341 M2342	R2087-L2091 WeakPolarHBondContact O-CB 3.38Å; R2087-L2091 VanDerWaalsContact O-CG 3.27Å; R2087-L2091 WeakPolarHBondContact O-CG 3.32Å; R2087-L2091 PolarHBondContact O-N 3.27Å; L2088-L2091 PolarHBondContact O-N 3.05Å; F2089-L2091 VanDerWaalsContact C-N 3.32Å; F2089-L2091 PolarHBondContact O-N 3.05Å; L2091-L2094 PolarHBondContact O-N 3.16Å; L2091-Y2095 VanDerWaalsContact O-CB 3.24Å; L2091-Y2095 WeakPolarHBondContact O-CB 3.35Å; L2091-Y2095 PolarHBondContact O-N 3.23Å; L2091-F2118 HydrophobicContact CD2-CD1 4.41Å; L2091-F2118 HydrophobicContact CD2-CE1 3.81Å; L2091-F2118 HydrophobicContact CD2-CZ 4.36Å; L2091-F2249 HydrophobicContact CB-CE2 4.37Å; L2091-F2249 HydrophobicContact CB-CZ 4.45Å; L2091-F2252 HydrophobicContact CB-CE1 4.44Å; L2091-F2252 HydrophobicContact CD2-CD1 4.28Å; L2091-F2252 HydrophobicContact CD2-CE1 3.84Å; L2091-T2253 HydrophobicContact CB-CG2 4.22Å; L2091-T2253 HydrophobicContact CD1-CG2 4.05Å; L2091-F2256 HydrophobicContact CD1-CB 4.26Å; L2091-F2256 HydrophobicContact CD1-CD1 3.58Å; L2091-F2256 HydrophobicContact CD1-CE1 4.13Å; L2091-F2256 HydrophobicContact CD1-CG 4.04Å; L2091-F2256 HydrophobicContact CD2-CB 3.7Å; L2091-F2256 HydrophobicContact CD2-CD1 3.94Å; L2091-F2256 HydrophobicContact CD2-CD2 3.89Å; L2091-F2256 HydrophobicContact CD2-CE1 4.43Å; L2091-F2256 HydrophobicContact CD2-CE2 4.45Å; L2091-F2256 HydrophobicContact CD2-CG 3.56Å; L2091-F2256 VanDerWaalsContact CD2-CG 3.46Å; L2091-F2256 HydrophobicContact CG-CD1 4.19Å; L2091-F2256 HydrophobicContact CG-CE1 4.46Å; L2091-F2256 HydrophobicContact CG-CG 4.31Å; L2091-L2341 HydrophobicContact CD1-CD1 4.23Å; L2091-L2341 HydrophobicContact CD1-CD2 4.1Å; L2091-M2342 HydrophobicContact CD1-CE 4.26Å
2092	R	79.7	Confident	73.8	Confident	23.2 Å²	23.2	47.2 Å²	47.2	9%	0.088	24%	0.239	C	C	.	.	H	α-helix	trans	-60.3	-49.2	174.4	-112.1	-179.9	177.6	152	1	110.6	T1871 L1872 M1873 L2088 F2089 W2090 L2094 Y2095 L2096 F2249 I2333 D2334	T1871-R2092 WeakPolarHBondContact O-CD 3.35Å; T1871-R2092 PolarHBondContact O-NE 3.41Å; T1871-R2092 PolarHBondContact O-NH2 3.49Å; T1871-R2092 PolarHBondContact OG1-NH2 3.37Å; L1872-R2092 HydrophobicContact CD1-CB 4.4Å; L1872-R2092 VanDerWaalsContact O-CD 3.23Å; L1872-R2092 WeakPolarHBondContact O-CD 3.36Å; L1872-R2092 PolarHBondContact O-NE 2.7Å; M1873-R2092 PolarHBondContact O-NH2 3.05Å; L2088-R2092 WeakPolarHBondContact O-CB 3.42Å; L2088-R2092 WeakPolarHBondContact O-CG 3.45Å; L2088-R2092 PolarHBondContact O-N 3.05Å; F2089-R2092 WeakPolarHBondContact O-CB 3.39Å; F2089-R2092 PolarHBondContact O-N 2.97Å; W2090-R2092 VanDerWaalsContact C-N 3.32Å; W2090-R2092 PolarHBondContact O-N 3.06Å; R2092-L2094 PolarHBondContact O-N 2.98Å; R2092-Y2095 PolarHBondContact O-N 3.05Å; R2092-L2096 HydrophobicContact CG-CD1 4.24Å; R2092-L2096 WeakPolarHBondContact O-CB 3.36Å; R2092-L2096 VanDerWaalsContact O-CG 3.25Å; R2092-L2096 WeakPolarHBondContact O-CG 3.34Å; R2092-L2096 PolarHBondContact O-N 3.17Å; R2092-L2096 VanDerWaalsContact O-N 3.12Å; R2092-F2249 HydrophobicContact CB-CE2 4.4Å; R2092-F2249 HydrophobicContact CB-CZ 4.26Å; R2092-F2249 HydrophobicContact CG-CE1 3.95Å; R2092-F2249 HydrophobicContact CG-CE2 3.97Å; R2092-F2249 HydrophobicContact CG-CZ 3.36Å; R2092-F2249 VanDerWaalsContact CG-CZ 3.44Å; R2092-I2333 PolarHBondContact NH2-O 3.08Å; R2092-D2334 IonicContact CZ-OD1 2.66Å; R2092-D2334 IonicContact NE-OD1 2.81Å; R2092-D2334 IonicContact NH2-OD1 2.91Å; R2092-D2334 PolarHBondContact NH2-OD1 3.14Å
2093	K	79	Confident	72.4	Confident	68 Å²	68	51.1 Å²	51.1	30%	0.296	25%	0.248	S	C	.	.	H	α-helix	trans	-58.1	-52.7	176	-176.4	175.8	177.8	179.1	0	111	L1872 T2007 F2089 W2090 Y2095 L2096 D2097	L1872-K2093 HydrophobicContact CD1-CB 3.99Å; T2007-K2093 HydrophobicContact CG2-CD 4.27Å; T2007-K2093 PolarHBondContact OG1-NZ 2.92Å; F2089-K2093 WeakPolarHBondContact O-CB 3.38Å; F2089-K2093 PolarHBondContact O-N 3.3Å; W2090-K2093 PolarHBondContact O-N 3.08Å; K2093-Y2095 VanDerWaalsContact C-N 3.33Å; K2093-Y2095 PolarHBondContact O-N 2.99Å; K2093-Y2095 VanDerWaalsContact O-N 3.15Å; K2093-L2096 CarbonylContact O-C 3.57Å; K2093-L2096 WeakPolarHBondContact O-CA 3.42Å; K2093-L2096 WeakPolarHBondContact O-CB 3.43Å; K2093-L2096 PolarHBondContact O-N 3.17Å; K2093-L2096 VanDerWaalsContact O-N 3.12Å; K2093-D2097 VanDerWaalsContact CE-OD2 3.27Å; K2093-D2097 WeakPolarHBondContact CE-OD2 3.27Å; K2093-D2097 WeakPolarHBondContact CG-OD1 2.96Å; K2093-D2097 WeakPolarHBondContact CG-OD2 3.35Å; K2093-D2097 VanDerWaalsContact O-CB 3.31Å; K2093-D2097 WeakPolarHBondContact O-CB 3.39Å; K2093-D2097 VanDerWaalsContact O-CG 3.26Å; K2093-D2097 PolarHBondContact O-N 3.08Å
2094	L	81.7	Confident	71.2	Confident	24.2 Å²	24.2	55 Å²	55	13%	0.127	27%	0.271	C	S	.	.	H	α-helix	trans	-60.9	-39.3	-179	-172.7	64.2	0	0	0	112.5	W2090 L2091 R2092 L2096 D2097 L2098 A2117 F2118 F2252	W2090-L2094 HydrophobicContact CH2-CD2 3.67Å; W2090-L2094 HydrophobicContact CZ2-CD2 3.63Å; W2090-L2094 HydrophobicContact CZ3-CD2 4.29Å; W2090-L2094 VanDerWaalsContact O-CB 3.26Å; W2090-L2094 WeakPolarHBondContact O-CB 3.3Å; W2090-L2094 PolarHBondContact O-N 3.23Å; L2091-L2094 PolarHBondContact O-N 3.16Å; R2092-L2094 PolarHBondContact O-N 2.98Å; L2094-L2096 VanDerWaalsContact C-N 3.32Å; L2094-L2096 PolarHBondContact O-N 3.35Å; L2094-D2097 PolarHBondContact O-N 3.24Å; L2094-L2098 HydrophobicContact CD1-CD1 4.33Å; L2094-L2098 HydrophobicContact CD1-CG 4.37Å; L2094-L2098 HydrophobicContact CG-CD1 4.11Å; L2094-L2098 WeakPolarHBondContact O-CB 3.36Å; L2094-L2098 WeakPolarHBondContact O-CD1 3.49Å; L2094-L2098 VanDerWaalsContact O-CG 3.22Å; L2094-L2098 WeakPolarHBondContact O-CG 3.42Å; L2094-L2098 PolarHBondContact O-N 3.11Å; L2094-L2098 VanDerWaalsContact O-N 3.1Å; L2094-A2117 HydrophobicContact CD1-CB 4.19Å; L2094-A2117 HydrophobicContact CD2-CB 4.1Å; L2094-A2117 HydrophobicContact CG-CB 4.36Å; L2094-F2118 HydrophobicContact CD2-CD1 3.75Å; L2094-F2118 HydrophobicContact CD2-CE1 3.87Å; L2094-F2252 HydrophobicContact CB-CZ 4.45Å; L2094-F2252 HydrophobicContact CD2-CZ 4.17Å; L2094-F2252 HydrophobicContact CG-CZ 4.16Å
2095	Y	81.6	Confident	70.1	Confident	18 Å²	18	59.1 Å²	59.1	7%	0.071	29%	0.288	C	S	.	.	H	α-helix	trans	-62.8	-43.8	174.9	-178.7	-96.1	0	0	0	111.7	P1870 L2091 R2092 K2093 D2097 L2098 L2099 A2108 L2247 F2249 F2252	P1870-Y2095 HydrophobicContact CB-CE1 4.46Å; P1870-Y2095 VanDerWaalsContact CD-CE1 3.47Å; P1870-Y2095 HydrophobicContact CG-CD1 3.66Å; P1870-Y2095 VanDerWaalsContact CG-CD1 3.47Å; P1870-Y2095 HydrophobicContact CG-CE1 3.72Å; P1870-Y2095 VanDerWaalsContact CG-CE1 3.42Å; P1870-Y2095 HydrophobicContact CG-CG 4.48Å; L2091-Y2095 VanDerWaalsContact O-CB 3.24Å; L2091-Y2095 WeakPolarHBondContact O-CB 3.35Å; L2091-Y2095 PolarHBondContact O-N 3.23Å; R2092-Y2095 PolarHBondContact O-N 3.05Å; K2093-Y2095 VanDerWaalsContact C-N 3.33Å; K2093-Y2095 PolarHBondContact O-N 2.99Å; K2093-Y2095 VanDerWaalsContact O-N 3.15Å; Y2095-D2097 VanDerWaalsContact C-N 3.29Å; Y2095-D2097 PolarHBondContact O-N 3Å; Y2095-L2098 PolarHBondContact O-N 3.1Å; Y2095-L2098 VanDerWaalsContact O-N 3.16Å; Y2095-L2099 HydrophobicContact CD1-CD1 4.06Å; Y2095-L2099 HydrophobicContact CD1-CD2 4.45Å; Y2095-L2099 HydrophobicContact CD1-CG 4.3Å; Y2095-L2099 HydrophobicContact CE1-CD1 3.85Å; Y2095-L2099 HydrophobicContact CE1-CD2 3.94Å; Y2095-L2099 HydrophobicContact CE1-CG 4.15Å; Y2095-L2099 WeakPolarHBondContact O-CG 3.3Å; Y2095-L2099 PolarHBondContact O-N 2.93Å; Y2095-L2099 VanDerWaalsContact O-N 3.13Å; Y2095-A2108 HydrophobicContact CE2-CB 4.09Å; Y2095-A2108 VanDerWaalsContact OH-CB 3.24Å; Y2095-A2108 WeakPolarHBondContact OH-CB 3.27Å; Y2095-L2247 WeakPolarHBondContact CE2-O 3.43Å; Y2095-L2247 PolarHBondContact OH-O 3.1Å; Y2095-F2249 HydrophobicContact CD1-CB 4.33Å; Y2095-F2249 AromaticContact CD1-CD2 3.88Å; Y2095-F2249 HydrophobicContact CD1-CD2 3.96Å; Y2095-F2249 HydrophobicContact CD1-CG 4.39Å; Y2095-F2249 HydrophobicContact CD2-CB 4.44Å; Y2095-F2249 AromaticContact CD2-CD2 3.95Å; Y2095-F2249 HydrophobicContact CD2-CD2 4.01Å; Y2095-F2249 HydrophobicContact CE1-CB 4.26Å; Y2095-F2249 HydrophobicContact CE1-CD2 4.33Å; Y2095-F2249 HydrophobicContact CE2-CB 4.29Å; Y2095-F2249 HydrophobicContact CE2-CD2 4.49Å; Y2095-F2249 AromaticContact CG-CD2 3.64Å; Y2095-F2249 HydrophobicContact CG-CD2 3.64Å; Y2095-F2249 HydrophobicContact CG-CE2 4.37Å; Y2095-F2249 PolarHBondContact OH-N 3.06Å; Y2095-F2252 HydrophobicContact CD2-CB 3.8Å; Y2095-F2252 AromaticContact CD2-CD1 3.88Å; Y2095-F2252 HydrophobicContact CD2-CD1 3.88Å; Y2095-F2252 AromaticContact CD2-CD2 3.83Å; Y2095-F2252 HydrophobicContact CD2-CD2 3.83Å; Y2095-F2252 HydrophobicContact CD2-CE1 4.35Å; Y2095-F2252 HydrophobicContact CD2-CE2 4.31Å; Y2095-F2252 AromaticContact CD2-CG 3.58Å; Y2095-F2252 HydrophobicContact CD2-CG 3.58Å; Y2095-F2252 HydrophobicContact CD2-CZ 4.45Å; Y2095-F2252 HydrophobicContact CE2-CB 4.08Å; Y2095-F2252 HydrophobicContact CE2-CD2 4.44Å; Y2095-F2252 HydrophobicContact CE2-CG 4.3Å; Y2095-F2252 HydrophobicContact CG-CD1 4.4Å; Y2095-F2252 HydrophobicContact CG-CG 4.39Å
2096	L	76.3	Confident	69	Low	15.6 Å²	15.6	61.6 Å²	61.6	8%	0.082	30%	0.302	C	S	.	.	H	α-helix	trans	-65.2	-38.8	175.9	-69.1	174.3	0	0	0	112.3	P1870 L1872 T1912 L1990 R2092 K2093 L2094 L2098 L2099	P1870-L2096 HydrophobicContact CB-CD2 3.93Å; P1870-L2096 HydrophobicContact CG-CD2 4.14Å; P1870-L2096 WeakPolarHBondContact O-CD2 3.39Å; L1872-L2096 HydrophobicContact CB-CD1 3.89Å; L1872-L2096 HydrophobicContact CD1-CD1 4.13Å; L1872-L2096 HydrophobicContact CG-CD1 4.43Å; T1912-L2096 HydrophobicContact CG2-CD2 3.81Å; L1990-L2096 HydrophobicContact CD1-CB 4.36Å; L1990-L2096 HydrophobicContact CD2-CD1 3.83Å; R2092-L2096 HydrophobicContact CG-CD1 4.24Å; R2092-L2096 WeakPolarHBondContact O-CB 3.36Å; R2092-L2096 VanDerWaalsContact O-CG 3.25Å; R2092-L2096 WeakPolarHBondContact O-CG 3.34Å; R2092-L2096 PolarHBondContact O-N 3.17Å; R2092-L2096 VanDerWaalsContact O-N 3.12Å; K2093-L2096 CarbonylContact O-C 3.57Å; K2093-L2096 WeakPolarHBondContact O-CA 3.42Å; K2093-L2096 WeakPolarHBondContact O-CB 3.43Å; K2093-L2096 PolarHBondContact O-N 3.17Å; K2093-L2096 VanDerWaalsContact O-N 3.12Å; L2094-L2096 VanDerWaalsContact C-N 3.32Å; L2094-L2096 PolarHBondContact O-N 3.35Å; L2096-L2098 VanDerWaalsContact C-N 3.32Å; L2096-L2098 PolarHBondContact O-N 2.95Å; L2096-L2099 HydrophobicContact CD2-CD1 3.78Å; L2096-L2099 WeakPolarHBondContact O-CB 3.39Å; L2096-L2099 PolarHBondContact O-N 3.14Å; L2096-L2099 VanDerWaalsContact O-N 3.16Å
2097	D	74.8	Confident	68	Low	62.2 Å²	62.2	58.8 Å²	58.8	33%	0.333	30%	0.297	S	S	.	.	H	α-helix	trans	-66.7	-28.3	177.6	-66.6	-8.7	0	0	0	112	L1990 K2093 L2094 Y2095	L1990-D2097 VanDerWaalsContact CD1-CA 3.49Å; L1990-D2097 HydrophobicContact CD1-CB 3.88Å; L1990-D2097 WeakPolarHBondContact CD1-O 3.44Å; L1990-D2097 HydrophobicContact CD2-CB 3.79Å; L1990-D2097 VanDerWaalsContact CD2-CB 3.43Å; L1990-D2097 WeakPolarHBondContact CD2-O 3.47Å; L1990-D2097 WeakPolarHBondContact CD2-OD1 3.23Å; L1990-D2097 HydrophobicContact CG-CB 4.43Å; K2093-D2097 VanDerWaalsContact CE-OD2 3.27Å; K2093-D2097 WeakPolarHBondContact CE-OD2 3.27Å; K2093-D2097 WeakPolarHBondContact CG-OD1 2.96Å; K2093-D2097 WeakPolarHBondContact CG-OD2 3.35Å; K2093-D2097 VanDerWaalsContact O-CB 3.31Å; K2093-D2097 WeakPolarHBondContact O-CB 3.39Å; K2093-D2097 VanDerWaalsContact O-CG 3.26Å; K2093-D2097 PolarHBondContact O-N 3.08Å; L2094-D2097 PolarHBondContact O-N 3.24Å; Y2095-D2097 VanDerWaalsContact C-N 3.29Å; Y2095-D2097 PolarHBondContact O-N 3Å
2098	L	76.3	Confident	67.2	Low	43.4 Å²	43.4	57.1 Å²	57.1	23%	0.227	29%	0.293	C	S	.	.	H	α-helix	trans	-90.7	-7.4	178	-67.3	171.5	0	0	0	114.3	L2094 Y2095 L2096 S2100 A2109 T2113 A2117 F2252	L2094-L2098 HydrophobicContact CD1-CD1 4.33Å; L2094-L2098 HydrophobicContact CD1-CG 4.37Å; L2094-L2098 HydrophobicContact CG-CD1 4.11Å; L2094-L2098 WeakPolarHBondContact O-CB 3.36Å; L2094-L2098 WeakPolarHBondContact O-CD1 3.49Å; L2094-L2098 VanDerWaalsContact O-CG 3.22Å; L2094-L2098 WeakPolarHBondContact O-CG 3.42Å; L2094-L2098 PolarHBondContact O-N 3.11Å; L2094-L2098 VanDerWaalsContact O-N 3.1Å; Y2095-L2098 PolarHBondContact O-N 3.1Å; Y2095-L2098 VanDerWaalsContact O-N 3.16Å; L2096-L2098 VanDerWaalsContact C-N 3.32Å; L2096-L2098 PolarHBondContact O-N 2.95Å; L2098-S2100 PolarHBondContact O-N 3.24Å; L2098-S2100 VanDerWaalsContact O-N 3.13Å; L2098-A2109 HydrophobicContact CB-CB 4.03Å; L2098-A2109 HydrophobicContact CD1-CB 4.09Å; L2098-T2113 HydrophobicContact CD2-CG2 4.07Å; L2098-A2117 HydrophobicContact CD1-CB 3.59Å; L2098-A2117 HydrophobicContact CD2-CB 4.08Å; L2098-A2117 HydrophobicContact CG-CB 4.34Å; L2098-F2252 HydrophobicContact CD1-CE2 3.82Å; L2098-F2252 HydrophobicContact CD1-CZ 3.95Å
2099	L	72.1	Confident	67	Low	19.2 Å²	19.2	56.9 Å²	56.9	10%	0.101	29%	0.293	C	S	.	.			trans	-68.5	110.5	176.2	-83.7	165.2	0	0	0	109.4	P1870 Y2095 L2096 L2106 A2108	P1870-L2099 HydrophobicContact CG-CD1 4.08Å; Y2095-L2099 HydrophobicContact CD1-CD1 4.06Å; Y2095-L2099 HydrophobicContact CD1-CD2 4.45Å; Y2095-L2099 HydrophobicContact CD1-CG 4.3Å; Y2095-L2099 HydrophobicContact CE1-CD1 3.85Å; Y2095-L2099 HydrophobicContact CE1-CD2 3.94Å; Y2095-L2099 HydrophobicContact CE1-CG 4.15Å; Y2095-L2099 WeakPolarHBondContact O-CG 3.3Å; Y2095-L2099 PolarHBondContact O-N 2.93Å; Y2095-L2099 VanDerWaalsContact O-N 3.13Å; L2096-L2099 HydrophobicContact CD2-CD1 3.78Å; L2096-L2099 WeakPolarHBondContact O-CB 3.39Å; L2096-L2099 PolarHBondContact O-N 3.14Å; L2096-L2099 VanDerWaalsContact O-N 3.16Å; L2099-L2106 HydrophobicContact CB-CD2 4.18Å; L2099-L2106 HydrophobicContact CD2-CB 4.16Å; L2099-L2106 HydrophobicContact CD2-CD2 4.38Å; L2099-A2108 HydrophobicContact CD2-CB 3.99Å; L2099-A2108 HydrophobicContact CG-CB 4.49Å
2100	S	61.3	Low	67.2	Low	50 Å²	50	57.7 Å²	57.7	35%	0.35	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	135.3	175.1	62.7	0	0	0	0	110.6	L2098 D2102 L2106 V2107	L2098-S2100 PolarHBondContact O-N 3.24Å; L2098-S2100 VanDerWaalsContact O-N 3.13Å; S2100-D2102 VanDerWaalsContact C-N 3.33Å; S2100-D2102 PolarHBondContact O-N 3.01Å; S2100-L2106 CarbonylContact O-C 3.45Å; S2100-L2106 VanDerWaalsContact O-CA 3.3Å; S2100-L2106 WeakPolarHBondContact O-CA 3.47Å; S2100-V2107 PolarHBondContact N-O 3.14Å; S2100-V2107 VanDerWaalsContact N-O 3.12Å; S2100-V2107 PolarHBondContact O-N 3.32Å; S2100-V2107 VanDerWaalsContact O-N 3.13Å; S2100-V2107 WeakPolarHBondContact OG-CB 3.38Å; S2100-V2107 PolarHBondContact OG-O 2.98Å
2101	A	52.3	Low	67.4	Low	53.2 Å²	53.2	53.6 Å²	53.6	44%	0.44	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	91.7	170.1	0	0	0	0	0	108.7	F1983 L2106	F1983-A2101 HydrophobicContact CB-CB 4.35Å; F1983-A2101 HydrophobicContact CD2-CB 3.71Å; F1983-A2101 HydrophobicContact CE1-CB 3.66Å; F1983-A2101 HydrophobicContact CE2-CB 4.25Å; F1983-A2101 HydrophobicContact CG-CB 4.25Å; F1983-A2101 HydrophobicContact CZ-CB 4.2Å; A2101-L2106 HydrophobicContact CB-CD2 4.26Å
2102	D	45.7	Very low	67.4	Low	106.8 Å²	106.8	54.6 Å²	54.6	57%	0.571	29%	0.29	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.1	139.4	166.3	-148.2	-7.7	0	0	0	108.7	S2100 N2104 F2105 V2107	S2100-D2102 VanDerWaalsContact C-N 3.33Å; S2100-D2102 PolarHBondContact O-N 3.01Å; D2102-N2104 PolarHBondContact O-N 2.92Å; D2102-F2105 PolarHBondContact N-O 3.22Å; D2102-F2105 VanDerWaalsContact N-O 3.16Å; D2102-F2105 PolarHBondContact O-N 2.94Å; D2102-F2105 VanDerWaalsContact O-O 3.05Å; D2102-V2107 HydrophobicContact CB-CG2 3.97Å
2103	Q	41.7	Very low	67.6	Low	167.4 Å²	167.4	56.2 Å²	56.2	78%	0.782	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-21.1	48.8	-165.4	-67.7	-165.7	25.6	0	0	117.1	F2105	Q2103-F2105 PolarHBondContact O-N 3.21Å
2104	N	44.4	Very low	68	Low	139.2 Å²	139.2	52.9 Å²	52.9	74%	0.744	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	114.8	-1.6	173.4	-67.4	-28	0	0	0	117.1	S1974 D2102	S1974-N2104 PolarHBondContact OG-OD1 2.73Å; D2102-N2104 PolarHBondContact O-N 2.92Å
2105	F	45.3	Very low	68.3	Low	146.4 Å²	146.4	52 Å²	52	64%	0.642	28%	0.284	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.8	138.4	179.3	-64.1	-80.4	0	0	0	111.9	D2102 Q2103 V2107	D2102-F2105 PolarHBondContact N-O 3.22Å; D2102-F2105 VanDerWaalsContact N-O 3.16Å; D2102-F2105 PolarHBondContact O-N 2.94Å; D2102-F2105 VanDerWaalsContact O-O 3.05Å; Q2103-F2105 PolarHBondContact O-N 3.21Å; F2105-V2107 VanDerWaalsContact C-N 3.35Å; F2105-V2107 HydrophobicContact CB-CG2 4.44Å; F2105-V2107 PolarHBondContact O-N 3.13Å
2106	L	52.1	Low	68.5	Low	67.8 Å²	67.8	56.4 Å²	56.4	36%	0.355	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	103.8	167.8	-72.3	173.8	0	0	0	108.5	F1983 L2099 S2100 A2101 A2108	F1983-L2106 HydrophobicContact CE2-CD1 4.01Å; F1983-L2106 HydrophobicContact CE2-CD2 3.52Å; F1983-L2106 HydrophobicContact CE2-CG 3.89Å; F1983-L2106 HydrophobicContact CZ-CD2 3.32Å; F1983-L2106 HydrophobicContact CZ-CG 4.14Å; L2099-L2106 HydrophobicContact CB-CD2 4.18Å; L2099-L2106 HydrophobicContact CD2-CB 4.16Å; L2099-L2106 HydrophobicContact CD2-CD2 4.38Å; S2100-L2106 CarbonylContact O-C 3.45Å; S2100-L2106 VanDerWaalsContact O-CA 3.3Å; S2100-L2106 WeakPolarHBondContact O-CA 3.47Å; A2101-L2106 HydrophobicContact CB-CD2 4.26Å; L2106-A2108 PolarHBondContact O-N 3.09Å
2107	V	57.5	Low	68.9	Low	56.2 Å²	56.2	57.4 Å²	57.4	34%	0.341	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	112.9	176	-176.7	0	0	0	0	107.8	S2100 D2102 F2105 P2246	S2100-V2107 PolarHBondContact N-O 3.14Å; S2100-V2107 VanDerWaalsContact N-O 3.12Å; S2100-V2107 PolarHBondContact O-N 3.32Å; S2100-V2107 VanDerWaalsContact O-N 3.13Å; S2100-V2107 WeakPolarHBondContact OG-CB 3.38Å; S2100-V2107 PolarHBondContact OG-O 2.98Å; D2102-V2107 HydrophobicContact CB-CG2 3.97Å; F2105-V2107 VanDerWaalsContact C-N 3.35Å; F2105-V2107 HydrophobicContact CB-CG2 4.44Å; F2105-V2107 PolarHBondContact O-N 3.13Å; V2107-P2246 HydrophobicContact CG1-CB 4.24Å; V2107-P2246 HydrophobicContact CG1-CG 4.49Å
2108	A	65.7	Low	69.5	Low	12.4 Å²	12.4	55 Å²	55	10%	0.102	30%	0.302	C	S	.	.	P	Polyproline II helix	trans	-71.5	157.9	176	0	0	0	0	0	111.8	Y2095 L2099 L2106 N2110 P2246 L2247	Y2095-A2108 HydrophobicContact CE2-CB 4.09Å; Y2095-A2108 VanDerWaalsContact OH-CB 3.24Å; Y2095-A2108 WeakPolarHBondContact OH-CB 3.27Å; L2099-A2108 HydrophobicContact CD2-CB 3.99Å; L2099-A2108 HydrophobicContact CG-CB 4.49Å; L2106-A2108 PolarHBondContact O-N 3.09Å; A2108-N2110 PolarHBondContact O-N 3.08Å; A2108-P2246 HydrophobicContact CB-CB 4.11Å; A2108-P2246 WeakPolarHBondContact O-CA 3.43Å; A2108-P2246 VanDerWaalsContact O-CB 3.27Å; A2108-P2246 WeakPolarHBondContact O-CB 3.24Å; A2108-L2247 WeakPolarHBondContact CB-O 3.39Å
2109	A	74.3	Confident	69.9	Low	6.4 Å²	6.4	55.1 Å²	55.1	5%	0.053	31%	0.314	C	S	.	.	P	Polyproline II helix	trans	-57.5	133.1	-177.1	0	0	0	0	0	111.8	L2098 T2113 A2114 L2247 F2252	L2098-A2109 HydrophobicContact CB-CB 4.03Å; L2098-A2109 HydrophobicContact CD1-CB 4.09Å; A2109-T2113 HydrophobicContact CB-CG2 4.35Å; A2109-A2114 HydrophobicContact CB-CB 4.33Å; A2109-L2247 VanDerWaalsContact O-CB 3.31Å; A2109-L2247 WeakPolarHBondContact O-CB 3.33Å; A2109-L2247 WeakPolarHBondContact O-CG 3.35Å; A2109-L2247 PolarHBondContact O-N 3.24Å; A2109-F2252 HydrophobicContact CB-CE2 4.5Å
2110	N	83.4	Confident	70.3	Confident	42 Å²	42	54.7 Å²	54.7	23%	0.225	31%	0.314	C	S	.	.	P	Polyproline II helix	trans	-68.6	159.9	166.1	54.5	8	0	0	0	109.8	A2108 S2112 T2113 A2114 E2244	A2108-N2110 PolarHBondContact O-N 3.08Å; N2110-S2112 VanDerWaalsContact C-N 3.25Å; N2110-S2112 PolarHBondContact O-N 3.21Å; N2110-S2112 VanDerWaalsContact O-N 3.13Å; N2110-S2112 PolarHBondContact OD1-N 2.88Å; N2110-T2113 HydrophobicContact CB-CG2 4.47Å; N2110-T2113 PolarHBondContact N-OG1 2.93Å; N2110-T2113 VanDerWaalsContact N-OG1 3.11Å; N2110-T2113 PolarHBondContact O-N 3.36Å; N2110-T2113 VanDerWaalsContact O-N 3.14Å; N2110-T2113 PolarHBondContact O-OG1 3.35Å; N2110-T2113 VanDerWaalsContact OD1-CB 3.23Å; N2110-T2113 WeakPolarHBondContact OD1-CB 3.31Å; N2110-T2113 PolarHBondContact OD1-N 2.99Å; N2110-T2113 PolarHBondContact OD1-OG1 3.1Å; N2110-A2114 WeakPolarHBondContact O-CB 3.4Å; N2110-A2114 PolarHBondContact O-N 3.27Å; N2110-E2244 HydrophobicContact CB-CB 4.31Å; N2110-E2244 WeakPolarHBondContact CB-O 3.23Å; N2110-E2244 VanDerWaalsContact CB-OE2 3.32Å; N2110-E2244 WeakPolarHBondContact CB-OE2 3.45Å; N2110-E2244 PolarHBondContact ND2-OE2 3.4Å
2111	P	86.9	Confident	71.1	Confident	3.2 Å²	3.2	60.2 Å²	60.2	2%	0.021	33%	0.327	C	S	.	.	H	α-helix	trans	-54.6	-36.4	-179.3	-25.7	32.7	0	0	0	114.2	A2114 L2115 Q2243 E2244 N2245 L2247 L2255 Y2359 L2362	P2111-A2114 PolarHBondContact O-N 3.02Å; P2111-L2115 WeakPolarHBondContact O-CB 3.38Å; P2111-L2115 WeakPolarHBondContact O-CD1 3.44Å; P2111-L2115 VanDerWaalsContact O-CG 3.27Å; P2111-L2115 WeakPolarHBondContact O-CG 3.37Å; P2111-L2115 PolarHBondContact O-N 3.4Å; P2111-Q2243 WeakPolarHBondContact CD-O 3.43Å; P2111-Q2243 WeakPolarHBondContact CG-O 3.41Å; P2111-E2244 WeakPolarHBondContact CD-OE2 3.42Å; P2111-N2245 WeakPolarHBondContact CD-O 3.31Å; P2111-L2247 HydrophobicContact CB-CD1 4.39Å; P2111-L2247 HydrophobicContact CG-CD1 4.35Å; P2111-L2247 HydrophobicContact CG-CD2 4.04Å; P2111-L2247 HydrophobicContact CG-CG 4.19Å; P2111-L2255 HydrophobicContact CB-CD2 4.12Å; P2111-Y2359 HydrophobicContact CB-CE1 4.46Å; P2111-Y2359 HydrophobicContact CG-CD1 4.48Å; P2111-Y2359 HydrophobicContact CG-CE1 4Å; P2111-L2362 HydrophobicContact CB-CD1 3.92Å; P2111-L2362 HydrophobicContact CG-CD1 4.41Å
2112	S	82.9	Confident	71.6	Confident	21.8 Å²	21.8	59.2 Å²	59.2	15%	0.152	32%	0.32	C	S	.	.	H	α-helix	trans	-63.3	-48.7	178.3	-71.3	0	0	0	0	112.3	N2110 A2114 L2115 Q2116 W2124 E2244	N2110-S2112 VanDerWaalsContact C-N 3.25Å; N2110-S2112 PolarHBondContact O-N 3.21Å; N2110-S2112 VanDerWaalsContact O-N 3.13Å; N2110-S2112 PolarHBondContact OD1-N 2.88Å; S2112-A2114 VanDerWaalsContact C-N 3.33Å; S2112-A2114 PolarHBondContact O-N 3.11Å; S2112-L2115 PolarHBondContact O-N 3.27Å; S2112-Q2116 WeakPolarHBondContact O-CB 3.4Å; S2112-Q2116 PolarHBondContact O-N 3.17Å; S2112-Q2116 VanDerWaalsContact O-N 3.11Å; S2112-W2124 VanDerWaalsContact OG-CD1 3.28Å; S2112-W2124 PolarHBondContact OG-NE1 2.76Å; S2112-W2124 VanDerWaalsContact OG-NE1 3.13Å; S2112-E2244 PolarHBondContact N-OE2 3.39Å; S2112-E2244 PolarHBondContact OG-OE1 3.3Å; S2112-E2244 PolarHBondContact OG-OE2 3.41Å
2113	T	84.5	Confident	72.1	Confident	55.8 Å²	55.8	59.4 Å²	59.4	34%	0.342	32%	0.315	S	S	.	.	H	α-helix	trans	-67.6	-39.7	177.8	-45.6	0	0	0	0	111.5	L2098 A2109 N2110 Q2116 A2117	L2098-T2113 HydrophobicContact CD2-CG2 4.07Å; A2109-T2113 HydrophobicContact CB-CG2 4.35Å; N2110-T2113 HydrophobicContact CB-CG2 4.47Å; N2110-T2113 PolarHBondContact N-OG1 2.93Å; N2110-T2113 VanDerWaalsContact N-OG1 3.11Å; N2110-T2113 PolarHBondContact O-N 3.36Å; N2110-T2113 VanDerWaalsContact O-N 3.14Å; N2110-T2113 PolarHBondContact O-OG1 3.35Å; N2110-T2113 VanDerWaalsContact OD1-CB 3.23Å; N2110-T2113 WeakPolarHBondContact OD1-CB 3.31Å; N2110-T2113 PolarHBondContact OD1-N 2.99Å; N2110-T2113 PolarHBondContact OD1-OG1 3.1Å; T2113-Q2116 PolarHBondContact O-N 3.02Å; T2113-A2117 WeakPolarHBondContact O-CB 3.38Å; T2113-A2117 PolarHBondContact O-N 3.21Å
2114	A	87.6	Confident	72.6	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-60.8	-48.5	175.1	0	0	0	0	0	111.7	A2109 N2110 P2111 S2112 Q2116 A2117 F2118 L2247 F2252 L2255	A2109-A2114 HydrophobicContact CB-CB 4.33Å; N2110-A2114 WeakPolarHBondContact O-CB 3.4Å; N2110-A2114 PolarHBondContact O-N 3.27Å; P2111-A2114 PolarHBondContact O-N 3.02Å; S2112-A2114 VanDerWaalsContact C-N 3.33Å; S2112-A2114 PolarHBondContact O-N 3.11Å; A2114-Q2116 VanDerWaalsContact C-N 3.31Å; A2114-Q2116 PolarHBondContact O-N 3.09Å; A2114-A2117 WeakPolarHBondContact O-CB 3.42Å; A2114-A2117 PolarHBondContact O-N 2.9Å; A2114-A2117 VanDerWaalsContact O-N 3.15Å; A2114-F2118 HydrophobicContact CB-CE2 4.21Å; A2114-F2118 HydrophobicContact CB-CZ 4.24Å; A2114-F2118 WeakPolarHBondContact O-CD1 3.33Å; A2114-F2118 VanDerWaalsContact O-CD2 3.28Å; A2114-F2118 WeakPolarHBondContact O-CD2 3.38Å; A2114-F2118 WeakPolarHBondContact O-CG 3.4Å; A2114-F2118 PolarHBondContact O-N 3.21Å; A2114-L2247 HydrophobicContact CB-CD1 3.8Å; A2114-F2252 HydrophobicContact CB-CD2 3.67Å; A2114-F2252 HydrophobicContact CB-CE2 3.5Å; A2114-F2252 VanDerWaalsContact CB-CE2 3.47Å; A2114-L2255 HydrophobicContact CB-CD2 4.03Å
2115	L	88.2	Confident	72.6	Confident	4.6 Å²	4.6	56.2 Å²	56.2	2%	0.024	30%	0.297	C	S	.	.	H	α-helix	trans	-62.2	-38.6	176.8	-74	166.3	0	0	0	112.1	P2111 S2112 A2117 F2118 G2119 G2120 L2255 F2259 L2362 A2363 S2366	P2111-L2115 WeakPolarHBondContact O-CB 3.38Å; P2111-L2115 WeakPolarHBondContact O-CD1 3.44Å; P2111-L2115 VanDerWaalsContact O-CG 3.27Å; P2111-L2115 WeakPolarHBondContact O-CG 3.37Å; P2111-L2115 PolarHBondContact O-N 3.4Å; S2112-L2115 PolarHBondContact O-N 3.27Å; L2115-A2117 VanDerWaalsContact C-N 3.34Å; L2115-A2117 PolarHBondContact O-N 3.1Å; L2115-F2118 HydrophobicContact CD2-CD2 4.26Å; L2115-F2118 PolarHBondContact O-N 3.18Å; L2115-G2119 PolarHBondContact O-N 2.91Å; L2115-G2120 VanDerWaalsContact O-CA 3.3Å; L2115-G2120 WeakPolarHBondContact O-CA 3.3Å; L2115-G2120 PolarHBondContact O-N 3.05Å; L2115-L2255 HydrophobicContact CD1-CD1 4.37Å; L2115-L2255 HydrophobicContact CD1-CD2 4.42Å; L2115-L2255 HydrophobicContact CD2-CD1 4.06Å; L2115-L2255 HydrophobicContact CD2-CD2 4.4Å; L2115-L2255 HydrophobicContact CD2-CG 4.11Å; L2115-L2255 HydrophobicContact CG-CD1 4.31Å; L2115-L2255 HydrophobicContact CG-CD2 4.08Å; L2115-L2255 HydrophobicContact CG-CG 4.3Å; L2115-F2259 HydrophobicContact CD2-CB 4.08Å; L2115-F2259 HydrophobicContact CD2-CD2 3.71Å; L2115-F2259 HydrophobicContact CD2-CE2 4.43Å; L2115-F2259 HydrophobicContact CD2-CG 4.14Å; L2115-L2362 HydrophobicContact CD1-CB 3.81Å; L2115-A2363 HydrophobicContact CD2-CB 4.07Å; L2115-S2366 WeakPolarHBondContact CD1-OG 3.45Å
2116	Q	85.7	Confident	72.3	Confident	111.6 Å²	111.6	55.6 Å²	55.6	52%	0.521	30%	0.301	S	S	.	.	H	α-helix	trans	-63.6	-41.8	174.3	-171.8	176.7	16.6	0	0	111.9	S2112 T2113 A2114 F2118 G2119 G2120	S2112-Q2116 WeakPolarHBondContact O-CB 3.4Å; S2112-Q2116 PolarHBondContact O-N 3.17Å; S2112-Q2116 VanDerWaalsContact O-N 3.11Å; T2113-Q2116 PolarHBondContact O-N 3.02Å; A2114-Q2116 VanDerWaalsContact C-N 3.31Å; A2114-Q2116 PolarHBondContact O-N 3.09Å; Q2116-F2118 VanDerWaalsContact C-N 3.3Å; Q2116-F2118 PolarHBondContact O-N 3Å; Q2116-G2119 WeakPolarHBondContact O-CA 3.13Å; Q2116-G2119 PolarHBondContact O-N 3.08Å; Q2116-G2120 WeakPolarHBondContact CA-O 3.41Å
2117	A	84	Confident	71.5	Confident	35.2 Å²	35.2	58.7 Å²	58.7	29%	0.291	31%	0.314	S	S	.	.	H	α-helix	trans	-67.3	-29.7	176.7	0	0	0	0	0	113	L2094 L2098 T2113 A2114 L2115 G2119	L2094-A2117 HydrophobicContact CD1-CB 4.19Å; L2094-A2117 HydrophobicContact CD2-CB 4.1Å; L2094-A2117 HydrophobicContact CG-CB 4.36Å; L2098-A2117 HydrophobicContact CD1-CB 3.59Å; L2098-A2117 HydrophobicContact CD2-CB 4.08Å; L2098-A2117 HydrophobicContact CG-CB 4.34Å; T2113-A2117 WeakPolarHBondContact O-CB 3.38Å; T2113-A2117 PolarHBondContact O-N 3.21Å; A2114-A2117 WeakPolarHBondContact O-CB 3.42Å; A2114-A2117 PolarHBondContact O-N 2.9Å; A2114-A2117 VanDerWaalsContact O-N 3.15Å; L2115-A2117 VanDerWaalsContact C-N 3.34Å; L2115-A2117 PolarHBondContact O-N 3.1Å; A2117-G2119 PolarHBondContact O-N 3.06Å
2118	F	87.9	Confident	70.4	Confident	11.4 Å²	11.4	63.3 Å²	63.3	5%	0.05	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73	-5.5	168.8	-52.9	-30.9	0	0	0	113.2	W2090 L2091 L2094 A2114 L2115 Q2116 F2252 L2255 F2256 F2259 F2939	W2090-F2118 AromaticContact CH2-CD1 3.93Å; W2090-F2118 HydrophobicContact CH2-CD1 4.06Å; W2090-F2118 HydrophobicContact CZ3-CD1 4.36Å; L2091-F2118 HydrophobicContact CD2-CD1 4.41Å; L2091-F2118 HydrophobicContact CD2-CE1 3.81Å; L2091-F2118 HydrophobicContact CD2-CZ 4.36Å; L2094-F2118 HydrophobicContact CD2-CD1 3.75Å; L2094-F2118 HydrophobicContact CD2-CE1 3.87Å; A2114-F2118 HydrophobicContact CB-CE2 4.21Å; A2114-F2118 HydrophobicContact CB-CZ 4.24Å; A2114-F2118 WeakPolarHBondContact O-CD1 3.33Å; A2114-F2118 VanDerWaalsContact O-CD2 3.28Å; A2114-F2118 WeakPolarHBondContact O-CD2 3.38Å; A2114-F2118 WeakPolarHBondContact O-CG 3.4Å; A2114-F2118 PolarHBondContact O-N 3.21Å; L2115-F2118 HydrophobicContact CD2-CD2 4.26Å; L2115-F2118 PolarHBondContact O-N 3.18Å; Q2116-F2118 VanDerWaalsContact C-N 3.3Å; Q2116-F2118 PolarHBondContact O-N 3Å; F2118-F2252 HydrophobicContact CD1-CZ 4.45Å; F2118-F2252 HydrophobicContact CE1-CD1 4.37Å; F2118-F2252 AromaticContact CE1-CE1 3.61Å; F2118-F2252 HydrophobicContact CE1-CE1 3.61Å; F2118-F2252 AromaticContact CE1-CE2 3.87Å; F2118-F2252 HydrophobicContact CE1-CE2 3.87Å; F2118-F2252 AromaticContact CE1-CZ 3.33Å; F2118-F2252 HydrophobicContact CE1-CZ 3.33Å; F2118-F2252 VanDerWaalsContact CE1-CZ 3.41Å; F2118-F2252 HydrophobicContact CZ-CD1 4.09Å; F2118-F2252 AromaticContact CZ-CD2 3.96Å; F2118-F2252 HydrophobicContact CZ-CD2 3.99Å; F2118-F2252 AromaticContact CZ-CE1 3.77Å; F2118-F2252 HydrophobicContact CZ-CE1 3.77Å; F2118-F2252 AromaticContact CZ-CE2 3.67Å; F2118-F2252 HydrophobicContact CZ-CE2 3.67Å; F2118-F2252 HydrophobicContact CZ-CG 4.2Å; F2118-F2252 AromaticContact CZ-CZ 3.56Å; F2118-F2252 HydrophobicContact CZ-CZ 3.56Å; F2118-L2255 HydrophobicContact CE2-CB 4.46Å; F2118-L2255 HydrophobicContact CE2-CD2 4.37Å; F2118-L2255 HydrophobicContact CE2-CG 4.16Å; F2118-F2256 HydrophobicContact CB-CD2 4.39Å; F2118-F2256 AromaticContact CD1-CD2 3.82Å; F2118-F2256 HydrophobicContact CD1-CD2 3.82Å; F2118-F2256 HydrophobicContact CD1-CE2 4.45Å; F2118-F2256 HydrophobicContact CD2-CB 4.34Å; F2118-F2256 HydrophobicContact CD2-CD2 4.18Å; F2118-F2256 HydrophobicContact CE1-CB 4.13Å; F2118-F2256 AromaticContact CE1-CD2 3.98Å; F2118-F2256 HydrophobicContact CE1-CD2 4.04Å; F2118-F2256 HydrophobicContact CE1-CG 4.45Å; F2118-F2256 HydrophobicContact CE2-CB 3.81Å; F2118-F2256 HydrophobicContact CE2-CD2 4.38Å; F2118-F2256 AromaticContact CG-CD2 3.87Å; F2118-F2256 HydrophobicContact CG-CD2 3.91Å; F2118-F2256 HydrophobicContact CZ-CB 3.7Å; F2118-F2256 HydrophobicContact CZ-CD2 4.36Å; F2118-F2256 HydrophobicContact CZ-CG 4.48Å; F2118-F2259 HydrophobicContact CB-CD1 3.64Å; F2118-F2259 HydrophobicContact CB-CE1 3.53Å; F2118-F2259 VanDerWaalsContact CB-CE1 3.43Å; F2118-F2259 HydrophobicContact CB-CG 4.29Å; F2118-F2259 HydrophobicContact CB-CZ 4.11Å; F2118-F2259 HydrophobicContact CD2-CB 4.39Å; F2118-F2259 HydrophobicContact CD2-CD1 4.26Å; F2118-F2259 HydrophobicContact CD2-CG 4.38Å; F2118-F2259 HydrophobicContact CG-CD1 4.29Å; F2118-F2259 VanDerWaalsContact O-CE1 3.24Å; F2118-F2259 WeakPolarHBondContact O-CE1 3.3Å; F2118-F2259 WeakPolarHBondContact O-CZ 3.29Å; F2118-F2939 VanDerWaalsContact O-CE1 3.22Å; F2118-F2939 WeakPolarHBondContact O-CE1 3.29Å
2119	G	83.6	Confident	68.9	Low	47.4 Å²	47.4	67.7 Å²	67.7	49%	0.489	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	97.4	9.2	-179.3	0	0	0	0	0	115.1	L2115 Q2116 A2117	L2115-G2119 PolarHBondContact O-N 2.91Å; Q2116-G2119 WeakPolarHBondContact O-CA 3.13Å; Q2116-G2119 PolarHBondContact O-N 3.08Å; A2117-G2119 PolarHBondContact O-N 3.06Å
2120	G	81.6	Confident	67	Low	10.2 Å²	10.2	71 Å²	71	11%	0.105	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-75	168.5	171.1	0	0	0	0	0	113.2	L2115 Q2116 S2366	L2115-G2120 VanDerWaalsContact O-CA 3.3Å; L2115-G2120 WeakPolarHBondContact O-CA 3.3Å; L2115-G2120 PolarHBondContact O-N 3.05Å; Q2116-G2120 WeakPolarHBondContact CA-O 3.41Å; G2120-S2366 WeakPolarHBondContact CA-O 3.37Å
2121	R	78.6	Confident	64.4	Low	164.6 Å²	164.6	78.4 Å²	78.4	62%	0.621	42%	0.423	S	S	*	.	P	Polyproline II helix	trans	-87.9	143.4	175.8	-62.1	-169.8	-176.3	-166.6	5	111.9	F2123 S2366 A2368	R2121-F2123 HydrophobicContact CB-CD2 4.48Å; R2121-F2123 HydrophobicContact CB-CE2 4.07Å; R2121-F2123 WeakPolarHBondContact O-CD2 3.42Å; R2121-F2123 PolarHBondContact O-N 2.98Å; R2121-S2366 PolarHBondContact N-O 3.07Å; R2121-A2368 HydrophobicContact CG-CB 4.47Å; R2121-A2368 VanDerWaalsContact NE-CB 3.35Å; R2121-A2368 VanDerWaalsContact NH2-CB 3.29Å; R2121-A2368 PolarHBondContact NH2-O 3.38Å
2122	A	61.5	Low	61.7	Low	33.8 Å²	33.8	81.3 Å²	81.3	28%	0.279	45%	0.453	S	S	.	.	P	Polyproline II helix	trans	-76.6	115.8	167.7	0	0	0	0	0	110	W2124 T2125	A2122-W2124 VanDerWaalsContact C-N 3.31Å; A2122-W2124 PolarHBondContact O-N 2.93Å; A2122-T2125 WeakPolarHBondContact CB-OG1 3.24Å
2123	F	56.9	Low	59.1	Low	109 Å²	109	85.7 Å²	85.7	48%	0.478	48%	0.484	S	S	.	.	S	Bend	trans	-77.4	-20	-174.2	-138	-96.3	0	0	0	114.2	R2121 Q2127 A2365	R2121-F2123 HydrophobicContact CB-CD2 4.48Å; R2121-F2123 HydrophobicContact CB-CE2 4.07Å; R2121-F2123 WeakPolarHBondContact O-CD2 3.42Å; R2121-F2123 PolarHBondContact O-N 2.98Å; F2123-Q2127 PolarHBondContact O-NE2 3.35Å; F2123-Q2127 VanDerWaalsContact O-NE2 3.17Å; F2123-A2365 HydrophobicContact CE2-CB 3.94Å; F2123-A2365 VanDerWaalsContact CE2-CB 3.42Å; F2123-A2365 WeakPolarHBondContact CE2-O 3.4Å; F2123-A2365 HydrophobicContact CZ-CB 3.87Å; F2123-A2365 WeakPolarHBondContact CZ-O 3.3Å
2124	W	52.4	Low	56.6	Low	135.6 Å²	135.6	89.1 Å²	89.1	51%	0.514	51%	0.507	S	S	.	.	S	Bend	trans	-98.6	-21.7	-164.4	-49.3	105.2	0	0	0	114.8	S2112 A2122 D2126 Q2127 I2242 L2362	S2112-W2124 VanDerWaalsContact OG-CD1 3.28Å; S2112-W2124 PolarHBondContact OG-NE1 2.76Å; S2112-W2124 VanDerWaalsContact OG-NE1 3.13Å; A2122-W2124 VanDerWaalsContact C-N 3.31Å; A2122-W2124 PolarHBondContact O-N 2.93Å; W2124-D2126 PolarHBondContact O-N 3.25Å; W2124-Q2127 PolarHBondContact O-N 2.86Å; W2124-I2242 HydrophobicContact CH2-CD1 3.78Å; W2124-I2242 HydrophobicContact CZ3-CD1 4.28Å; W2124-L2362 HydrophobicContact CZ2-CD2 3.99Å
2125	T	43	Very low	53.8	Low	104.2 Å²	104.2	94.5 Å²	94.5	64%	0.639	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-27.2	-171.8	-9.7	0	0	0	0	113.8	A2122 Q2127 S2129	A2122-T2125 WeakPolarHBondContact CB-OG1 3.24Å; T2125-Q2127 PolarHBondContact O-N 3.43Å; T2125-S2129 PolarHBondContact O-OG 3.29Å
2126	D	39.2	Very low	51	Low	134 Å²	134	102.2 Å²	102.2	72%	0.717	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.1	-18.6	-174.2	-86	-12.2	0	0	0	114.7	W2124 S2129	W2124-D2126 PolarHBondContact O-N 3.25Å; D2126-S2129 PolarHBondContact O-OG 3.05Å
2127	Q	37	Very low	48.4	Very low	132.8 Å²	132.8	105.1 Å²	105.1	62%	0.621	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.1	-18.6	-175	-72.6	-166.6	34.3	0	0	115	F2123 W2124 T2125 S2129 A2130	F2123-Q2127 PolarHBondContact O-NE2 3.35Å; F2123-Q2127 VanDerWaalsContact O-NE2 3.17Å; W2124-Q2127 PolarHBondContact O-N 2.86Å; T2125-Q2127 PolarHBondContact O-N 3.43Å; Q2127-S2129 VanDerWaalsContact C-N 3.29Å; Q2127-S2129 PolarHBondContact O-N 3.04Å; Q2127-A2130 PolarHBondContact O-N 3.11Å; Q2127-A2130 VanDerWaalsContact O-N 3.15Å
2128	L	34.4	Very low	45.7	Very low	154.2 Å²	154.2	109 Å²	109	81%	0.807	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79	-14.4	-179.2	-75.6	166.5	0	0	0	113.8	A2130	L2128-A2130 VanDerWaalsContact C-N 3.3Å
2129	S	33.5	Very low	42.8	Very low	104.6 Å²	104.6	113.9 Å²	113.9	73%	0.731	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.6	-5.9	178.1	16.9	0	0	0	0	114.2	T2125 D2126 Q2127 F2131	T2125-S2129 PolarHBondContact O-OG 3.29Å; D2126-S2129 PolarHBondContact O-OG 3.05Å; Q2127-S2129 VanDerWaalsContact C-N 3.29Å; Q2127-S2129 PolarHBondContact O-N 3.04Å; S2129-F2131 VanDerWaalsContact C-N 3.27Å; S2129-F2131 PolarHBondContact O-N 2.84Å
2130	A	33.3	Very low	40.3	Very low	75 Å²	75	117 Å²	117	62%	0.62	67%	0.667	S	S	*	*			trans	-101.5	6	-171.1	0	0	0	0	0	115.4	Q2127 L2128 G2132	Q2127-A2130 PolarHBondContact O-N 3.11Å; Q2127-A2130 VanDerWaalsContact O-N 3.15Å; L2128-A2130 VanDerWaalsContact C-N 3.3Å; A2130-G2132 VanDerWaalsContact C-N 3.31Å; A2130-G2132 PolarHBondContact O-N 3.22Å
2131	F	29.9	Very low	37.8	Very low	197.6 Å²	197.6	123.2 Å²	123.2	87%	0.867	70%	0.703	S	S	*	*			trans	-94.7	64.3	173.8	-81.1	-80.8	0	0	0	112.1	S2129	S2129-F2131 VanDerWaalsContact C-N 3.27Å; S2129-F2131 PolarHBondContact O-N 2.84Å
2132	G	29.2	Very low	35.3	Very low	63.4 Å²	63.4	124.2 Å²	124.2	65%	0.654	71%	0.712	S	S	*	*	S	Bend	trans	-115.2	125.3	162.3	0	0	0	0	0	109.5	A2130	A2130-G2132 VanDerWaalsContact C-N 3.31Å; A2130-G2132 PolarHBondContact O-N 3.22Å
2133	S	28.7	Very low	33.8	Very low	115 Å²	115	132.3 Å²	132.3	80%	0.804	74%	0.741	S	S	*	*			trans	-43.9	142.9	-177.6	-41.3	0	0	0	0	114.9	S2135	S2133-S2135 PolarHBondContact O-N 3.35Å
2134	P	32.2	Very low	32.4	Very low	127 Å²	127	136.3 Å²	136.3	83%	0.825	76%	0.758	S	S	*	*			trans	-89.5	134.7	-171.5	33.7	-30.9	0	0	0	112.7
2135	S	28.6	Very low	31.2	Very low	113.2 Å²	113.2	136.4 Å²	136.4	79%	0.792	77%	0.774	S	S	*	*			trans	-106.8	125.8	160.1	65.1	0	0	0	0	111.8	S2133 H2137	S2133-S2135 PolarHBondContact O-N 3.35Å; S2135-H2137 PolarHBondContact O-N 2.93Å
2136	E	29.1	Very low	30.4	Very low	167.2 Å²	167.2	141 Å²	141	78%	0.781	79%	0.785	S	S	*	*			trans	-60.5	139	161.9	-62.9	-179.7	156.7	0	0	114.5
2137	H	30.8	Very low	29.8	Very low	172 Å²	172	139.9 Å²	139.9	80%	0.796	79%	0.788	S	S	*	*			trans	94.2	117.7	147.3	-68.2	-54.1	0	0	0	116.3	S2135	S2135-H2137 PolarHBondContact O-N 2.93Å
2138	S	28	Very low	29.3	Very low	116.2 Å²	116.2	139.2 Å²	139.2	81%	0.813	79%	0.792	S	S	*	*				148.4	126.9	126.3	54.1	0	0	0	0	114.3	P2140	S2138-P2140 VanDerWaalsContact O-CD 3.29Å; S2138-P2140 WeakPolarHBondContact O-CD 3.32Å
2139	S	26.6	Very low	28.8	Very low	114.6 Å²	114.6	142.9 Å²	142.9	80%	0.801	80%	0.795	S	S	*	*			trans	-79.4	141.8	178.2	10.6	0	0	0	0	113.1	T2141	S2139-T2141 PolarHBondContact O-N 3.29Å
2140	P	30.9	Very low	28.5	Very low	113.4 Å²	113.4	148 Å²	148	74%	0.736	80%	0.8	S	S	*	*			trans	-94.5	144.3	-166.7	29	-20.7	0	0	0	111.6	S2138 F2142	S2138-P2140 VanDerWaalsContact O-CD 3.29Å; S2138-P2140 WeakPolarHBondContact O-CD 3.32Å; P2140-F2142 VanDerWaalsContact C-N 3.35Å; P2140-F2142 PolarHBondContact O-N 3.33Å
2141	T	29.3	Very low	28.3	Very low	139.8 Å²	139.8	150.3 Å²	150.3	86%	0.858	81%	0.809	S	S	*	*			trans	-101.2	116.4	171.2	-15.2	0	0	0	0	111.3	S2139 K2143	S2139-T2141 PolarHBondContact O-N 3.29Å; T2141-K2143 PolarHBondContact O-N 3.28Å
2142	F	27.6	Very low	28.1	Very low	186.2 Å²	186.2	146 Å²	146	82%	0.817	80%	0.803	S	S	*	*			trans	-75.3	118.6	174.5	-103.1	-94.4	0	0	0	111.2	P2140 K2144	P2140-F2142 VanDerWaalsContact C-N 3.35Å; P2140-F2142 PolarHBondContact O-N 3.33Å; F2142-K2144 VanDerWaalsContact C-N 3.33Å; F2142-K2144 HydrophobicContact CD1-CG 4.43Å; F2142-K2144 PolarHBondContact O-N 3.2Å
2143	K	29	Very low	28.1	Very low	203.2 Å²	203.2	151.8 Å²	151.8	88%	0.883	81%	0.813	S	S	*	*			trans	-101	122.3	158.4	-81.2	177.8	-178.7	175.1	0	109.8	T2141 T2145	T2141-K2143 PolarHBondContact O-N 3.28Å; K2143-T2145 PolarHBondContact O-N 3.09Å
2144	K	27	Very low	28	Very low	192.2 Å²	192.2	156.8 Å²	156.8	84%	0.836	81%	0.814	S	S	*	*			trans	-74.3	121.3	177.3	-66.2	174.7	178.4	174.2	0	110.3	F2142 K2146	F2142-K2144 VanDerWaalsContact C-N 3.33Å; F2142-K2144 HydrophobicContact CD1-CG 4.43Å; F2142-K2144 PolarHBondContact O-N 3.2Å; K2144-K2146 PolarHBondContact O-N 3.1Å
2145	T	27.7	Very low	27.8	Very low	138 Å²	138	154 Å²	154	85%	0.847	81%	0.809	S	S	*	*			trans	-108.8	139.5	151.6	28.9	0	0	0	0	109	K2143 S2147	K2143-T2145 PolarHBondContact O-N 3.09Å; T2145-S2147 PolarHBondContact O-N 3.32Å
2146	K	26.5	Very low	27.7	Very low	202 Å²	202	159 Å²	159	88%	0.878	81%	0.812	S	S	*	*			trans	-86.1	127.7	-174.3	-74.7	174.8	179.2	176.8	0	109.2	K2144 V2148	K2144-K2146 PolarHBondContact O-N 3.1Å; K2146-V2148 PolarHBondContact O-N 3.15Å; K2146-V2148 VanDerWaalsContact O-N 3.15Å
2147	S	25.7	Very low	27.6	Very low	110.6 Å²	110.6	158.9 Å²	158.9	77%	0.773	82%	0.816	S	S	*	*			trans	-78.9	134.4	165.3	-178.8	0	0	0	0	110.6	T2145 R2149	T2145-S2147 PolarHBondContact O-N 3.32Å; S2147-R2149 PolarHBondContact O-N 2.92Å
2148	V	27.3	Very low	27.7	Very low	118.2 Å²	118.2	156 Å²	156	72%	0.716	81%	0.812	S	S	*	*			trans	-95	114.5	167.5	169.5	0	0	0	0	109.6	K2146 Y2150	K2146-V2148 PolarHBondContact O-N 3.15Å; K2146-V2148 VanDerWaalsContact O-N 3.15Å; V2148-Y2150 HydrophobicContact CG1-CE2 4.28Å; V2148-Y2150 PolarHBondContact O-N 3.32Å
2149	R	24.8	Very low	27.6	Very low	230.6 Å²	230.6	157 Å²	157	87%	0.87	81%	0.814	S	S	*	*			trans	-77	126	163.3	-80.8	-179.1	-132.3	174.2	1.2	112.1	S2147	S2147-R2149 PolarHBondContact O-N 2.92Å
2150	Y	26.2	Very low	27.7	Very low	211.8 Å²	211.8	156 Å²	156	83%	0.831	81%	0.812	S	S	*	*			trans	-79.7	144.9	161.8	-71.5	-85.8	0	0	0	109.9	V2148 S2152	V2148-Y2150 HydrophobicContact CG1-CE2 4.28Å; V2148-Y2150 PolarHBondContact O-N 3.32Å; Y2150-S2152 PolarHBondContact O-N 3.08Å
2151	P	29	Very low	27.5	Very low	124.2 Å²	124.2	160.5 Å²	160.5	81%	0.806	82%	0.82	S	S	*	*			trans	-99.4	134.7	148.1	18.1	-6	0	0	0	112.7	Q2153	P2151-Q2153 VanDerWaalsContact C-N 3.33Å; P2151-Q2153 PolarHBondContact O-N 3.26Å
2152	S	26.4	Very low	27.5	Very low	106.8 Å²	106.8	161.9 Å²	161.9	75%	0.747	82%	0.821	S	S	*	*			trans	-63.5	121.5	170.4	164.5	0	0	0	0	113.6	Y2150 R2154	Y2150-S2152 PolarHBondContact O-N 3.08Å; S2152-R2154 PolarHBondContact O-N 3.16Å
2153	Q	29.6	Very low	27.5	Very low	185.6 Å²	185.6	162.2 Å²	162.2	87%	0.867	82%	0.823	S	S	*	*			trans	-113.2	118.3	149.9	-83.7	-177.2	10.4	0	0	110.3	P2151 G2155	P2151-Q2153 VanDerWaalsContact C-N 3.33Å; P2151-Q2153 PolarHBondContact O-N 3.26Å; Q2153-G2155 PolarHBondContact O-N 3.08Å
2154	R	26.5	Very low	27.3	Very low	219 Å²	219	162.1 Å²	162.1	83%	0.826	82%	0.822	S	S	*	*			trans	-52.4	108.7	154.4	-114.8	179	-163.5	177.6	-0.9	110.9	S2152 Y2156	S2152-R2154 PolarHBondContact O-N 3.16Å; R2154-Y2156 HydrophobicContact CB-CD2 4.48Å; R2154-Y2156 HydrophobicContact CB-CE2 4.36Å; R2154-Y2156 PolarHBondContact O-N 2.9Å
2155	G	26.5	Very low	27.2	Very low	68.2 Å²	68.2	160.3 Å²	160.3	70%	0.703	82%	0.821	S	S	*	*			trans	-120	132.5	133.7	0	0	0	0	0	110.6	Q2153 L2157	Q2153-G2155 PolarHBondContact O-N 3.08Å; G2155-L2157 PolarHBondContact O-N 3.45Å
2156	Y	27.3	Very low	27.1	Very low	219.4 Å²	219.4	158.7 Å²	158.7	86%	0.86	82%	0.815	S	S	*	*			trans	-94.6	120.1	167.8	-78.2	-87.6	0	0	0	112	R2154	R2154-Y2156 HydrophobicContact CB-CD2 4.48Å; R2154-Y2156 HydrophobicContact CB-CE2 4.36Å; R2154-Y2156 PolarHBondContact O-N 2.9Å
2157	L	26.9	Very low	27.2	Very low	164.4 Å²	164.4	155.2 Å²	155.2	86%	0.861	81%	0.81	S	S	*	*			trans	-107.4	155.8	164.6	-87.7	141.8	0	0	0	109.3	G2155	G2155-L2157 PolarHBondContact O-N 3.45Å
2158	P	32	Very low	27.2	Very low	110.6 Å²	110.6	156.1 Å²	156.1	72%	0.718	81%	0.812	S	S	*	*			trans	-107.6	158.2	-169.5	24.6	-9.6	0	0	0	115.1	A2160	P2158-A2160 PolarHBondContact O-N 3.16Å
2159	T	27	Very low	27.2	Very low	138.8 Å²	138.8	154 Å²	154	85%	0.852	81%	0.813	S	S	*	*			trans	-22.2	116.4	167.1	47.4	0	0	0	0	115.9	K2161	T2159-K2161 PolarHBondContact O-N 2.79Å
2160	A	29	Very low	27.4	Very low	93.2 Å²	93.2	150.4 Å²	150.4	77%	0.77	81%	0.811	S	S	*	*			trans	-122	128.4	153.9	0	0	0	0	0	111	P2158 L2162	P2158-A2160 PolarHBondContact O-N 3.16Å; A2160-L2162 PolarHBondContact O-N 3.24Å
2161	K	27	Very low	27.4	Very low	207 Å²	207	149.2 Å²	149.2	90%	0.9	81%	0.813	S	S	*	*			trans	-60.6	127.1	161.9	-70.2	171.5	-178.2	175.2	0	113.3	T2159 K2163	T2159-K2161 PolarHBondContact O-N 2.79Å; K2161-K2163 PolarHBondContact O-N 3.36Å
2162	L	28.3	Very low	27.3	Very low	169.8 Å²	169.8	146.4 Å²	146.4	89%	0.889	81%	0.807	S	S	*	*			trans	-122.4	130.3	170.2	-162.1	83	0	0	0	111.4	A2160 K2164	A2160-L2162 PolarHBondContact O-N 3.24Å; L2162-K2164 PolarHBondContact O-N 2.8Å
2163	K	26.8	Very low	27.3	Very low	193.2 Å²	193.2	150.5 Å²	150.5	84%	0.84	81%	0.812	S	S	*	*			trans	-89.1	131.4	176.2	-83.1	172.7	177	179.5	0	110.8	K2161 L2165	K2161-K2163 PolarHBondContact O-N 3.36Å; K2163-L2165 PolarHBondContact O-N 2.99Å
2164	K	25.5	Very low	27.5	Very low	201.2 Å²	201.2	147.1 Å²	147.1	88%	0.875	81%	0.806	S	S	*	*			trans	-58.2	117.7	152.8	-150.6	178.3	-178.6	-178.4	0	111.1	L2162 S2166	L2162-K2164 PolarHBondContact O-N 2.8Å; K2164-S2166 PolarHBondContact O-N 3.28Å
2165	L	26.1	Very low	27.9	Very low	154 Å²	154	140.9 Å²	140.9	81%	0.806	80%	0.797	S	S	*	*			trans	-101.4	129	157.6	-95.7	126.6	0	0	0	109.3	K2163 V2167	K2163-L2165 PolarHBondContact O-N 2.99Å; L2165-V2167 PolarHBondContact O-N 3.39Å
2166	S	24.3	Very low	28.3	Very low	103.6 Å²	103.6	148.5 Å²	148.5	72%	0.724	80%	0.804	S	S	*	*			trans	-38.4	130.9	153	87.3	0	0	0	0	112.8	K2164 T2168	K2164-S2166 PolarHBondContact O-N 3.28Å; S2166-T2168 PolarHBondContact O-N 3.2Å
2167	V	28.4	Very low	28.9	Very low	128.6 Å²	128.6	142.6 Å²	142.6	78%	0.779	79%	0.791	S	S	*	*				-119.5	128.9	127	144.1	0	0	0	0	109	L2165 G2169	L2165-V2167 PolarHBondContact O-N 3.39Å; V2167-G2169 PolarHBondContact O-N 2.92Å
2168	T	27.1	Very low	29.5	Very low	130.8 Å²	130.8	144.8 Å²	144.8	80%	0.802	79%	0.787	S	S	*	*			trans	-24.7	133.7	167.3	47.7	0	0	0	0	114.9	S2166 D2170	S2166-T2168 PolarHBondContact O-N 3.2Å; T2168-D2170 PolarHBondContact O-N 3.44Å
2169	G	27.4	Very low	30	Very low	72.4 Å²	72.4	144.7 Å²	144.7	75%	0.746	78%	0.78	S	S	*	*			trans	-135.6	110.4	172.1	0	0	0	0	0	112.5	V2167 Q2171	V2167-G2169 PolarHBondContact O-N 2.92Å; G2169-Q2171 PolarHBondContact O-N 3.04Å
2170	D	27	Very low	30.7	Very low	155.4 Å²	155.4	141.2 Å²	141.2	83%	0.831	76%	0.761	S	S	*	*			trans	-32.4	131.5	145.9	-141.2	1	0	0	0	112.7	T2168 G2172	T2168-D2170 PolarHBondContact O-N 3.44Å; D2170-G2172 VanDerWaalsContact C-N 3.28Å; D2170-G2172 PolarHBondContact O-N 2.94Å; D2170-G2172 VanDerWaalsContact O-N 3.09Å
2171	Q	27.2	Very low	31.3	Very low	186.2 Å²	186.2	141.6 Å²	141.6	87%	0.87	75%	0.749	S	S	*	*			trans	-99.8	111.7	167.4	-62.6	-150.6	16.8	0	0	112.6	G2169 F2173	G2169-Q2171 PolarHBondContact O-N 3.04Å; Q2171-F2173 PolarHBondContact O-N 3.19Å
2172	G	27.3	Very low	31.7	Very low	66.8 Å²	66.8	140.5 Å²	140.5	69%	0.689	74%	0.74	S	S	*	*			trans	-133.4	112.7	166.6	0	0	0	0	0	113.1	D2170 P2174	D2170-G2172 VanDerWaalsContact C-N 3.28Å; D2170-G2172 PolarHBondContact O-N 2.94Å; D2170-G2172 VanDerWaalsContact O-N 3.09Å; G2172-P2174 WeakPolarHBondContact O-CD 3.47Å
2173	F	27.1	Very low	32	Very low	192.4 Å²	192.4	138.6 Å²	138.6	84%	0.844	73%	0.73	S	S	*	*			trans	-39.8	144.6	165.8	-77.3	-90.4	0	0	0	113.1	Q2171 S2175	Q2171-F2173 PolarHBondContact O-N 3.19Å; F2173-S2175 VanDerWaalsContact C-N 3.33Å; F2173-S2175 PolarHBondContact O-N 3.06Å
2174	P	31.8	Very low	32.5	Very low	113.6 Å²	113.6	133.2 Å²	133.2	74%	0.738	72%	0.717	S	S	*	*			trans	-97.4	108.5	-173.4	32	-27.4	0	0	0	112.2	G2172 R2176	G2172-P2174 WeakPolarHBondContact O-CD 3.47Å; P2174-R2176 VanDerWaalsContact C-N 3.34Å; P2174-R2176 PolarHBondContact O-N 3.27Å; P2174-R2176 VanDerWaalsContact O-N 3.08Å
2175	S	35	Very low	33.2	Very low	90 Å²	90	129.4 Å²	129.4	63%	0.629	70%	0.7	S	S	*	*			trans	-79	105.4	164.2	-57.5	0	0	0	0	111.1	Q1818 F2173 V2177 R2182	Q1818-S2175 VanDerWaalsContact NE2-CB 3.3Å; Q1818-S2175 PolarHBondContact NE2-OG 3.29Å; F2173-S2175 VanDerWaalsContact C-N 3.33Å; F2173-S2175 PolarHBondContact O-N 3.06Å; S2175-V2177 PolarHBondContact O-N 2.95Å; S2175-R2182 PolarHBondContact OG-NH1 3.1Å; S2175-R2182 PolarHBondContact OG-NH2 3.39Å
2176	R	36.7	Very low	33.7	Very low	227 Å²	227	131.4 Å²	131.4	86%	0.857	70%	0.697	S	S	*	*			trans	-75.9	67	171.9	-106.9	-178.4	-161.9	-177.3	1.3	112.3	P2174 R2178	P2174-R2176 VanDerWaalsContact C-N 3.34Å; P2174-R2176 PolarHBondContact O-N 3.27Å; P2174-R2176 VanDerWaalsContact O-N 3.08Å; R2176-R2178 VanDerWaalsContact C-N 3.28Å; R2176-R2178 PolarHBondContact O-N 3.14Å; R2176-R2178 VanDerWaalsContact O-N 3.12Å
2177	V	38.8	Very low	34.2	Very low	95.8 Å²	95.8	132.6 Å²	132.6	58%	0.581	70%	0.695	S	S	*	*			trans	-81.9	105.8	157	-177.3	0	0	0	0	109.8	T1764 S1768 V1769 L1822 S2175 L2179 R2182	T1764-V2177 HydrophobicContact CG2-CG1 4.19Å; S1768-V2177 WeakPolarHBondContact OG-CG2 3.33Å; V1769-V2177 HydrophobicContact CG2-CG2 3.63Å; L1822-V2177 HydrophobicContact CD1-CB 4.31Å; L1822-V2177 HydrophobicContact CD1-CG1 4.5Å; S2175-V2177 PolarHBondContact O-N 2.95Å; V2177-L2179 HydrophobicContact CG1-CD2 3.89Å; V2177-L2179 PolarHBondContact O-N 2.75Å; V2177-R2182 PolarHBondContact O-NH1 3.36Å
2178	R	39.6	Very low	34.2	Very low	211 Å²	211	131.8 Å²	131.8	80%	0.796	70%	0.695	S	S	*	*			trans	-93.4	108.2	173	-115.9	-175.5	-178.6	166.3	1.3	108.6	R2176 S2180	R2176-R2178 VanDerWaalsContact C-N 3.28Å; R2176-R2178 PolarHBondContact O-N 3.14Å; R2176-R2178 VanDerWaalsContact O-N 3.12Å; R2178-S2180 PolarHBondContact O-N 3.33Å
2179	L	41.8	Very low	34.4	Very low	108.4 Å²	108.4	131.6 Å²	131.6	57%	0.568	70%	0.696	S	S	*	*			trans	-68.4	117	167.2	-63.9	173.6	0	0	0	109.1	D1761 I1765 L1822 V1826 V2177 I2181 R2182	D1761-L2179 HydrophobicContact CB-CD2 4.37Å; I1765-L2179 HydrophobicContact CD1-CD1 4.06Å; I1765-L2179 HydrophobicContact CD1-CD2 3.64Å; I1765-L2179 HydrophobicContact CG1-CD2 3.38Å; L1822-L2179 HydrophobicContact CB-CD1 4.3Å; L1822-L2179 HydrophobicContact CD2-CD1 3.75Å; L1822-L2179 HydrophobicContact CD2-CG 4.36Å; V1826-L2179 HydrophobicContact CG2-CD1 4.21Å; V2177-L2179 HydrophobicContact CG1-CD2 3.89Å; V2177-L2179 PolarHBondContact O-N 2.75Å; L2179-I2181 PolarHBondContact O-N 3.03Å; L2179-R2182 HydrophobicContact CB-CB 4.27Å; L2179-R2182 HydrophobicContact CD1-CG 4.41Å; L2179-R2182 PolarHBondContact O-N 2.92Å
2180	S	42.9	Very low	34.4	Very low	64.4 Å²	64.4	131.8 Å²	131.8	45%	0.45	70%	0.698	S	S	.	*			trans	-89.4	55.3	174.7	49.8	0	0	0	0	110.2	P1732 T1757 D1761 R2178 R2182	P1732-S2180 WeakPolarHBondContact CD-O 3.36Å; P1732-S2180 WeakPolarHBondContact CG-O 3.47Å; T1757-S2180 WeakPolarHBondContact CG2-OG 3.47Å; D1761-S2180 VanDerWaalsContact CG-N 3.33Å; D1761-S2180 VanDerWaalsContact OD1-CB 3.28Å; D1761-S2180 WeakPolarHBondContact OD1-CB 3.41Å; D1761-S2180 PolarHBondContact OD1-N 3.16Å; D1761-S2180 PolarHBondContact OD1-OG 2.74Å; D1761-S2180 PolarHBondContact OD2-N 3.46Å; D1761-S2180 VanDerWaalsContact OD2-N 3.08Å; D1761-S2180 PolarHBondContact OD2-OG 3.14Å; D1761-S2180 VanDerWaalsContact OD2-OG 3.07Å; R2178-S2180 PolarHBondContact O-N 3.33Å; S2180-R2182 PolarHBondContact O-N 3.27Å; S2180-R2182 VanDerWaalsContact O-N 3.07Å
2181	I	40.3	Very low	34.4	Very low	102.2 Å²	102.2	129.4 Å²	129.4	52%	0.524	69%	0.694	S	S	.	*			trans	-85.4	66.3	170	-52.6	171.5	0	0	0	109.1	T1757 F1758 D1761 N1829 L2179 N2183 S2184 F2185	T1757-I2181 HydrophobicContact CG2-CD1 3.55Å; T1757-I2181 HydrophobicContact CG2-CG1 3.66Å; F1758-I2181 HydrophobicContact CD1-CD1 3.41Å; F1758-I2181 VanDerWaalsContact CD1-CD1 3.41Å; F1758-I2181 HydrophobicContact CE1-CD1 3.53Å; F1758-I2181 HydrophobicContact CG-CD1 4.06Å; F1758-I2181 HydrophobicContact CZ-CD1 4.27Å; D1761-I2181 WeakPolarHBondContact OD2-CG1 3.14Å; D1761-I2181 PolarHBondContact OD2-N 2.73Å; N1829-I2181 HydrophobicContact CB-CG2 3.96Å; N1829-I2181 WeakPolarHBondContact ND2-CG2 3.41Å; N1829-I2181 PolarHBondContact ND2-O 3.3Å; L2179-I2181 PolarHBondContact O-N 3.03Å; I2181-N2183 WeakPolarHBondContact O-CA 3.47Å; I2181-N2183 PolarHBondContact O-N 3.03Å; I2181-S2184 PolarHBondContact O-N 3.42Å; I2181-S2184 VanDerWaalsContact O-N 3.16Å; I2181-F2185 HydrophobicContact CD1-CE2 4.47Å; I2181-F2185 HydrophobicContact CG1-CE2 4.48Å; I2181-F2185 HydrophobicContact CG2-CD2 3.6Å; I2181-F2185 VanDerWaalsContact CG2-CD2 3.4Å; I2181-F2185 HydrophobicContact CG2-CE2 3.33Å; I2181-F2185 HydrophobicContact CG2-CZ 4.26Å
2182	R	35.3	Very low	34.4	Very low	184 Å²	184	125.9 Å²	125.9	69%	0.694	69%	0.69	S	S	*	*			trans	-89.7	59.4	179.9	-167.2	172.8	-175.7	167.2	0.6	111.8	T1825 S2175 V2177 L2179 S2180 S2184	T1825-R2182 WeakPolarHBondContact CG2-O 3.26Å; S2175-R2182 PolarHBondContact OG-NH1 3.1Å; S2175-R2182 PolarHBondContact OG-NH2 3.39Å; V2177-R2182 PolarHBondContact O-NH1 3.36Å; L2179-R2182 HydrophobicContact CB-CB 4.27Å; L2179-R2182 HydrophobicContact CD1-CG 4.41Å; L2179-R2182 PolarHBondContact O-N 2.92Å; S2180-R2182 PolarHBondContact O-N 3.27Å; S2180-R2182 VanDerWaalsContact O-N 3.07Å; R2182-S2184 PolarHBondContact O-N 3.01Å
2183	N	35.9	Very low	34.5	Very low	129.6 Å²	129.6	131.4 Å²	131.4	69%	0.693	70%	0.697	S	S	*	*			trans	-96.5	96.7	165.7	-77.3	-13.5	0	0	0	111.3	I2181 F2185	I2181-N2183 WeakPolarHBondContact O-CA 3.47Å; I2181-N2183 PolarHBondContact O-N 3.03Å; N2183-F2185 PolarHBondContact O-N 3.16Å
2184	S	38	Very low	34.5	Very low	79.4 Å²	79.4	129.7 Å²	129.7	56%	0.555	70%	0.697	S	S	*	*			trans	-81.4	54.9	159.3	-55.5	0	0	0	0	113.5	Q1741 I2181 R2182 R2186	Q1741-S2184 PolarHBondContact NE2-O 2.94Å; I2181-S2184 PolarHBondContact O-N 3.42Å; I2181-S2184 VanDerWaalsContact O-N 3.16Å; R2182-S2184 PolarHBondContact O-N 3.01Å; S2184-R2186 PolarHBondContact O-N 3.06Å; S2184-R2186 PolarHBondContact OG-NE 3.15Å
2185	F	39.8	Very low	34.3	Very low	121.4 Å²	121.4	129.7 Å²	129.7	53%	0.532	70%	0.7	S	S	.	*			trans	-100.1	63.6	163.9	-68	-68.7	0	0	0	111	R1737 T1740 L1744 N1829 F1833 I2181 N2183 L2187	R1737-F2185 HydrophobicContact CG-CE1 4.22Å; T1740-F2185 HydrophobicContact CG2-CB 4.48Å; T1740-F2185 HydrophobicContact CG2-CD1 3.34Å; T1740-F2185 HydrophobicContact CG2-CE1 3.61Å; T1740-F2185 HydrophobicContact CG2-CG 3.97Å; T1740-F2185 HydrophobicContact CG2-CZ 4.41Å; L1744-F2185 HydrophobicContact CD1-CB 4.37Å; N1829-F2185 HydrophobicContact CB-CD2 4.37Å; F1833-F2185 HydrophobicContact CE2-CD2 4.1Å; F1833-F2185 HydrophobicContact CE2-CE2 4.43Å; F1833-F2185 HydrophobicContact CE2-CG 4.42Å; F1833-F2185 HydrophobicContact CZ-CD2 4.34Å; F1833-F2185 HydrophobicContact CZ-CG 4.48Å; I2181-F2185 HydrophobicContact CD1-CE2 4.47Å; I2181-F2185 HydrophobicContact CG1-CE2 4.48Å; I2181-F2185 HydrophobicContact CG2-CD2 3.6Å; I2181-F2185 VanDerWaalsContact CG2-CD2 3.4Å; I2181-F2185 HydrophobicContact CG2-CE2 3.33Å; I2181-F2185 HydrophobicContact CG2-CZ 4.26Å; N2183-F2185 PolarHBondContact O-N 3.16Å; F2185-L2187 HydrophobicContact CD1-CD1 4.45Å; F2185-L2187 PolarHBondContact O-N 3.11Å
2186	R	36.4	Very low	33.9	Very low	196 Å²	196	129.2 Å²	129.2	74%	0.74	71%	0.709	S	S	*	*			trans	-79.8	112.6	165.4	-71.8	-172.3	-165.8	-141.4	1.9	108.3	D1828 T1832 S2184 S2188	D1828-R2186 IonicContact OD2-CZ 3.77Å; D1828-R2186 IonicContact OD2-NH1 3.53Å; D1828-R2186 IonicContact OD2-NH2 3.28Å; D1828-R2186 PolarHBondContact OD2-NH2 2.87Å; T1832-R2186 HydrophobicContact CG2-CG 4.48Å; S2184-R2186 PolarHBondContact O-N 3.06Å; S2184-R2186 PolarHBondContact OG-NE 3.15Å; R2186-S2188 PolarHBondContact O-N 3.26Å; R2186-S2188 VanDerWaalsContact O-N 3.17Å
2187	L	34.9	Very low	33.4	Very low	128.4 Å²	128.4	124 Å²	124	67%	0.672	71%	0.707	S	S	*	*			trans	-91	115.7	160.9	-69.5	169.8	0	0	0	107.3	F2185 P2189	F2185-L2187 HydrophobicContact CD1-CD1 4.45Å; F2185-L2187 PolarHBondContact O-N 3.11Å; L2187-P2189 VanDerWaalsContact O-CD 3.23Å; L2187-P2189 WeakPolarHBondContact O-CD 3.32Å; L2187-P2189 VanDerWaalsContact O-N 3.11Å
2188	S	28.6	Very low	32.8	Very low	113.4 Å²	113.4	130.7 Å²	130.7	79%	0.793	72%	0.722	S	S	*	*			trans	-66.6	128.5	171.5	-65.1	0	0	0	0	108.8	R2186 G2190	R2186-S2188 PolarHBondContact O-N 3.26Å; R2186-S2188 VanDerWaalsContact O-N 3.17Å; S2188-G2190 PolarHBondContact O-N 3.16Å; S2188-G2190 VanDerWaalsContact O-N 3.11Å
2189	P	30.7	Very low	32.2	Very low	125.8 Å²	125.8	126.8 Å²	126.8	82%	0.817	72%	0.722	S	S	*	*			trans	-70.9	117.3	175.2	18.8	-16.9	0	0	0	109.1	L2187 S2191	L2187-P2189 VanDerWaalsContact O-CD 3.23Å; L2187-P2189 WeakPolarHBondContact O-CD 3.32Å; L2187-P2189 VanDerWaalsContact O-N 3.11Å; P2189-S2191 PolarHBondContact O-N 3.04Å
2190	G	26.9	Very low	31.5	Very low	76 Å²	76	128.8 Å²	128.8	78%	0.784	73%	0.733	S	S	*	*			trans	-70.9	129.7	167.6	0	0	0	0	0	110.1	S2188 S2192	S2188-G2190 PolarHBondContact O-N 3.16Å; S2188-G2190 VanDerWaalsContact O-N 3.11Å; G2190-S2192 PolarHBondContact O-N 3.05Å
2191	S	28	Very low	30.7	Very low	106 Å²	106	130.6 Å²	130.6	74%	0.741	75%	0.745	S	S	*	*			trans	-99.4	127.1	170.6	55.7	0	0	0	0	111.3	P2189 Q2193	P2189-S2191 PolarHBondContact O-N 3.04Å; S2191-Q2193 PolarHBondContact O-N 3.27Å
2192	S	27.3	Very low	30.1	Very low	112.4 Å²	112.4	133.3 Å²	133.3	79%	0.786	76%	0.759	S	S	*	*			trans	-36	115.1	152.6	-16.1	0	0	0	0	112.4	G2190 D2194	G2190-S2192 PolarHBondContact O-N 3.05Å; S2192-D2194 PolarHBondContact O-N 3.33Å; S2192-D2194 VanDerWaalsContact O-N 3.14Å
2193	Q	28.9	Very low	29.7	Very low	182.6 Å²	182.6	132.5 Å²	132.5	85%	0.853	77%	0.768	S	S	*	*			trans	-103.1	128.6	139.3	-75.4	-176.8	-25.1	0	0	110.2	S2191 S2195	S2191-Q2193 PolarHBondContact O-N 3.27Å; Q2193-S2195 PolarHBondContact O-N 3.02Å
2194	D	27.2	Very low	29.3	Very low	156.6 Å²	156.6	131 Å²	131	84%	0.837	77%	0.774	S	S	*	*			trans	-74.1	132.4	158	-119	-21.4	0	0	0	112.4	S2192 G2196	S2192-D2194 PolarHBondContact O-N 3.33Å; S2192-D2194 VanDerWaalsContact O-N 3.14Å; D2194-G2196 PolarHBondContact O-N 3.36Å
2195	S	28.1	Very low	28.7	Very low	113.8 Å²	113.8	132.4 Å²	132.4	80%	0.796	78%	0.783	S	S	*	*			trans	-135.1	119.1	175	-30.5	0	0	0	0	109.8	Q2193 S2197	Q2193-S2195 PolarHBondContact O-N 3.02Å; S2195-S2197 PolarHBondContact O-N 3.23Å
2196	G	25.7	Very low	28.2	Very low	79 Å²	79	132.3 Å²	132.3	81%	0.814	80%	0.798	S	S	*	*			trans	-126.9	116	175.1	0	0	0	0	0	112.6	D2194 R2198	D2194-G2196 PolarHBondContact O-N 3.36Å; G2196-R2198 PolarHBondContact O-N 3.39Å; G2196-R2198 VanDerWaalsContact O-N 3.07Å
2197	S	26.9	Very low	27.7	Very low	117.2 Å²	117.2	132 Å²	132	82%	0.82	80%	0.802	S	S	*	*			trans	-114.2	137.8	155.8	171.1	0	0	0	0	111.4	S2195 V2199	S2195-S2197 PolarHBondContact O-N 3.23Å; S2197-V2199 PolarHBondContact O-N 3.19Å
2198	R	25	Very low	27.4	Very low	236.4 Å²	236.4	134 Å²	134	89%	0.892	81%	0.81	S	S	*	*			trans	-115.3	130.5	164.5	-80.7	175.4	177.2	179.8	-1.2	110.1	G2196 N2200	G2196-R2198 PolarHBondContact O-N 3.39Å; G2196-R2198 VanDerWaalsContact O-N 3.07Å; R2198-N2200 PolarHBondContact O-N 3.41Å; R2198-N2200 VanDerWaalsContact O-N 3.16Å
2199	V	27.5	Very low	27.3	Very low	130.8 Å²	130.8	134.6 Å²	134.6	79%	0.793	81%	0.809	S	S	*	*			trans	-130	119	150.5	-179.8	0	0	0	0	109.2	S2197	S2197-V2199 PolarHBondContact O-N 3.19Å
2200	N	26.7	Very low	27.1	Very low	149.4 Å²	149.4	133.5 Å²	133.5	80%	0.799	80%	0.804	S	S	*	*			trans	-101	127.4	156.4	-82.3	-18.3	0	0	0	112.3	R2198 I2202	R2198-N2200 PolarHBondContact O-N 3.41Å; R2198-N2200 VanDerWaalsContact O-N 3.16Å; N2200-I2202 PolarHBondContact O-N 3.02Å
2201	S	26.1	Very low	27	Very low	102.8 Å²	102.8	138.9 Å²	138.9	72%	0.719	81%	0.809	S	S	*	*			trans	-114.5	142.1	134.7	51	0	0	0	0	112
2202	I	28.6	Very low	27	Very low	158 Å²	158	138.3 Å²	138.3	81%	0.81	81%	0.81	S	S	*	*			trans	-146.6	121.3	132.3	-63.2	163.3	0	0	0	110.1	N2200 A2204	N2200-I2202 PolarHBondContact O-N 3.02Å; I2202-A2204 HydrophobicContact CG2-CB 4.5Å; I2202-A2204 PolarHBondContact O-N 3.42Å
2203	L	26.5	Very low	27	Very low	167.8 Å²	167.8	142.8 Å²	142.8	88%	0.879	82%	0.815	S	S	*	*			trans	-95.7	133.3	158.3	-105.6	99.2	0	0	0	110.3	S2205	L2203-S2205 PolarHBondContact O-N 3.41Å; L2203-S2205 VanDerWaalsContact O-N 3.16Å
2204	A	27.4	Very low	26.9	Very low	98.4 Å²	98.4	138.3 Å²	138.3	81%	0.813	81%	0.81	S	S	*	*			trans	-108.7	120.1	160.7	0	0	0	0	0	112.5	I2202	I2202-A2204 HydrophobicContact CG2-CB 4.5Å; I2202-A2204 PolarHBondContact O-N 3.42Å
2205	S	26.6	Very low	27	Very low	108.4 Å²	108.4	139.6 Å²	139.6	76%	0.758	81%	0.811	S	S	*	*			trans	-117	130.9	171.1	101.8	0	0	0	0	110.6	L2203 K2207	L2203-S2205 PolarHBondContact O-N 3.41Å; L2203-S2205 VanDerWaalsContact O-N 3.16Å; S2205-K2207 PolarHBondContact O-N 3.18Å
2206	S	28.2	Very low	27	Very low	119 Å²	119	139.3 Å²	139.3	83%	0.832	81%	0.808	S	S	*	*			trans	-116.9	126.5	158.7	-83.5	0	0	0	0	113.4
2207	K	26.1	Very low	27	Very low	190.2 Å²	190.2	141.2 Å²	141.2	83%	0.827	81%	0.809	S	S	*	*			trans	-113.6	134.4	-174.2	-120.6	178.4	175.5	179.6	0	109.4	S2205 T2209	S2205-K2207 PolarHBondContact O-N 3.18Å; K2207-T2209 PolarHBondContact O-N 3.43Å
2208	M	27.8	Very low	27	Very low	170.8 Å²	170.8	139.3 Å²	139.3	84%	0.841	81%	0.808	S	S	*	*			trans	-113.6	139.9	161.9	-62.9	-149.9	94.4	0	0	112.7
2209	T	27.7	Very low	27.1	Very low	125.6 Å²	125.6	137.1 Å²	137.1	77%	0.771	81%	0.808	S	S	*	*			trans	-117.4	144.3	-157	41.1	0	0	0	0	112.2	K2207	K2207-T2209 PolarHBondContact O-N 3.43Å
2210	S	25.9	Very low	27.1	Very low	101.6 Å²	101.6	135.9 Å²	135.9	71%	0.71	81%	0.806	S	S	*	*			trans	-96.6	140.5	165.2	52.1	0	0	0	0	114.7
2211	E	25.6	Very low	27.2	Very low	190 Å²	190	138.6 Å²	138.6	89%	0.888	81%	0.81	S	S	*	*			trans	120.5	119.9	152.9	-74.5	178.8	-176.4	0	0	116.3
2212	A	27.8	Very low	27.3	Very low	93.4 Å²	93.4	143.2 Å²	143.2	77%	0.772	82%	0.817	S	S	*	*			trans	-145.2	128.8	158.4	0	0	0	0	0	113.1
2213	K	27.5	Very low	27.2	Very low	207.2 Å²	207.2	141.2 Å²	141.2	90%	0.901	82%	0.817	S	S	*	*			trans	102.7	127.1	140.2	-102.4	169.4	178.9	174.2	0	113.6
2214	A	26	Very low	27.3	Very low	88.8 Å²	88.8	139.7 Å²	139.7	73%	0.734	82%	0.815	S	S	*	*				23.5	130.1	124.2	0	0	0	0	0	115.9
2215	Q	28.9	Very low	27.2	Very low	184 Å²	184	143.1 Å²	143.1	86%	0.86	82%	0.819	S	S	*	*				-161.1	133.5	129	-87.3	159.4	-28.2	0	0	114.1
2216	S	27.7	Very low	27.1	Very low	105.6 Å²	105.6	142.5 Å²	142.5	74%	0.738	82%	0.82	S	S	*	*			trans	69.8	127.5	138	55.2	0	0	0	0	117.5
2217	S	26.2	Very low	27	Very low	120 Å²	120	141.9 Å²	141.9	84%	0.839	82%	0.816	S	S	*	*				94.4	119.9	128.5	57.1	0	0	0	0	115.3
2218	G	27.8	Very low	27.1	Very low	77.2 Å²	77.2	140.6 Å²	140.6	80%	0.796	82%	0.818	S	S	*	*			trans	162.1	106	152.5	0	0	0	0	0	111.7	S2220	G2218-S2220 PolarHBondContact O-N 3.4Å
2219	E	27.1	Very low	27.1	Very low	190.2 Å²	190.2	139 Å²	139	89%	0.889	82%	0.817	S	S	*	*			trans	-73.9	137.6	177.8	-68.9	175.5	134	0	0	115.1
2220	S	27.6	Very low	26.9	Very low	106 Å²	106	138 Å²	138	74%	0.741	82%	0.815	S	S	*	*			trans	-175.2	122.2	133.7	-87.8	0	0	0	0	115.8	G2218 K2222	G2218-S2220 PolarHBondContact O-N 3.4Å; S2220-K2222 PolarHBondContact O-N 3.23Å
2221	K	28.3	Very low	27.1	Very low	206.6 Å²	206.6	139 Å²	139	90%	0.898	82%	0.819	S	S	*	*			trans	-111.7	123.8	149.9	-81	161.1	-174.3	171	0	114.6
2222	K	27	Very low	27	Very low	198.6 Å²	198.6	134.9 Å²	134.9	86%	0.863	81%	0.811	S	S	*	*			trans	-99.1	121.8	164.8	-69.9	-179.6	177.1	178.4	0	112.5	S2220	S2220-K2222 PolarHBondContact O-N 3.23Å
2223	S	28.1	Very low	27	Very low	116.4 Å²	116.4	136.6 Å²	136.6	81%	0.814	81%	0.812	S	S	*	*			trans	-103.7	118.2	142.7	59.4	0	0	0	0	112.8	L2225	S2223-L2225 PolarHBondContact O-N 3.1Å; S2223-L2225 VanDerWaalsContact O-N 3.08Å
2224	T	26.8	Very low	27	Very low	135.8 Å²	135.8	134.9 Å²	134.9	83%	0.833	81%	0.81	S	S	*	*			trans	-90.7	122.2	164.1	-53.1	0	0	0	0	111.6
2225	L	25.8	Very low	27	Very low	170 Å²	170	138.7 Å²	138.7	89%	0.89	81%	0.812	S	S	*	*			trans	-83.9	120.7	158.1	-118.7	131	0	0	0	112.2	S2223 S2227	S2223-L2225 PolarHBondContact O-N 3.1Å; S2223-L2225 VanDerWaalsContact O-N 3.08Å; L2225-S2227 PolarHBondContact O-N 3.31Å
2226	A	24.9	Very low	26.9	Very low	95 Å²	95	140.1 Å²	140.1	79%	0.785	82%	0.815	S	S	*	*			trans	-88.6	129.4	174.7	0	0	0	0	0	111
2227	S	26.4	Very low	26.9	Very low	107.8 Å²	107.8	144.2 Å²	144.2	75%	0.754	82%	0.819	S	S	*	*			trans	-124.5	120.6	165.6	146.3	0	0	0	0	109.9	L2225 V2229	L2225-S2227 PolarHBondContact O-N 3.31Å; S2227-V2229 PolarHBondContact O-N 3.12Å; S2227-V2229 VanDerWaalsContact O-N 3.13Å
2228	L	27.4	Very low	27.1	Very low	163 Å²	163	143.2 Å²	143.2	85%	0.853	81%	0.813	S	S	*	*			trans	-24.8	111.6	156.9	-71.7	152.2	0	0	0	112.1	S2230	L2228-S2230 PolarHBondContact O-N 3.01Å
2229	V	27.9	Very low	27.4	Very low	135.2 Å²	135.2	146.2 Å²	146.2	82%	0.819	81%	0.809	S	S	*	*			trans	-91.1	117.5	154.4	-179.7	0	0	0	0	109.8	S2227 P2231	S2227-V2229 PolarHBondContact O-N 3.12Å; S2227-V2229 VanDerWaalsContact O-N 3.13Å; V2229-P2231 WeakPolarHBondContact O-CD 3.43Å
2230	S	24.5	Very low	27.9	Very low	105 Å²	105	139.6 Å²	139.6	73%	0.734	79%	0.792	S	S	*	*			trans	-83.4	134.9	168.8	-60.5	0	0	0	0	109.8	L2228 S2232	L2228-S2230 PolarHBondContact O-N 3.01Å; S2230-S2232 PolarHBondContact O-N 2.97Å
2231	P	28.7	Very low	28.6	Very low	123 Å²	123	141.1 Å²	141.1	80%	0.799	79%	0.792	S	S	*	*			trans	-92.8	115.6	-170.6	31.4	-26.3	0	0	0	110.7	V2229 T2233	V2229-P2231 WeakPolarHBondContact O-CD 3.43Å; P2231-T2233 PolarHBondContact O-N 2.85Å; P2231-T2233 VanDerWaalsContact O-N 3.13Å
2232	S	25.2	Very low	29.7	Very low	103.6 Å²	103.6	134.8 Å²	134.8	72%	0.724	77%	0.767	S	S	*	*			trans	-79	113.3	162.7	46.5	0	0	0	0	113.1	S2230 M2234	S2230-S2232 PolarHBondContact O-N 2.97Å; S2232-M2234 PolarHBondContact O-N 2.99Å; S2232-M2234 VanDerWaalsContact O-N 3.15Å
2233	T	27.5	Very low	31.1	Very low	128.6 Å²	128.6	130.1 Å²	130.1	79%	0.789	75%	0.749	S	S	*	*			trans	17.6	102.2	146.3	32.8	0	0	0	0	115.6	P2231	P2231-T2233 PolarHBondContact O-N 2.85Å; P2231-T2233 VanDerWaalsContact O-N 3.13Å
2234	M	26	Very low	32.9	Very low	171.6 Å²	171.6	128.6 Å²	128.6	85%	0.845	73%	0.728	S	S	*	*			trans	-129.9	119.5	153.3	-77.1	-116.9	81.1	0	0	109.9	S2232 K2236	S2232-M2234 PolarHBondContact O-N 2.99Å; S2232-M2234 VanDerWaalsContact O-N 3.15Å; M2234-K2236 PolarHBondContact O-N 2.83Å
2235	H	27.7	Very low	35.4	Very low	170.2 Å²	170.2	126.2 Å²	126.2	79%	0.788	71%	0.711	S	S	*	*			trans	-54.4	112.5	176	-68	-67.8	0	0	0	114.6	K2237	H2235-K2237 VanDerWaalsContact C-N 3.32Å; H2235-K2237 PolarHBondContact O-N 3.23Å; H2235-K2237 VanDerWaalsContact O-N 3.13Å
2236	K	26.3	Very low	38	Very low	212.4 Å²	212.4	121.6 Å²	121.6	92%	0.923	69%	0.691	S	S	*	*			trans	-73.1	91.4	161.1	-76.5	176.1	179.9	178.7	0	111.2	M2234 S2238	M2234-K2236 PolarHBondContact O-N 2.83Å; K2236-S2238 PolarHBondContact O-N 2.73Å
2237	K	27.1	Very low	40.9	Very low	191 Å²	191	117.1 Å²	117.1	83%	0.83	65%	0.654	S	S	*	*			trans	-76.4	122	163.8	-90.1	-179.7	172.6	-168.3	0	110.4	H2235 I2239 D2241	H2235-K2237 VanDerWaalsContact C-N 3.32Å; H2235-K2237 PolarHBondContact O-N 3.23Å; H2235-K2237 VanDerWaalsContact O-N 3.13Å; K2237-I2239 VanDerWaalsContact C-N 3.33Å; K2237-I2239 PolarHBondContact O-N 3.21Å; K2237-I2239 VanDerWaalsContact O-N 3.08Å; K2237-D2241 WeakPolarHBondContact CB-OD2 3.47Å; K2237-D2241 HydrophobicContact CD-CB 4.48Å; K2237-D2241 VanDerWaalsContact CD-OD2 3.24Å; K2237-D2241 WeakPolarHBondContact CD-OD2 3.41Å; K2237-D2241 WeakPolarHBondContact CG-OD2 3.12Å; K2237-D2241 IonicContact NZ-OD1 2.75Å; K2237-D2241 PolarHBondContact NZ-OD1 3.02Å; K2237-D2241 IonicContact NZ-OD2 2.75Å; K2237-D2241 PolarHBondContact NZ-OD2 3.36Å
2238	S	31.2	Very low	43.6	Very low	100.6 Å²	100.6	114.8 Å²	114.8	70%	0.703	63%	0.633	S	S	*	*			trans	-38.9	111.9	171.3	169.9	0	0	0	0	112.7	K2236 G2240 D2241	K2236-S2238 PolarHBondContact O-N 2.73Å; S2238-G2240 PolarHBondContact O-N 3.34Å; S2238-G2240 VanDerWaalsContact O-N 3.14Å; S2238-D2241 WeakPolarHBondContact CA-OD2 3.49Å; S2238-D2241 PolarHBondContact O-N 3.22Å
2239	I	34.2	Very low	46.2	Very low	139 Å²	139	107.9 Å²	107.9	71%	0.713	60%	0.596	S	S	*	*			trans	-103	53.5	158.4	-89.9	163.7	0	0	0	107.2	K2237 I2242	K2237-I2239 VanDerWaalsContact C-N 3.33Å; K2237-I2239 PolarHBondContact O-N 3.21Å; K2237-I2239 VanDerWaalsContact O-N 3.08Å; I2239-I2242 HydrophobicContact CG1-CD1 3.92Å; I2239-I2242 HydrophobicContact CG2-CD1 4.47Å; I2239-I2242 WeakPolarHBondContact O-CD1 3.35Å; I2239-I2242 VanDerWaalsContact O-CG1 3.29Å; I2239-I2242 WeakPolarHBondContact O-CG1 3.48Å
2240	G	37.7	Very low	48.9	Very low	51.6 Å²	51.6	102.5 Å²	102.5	53%	0.532	56%	0.562	S	S	.	*			trans	-79.3	-10.5	-177.4	0	0	0	0	0	113.5	S2238 I2242 Q2243	S2238-G2240 PolarHBondContact O-N 3.34Å; S2238-G2240 VanDerWaalsContact O-N 3.14Å; G2240-I2242 VanDerWaalsContact C-N 3.29Å; G2240-I2242 PolarHBondContact O-N 3.36Å; G2240-I2242 VanDerWaalsContact O-N 3.12Å; G2240-Q2243 PolarHBondContact O-N 2.84Å; G2240-Q2243 VanDerWaalsContact O-N 3.08Å
2241	D	41.2	Very low	51.8	Low	138.4 Å²	138.4	99.3 Å²	99.3	74%	0.74	54%	0.536	S	S	*	.			trans	-51.8	41.9	173.6	-58.5	-38.3	0	0	0	113.6	K2237 S2238 Q2243	K2237-D2241 WeakPolarHBondContact CB-OD2 3.47Å; K2237-D2241 HydrophobicContact CD-CB 4.48Å; K2237-D2241 VanDerWaalsContact CD-OD2 3.24Å; K2237-D2241 WeakPolarHBondContact CD-OD2 3.41Å; K2237-D2241 WeakPolarHBondContact CG-OD2 3.12Å; K2237-D2241 IonicContact NZ-OD1 2.75Å; K2237-D2241 PolarHBondContact NZ-OD1 3.02Å; K2237-D2241 IonicContact NZ-OD2 2.75Å; K2237-D2241 PolarHBondContact NZ-OD2 3.36Å; S2238-D2241 WeakPolarHBondContact CA-OD2 3.49Å; S2238-D2241 PolarHBondContact O-N 3.22Å; D2241-Q2243 VanDerWaalsContact C-N 3.32Å; D2241-Q2243 PolarHBondContact O-N 3.29Å
2242	I	51.4	Low	54.7	Low	74.4 Å²	74.4	93.4 Å²	93.4	38%	0.382	50%	0.498	S	S	.	.			trans	-77.6	86	170.4	-59.8	174.7	0	0	0	107.3	W2124 I2239 G2240 E2244 I2358 L2362	W2124-I2242 HydrophobicContact CH2-CD1 3.78Å; W2124-I2242 HydrophobicContact CZ3-CD1 4.28Å; I2239-I2242 HydrophobicContact CG1-CD1 3.92Å; I2239-I2242 HydrophobicContact CG2-CD1 4.47Å; I2239-I2242 WeakPolarHBondContact O-CD1 3.35Å; I2239-I2242 VanDerWaalsContact O-CG1 3.29Å; I2239-I2242 WeakPolarHBondContact O-CG1 3.48Å; G2240-I2242 VanDerWaalsContact C-N 3.29Å; G2240-I2242 PolarHBondContact O-N 3.36Å; G2240-I2242 VanDerWaalsContact O-N 3.12Å; I2242-E2244 VanDerWaalsContact C-N 3.31Å; I2242-E2244 PolarHBondContact O-N 3.08Å; I2242-I2358 HydrophobicContact CG2-CD1 3.98Å; I2242-I2358 HydrophobicContact CG2-CG2 4.22Å; I2242-L2362 HydrophobicContact CG2-CD1 4.46Å
2243	Q	56.2	Low	57.7	Low	100 Å²	100	88.5 Å²	88.5	47%	0.467	46%	0.463	S	S	.	.			trans	-55.2	73.8	-178.7	-103	178.7	-21.2	0	0	112.4	P2111 G2240 D2241 N2245	P2111-Q2243 WeakPolarHBondContact CD-O 3.43Å; P2111-Q2243 WeakPolarHBondContact CG-O 3.41Å; G2240-Q2243 PolarHBondContact O-N 2.84Å; G2240-Q2243 VanDerWaalsContact O-N 3.08Å; D2241-Q2243 VanDerWaalsContact C-N 3.32Å; D2241-Q2243 PolarHBondContact O-N 3.29Å; Q2243-N2245 VanDerWaalsContact CD-ND2 3.32Å; Q2243-N2245 WeakPolarHBondContact CG-ND2 3.34Å; Q2243-N2245 WeakPolarHBondContact CG-OD1 3.38Å; Q2243-N2245 PolarHBondContact NE2-ND2 2.91Å; Q2243-N2245 PolarHBondContact O-N 3.18Å; Q2243-N2245 VanDerWaalsContact O-N 3.08Å
2244	E	67.8	Low	60.6	Low	83.4 Å²	83.4	83.5 Å²	83.5	39%	0.39	43%	0.431	S	S	.	.			trans	-84.3	38.6	171.2	-71.5	-111.3	155.5	0	0	111.7	N2110 P2111 S2112 I2242	N2110-E2244 HydrophobicContact CB-CB 4.31Å; N2110-E2244 WeakPolarHBondContact CB-O 3.23Å; N2110-E2244 VanDerWaalsContact CB-OE2 3.32Å; N2110-E2244 WeakPolarHBondContact CB-OE2 3.45Å; N2110-E2244 PolarHBondContact ND2-OE2 3.4Å; P2111-E2244 WeakPolarHBondContact CD-OE2 3.42Å; S2112-E2244 PolarHBondContact N-OE2 3.39Å; S2112-E2244 PolarHBondContact OG-OE1 3.3Å; S2112-E2244 PolarHBondContact OG-OE2 3.41Å; I2242-E2244 VanDerWaalsContact C-N 3.31Å; I2242-E2244 PolarHBondContact O-N 3.08Å
2245	N	77.5	Confident	63.7	Low	86.2 Å²	86.2	75.4 Å²	75.4	46%	0.461	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-65.9	143.4	176	-73.9	-12.2	0	0	0	110.2	P2111 Q2243 L2247	P2111-N2245 WeakPolarHBondContact CD-O 3.31Å; Q2243-N2245 VanDerWaalsContact CD-ND2 3.32Å; Q2243-N2245 WeakPolarHBondContact CG-ND2 3.34Å; Q2243-N2245 WeakPolarHBondContact CG-OD1 3.38Å; Q2243-N2245 PolarHBondContact NE2-ND2 2.91Å; Q2243-N2245 PolarHBondContact O-N 3.18Å; Q2243-N2245 VanDerWaalsContact O-N 3.08Å; N2245-L2247 PolarHBondContact O-N 3.02Å
2246	P	82.2	Confident	66.7	Low	73 Å²	73	67.8 Å²	67.8	47%	0.474	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-60.3	128.3	175	25.7	-34	0	0	0	110	V2107 A2108	V2107-P2246 HydrophobicContact CG1-CB 4.24Å; V2107-P2246 HydrophobicContact CG1-CG 4.49Å; A2108-P2246 HydrophobicContact CB-CB 4.11Å; A2108-P2246 WeakPolarHBondContact O-CA 3.43Å; A2108-P2246 VanDerWaalsContact O-CB 3.27Å; A2108-P2246 WeakPolarHBondContact O-CB 3.24Å
2247	L	84.2	Confident	69.7	Low	1 Å²	1	58.3 Å²	58.3	1%	0.005	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-74.6	133.2	-178.4	-66.3	169.4	0	0	0	110.4	Y2095 A2108 A2109 P2111 A2114 N2245 E2251 F2252 L2255 Y2359	Y2095-L2247 WeakPolarHBondContact CE2-O 3.43Å; Y2095-L2247 PolarHBondContact OH-O 3.1Å; A2108-L2247 WeakPolarHBondContact CB-O 3.39Å; A2109-L2247 VanDerWaalsContact O-CB 3.31Å; A2109-L2247 WeakPolarHBondContact O-CB 3.33Å; A2109-L2247 WeakPolarHBondContact O-CG 3.35Å; A2109-L2247 PolarHBondContact O-N 3.24Å; P2111-L2247 HydrophobicContact CB-CD1 4.39Å; P2111-L2247 HydrophobicContact CG-CD1 4.35Å; P2111-L2247 HydrophobicContact CG-CD2 4.04Å; P2111-L2247 HydrophobicContact CG-CG 4.19Å; A2114-L2247 HydrophobicContact CB-CD1 3.8Å; N2245-L2247 PolarHBondContact O-N 3.02Å; L2247-E2251 HydrophobicContact CB-CB 4.33Å; L2247-E2251 HydrophobicContact CD2-CB 3.68Å; L2247-F2252 HydrophobicContact CB-CB 4.37Å; L2247-F2252 HydrophobicContact CD1-CD2 4.25Å; L2247-L2255 HydrophobicContact CD1-CD2 3.62Å; L2247-Y2359 HydrophobicContact CD2-CE1 3.89Å; L2247-Y2359 HydrophobicContact CD2-CE2 4.33Å; L2247-Y2359 VanDerWaalsContact CD2-CZ 3.48Å; L2247-Y2359 VanDerWaalsContact CD2-OH 3.27Å; L2247-Y2359 WeakPolarHBondContact CD2-OH 3.35Å
2248	N	83.6	Confident	72.7	Confident	59 Å²	59	49.7 Å²	49.7	32%	0.316	28%	0.278	S	S	.	.	P	Polyproline II helix	trans	-73.7	165.1	160.9	70	59.3	0	0	0	110.4	L2250 E2251 F2252	N2248-L2250 VanDerWaalsContact C-N 3.28Å; N2248-L2250 PolarHBondContact O-N 3.02Å; N2248-L2250 WeakPolarHBondContact OD1-CB 3.33Å; N2248-L2250 PolarHBondContact OD1-N 3.23Å; N2248-L2250 VanDerWaalsContact OD1-N 3.12Å; N2248-E2251 VanDerWaalsContact CG-OE2 3.32Å; N2248-E2251 PolarHBondContact N-OE2 3.23Å; N2248-E2251 VanDerWaalsContact N-OE2 3.09Å; N2248-E2251 VanDerWaalsContact ND2-CD 3.34Å; N2248-E2251 WeakPolarHBondContact ND2-CG 3.35Å; N2248-E2251 PolarHBondContact ND2-OE2 3.18Å; N2248-E2251 PolarHBondContact O-N 3.11Å; N2248-E2251 VanDerWaalsContact O-N 3.08Å; N2248-E2251 VanDerWaalsContact OD1-CG 3.3Å; N2248-E2251 WeakPolarHBondContact OD1-CG 3.36Å; N2248-E2251 PolarHBondContact OD1-N 3.05Å; N2248-F2252 WeakPolarHBondContact O-CB 3.38Å; N2248-F2252 PolarHBondContact O-N 2.97Å
2249	F	82.5	Confident	75.6	Confident	19 Å²	19	45 Å²	45	8%	0.083	25%	0.245	C	C	.	.	H	α-helix	trans	-58.9	-34.3	-176	-176.5	-112.3	0	0	0	113.7	P1870 L1872 L2088 L2091 R2092 Y2095 F2252 T2253 I2333	P1870-F2249 HydrophobicContact CB-CB 4.19Å; P1870-F2249 HydrophobicContact CB-CD1 4.04Å; P1870-F2249 HydrophobicContact CB-CD2 4.32Å; P1870-F2249 HydrophobicContact CB-CG 4.09Å; P1870-F2249 HydrophobicContact CG-CB 3.78Å; P1870-F2249 HydrophobicContact CG-CD1 3.84Å; P1870-F2249 HydrophobicContact CG-CD2 4.18Å; P1870-F2249 HydrophobicContact CG-CG 3.78Å; L1872-F2249 HydrophobicContact CD1-CD1 4.07Å; L1872-F2249 HydrophobicContact CD1-CE1 3.15Å; L1872-F2249 HydrophobicContact CD1-CZ 3.43Å; L1872-F2249 VanDerWaalsContact CD1-CZ 3.43Å; L1872-F2249 HydrophobicContact CD2-CE1 3.93Å; L1872-F2249 HydrophobicContact CG-CD1 4.45Å; L1872-F2249 HydrophobicContact CG-CE1 3.83Å; L2088-F2249 HydrophobicContact CD1-CE1 4.26Å; L2088-F2249 HydrophobicContact CD1-CZ 4.08Å; L2091-F2249 HydrophobicContact CB-CE2 4.37Å; L2091-F2249 HydrophobicContact CB-CZ 4.45Å; R2092-F2249 HydrophobicContact CB-CE2 4.4Å; R2092-F2249 HydrophobicContact CB-CZ 4.26Å; R2092-F2249 HydrophobicContact CG-CE1 3.95Å; R2092-F2249 HydrophobicContact CG-CE2 3.97Å; R2092-F2249 HydrophobicContact CG-CZ 3.36Å; R2092-F2249 VanDerWaalsContact CG-CZ 3.44Å; Y2095-F2249 HydrophobicContact CD1-CB 4.33Å; Y2095-F2249 AromaticContact CD1-CD2 3.88Å; Y2095-F2249 HydrophobicContact CD1-CD2 3.96Å; Y2095-F2249 HydrophobicContact CD1-CG 4.39Å; Y2095-F2249 HydrophobicContact CD2-CB 4.44Å; Y2095-F2249 AromaticContact CD2-CD2 3.95Å; Y2095-F2249 HydrophobicContact CD2-CD2 4.01Å; Y2095-F2249 HydrophobicContact CE1-CB 4.26Å; Y2095-F2249 HydrophobicContact CE1-CD2 4.33Å; Y2095-F2249 HydrophobicContact CE2-CB 4.29Å; Y2095-F2249 HydrophobicContact CE2-CD2 4.49Å; Y2095-F2249 AromaticContact CG-CD2 3.64Å; Y2095-F2249 HydrophobicContact CG-CD2 3.64Å; Y2095-F2249 HydrophobicContact CG-CE2 4.37Å; Y2095-F2249 PolarHBondContact OH-N 3.06Å; F2249-F2252 HydrophobicContact CD2-CD1 4.42Å; F2249-F2252 HydrophobicContact CE2-CD1 4.43Å; F2249-F2252 WeakPolarHBondContact O-CB 3.48Å; F2249-F2252 PolarHBondContact O-N 3.16Å; F2249-T2253 HydrophobicContact CD1-CG2 4.22Å; F2249-T2253 HydrophobicContact CD2-CG2 4.34Å; F2249-T2253 HydrophobicContact CE1-CG2 3.7Å; F2249-T2253 HydrophobicContact CE2-CG2 3.84Å; F2249-T2253 HydrophobicContact CG-CG2 4.46Å; F2249-T2253 HydrophobicContact CZ-CG2 3.5Å; F2249-T2253 VanDerWaalsContact CZ-CG2 3.46Å; F2249-T2253 WeakPolarHBondContact O-CB 3.28Å; F2249-T2253 VanDerWaalsContact O-CG2 3.32Å; F2249-T2253 WeakPolarHBondContact O-CG2 3.32Å; F2249-T2253 PolarHBondContact O-N 3.22Å; F2249-T2253 PolarHBondContact O-OG1 3.26Å; F2249-I2333 HydrophobicContact CB-CD1 3.96Å; F2249-I2333 HydrophobicContact CD1-CB 4.33Å; F2249-I2333 HydrophobicContact CD1-CD1 3.74Å; F2249-I2333 HydrophobicContact CD1-CG1 4.16Å; F2249-I2333 HydrophobicContact CD1-CG2 3.81Å; F2249-I2333 HydrophobicContact CE1-CB 4.17Å; F2249-I2333 HydrophobicContact CE1-CG2 3.57Å; F2249-I2333 VanDerWaalsContact CE1-CG2 3.44Å; F2249-I2333 HydrophobicContact CG-CD1 4.32Å; F2249-I2333 HydrophobicContact CZ-CG2 4.37Å
2250	L	83.3	Confident	78.3	Confident	21.4 Å²	21.4	39.1 Å²	39.1	11%	0.112	22%	0.216	C	C	.	.	H	α-helix	trans	-62.7	-48.7	175.1	172.9	64.2	0	0	0	111.1	N2248 F2252 T2253 E2254 N2329 F2332 I2333 I2345 T2347 K2349 R2350 I2351	N2248-L2250 VanDerWaalsContact C-N 3.28Å; N2248-L2250 PolarHBondContact O-N 3.02Å; N2248-L2250 WeakPolarHBondContact OD1-CB 3.33Å; N2248-L2250 PolarHBondContact OD1-N 3.23Å; N2248-L2250 VanDerWaalsContact OD1-N 3.12Å; L2250-F2252 VanDerWaalsContact C-N 3.33Å; L2250-F2252 PolarHBondContact O-N 3.3Å; L2250-T2253 WeakPolarHBondContact CA-OG1 3.45Å; L2250-T2253 PolarHBondContact O-N 3.21Å; L2250-T2253 PolarHBondContact O-OG1 3.22Å; L2250-E2254 HydrophobicContact CD1-CG 4.13Å; L2250-E2254 WeakPolarHBondContact O-CB 3.27Å; L2250-E2254 WeakPolarHBondContact O-CG 3.43Å; L2250-E2254 PolarHBondContact O-N 3.06Å; L2250-N2329 HydrophobicContact CB-CB 4.27Å; L2250-N2329 HydrophobicContact CD2-CB 3.83Å; L2250-F2332 HydrophobicContact CB-CD1 3.98Å; L2250-F2332 HydrophobicContact CB-CE1 3.72Å; L2250-F2332 HydrophobicContact CB-CZ 4.28Å; L2250-F2332 HydrophobicContact CD1-CD1 4.07Å; L2250-F2332 HydrophobicContact CD1-CE1 4.05Å; L2250-F2332 HydrophobicContact CD1-CE2 4.07Å; L2250-F2332 HydrophobicContact CD1-CZ 3.49Å; L2250-F2332 VanDerWaalsContact CD1-CZ 3.49Å; L2250-F2332 HydrophobicContact CD2-CE2 4.48Å; L2250-F2332 HydrophobicContact CD2-CZ 4.46Å; L2250-F2332 HydrophobicContact CG-CE1 4.21Å; L2250-F2332 HydrophobicContact CG-CZ 4.26Å; L2250-I2333 HydrophobicContact CB-CG1 4.38Å; L2250-I2333 HydrophobicContact CD1-CD1 3.66Å; L2250-I2333 HydrophobicContact CD1-CG1 3.98Å; L2250-I2345 HydrophobicContact CB-CG2 4.37Å; L2250-I2345 HydrophobicContact CD1-CB 4.08Å; L2250-I2345 HydrophobicContact CD1-CD1 4.4Å; L2250-I2345 HydrophobicContact CD1-CG1 3.56Å; L2250-I2345 HydrophobicContact CD1-CG2 3.37Å; L2250-I2345 WeakPolarHBondContact CD1-O 3.43Å; L2250-I2345 HydrophobicContact CG-CG2 4.3Å; L2250-T2347 HydrophobicContact CD1-CG2 3.63Å; L2250-K2349 HydrophobicContact CD2-CB 3.81Å; L2250-R2350 HydrophobicContact CD2-CB 4.18Å; L2250-I2351 HydrophobicContact CD1-CD1 4.36Å; L2250-I2351 HydrophobicContact CG-CD1 4.28Å; L2250-I2351 HydrophobicContact CG-CG1 4.43Å
2251	E	87.2	Confident	80.8	Confident	37.2 Å²	37.2	36.8 Å²	36.8	17%	0.174	19%	0.191	C	C	.	.	H	α-helix	trans	-64.8	-37.6	177.2	-64.4	173.4	128.3	0	0	112	L2247 N2248 T2253 E2254 L2255 I2351 Y2359	L2247-E2251 HydrophobicContact CB-CB 4.33Å; L2247-E2251 HydrophobicContact CD2-CB 3.68Å; N2248-E2251 VanDerWaalsContact CG-OE2 3.32Å; N2248-E2251 PolarHBondContact N-OE2 3.23Å; N2248-E2251 VanDerWaalsContact N-OE2 3.09Å; N2248-E2251 VanDerWaalsContact ND2-CD 3.34Å; N2248-E2251 WeakPolarHBondContact ND2-CG 3.35Å; N2248-E2251 PolarHBondContact ND2-OE2 3.18Å; N2248-E2251 PolarHBondContact O-N 3.11Å; N2248-E2251 VanDerWaalsContact O-N 3.08Å; N2248-E2251 VanDerWaalsContact OD1-CG 3.3Å; N2248-E2251 WeakPolarHBondContact OD1-CG 3.36Å; N2248-E2251 PolarHBondContact OD1-N 3.05Å; E2251-T2253 VanDerWaalsContact C-N 3.32Å; E2251-T2253 PolarHBondContact O-N 3.15Å; E2251-E2254 PolarHBondContact O-N 3.06Å; E2251-L2255 VanDerWaalsContact O-CB 3.27Å; E2251-L2255 WeakPolarHBondContact O-CB 3.3Å; E2251-L2255 PolarHBondContact O-N 2.91Å; E2251-I2351 HydrophobicContact CB-CD1 4.25Å; E2251-I2351 HydrophobicContact CG-CD1 3.71Å; E2251-I2351 HydrophobicContact CG-CG1 4.01Å; E2251-Y2359 HydrophobicContact CB-CE2 4.2Å; E2251-Y2359 VanDerWaalsContact CD-OH 3.28Å; E2251-Y2359 HydrophobicContact CG-CE2 4.23Å; E2251-Y2359 PolarHBondContact OE1-OH 3.02Å
2252	F	88.4	Confident	83.1	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-60.7	-45.4	174.1	-174.7	-96.2	0	0	0	112	L2091 L2094 Y2095 L2098 A2109 A2114 F2118 L2247 N2248 F2249 L2250 L2255 F2256	L2091-F2252 HydrophobicContact CB-CE1 4.44Å; L2091-F2252 HydrophobicContact CD2-CD1 4.28Å; L2091-F2252 HydrophobicContact CD2-CE1 3.84Å; L2094-F2252 HydrophobicContact CB-CZ 4.45Å; L2094-F2252 HydrophobicContact CD2-CZ 4.17Å; L2094-F2252 HydrophobicContact CG-CZ 4.16Å; Y2095-F2252 HydrophobicContact CD2-CB 3.8Å; Y2095-F2252 AromaticContact CD2-CD1 3.88Å; Y2095-F2252 HydrophobicContact CD2-CD1 3.88Å; Y2095-F2252 AromaticContact CD2-CD2 3.83Å; Y2095-F2252 HydrophobicContact CD2-CD2 3.83Å; Y2095-F2252 HydrophobicContact CD2-CE1 4.35Å; Y2095-F2252 HydrophobicContact CD2-CE2 4.31Å; Y2095-F2252 AromaticContact CD2-CG 3.58Å; Y2095-F2252 HydrophobicContact CD2-CG 3.58Å; Y2095-F2252 HydrophobicContact CD2-CZ 4.45Å; Y2095-F2252 HydrophobicContact CE2-CB 4.08Å; Y2095-F2252 HydrophobicContact CE2-CD2 4.44Å; Y2095-F2252 HydrophobicContact CE2-CG 4.3Å; Y2095-F2252 HydrophobicContact CG-CD1 4.4Å; Y2095-F2252 HydrophobicContact CG-CG 4.39Å; L2098-F2252 HydrophobicContact CD1-CE2 3.82Å; L2098-F2252 HydrophobicContact CD1-CZ 3.95Å; A2109-F2252 HydrophobicContact CB-CE2 4.5Å; A2114-F2252 HydrophobicContact CB-CD2 3.67Å; A2114-F2252 HydrophobicContact CB-CE2 3.5Å; A2114-F2252 VanDerWaalsContact CB-CE2 3.47Å; F2118-F2252 HydrophobicContact CD1-CZ 4.45Å; F2118-F2252 HydrophobicContact CE1-CD1 4.37Å; F2118-F2252 AromaticContact CE1-CE1 3.61Å; F2118-F2252 HydrophobicContact CE1-CE1 3.61Å; F2118-F2252 AromaticContact CE1-CE2 3.87Å; F2118-F2252 HydrophobicContact CE1-CE2 3.87Å; F2118-F2252 AromaticContact CE1-CZ 3.33Å; F2118-F2252 HydrophobicContact CE1-CZ 3.33Å; F2118-F2252 VanDerWaalsContact CE1-CZ 3.41Å; F2118-F2252 HydrophobicContact CZ-CD1 4.09Å; F2118-F2252 AromaticContact CZ-CD2 3.96Å; F2118-F2252 HydrophobicContact CZ-CD2 3.99Å; F2118-F2252 AromaticContact CZ-CE1 3.77Å; F2118-F2252 HydrophobicContact CZ-CE1 3.77Å; F2118-F2252 AromaticContact CZ-CE2 3.67Å; F2118-F2252 HydrophobicContact CZ-CE2 3.67Å; F2118-F2252 HydrophobicContact CZ-CG 4.2Å; F2118-F2252 AromaticContact CZ-CZ 3.56Å; F2118-F2252 HydrophobicContact CZ-CZ 3.56Å; L2247-F2252 HydrophobicContact CB-CB 4.37Å; L2247-F2252 HydrophobicContact CD1-CD2 4.25Å; N2248-F2252 WeakPolarHBondContact O-CB 3.38Å; N2248-F2252 PolarHBondContact O-N 2.97Å; F2249-F2252 HydrophobicContact CD2-CD1 4.42Å; F2249-F2252 HydrophobicContact CE2-CD1 4.43Å; F2249-F2252 WeakPolarHBondContact O-CB 3.48Å; F2249-F2252 PolarHBondContact O-N 3.16Å; L2250-F2252 VanDerWaalsContact C-N 3.33Å; L2250-F2252 PolarHBondContact O-N 3.3Å; F2252-L2255 PolarHBondContact O-N 3.04Å; F2252-F2256 PolarHBondContact O-N 3.13Å
2253	T	88	Confident	84.9	Confident	0.4 Å²	0.4	28.9 Å²	28.9	0%	0.002	15%	0.148	C	C	.	.	H	α-helix	trans	-67	-38.9	176.7	45	0	0	0	0	112.6	L2088 L2091 F2249 L2250 E2251 F2256 K2257 I2333 L2341	L2088-T2253 HydrophobicContact CD1-CG2 4.24Å; L2091-T2253 HydrophobicContact CB-CG2 4.22Å; L2091-T2253 HydrophobicContact CD1-CG2 4.05Å; F2249-T2253 HydrophobicContact CD1-CG2 4.22Å; F2249-T2253 HydrophobicContact CD2-CG2 4.34Å; F2249-T2253 HydrophobicContact CE1-CG2 3.7Å; F2249-T2253 HydrophobicContact CE2-CG2 3.84Å; F2249-T2253 HydrophobicContact CG-CG2 4.46Å; F2249-T2253 HydrophobicContact CZ-CG2 3.5Å; F2249-T2253 VanDerWaalsContact CZ-CG2 3.46Å; F2249-T2253 WeakPolarHBondContact O-CB 3.28Å; F2249-T2253 VanDerWaalsContact O-CG2 3.32Å; F2249-T2253 WeakPolarHBondContact O-CG2 3.32Å; F2249-T2253 PolarHBondContact O-N 3.22Å; F2249-T2253 PolarHBondContact O-OG1 3.26Å; L2250-T2253 WeakPolarHBondContact CA-OG1 3.45Å; L2250-T2253 PolarHBondContact O-N 3.21Å; L2250-T2253 PolarHBondContact O-OG1 3.22Å; E2251-T2253 VanDerWaalsContact C-N 3.32Å; E2251-T2253 PolarHBondContact O-N 3.15Å; T2253-F2256 WeakPolarHBondContact O-CB 3.35Å; T2253-F2256 PolarHBondContact O-N 3.12Å; T2253-K2257 VanDerWaalsContact O-CG 3.29Å; T2253-K2257 WeakPolarHBondContact O-CG 3.3Å; T2253-K2257 PolarHBondContact O-N 3.15Å; T2253-I2333 HydrophobicContact CG2-CD1 4.33Å; T2253-L2341 HydrophobicContact CG2-CD1 3.62Å
2254	E	87.9	Confident	86.6	Confident	24.2 Å²	24.2	26 Å²	26	11%	0.113	13%	0.133	C	C	.	.	H	α-helix	trans	-69.6	-38.8	176.7	-85.6	-49.2	148.9	0	0	112.2	L2250 E2251 F2256 K2257 L2258 I2345 S2346 T2347 S2348 I2351 M2356	L2250-E2254 HydrophobicContact CD1-CG 4.13Å; L2250-E2254 WeakPolarHBondContact O-CB 3.27Å; L2250-E2254 WeakPolarHBondContact O-CG 3.43Å; L2250-E2254 PolarHBondContact O-N 3.06Å; E2251-E2254 PolarHBondContact O-N 3.06Å; E2254-F2256 VanDerWaalsContact C-N 3.29Å; E2254-F2256 PolarHBondContact O-N 3.07Å; E2254-K2257 WeakPolarHBondContact O-CB 3.23Å; E2254-K2257 PolarHBondContact O-N 3.27Å; E2254-K2257 VanDerWaalsContact O-N 3.15Å; E2254-K2257 WeakPolarHBondContact OE1-CD 3.41Å; E2254-K2257 VanDerWaalsContact OE1-CE 3.31Å; E2254-K2257 WeakPolarHBondContact OE1-CE 3.35Å; E2254-K2257 IonicContact OE1-NZ 3.08Å; E2254-K2257 PolarHBondContact OE1-NZ 3.09Å; E2254-K2257 WeakPolarHBondContact OE2-CD 3.35Å; E2254-K2257 IonicContact OE2-NZ 2.68Å; E2254-K2257 PolarHBondContact OE2-NZ 3.08Å; E2254-L2258 WeakPolarHBondContact O-CG 3.4Å; E2254-L2258 PolarHBondContact O-N 3.22Å; E2254-L2258 VanDerWaalsContact O-N 3.08Å; E2254-I2345 WeakPolarHBondContact OE1-CG2 3.48Å; E2254-S2346 PolarHBondContact OE2-OG 2.98Å; E2254-T2347 VanDerWaalsContact OE1-CB 3.24Å; E2254-T2347 WeakPolarHBondContact OE1-CB 3.18Å; E2254-T2347 PolarHBondContact OE1-OG1 3.18Å; E2254-S2348 PolarHBondContact OE2-OG 3.27Å; E2254-I2351 HydrophobicContact CB-CD1 4.02Å; E2254-I2351 HydrophobicContact CG-CD1 4.04Å; E2254-M2356 HydrophobicContact CB-CE 3.92Å; E2254-M2356 HydrophobicContact CB-SD 4.44Å; E2254-M2356 HydrophobicContact CG-CE 3.81Å; E2254-M2356 HydrophobicContact CG-SD 3.67Å; E2254-M2356 WeakPolarHBondContact OE2-CE 3.33Å
2255	L	91.1	Very high	87.7	Confident	0 Å²	0	26.1 Å²	26.1	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-60.2	-40.8	172.1	-177.5	63.3	0	0	0	111.3	P2111 A2114 L2115 F2118 L2247 E2251 F2252 L2258 F2259 Y2359 A2363	P2111-L2255 HydrophobicContact CB-CD2 4.12Å; A2114-L2255 HydrophobicContact CB-CD2 4.03Å; L2115-L2255 HydrophobicContact CD1-CD1 4.37Å; L2115-L2255 HydrophobicContact CD1-CD2 4.42Å; L2115-L2255 HydrophobicContact CD2-CD1 4.06Å; L2115-L2255 HydrophobicContact CD2-CD2 4.4Å; L2115-L2255 HydrophobicContact CD2-CG 4.11Å; L2115-L2255 HydrophobicContact CG-CD1 4.31Å; L2115-L2255 HydrophobicContact CG-CD2 4.08Å; L2115-L2255 HydrophobicContact CG-CG 4.3Å; F2118-L2255 HydrophobicContact CE2-CB 4.46Å; F2118-L2255 HydrophobicContact CE2-CD2 4.37Å; F2118-L2255 HydrophobicContact CE2-CG 4.16Å; L2247-L2255 HydrophobicContact CD1-CD2 3.62Å; E2251-L2255 VanDerWaalsContact O-CB 3.27Å; E2251-L2255 WeakPolarHBondContact O-CB 3.3Å; E2251-L2255 PolarHBondContact O-N 2.91Å; F2252-L2255 PolarHBondContact O-N 3.04Å; L2255-L2258 PolarHBondContact O-N 3.13Å; L2255-F2259 WeakPolarHBondContact O-CB 3.4Å; L2255-F2259 PolarHBondContact O-N 3.01Å; L2255-Y2359 HydrophobicContact CD1-CD1 4.33Å; L2255-Y2359 HydrophobicContact CD1-CG 4.16Å; L2255-A2363 HydrophobicContact CD1-CB 4.36Å
2256	F	91.7	Very high	88.4	Confident	11.4 Å²	11.4	24 Å²	24	5%	0.05	12%	0.121	C	C	.	.	H	α-helix	trans	-63	-43.1	173.2	177.9	-102	0	0	0	112.6	W2090 L2091 F2118 F2252 T2253 E2254 L2258 F2259 S2260 L2341 M2342 F2939 Y3037	W2090-F2256 HydrophobicContact CE3-CE2 4.38Å; W2090-F2256 HydrophobicContact CE3-CZ 4.45Å; W2090-F2256 HydrophobicContact CH2-CD2 4.37Å; W2090-F2256 AromaticContact CH2-CE2 3.86Å; W2090-F2256 HydrophobicContact CH2-CE2 3.91Å; W2090-F2256 HydrophobicContact CH2-CZ 4.42Å; W2090-F2256 AromaticContact CZ3-CD2 3.85Å; W2090-F2256 HydrophobicContact CZ3-CD2 3.85Å; W2090-F2256 HydrophobicContact CZ3-CE1 4.42Å; W2090-F2256 AromaticContact CZ3-CE2 3.4Å; W2090-F2256 HydrophobicContact CZ3-CE2 3.4Å; W2090-F2256 VanDerWaalsContact CZ3-CE2 3.44Å; W2090-F2256 AromaticContact CZ3-CZ 3.74Å; W2090-F2256 HydrophobicContact CZ3-CZ 3.81Å; L2091-F2256 HydrophobicContact CD1-CB 4.26Å; L2091-F2256 HydrophobicContact CD1-CD1 3.58Å; L2091-F2256 HydrophobicContact CD1-CE1 4.13Å; L2091-F2256 HydrophobicContact CD1-CG 4.04Å; L2091-F2256 HydrophobicContact CD2-CB 3.7Å; L2091-F2256 HydrophobicContact CD2-CD1 3.94Å; L2091-F2256 HydrophobicContact CD2-CD2 3.89Å; L2091-F2256 HydrophobicContact CD2-CE1 4.43Å; L2091-F2256 HydrophobicContact CD2-CE2 4.45Å; L2091-F2256 HydrophobicContact CD2-CG 3.56Å; L2091-F2256 VanDerWaalsContact CD2-CG 3.46Å; L2091-F2256 HydrophobicContact CG-CD1 4.19Å; L2091-F2256 HydrophobicContact CG-CE1 4.46Å; L2091-F2256 HydrophobicContact CG-CG 4.31Å; F2118-F2256 HydrophobicContact CB-CD2 4.39Å; F2118-F2256 AromaticContact CD1-CD2 3.82Å; F2118-F2256 HydrophobicContact CD1-CD2 3.82Å; F2118-F2256 HydrophobicContact CD1-CE2 4.45Å; F2118-F2256 HydrophobicContact CD2-CB 4.34Å; F2118-F2256 HydrophobicContact CD2-CD2 4.18Å; F2118-F2256 HydrophobicContact CE1-CB 4.13Å; F2118-F2256 AromaticContact CE1-CD2 3.98Å; F2118-F2256 HydrophobicContact CE1-CD2 4.04Å; F2118-F2256 HydrophobicContact CE1-CG 4.45Å; F2118-F2256 HydrophobicContact CE2-CB 3.81Å; F2118-F2256 HydrophobicContact CE2-CD2 4.38Å; F2118-F2256 AromaticContact CG-CD2 3.87Å; F2118-F2256 HydrophobicContact CG-CD2 3.91Å; F2118-F2256 HydrophobicContact CZ-CB 3.7Å; F2118-F2256 HydrophobicContact CZ-CD2 4.36Å; F2118-F2256 HydrophobicContact CZ-CG 4.48Å; F2252-F2256 PolarHBondContact O-N 3.13Å; T2253-F2256 WeakPolarHBondContact O-CB 3.35Å; T2253-F2256 PolarHBondContact O-N 3.12Å; E2254-F2256 VanDerWaalsContact C-N 3.29Å; E2254-F2256 PolarHBondContact O-N 3.07Å; F2256-L2258 VanDerWaalsContact C-N 3.31Å; F2256-L2258 PolarHBondContact O-N 2.87Å; F2256-F2259 HydrophobicContact CD2-CD1 4.43Å; F2256-F2259 HydrophobicContact CE2-CD1 4.14Å; F2256-F2259 CarbonylContact O-C 3.54Å; F2256-F2259 WeakPolarHBondContact O-CB 3.3Å; F2256-F2259 PolarHBondContact O-N 2.99Å; F2256-F2259 VanDerWaalsContact O-N 3.11Å; F2256-S2260 WeakPolarHBondContact CE1-OG 3.28Å; F2256-S2260 WeakPolarHBondContact CE2-OG 3.42Å; F2256-S2260 WeakPolarHBondContact CZ-OG 3.11Å; F2256-S2260 VanDerWaalsContact O-CB 3.26Å; F2256-S2260 WeakPolarHBondContact O-CB 3.29Å; F2256-S2260 PolarHBondContact O-N 3.06Å; F2256-S2260 PolarHBondContact O-OG 3.12Å; F2256-L2341 HydrophobicContact CD1-CD2 4.4Å; F2256-L2341 HydrophobicContact CE1-CD2 4.29Å; F2256-M2342 HydrophobicContact CE1-CE 4.37Å; F2256-F2939 HydrophobicContact CE2-CZ 4.49Å; F2256-Y3037 HydrophobicContact CE1-CD2 4.47Å; F2256-Y3037 AromaticContact CE1-CE2 3.54Å; F2256-Y3037 HydrophobicContact CE1-CE2 3.54Å; F2256-Y3037 HydrophobicContact CZ-CD2 4.13Å; F2256-Y3037 AromaticContact CZ-CE2 3.34Å; F2256-Y3037 HydrophobicContact CZ-CE2 3.34Å; F2256-Y3037 AromaticContact CZ-CZ 3.62Å
2257	K	89.6	Confident	88.9	Confident	14 Å²	14	20.8 Å²	20.8	6%	0.061	10%	0.1	C	C	.	.	H	α-helix	trans	-58.6	-44.7	177.1	-69.6	173.4	-161	178.7	0	111.3	T2253 E2254 S2260 I2261 L2341 M2342 Q2344 S2346 T2347	T2253-K2257 VanDerWaalsContact O-CG 3.29Å; T2253-K2257 WeakPolarHBondContact O-CG 3.3Å; T2253-K2257 PolarHBondContact O-N 3.15Å; E2254-K2257 WeakPolarHBondContact O-CB 3.23Å; E2254-K2257 PolarHBondContact O-N 3.27Å; E2254-K2257 VanDerWaalsContact O-N 3.15Å; E2254-K2257 WeakPolarHBondContact OE1-CD 3.41Å; E2254-K2257 VanDerWaalsContact OE1-CE 3.31Å; E2254-K2257 WeakPolarHBondContact OE1-CE 3.35Å; E2254-K2257 IonicContact OE1-NZ 3.08Å; E2254-K2257 PolarHBondContact OE1-NZ 3.09Å; E2254-K2257 WeakPolarHBondContact OE2-CD 3.35Å; E2254-K2257 IonicContact OE2-NZ 2.68Å; E2254-K2257 PolarHBondContact OE2-NZ 3.08Å; K2257-S2260 PolarHBondContact O-N 3.06Å; K2257-I2261 WeakPolarHBondContact O-CB 3.47Å; K2257-I2261 WeakPolarHBondContact O-CD1 3.46Å; K2257-I2261 VanDerWaalsContact O-CG1 3.28Å; K2257-I2261 WeakPolarHBondContact O-CG1 3.41Å; K2257-I2261 PolarHBondContact O-N 3.12Å; K2257-I2261 VanDerWaalsContact O-N 3.12Å; K2257-L2341 WeakPolarHBondContact CD-O 3.43Å; K2257-L2341 WeakPolarHBondContact CE-O 3.33Å; K2257-L2341 PolarHBondContact NZ-O 3.14Å; K2257-L2341 VanDerWaalsContact NZ-O 3.11Å; K2257-M2342 HydrophobicContact CD-CE 3.97Å; K2257-M2342 VanDerWaalsContact CE-SD 3.59Å; K2257-M2342 HydrophobicContact CG-CE 4.04Å; K2257-M2342 HydrophobicContact CG-SD 4.2Å; K2257-M2342 PolarHBondContact NZ-O 3.07Å; K2257-M2342 PolarHBondContact NZ-SD 3.21Å; K2257-Q2344 PolarHBondContact NZ-O 2.96Å; K2257-S2346 PolarHBondContact NZ-OG 3.02Å; K2257-T2347 PolarHBondContact NZ-OG1 3.03Å
2258	L	89.7	Confident	89.2	Confident	10.4 Å²	10.4	22.3 Å²	22.3	5%	0.054	11%	0.105	C	C	.	.	H	α-helix	trans	-60.6	-51.1	175.5	-68.1	170.6	0	0	0	110.7	E2254 L2255 F2256 S2260 I2261 R2262 M2356 D2360 A2363	E2254-L2258 WeakPolarHBondContact O-CG 3.4Å; E2254-L2258 PolarHBondContact O-N 3.22Å; E2254-L2258 VanDerWaalsContact O-N 3.08Å; L2255-L2258 PolarHBondContact O-N 3.13Å; F2256-L2258 VanDerWaalsContact C-N 3.31Å; F2256-L2258 PolarHBondContact O-N 2.87Å; L2258-S2260 VanDerWaalsContact C-N 3.34Å; L2258-S2260 PolarHBondContact O-N 3.23Å; L2258-I2261 PolarHBondContact O-N 3.01Å; L2258-I2261 VanDerWaalsContact O-N 3.13Å; L2258-R2262 WeakPolarHBondContact O-CB 3.42Å; L2258-R2262 VanDerWaalsContact O-CG 3.25Å; L2258-R2262 WeakPolarHBondContact O-CG 3.31Å; L2258-R2262 PolarHBondContact O-N 3.17Å; L2258-M2356 HydrophobicContact CD1-CE 3.88Å; L2258-M2356 HydrophobicContact CD1-CG 4.47Å; L2258-M2356 HydrophobicContact CD1-SD 3.85Å; L2258-M2356 HydrophobicContact CD2-CE 4.47Å; L2258-M2356 HydrophobicContact CG-CE 4.35Å; L2258-M2356 HydrophobicContact CG-SD 4.46Å; L2258-D2360 HydrophobicContact CD1-CB 4.16Å; L2258-D2360 HydrophobicContact CD2-CB 4.29Å; L2258-A2363 HydrophobicContact CB-CB 4.14Å
2259	F	91.4	Very high	89.6	Confident	1.8 Å²	1.8	22.8 Å²	22.8	1%	0.008	11%	0.108	C	C	.	.	H	α-helix	trans	-56.9	-48.1	177.2	179.3	-97.7	0	0	0	112.7	L2115 F2118 L2255 F2256 I2261 R2262 M2263 A2363 S2366 I2367 F2939 L2975	L2115-F2259 HydrophobicContact CD2-CB 4.08Å; L2115-F2259 HydrophobicContact CD2-CD2 3.71Å; L2115-F2259 HydrophobicContact CD2-CE2 4.43Å; L2115-F2259 HydrophobicContact CD2-CG 4.14Å; F2118-F2259 HydrophobicContact CB-CD1 3.64Å; F2118-F2259 HydrophobicContact CB-CE1 3.53Å; F2118-F2259 VanDerWaalsContact CB-CE1 3.43Å; F2118-F2259 HydrophobicContact CB-CG 4.29Å; F2118-F2259 HydrophobicContact CB-CZ 4.11Å; F2118-F2259 HydrophobicContact CD2-CB 4.39Å; F2118-F2259 HydrophobicContact CD2-CD1 4.26Å; F2118-F2259 HydrophobicContact CD2-CG 4.38Å; F2118-F2259 HydrophobicContact CG-CD1 4.29Å; F2118-F2259 VanDerWaalsContact O-CE1 3.24Å; F2118-F2259 WeakPolarHBondContact O-CE1 3.3Å; F2118-F2259 WeakPolarHBondContact O-CZ 3.29Å; L2255-F2259 WeakPolarHBondContact O-CB 3.4Å; L2255-F2259 PolarHBondContact O-N 3.01Å; F2256-F2259 HydrophobicContact CD2-CD1 4.43Å; F2256-F2259 HydrophobicContact CE2-CD1 4.14Å; F2256-F2259 CarbonylContact O-C 3.54Å; F2256-F2259 WeakPolarHBondContact O-CB 3.3Å; F2256-F2259 PolarHBondContact O-N 2.99Å; F2256-F2259 VanDerWaalsContact O-N 3.11Å; F2259-I2261 VanDerWaalsContact C-N 3.28Å; F2259-I2261 PolarHBondContact O-N 2.96Å; F2259-R2262 PolarHBondContact O-N 3.19Å; F2259-R2262 VanDerWaalsContact O-N 3.15Å; F2259-M2263 HydrophobicContact CD1-CE 3.88Å; F2259-M2263 VanDerWaalsContact CD1-CE 3.44Å; F2259-M2263 HydrophobicContact CD1-CG 4.37Å; F2259-M2263 HydrophobicContact CD1-SD 4.11Å; F2259-M2263 HydrophobicContact CE1-CE 3.56Å; F2259-M2263 HydrophobicContact CE1-CG 4.04Å; F2259-M2263 HydrophobicContact CE1-SD 3.75Å; F2259-M2263 WeakPolarHBondContact CE1-SD 2.97Å; F2259-M2263 HydrophobicContact CE2-CE 4.03Å; F2259-M2263 HydrophobicContact CE2-CG 4.19Å; F2259-M2263 HydrophobicContact CE2-SD 4.09Å; F2259-M2263 HydrophobicContact CG-CE 4.37Å; F2259-M2263 HydrophobicContact CZ-CE 3.68Å; F2259-M2263 HydrophobicContact CZ-CG 3.94Å; F2259-M2263 HydrophobicContact CZ-SD 3.26Å; F2259-M2263 WeakPolarHBondContact CZ-SD 3.49Å; F2259-M2263 WeakPolarHBondContact O-CB 3.35Å; F2259-M2263 WeakPolarHBondContact O-CG 3.31Å; F2259-M2263 PolarHBondContact O-N 2.97Å; F2259-A2363 HydrophobicContact CB-CB 4.18Å; F2259-S2366 WeakPolarHBondContact CD2-OG 3.21Å; F2259-S2366 VanDerWaalsContact CE2-OG 3.32Å; F2259-S2366 WeakPolarHBondContact CE2-OG 3.45Å; F2259-I2367 HydrophobicContact CD2-CD1 4.12Å; F2259-I2367 HydrophobicContact CD2-CG1 4Å; F2259-I2367 HydrophobicContact CE2-CD1 4.25Å; F2259-I2367 HydrophobicContact CE2-CG1 3.67Å; F2259-I2367 HydrophobicContact CZ-CG1 4.25Å; F2259-F2939 HydrophobicContact CE1-CZ 4.11Å; F2259-L2975 HydrophobicContact CE1-CD1 4.35Å; F2259-L2975 HydrophobicContact CZ-CD1 4.31Å; F2259-L2975 HydrophobicContact CZ-CD2 4.03Å
2260	S	91	Very high	90.1	Very high	14.6 Å²	14.6	23.6 Å²	23.6	10%	0.102	11%	0.113	C	C	.	.	H	α-helix	trans	-60.7	-35.6	178.9	-136.6	0	0	0	0	112.9	F2256 K2257 L2258 R2262 M2263 R2264 Y3037	F2256-S2260 WeakPolarHBondContact CE1-OG 3.28Å; F2256-S2260 WeakPolarHBondContact CE2-OG 3.42Å; F2256-S2260 WeakPolarHBondContact CZ-OG 3.11Å; F2256-S2260 VanDerWaalsContact O-CB 3.26Å; F2256-S2260 WeakPolarHBondContact O-CB 3.29Å; F2256-S2260 PolarHBondContact O-N 3.06Å; F2256-S2260 PolarHBondContact O-OG 3.12Å; K2257-S2260 PolarHBondContact O-N 3.06Å; L2258-S2260 VanDerWaalsContact C-N 3.34Å; L2258-S2260 PolarHBondContact O-N 3.23Å; S2260-R2262 VanDerWaalsContact C-N 3.35Å; S2260-R2262 PolarHBondContact O-N 3.05Å; S2260-M2263 VanDerWaalsContact O-CG 3.31Å; S2260-M2263 WeakPolarHBondContact O-CG 3.42Å; S2260-M2263 PolarHBondContact O-N 2.54Å; S2260-R2264 VanDerWaalsContact O-CG 3.25Å; S2260-R2264 WeakPolarHBondContact O-CG 3.37Å; S2260-Y3037 PolarHBondContact OG-OH 3.27Å
2261	I	90.4	Very high	90.5	Very high	3.2 Å²	3.2	22.7 Å²	22.7	2%	0.016	11%	0.108	C	C	.	.	H	α-helix	trans	-76.7	-41.1	175.8	-67.7	168.5	0	0	0	110.7	K2257 L2258 F2259 M2263 R2264 M2342 F2425 E2426 A2429 R2430 L2433	K2257-I2261 WeakPolarHBondContact O-CB 3.47Å; K2257-I2261 WeakPolarHBondContact O-CD1 3.46Å; K2257-I2261 VanDerWaalsContact O-CG1 3.28Å; K2257-I2261 WeakPolarHBondContact O-CG1 3.41Å; K2257-I2261 PolarHBondContact O-N 3.12Å; K2257-I2261 VanDerWaalsContact O-N 3.12Å; L2258-I2261 PolarHBondContact O-N 3.01Å; L2258-I2261 VanDerWaalsContact O-N 3.13Å; F2259-I2261 VanDerWaalsContact C-N 3.28Å; F2259-I2261 PolarHBondContact O-N 2.96Å; I2261-M2263 VanDerWaalsContact C-N 3.29Å; I2261-M2263 PolarHBondContact O-N 3.18Å; I2261-R2264 WeakPolarHBondContact O-CB 3.38Å; I2261-R2264 PolarHBondContact O-N 3.05Å; I2261-R2264 VanDerWaalsContact O-N 3.15Å; I2261-M2342 HydrophobicContact CD1-CE 4.05Å; I2261-M2342 HydrophobicContact CG1-CE 3.94Å; I2261-F2425 HydrophobicContact CG2-CE1 3.85Å; I2261-F2425 HydrophobicContact CG2-CZ 4.15Å; I2261-E2426 HydrophobicContact CD1-CG 3.89Å; I2261-E2426 HydrophobicContact CG2-CG 4.11Å; I2261-A2429 HydrophobicContact CG1-CB 4.35Å; I2261-A2429 HydrophobicContact CG2-CB 3.89Å; I2261-R2430 HydrophobicContact CD1-CG 3.86Å; I2261-L2433 HydrophobicContact CG1-CD1 4.31Å
2262	R	90	Very high	90.8	Very high	6.6 Å²	6.6	25.1 Å²	25.1	3%	0.025	12%	0.118	C	C	.	.	H	α-helix	trans	-70.6	-23.5	-178.3	-64	-64.1	176.3	-155.1	-5.8	112.9	L2258 F2259 S2260 R2264 R2268 D2360 T2364 I2367 S2371 A2372 G2373 D2375 E2426	L2258-R2262 WeakPolarHBondContact O-CB 3.42Å; L2258-R2262 VanDerWaalsContact O-CG 3.25Å; L2258-R2262 WeakPolarHBondContact O-CG 3.31Å; L2258-R2262 PolarHBondContact O-N 3.17Å; F2259-R2262 PolarHBondContact O-N 3.19Å; F2259-R2262 VanDerWaalsContact O-N 3.15Å; S2260-R2262 VanDerWaalsContact C-N 3.35Å; S2260-R2262 PolarHBondContact O-N 3.05Å; R2262-R2264 VanDerWaalsContact C-N 3.3Å; R2262-R2264 PolarHBondContact O-N 3.36Å; R2262-R2268 PolarHBondContact O-NH2 3.03Å; R2262-D2360 VanDerWaalsContact CZ-CG 3.45Å; R2262-D2360 IonicContact CZ-OD1 3.39Å; R2262-D2360 VanDerWaalsContact CZ-OD1 3.24Å; R2262-D2360 IonicContact CZ-OD2 3.02Å; R2262-D2360 VanDerWaalsContact CZ-OD2 3.22Å; R2262-D2360 IonicContact NE-OD1 3.44Å; R2262-D2360 PolarHBondContact NE-OD1 3.04Å; R2262-D2360 IonicContact NE-OD2 3.47Å; R2262-D2360 IonicContact NH1-OD1 3.85Å; R2262-D2360 PolarHBondContact NH1-OD1 3.5Å; R2262-D2360 VanDerWaalsContact NH1-OD1 3.15Å; R2262-D2360 IonicContact NH1-OD2 2.88Å; R2262-D2360 PolarHBondContact NH1-OD2 3.08Å; R2262-D2360 VanDerWaalsContact NH2-CG 3.26Å; R2262-D2360 IonicContact NH2-OD1 3.34Å; R2262-D2360 PolarHBondContact NH2-OD1 3.24Å; R2262-D2360 IonicContact NH2-OD2 3.22Å; R2262-D2360 PolarHBondContact NH2-OD2 3.16Å; R2262-T2364 VanDerWaalsContact CD-OG1 3.29Å; R2262-T2364 WeakPolarHBondContact CD-OG1 3.23Å; R2262-T2364 WeakPolarHBondContact CG-OG1 3.41Å; R2262-T2364 PolarHBondContact NH1-OG1 3.44Å; R2262-I2367 VanDerWaalsContact C-CD1 3.48Å; R2262-I2367 HydrophobicContact CB-CD1 3.56Å; R2262-I2367 VanDerWaalsContact CB-CD1 3.42Å; R2262-S2371 CarbonylContact O-C 3.52Å; R2262-S2371 WeakPolarHBondContact O-CA 3.32Å; R2262-A2372 WeakPolarHBondContact O-CB 3.32Å; R2262-A2372 PolarHBondContact O-N 3.24Å; R2262-G2373 WeakPolarHBondContact CD-O 3.22Å; R2262-G2373 PolarHBondContact NE-O 2.99Å; R2262-G2373 PolarHBondContact NH1-O 3.18Å; R2262-D2375 VanDerWaalsContact NH1-N 3.18Å; R2262-E2426 IonicContact CZ-OE2 2.97Å; R2262-E2426 IonicContact NH1-OE2 2.77Å; R2262-E2426 IonicContact NH2-OE2 3.33Å; R2262-E2426 PolarHBondContact NH2-OE2 2.92Å; R2262-E2426 VanDerWaalsContact NH2-OE2 3.11Å
2263	M	89.8	Confident	90.9	Very high	40.4 Å²	40.4	27.6 Å²	27.6	20%	0.199	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-12.2	173.6	77	-177.8	-35.3	0	0	113.8	F2259 S2260 I2261 K2265 I2367 N2370 Q2938 F2939 L2975 N2976	F2259-M2263 HydrophobicContact CD1-CE 3.88Å; F2259-M2263 VanDerWaalsContact CD1-CE 3.44Å; F2259-M2263 HydrophobicContact CD1-CG 4.37Å; F2259-M2263 HydrophobicContact CD1-SD 4.11Å; F2259-M2263 HydrophobicContact CE1-CE 3.56Å; F2259-M2263 HydrophobicContact CE1-CG 4.04Å; F2259-M2263 HydrophobicContact CE1-SD 3.75Å; F2259-M2263 WeakPolarHBondContact CE1-SD 2.97Å; F2259-M2263 HydrophobicContact CE2-CE 4.03Å; F2259-M2263 HydrophobicContact CE2-CG 4.19Å; F2259-M2263 HydrophobicContact CE2-SD 4.09Å; F2259-M2263 HydrophobicContact CG-CE 4.37Å; F2259-M2263 HydrophobicContact CZ-CE 3.68Å; F2259-M2263 HydrophobicContact CZ-CG 3.94Å; F2259-M2263 HydrophobicContact CZ-SD 3.26Å; F2259-M2263 WeakPolarHBondContact CZ-SD 3.49Å; F2259-M2263 WeakPolarHBondContact O-CB 3.35Å; F2259-M2263 WeakPolarHBondContact O-CG 3.31Å; F2259-M2263 PolarHBondContact O-N 2.97Å; S2260-M2263 VanDerWaalsContact O-CG 3.31Å; S2260-M2263 WeakPolarHBondContact O-CG 3.42Å; S2260-M2263 PolarHBondContact O-N 2.54Å; I2261-M2263 VanDerWaalsContact C-N 3.29Å; I2261-M2263 PolarHBondContact O-N 3.18Å; M2263-K2265 PolarHBondContact O-N 3.04Å; M2263-I2367 HydrophobicContact CB-CD1 4.15Å; M2263-I2367 HydrophobicContact CB-CG1 4.4Å; M2263-I2367 HydrophobicContact CB-CG2 4.42Å; M2263-I2367 HydrophobicContact CG-CD1 3.68Å; M2263-I2367 HydrophobicContact CG-CG1 4.01Å; M2263-N2370 CarbonylContact C-O 3.59Å; M2263-N2370 VanDerWaalsContact O-O 3.08Å; M2263-Q2938 HydrophobicContact CE-CB 4.14Å; M2263-Q2938 HydrophobicContact CE-CG 4.13Å; M2263-F2939 HydrophobicContact CE-CD2 4.14Å; M2263-F2939 HydrophobicContact CE-CE2 3.8Å; M2263-F2939 HydrophobicContact CE-CZ 4.33Å; M2263-F2939 HydrophobicContact SD-CE2 3.99Å; M2263-F2939 HydrophobicContact SD-CZ 4.32Å; M2263-L2975 HydrophobicContact CE-CD1 4.18Å; M2263-L2975 HydrophobicContact CE-CG 4.27Å; M2263-L2975 VanDerWaalsContact CE-O 3.27Å; M2263-L2975 WeakPolarHBondContact CE-O 3.33Å; M2263-N2976 HydrophobicContact CB-CB 4.38Å; M2263-N2976 HydrophobicContact CE-CB 3.96Å; M2263-N2976 PolarHBondContact O-ND2 3.03Å
2264	R	91	Very high	91	Very high	39.6 Å²	39.6	28.3 Å²	28.3	15%	0.149	13%	0.133	C	C	.	.			trans	-94.6	68.4	-173	-64	-61.9	-61.8	-91.4	1.6	113.6	S2260 I2261 R2262 D2266 L2267 R2268 L2433 Q2938 H3024	S2260-R2264 VanDerWaalsContact O-CG 3.25Å; S2260-R2264 WeakPolarHBondContact O-CG 3.37Å; I2261-R2264 WeakPolarHBondContact O-CB 3.38Å; I2261-R2264 PolarHBondContact O-N 3.05Å; I2261-R2264 VanDerWaalsContact O-N 3.15Å; R2262-R2264 VanDerWaalsContact C-N 3.3Å; R2262-R2264 PolarHBondContact O-N 3.36Å; R2264-D2266 VanDerWaalsContact C-N 3.29Å; R2264-D2266 VanDerWaalsContact C-OD1 3.27Å; R2264-D2266 VanDerWaalsContact CA-OD1 3.31Å; R2264-D2266 WeakPolarHBondContact CA-OD1 3.34Å; R2264-D2266 WeakPolarHBondContact CB-OD1 3.37Å; R2264-D2266 IonicContact CZ-OD1 2.95Å; R2264-D2266 IonicContact CZ-OD2 3.29Å; R2264-D2266 VanDerWaalsContact CZ-OD2 3.29Å; R2264-D2266 IonicContact NE-OD1 3.22Å; R2264-D2266 PolarHBondContact NE-OD1 3.15Å; R2264-D2266 IonicContact NE-OD2 3.46Å; R2264-D2266 PolarHBondContact NE-OD2 3.18Å; R2264-D2266 VanDerWaalsContact NE-OD2 3.1Å; R2264-D2266 IonicContact NH2-OD1 3.17Å; R2264-D2266 IonicContact NH2-OD2 3.04Å; R2264-D2266 PolarHBondContact NH2-OD2 3.15Å; R2264-D2266 PolarHBondContact O-N 3.2Å; R2264-L2267 HydrophobicContact CB-CB 4.03Å; R2264-L2267 HydrophobicContact CB-CD1 3.93Å; R2264-L2267 HydrophobicContact CB-CG 3.91Å; R2264-L2267 HydrophobicContact CG-CD1 4.08Å; R2264-L2267 HydrophobicContact CG-CG 4.41Å; R2264-L2267 VanDerWaalsContact CZ-CD1 3.45Å; R2264-L2267 VanDerWaalsContact CZ-CG 3.49Å; R2264-L2267 VanDerWaalsContact NH2-CG 3.25Å; R2264-L2267 PolarHBondContact O-N 3.09Å; R2264-R2268 PolarHBondContact O-N 3Å; R2264-R2268 VanDerWaalsContact O-N 3.13Å; R2264-L2433 HydrophobicContact CG-CD1 4.46Å; R2264-L2433 VanDerWaalsContact NH1-CD2 3.3Å; R2264-Q2938 VanDerWaalsContact NH1-OE1 3.17Å; R2264-H3024 PolarHBondContact NH1-CE1 3.21Å; R2264-H3024 PolarHBondContact NH1-NE2 3.47Å; R2264-H3024 PolarHBondContact NH2-CE1 2.91Å; R2264-H3024 PolarHBondContact NH2-NE2 3.3Å
2265	K	91.2	Very high	91.2	Very high	84.2 Å²	84.2	27.4 Å²	27.4	37%	0.366	13%	0.129	S	C	.	.	H	α-helix	trans	-57.6	-39.6	171.3	173.7	-178.7	-179.6	-136.8	0	112.2	M2263 L2267 R2268 D2269 N2370 S2371 I2978	M2263-K2265 PolarHBondContact O-N 3.04Å; K2265-L2267 VanDerWaalsContact C-N 3.32Å; K2265-L2267 PolarHBondContact O-N 3.25Å; K2265-R2268 WeakPolarHBondContact O-CA 3.29Å; K2265-R2268 WeakPolarHBondContact O-CB 3.3Å; K2265-R2268 PolarHBondContact O-N 3.15Å; K2265-R2268 VanDerWaalsContact O-N 3.13Å; K2265-D2269 VanDerWaalsContact CE-OD2 3.28Å; K2265-D2269 WeakPolarHBondContact CE-OD2 3.21Å; K2265-D2269 VanDerWaalsContact CG-OD2 3.29Å; K2265-D2269 WeakPolarHBondContact CG-OD2 3.42Å; K2265-D2269 IonicContact NZ-OD2 3.3Å; K2265-D2269 PolarHBondContact NZ-OD2 3.09Å; K2265-D2269 PolarHBondContact O-N 3.05Å; K2265-N2370 HydrophobicContact CB-CB 4.26Å; K2265-N2370 WeakPolarHBondContact CB-O 3.43Å; K2265-N2370 HydrophobicContact CD-CB 4.3Å; K2265-N2370 VanDerWaalsContact CD-CG 3.42Å; K2265-N2370 WeakPolarHBondContact CD-ND2 3.49Å; K2265-N2370 WeakPolarHBondContact CD-OD1 3.39Å; K2265-N2370 PolarHBondContact N-O 3.14Å; K2265-N2370 PolarHBondContact NZ-OD1 2.86Å; K2265-S2371 WeakPolarHBondContact CD-OG 3.45Å; K2265-S2371 WeakPolarHBondContact CG-OG 3.44Å; K2265-I2978 HydrophobicContact CB-CD1 4.31Å
2266	D	92.1	Very high	91.1	Very high	41.6 Å²	41.6	32.3 Å²	32.3	22%	0.222	15%	0.148	C	C	.	.	H	α-helix	trans	-54	-46.6	176.1	62.2	-41.3	0	0	0	112.3	R2264 R2268 D2269 L2270 I2935 S2936 I2978 F3041	R2264-D2266 VanDerWaalsContact C-N 3.29Å; R2264-D2266 VanDerWaalsContact C-OD1 3.27Å; R2264-D2266 VanDerWaalsContact CA-OD1 3.31Å; R2264-D2266 WeakPolarHBondContact CA-OD1 3.34Å; R2264-D2266 WeakPolarHBondContact CB-OD1 3.37Å; R2264-D2266 IonicContact CZ-OD1 2.95Å; R2264-D2266 IonicContact CZ-OD2 3.29Å; R2264-D2266 VanDerWaalsContact CZ-OD2 3.29Å; R2264-D2266 IonicContact NE-OD1 3.22Å; R2264-D2266 PolarHBondContact NE-OD1 3.15Å; R2264-D2266 IonicContact NE-OD2 3.46Å; R2264-D2266 PolarHBondContact NE-OD2 3.18Å; R2264-D2266 VanDerWaalsContact NE-OD2 3.1Å; R2264-D2266 IonicContact NH2-OD1 3.17Å; R2264-D2266 IonicContact NH2-OD2 3.04Å; R2264-D2266 PolarHBondContact NH2-OD2 3.15Å; R2264-D2266 PolarHBondContact O-N 3.2Å; D2266-R2268 VanDerWaalsContact C-N 3.31Å; D2266-R2268 PolarHBondContact O-N 3.08Å; D2266-D2269 PolarHBondContact O-N 3.09Å; D2266-L2270 WeakPolarHBondContact O-CB 3.39Å; D2266-L2270 PolarHBondContact O-N 3.17Å; D2266-L2270 VanDerWaalsContact O-N 3.07Å; D2266-I2935 HydrophobicContact CB-CG2 4.09Å; D2266-S2936 WeakPolarHBondContact OD2-CB 3.21Å; D2266-S2936 PolarHBondContact OD2-OG 2.95Å; D2266-I2978 HydrophobicContact CB-CD1 4.05Å; D2266-I2978 HydrophobicContact CB-CG1 4.45Å; D2266-F3041 WeakPolarHBondContact OD2-CD1 3.44Å
2267	L	93	Very high	90.8	Very high	6.4 Å²	6.4	36.6 Å²	36.6	3%	0.034	16%	0.164	C	C	.	.	H	α-helix	trans	-68.8	-32.6	176.7	-62	-172.2	0	0	0	112.3	R2264 K2265 D2269 L2270 F2271 F2425 A2429 L2432 L2433 F3041	R2264-L2267 HydrophobicContact CB-CB 4.03Å; R2264-L2267 HydrophobicContact CB-CD1 3.93Å; R2264-L2267 HydrophobicContact CB-CG 3.91Å; R2264-L2267 HydrophobicContact CG-CD1 4.08Å; R2264-L2267 HydrophobicContact CG-CG 4.41Å; R2264-L2267 VanDerWaalsContact CZ-CD1 3.45Å; R2264-L2267 VanDerWaalsContact CZ-CG 3.49Å; R2264-L2267 VanDerWaalsContact NH2-CG 3.25Å; R2264-L2267 PolarHBondContact O-N 3.09Å; K2265-L2267 VanDerWaalsContact C-N 3.32Å; K2265-L2267 PolarHBondContact O-N 3.25Å; L2267-D2269 VanDerWaalsContact C-N 3.32Å; L2267-L2270 HydrophobicContact CD2-CD2 4.5Å; L2267-L2270 PolarHBondContact O-N 3.32Å; L2267-F2271 VanDerWaalsContact O-CB 3.25Å; L2267-F2271 WeakPolarHBondContact O-CB 3.35Å; L2267-F2271 PolarHBondContact O-N 3.16Å; L2267-F2425 HydrophobicContact CB-CE2 4.16Å; L2267-A2429 HydrophobicContact CD1-CB 4.17Å; L2267-L2432 HydrophobicContact CD1-CB 4.24Å; L2267-L2432 HydrophobicContact CD1-CD1 4.43Å; L2267-L2432 HydrophobicContact CD2-CB 4.37Å; L2267-L2432 HydrophobicContact CD2-CD1 3.7Å; L2267-L2433 HydrophobicContact CD1-CD1 4.41Å; L2267-L2433 HydrophobicContact CD1-CD2 4.49Å; L2267-L2433 HydrophobicContact CD1-CG 4.4Å; L2267-F3041 HydrophobicContact CD2-CD1 4.23Å; L2267-F3041 HydrophobicContact CD2-CE1 3.49Å; L2267-F3041 VanDerWaalsContact CD2-CE1 3.49Å; L2267-F3041 HydrophobicContact CD2-CE2 4.15Å; L2267-F3041 HydrophobicContact CD2-CZ 3.44Å; L2267-F3041 VanDerWaalsContact CD2-CZ 3.44Å
2268	R	90.5	Very high	90.5	Very high	32.2 Å²	32.2	38.3 Å²	38.3	12%	0.122	17%	0.17	C	C	.	.	H	α-helix	trans	-67.9	-42	177	-172.4	163.3	-130.9	-174.4	4.4	111.4	R2262 R2264 K2265 D2266 L2270 F2271 K2272 N2370 S2371 A2372 G2373 V2374 D2375 F2425	R2262-R2268 PolarHBondContact O-NH2 3.03Å; R2264-R2268 PolarHBondContact O-N 3Å; R2264-R2268 VanDerWaalsContact O-N 3.13Å; K2265-R2268 WeakPolarHBondContact O-CA 3.29Å; K2265-R2268 WeakPolarHBondContact O-CB 3.3Å; K2265-R2268 PolarHBondContact O-N 3.15Å; K2265-R2268 VanDerWaalsContact O-N 3.13Å; D2266-R2268 VanDerWaalsContact C-N 3.31Å; D2266-R2268 PolarHBondContact O-N 3.08Å; R2268-L2270 VanDerWaalsContact C-N 3.31Å; R2268-F2271 PolarHBondContact O-N 3.26Å; R2268-K2272 VanDerWaalsContact O-CG 3.3Å; R2268-K2272 WeakPolarHBondContact O-CG 3.4Å; R2268-K2272 PolarHBondContact O-N 2.82Å; R2268-K2272 VanDerWaalsContact O-N 3.13Å; R2268-N2370 PolarHBondContact NH1-O 3.11Å; R2268-S2371 VanDerWaalsContact CD-O 3.27Å; R2268-S2371 WeakPolarHBondContact CD-O 3.46Å; R2268-S2371 PolarHBondContact NH1-O 3.01Å; R2268-A2372 HydrophobicContact CB-CB 4.15Å; R2268-A2372 VanDerWaalsContact CD-O 3.25Å; R2268-A2372 WeakPolarHBondContact CD-O 3.49Å; R2268-A2372 HydrophobicContact CG-CB 4.38Å; R2268-A2372 VanDerWaalsContact CZ-O 3.3Å; R2268-A2372 PolarHBondContact NE-O 3.12Å; R2268-A2372 VanDerWaalsContact NH1-CA 3.31Å; R2268-A2372 VanDerWaalsContact NH1-CB 3.29Å; R2268-A2372 VanDerWaalsContact NH1-N 3.13Å; R2268-A2372 PolarHBondContact NH1-O 2.95Å; R2268-G2373 VanDerWaalsContact NH1-N 3.12Å; R2268-G2373 PolarHBondContact NH1-O 3.07Å; R2268-G2373 PolarHBondContact NH2-O 3.1Å; R2268-V2374 PolarHBondContact NH1-O 3.29Å; R2268-D2375 IonicContact CZ-OD1 2.67Å; R2268-D2375 IonicContact CZ-OD2 3.6Å; R2268-D2375 IonicContact NE-OD2 3.07Å; R2268-D2375 PolarHBondContact NE-OD2 2.98Å; R2268-D2375 IonicContact NH1-OD1 3.29Å; R2268-D2375 PolarHBondContact NH1-OD1 3.16Å; R2268-D2375 IonicContact NH1-OD2 3.77Å; R2268-D2375 PolarHBondContact NH1-OD2 2.81Å; R2268-D2375 PolarHBondContact NH2-O 2.75Å; R2268-D2375 IonicContact NH2-OD1 3.93Å; R2268-D2375 PolarHBondContact NH2-OD1 2.74Å; R2268-D2375 IonicContact NH2-OD2 2.69Å; R2268-D2375 PolarHBondContact NH2-OD2 3.16Å; R2268-F2425 HydrophobicContact CB-CD2 4.13Å; R2268-F2425 HydrophobicContact CB-CE1 4.38Å; R2268-F2425 HydrophobicContact CB-CE2 3.62Å; R2268-F2425 HydrophobicContact CB-CZ 3.84Å; R2268-F2425 HydrophobicContact CG-CD2 4.32Å; R2268-F2425 HydrophobicContact CG-CE1 4.45Å; R2268-F2425 HydrophobicContact CG-CE2 4.28Å; R2268-F2425 HydrophobicContact CG-CG 4.4Å; R2268-F2425 HydrophobicContact CG-CZ 4.38Å; R2268-F2425 VanDerWaalsContact N-CE2 3.31Å; R2268-F2425 VanDerWaalsContact NH1-CD1 3.34Å
2269	D	92.2	Very high	90.3	Very high	69.4 Å²	69.4	42.7 Å²	42.7	37%	0.371	19%	0.19	S	C	.	.	H	α-helix	trans	-69.5	-40	178.5	-66.7	-21.7	0	0	0	110.5	K2265 D2266 L2267 F2271 K2272 E2273	K2265-D2269 VanDerWaalsContact CE-OD2 3.28Å; K2265-D2269 WeakPolarHBondContact CE-OD2 3.21Å; K2265-D2269 VanDerWaalsContact CG-OD2 3.29Å; K2265-D2269 WeakPolarHBondContact CG-OD2 3.42Å; K2265-D2269 IonicContact NZ-OD2 3.3Å; K2265-D2269 PolarHBondContact NZ-OD2 3.09Å; K2265-D2269 PolarHBondContact O-N 3.05Å; D2266-D2269 PolarHBondContact O-N 3.09Å; L2267-D2269 VanDerWaalsContact C-N 3.32Å; D2269-F2271 PolarHBondContact O-N 3.44Å; D2269-K2272 PolarHBondContact O-N 3.12Å; D2269-K2272 IonicContact OD1-NZ 3.08Å; D2269-K2272 PolarHBondContact OD1-NZ 2.73Å; D2269-E2273 WeakPolarHBondContact O-CB 3.4Å; D2269-E2273 PolarHBondContact O-N 3.13Å; D2269-E2273 VanDerWaalsContact O-N 3.11Å
2270	L	91.8	Very high	89.9	Confident	37 Å²	37	46.4 Å²	46.4	19%	0.194	21%	0.207	C	C	.	.	H	α-helix	trans	-59.3	-47.3	170.5	-179.9	61.4	0	0	0	112.1	D2266 L2267 R2268 K2272 E2273 Q2274 F2390 F2428 L2432 Y3022 F3041	D2266-L2270 WeakPolarHBondContact O-CB 3.39Å; D2266-L2270 PolarHBondContact O-N 3.17Å; D2266-L2270 VanDerWaalsContact O-N 3.07Å; L2267-L2270 HydrophobicContact CD2-CD2 4.5Å; L2267-L2270 PolarHBondContact O-N 3.32Å; R2268-L2270 VanDerWaalsContact C-N 3.31Å; L2270-K2272 VanDerWaalsContact C-N 3.34Å; L2270-K2272 PolarHBondContact O-N 3.1Å; L2270-E2273 WeakPolarHBondContact O-CB 3.36Å; L2270-E2273 PolarHBondContact O-N 3.29Å; L2270-Q2274 HydrophobicContact CD1-CG 4.17Å; L2270-Q2274 WeakPolarHBondContact O-CG 3.35Å; L2270-Q2274 PolarHBondContact O-N 3.19Å; L2270-F2390 HydrophobicContact CD1-CE2 4.42Å; L2270-F2390 HydrophobicContact CD2-CE2 4.1Å; L2270-F2390 HydrophobicContact CD2-CZ 4.26Å; L2270-F2390 HydrophobicContact CG-CE2 4.34Å; L2270-F2428 HydrophobicContact CD2-CE1 4.17Å; L2270-F2428 HydrophobicContact CD2-CZ 4.1Å; L2270-F2428 HydrophobicContact CG-CE1 4.19Å; L2270-F2428 HydrophobicContact CG-CZ 4.17Å; L2270-L2432 HydrophobicContact CD2-CD1 4.08Å; L2270-Y3022 HydrophobicContact CD1-CE1 3.97Å; L2270-Y3022 HydrophobicContact CD1-CE2 3.9Å; L2270-Y3022 HydrophobicContact CD2-CD1 3.8Å; L2270-Y3022 HydrophobicContact CD2-CD2 4.23Å; L2270-Y3022 HydrophobicContact CD2-CE1 3.87Å; L2270-Y3022 HydrophobicContact CD2-CE2 4.29Å; L2270-Y3022 HydrophobicContact CD2-CG 3.99Å; L2270-F3041 HydrophobicContact CD2-CE1 4.46Å; L2270-F3041 HydrophobicContact CD2-CZ 4.25Å
2271	F	93.1	Very high	89.1	Confident	2 Å²	2	49.3 Å²	49.3	1%	0.009	22%	0.22	C	C	.	.	H	α-helix	trans	-58.6	-46.5	177.8	174.5	-98.9	0	0	0	112	L2267 R2268 D2269 E2273 Q2274 V2275 M2380 L2382 F2425 F2428	L2267-F2271 VanDerWaalsContact O-CB 3.25Å; L2267-F2271 WeakPolarHBondContact O-CB 3.35Å; L2267-F2271 PolarHBondContact O-N 3.16Å; R2268-F2271 PolarHBondContact O-N 3.26Å; D2269-F2271 PolarHBondContact O-N 3.44Å; F2271-E2273 VanDerWaalsContact C-N 3.31Å; F2271-E2273 PolarHBondContact O-N 3.22Å; F2271-Q2274 PolarHBondContact O-N 3.28Å; F2271-V2275 HydrophobicContact CD1-CG2 4.3Å; F2271-V2275 HydrophobicContact CD2-CG2 4.43Å; F2271-V2275 HydrophobicContact CE1-CG2 3.92Å; F2271-V2275 HydrophobicContact CE2-CG2 4.21Å; F2271-V2275 HydrophobicContact CZ-CG2 3.88Å; F2271-V2275 WeakPolarHBondContact O-CG2 3.37Å; F2271-V2275 PolarHBondContact O-N 3.21Å; F2271-M2380 HydrophobicContact CD1-CE 4.44Å; F2271-M2380 HydrophobicContact CE1-CB 3.98Å; F2271-M2380 HydrophobicContact CE1-CE 4.38Å; F2271-M2380 HydrophobicContact CZ-CB 4.35Å; F2271-L2382 HydrophobicContact CD2-CD1 3.84Å; F2271-L2382 HydrophobicContact CD2-CG 4.17Å; F2271-L2382 HydrophobicContact CE2-CD1 3.84Å; F2271-L2382 HydrophobicContact CE2-CG 3.74Å; F2271-L2382 HydrophobicContact CZ-CG 4.43Å; F2271-F2425 HydrophobicContact CB-CD2 4.05Å; F2271-F2425 HydrophobicContact CD1-CB 3.83Å; F2271-F2425 HydrophobicContact CD1-CD2 4.38Å; F2271-F2425 HydrophobicContact CD1-CG 4.46Å; F2271-F2425 HydrophobicContact CD2-CB 4.49Å; F2271-F2425 HydrophobicContact CE1-CB 3.85Å; F2271-F2425 HydrophobicContact CE2-CB 4.49Å; F2271-F2425 HydrophobicContact CG-CB 4.2Å; F2271-F2425 HydrophobicContact CG-CD2 4.21Å; F2271-F2425 HydrophobicContact CZ-CB 4.23Å; F2271-F2425 VanDerWaalsContact CZ-N 3.3Å; F2271-F2428 HydrophobicContact CB-CD1 3.76Å; F2271-F2428 HydrophobicContact CB-CE1 3.99Å; F2271-F2428 HydrophobicContact CB-CG 4.47Å; F2271-F2428 HydrophobicContact CD2-CB 3.69Å; F2271-F2428 AromaticContact CD2-CD1 3.87Å; F2271-F2428 HydrophobicContact CD2-CD1 3.87Å; F2271-F2428 HydrophobicContact CD2-CD2 4.41Å; F2271-F2428 AromaticContact CD2-CG 3.75Å; F2271-F2428 HydrophobicContact CD2-CG 3.75Å; F2271-F2428 HydrophobicContact CE2-CB 4.12Å; F2271-F2428 HydrophobicContact CE2-CG 4.46Å; F2271-F2428 HydrophobicContact CG-CD1 4.28Å
2272	K	92	Very high	88.3	Confident	87.6 Å²	87.6	53.6 Å²	53.6	38%	0.381	24%	0.24	S	C	.	.	H	α-helix	trans	-60	-42.3	177.1	-73.8	172.5	-179.6	171.5	0	111.9	R2268 D2269 L2270 Q2274 V2275 R2276 M2380	R2268-K2272 VanDerWaalsContact O-CG 3.3Å; R2268-K2272 WeakPolarHBondContact O-CG 3.4Å; R2268-K2272 PolarHBondContact O-N 2.82Å; R2268-K2272 VanDerWaalsContact O-N 3.13Å; D2269-K2272 PolarHBondContact O-N 3.12Å; D2269-K2272 IonicContact OD1-NZ 3.08Å; D2269-K2272 PolarHBondContact OD1-NZ 2.73Å; L2270-K2272 VanDerWaalsContact C-N 3.34Å; L2270-K2272 PolarHBondContact O-N 3.1Å; K2272-Q2274 VanDerWaalsContact C-N 3.35Å; K2272-V2275 PolarHBondContact O-N 2.92Å; K2272-R2276 WeakPolarHBondContact O-CB 3.43Å; K2272-R2276 PolarHBondContact O-N 3.23Å; K2272-M2380 HydrophobicContact CB-CE 4.33Å; K2272-M2380 HydrophobicContact CG-CE 3.88Å; K2272-M2380 HydrophobicContact CG-SD 4.31Å
2273	E	91.3	Very high	87.5	Confident	53.6 Å²	53.6	60.7 Å²	60.7	25%	0.25	27%	0.271	S	S	.	.	H	α-helix	trans	-63.3	-41.5	177.3	175.6	60.2	-173.5	0	0	111.7	D2269 L2270 F2271 V2275 R2276 R2277	D2269-E2273 WeakPolarHBondContact O-CB 3.4Å; D2269-E2273 PolarHBondContact O-N 3.13Å; D2269-E2273 VanDerWaalsContact O-N 3.11Å; L2270-E2273 WeakPolarHBondContact O-CB 3.36Å; L2270-E2273 PolarHBondContact O-N 3.29Å; F2271-E2273 VanDerWaalsContact C-N 3.31Å; F2271-E2273 PolarHBondContact O-N 3.22Å; E2273-V2275 PolarHBondContact O-N 3.24Å; E2273-R2276 VanDerWaalsContact CD-NH2 3.26Å; E2273-R2276 PolarHBondContact O-N 2.81Å; E2273-R2276 IonicContact OE1-CZ 3.43Å; E2273-R2276 IonicContact OE1-NE 3.37Å; E2273-R2276 IonicContact OE1-NH2 3.52Å; E2273-R2276 PolarHBondContact OE1-NH2 3.07Å; E2273-R2276 IonicContact OE2-CZ 2.93Å; E2273-R2276 VanDerWaalsContact OE2-CZ 3.27Å; E2273-R2276 IonicContact OE2-NE 3.17Å; E2273-R2276 PolarHBondContact OE2-NE 3.03Å; E2273-R2276 IonicContact OE2-NH2 3.14Å; E2273-R2276 PolarHBondContact OE2-NH2 3.18Å; E2273-R2277 WeakPolarHBondContact O-CB 3.44Å; E2273-R2277 WeakPolarHBondContact O-CG 3.37Å; E2273-R2277 PolarHBondContact O-N 3.25Å; E2273-R2277 IonicContact OE1-CZ 3.53Å; E2273-R2277 VanDerWaalsContact OE1-CZ 3.26Å; E2273-R2277 IonicContact OE1-NE 3.14Å; E2273-R2277 PolarHBondContact OE1-NE 3.26Å; E2273-R2277 IonicContact OE1-NH2 2.97Å; E2273-R2277 PolarHBondContact OE1-NH2 3.29Å
2274	Q	90.8	Very high	86.2	Confident	13.6 Å²	13.6	66.5 Å²	66.5	6%	0.064	30%	0.297	C	S	.	.	H	α-helix	trans	-64.8	-42.6	175.5	-65.3	-52.7	-45.5	0	0	112.5	L2270 F2271 K2272 R2276 R2277 Y2278 L2382 F2390 H2394 F2428	L2270-Q2274 HydrophobicContact CD1-CG 4.17Å; L2270-Q2274 WeakPolarHBondContact O-CG 3.35Å; L2270-Q2274 PolarHBondContact O-N 3.19Å; F2271-Q2274 PolarHBondContact O-N 3.28Å; K2272-Q2274 VanDerWaalsContact C-N 3.35Å; Q2274-R2276 VanDerWaalsContact C-N 3.33Å; Q2274-R2276 PolarHBondContact O-N 3.25Å; Q2274-R2277 PolarHBondContact O-N 3.13Å; Q2274-Y2278 WeakPolarHBondContact O-CB 3.41Å; Q2274-Y2278 PolarHBondContact O-N 3.16Å; Q2274-Y2278 VanDerWaalsContact O-N 3.08Å; Q2274-L2382 HydrophobicContact CB-CD1 4.39Å; Q2274-L2382 HydrophobicContact CB-CD2 3.98Å; Q2274-F2390 HydrophobicContact CG-CD2 3.74Å; Q2274-F2390 HydrophobicContact CG-CE2 4.16Å; Q2274-F2390 HydrophobicContact CG-CG 4.48Å; Q2274-H2394 PolarHBondContact NE2-CD2 3.22Å; Q2274-H2394 VanDerWaalsContact NE2-CD2 3.29Å; Q2274-H2394 PolarHBondContact NE2-CE1 2.94Å; Q2274-H2394 PolarHBondContact NE2-NE2 3.32Å; Q2274-F2428 HydrophobicContact CG-CZ 4.46Å
2275	V	90.6	Very high	84.4	Confident	6.4 Å²	6.4	72.1 Å²	72.1	4%	0.039	33%	0.325	C	S	.	.	H	α-helix	trans	-60.6	-44.4	175.4	172.8	0	0	0	0	110.6	F2271 K2272 E2273 Y2278 Q2279 M2380 L2382	F2271-V2275 HydrophobicContact CD1-CG2 4.3Å; F2271-V2275 HydrophobicContact CD2-CG2 4.43Å; F2271-V2275 HydrophobicContact CE1-CG2 3.92Å; F2271-V2275 HydrophobicContact CE2-CG2 4.21Å; F2271-V2275 HydrophobicContact CZ-CG2 3.88Å; F2271-V2275 WeakPolarHBondContact O-CG2 3.37Å; F2271-V2275 PolarHBondContact O-N 3.21Å; K2272-V2275 PolarHBondContact O-N 2.92Å; E2273-V2275 PolarHBondContact O-N 3.24Å; V2275-Y2278 PolarHBondContact O-N 2.89Å; V2275-Q2279 HydrophobicContact CG1-CG 4.49Å; V2275-Q2279 WeakPolarHBondContact O-CB 3.37Å; V2275-Q2279 VanDerWaalsContact O-CG 3.26Å; V2275-Q2279 WeakPolarHBondContact O-CG 3.4Å; V2275-Q2279 PolarHBondContact O-N 3.13Å; V2275-Q2279 VanDerWaalsContact O-N 3.1Å; V2275-M2380 HydrophobicContact CB-CE 4.03Å; V2275-M2380 HydrophobicContact CG1-CB 4.46Å; V2275-M2380 HydrophobicContact CG1-CE 3.92Å; V2275-M2380 HydrophobicContact CG2-CE 4.29Å; V2275-L2382 HydrophobicContact CB-CD2 4.48Å; V2275-L2382 HydrophobicContact CG2-CD2 3.66Å; V2275-L2382 HydrophobicContact CG2-CG 4.1Å
2276	R	89.7	Confident	82.1	Confident	101.8 Å²	101.8	75.1 Å²	75.1	38%	0.384	34%	0.34	S	S	.	.	H	α-helix	trans	-61.8	-50.4	177.9	-173.4	-170.5	68	78.4	2.8	111.9	K2272 E2273 Q2274 Y2278 Q2279 E2280	K2272-R2276 WeakPolarHBondContact O-CB 3.43Å; K2272-R2276 PolarHBondContact O-N 3.23Å; E2273-R2276 VanDerWaalsContact CD-NH2 3.26Å; E2273-R2276 PolarHBondContact O-N 2.81Å; E2273-R2276 IonicContact OE1-CZ 3.43Å; E2273-R2276 IonicContact OE1-NE 3.37Å; E2273-R2276 IonicContact OE1-NH2 3.52Å; E2273-R2276 PolarHBondContact OE1-NH2 3.07Å; E2273-R2276 IonicContact OE2-CZ 2.93Å; E2273-R2276 VanDerWaalsContact OE2-CZ 3.27Å; E2273-R2276 IonicContact OE2-NE 3.17Å; E2273-R2276 PolarHBondContact OE2-NE 3.03Å; E2273-R2276 IonicContact OE2-NH2 3.14Å; E2273-R2276 PolarHBondContact OE2-NH2 3.18Å; Q2274-R2276 VanDerWaalsContact C-N 3.33Å; Q2274-R2276 PolarHBondContact O-N 3.25Å; R2276-Y2278 VanDerWaalsContact C-N 3.33Å; R2276-Y2278 PolarHBondContact O-N 3.03Å; R2276-Q2279 PolarHBondContact O-N 3.18Å; R2276-E2280 VanDerWaalsContact CG-OE1 3.29Å; R2276-E2280 WeakPolarHBondContact CG-OE1 3.31Å; R2276-E2280 IonicContact CZ-OE1 3.47Å; R2276-E2280 IonicContact CZ-OE2 3.2Å; R2276-E2280 IonicContact NH1-OE1 3.35Å; R2276-E2280 PolarHBondContact NH1-OE1 3.07Å; R2276-E2280 IonicContact NH1-OE2 3.32Å; R2276-E2280 PolarHBondContact NH1-OE2 3.2Å; R2276-E2280 WeakPolarHBondContact O-CG 3.34Å; R2276-E2280 PolarHBondContact O-N 3.21Å
2277	R	86.3	Confident	79.6	Confident	102.4 Å²	102.4	78.3 Å²	78.3	39%	0.386	36%	0.364	S	S	.	.	H	α-helix	trans	-57.8	-44.4	179.2	-75.9	-177.9	-177.4	-155.6	-3.3	112.4	E2273 Q2274 E2280 Q2281 H2394	E2273-R2277 WeakPolarHBondContact O-CB 3.44Å; E2273-R2277 WeakPolarHBondContact O-CG 3.37Å; E2273-R2277 PolarHBondContact O-N 3.25Å; E2273-R2277 IonicContact OE1-CZ 3.53Å; E2273-R2277 VanDerWaalsContact OE1-CZ 3.26Å; E2273-R2277 IonicContact OE1-NE 3.14Å; E2273-R2277 PolarHBondContact OE1-NE 3.26Å; E2273-R2277 IonicContact OE1-NH2 2.97Å; E2273-R2277 PolarHBondContact OE1-NH2 3.29Å; Q2274-R2277 PolarHBondContact O-N 3.13Å; R2277-E2280 PolarHBondContact O-N 3.23Å; R2277-Q2281 WeakPolarHBondContact O-CG 3.35Å; R2277-Q2281 PolarHBondContact O-N 3.07Å; R2277-Q2281 VanDerWaalsContact O-N 3.08Å; R2277-H2394 PolarHBondContact NH1-NE2 3.23Å
2278	Y	83.8	Confident	76.9	Confident	50 Å²	50	87.1 Å²	87.1	20%	0.196	40%	0.404	C	S	.	.	H	α-helix	trans	-68.1	-40.4	-179.5	-169.3	-95.8	0	0	0	111.9	Q2274 V2275 R2276 E2280 Q2281 E2282 T2383 A2385 A2386	Q2274-Y2278 WeakPolarHBondContact O-CB 3.41Å; Q2274-Y2278 PolarHBondContact O-N 3.16Å; Q2274-Y2278 VanDerWaalsContact O-N 3.08Å; V2275-Y2278 PolarHBondContact O-N 2.89Å; R2276-Y2278 VanDerWaalsContact C-N 3.33Å; R2276-Y2278 PolarHBondContact O-N 3.03Å; Y2278-E2280 VanDerWaalsContact C-N 3.27Å; Y2278-E2280 PolarHBondContact O-N 3.16Å; Y2278-Q2281 PolarHBondContact O-N 3.16Å; Y2278-E2282 HydrophobicContact CD1-CG 4.27Å; Y2278-E2282 VanDerWaalsContact CE1-CD 3.45Å; Y2278-E2282 HydrophobicContact CE1-CG 3.8Å; Y2278-E2282 VanDerWaalsContact CE1-OE1 3.25Å; Y2278-E2282 WeakPolarHBondContact CE1-OE1 3.4Å; Y2278-E2282 PolarHBondContact O-N 3.12Å; Y2278-E2282 PolarHBondContact OH-OE1 3.34Å; Y2278-T2383 HydrophobicContact CE1-CG2 4.26Å; Y2278-T2383 PolarHBondContact OH-OG1 3.41Å; Y2278-A2385 HydrophobicContact CE2-CB 4.22Å; Y2278-A2385 WeakPolarHBondContact OH-CB 3.3Å; Y2278-A2386 HydrophobicContact CD1-CB 4.03Å; Y2278-A2386 HydrophobicContact CD2-CB 3.58Å; Y2278-A2386 VanDerWaalsContact CD2-CB 3.47Å; Y2278-A2386 HydrophobicContact CE1-CB 4.25Å; Y2278-A2386 HydrophobicContact CE2-CB 3.92Å; Y2278-A2386 HydrophobicContact CG-CB 3.64Å
2279	Q	83.7	Confident	74.2	Confident	101.4 Å²	101.4	90.8 Å²	90.8	47%	0.474	44%	0.435	S	S	.	.	H	α-helix	trans	-62.8	-30.5	173.6	-73.5	176.1	1.9	0	0	113.2	V2275 R2276 K2283	V2275-Q2279 HydrophobicContact CG1-CG 4.49Å; V2275-Q2279 WeakPolarHBondContact O-CB 3.37Å; V2275-Q2279 VanDerWaalsContact O-CG 3.26Å; V2275-Q2279 WeakPolarHBondContact O-CG 3.4Å; V2275-Q2279 PolarHBondContact O-N 3.13Å; V2275-Q2279 VanDerWaalsContact O-N 3.1Å; R2276-Q2279 PolarHBondContact O-N 3.18Å; Q2279-K2283 WeakPolarHBondContact O-CD 3.44Å; Q2279-K2283 WeakPolarHBondContact O-CE 3.43Å; Q2279-K2283 VanDerWaalsContact O-CG 3.25Å; Q2279-K2283 WeakPolarHBondContact O-CG 3.4Å; Q2279-K2283 PolarHBondContact O-N 3.24Å
2280	E	83.9	Confident	71.3	Confident	79.4 Å²	79.4	96.3 Å²	96.3	37%	0.371	46%	0.456	S	S	.	.	H	α-helix	trans	-74.1	-39	174.2	-74.4	167.2	-171.9	0	0	112	R2276 R2277 Y2278 K2283 Q2284	R2276-E2280 VanDerWaalsContact CG-OE1 3.29Å; R2276-E2280 WeakPolarHBondContact CG-OE1 3.31Å; R2276-E2280 IonicContact CZ-OE1 3.47Å; R2276-E2280 IonicContact CZ-OE2 3.2Å; R2276-E2280 IonicContact NH1-OE1 3.35Å; R2276-E2280 PolarHBondContact NH1-OE1 3.07Å; R2276-E2280 IonicContact NH1-OE2 3.32Å; R2276-E2280 PolarHBondContact NH1-OE2 3.2Å; R2276-E2280 WeakPolarHBondContact O-CG 3.34Å; R2276-E2280 PolarHBondContact O-N 3.21Å; R2277-E2280 PolarHBondContact O-N 3.23Å; Y2278-E2280 VanDerWaalsContact C-N 3.27Å; Y2278-E2280 PolarHBondContact O-N 3.16Å; E2280-K2283 PolarHBondContact O-N 3.29Å; E2280-Q2284 WeakPolarHBondContact O-CG 3.3Å; E2280-Q2284 PolarHBondContact O-N 3.28Å; E2280-Q2284 VanDerWaalsContact O-N 3.14Å
2281	Q	74.7	Confident	68.5	Low	76.6 Å²	76.6	102.3 Å²	102.3	36%	0.358	49%	0.487	S	S	.	.	H	α-helix	trans	-65.4	-42.1	175	-72.6	176.9	-1.9	0	0	112.4	R2277 Y2278 K2283 Q2284 Q2285	R2277-Q2281 WeakPolarHBondContact O-CG 3.35Å; R2277-Q2281 PolarHBondContact O-N 3.07Å; R2277-Q2281 VanDerWaalsContact O-N 3.08Å; Y2278-Q2281 PolarHBondContact O-N 3.16Å; Q2281-K2283 VanDerWaalsContact C-N 3.3Å; Q2281-K2283 PolarHBondContact O-N 3.06Å; Q2281-Q2284 PolarHBondContact O-N 2.92Å; Q2281-Q2284 VanDerWaalsContact O-N 3.15Å; Q2281-Q2285 WeakPolarHBondContact O-CG 3.3Å; Q2281-Q2285 PolarHBondContact O-N 3.04Å; Q2281-Q2285 VanDerWaalsContact O-N 3.11Å
2282	E	73.6	Confident	65.5	Low	93.6 Å²	93.6	111.3 Å²	111.3	44%	0.437	53%	0.527	S	S	.	.	H	α-helix	trans	-62.8	-37.3	175.6	-78.1	-167.9	154	0	0	112.3	Y2278 Q2284 Q2285 Q2286	Y2278-E2282 HydrophobicContact CD1-CG 4.27Å; Y2278-E2282 VanDerWaalsContact CE1-CD 3.45Å; Y2278-E2282 HydrophobicContact CE1-CG 3.8Å; Y2278-E2282 VanDerWaalsContact CE1-OE1 3.25Å; Y2278-E2282 WeakPolarHBondContact CE1-OE1 3.4Å; Y2278-E2282 PolarHBondContact O-N 3.12Å; Y2278-E2282 PolarHBondContact OH-OE1 3.34Å; E2282-Q2284 VanDerWaalsContact C-N 3.3Å; E2282-Q2284 PolarHBondContact O-N 3.26Å; E2282-Q2285 PolarHBondContact O-N 2.98Å; E2282-Q2286 PolarHBondContact O-N 2.99Å
2283	K	73.4	Confident	62.6	Low	155.6 Å²	155.6	112.1 Å²	112.1	68%	0.677	54%	0.543	S	S	*	.	H	α-helix	trans	-66.4	-32.8	176	-74.7	173.4	-174.8	174	0	112.9	Q2279 E2280 Q2281 Q2285	Q2279-K2283 WeakPolarHBondContact O-CD 3.44Å; Q2279-K2283 WeakPolarHBondContact O-CE 3.43Å; Q2279-K2283 VanDerWaalsContact O-CG 3.25Å; Q2279-K2283 WeakPolarHBondContact O-CG 3.4Å; Q2279-K2283 PolarHBondContact O-N 3.24Å; E2280-K2283 PolarHBondContact O-N 3.29Å; Q2281-K2283 VanDerWaalsContact C-N 3.3Å; Q2281-K2283 PolarHBondContact O-N 3.06Å; K2283-Q2285 PolarHBondContact O-N 3.29Å
2284	Q	61.5	Low	59.6	Low	162.4 Å²	162.4	117.3 Å²	117.3	76%	0.759	57%	0.572	S	S	*	*	H	α-helix	trans	-77.4	-23.8	177.9	-70.3	174.2	16.9	0	0	112.8	E2280 Q2281 E2282	E2280-Q2284 WeakPolarHBondContact O-CG 3.3Å; E2280-Q2284 PolarHBondContact O-N 3.28Å; E2280-Q2284 VanDerWaalsContact O-N 3.14Å; Q2281-Q2284 PolarHBondContact O-N 2.92Å; Q2281-Q2284 VanDerWaalsContact O-N 3.15Å; E2282-Q2284 VanDerWaalsContact C-N 3.3Å; E2282-Q2284 PolarHBondContact O-N 3.26Å
2285	Q	54.6	Low	56.8	Low	156.4 Å²	156.4	121.7 Å²	121.7	73%	0.731	60%	0.604	S	S	*	*	H	α-helix	trans	-90.9	-7.5	179.5	-69.5	-179.5	21.2	0	0	114.1	Q2281 E2282 K2283 P2287	Q2281-Q2285 WeakPolarHBondContact O-CG 3.3Å; Q2281-Q2285 PolarHBondContact O-N 3.04Å; Q2281-Q2285 VanDerWaalsContact O-N 3.11Å; E2282-Q2285 PolarHBondContact O-N 2.98Å; K2283-Q2285 PolarHBondContact O-N 3.29Å; Q2285-P2287 VanDerWaalsContact O-CD 3.27Å; Q2285-P2287 WeakPolarHBondContact O-CD 3.34Å
2286	Q	40.9	Very low	53.8	Low	147 Å²	147	131.7 Å²	131.7	69%	0.687	65%	0.647	S	S	*	*	S	Bend	trans	-80.8	113.1	171	-75.3	-173.1	11.4	0	0	110.5	E2282 H2288	E2282-Q2286 PolarHBondContact O-N 2.99Å; Q2286-H2288 PolarHBondContact O-N 2.99Å
2287	P	40.7	Very low	50.9	Low	110.2 Å²	110.2	131.9 Å²	131.9	72%	0.716	67%	0.665	S	S	*	*			trans	-68	137.5	178.5	12.1	-9.4	0	0	0	110.5	Q2285 S2289	Q2285-P2287 VanDerWaalsContact O-CD 3.27Å; Q2285-P2287 WeakPolarHBondContact O-CD 3.34Å; P2287-S2289 VanDerWaalsContact C-N 3.29Å; P2287-S2289 PolarHBondContact O-N 2.94Å
2288	H	36.6	Very low	48.1	Very low	190.6 Å²	190.6	132.1 Å²	132.1	88%	0.882	68%	0.682	S	S	*	*			trans	-59.7	88.6	174.3	-75.8	-79.8	0	0	0	112.1	Q2286 F2290	Q2286-H2288 PolarHBondContact O-N 2.99Å; H2288-F2290 PolarHBondContact O-N 3.25Å
2289	S	33.3	Very low	45.5	Very low	109.2 Å²	109.2	136.8 Å²	136.8	76%	0.764	71%	0.709	S	S	*	*			trans	-100.8	74.4	163.9	56.3	0	0	0	0	110	P2287 L2291	P2287-S2289 VanDerWaalsContact C-N 3.29Å; P2287-S2289 PolarHBondContact O-N 2.94Å; S2289-L2291 VanDerWaalsContact C-N 3.28Å; S2289-L2291 PolarHBondContact O-N 3.15Å; S2289-L2291 VanDerWaalsContact O-N 3.14Å
2290	F	30.8	Very low	42.9	Very low	186 Å²	186	137.2 Å²	137.2	82%	0.816	72%	0.721	S	S	*	*			trans	-86.9	82.1	168.8	-150.5	-88.5	0	0	0	109.8	H2288	H2288-F2290 PolarHBondContact O-N 3.25Å
2291	L	33.2	Very low	40.1	Very low	163 Å²	163	140.2 Å²	140.2	85%	0.853	74%	0.74	S	S	*	*			trans	-112.9	111	169.3	-75.1	173.6	0	0	0	110.3	S2289 S2293	S2289-L2291 VanDerWaalsContact C-N 3.28Å; S2289-L2291 PolarHBondContact O-N 3.15Å; S2289-L2291 VanDerWaalsContact O-N 3.14Å; L2291-S2293 PolarHBondContact O-N 3.22Å; L2291-S2293 VanDerWaalsContact O-N 3.11Å
2292	K	29.9	Very low	38	Very low	191.4 Å²	191.4	143.6 Å²	143.6	83%	0.832	76%	0.759	S	S	*	*			trans	-76.2	120.9	157.9	-75.8	175.3	177.5	179.3	0	108.8
2293	S	30.6	Very low	35.7	Very low	102.8 Å²	102.8	146.8 Å²	146.8	72%	0.719	77%	0.774	S	S	*	*			trans	-124	114.1	156.7	54.9	0	0	0	0	109.1	L2291 S2295	L2291-S2293 PolarHBondContact O-N 3.22Å; L2291-S2293 VanDerWaalsContact O-N 3.11Å; S2293-S2295 PolarHBondContact O-N 3.03Å
2294	D	29.2	Very low	33.6	Very low	163.2 Å²	163.2	147.2 Å²	147.2	87%	0.873	78%	0.782	S	S	*	*			trans	-74.9	120.1	160.4	-76.2	-57.4	0	0	0	109.9
2295	S	31.2	Very low	31.9	Very low	105.6 Å²	105.6	146.6 Å²	146.6	74%	0.738	78%	0.784	S	S	*	*			trans	-134.8	107.1	165.7	-33.1	0	0	0	0	110	S2293 S2297	S2293-S2295 PolarHBondContact O-N 3.03Å; S2295-S2297 PolarHBondContact O-N 3.31Å
2296	K	28.9	Very low	30.7	Very low	216.2 Å²	216.2	144.4 Å²	144.4	94%	0.94	78%	0.783	S	S	*	*			trans	-84.4	108	161.7	-75.7	172.1	-179.4	175.9	0	108.8	S2298	K2296-S2298 PolarHBondContact O-N 2.86Å
2297	S	29.2	Very low	30.1	Very low	107 Å²	107	142.8 Å²	142.8	75%	0.748	79%	0.788	S	S	*	*			trans	-127.8	110.6	161.4	57.7	0	0	0	0	110.2	S2295 I2299	S2295-S2297 PolarHBondContact O-N 3.31Å; S2297-I2299 PolarHBondContact O-N 2.62Å
2298	S	27.5	Very low	29.5	Very low	107 Å²	107	146.5 Å²	146.5	75%	0.748	80%	0.795	S	S	*	*			trans	-40	116.3	147	147.2	0	0	0	0	112.1	K2296 C2300	K2296-S2298 PolarHBondContact O-N 2.86Å; S2298-C2300 PolarHBondContact O-N 3.26Å
2299	I	29	Very low	29.1	Very low	148.2 Å²	148.2	142.7 Å²	142.7	76%	0.76	79%	0.79	S	S	*	*			trans	-57.7	113.4	156.1	-64	167.1	0	0	0	109.1	S2297	S2297-I2299 PolarHBondContact O-N 2.62Å
2300	C	28.1	Very low	28.9	Very low	109.2 Å²	109.2	142 Å²	142	74%	0.738	79%	0.791	S	S	*	*			trans	-120.6	126.3	159.1	-76.7	0	0	0	0	107.2	S2298 I2302	S2298-C2300 PolarHBondContact O-N 3.26Å; C2300-I2302 VanDerWaalsContact C-N 3.31Å; C2300-I2302 HydrophobicContact CB-CG1 4.49Å; C2300-I2302 PolarHBondContact O-N 3.04Å
2301	D	26.1	Very low	28.8	Very low	142.4 Å²	142.4	141.9 Å²	141.9	76%	0.761	79%	0.793	S	S	*	*			trans	-40	116.8	162.1	-61.2	-56.9	0	0	0	112.2	H2303	D2301-H2303 PolarHBondContact O-N 3.2Å
2302	I	29.1	Very low	28.6	Very low	148 Å²	148	140.7 Å²	140.7	76%	0.759	79%	0.793	S	S	*	*			trans	-117.6	109.7	152.2	-77.9	170.2	0	0	0	109.3	C2300 L2304	C2300-I2302 VanDerWaalsContact C-N 3.31Å; C2300-I2302 HydrophobicContact CB-CG1 4.49Å; C2300-I2302 PolarHBondContact O-N 3.04Å; I2302-L2304 HydrophobicContact CG2-CD1 4.46Å; I2302-L2304 HydrophobicContact CG2-CG 4.39Å; I2302-L2304 PolarHBondContact O-N 3.24Å; I2302-L2304 VanDerWaalsContact O-N 3.14Å
2303	H	26.3	Very low	28.5	Very low	161.2 Å²	161.2	136.2 Å²	136.2	75%	0.746	79%	0.786	S	S	*	*			trans	-41.1	108.2	160.3	-90.9	-88.2	0	0	0	113	D2301 L2305	D2301-H2303 PolarHBondContact O-N 3.2Å; H2303-L2305 PolarHBondContact O-N 3.03Å; H2303-L2305 VanDerWaalsContact O-N 3.13Å
2304	L	28	Very low	28.4	Very low	163.2 Å²	163.2	138.5 Å²	138.5	85%	0.854	79%	0.79	S	S	*	*			trans	-94.5	99.7	152.9	-85.8	151.4	0	0	0	109.2	I2302 P2306	I2302-L2304 HydrophobicContact CG2-CD1 4.46Å; I2302-L2304 HydrophobicContact CG2-CG 4.39Å; I2302-L2304 PolarHBondContact O-N 3.24Å; I2302-L2304 VanDerWaalsContact O-N 3.14Å; L2304-P2306 WeakPolarHBondContact O-CD 3.27Å
2305	L	25.8	Very low	28.4	Very low	151.2 Å²	151.2	140.2 Å²	140.2	79%	0.792	79%	0.789	S	S	*	*			trans	-80.7	134.5	161.2	-91.4	145.8	0	0	0	108.6	H2303 S2307	H2303-L2305 PolarHBondContact O-N 3.03Å; H2303-L2305 VanDerWaalsContact O-N 3.13Å; L2305-S2307 PolarHBondContact O-N 3.24Å
2306	P	30.4	Very low	28.3	Very low	109.8 Å²	109.8	144.2 Å²	144.2	71%	0.713	79%	0.794	S	S	*	*			trans	-86.7	123.7	173	-0.8	19.9	0	0	0	109.8	L2304 H2308	L2304-P2306 WeakPolarHBondContact O-CD 3.27Å; P2306-H2308 VanDerWaalsContact C-N 3.33Å; P2306-H2308 PolarHBondContact O-N 3.14Å
2307	S	27.5	Very low	28.3	Very low	113.4 Å²	113.4	141.7 Å²	141.7	79%	0.793	79%	0.79	S	S	*	*			trans	-71.3	117.9	168.5	50.3	0	0	0	0	110.2	L2305 S2309	L2305-S2307 PolarHBondContact O-N 3.24Å; S2307-S2309 PolarHBondContact O-N 3.39Å; S2307-S2309 VanDerWaalsContact O-N 3.12Å
2308	H	29.1	Very low	28.2	Very low	187 Å²	187	141.5 Å²	141.5	87%	0.866	80%	0.796	S	S	*	*			trans	-86.4	119	167.8	-75.1	-77.6	0	0	0	110.9	P2306 A2310	P2306-H2308 VanDerWaalsContact C-N 3.33Å; P2306-H2308 PolarHBondContact O-N 3.14Å; H2308-A2310 PolarHBondContact O-N 3.18Å; H2308-A2310 VanDerWaalsContact O-N 3.15Å
2309	S	28.2	Very low	28.2	Very low	111 Å²	111	142.1 Å²	142.1	78%	0.776	80%	0.8	S	S	*	*			trans	-84.8	115.5	166.2	49	0	0	0	0	109.6	S2307 E2311	S2307-S2309 PolarHBondContact O-N 3.39Å; S2307-S2309 VanDerWaalsContact O-N 3.12Å; S2309-E2311 PolarHBondContact O-N 2.91Å
2310	A	29.1	Very low	28.2	Very low	95.6 Å²	95.6	139.8 Å²	139.8	79%	0.79	80%	0.803	S	S	*	*			trans	-93	110.4	165.5	0	0	0	0	0	108.5	H2308 T2312	H2308-A2310 PolarHBondContact O-N 3.18Å; H2308-A2310 VanDerWaalsContact O-N 3.15Å; A2310-T2312 PolarHBondContact O-N 3.23Å
2311	E	28	Very low	28.2	Very low	184 Å²	184	138.4 Å²	138.4	86%	0.86	81%	0.806	S	S	*	*			trans	-82.1	132.5	164.6	-68.4	179.3	149.2	0	0	109.3	S2309 S2313	S2309-E2311 PolarHBondContact O-N 2.91Å; E2311-S2313 PolarHBondContact O-N 3Å
2312	T	29.6	Very low	28.3	Very low	136.6 Å²	136.6	140.8 Å²	140.8	84%	0.838	81%	0.81	S	S	*	*			trans	-124.3	123.6	162.1	32.9	0	0	0	0	110.2	A2310 D2314	A2310-T2312 PolarHBondContact O-N 3.23Å; T2312-D2314 PolarHBondContact O-N 2.59Å
2313	S	26.9	Very low	28.4	Very low	98.6 Å²	98.6	141.1 Å²	141.1	69%	0.69	81%	0.814	S	S	*	*			trans	-103.6	136.9	171.8	50.4	0	0	0	0	110.7	E2311	E2311-S2313 PolarHBondContact O-N 3Å
2314	D	30.2	Very low	28.6	Very low	150.4 Å²	150.4	138 Å²	138	80%	0.804	82%	0.816	S	S	*	*				-154.3	125	104.4	-91.2	-44	0	0	0	112.9	T2312 K2316	T2312-D2314 PolarHBondContact O-N 2.59Å; D2314-K2316 PolarHBondContact O-N 3.47Å
2315	K	28.4	Very low	28.7	Very low	198.2 Å²	198.2	136.2 Å²	136.2	86%	0.862	81%	0.807	S	S	*	*			trans	-112.7	117.7	157.9	-78.2	175.4	179.6	173.4	0	110.5
2316	K	28.4	Very low	29.2	Very low	189.8 Å²	189.8	133.5 Å²	133.5	83%	0.825	80%	0.798	S	S	*	*			trans	-162.8	120.2	158.4	-82.4	168.1	-177.8	176.4	0	110.7	D2314	D2314-K2316 PolarHBondContact O-N 3.47Å
2317	N	28.9	Very low	29.4	Very low	163.4 Å²	163.4	134.3 Å²	134.3	87%	0.874	79%	0.791	S	S	*	*			trans	-173.5	101.5	137.2	-84	-18.7	0	0	0	111.7
2318	A	27.8	Very low	29.8	Very low	104.2 Å²	104.2	136.1 Å²	136.1	86%	0.861	79%	0.789	S	S	*	*			trans	-118.6	103.4	162.7	0	0	0	0	0	109.3
2319	S	28.2	Very low	30.2	Very low	118.4 Å²	118.4	131.3 Å²	131.3	83%	0.828	77%	0.769	S	S	*	*			trans	-152	124	159.9	51.9	0	0	0	0	110.5	G2321	S2319-G2321 PolarHBondContact O-N 3.37Å
2320	A	28.6	Very low	30.9	Very low	100.6 Å²	100.6	130.2 Å²	130.2	83%	0.831	76%	0.755	S	S	*	*			trans	-101.3	123	169.9	0	0	0	0	0	111.7	K2322	A2320-K2322 HydrophobicContact CB-CG 4.34Å; A2320-K2322 PolarHBondContact O-N 3.41Å
2321	G	27.8	Very low	31.6	Very low	78.8 Å²	78.8	128.2 Å²	128.2	81%	0.812	74%	0.738	S	S	*	*			trans	-104	114.8	164.4	0	0	0	0	0	111.7	S2319 D2323	S2319-G2321 PolarHBondContact O-N 3.37Å; G2321-D2323 PolarHBondContact O-N 3.17Å
2322	K	28.8	Very low	32.4	Very low	192.4 Å²	192.4	123.8 Å²	123.8	84%	0.837	72%	0.716	S	S	*	*			trans	-70	119.1	157.4	-71.5	177.7	175.5	178.9	0	110	A2320 A2324	A2320-K2322 HydrophobicContact CB-CG 4.34Å; A2320-K2322 PolarHBondContact O-N 3.41Å; K2322-A2324 PolarHBondContact O-N 3.31Å
2323	D	30.4	Very low	33.2	Very low	155.8 Å²	155.8	119.6 Å²	119.6	83%	0.833	69%	0.688	S	S	*	*			trans	-170.8	114.6	143.7	-70.5	-35.8	0	0	0	110.2	G2321 D2325	G2321-D2323 PolarHBondContact O-N 3.17Å; D2323-D2325 VanDerWaalsContact C-N 3.3Å; D2323-D2325 PolarHBondContact O-N 2.79Å
2324	A	30	Very low	34.2	Very low	95.4 Å²	95.4	118.4 Å²	118.4	79%	0.788	67%	0.674	S	S	*	*			trans	-78	107.5	173.2	0	0	0	0	0	109.5	K2322 P2326	K2322-A2324 PolarHBondContact O-N 3.31Å; A2324-P2326 VanDerWaalsContact O-CD 3.31Å; A2324-P2326 WeakPolarHBondContact O-CD 3.26Å; A2324-P2326 VanDerWaalsContact O-N 3.11Å
2325	D	31.4	Very low	35	Very low	125.2 Å²	125.2	116.6 Å²	116.6	67%	0.67	66%	0.659	S	S	*	*			trans	-68.9	129.1	164	-102.3	-31.7	0	0	0	111.4	D2323 F2327 M2328	D2323-D2325 VanDerWaalsContact C-N 3.3Å; D2323-D2325 PolarHBondContact O-N 2.79Å; D2325-F2327 HydrophobicContact CB-CD2 4.39Å; D2325-F2327 PolarHBondContact O-N 3.35Å; D2325-F2327 VanDerWaalsContact O-N 3.14Å; D2325-F2327 WeakPolarHBondContact OD1-CD2 3.39Å; D2325-M2328 PolarHBondContact O-N 3.03Å
2326	P	35.5	Very low	36	Very low	94.2 Å²	94.2	109.3 Å²	109.3	61%	0.612	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.3	11	179.4	0.9	8.1	0	0	0	112.9	A2324 M2328 N2329	A2324-P2326 VanDerWaalsContact O-CD 3.31Å; A2324-P2326 WeakPolarHBondContact O-CD 3.26Å; A2324-P2326 VanDerWaalsContact O-N 3.11Å; P2326-M2328 VanDerWaalsContact C-N 3.29Å; P2326-M2328 PolarHBondContact O-N 2.83Å; P2326-N2329 PolarHBondContact O-N 3.37Å
2327	F	35.3	Very low	37.2	Very low	127.2 Å²	127.2	104.4 Å²	104.4	56%	0.558	61%	0.61	S	S	*	*			trans	-100.8	12.3	-174.6	-74.3	-81.5	0	0	0	113.9	M1867 P1868 D2325 N2329 D2330	M1867-F2327 HydrophobicContact CB-CD1 4.47Å; M1867-F2327 HydrophobicContact CB-CE1 4.03Å; M1867-F2327 HydrophobicContact CB-CE2 4.43Å; M1867-F2327 HydrophobicContact CB-CZ 4.01Å; M1867-F2327 HydrophobicContact CE-CD2 3.71Å; M1867-F2327 HydrophobicContact CE-CE2 3.14Å; M1867-F2327 HydrophobicContact CE-CZ 3.9Å; M1867-F2327 HydrophobicContact CG-CE1 4.48Å; M1867-F2327 HydrophobicContact CG-CE2 4.06Å; M1867-F2327 HydrophobicContact CG-CZ 3.97Å; M1867-F2327 HydrophobicContact SD-CD2 3.55Å; M1867-F2327 VanDerWaalsContact SD-CD2 3.55Å; M1867-F2327 HydrophobicContact SD-CE2 3.4Å; M1867-F2327 WeakPolarHBondContact SD-CE2 3.46Å; M1867-F2327 HydrophobicContact SD-CG 4.26Å; M1867-F2327 HydrophobicContact SD-CZ 3.93Å; P1868-F2327 HydrophobicContact CG-CB 4.01Å; P1868-F2327 WeakPolarHBondContact O-CD1 3.31Å; D2325-F2327 HydrophobicContact CB-CD2 4.39Å; D2325-F2327 PolarHBondContact O-N 3.35Å; D2325-F2327 VanDerWaalsContact O-N 3.14Å; D2325-F2327 WeakPolarHBondContact OD1-CD2 3.39Å; F2327-N2329 VanDerWaalsContact C-N 3.32Å; F2327-N2329 PolarHBondContact O-N 3.23Å; F2327-D2330 PolarHBondContact O-N 3.14Å
2328	M	34.5	Very low	38.4	Very low	151.8 Å²	151.8	98.1 Å²	98.1	75%	0.748	58%	0.578	S	S	*	*			trans	-78.3	49.1	169.7	-79.8	-101.7	174.3	0	0	113.4	D2325 P2326 K2349 R2350	D2325-M2328 PolarHBondContact O-N 3.03Å; P2326-M2328 VanDerWaalsContact C-N 3.29Å; P2326-M2328 PolarHBondContact O-N 2.83Å; M2328-K2349 PolarHBondContact O-NZ 3.08Å; M2328-R2350 PolarHBondContact O-NH1 3.42Å
2329	N	39.2	Very low	39.7	Very low	86.4 Å²	86.4	95.7 Å²	95.7	46%	0.462	55%	0.551	S	S	.	*			trans	-110.6	7.2	171.8	-86.8	-29.8	0	0	0	111.8	L2250 P2326 F2327 A2331 F2332 I2333 K2349 R2350	L2250-N2329 HydrophobicContact CB-CB 4.27Å; L2250-N2329 HydrophobicContact CD2-CB 3.83Å; P2326-N2329 PolarHBondContact O-N 3.37Å; F2327-N2329 VanDerWaalsContact C-N 3.32Å; F2327-N2329 PolarHBondContact O-N 3.23Å; N2329-A2331 VanDerWaalsContact C-N 3.3Å; N2329-A2331 PolarHBondContact O-N 3.06Å; N2329-A2331 VanDerWaalsContact O-N 3.13Å; N2329-F2332 VanDerWaalsContact O-CB 3.31Å; N2329-F2332 WeakPolarHBondContact O-CB 3.43Å; N2329-F2332 PolarHBondContact O-N 2.89Å; N2329-F2332 VanDerWaalsContact O-N 3.13Å; N2329-I2333 WeakPolarHBondContact O-CG1 3.45Å; N2329-I2333 PolarHBondContact O-N 3.29Å; N2329-K2349 WeakPolarHBondContact OD1-CB 3.36Å; N2329-K2349 WeakPolarHBondContact OD1-CD 3.44Å; N2329-R2350 PolarHBondContact OD1-NH1 3.07Å
2330	D	41.8	Very low	41.2	Very low	87.8 Å²	87.8	93.4 Å²	93.4	47%	0.47	53%	0.527	S	S	.	.	H	α-helix	trans	-70.3	-22	-178.5	-78.2	-21.6	0	0	0	112.2	T1857 P1868 F2327 F2332 I2333 D2334	T1857-D2330 HydrophobicContact CG2-CB 4.45Å; P1868-D2330 VanDerWaalsContact CB-OD2 3.27Å; P1868-D2330 WeakPolarHBondContact CB-OD2 3.12Å; F2327-D2330 PolarHBondContact O-N 3.14Å; D2330-F2332 PolarHBondContact O-N 3.14Å; D2330-F2332 VanDerWaalsContact O-N 3.07Å; D2330-I2333 PolarHBondContact O-N 3.03Å; D2330-D2334 PolarHBondContact O-N 3.01Å
2331	A	44.2	Very low	42.9	Very low	52 Å²	52	89.5 Å²	89.5	43%	0.43	49%	0.492	S	S	.	.	H	α-helix	trans	-71.7	-1.6	176.4	0	0	0	0	0	113.5	T1857 N2329 K2335	T1857-A2331 VanDerWaalsContact OG1-CA 3.32Å; T1857-A2331 WeakPolarHBondContact OG1-CA 3.43Å; T1857-A2331 VanDerWaalsContact OG1-CB 3.23Å; T1857-A2331 WeakPolarHBondContact OG1-CB 3.36Å; N2329-A2331 VanDerWaalsContact C-N 3.3Å; N2329-A2331 PolarHBondContact O-N 3.06Å; N2329-A2331 VanDerWaalsContact O-N 3.13Å; A2331-K2335 WeakPolarHBondContact O-CD 3.33Å; A2331-K2335 WeakPolarHBondContact O-CE 3.42Å; A2331-K2335 VanDerWaalsContact O-CG 3.28Å; A2331-K2335 WeakPolarHBondContact O-CG 3.41Å; A2331-K2335 PolarHBondContact O-N 3.37Å; A2331-K2335 PolarHBondContact O-NZ 3.15Å
2332	F	44.5	Very low	44.7	Very low	91.6 Å²	91.6	86.8 Å²	86.8	40%	0.402	46%	0.459	S	S	.	.	H	α-helix	trans	-101.6	-28.8	169.9	-169.5	-97.3	0	0	0	113.4	L2250 N2329 D2330 D2334 K2335 L2336 Q2344 I2345 T2347	L2250-F2332 HydrophobicContact CB-CD1 3.98Å; L2250-F2332 HydrophobicContact CB-CE1 3.72Å; L2250-F2332 HydrophobicContact CB-CZ 4.28Å; L2250-F2332 HydrophobicContact CD1-CD1 4.07Å; L2250-F2332 HydrophobicContact CD1-CE1 4.05Å; L2250-F2332 HydrophobicContact CD1-CE2 4.07Å; L2250-F2332 HydrophobicContact CD1-CZ 3.49Å; L2250-F2332 VanDerWaalsContact CD1-CZ 3.49Å; L2250-F2332 HydrophobicContact CD2-CE2 4.48Å; L2250-F2332 HydrophobicContact CD2-CZ 4.46Å; L2250-F2332 HydrophobicContact CG-CE1 4.21Å; L2250-F2332 HydrophobicContact CG-CZ 4.26Å; N2329-F2332 VanDerWaalsContact O-CB 3.31Å; N2329-F2332 WeakPolarHBondContact O-CB 3.43Å; N2329-F2332 PolarHBondContact O-N 2.89Å; N2329-F2332 VanDerWaalsContact O-N 3.13Å; D2330-F2332 PolarHBondContact O-N 3.14Å; D2330-F2332 VanDerWaalsContact O-N 3.07Å; F2332-D2334 VanDerWaalsContact C-N 3.29Å; F2332-D2334 PolarHBondContact O-N 3.34Å; F2332-K2335 CarbonylContact O-C 3.54Å; F2332-K2335 VanDerWaalsContact O-CA 3.24Å; F2332-K2335 WeakPolarHBondContact O-CA 3.37Å; F2332-K2335 WeakPolarHBondContact O-CB 3.49Å; F2332-K2335 PolarHBondContact O-N 3.06Å; F2332-L2336 HydrophobicContact CD1-CD1 3.56Å; F2332-L2336 HydrophobicContact CE1-CD1 3.63Å; F2332-L2336 VanDerWaalsContact CE1-CD1 3.48Å; F2332-L2336 HydrophobicContact CE2-CD1 3.88Å; F2332-L2336 HydrophobicContact CZ-CD1 3.22Å; F2332-L2336 WeakPolarHBondContact O-CD1 3.27Å; F2332-L2336 PolarHBondContact O-N 3.27Å; F2332-L2336 VanDerWaalsContact O-N 3.13Å; F2332-Q2344 VanDerWaalsContact CZ-OE1 3.31Å; F2332-I2345 HydrophobicContact CE1-CD1 4.03Å; F2332-I2345 HydrophobicContact CE2-CB 4.33Å; F2332-I2345 HydrophobicContact CE2-CG2 3.59Å; F2332-I2345 HydrophobicContact CZ-CB 3.84Å; F2332-I2345 HydrophobicContact CZ-CD1 3.58Å; F2332-I2345 HydrophobicContact CZ-CG1 4.33Å; F2332-I2345 HydrophobicContact CZ-CG2 3.61Å; F2332-T2347 HydrophobicContact CD1-CG2 4.02Å; F2332-T2347 HydrophobicContact CD2-CG2 3.96Å; F2332-T2347 HydrophobicContact CE1-CG2 3.24Å; F2332-T2347 HydrophobicContact CE2-CG2 3.78Å; F2332-T2347 WeakPolarHBondContact CE2-OG1 3.39Å; F2332-T2347 HydrophobicContact CZ-CG2 3.97Å
2333	I	46.3	Very low	46.5	Very low	49.4 Å²	49.4	81.2 Å²	81.2	25%	0.253	43%	0.432	S	S	.	.	H	α-helix	trans	-74.2	-21.6	176.9	-61.7	-165.5	0	0	0	110.5	L2088 R2092 F2249 L2250 T2253 N2329 D2330 K2335 L2336	L2088-I2333 HydrophobicContact CD1-CG2 3.7Å; L2088-I2333 HydrophobicContact CD2-CG2 4.46Å; R2092-I2333 PolarHBondContact NH2-O 3.08Å; F2249-I2333 HydrophobicContact CB-CD1 3.96Å; F2249-I2333 HydrophobicContact CD1-CB 4.33Å; F2249-I2333 HydrophobicContact CD1-CD1 3.74Å; F2249-I2333 HydrophobicContact CD1-CG1 4.16Å; F2249-I2333 HydrophobicContact CD1-CG2 3.81Å; F2249-I2333 HydrophobicContact CE1-CB 4.17Å; F2249-I2333 HydrophobicContact CE1-CG2 3.57Å; F2249-I2333 VanDerWaalsContact CE1-CG2 3.44Å; F2249-I2333 HydrophobicContact CG-CD1 4.32Å; F2249-I2333 HydrophobicContact CZ-CG2 4.37Å; L2250-I2333 HydrophobicContact CB-CG1 4.38Å; L2250-I2333 HydrophobicContact CD1-CD1 3.66Å; L2250-I2333 HydrophobicContact CD1-CG1 3.98Å; T2253-I2333 HydrophobicContact CG2-CD1 4.33Å; N2329-I2333 WeakPolarHBondContact O-CG1 3.45Å; N2329-I2333 PolarHBondContact O-N 3.29Å; D2330-I2333 PolarHBondContact O-N 3.03Å; I2333-K2335 VanDerWaalsContact C-N 3.31Å; I2333-K2335 PolarHBondContact O-N 3.24Å; I2333-L2336 WeakPolarHBondContact O-CB 3.17Å; I2333-L2336 PolarHBondContact O-N 3.27Å; I2333-L2336 VanDerWaalsContact O-N 3.1Å
2334	D	48.1	Very low	47.8	Very low	74.2 Å²	74.2	76.4 Å²	76.4	40%	0.397	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-8.5	170.6	-84.7	-17.5	0	0	0	112.2	R1876 R2092 D2330 F2332 L2336	R1876-D2334 PolarHBondContact NE-O 2.94Å; R1876-D2334 VanDerWaalsContact NE-O 3.17Å; R1876-D2334 PolarHBondContact NH2-O 3.33Å; R1876-D2334 VanDerWaalsContact NH2-O 3.12Å; R2092-D2334 IonicContact CZ-OD1 2.66Å; R2092-D2334 IonicContact NE-OD1 2.81Å; R2092-D2334 IonicContact NH2-OD1 2.91Å; R2092-D2334 PolarHBondContact NH2-OD1 3.14Å; D2330-D2334 PolarHBondContact O-N 3.01Å; F2332-D2334 VanDerWaalsContact C-N 3.29Å; F2332-D2334 PolarHBondContact O-N 3.34Å; D2334-L2336 VanDerWaalsContact C-N 3.31Å; D2334-L2336 PolarHBondContact O-N 2.99Å; D2334-L2336 VanDerWaalsContact O-N 3.09Å
2335	K	47.9	Very low	49	Very low	111.4 Å²	111.4	73.4 Å²	73.4	48%	0.484	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-7.3	171.3	-54.3	164.8	-176.9	177.3	0	112.6	S1855 A2331 F2332 I2333 M2337	S1855-K2335 PolarHBondContact OG-NZ 3.28Å; A2331-K2335 WeakPolarHBondContact O-CD 3.33Å; A2331-K2335 WeakPolarHBondContact O-CE 3.42Å; A2331-K2335 VanDerWaalsContact O-CG 3.28Å; A2331-K2335 WeakPolarHBondContact O-CG 3.41Å; A2331-K2335 PolarHBondContact O-N 3.37Å; A2331-K2335 PolarHBondContact O-NZ 3.15Å; F2332-K2335 CarbonylContact O-C 3.54Å; F2332-K2335 VanDerWaalsContact O-CA 3.24Å; F2332-K2335 WeakPolarHBondContact O-CA 3.37Å; F2332-K2335 WeakPolarHBondContact O-CB 3.49Å; F2332-K2335 PolarHBondContact O-N 3.06Å; I2333-K2335 VanDerWaalsContact C-N 3.31Å; I2333-K2335 PolarHBondContact O-N 3.24Å; K2335-M2337 WeakPolarHBondContact O-CE 3.4Å; K2335-M2337 PolarHBondContact O-N 3.11Å; K2335-M2337 VanDerWaalsContact O-N 3.09Å
2336	L	49.5	Very low	49.7	Very low	44.4 Å²	44.4	71.3 Å²	71.3	23%	0.232	37%	0.371	C	S	.	.			trans	-70	98.9	178.3	-114.8	94.6	0	0	0	111.2	L2088 F2332 I2333 D2334 Q2340 L2341 I2345 T2347	L2088-L2336 HydrophobicContact CD1-CD2 3.71Å; L2088-L2336 HydrophobicContact CD2-CB 3.92Å; L2088-L2336 HydrophobicContact CD2-CD2 4.07Å; L2088-L2336 HydrophobicContact CG-CD2 4.35Å; F2332-L2336 HydrophobicContact CD1-CD1 3.56Å; F2332-L2336 HydrophobicContact CE1-CD1 3.63Å; F2332-L2336 VanDerWaalsContact CE1-CD1 3.48Å; F2332-L2336 HydrophobicContact CE2-CD1 3.88Å; F2332-L2336 HydrophobicContact CZ-CD1 3.22Å; F2332-L2336 WeakPolarHBondContact O-CD1 3.27Å; F2332-L2336 PolarHBondContact O-N 3.27Å; F2332-L2336 VanDerWaalsContact O-N 3.13Å; I2333-L2336 WeakPolarHBondContact O-CB 3.17Å; I2333-L2336 PolarHBondContact O-N 3.27Å; I2333-L2336 VanDerWaalsContact O-N 3.1Å; D2334-L2336 VanDerWaalsContact C-N 3.31Å; D2334-L2336 PolarHBondContact O-N 2.99Å; D2334-L2336 VanDerWaalsContact O-N 3.09Å; L2336-Q2340 HydrophobicContact CD1-CB 3.45Å; L2336-Q2340 VanDerWaalsContact CD1-CB 3.45Å; L2336-Q2340 HydrophobicContact CG-CB 4.17Å; L2336-L2341 HydrophobicContact CD2-CD1 4.32Å; L2336-I2345 HydrophobicContact CD1-CD1 3.38Å; L2336-I2345 VanDerWaalsContact CD1-CD1 3.45Å; L2336-I2345 HydrophobicContact CD1-CG1 4.31Å; L2336-I2345 HydrophobicContact CD2-CD1 4.45Å; L2336-I2345 HydrophobicContact CG-CD1 3.72Å; L2336-T2347 HydrophobicContact CD1-CG2 4.29Å
2337	M	51.9	Low	50.3	Low	88.4 Å²	88.4	70.3 Å²	70.3	44%	0.435	36%	0.362	S	S	.	.			trans	-65.8	136.1	172.9	-65.5	-67.3	152.9	0	0	110.5	R1876 K2335 D2339 Q2340 L2341	R1876-M2337 PolarHBondContact NH2-SD 2.9Å; K2335-M2337 WeakPolarHBondContact O-CE 3.4Å; K2335-M2337 PolarHBondContact O-N 3.11Å; K2335-M2337 VanDerWaalsContact O-N 3.09Å; M2337-D2339 VanDerWaalsContact C-N 3.33Å; M2337-D2339 WeakPolarHBondContact CB-OD1 3.41Å; M2337-D2339 PolarHBondContact O-N 3.19Å; M2337-D2339 VanDerWaalsContact O-N 3.07Å; M2337-Q2340 HydrophobicContact CB-CB 4.42Å; M2337-Q2340 HydrophobicContact CB-CG 4.07Å; M2337-Q2340 WeakPolarHBondContact O-CA 3.44Å; M2337-Q2340 WeakPolarHBondContact O-CB 3.48Å; M2337-Q2340 PolarHBondContact O-N 3.27Å; M2337-L2341 PolarHBondContact O-N 2.99Å
2338	P	54.1	Low	50.8	Low	31.4 Å²	31.4	68.2 Å²	68.2	20%	0.204	36%	0.363	C	S	.	.	G	3₁₀ helix	trans	-54.2	-35.8	-174.5	-29.5	36.5	0	0	0	115	H2083 L2088 Q2340 L2341 M2342	H2083-P2338 HydrophobicContact CB-CB 4.12Å; H2083-P2338 VanDerWaalsContact CD2-CG 3.49Å; H2083-P2338 WeakPolarHBondContact CD2-CG 3.46Å; L2088-P2338 HydrophobicContact CD2-CB 4.45Å; L2088-P2338 HydrophobicContact CD2-CG 4.32Å; P2338-Q2340 VanDerWaalsContact C-N 3.32Å; P2338-Q2340 PolarHBondContact O-N 3Å; P2338-L2341 PolarHBondContact O-N 2.73Å; P2338-M2342 PolarHBondContact O-N 3.43Å
2339	D	54.9	Low	51.8	Low	52 Å²	52	68.1 Å²	68.1	28%	0.278	36%	0.359	S	S	.	.	G	3₁₀ helix	trans	-73.7	-8	179.8	-122.3	-19	0	0	0	113.9	H2083 H2084 D2085 M2337 L2341 R2343 S2435	H2083-D2339 IonicContact CE1-OD2 3.77Å; H2083-D2339 IonicContact CG-OD2 3.44Å; H2083-D2339 IonicContact ND1-OD2 3.72Å; H2083-D2339 PolarHBondContact ND1-OD2 3.07Å; H2084-D2339 PolarHBondContact N-OD1 3.39Å; D2085-D2339 PolarHBondContact N-OD1 2.95Å; M2337-D2339 VanDerWaalsContact C-N 3.33Å; M2337-D2339 WeakPolarHBondContact CB-OD1 3.41Å; M2337-D2339 PolarHBondContact O-N 3.19Å; M2337-D2339 VanDerWaalsContact O-N 3.07Å; D2339-L2341 PolarHBondContact O-N 3.35Å; D2339-R2343 WeakPolarHBondContact O-CB 3.27Å; D2339-R2343 WeakPolarHBondContact O-CD 3.14Å; D2339-R2343 WeakPolarHBondContact O-CG 3.49Å; D2339-R2343 PolarHBondContact O-N 3.24Å; D2339-R2343 IonicContact OD2-CZ 2.68Å; D2339-R2343 IonicContact OD2-NE 3.06Å; D2339-R2343 PolarHBondContact OD2-NE 2.67Å; D2339-R2343 IonicContact OD2-NH2 3.32Å; D2339-R2343 PolarHBondContact OD2-NH2 3.35Å; D2339-S2435 PolarHBondContact O-OG 3.15Å
2340	Q	59.7	Low	52.9	Low	70.8 Å²	70.8	72.9 Å²	72.9	33%	0.331	37%	0.371	S	S	.	.	G	3₁₀ helix	trans	-94.5	-6.4	179.6	-69	-165.6	-1	0	0	113.3	L2336 M2337 P2338 M2342 R2343 Q2344	L2336-Q2340 HydrophobicContact CD1-CB 3.45Å; L2336-Q2340 VanDerWaalsContact CD1-CB 3.45Å; L2336-Q2340 HydrophobicContact CG-CB 4.17Å; M2337-Q2340 HydrophobicContact CB-CB 4.42Å; M2337-Q2340 HydrophobicContact CB-CG 4.07Å; M2337-Q2340 WeakPolarHBondContact O-CA 3.44Å; M2337-Q2340 WeakPolarHBondContact O-CB 3.48Å; M2337-Q2340 PolarHBondContact O-N 3.27Å; P2338-Q2340 VanDerWaalsContact C-N 3.32Å; P2338-Q2340 PolarHBondContact O-N 3Å; Q2340-M2342 VanDerWaalsContact C-N 3.28Å; Q2340-M2342 PolarHBondContact O-N 3.07Å; Q2340-M2342 VanDerWaalsContact O-N 3.12Å; Q2340-R2343 HydrophobicContact CB-CB 4.32Å; Q2340-R2343 HydrophobicContact CB-CG 4.43Å; Q2340-R2343 CarbonylContact O-C 3.55Å; Q2340-R2343 WeakPolarHBondContact O-CB 3.3Å; Q2340-R2343 PolarHBondContact O-N 3.17Å; Q2340-Q2344 HydrophobicContact CB-CG 4.21Å; Q2340-Q2344 WeakPolarHBondContact O-CA 3.35Å; Q2340-Q2344 WeakPolarHBondContact O-CB 3.33Å; Q2340-Q2344 VanDerWaalsContact O-CG 3.23Å; Q2340-Q2344 WeakPolarHBondContact O-CG 3.45Å; Q2340-Q2344 PolarHBondContact O-N 2.97Å
2341	L	64.4	Low	54.5	Low	18 Å²	18	69.8 Å²	69.8	9%	0.094	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-45.1	-177.4	-170.5	67.3	0	0	0	112.4	R2087 L2088 L2091 T2253 F2256 K2257 L2336 M2337 P2338 D2339 R2343 Q2344 I2345	R2087-L2341 HydrophobicContact CB-CD2 3.57Å; R2087-L2341 VanDerWaalsContact CB-CD2 3.48Å; L2088-L2341 HydrophobicContact CD1-CD1 4.35Å; L2088-L2341 HydrophobicContact CD2-CB 4.44Å; L2088-L2341 HydrophobicContact CD2-CD2 3.21Å; L2088-L2341 HydrophobicContact CD2-CG 3.55Å; L2091-L2341 HydrophobicContact CD1-CD1 4.23Å; L2091-L2341 HydrophobicContact CD1-CD2 4.1Å; T2253-L2341 HydrophobicContact CG2-CD1 3.62Å; F2256-L2341 HydrophobicContact CD1-CD2 4.4Å; F2256-L2341 HydrophobicContact CE1-CD2 4.29Å; K2257-L2341 WeakPolarHBondContact CD-O 3.43Å; K2257-L2341 WeakPolarHBondContact CE-O 3.33Å; K2257-L2341 PolarHBondContact NZ-O 3.14Å; K2257-L2341 VanDerWaalsContact NZ-O 3.11Å; L2336-L2341 HydrophobicContact CD2-CD1 4.32Å; M2337-L2341 PolarHBondContact O-N 2.99Å; P2338-L2341 PolarHBondContact O-N 2.73Å; D2339-L2341 PolarHBondContact O-N 3.35Å; L2341-R2343 VanDerWaalsContact C-N 3.3Å; L2341-R2343 PolarHBondContact O-N 3.46Å; L2341-Q2344 PolarHBondContact O-N 3.08Å; L2341-I2345 HydrophobicContact CD2-CD1 4.41Å; L2341-I2345 HydrophobicContact CG-CD1 4.31Å; L2341-I2345 VanDerWaalsContact O-CB 3.26Å; L2341-I2345 WeakPolarHBondContact O-CB 3.33Å; L2341-I2345 WeakPolarHBondContact O-CD1 3.33Å; L2341-I2345 VanDerWaalsContact O-CG1 3.28Å; L2341-I2345 WeakPolarHBondContact O-CG1 3.36Å; L2341-I2345 PolarHBondContact O-N 3.22Å
2342	M	66.8	Low	56.2	Low	23 Å²	23	70.5 Å²	70.5	11%	0.113	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-16.7	178.6	-69.4	-64.1	-94.2	0	0	113.5	L2088 L2091 F2256 K2257 I2261 P2338 Q2340 I2345 S2346 R2430 L2433	L2088-M2342 HydrophobicContact CD1-SD 3.69Å; L2091-M2342 HydrophobicContact CD1-CE 4.26Å; F2256-M2342 HydrophobicContact CE1-CE 4.37Å; K2257-M2342 HydrophobicContact CD-CE 3.97Å; K2257-M2342 VanDerWaalsContact CE-SD 3.59Å; K2257-M2342 HydrophobicContact CG-CE 4.04Å; K2257-M2342 HydrophobicContact CG-SD 4.2Å; K2257-M2342 PolarHBondContact NZ-O 3.07Å; K2257-M2342 PolarHBondContact NZ-SD 3.21Å; I2261-M2342 HydrophobicContact CD1-CE 4.05Å; I2261-M2342 HydrophobicContact CG1-CE 3.94Å; P2338-M2342 PolarHBondContact O-N 3.43Å; Q2340-M2342 VanDerWaalsContact C-N 3.28Å; Q2340-M2342 PolarHBondContact O-N 3.07Å; Q2340-M2342 VanDerWaalsContact O-N 3.12Å; M2342-I2345 HydrophobicContact SD-CD1 4.31Å; M2342-S2346 PolarHBondContact O-OG 3.05Å; M2342-R2430 HydrophobicContact CE-CG 3.96Å; M2342-R2430 WeakPolarHBondContact O-CB 3.45Å; M2342-R2430 VanDerWaalsContact O-CD 3.22Å; M2342-R2430 WeakPolarHBondContact O-CD 3.34Å; M2342-R2430 WeakPolarHBondContact O-CG 3.37Å; M2342-L2433 HydrophobicContact CE-CB 4.05Å; M2342-L2433 HydrophobicContact CE-CD1 3.76Å; M2342-L2433 HydrophobicContact CE-CG 4.41Å; M2342-L2433 HydrophobicContact CG-CB 4Å
2343	R	65.5	Low	57.9	Low	74.6 Å²	74.6	71.8 Å²	71.8	28%	0.282	37%	0.37	S	S	.	.	S	Bend	trans	-79.9	-54.9	178.4	-95.5	-179	-131.5	-131.3	3.2	112.4	D2339 Q2340 L2341 I2345 S2346 T2347 R2410 H2411 D2434	D2339-R2343 WeakPolarHBondContact O-CB 3.27Å; D2339-R2343 WeakPolarHBondContact O-CD 3.14Å; D2339-R2343 WeakPolarHBondContact O-CG 3.49Å; D2339-R2343 PolarHBondContact O-N 3.24Å; D2339-R2343 IonicContact OD2-CZ 2.68Å; D2339-R2343 IonicContact OD2-NE 3.06Å; D2339-R2343 PolarHBondContact OD2-NE 2.67Å; D2339-R2343 IonicContact OD2-NH2 3.32Å; D2339-R2343 PolarHBondContact OD2-NH2 3.35Å; Q2340-R2343 HydrophobicContact CB-CB 4.32Å; Q2340-R2343 HydrophobicContact CB-CG 4.43Å; Q2340-R2343 CarbonylContact O-C 3.55Å; Q2340-R2343 WeakPolarHBondContact O-CB 3.3Å; Q2340-R2343 PolarHBondContact O-N 3.17Å; L2341-R2343 VanDerWaalsContact C-N 3.3Å; L2341-R2343 PolarHBondContact O-N 3.46Å; R2343-I2345 VanDerWaalsContact C-N 3.34Å; R2343-I2345 PolarHBondContact O-N 2.75Å; R2343-I2345 VanDerWaalsContact O-N 3.09Å; R2343-S2346 WeakPolarHBondContact O-CB 3.4Å; R2343-S2346 PolarHBondContact O-N 3.09Å; R2343-S2346 VanDerWaalsContact O-N 3.11Å; R2343-T2347 PolarHBondContact O-N 3.12Å; R2343-R2410 HydrophobicContact CB-CG 4.26Å; R2343-R2410 HydrophobicContact CG-CG 3.81Å; R2343-R2410 PolarHBondContact NH1-O 3.28Å; R2343-H2411 PolarHBondContact NH1-NE2 3.47Å; R2343-D2434 WeakPolarHBondContact CG-OD2 3.09Å; R2343-D2434 IonicContact CZ-OD1 3.41Å; R2343-D2434 IonicContact CZ-OD2 3.09Å; R2343-D2434 IonicContact NE-OD1 2.79Å; R2343-D2434 IonicContact NE-OD2 3.31Å; R2343-D2434 PolarHBondContact NE-OD2 2.88Å; R2343-D2434 IonicContact NH1-OD1 2.78Å; R2343-D2434 PolarHBondContact NH1-OD1 3.17Å; R2343-D2434 IonicContact NH1-OD2 3.25Å; R2343-D2434 PolarHBondContact NH1-OD2 3.42Å; R2343-D2434 IonicContact NH2-OD1 3.56Å; R2343-D2434 PolarHBondContact NH2-OD1 3.47Å; R2343-D2434 IonicContact NH2-OD2 3.1Å; R2343-D2434 PolarHBondContact NH2-OD2 3.1Å
2344	Q	57.9	Low	59.7	Low	55.2 Å²	55.2	77.2 Å²	77.2	26%	0.258	39%	0.392	S	S	.	.			trans	-75.6	83.6	177	-105.8	-118.6	-29.6	0	0	111.3	K2257 F2332 Q2340 L2341 S2346 T2347 S2348 R2410 R2418	K2257-Q2344 PolarHBondContact NZ-O 2.96Å; F2332-Q2344 VanDerWaalsContact CZ-OE1 3.31Å; Q2340-Q2344 HydrophobicContact CB-CG 4.21Å; Q2340-Q2344 WeakPolarHBondContact O-CA 3.35Å; Q2340-Q2344 WeakPolarHBondContact O-CB 3.33Å; Q2340-Q2344 VanDerWaalsContact O-CG 3.23Å; Q2340-Q2344 WeakPolarHBondContact O-CG 3.45Å; Q2340-Q2344 PolarHBondContact O-N 2.97Å; L2341-Q2344 PolarHBondContact O-N 3.08Å; Q2344-S2346 PolarHBondContact NE2-OG 2.83Å; Q2344-S2346 PolarHBondContact O-N 2.88Å; Q2344-T2347 WeakPolarHBondContact CA-OG1 3.41Å; Q2344-T2347 PolarHBondContact O-N 3.22Å; Q2344-T2347 PolarHBondContact O-OG1 3.39Å; Q2344-S2348 PolarHBondContact O-N 3.32Å; Q2344-S2348 VanDerWaalsContact O-N 3.16Å; Q2344-R2410 PolarHBondContact N-O 2.82Å; Q2344-R2418 VanDerWaalsContact CD-CZ 3.41Å
2345	I	55.1	Low	61.5	Low	33.2 Å²	33.2	75.1 Å²	75.1	17%	0.17	38%	0.38	C	S	.	.			trans	-87.9	-10.5	175.4	-62.5	164.6	0	0	0	109.7	L1872 L2088 L2250 E2254 F2332 L2336 L2341 M2342 R2343 T2347 S2348 R2410 E2412	L1872-I2345 HydrophobicContact CD2-CD1 3.7Å; L1872-I2345 HydrophobicContact CD2-CG1 4.18Å; L2088-I2345 HydrophobicContact CD1-CD1 3.66Å; L2088-I2345 HydrophobicContact CD2-CD1 4.36Å; L2250-I2345 HydrophobicContact CB-CG2 4.37Å; L2250-I2345 HydrophobicContact CD1-CB 4.08Å; L2250-I2345 HydrophobicContact CD1-CD1 4.4Å; L2250-I2345 HydrophobicContact CD1-CG1 3.56Å; L2250-I2345 HydrophobicContact CD1-CG2 3.37Å; L2250-I2345 WeakPolarHBondContact CD1-O 3.43Å; L2250-I2345 HydrophobicContact CG-CG2 4.3Å; E2254-I2345 WeakPolarHBondContact OE1-CG2 3.48Å; F2332-I2345 HydrophobicContact CE1-CD1 4.03Å; F2332-I2345 HydrophobicContact CE2-CB 4.33Å; F2332-I2345 HydrophobicContact CE2-CG2 3.59Å; F2332-I2345 HydrophobicContact CZ-CB 3.84Å; F2332-I2345 HydrophobicContact CZ-CD1 3.58Å; F2332-I2345 HydrophobicContact CZ-CG1 4.33Å; F2332-I2345 HydrophobicContact CZ-CG2 3.61Å; L2336-I2345 HydrophobicContact CD1-CD1 3.38Å; L2336-I2345 VanDerWaalsContact CD1-CD1 3.45Å; L2336-I2345 HydrophobicContact CD1-CG1 4.31Å; L2336-I2345 HydrophobicContact CD2-CD1 4.45Å; L2336-I2345 HydrophobicContact CG-CD1 3.72Å; L2341-I2345 HydrophobicContact CD2-CD1 4.41Å; L2341-I2345 HydrophobicContact CG-CD1 4.31Å; L2341-I2345 VanDerWaalsContact O-CB 3.26Å; L2341-I2345 WeakPolarHBondContact O-CB 3.33Å; L2341-I2345 WeakPolarHBondContact O-CD1 3.33Å; L2341-I2345 VanDerWaalsContact O-CG1 3.28Å; L2341-I2345 WeakPolarHBondContact O-CG1 3.36Å; L2341-I2345 PolarHBondContact O-N 3.22Å; M2342-I2345 HydrophobicContact SD-CD1 4.31Å; R2343-I2345 VanDerWaalsContact C-N 3.34Å; R2343-I2345 PolarHBondContact O-N 2.75Å; R2343-I2345 VanDerWaalsContact O-N 3.09Å; I2345-T2347 VanDerWaalsContact C-N 3.31Å; I2345-T2347 HydrophobicContact CG2-CG2 3.78Å; I2345-T2347 PolarHBondContact O-N 3.08Å; I2345-S2348 PolarHBondContact O-N 3.11Å; I2345-R2410 WeakPolarHBondContact CD1-O 3.33Å; I2345-E2412 WeakPolarHBondContact CD1-O 3.49Å
2346	S	47.7	Very low	63.2	Low	81.2 Å²	81.2	71.8 Å²	71.8	57%	0.568	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	3.5	-178.1	-60.2	0	0	0	0	113.7	E2254 K2257 M2342 R2343 Q2344 K2349	E2254-S2346 PolarHBondContact OE2-OG 2.98Å; K2257-S2346 PolarHBondContact NZ-OG 3.02Å; M2342-S2346 PolarHBondContact O-OG 3.05Å; R2343-S2346 WeakPolarHBondContact O-CB 3.4Å; R2343-S2346 PolarHBondContact O-N 3.09Å; R2343-S2346 VanDerWaalsContact O-N 3.11Å; Q2344-S2346 PolarHBondContact NE2-OG 2.83Å; Q2344-S2346 PolarHBondContact O-N 2.88Å; S2346-K2349 PolarHBondContact O-N 3.07Å
2347	T	47.5	Very low	64.9	Low	71.6 Å²	71.6	76.9 Å²	76.9	44%	0.439	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.7	4.6	-178.6	51.7	0	0	0	0	113.9	L2250 E2254 K2257 F2332 L2336 R2343 Q2344 I2345 K2349 R2350	L2250-T2347 HydrophobicContact CD1-CG2 3.63Å; E2254-T2347 VanDerWaalsContact OE1-CB 3.24Å; E2254-T2347 WeakPolarHBondContact OE1-CB 3.18Å; E2254-T2347 PolarHBondContact OE1-OG1 3.18Å; K2257-T2347 PolarHBondContact NZ-OG1 3.03Å; F2332-T2347 HydrophobicContact CD1-CG2 4.02Å; F2332-T2347 HydrophobicContact CD2-CG2 3.96Å; F2332-T2347 HydrophobicContact CE1-CG2 3.24Å; F2332-T2347 HydrophobicContact CE2-CG2 3.78Å; F2332-T2347 WeakPolarHBondContact CE2-OG1 3.39Å; F2332-T2347 HydrophobicContact CZ-CG2 3.97Å; L2336-T2347 HydrophobicContact CD1-CG2 4.29Å; R2343-T2347 PolarHBondContact O-N 3.12Å; Q2344-T2347 WeakPolarHBondContact CA-OG1 3.41Å; Q2344-T2347 PolarHBondContact O-N 3.22Å; Q2344-T2347 PolarHBondContact O-OG1 3.39Å; I2345-T2347 VanDerWaalsContact C-N 3.31Å; I2345-T2347 HydrophobicContact CG2-CG2 3.78Å; I2345-T2347 PolarHBondContact O-N 3.08Å; T2347-K2349 PolarHBondContact O-N 3.07Å; T2347-R2350 PolarHBondContact O-N 3.31Å
2348	S	45.6	Very low	66.6	Low	83 Å²	83	74.9 Å²	74.9	58%	0.58	38%	0.378	S	S	*	.	S	Bend	trans	-59.7	-15	177.4	-122.1	0	0	0	0	115.9	E2254 Q2344 I2345 R2350 I2351	E2254-S2348 PolarHBondContact OE2-OG 3.27Å; Q2344-S2348 PolarHBondContact O-N 3.32Å; Q2344-S2348 VanDerWaalsContact O-N 3.16Å; I2345-S2348 PolarHBondContact O-N 3.11Å; S2348-R2350 PolarHBondContact O-N 2.83Å; S2348-R2350 VanDerWaalsContact O-N 3.12Å; S2348-I2351 PolarHBondContact O-N 3.32Å
2349	K	54.3	Low	68.3	Low	150.8 Å²	150.8	73.6 Å²	73.6	66%	0.656	37%	0.369	S	S	*	.			trans	-96.3	81.7	174.6	-72.5	-177.2	178.7	175.5	0	111.7	L2250 M2328 N2329 S2346 T2347 I2351	L2250-K2349 HydrophobicContact CD2-CB 3.81Å; M2328-K2349 PolarHBondContact O-NZ 3.08Å; N2329-K2349 WeakPolarHBondContact OD1-CB 3.36Å; N2329-K2349 WeakPolarHBondContact OD1-CD 3.44Å; S2346-K2349 PolarHBondContact O-N 3.07Å; T2347-K2349 PolarHBondContact O-N 3.07Å; K2349-I2351 PolarHBondContact O-N 3.28Å; K2349-I2351 VanDerWaalsContact O-N 3.11Å
2350	R	63.7	Low	69.8	Low	186.8 Å²	186.8	72 Å²	72	71%	0.705	36%	0.36	S	S	*	.	P	Polyproline II helix	trans	-73.7	111.3	175.1	-75.7	-172	178.9	-168.3	1.3	110.8	L2250 M2328 N2329 T2347 S2348 A2352	L2250-R2350 HydrophobicContact CD2-CB 4.18Å; M2328-R2350 PolarHBondContact O-NH1 3.42Å; N2329-R2350 PolarHBondContact OD1-NH1 3.07Å; T2347-R2350 PolarHBondContact O-N 3.31Å; S2348-R2350 PolarHBondContact O-N 2.83Å; S2348-R2350 VanDerWaalsContact O-N 3.12Å; R2350-A2352 PolarHBondContact O-N 3.01Å
2351	I	73.9	Confident	71.2	Confident	22.8 Å²	22.8	70.9 Å²	70.9	12%	0.117	36%	0.363	C	S	.	.	P	Polyproline II helix	trans	-65.6	132.5	165.7	-61.1	165.6	0	0	0	107.3	L2250 E2251 E2254 S2348 K2349 D2353 Q2355 M2356 Y2359	L2250-I2351 HydrophobicContact CD1-CD1 4.36Å; L2250-I2351 HydrophobicContact CG-CD1 4.28Å; L2250-I2351 HydrophobicContact CG-CG1 4.43Å; E2251-I2351 HydrophobicContact CB-CD1 4.25Å; E2251-I2351 HydrophobicContact CG-CD1 3.71Å; E2251-I2351 HydrophobicContact CG-CG1 4.01Å; E2254-I2351 HydrophobicContact CB-CD1 4.02Å; E2254-I2351 HydrophobicContact CG-CD1 4.04Å; S2348-I2351 PolarHBondContact O-N 3.32Å; K2349-I2351 PolarHBondContact O-N 3.28Å; K2349-I2351 VanDerWaalsContact O-N 3.11Å; I2351-D2353 PolarHBondContact O-N 3.09Å; I2351-Q2355 HydrophobicContact CG2-CB 3.91Å; I2351-Q2355 HydrophobicContact CG2-CG 4.04Å; I2351-M2356 HydrophobicContact CB-CE 3.84Å; I2351-M2356 HydrophobicContact CB-CG 4.12Å; I2351-M2356 HydrophobicContact CB-SD 3.86Å; I2351-M2356 HydrophobicContact CD1-CE 3.48Å; I2351-M2356 HydrophobicContact CD1-SD 3.86Å; I2351-M2356 HydrophobicContact CG1-CE 4.22Å; I2351-M2356 HydrophobicContact CG1-SD 4.42Å; I2351-M2356 HydrophobicContact CG2-CE 3.84Å; I2351-M2356 HydrophobicContact CG2-CG 3.94Å; I2351-M2356 HydrophobicContact CG2-SD 3.78Å; I2351-Y2359 HydrophobicContact CD1-CE2 4.44Å; I2351-Y2359 HydrophobicContact CG2-CD2 4.47Å; I2351-Y2359 HydrophobicContact CG2-CE2 4.18Å
2352	A	81.2	Confident	72.3	Confident	65.8 Å²	65.8	71.5 Å²	71.5	54%	0.544	37%	0.366	S	S	.	.	P	Polyproline II helix	trans	-58.7	136.8	-175.8	0	0	0	0	0	111.3	R2350 K2354 Q2355 M2356	R2350-A2352 PolarHBondContact O-N 3.01Å; A2352-K2354 PolarHBondContact O-N 2.98Å; A2352-Q2355 HydrophobicContact CB-CB 4.41Å; A2352-Q2355 WeakPolarHBondContact O-CA 3.31Å; A2352-Q2355 WeakPolarHBondContact O-CB 3.36Å; A2352-Q2355 PolarHBondContact O-N 3.2Å; A2352-M2356 PolarHBondContact O-N 2.94Å
2353	D	79.8	Confident	73.4	Confident	118.8 Å²	118.8	70.4 Å²	70.4	64%	0.635	36%	0.361	S	S	*	.	H	α-helix	trans	-52.6	-33.6	-177.5	-65	-12.9	0	0	0	113.4	I2351 M2356 K2357	I2351-D2353 PolarHBondContact O-N 3.09Å; D2353-M2356 PolarHBondContact O-N 2.75Å; D2353-K2357 WeakPolarHBondContact O-CD 3.23Å; D2353-K2357 VanDerWaalsContact O-CG 3.29Å; D2353-K2357 WeakPolarHBondContact O-CG 3.33Å; D2353-K2357 PolarHBondContact O-N 3.29Å; D2353-K2357 VanDerWaalsContact O-N 3.12Å
2354	K	84.1	Confident	74.5	Confident	164.2 Å²	164.2	67.5 Å²	67.5	71%	0.714	35%	0.351	S	S	*	.	H	α-helix	trans	-64.8	-41.8	175	-173.8	-176.2	175.9	-170.2	0	111.6	A2352 K2357 I2358	A2352-K2354 PolarHBondContact O-N 2.98Å; K2354-K2357 PolarHBondContact O-N 2.97Å; K2354-I2358 HydrophobicContact CG-CD1 4.49Å; K2354-I2358 WeakPolarHBondContact O-CG1 3.38Å; K2354-I2358 PolarHBondContact O-N 2.91Å
2355	Q	85.3	Confident	76	Confident	29.6 Å²	29.6	67.3 Å²	67.3	14%	0.138	36%	0.36	C	S	.	.	H	α-helix	trans	-70.6	-41.1	178.7	-168.6	67	6	0	0	111.1	I2351 A2352 K2357 I2358 Y2359	I2351-Q2355 HydrophobicContact CG2-CB 3.91Å; I2351-Q2355 HydrophobicContact CG2-CG 4.04Å; A2352-Q2355 HydrophobicContact CB-CB 4.41Å; A2352-Q2355 WeakPolarHBondContact O-CA 3.31Å; A2352-Q2355 WeakPolarHBondContact O-CB 3.36Å; A2352-Q2355 PolarHBondContact O-N 3.2Å; Q2355-K2357 VanDerWaalsContact C-N 3.29Å; Q2355-K2357 PolarHBondContact O-N 3.1Å; Q2355-I2358 WeakPolarHBondContact O-CA 3.42Å; Q2355-I2358 WeakPolarHBondContact O-CB 3.35Å; Q2355-I2358 PolarHBondContact O-N 3.12Å; Q2355-Y2359 HydrophobicContact CG-CD1 4.49Å; Q2355-Y2359 HydrophobicContact CG-CD2 4.32Å; Q2355-Y2359 HydrophobicContact CG-CE1 4.19Å; Q2355-Y2359 HydrophobicContact CG-CE2 3.7Å; Q2355-Y2359 VanDerWaalsContact NE2-CZ 3.33Å; Q2355-Y2359 PolarHBondContact NE2-OH 3.23Å; Q2355-Y2359 VanDerWaalsContact NE2-OH 3.12Å; Q2355-Y2359 PolarHBondContact O-N 2.88Å
2356	M	84.8	Confident	77.6	Confident	42.4 Å²	42.4	66.1 Å²	66.1	21%	0.209	35%	0.354	C	S	.	.	H	α-helix	trans	-58.7	-40	173.8	-96	-45.7	165.3	0	0	112.6	E2254 L2258 I2351 A2352 D2353 I2358 Y2359 D2360	E2254-M2356 HydrophobicContact CB-CE 3.92Å; E2254-M2356 HydrophobicContact CB-SD 4.44Å; E2254-M2356 HydrophobicContact CG-CE 3.81Å; E2254-M2356 HydrophobicContact CG-SD 3.67Å; E2254-M2356 WeakPolarHBondContact OE2-CE 3.33Å; L2258-M2356 HydrophobicContact CD1-CE 3.88Å; L2258-M2356 HydrophobicContact CD1-CG 4.47Å; L2258-M2356 HydrophobicContact CD1-SD 3.85Å; L2258-M2356 HydrophobicContact CD2-CE 4.47Å; L2258-M2356 HydrophobicContact CG-CE 4.35Å; L2258-M2356 HydrophobicContact CG-SD 4.46Å; I2351-M2356 HydrophobicContact CB-CE 3.84Å; I2351-M2356 HydrophobicContact CB-CG 4.12Å; I2351-M2356 HydrophobicContact CB-SD 3.86Å; I2351-M2356 HydrophobicContact CD1-CE 3.48Å; I2351-M2356 HydrophobicContact CD1-SD 3.86Å; I2351-M2356 HydrophobicContact CG1-CE 4.22Å; I2351-M2356 HydrophobicContact CG1-SD 4.42Å; I2351-M2356 HydrophobicContact CG2-CE 3.84Å; I2351-M2356 HydrophobicContact CG2-CG 3.94Å; I2351-M2356 HydrophobicContact CG2-SD 3.78Å; A2352-M2356 PolarHBondContact O-N 2.94Å; D2353-M2356 PolarHBondContact O-N 2.75Å; M2356-I2358 VanDerWaalsContact C-N 3.29Å; M2356-I2358 PolarHBondContact O-N 3Å; M2356-Y2359 HydrophobicContact CE-CD2 4.05Å; M2356-Y2359 HydrophobicContact CE-CE2 4.13Å; M2356-Y2359 PolarHBondContact O-N 3.25Å; M2356-Y2359 HydrophobicContact SD-CD2 4.37Å; M2356-D2360 VanDerWaalsContact O-CB 3.24Å; M2356-D2360 WeakPolarHBondContact O-CB 3.4Å; M2356-D2360 PolarHBondContact O-N 3.01Å
2357	K	85.6	Confident	79.5	Confident	152.2 Å²	152.2	62.9 Å²	62.9	66%	0.662	33%	0.331	S	S	*	.	H	α-helix	trans	-64.2	-32.1	173.9	-72.8	171	-176.6	177.4	0	113.2	D2353 K2354 Q2355 A2361	D2353-K2357 WeakPolarHBondContact O-CD 3.23Å; D2353-K2357 VanDerWaalsContact O-CG 3.29Å; D2353-K2357 WeakPolarHBondContact O-CG 3.33Å; D2353-K2357 PolarHBondContact O-N 3.29Å; D2353-K2357 VanDerWaalsContact O-N 3.12Å; K2354-K2357 PolarHBondContact O-N 2.97Å; Q2355-K2357 VanDerWaalsContact C-N 3.29Å; Q2355-K2357 PolarHBondContact O-N 3.1Å; K2357-A2361 WeakPolarHBondContact O-CB 3.33Å; K2357-A2361 PolarHBondContact O-N 3.23Å; K2357-A2361 VanDerWaalsContact O-N 3.12Å
2358	I	86.8	Confident	81	Confident	45.4 Å²	45.4	62.3 Å²	62.3	23%	0.233	33%	0.333	C	S	.	.	H	α-helix	trans	-70.3	-48.9	175	-66.8	164.6	0	0	0	109.6	I2242 K2354 Q2355 M2356 D2360 A2361 L2362	I2242-I2358 HydrophobicContact CG2-CD1 3.98Å; I2242-I2358 HydrophobicContact CG2-CG2 4.22Å; K2354-I2358 HydrophobicContact CG-CD1 4.49Å; K2354-I2358 WeakPolarHBondContact O-CG1 3.38Å; K2354-I2358 PolarHBondContact O-N 2.91Å; Q2355-I2358 WeakPolarHBondContact O-CA 3.42Å; Q2355-I2358 WeakPolarHBondContact O-CB 3.35Å; Q2355-I2358 PolarHBondContact O-N 3.12Å; M2356-I2358 VanDerWaalsContact C-N 3.29Å; M2356-I2358 PolarHBondContact O-N 3Å; I2358-D2360 VanDerWaalsContact C-N 3.3Å; I2358-D2360 PolarHBondContact O-N 3.02Å; I2358-A2361 PolarHBondContact O-N 3.34Å; I2358-L2362 HydrophobicContact CG2-CD1 3.91Å; I2358-L2362 HydrophobicContact CG2-CG 4.35Å; I2358-L2362 WeakPolarHBondContact O-CB 3.46Å; I2358-L2362 VanDerWaalsContact O-CG 3.32Å; I2358-L2362 WeakPolarHBondContact O-CG 3.3Å; I2358-L2362 PolarHBondContact O-N 3.21Å
2359	Y	89.3	Confident	82.6	Confident	3.8 Å²	3.8	63.6 Å²	63.6	2%	0.015	33%	0.33	C	S	.	.	H	α-helix	trans	-58.3	-41	175.7	-67	-22.3	0	0	0	112.4	P2111 L2247 E2251 L2255 I2351 Q2355 M2356 L2362 A2363	P2111-Y2359 HydrophobicContact CB-CE1 4.46Å; P2111-Y2359 HydrophobicContact CG-CD1 4.48Å; P2111-Y2359 HydrophobicContact CG-CE1 4Å; L2247-Y2359 HydrophobicContact CD2-CE1 3.89Å; L2247-Y2359 HydrophobicContact CD2-CE2 4.33Å; L2247-Y2359 VanDerWaalsContact CD2-CZ 3.48Å; L2247-Y2359 VanDerWaalsContact CD2-OH 3.27Å; L2247-Y2359 WeakPolarHBondContact CD2-OH 3.35Å; E2251-Y2359 HydrophobicContact CB-CE2 4.2Å; E2251-Y2359 VanDerWaalsContact CD-OH 3.28Å; E2251-Y2359 HydrophobicContact CG-CE2 4.23Å; E2251-Y2359 PolarHBondContact OE1-OH 3.02Å; L2255-Y2359 HydrophobicContact CD1-CD1 4.33Å; L2255-Y2359 HydrophobicContact CD1-CG 4.16Å; I2351-Y2359 HydrophobicContact CD1-CE2 4.44Å; I2351-Y2359 HydrophobicContact CG2-CD2 4.47Å; I2351-Y2359 HydrophobicContact CG2-CE2 4.18Å; Q2355-Y2359 HydrophobicContact CG-CD1 4.49Å; Q2355-Y2359 HydrophobicContact CG-CD2 4.32Å; Q2355-Y2359 HydrophobicContact CG-CE1 4.19Å; Q2355-Y2359 HydrophobicContact CG-CE2 3.7Å; Q2355-Y2359 VanDerWaalsContact NE2-CZ 3.33Å; Q2355-Y2359 PolarHBondContact NE2-OH 3.23Å; Q2355-Y2359 VanDerWaalsContact NE2-OH 3.12Å; Q2355-Y2359 PolarHBondContact O-N 2.88Å; M2356-Y2359 HydrophobicContact CE-CD2 4.05Å; M2356-Y2359 HydrophobicContact CE-CE2 4.13Å; M2356-Y2359 PolarHBondContact O-N 3.25Å; M2356-Y2359 HydrophobicContact SD-CD2 4.37Å; Y2359-L2362 HydrophobicContact CD1-CD1 4.39Å; Y2359-L2362 PolarHBondContact O-N 3.06Å; Y2359-A2363 VanDerWaalsContact O-CB 3.26Å; Y2359-A2363 WeakPolarHBondContact O-CB 3.37Å; Y2359-A2363 PolarHBondContact O-N 3.23Å
2360	D	87.3	Confident	83.7	Confident	18 Å²	18	58.9 Å²	58.9	10%	0.096	31%	0.312	C	S	.	.	H	α-helix	trans	-65.5	-40.9	177.6	-170.7	34.7	0	0	0	112.4	L2258 R2262 M2356 I2358 T2364	L2258-D2360 HydrophobicContact CD1-CB 4.16Å; L2258-D2360 HydrophobicContact CD2-CB 4.29Å; R2262-D2360 VanDerWaalsContact CZ-CG 3.45Å; R2262-D2360 IonicContact CZ-OD1 3.39Å; R2262-D2360 VanDerWaalsContact CZ-OD1 3.24Å; R2262-D2360 IonicContact CZ-OD2 3.02Å; R2262-D2360 VanDerWaalsContact CZ-OD2 3.22Å; R2262-D2360 IonicContact NE-OD1 3.44Å; R2262-D2360 PolarHBondContact NE-OD1 3.04Å; R2262-D2360 IonicContact NE-OD2 3.47Å; R2262-D2360 IonicContact NH1-OD1 3.85Å; R2262-D2360 PolarHBondContact NH1-OD1 3.5Å; R2262-D2360 VanDerWaalsContact NH1-OD1 3.15Å; R2262-D2360 IonicContact NH1-OD2 2.88Å; R2262-D2360 PolarHBondContact NH1-OD2 3.08Å; R2262-D2360 VanDerWaalsContact NH2-CG 3.26Å; R2262-D2360 IonicContact NH2-OD1 3.34Å; R2262-D2360 PolarHBondContact NH2-OD1 3.24Å; R2262-D2360 IonicContact NH2-OD2 3.22Å; R2262-D2360 PolarHBondContact NH2-OD2 3.16Å; M2356-D2360 VanDerWaalsContact O-CB 3.24Å; M2356-D2360 WeakPolarHBondContact O-CB 3.4Å; M2356-D2360 PolarHBondContact O-N 3.01Å; I2358-D2360 VanDerWaalsContact C-N 3.3Å; I2358-D2360 PolarHBondContact O-N 3.02Å; D2360-T2364 VanDerWaalsContact O-CB 3.29Å; D2360-T2364 WeakPolarHBondContact O-CB 3.37Å; D2360-T2364 PolarHBondContact O-N 3.13Å; D2360-T2364 PolarHBondContact O-OG1 3.23Å
2361	A	88.2	Confident	84.3	Confident	49 Å²	49	52.1 Å²	52.1	41%	0.405	29%	0.292	S	S	.	.	H	α-helix	trans	-65.2	-43.7	174.5	0	0	0	0	0	112	K2357 I2358 T2364 A2365	K2357-A2361 WeakPolarHBondContact O-CB 3.33Å; K2357-A2361 PolarHBondContact O-N 3.23Å; K2357-A2361 VanDerWaalsContact O-N 3.12Å; I2358-A2361 PolarHBondContact O-N 3.34Å; A2361-T2364 PolarHBondContact O-N 3.19Å; A2361-A2365 VanDerWaalsContact O-CB 3.29Å; A2361-A2365 WeakPolarHBondContact O-CB 3.23Å; A2361-A2365 PolarHBondContact O-N 3.21Å
2362	L	89	Confident	84.3	Confident	29.2 Å²	29.2	51.3 Å²	51.3	15%	0.153	29%	0.289	C	S	.	.	H	α-helix	trans	-63.8	-48.2	177.1	-71	172.4	0	0	0	111.6	P2111 L2115 W2124 I2242 I2358 Y2359 T2364 A2365 S2366	P2111-L2362 HydrophobicContact CB-CD1 3.92Å; P2111-L2362 HydrophobicContact CG-CD1 4.41Å; L2115-L2362 HydrophobicContact CD1-CB 3.81Å; W2124-L2362 HydrophobicContact CZ2-CD2 3.99Å; I2242-L2362 HydrophobicContact CG2-CD1 4.46Å; I2358-L2362 HydrophobicContact CG2-CD1 3.91Å; I2358-L2362 HydrophobicContact CG2-CG 4.35Å; I2358-L2362 WeakPolarHBondContact O-CB 3.46Å; I2358-L2362 VanDerWaalsContact O-CG 3.32Å; I2358-L2362 WeakPolarHBondContact O-CG 3.3Å; I2358-L2362 PolarHBondContact O-N 3.21Å; Y2359-L2362 HydrophobicContact CD1-CD1 4.39Å; Y2359-L2362 PolarHBondContact O-N 3.06Å; L2362-T2364 VanDerWaalsContact C-N 3.31Å; L2362-T2364 PolarHBondContact O-N 3.06Å; L2362-A2365 PolarHBondContact O-N 3.27Å; L2362-A2365 VanDerWaalsContact O-N 3.11Å; L2362-S2366 WeakPolarHBondContact O-CB 3.15Å; L2362-S2366 PolarHBondContact O-N 2.95Å; L2362-S2366 PolarHBondContact O-OG 3.44Å
2363	A	89.7	Confident	84	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-59.4	-44.3	177	0	0	0	0	0	111.7	L2115 L2255 L2258 F2259 Y2359 A2365 S2366 I2367	L2115-A2363 HydrophobicContact CD2-CB 4.07Å; L2255-A2363 HydrophobicContact CD1-CB 4.36Å; L2258-A2363 HydrophobicContact CB-CB 4.14Å; F2259-A2363 HydrophobicContact CB-CB 4.18Å; Y2359-A2363 VanDerWaalsContact O-CB 3.26Å; Y2359-A2363 WeakPolarHBondContact O-CB 3.37Å; Y2359-A2363 PolarHBondContact O-N 3.23Å; A2363-A2365 VanDerWaalsContact C-N 3.31Å; A2363-A2365 PolarHBondContact O-N 3.16Å; A2363-S2366 PolarHBondContact O-N 2.99Å; A2363-S2366 PolarHBondContact O-OG 2.98Å; A2363-I2367 VanDerWaalsContact O-CD1 3.3Å; A2363-I2367 WeakPolarHBondContact O-CD1 3.3Å; A2363-I2367 WeakPolarHBondContact O-CG1 3.35Å
2364	T	88.7	Confident	83.5	Confident	13.6 Å²	13.6	47.5 Å²	47.5	8%	0.083	27%	0.269	C	S	.	.	H	α-helix	trans	-62.9	-42.1	176.7	-61.1	0	0	0	0	112.2	R2262 D2360 A2361 L2362 S2366 I2367 N2370 S2371 A2372 V2374	R2262-T2364 VanDerWaalsContact CD-OG1 3.29Å; R2262-T2364 WeakPolarHBondContact CD-OG1 3.23Å; R2262-T2364 WeakPolarHBondContact CG-OG1 3.41Å; R2262-T2364 PolarHBondContact NH1-OG1 3.44Å; D2360-T2364 VanDerWaalsContact O-CB 3.29Å; D2360-T2364 WeakPolarHBondContact O-CB 3.37Å; D2360-T2364 PolarHBondContact O-N 3.13Å; D2360-T2364 PolarHBondContact O-OG1 3.23Å; A2361-T2364 PolarHBondContact O-N 3.19Å; L2362-T2364 VanDerWaalsContact C-N 3.31Å; L2362-T2364 PolarHBondContact O-N 3.06Å; T2364-S2366 VanDerWaalsContact C-N 3.31Å; T2364-S2366 PolarHBondContact O-N 3.41Å; T2364-I2367 PolarHBondContact O-N 3.1Å; T2364-N2370 WeakPolarHBondContact CG2-ND2 3.4Å; T2364-S2371 PolarHBondContact O-OG 3.13Å; T2364-S2371 VanDerWaalsContact O-OG 3.06Å; T2364-A2372 VanDerWaalsContact CG2-O 3.24Å; T2364-A2372 WeakPolarHBondContact CG2-O 3.44Å; T2364-V2374 HydrophobicContact CG2-CG2 4.05Å; T2364-V2374 VanDerWaalsContact OG1-CG2 3.3Å; T2364-V2374 WeakPolarHBondContact OG1-CG2 3.27Å
2365	A	88.5	Confident	82.4	Confident	52.4 Å²	52.4	42.7 Å²	42.7	43%	0.433	25%	0.252	S	S	.	.	H	α-helix	trans	-71.6	-29.8	-179.1	0	0	0	0	0	112.8	F2123 A2361 L2362 A2363 I2367	F2123-A2365 HydrophobicContact CE2-CB 3.94Å; F2123-A2365 VanDerWaalsContact CE2-CB 3.42Å; F2123-A2365 WeakPolarHBondContact CE2-O 3.4Å; F2123-A2365 HydrophobicContact CZ-CB 3.87Å; F2123-A2365 WeakPolarHBondContact CZ-O 3.3Å; A2361-A2365 VanDerWaalsContact O-CB 3.29Å; A2361-A2365 WeakPolarHBondContact O-CB 3.23Å; A2361-A2365 PolarHBondContact O-N 3.21Å; L2362-A2365 PolarHBondContact O-N 3.27Å; L2362-A2365 VanDerWaalsContact O-N 3.11Å; A2363-A2365 VanDerWaalsContact C-N 3.31Å; A2363-A2365 PolarHBondContact O-N 3.16Å; A2365-I2367 VanDerWaalsContact C-N 3.26Å; A2365-I2367 PolarHBondContact O-N 3.19Å
2366	S	88.7	Confident	81.1	Confident	6.6 Å²	6.6	45.8 Å²	45.8	5%	0.046	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-11.1	179.9	29.1	0	0	0	0	114.4	L2115 G2120 R2121 F2259 L2362 A2363 T2364 A2368	L2115-S2366 WeakPolarHBondContact CD1-OG 3.45Å; G2120-S2366 WeakPolarHBondContact CA-O 3.37Å; R2121-S2366 PolarHBondContact N-O 3.07Å; F2259-S2366 WeakPolarHBondContact CD2-OG 3.21Å; F2259-S2366 VanDerWaalsContact CE2-OG 3.32Å; F2259-S2366 WeakPolarHBondContact CE2-OG 3.45Å; L2362-S2366 WeakPolarHBondContact O-CB 3.15Å; L2362-S2366 PolarHBondContact O-N 2.95Å; L2362-S2366 PolarHBondContact O-OG 3.44Å; A2363-S2366 PolarHBondContact O-N 2.99Å; A2363-S2366 PolarHBondContact O-OG 2.98Å; T2364-S2366 VanDerWaalsContact C-N 3.31Å; T2364-S2366 PolarHBondContact O-N 3.41Å; S2366-A2368 PolarHBondContact O-N 2.87Å
2367	I	87.5	Confident	79.8	Confident	15.4 Å²	15.4	46 Å²	46	8%	0.079	28%	0.279	C	S	.	.			trans	-96.5	111.7	-176.8	-61.9	160.8	0	0	0	110	F2259 R2262 M2263 A2363 T2364 A2365 Q2369 N2370	F2259-I2367 HydrophobicContact CD2-CD1 4.12Å; F2259-I2367 HydrophobicContact CD2-CG1 4Å; F2259-I2367 HydrophobicContact CE2-CD1 4.25Å; F2259-I2367 HydrophobicContact CE2-CG1 3.67Å; F2259-I2367 HydrophobicContact CZ-CG1 4.25Å; R2262-I2367 VanDerWaalsContact C-CD1 3.48Å; R2262-I2367 HydrophobicContact CB-CD1 3.56Å; R2262-I2367 VanDerWaalsContact CB-CD1 3.42Å; M2263-I2367 HydrophobicContact CB-CD1 4.15Å; M2263-I2367 HydrophobicContact CB-CG1 4.4Å; M2263-I2367 HydrophobicContact CB-CG2 4.42Å; M2263-I2367 HydrophobicContact CG-CD1 3.68Å; M2263-I2367 HydrophobicContact CG-CG1 4.01Å; A2363-I2367 VanDerWaalsContact O-CD1 3.3Å; A2363-I2367 WeakPolarHBondContact O-CD1 3.3Å; A2363-I2367 WeakPolarHBondContact O-CG1 3.35Å; T2364-I2367 PolarHBondContact O-N 3.1Å; A2365-I2367 VanDerWaalsContact C-N 3.26Å; A2365-I2367 PolarHBondContact O-N 3.19Å; I2367-Q2369 WeakPolarHBondContact CG2-O 3.37Å; I2367-Q2369 PolarHBondContact O-N 3Å; I2367-N2370 PolarHBondContact O-N 3.41Å
2368	A	79.7	Confident	79	Confident	58.2 Å²	58.2	45.8 Å²	45.8	48%	0.481	27%	0.274	S	S	.	.			trans	-67.4	-37.9	-171.4	0	0	0	0	0	115.3	R2121 S2366 N2370	R2121-A2368 HydrophobicContact CG-CB 4.47Å; R2121-A2368 VanDerWaalsContact NE-CB 3.35Å; R2121-A2368 VanDerWaalsContact NH2-CB 3.29Å; R2121-A2368 PolarHBondContact NH2-O 3.38Å; S2366-A2368 PolarHBondContact O-N 2.87Å; A2368-N2370 VanDerWaalsContact C-N 3.32Å; A2368-N2370 PolarHBondContact O-N 2.79Å
2369	Q	78.2	Confident	78.5	Confident	111.6 Å²	111.6	47.2 Å²	47.2	52%	0.521	29%	0.287	S	S	.	.	S	Bend	trans	-127.8	137	-180	-68.6	-176.1	-2.2	0	0	108	I2367 S2371 R2972 N2973 N2976	I2367-Q2369 WeakPolarHBondContact CG2-O 3.37Å; I2367-Q2369 PolarHBondContact O-N 3Å; Q2369-S2371 PolarHBondContact O-N 3.08Å; Q2369-S2371 PolarHBondContact O-OG 3.49Å; Q2369-R2972 PolarHBondContact NE2-O 3.25Å; Q2369-N2973 PolarHBondContact OE1-ND2 2.81Å; Q2369-N2976 PolarHBondContact O-ND2 3.23Å; Q2369-N2976 PolarHBondContact O-OD1 3.18Å
2370	N	77.1	Confident	78.3	Confident	51.2 Å²	51.2	49.7 Å²	49.7	27%	0.274	30%	0.3	S	S	.	.	S	Bend	trans	43.9	41.2	176.1	-70.4	-27.8	0	0	0	113.7	M2263 K2265 R2268 T2364 I2367 A2368 A2372 G2373 N2976 I2978	M2263-N2370 CarbonylContact C-O 3.59Å; M2263-N2370 VanDerWaalsContact O-O 3.08Å; K2265-N2370 HydrophobicContact CB-CB 4.26Å; K2265-N2370 WeakPolarHBondContact CB-O 3.43Å; K2265-N2370 HydrophobicContact CD-CB 4.3Å; K2265-N2370 VanDerWaalsContact CD-CG 3.42Å; K2265-N2370 WeakPolarHBondContact CD-ND2 3.49Å; K2265-N2370 WeakPolarHBondContact CD-OD1 3.39Å; K2265-N2370 PolarHBondContact N-O 3.14Å; K2265-N2370 PolarHBondContact NZ-OD1 2.86Å; R2268-N2370 PolarHBondContact NH1-O 3.11Å; T2364-N2370 WeakPolarHBondContact CG2-ND2 3.4Å; I2367-N2370 PolarHBondContact O-N 3.41Å; A2368-N2370 VanDerWaalsContact C-N 3.32Å; A2368-N2370 PolarHBondContact O-N 2.79Å; N2370-A2372 PolarHBondContact O-N 2.87Å; N2370-A2372 WeakPolarHBondContact OD1-CA 3.22Å; N2370-A2372 PolarHBondContact OD1-N 2.91Å; N2370-A2372 VanDerWaalsContact OD1-N 3.1Å; N2370-A2372 PolarHBondContact OD1-O 3.25Å; N2370-G2373 PolarHBondContact OD1-N 3.4Å; N2370-N2976 WeakPolarHBondContact CB-ND2 3.38Å; N2370-N2976 PolarHBondContact ND2-O 2.82Å; N2370-N2976 PolarHBondContact O-ND2 3.18Å; N2370-I2978 HydrophobicContact CB-CD1 3.86Å; N2370-I2978 HydrophobicContact CB-CG1 4.42Å
2371	S	76.3	Confident	78.5	Confident	43 Å²	43	52.9 Å²	52.9	30%	0.301	31%	0.311	S	S	.	.			trans	-64.3	115.3	167.5	-170.3	0	0	0	0	109.2	R2262 K2265 R2268 T2364 Q2369 G2373	R2262-S2371 CarbonylContact O-C 3.52Å; R2262-S2371 WeakPolarHBondContact O-CA 3.32Å; K2265-S2371 WeakPolarHBondContact CD-OG 3.45Å; K2265-S2371 WeakPolarHBondContact CG-OG 3.44Å; R2268-S2371 VanDerWaalsContact CD-O 3.27Å; R2268-S2371 WeakPolarHBondContact CD-O 3.46Å; R2268-S2371 PolarHBondContact NH1-O 3.01Å; T2364-S2371 PolarHBondContact O-OG 3.13Å; T2364-S2371 VanDerWaalsContact O-OG 3.06Å; Q2369-S2371 PolarHBondContact O-N 3.08Å; Q2369-S2371 PolarHBondContact O-OG 3.49Å; S2371-G2373 PolarHBondContact O-N 3.09Å; S2371-G2373 VanDerWaalsContact O-N 3.07Å; S2371-G2373 PolarHBondContact OG-N 3.34Å
2372	A	75.1	Confident	78.7	Confident	6.6 Å²	6.6	50.7 Å²	50.7	6%	0.055	29%	0.292	C	S	.	.			trans	-69.1	5.7	171.8	0	0	0	0	0	112.1	R2262 R2268 T2364 N2370 V2374 F2425	R2262-A2372 WeakPolarHBondContact O-CB 3.32Å; R2262-A2372 PolarHBondContact O-N 3.24Å; R2268-A2372 HydrophobicContact CB-CB 4.15Å; R2268-A2372 VanDerWaalsContact CD-O 3.25Å; R2268-A2372 WeakPolarHBondContact CD-O 3.49Å; R2268-A2372 HydrophobicContact CG-CB 4.38Å; R2268-A2372 VanDerWaalsContact CZ-O 3.3Å; R2268-A2372 PolarHBondContact NE-O 3.12Å; R2268-A2372 VanDerWaalsContact NH1-CA 3.31Å; R2268-A2372 VanDerWaalsContact NH1-CB 3.29Å; R2268-A2372 VanDerWaalsContact NH1-N 3.13Å; R2268-A2372 PolarHBondContact NH1-O 2.95Å; T2364-A2372 VanDerWaalsContact CG2-O 3.24Å; T2364-A2372 WeakPolarHBondContact CG2-O 3.44Å; N2370-A2372 PolarHBondContact O-N 2.87Å; N2370-A2372 WeakPolarHBondContact OD1-CA 3.22Å; N2370-A2372 PolarHBondContact OD1-N 2.91Å; N2370-A2372 VanDerWaalsContact OD1-N 3.1Å; N2370-A2372 PolarHBondContact OD1-O 3.25Å; A2372-V2374 PolarHBondContact O-N 3.2Å; A2372-F2425 HydrophobicContact CB-CE1 4.08Å; A2372-F2425 HydrophobicContact CB-CZ 3.95Å
2373	G	74.1	Confident	78.9	Confident	29.8 Å²	29.8	51.2 Å²	51.2	31%	0.307	30%	0.296	S	S	.	.			trans	36.7	153	179.9	0	0	0	0	0	112.2	R2262 R2268 N2370 S2371 D2375	R2262-G2373 WeakPolarHBondContact CD-O 3.22Å; R2262-G2373 PolarHBondContact NE-O 2.99Å; R2262-G2373 PolarHBondContact NH1-O 3.18Å; R2268-G2373 VanDerWaalsContact NH1-N 3.12Å; R2268-G2373 PolarHBondContact NH1-O 3.07Å; R2268-G2373 PolarHBondContact NH2-O 3.1Å; N2370-G2373 PolarHBondContact OD1-N 3.4Å; S2371-G2373 PolarHBondContact O-N 3.09Å; S2371-G2373 VanDerWaalsContact O-N 3.07Å; S2371-G2373 PolarHBondContact OG-N 3.34Å; G2373-D2375 PolarHBondContact O-N 3.23Å; G2373-D2375 VanDerWaalsContact O-N 3.12Å
2374	V	69.5	Low	79.1	Confident	74.4 Å²	74.4	51.9 Å²	51.9	45%	0.451	30%	0.302	S	S	.	.			trans	-63.5	109.4	178.2	-170.3	0	0	0	0	109.3	R2268 T2364 A2372 T2376	R2268-V2374 PolarHBondContact NH1-O 3.29Å; T2364-V2374 HydrophobicContact CG2-CG2 4.05Å; T2364-V2374 VanDerWaalsContact OG1-CG2 3.3Å; T2364-V2374 WeakPolarHBondContact OG1-CG2 3.27Å; A2372-V2374 PolarHBondContact O-N 3.2Å; V2374-T2376 HydrophobicContact CB-CG2 4.4Å; V2374-T2376 HydrophobicContact CG1-CG2 3.64Å; V2374-T2376 PolarHBondContact O-N 2.78Å
2375	D	62.1	Low	79.2	Confident	65.2 Å²	65.2	53.4 Å²	53.4	35%	0.349	32%	0.316	S	S	.	.			trans	-90.4	89.1	171.3	-143.3	-9.4	0	0	0	112.1	R2262 R2268 G2373 S2377	R2262-D2375 VanDerWaalsContact NH1-N 3.18Å; R2268-D2375 IonicContact CZ-OD1 2.67Å; R2268-D2375 IonicContact CZ-OD2 3.6Å; R2268-D2375 IonicContact NE-OD2 3.07Å; R2268-D2375 PolarHBondContact NE-OD2 2.98Å; R2268-D2375 IonicContact NH1-OD1 3.29Å; R2268-D2375 PolarHBondContact NH1-OD1 3.16Å; R2268-D2375 IonicContact NH1-OD2 3.77Å; R2268-D2375 PolarHBondContact NH1-OD2 2.81Å; R2268-D2375 PolarHBondContact NH2-O 2.75Å; R2268-D2375 IonicContact NH2-OD1 3.93Å; R2268-D2375 PolarHBondContact NH2-OD1 2.74Å; R2268-D2375 IonicContact NH2-OD2 2.69Å; R2268-D2375 PolarHBondContact NH2-OD2 3.16Å; G2373-D2375 PolarHBondContact O-N 3.23Å; G2373-D2375 VanDerWaalsContact O-N 3.12Å; D2375-S2377 VanDerWaalsContact C-N 3.31Å; D2375-S2377 PolarHBondContact O-N 2.99Å; D2375-S2377 WeakPolarHBondContact OD1-CA 3.27Å; D2375-S2377 VanDerWaalsContact OD1-CB 3.31Å; D2375-S2377 WeakPolarHBondContact OD1-CB 3.23Å; D2375-S2377 PolarHBondContact OD1-N 3.21Å; D2375-S2377 PolarHBondContact OD1-OG 3.03Å
2376	T	57.2	Low	79.5	Confident	93.2 Å²	93.2	51.1 Å²	51.1	57%	0.572	30%	0.297	S	S	*	.			trans	-88.8	4.5	165	50.7	0	0	0	0	112.3	V2374 R2378 S2379 M2380	V2374-T2376 HydrophobicContact CB-CG2 4.4Å; V2374-T2376 HydrophobicContact CG1-CG2 3.64Å; V2374-T2376 PolarHBondContact O-N 2.78Å; T2376-R2378 PolarHBondContact O-N 3.23Å; T2376-R2378 VanDerWaalsContact O-N 3.1Å; T2376-S2379 PolarHBondContact O-N 3.3Å; T2376-S2379 PolarHBondContact O-OG 3.03Å; T2376-M2380 HydrophobicContact CG2-CE 3.89Å; T2376-M2380 PolarHBondContact O-N 3.37Å
2377	S	58.3	Low	79.7	Confident	48.2 Å²	48.2	50.9 Å²	50.9	34%	0.337	30%	0.296	S	S	.	.			trans	-81.9	111.7	-173.5	65.5	0	0	0	0	110.8	D2375 S2379	D2375-S2377 VanDerWaalsContact C-N 3.31Å; D2375-S2377 PolarHBondContact O-N 2.99Å; D2375-S2377 WeakPolarHBondContact OD1-CA 3.27Å; D2375-S2377 VanDerWaalsContact OD1-CB 3.31Å; D2375-S2377 WeakPolarHBondContact OD1-CB 3.23Å; D2375-S2377 PolarHBondContact OD1-N 3.21Å; D2375-S2377 PolarHBondContact OD1-OG 3.03Å; S2377-S2379 VanDerWaalsContact CB-OG 3.28Å; S2377-S2379 WeakPolarHBondContact CB-OG 3.42Å; S2377-S2379 PolarHBondContact O-N 2.89Å; S2377-S2379 PolarHBondContact OG-OG 3.38Å
2378	R	67.8	Low	80	Confident	147.6 Å²	147.6	53.1 Å²	53.1	56%	0.557	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.2	22.5	169.8	-66.6	-179	171.4	170.1	-4.5	112.9	T2376 W2381 D2414 M2417	T2376-R2378 PolarHBondContact O-N 3.23Å; T2376-R2378 VanDerWaalsContact O-N 3.1Å; R2378-W2381 VanDerWaalsContact O-CE3 3.27Å; R2378-W2381 VanDerWaalsContact O-CZ3 3.24Å; R2378-W2381 WeakPolarHBondContact O-CZ3 3.33Å; R2378-D2414 IonicContact CZ-OD1 2.96Å; R2378-D2414 IonicContact CZ-OD2 3.23Å; R2378-D2414 VanDerWaalsContact CZ-OD2 3.3Å; R2378-D2414 IonicContact NE-OD1 3.72Å; R2378-D2414 IonicContact NE-OD2 3.27Å; R2378-D2414 PolarHBondContact NE-OD2 3.13Å; R2378-D2414 VanDerWaalsContact NH2-CG 3.26Å; R2378-D2414 IonicContact NH2-OD1 2.87Å; R2378-D2414 PolarHBondContact NH2-OD1 3.03Å; R2378-D2414 IonicContact NH2-OD2 3.45Å; R2378-D2414 PolarHBondContact NH2-OD2 2.96Å; R2378-M2417 HydrophobicContact CB-SD 4.37Å; R2378-M2417 HydrophobicContact CG-SD 4.32Å
2379	S	75.3	Confident	80.5	Confident	74.4 Å²	74.4	51.5 Å²	51.5	52%	0.52	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.4	-23.5	-172.5	66.1	0	0	0	0	113.7	T2376 S2377 W2381	T2376-S2379 PolarHBondContact O-N 3.3Å; T2376-S2379 PolarHBondContact O-OG 3.03Å; S2377-S2379 VanDerWaalsContact CB-OG 3.28Å; S2377-S2379 WeakPolarHBondContact CB-OG 3.42Å; S2377-S2379 PolarHBondContact O-N 2.89Å; S2377-S2379 PolarHBondContact OG-OG 3.38Å; S2379-W2381 VanDerWaalsContact C-CZ3 3.46Å; S2379-W2381 VanDerWaalsContact O-CZ3 3.3Å; S2379-W2381 WeakPolarHBondContact O-CZ3 3.27Å
2380	M	86.2	Confident	81.2	Confident	56 Å²	56	46.4 Å²	46.4	28%	0.276	27%	0.266	S	S	.	.			trans	-125.3	134.1	178.6	-65.3	-174.6	27.4	0	0	110.3	F2271 K2272 V2275 T2376	F2271-M2380 HydrophobicContact CD1-CE 4.44Å; F2271-M2380 HydrophobicContact CE1-CB 3.98Å; F2271-M2380 HydrophobicContact CE1-CE 4.38Å; F2271-M2380 HydrophobicContact CZ-CB 4.35Å; K2272-M2380 HydrophobicContact CB-CE 4.33Å; K2272-M2380 HydrophobicContact CG-CE 3.88Å; K2272-M2380 HydrophobicContact CG-SD 4.31Å; V2275-M2380 HydrophobicContact CB-CE 4.03Å; V2275-M2380 HydrophobicContact CG1-CB 4.46Å; V2275-M2380 HydrophobicContact CG1-CE 3.92Å; V2275-M2380 HydrophobicContact CG2-CE 4.29Å; T2376-M2380 HydrophobicContact CG2-CE 3.89Å; T2376-M2380 PolarHBondContact O-N 3.37Å
2381	W	91.1	Very high	82	Confident	85.8 Å²	85.8	44.4 Å²	44.4	33%	0.325	26%	0.255	S	S	.	.			trans	-157.1	157.7	-179	58.3	79	0	0	0	111.5	R2378 S2379 M2417 R2422 M2423	R2378-W2381 VanDerWaalsContact O-CE3 3.27Å; R2378-W2381 VanDerWaalsContact O-CZ3 3.24Å; R2378-W2381 WeakPolarHBondContact O-CZ3 3.33Å; S2379-W2381 VanDerWaalsContact C-CZ3 3.46Å; S2379-W2381 VanDerWaalsContact O-CZ3 3.3Å; S2379-W2381 WeakPolarHBondContact O-CZ3 3.27Å; W2381-M2417 HydrophobicContact CB-CE 3.48Å; W2381-M2417 VanDerWaalsContact CB-CE 3.41Å; W2381-M2417 HydrophobicContact CD2-CE 4.23Å; W2381-M2417 HydrophobicContact CE3-CE 4.15Å; W2381-M2417 HydrophobicContact CG-CE 3.98Å; W2381-R2422 HydrophobicContact CB-CB 4.11Å; W2381-R2422 HydrophobicContact CB-CG 4.43Å; W2381-R2422 HydrophobicContact CG-CB 4.21Å; W2381-R2422 HydrophobicContact CG-CG 4.15Å; W2381-M2423 CarbonylContact C-O 3.55Å; W2381-M2423 VanDerWaalsContact CA-O 3.24Å; W2381-M2423 WeakPolarHBondContact CA-O 3.3Å; W2381-M2423 WeakPolarHBondContact CB-O 3.36Å
2382	L	92.5	Very high	82.6	Confident	3.2 Å²	3.2	49.3 Å²	49.3	2%	0.017	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	140.2	166.8	-63.7	170.5	0	0	0	109.5	F2271 Q2274 V2275 A2386 V2387 R2422 M2423 F2428	F2271-L2382 HydrophobicContact CD2-CD1 3.84Å; F2271-L2382 HydrophobicContact CD2-CG 4.17Å; F2271-L2382 HydrophobicContact CE2-CD1 3.84Å; F2271-L2382 HydrophobicContact CE2-CG 3.74Å; F2271-L2382 HydrophobicContact CZ-CG 4.43Å; Q2274-L2382 HydrophobicContact CB-CD1 4.39Å; Q2274-L2382 HydrophobicContact CB-CD2 3.98Å; V2275-L2382 HydrophobicContact CB-CD2 4.48Å; V2275-L2382 HydrophobicContact CG2-CD2 3.66Å; V2275-L2382 HydrophobicContact CG2-CG 4.1Å; L2382-A2386 HydrophobicContact CB-CB 4.15Å; L2382-A2386 HydrophobicContact CD2-CB 3.93Å; L2382-V2387 HydrophobicContact CB-CG2 4.08Å; L2382-R2422 CarbonylContact O-C 3.36Å; L2382-R2422 WeakPolarHBondContact O-CA 3.42Å; L2382-M2423 HydrophobicContact CB-CB 4.4Å; L2382-M2423 PolarHBondContact N-O 3.16Å; L2382-M2423 PolarHBondContact O-N 3.13Å; L2382-F2428 HydrophobicContact CD1-CD2 3.76Å; L2382-F2428 HydrophobicContact CD1-CE2 4.09Å; L2382-F2428 HydrophobicContact CD1-CG 4.42Å
2383	T	93.2	Very high	83.2	Confident	37.8 Å²	37.8	52.4 Å²	52.4	23%	0.232	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	165.3	170.2	59.6	0	0	0	0	110.3	Y2278 A2385 A2386 V2387	Y2278-T2383 HydrophobicContact CE1-CG2 4.26Å; Y2278-T2383 PolarHBondContact OH-OG1 3.41Å; T2383-A2385 PolarHBondContact O-N 3.2Å; T2383-A2386 WeakPolarHBondContact O-CB 3.4Å; T2383-A2386 PolarHBondContact O-N 3.12Å; T2383-A2386 VanDerWaalsContact O-N 3.08Å; T2383-A2386 WeakPolarHBondContact OG1-CB 3.35Å; T2383-A2386 PolarHBondContact OG1-N 3.08Å; T2383-A2386 VanDerWaalsContact OG1-N 3.16Å; T2383-V2387 WeakPolarHBondContact O-CG2 3.4Å; T2383-V2387 PolarHBondContact O-N 3.22Å
2384	A	93.1	Very high	83.9	Confident	15.2 Å²	15.2	53.5 Å²	53.5	13%	0.126	28%	0.279	C	S	.	.	H	α-helix	trans	-54.1	-39.2	172.2	0	0	0	0	0	112.6	V2387 K2388 A2404 V2405 I2408	A2384-V2387 PolarHBondContact O-N 3.18Å; A2384-K2388 WeakPolarHBondContact O-CB 3.28Å; A2384-K2388 PolarHBondContact O-N 2.9Å; A2384-A2404 HydrophobicContact CB-CB 4.35Å; A2384-A2404 WeakPolarHBondContact O-CB 3.38Å; A2384-V2405 HydrophobicContact CB-CG2 3.89Å; A2384-I2408 HydrophobicContact CB-CD1 4Å
2385	A	92.7	Very high	84.8	Confident	45 Å²	45	51.8 Å²	51.8	37%	0.372	27%	0.266	S	S	.	.	H	α-helix	trans	-65	-39.5	175.1	0	0	0	0	0	112.7	Y2278 T2383 K2388 S2389	Y2278-A2385 HydrophobicContact CE2-CB 4.22Å; Y2278-A2385 WeakPolarHBondContact OH-CB 3.3Å; T2383-A2385 PolarHBondContact O-N 3.2Å; A2385-K2388 PolarHBondContact O-N 3.11Å; A2385-S2389 WeakPolarHBondContact O-CB 3.43Å; A2385-S2389 PolarHBondContact O-N 3.09Å
2386	A	93.1	Very high	85.9	Confident	4.8 Å²	4.8	54.2 Å²	54.2	4%	0.04	28%	0.276	C	S	.	.	H	α-helix	trans	-65.6	-41.5	174.6	0	0	0	0	0	111.9	Y2278 L2382 T2383 S2389 F2390	Y2278-A2386 HydrophobicContact CD1-CB 4.03Å; Y2278-A2386 HydrophobicContact CD2-CB 3.58Å; Y2278-A2386 VanDerWaalsContact CD2-CB 3.47Å; Y2278-A2386 HydrophobicContact CE1-CB 4.25Å; Y2278-A2386 HydrophobicContact CE2-CB 3.92Å; Y2278-A2386 HydrophobicContact CG-CB 3.64Å; L2382-A2386 HydrophobicContact CB-CB 4.15Å; L2382-A2386 HydrophobicContact CD2-CB 3.93Å; T2383-A2386 WeakPolarHBondContact O-CB 3.4Å; T2383-A2386 PolarHBondContact O-N 3.12Å; T2383-A2386 VanDerWaalsContact O-N 3.08Å; T2383-A2386 WeakPolarHBondContact OG1-CB 3.35Å; T2383-A2386 PolarHBondContact OG1-N 3.08Å; T2383-A2386 VanDerWaalsContact OG1-N 3.16Å; A2386-S2389 WeakPolarHBondContact O-CB 3.45Å; A2386-S2389 PolarHBondContact O-N 3.1Å; A2386-F2390 WeakPolarHBondContact O-CB 3.44Å; A2386-F2390 PolarHBondContact O-N 2.96Å
2387	V	93.3	Very high	87.3	Confident	3 Å²	3	53.7 Å²	53.7	2%	0.018	27%	0.268	C	S	.	.	H	α-helix	trans	-62.4	-45.7	174.8	173.7	0	0	0	0	110.9	L2382 T2383 A2384 S2389 F2390 M2391 L2407 I2408 M2423	L2382-V2387 HydrophobicContact CB-CG2 4.08Å; T2383-V2387 WeakPolarHBondContact O-CG2 3.4Å; T2383-V2387 PolarHBondContact O-N 3.22Å; A2384-V2387 PolarHBondContact O-N 3.18Å; V2387-S2389 VanDerWaalsContact C-N 3.32Å; V2387-S2389 PolarHBondContact O-N 2.96Å; V2387-F2390 WeakPolarHBondContact O-CB 3.43Å; V2387-F2390 PolarHBondContact O-N 3.03Å; V2387-F2390 VanDerWaalsContact O-N 3.11Å; V2387-M2391 VanDerWaalsContact O-CG 3.31Å; V2387-M2391 WeakPolarHBondContact O-CG 3.32Å; V2387-M2391 PolarHBondContact O-N 3.21Å; V2387-L2407 HydrophobicContact CG1-CD1 4.43Å; V2387-L2407 HydrophobicContact CG1-CD2 4.07Å; V2387-I2408 HydrophobicContact CG2-CD1 4.2Å; V2387-I2408 HydrophobicContact CG2-CG1 4.24Å; V2387-M2423 HydrophobicContact CG2-CB 4.46Å; V2387-M2423 HydrophobicContact CG2-CE 4.34Å; V2387-M2423 HydrophobicContact CG2-SD 4.1Å
2388	K	93.6	Very high	88.8	Confident	61.2 Å²	61.2	56.8 Å²	56.8	27%	0.266	29%	0.286	S	S	.	.	H	α-helix	trans	-58.9	-41.8	174.6	-179.7	176	176.2	-172.1	0	112.3	A2384 A2385 F2390 M2391 R2392 I2399 D2401 A2404	A2384-K2388 WeakPolarHBondContact O-CB 3.28Å; A2384-K2388 PolarHBondContact O-N 2.9Å; A2385-K2388 PolarHBondContact O-N 3.11Å; K2388-F2390 VanDerWaalsContact C-N 3.34Å; K2388-M2391 PolarHBondContact O-N 2.99Å; K2388-R2392 PolarHBondContact O-N 3.17Å; K2388-R2392 VanDerWaalsContact O-N 3.1Å; K2388-I2399 HydrophobicContact CB-CG1 4.4Å; K2388-I2399 VanDerWaalsContact CE-O 3.27Å; K2388-I2399 WeakPolarHBondContact CE-O 3.32Å; K2388-I2399 HydrophobicContact CG-CG1 4.2Å; K2388-D2401 WeakPolarHBondContact CD-OD1 3.25Å; K2388-D2401 WeakPolarHBondContact CE-OD1 3.39Å; K2388-D2401 IonicContact NZ-OD1 3.42Å; K2388-D2401 PolarHBondContact NZ-OD1 2.9Å; K2388-D2401 IonicContact NZ-OD2 3.39Å; K2388-D2401 PolarHBondContact NZ-OD2 3.41Å; K2388-A2404 HydrophobicContact CB-CB 4.1Å
2389	S	91.7	Very high	89.9	Confident	24.4 Å²	24.4	50.9 Å²	50.9	17%	0.171	27%	0.266	C	S	.	.	H	α-helix	trans	-64.3	-43.1	175.3	-168.2	0	0	0	0	111.8	A2385 A2386 V2387 M2391 R2392 I2393	A2385-S2389 WeakPolarHBondContact O-CB 3.43Å; A2385-S2389 PolarHBondContact O-N 3.09Å; A2386-S2389 WeakPolarHBondContact O-CB 3.45Å; A2386-S2389 PolarHBondContact O-N 3.1Å; V2387-S2389 VanDerWaalsContact C-N 3.32Å; V2387-S2389 PolarHBondContact O-N 2.96Å; S2389-M2391 PolarHBondContact O-N 3.12Å; S2389-R2392 PolarHBondContact O-N 3.06Å; S2389-I2393 WeakPolarHBondContact O-CB 3.28Å; S2389-I2393 VanDerWaalsContact O-CG1 3.28Å; S2389-I2393 WeakPolarHBondContact O-CG1 3.34Å; S2389-I2393 PolarHBondContact O-N 3.03Å; S2389-I2393 VanDerWaalsContact OG-CD1 3.32Å; S2389-I2393 WeakPolarHBondContact OG-CD1 3.3Å
2390	F	93.1	Very high	90.8	Very high	5.2 Å²	5.2	49.8 Å²	49.8	2%	0.023	26%	0.258	C	S	.	.	H	α-helix	trans	-58.9	-48.2	175.2	174.7	-94.6	0	0	0	111.8	L2270 Q2274 A2386 V2387 K2388 R2392 I2393 H2394 Q2395 F2428 F2431 L2432 Y3022	L2270-F2390 HydrophobicContact CD1-CE2 4.42Å; L2270-F2390 HydrophobicContact CD2-CE2 4.1Å; L2270-F2390 HydrophobicContact CD2-CZ 4.26Å; L2270-F2390 HydrophobicContact CG-CE2 4.34Å; Q2274-F2390 HydrophobicContact CG-CD2 3.74Å; Q2274-F2390 HydrophobicContact CG-CE2 4.16Å; Q2274-F2390 HydrophobicContact CG-CG 4.48Å; A2386-F2390 WeakPolarHBondContact O-CB 3.44Å; A2386-F2390 PolarHBondContact O-N 2.96Å; V2387-F2390 WeakPolarHBondContact O-CB 3.43Å; V2387-F2390 PolarHBondContact O-N 3.03Å; V2387-F2390 VanDerWaalsContact O-N 3.11Å; K2388-F2390 VanDerWaalsContact C-N 3.34Å; F2390-R2392 VanDerWaalsContact C-N 3.33Å; F2390-R2392 PolarHBondContact O-N 3.12Å; F2390-I2393 PolarHBondContact O-N 3.16Å; F2390-H2394 HydrophobicContact CD2-CB 4.04Å; F2390-H2394 AromaticContact CD2-CD2 3.64Å; F2390-H2394 AromaticContact CD2-CG 3.82Å; F2390-H2394 HydrophobicContact CE2-CB 3.83Å; F2390-H2394 AromaticContact CE2-CD2 3.83Å; F2390-H2394 AromaticContact CE2-CG 3.65Å; F2390-H2394 HydrophobicContact CG-CB 4.49Å; F2390-H2394 HydrophobicContact CZ-CB 4.18Å; F2390-H2394 WeakPolarHBondContact O-CA 3.35Å; F2390-H2394 WeakPolarHBondContact O-CB 3.39Å; F2390-H2394 PolarHBondContact O-N 3.05Å; F2390-Q2395 HydrophobicContact CD1-CG 4.24Å; F2390-Q2395 HydrophobicContact CE1-CG 4Å; F2390-Q2395 HydrophobicContact CZ-CG 4.49Å; F2390-Q2395 PolarHBondContact O-N 3.07Å; F2390-F2428 HydrophobicContact CD1-CE2 4.32Å; F2390-F2428 HydrophobicContact CD2-CE2 4.38Å; F2390-F2428 HydrophobicContact CD2-CZ 4.32Å; F2390-F2428 AromaticContact CE1-CE2 3.97Å; F2390-F2428 HydrophobicContact CE1-CE2 4.11Å; F2390-F2428 HydrophobicContact CE1-CZ 4.28Å; F2390-F2428 HydrophobicContact CE2-CE2 4.15Å; F2390-F2428 AromaticContact CE2-CZ 3.91Å; F2390-F2428 HydrophobicContact CE2-CZ 3.91Å; F2390-F2428 HydrophobicContact CG-CE2 4.33Å; F2390-F2428 AromaticContact CZ-CE2 3.96Å; F2390-F2428 HydrophobicContact CZ-CE2 4.02Å; F2390-F2428 AromaticContact CZ-CZ 3.85Å; F2390-F2428 HydrophobicContact CZ-CZ 3.89Å; F2390-F2431 HydrophobicContact CD1-CE1 4.36Å; F2390-F2431 AromaticContact CE1-CE1 3.94Å; F2390-F2431 HydrophobicContact CE1-CE1 4Å; F2390-L2432 HydrophobicContact CE1-CD2 4.13Å; F2390-L2432 HydrophobicContact CZ-CD1 4.48Å; F2390-L2432 HydrophobicContact CZ-CD2 4.18Å; F2390-Y3022 AromaticContact CE2-CD2 3.69Å; F2390-Y3022 HydrophobicContact CE2-CD2 3.69Å; F2390-Y3022 AromaticContact CE2-CE2 3.91Å; F2390-Y3022 HydrophobicContact CE2-CE2 3.91Å; F2390-Y3022 AromaticContact CZ-CD2 3.58Å; F2390-Y3022 HydrophobicContact CZ-CD2 3.58Å; F2390-Y3022 HydrophobicContact CZ-CE2 4.29Å; F2390-Y3022 HydrophobicContact CZ-CG 4.33Å
2391	M	92.7	Very high	91.2	Very high	7.6 Å²	7.6	51.4 Å²	51.4	4%	0.037	27%	0.268	C	S	.	.	I	π-helix	trans	-59.1	-46.1	178.6	-68.3	-60.6	-65.9	0	0	111.8	V2387 K2388 S2389 I2393 Q2395 M2396 E2397 I2399 L2407 F2431	V2387-M2391 VanDerWaalsContact O-CG 3.31Å; V2387-M2391 WeakPolarHBondContact O-CG 3.32Å; V2387-M2391 PolarHBondContact O-N 3.21Å; K2388-M2391 PolarHBondContact O-N 2.99Å; S2389-M2391 PolarHBondContact O-N 3.12Å; M2391-I2393 PolarHBondContact O-N 3.13Å; M2391-Q2395 HydrophobicContact CE-CB 4.13Å; M2391-Q2395 HydrophobicContact CE-CG 4.16Å; M2391-Q2395 CarbonylContact O-C 3.5Å; M2391-Q2395 WeakPolarHBondContact O-CA 3.37Å; M2391-Q2395 WeakPolarHBondContact O-CB 3.38Å; M2391-Q2395 PolarHBondContact O-N 3.02Å; M2391-Q2395 VanDerWaalsContact O-N 3.13Å; M2391-Q2395 HydrophobicContact SD-CB 4.22Å; M2391-Q2395 HydrophobicContact SD-CG 3.9Å; M2391-Q2395 PolarHBondContact SD-OE1 3.37Å; M2391-M2396 PolarHBondContact O-N 2.99Å; M2391-M2396 VanDerWaalsContact O-N 3.08Å; M2391-E2397 CarbonylContact C-O 3.52Å; M2391-E2397 VanDerWaalsContact C-O 3.26Å; M2391-E2397 WeakPolarHBondContact CB-O 3.39Å; M2391-E2397 HydrophobicContact CE-CB 4.12Å; M2391-E2397 VanDerWaalsContact CE-OE2 3.22Å; M2391-E2397 WeakPolarHBondContact CE-OE2 3.48Å; M2391-E2397 PolarHBondContact O-N 3.17Å; M2391-E2397 VanDerWaalsContact O-N 3.08Å; M2391-I2399 HydrophobicContact CB-CD1 4.09Å; M2391-I2399 HydrophobicContact CB-CG1 4Å; M2391-I2399 HydrophobicContact CB-CG2 4.43Å; M2391-I2399 HydrophobicContact CE-CG2 4.34Å; M2391-I2399 HydrophobicContact CG-CD1 3.68Å; M2391-I2399 HydrophobicContact CG-CG1 4.16Å; M2391-L2407 HydrophobicContact CG-CD1 4.47Å; M2391-L2407 HydrophobicContact SD-CD1 4.39Å; M2391-F2431 HydrophobicContact CE-CZ 4.22Å; M2391-F2431 HydrophobicContact SD-CE1 4.05Å; M2391-F2431 HydrophobicContact SD-CE2 4.31Å; M2391-F2431 HydrophobicContact SD-CZ 3.45Å; M2391-F2431 WeakPolarHBondContact SD-CZ 3.37Å
2392	R	90	Very high	91.3	Very high	146.6 Å²	146.6	50.9 Å²	50.9	55%	0.553	28%	0.282	S	S	*	.	I	π-helix	trans	-65.3	-42.8	178.6	-173.5	-172.5	51	94.7	-1.5	113.2	K2388 S2389 F2390 M2396 E2397	K2388-R2392 PolarHBondContact O-N 3.17Å; K2388-R2392 VanDerWaalsContact O-N 3.1Å; S2389-R2392 PolarHBondContact O-N 3.06Å; F2390-R2392 VanDerWaalsContact C-N 3.33Å; F2390-R2392 PolarHBondContact O-N 3.12Å; R2392-M2396 WeakPolarHBondContact O-CA 3.38Å; R2392-E2397 PolarHBondContact N-O 3.27Å
2393	I	87.5	Confident	91.4	Very high	72 Å²	72	55.7 Å²	55.7	37%	0.369	30%	0.304	S	S	.	.	I	π-helix	trans	-85.5	-43.3	-171.7	-64.8	171.7	0	0	0	111.9	S2389 F2390 M2391	S2389-I2393 WeakPolarHBondContact O-CB 3.28Å; S2389-I2393 VanDerWaalsContact O-CG1 3.28Å; S2389-I2393 WeakPolarHBondContact O-CG1 3.34Å; S2389-I2393 PolarHBondContact O-N 3.03Å; S2389-I2393 VanDerWaalsContact OG-CD1 3.32Å; S2389-I2393 WeakPolarHBondContact OG-CD1 3.3Å; F2390-I2393 PolarHBondContact O-N 3.16Å; M2391-I2393 PolarHBondContact O-N 3.13Å
2394	H	88	Confident	91.4	Very high	52.6 Å²	52.6	53.9 Å²	53.9	24%	0.244	29%	0.293	C	S	.	.	I	π-helix	trans	-100.2	-38.6	-171.7	-73.3	-75.6	0	0	0	113.3	Q2274 R2277 F2390 G3021 Y3022 Y3043	Q2274-H2394 PolarHBondContact NE2-CD2 3.22Å; Q2274-H2394 VanDerWaalsContact NE2-CD2 3.29Å; Q2274-H2394 PolarHBondContact NE2-CE1 2.94Å; Q2274-H2394 PolarHBondContact NE2-NE2 3.32Å; R2277-H2394 PolarHBondContact NH1-NE2 3.23Å; F2390-H2394 HydrophobicContact CD2-CB 4.04Å; F2390-H2394 AromaticContact CD2-CD2 3.64Å; F2390-H2394 AromaticContact CD2-CG 3.82Å; F2390-H2394 HydrophobicContact CE2-CB 3.83Å; F2390-H2394 AromaticContact CE2-CD2 3.83Å; F2390-H2394 AromaticContact CE2-CG 3.65Å; F2390-H2394 HydrophobicContact CG-CB 4.49Å; F2390-H2394 HydrophobicContact CZ-CB 4.18Å; F2390-H2394 WeakPolarHBondContact O-CA 3.35Å; F2390-H2394 WeakPolarHBondContact O-CB 3.39Å; F2390-H2394 PolarHBondContact O-N 3.05Å; H2394-G3021 WeakPolarHBondContact O-CA 3.24Å; H2394-Y3022 HydrophobicContact CB-CD2 3.84Å; H2394-Y3022 HydrophobicContact CB-CE2 3.74Å; H2394-Y3022 AromaticContact CG-CE2 3.64Å; H2394-Y3022 AromaticContact ND1-CE2 3.73Å; H2394-Y3043 HydrophobicContact CB-CE2 4.29Å; H2394-Y3043 AromaticContact ND1-CE2 3.88Å; H2394-Y3043 WeakPolarHBondContact O-CE2 3.34Å
2395	Q	87.8	Confident	91.5	Very high	38.4 Å²	38.4	55.2 Å²	55.2	18%	0.179	30%	0.3	C	S	.	.	I	π-helix	trans	-91.1	-8.6	177.4	-59	-80.7	10.6	0	0	112.9	F2390 M2391 E2397 N2437 G3021 Y3022 R3023	F2390-Q2395 HydrophobicContact CD1-CG 4.24Å; F2390-Q2395 HydrophobicContact CE1-CG 4Å; F2390-Q2395 HydrophobicContact CZ-CG 4.49Å; F2390-Q2395 PolarHBondContact O-N 3.07Å; M2391-Q2395 HydrophobicContact CE-CB 4.13Å; M2391-Q2395 HydrophobicContact CE-CG 4.16Å; M2391-Q2395 CarbonylContact O-C 3.5Å; M2391-Q2395 WeakPolarHBondContact O-CA 3.37Å; M2391-Q2395 WeakPolarHBondContact O-CB 3.38Å; M2391-Q2395 PolarHBondContact O-N 3.02Å; M2391-Q2395 VanDerWaalsContact O-N 3.13Å; M2391-Q2395 HydrophobicContact SD-CB 4.22Å; M2391-Q2395 HydrophobicContact SD-CG 3.9Å; M2391-Q2395 PolarHBondContact SD-OE1 3.37Å; Q2395-E2397 HydrophobicContact CB-CB 4.32Å; Q2395-E2397 HydrophobicContact CB-CG 4.39Å; Q2395-E2397 PolarHBondContact O-N 3.09Å; Q2395-E2397 VanDerWaalsContact O-N 3.15Å; Q2395-N2437 PolarHBondContact NE2-ND2 3.24Å; Q2395-N2437 PolarHBondContact NE2-OD1 3.14Å; Q2395-N2437 VanDerWaalsContact NE2-OD1 3.09Å; Q2395-N2437 PolarHBondContact OE1-OD1 2.97Å; Q2395-G3021 VanDerWaalsContact OE1-CA 3.3Å; Q2395-Y3022 PolarHBondContact NE2-O 3.5Å; Q2395-R3023 PolarHBondContact O-NH2 3.46Å
2396	M	86.1	Confident	91.6	Very high	115.6 Å²	115.6	57.3 Å²	57.3	57%	0.569	30%	0.301	S	S	*	.			trans	55.6	24.8	-173.4	-58.2	-162.2	50.1	0	0	113.5	M2391 R2392 P2398 A3020 P3073 F3075	M2391-M2396 PolarHBondContact O-N 2.99Å; M2391-M2396 VanDerWaalsContact O-N 3.08Å; R2392-M2396 WeakPolarHBondContact O-CA 3.38Å; M2396-P2398 WeakPolarHBondContact O-CD 3.46Å; M2396-A3020 HydrophobicContact CB-CB 4.1Å; M2396-A3020 HydrophobicContact CG-CB 3.91Å; M2396-P3073 HydrophobicContact CB-CB 3.81Å; M2396-P3073 HydrophobicContact CB-CG 4.09Å; M2396-P3073 HydrophobicContact CE-CB 4.29Å; M2396-F3075 HydrophobicContact CE-CB 4.37Å
2397	E	87	Confident	91.6	Very high	83.8 Å²	83.8	57.9 Å²	57.9	39%	0.392	30%	0.304	S	S	.	.			trans	-112.1	105.5	-177.5	-91.4	177.8	173.5	0	0	109.7	M2391 R2392 Q2395 I2399 R3019 R3023	M2391-E2397 CarbonylContact C-O 3.52Å; M2391-E2397 VanDerWaalsContact C-O 3.26Å; M2391-E2397 WeakPolarHBondContact CB-O 3.39Å; M2391-E2397 HydrophobicContact CE-CB 4.12Å; M2391-E2397 VanDerWaalsContact CE-OE2 3.22Å; M2391-E2397 WeakPolarHBondContact CE-OE2 3.48Å; M2391-E2397 PolarHBondContact O-N 3.17Å; M2391-E2397 VanDerWaalsContact O-N 3.08Å; R2392-E2397 PolarHBondContact N-O 3.27Å; Q2395-E2397 HydrophobicContact CB-CB 4.32Å; Q2395-E2397 HydrophobicContact CB-CG 4.39Å; Q2395-E2397 PolarHBondContact O-N 3.09Å; Q2395-E2397 VanDerWaalsContact O-N 3.15Å; E2397-I2399 HydrophobicContact CG-CG2 4.18Å; E2397-I2399 PolarHBondContact O-N 3.14Å; E2397-R3019 IonicContact OE1-CZ 3.93Å; E2397-R3019 IonicContact OE1-NE 3.55Å; E2397-R3019 PolarHBondContact OE1-NE 3.1Å; E2397-R3019 IonicContact OE1-NH2 2.75Å; E2397-R3019 PolarHBondContact OE1-NH2 3.1Å; E2397-R3019 IonicContact OE2-NH2 2.73Å; E2397-R3023 IonicContact OE1-CZ 3.01Å; E2397-R3023 IonicContact OE1-NH1 2.7Å; E2397-R3023 IonicContact OE1-NH2 3.94Å; E2397-R3023 PolarHBondContact OE1-NH2 3.49Å; E2397-R3023 IonicContact OE2-CZ 2.78Å; E2397-R3023 VanDerWaalsContact OE2-CZ 3.31Å; E2397-R3023 IonicContact OE2-NH1 3.27Å; E2397-R3023 PolarHBondContact OE2-NH1 3.2Å; E2397-R3023 IonicContact OE2-NH2 3.79Å; E2397-R3023 PolarHBondContact OE2-NH2 2.91Å
2398	P	88.3	Confident	91.6	Very high	111.8 Å²	111.8	57.8 Å²	57.8	73%	0.726	30%	0.304	S	S	*	.			trans	-73.6	117.2	176.9	29.2	-32.3	0	0	0	110.4	M2396	M2396-P2398 WeakPolarHBondContact O-CD 3.46Å
2399	I	92.2	Very high	91.6	Very high	23.6 Å²	23.6	56.7 Å²	56.7	12%	0.121	31%	0.305	C	S	.	.			trans	-113.2	153.7	176.7	65	164.5	0	0	0	112.3	K2388 M2391 E2397 Q2403 A2404 L2407	K2388-I2399 HydrophobicContact CB-CG1 4.4Å; K2388-I2399 VanDerWaalsContact CE-O 3.27Å; K2388-I2399 WeakPolarHBondContact CE-O 3.32Å; K2388-I2399 HydrophobicContact CG-CG1 4.2Å; M2391-I2399 HydrophobicContact CB-CD1 4.09Å; M2391-I2399 HydrophobicContact CB-CG1 4Å; M2391-I2399 HydrophobicContact CB-CG2 4.43Å; M2391-I2399 HydrophobicContact CE-CG2 4.34Å; M2391-I2399 HydrophobicContact CG-CD1 3.68Å; M2391-I2399 HydrophobicContact CG-CG1 4.16Å; E2397-I2399 HydrophobicContact CG-CG2 4.18Å; E2397-I2399 PolarHBondContact O-N 3.14Å; I2399-Q2403 HydrophobicContact CB-CB 4.06Å; I2399-Q2403 HydrophobicContact CD1-CB 4.46Å; I2399-A2404 HydrophobicContact CD1-CB 3.77Å; I2399-L2407 HydrophobicContact CD1-CD1 3.73Å
2400	S	94.1	Very high	91.5	Very high	53 Å²	53	59.9 Å²	59.9	37%	0.371	31%	0.314	S	S	.	.			trans	-73.8	161.8	171.4	68.7	0	0	0	0	112.1	A2402 Q2403 A2404	S2400-A2402 VanDerWaalsContact C-N 3.27Å; S2400-A2402 PolarHBondContact O-N 3.15Å; S2400-Q2403 PolarHBondContact O-N 3.28Å; S2400-Q2403 WeakPolarHBondContact OG-CB 3.42Å; S2400-Q2403 VanDerWaalsContact OG-CG 3.29Å; S2400-Q2403 WeakPolarHBondContact OG-CG 3.4Å; S2400-Q2403 PolarHBondContact OG-N 3.23Å; S2400-Q2403 VanDerWaalsContact OG-N 3.16Å; S2400-Q2403 PolarHBondContact OG-OE1 3.31Å; S2400-A2404 PolarHBondContact O-N 2.97Å
2401	D	93.4	Very high	91.4	Very high	89.75 Å²	89.75	59.8 Å²	59.8	48%	0.48	31%	0.314	S	S	.	.	H	α-helix	trans	-63.6	-34.8	176.7	-56.7	-74	0	0	0	111.8	K2388 A2404 V2405	K2388-D2401 WeakPolarHBondContact CD-OD1 3.25Å; K2388-D2401 WeakPolarHBondContact CE-OD1 3.39Å; K2388-D2401 IonicContact NZ-OD1 3.42Å; K2388-D2401 PolarHBondContact NZ-OD1 2.9Å; K2388-D2401 IonicContact NZ-OD2 3.39Å; K2388-D2401 PolarHBondContact NZ-OD2 3.41Å; D2401-A2404 PolarHBondContact O-N 3.2Å; D2401-V2405 WeakPolarHBondContact O-CG2 3.43Å; D2401-V2405 PolarHBondContact O-N 3.04Å
2402	A	94.8	Very high	91.4	Very high	74.5 Å²	74.5	59.5 Å²	59.5	62%	0.616	31%	0.312	S	S	*	.	H	α-helix	trans	-63.1	-44.1	173.8	0	0	0	0	0	111.9	S2400 A2404 V2405 E2406	S2400-A2402 VanDerWaalsContact C-N 3.27Å; S2400-A2402 PolarHBondContact O-N 3.15Å; A2402-A2404 VanDerWaalsContact C-N 3.31Å; A2402-A2404 PolarHBondContact O-N 2.94Å; A2402-V2405 PolarHBondContact O-N 3.07Å; A2402-E2406 VanDerWaalsContact O-CB 3.32Å; A2402-E2406 WeakPolarHBondContact O-CB 3.37Å; A2402-E2406 PolarHBondContact O-N 3.21Å
2403	Q	93.7	Very high	91.2	Very high	104.25 Å²	104.25	54.6 Å²	54.6	49%	0.487	30%	0.299	S	S	.	.	H	α-helix	trans	-63.5	-36.7	174.4	-76.2	166.3	-41.1	0	0	112	I2399 S2400 E2406 L2407	I2399-Q2403 HydrophobicContact CB-CB 4.06Å; I2399-Q2403 HydrophobicContact CD1-CB 4.46Å; S2400-Q2403 PolarHBondContact O-N 3.28Å; S2400-Q2403 WeakPolarHBondContact OG-CB 3.42Å; S2400-Q2403 VanDerWaalsContact OG-CG 3.29Å; S2400-Q2403 WeakPolarHBondContact OG-CG 3.4Å; S2400-Q2403 PolarHBondContact OG-N 3.23Å; S2400-Q2403 VanDerWaalsContact OG-N 3.16Å; S2400-Q2403 PolarHBondContact OG-OE1 3.31Å; Q2403-E2406 PolarHBondContact O-N 3.21Å; Q2403-L2407 VanDerWaalsContact O-CB 3.22Å; Q2403-L2407 WeakPolarHBondContact O-CB 3.43Å; Q2403-L2407 WeakPolarHBondContact O-CG 3.38Å; Q2403-L2407 PolarHBondContact O-N 3.31Å
2404	A	94.4	Very high	91.1	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-65.9	-42.8	176.3	0	0	0	0	0	111.9	A2384 K2388 I2399 S2400 D2401 A2402 E2406 L2407 I2408	A2384-A2404 HydrophobicContact CB-CB 4.35Å; A2384-A2404 WeakPolarHBondContact O-CB 3.38Å; K2388-A2404 HydrophobicContact CB-CB 4.1Å; I2399-A2404 HydrophobicContact CD1-CB 3.77Å; S2400-A2404 PolarHBondContact O-N 2.97Å; D2401-A2404 PolarHBondContact O-N 3.2Å; A2402-A2404 VanDerWaalsContact C-N 3.31Å; A2402-A2404 PolarHBondContact O-N 2.94Å; A2404-E2406 VanDerWaalsContact C-N 3.32Å; A2404-E2406 PolarHBondContact O-N 3.41Å; A2404-L2407 PolarHBondContact O-N 3.19Å; A2404-I2408 WeakPolarHBondContact O-CG1 3.32Å; A2404-I2408 PolarHBondContact O-N 3.13Å; A2404-I2408 VanDerWaalsContact O-N 3.14Å
2405	V	95.3	Very high	91	Very high	43 Å²	43	53.6 Å²	53.6	26%	0.261	31%	0.305	S	S	.	.	H	α-helix	trans	-62.9	-43.4	174.3	170.4	0	0	0	0	111.3	A2384 D2401 A2402 L2407 I2408 A2409 Q2421	A2384-V2405 HydrophobicContact CB-CG2 3.89Å; D2401-V2405 WeakPolarHBondContact O-CG2 3.43Å; D2401-V2405 PolarHBondContact O-N 3.04Å; A2402-V2405 PolarHBondContact O-N 3.07Å; V2405-L2407 VanDerWaalsContact C-N 3.35Å; V2405-L2407 PolarHBondContact O-N 3Å; V2405-I2408 WeakPolarHBondContact O-CB 3.29Å; V2405-I2408 PolarHBondContact O-N 3.19Å; V2405-A2409 WeakPolarHBondContact O-CB 3.35Å; V2405-A2409 PolarHBondContact O-N 3.28Å; V2405-Q2421 HydrophobicContact CG1-CG 4.13Å; V2405-Q2421 VanDerWaalsContact CG1-NE2 3.35Å; V2405-Q2421 HydrophobicContact CG2-CG 4.43Å
2406	E	94	Very high	91.1	Very high	87.25 Å²	87.25	54.7 Å²	54.7	41%	0.408	31%	0.314	S	S	.	.	H	α-helix	trans	-63.9	-39.9	177.3	170.3	55.1	-155.7	0	0	112.1	A2402 Q2403 A2404 I2408 A2409 R2410	A2402-E2406 VanDerWaalsContact O-CB 3.32Å; A2402-E2406 WeakPolarHBondContact O-CB 3.37Å; A2402-E2406 PolarHBondContact O-N 3.21Å; Q2403-E2406 PolarHBondContact O-N 3.21Å; A2404-E2406 VanDerWaalsContact C-N 3.32Å; A2404-E2406 PolarHBondContact O-N 3.41Å; E2406-I2408 VanDerWaalsContact C-N 3.3Å; E2406-I2408 PolarHBondContact O-N 2.95Å; E2406-A2409 PolarHBondContact O-N 2.87Å; E2406-A2409 VanDerWaalsContact O-N 3.16Å; E2406-R2410 VanDerWaalsContact O-CB 3.27Å; E2406-R2410 WeakPolarHBondContact O-CB 3.29Å; E2406-R2410 PolarHBondContact O-N 3.32Å; E2406-R2410 IonicContact OE1-CZ 3.39Å; E2406-R2410 VanDerWaalsContact OE1-CZ 3.3Å; E2406-R2410 IonicContact OE1-NE 3.35Å; E2406-R2410 PolarHBondContact OE1-NE 2.94Å; E2406-R2410 IonicContact OE1-NH2 3.47Å; E2406-R2410 PolarHBondContact OE1-NH2 3.17Å
2407	L	92.5	Very high	91.2	Very high	18.5 Å²	18.5	49.7 Å²	49.7	10%	0.097	29%	0.29	C	S	.	.	H	α-helix	trans	-60.5	-38.7	173.2	-96	168.5	0	0	0	111.9	V2387 M2391 I2399 Q2403 A2404 V2405 R2410 H2411 M2423 F2431	V2387-L2407 HydrophobicContact CG1-CD1 4.43Å; V2387-L2407 HydrophobicContact CG1-CD2 4.07Å; M2391-L2407 HydrophobicContact CG-CD1 4.47Å; M2391-L2407 HydrophobicContact SD-CD1 4.39Å; I2399-L2407 HydrophobicContact CD1-CD1 3.73Å; Q2403-L2407 VanDerWaalsContact O-CB 3.22Å; Q2403-L2407 WeakPolarHBondContact O-CB 3.43Å; Q2403-L2407 WeakPolarHBondContact O-CG 3.38Å; Q2403-L2407 PolarHBondContact O-N 3.31Å; A2404-L2407 PolarHBondContact O-N 3.19Å; V2405-L2407 VanDerWaalsContact C-N 3.35Å; V2405-L2407 PolarHBondContact O-N 3Å; L2407-R2410 PolarHBondContact O-N 3.44Å; L2407-H2411 PolarHBondContact O-CD2 2.97Å; L2407-H2411 PolarHBondContact O-N 3.11Å; L2407-H2411 VanDerWaalsContact O-N 3.14Å; L2407-H2411 PolarHBondContact O-ND1 2.94Å; L2407-M2423 HydrophobicContact CD2-CE 3.56Å; L2407-F2431 HydrophobicContact CD1-CD2 4.13Å; L2407-F2431 HydrophobicContact CD1-CE2 4.17Å; L2407-F2431 HydrophobicContact CD1-CZ 4.32Å; L2407-F2431 HydrophobicContact CD2-CB 4.18Å; L2407-F2431 HydrophobicContact CD2-CD1 4.17Å; L2407-F2431 HydrophobicContact CD2-CD2 4Å; L2407-F2431 HydrophobicContact CD2-CE2 4.04Å; L2407-F2431 HydrophobicContact CD2-CG 3.72Å; L2407-F2431 HydrophobicContact CG-CD2 4.13Å; L2407-F2431 HydrophobicContact CG-CE2 4.37Å
2408	I	93.8	Very high	91.4	Very high	1 Å²	1	49.7 Å²	49.7	1%	0.005	29%	0.286	C	S	.	.	H	α-helix	trans	-67.1	-47.8	173	-61.8	177.5	0	0	0	110.4	A2384 V2387 A2404 V2405 E2406 R2410 H2411 E2412 Q2421 M2423	A2384-I2408 HydrophobicContact CB-CD1 4Å; V2387-I2408 HydrophobicContact CG2-CD1 4.2Å; V2387-I2408 HydrophobicContact CG2-CG1 4.24Å; A2404-I2408 WeakPolarHBondContact O-CG1 3.32Å; A2404-I2408 PolarHBondContact O-N 3.13Å; A2404-I2408 VanDerWaalsContact O-N 3.14Å; V2405-I2408 WeakPolarHBondContact O-CB 3.29Å; V2405-I2408 PolarHBondContact O-N 3.19Å; E2406-I2408 VanDerWaalsContact C-N 3.3Å; E2406-I2408 PolarHBondContact O-N 2.95Å; I2408-R2410 VanDerWaalsContact C-N 3.25Å; I2408-R2410 PolarHBondContact O-N 3.21Å; I2408-R2410 VanDerWaalsContact O-N 3.16Å; I2408-H2411 PolarHBondContact O-N 2.94Å; I2408-E2412 HydrophobicContact CG2-CB 4.15Å; I2408-E2412 VanDerWaalsContact O-CB 3.26Å; I2408-E2412 WeakPolarHBondContact O-CB 3.39Å; I2408-E2412 PolarHBondContact O-N 2.93Å; I2408-Q2421 WeakPolarHBondContact CD1-O 3.38Å; I2408-M2423 HydrophobicContact CB-CE 4.43Å; I2408-M2423 HydrophobicContact CD1-CB 4.43Å; I2408-M2423 HydrophobicContact CG1-CB 4.14Å; I2408-M2423 HydrophobicContact CG1-CE 4.03Å; I2408-M2423 HydrophobicContact CG2-CB 4.41Å
2409	A	92.7	Very high	91.6	Very high	37 Å²	37	48.9 Å²	48.9	31%	0.306	28%	0.283	S	S	.	.	H	α-helix	trans	-56.5	-38	-179.3	0	0	0	0	0	112.4	V2405 E2406 R2418	V2405-A2409 WeakPolarHBondContact O-CB 3.35Å; V2405-A2409 PolarHBondContact O-N 3.28Å; E2406-A2409 PolarHBondContact O-N 2.87Å; E2406-A2409 VanDerWaalsContact O-N 3.16Å; A2409-R2418 VanDerWaalsContact O-CD 3.27Å; A2409-R2418 WeakPolarHBondContact O-CD 3.29Å; A2409-R2418 PolarHBondContact O-NE 3.04Å
2410	R	90.1	Very high	91.6	Very high	92.75 Å²	92.75	53.6 Å²	53.6	35%	0.35	30%	0.302	S	S	.	.	H	α-helix	trans	-74.6	-36.8	-177.8	-170.7	179.9	-54.6	147.7	-0	114.7	R2343 Q2344 I2345 E2406 L2407 I2408	R2343-R2410 HydrophobicContact CB-CG 4.26Å; R2343-R2410 HydrophobicContact CG-CG 3.81Å; R2343-R2410 PolarHBondContact NH1-O 3.28Å; Q2344-R2410 PolarHBondContact N-O 2.82Å; I2345-R2410 WeakPolarHBondContact CD1-O 3.33Å; E2406-R2410 VanDerWaalsContact O-CB 3.27Å; E2406-R2410 WeakPolarHBondContact O-CB 3.29Å; E2406-R2410 PolarHBondContact O-N 3.32Å; E2406-R2410 IonicContact OE1-CZ 3.39Å; E2406-R2410 VanDerWaalsContact OE1-CZ 3.3Å; E2406-R2410 IonicContact OE1-NE 3.35Å; E2406-R2410 PolarHBondContact OE1-NE 2.94Å; E2406-R2410 IonicContact OE1-NH2 3.47Å; E2406-R2410 PolarHBondContact OE1-NH2 3.17Å; L2407-R2410 PolarHBondContact O-N 3.44Å; I2408-R2410 VanDerWaalsContact C-N 3.25Å; I2408-R2410 PolarHBondContact O-N 3.21Å; I2408-R2410 VanDerWaalsContact O-N 3.16Å
2411	H	91.3	Very high	91.6	Very high	3.75 Å²	3.75	55.9 Å²	55.9	2%	0.017	31%	0.307	C	S	.	.	H	α-helix	trans	-109.9	-21.3	-170.1	-55.9	94	0	0	0	114.6	R2343 L2407 I2408 P2413 G2427 R2430 F2431 D2434	R2343-H2411 PolarHBondContact NH1-NE2 3.47Å; L2407-H2411 PolarHBondContact O-CD2 2.97Å; L2407-H2411 PolarHBondContact O-N 3.11Å; L2407-H2411 VanDerWaalsContact O-N 3.14Å; L2407-H2411 PolarHBondContact O-ND1 2.94Å; I2408-H2411 PolarHBondContact O-N 2.94Å; H2411-P2413 VanDerWaalsContact O-CD 3.29Å; H2411-P2413 WeakPolarHBondContact O-CD 3.39Å; H2411-G2427 WeakPolarHBondContact CB-O 3.33Å; H2411-G2427 WeakPolarHBondContact O-CA 3.39Å; H2411-R2430 HydrophobicContact CB-CB 4.2Å; H2411-R2430 WeakPolarHBondContact O-CD 3.24Å; H2411-F2431 HydrophobicContact CB-CB 4.16Å; H2411-F2431 AromaticContact CD2-CD2 3.87Å; H2411-F2431 AromaticContact CE1-CD2 3.84Å; H2411-F2431 AromaticContact NE2-CD2 3.84Å; H2411-D2434 IonicContact CE1-OD2 3.56Å; H2411-D2434 PolarHBondContact CE1-OD2 3.24Å; H2411-D2434 IonicContact ND1-OD2 2.77Å; H2411-D2434 PolarHBondContact ND1-OD2 3.02Å; H2411-D2434 IonicContact NE2-OD2 2.78Å
2412	E	92.3	Very high	91.7	Very high	1.25 Å²	1.25	55.5 Å²	55.5	1%	0.006	30%	0.299	C	S	.	.			trans	-73.6	116.9	-177	176.6	51	-134	0	0	111.9	I2345 I2408 D2414 M2417 R2418 S2424	I2345-E2412 WeakPolarHBondContact CD1-O 3.49Å; I2408-E2412 HydrophobicContact CG2-CB 4.15Å; I2408-E2412 VanDerWaalsContact O-CB 3.26Å; I2408-E2412 WeakPolarHBondContact O-CB 3.39Å; I2408-E2412 PolarHBondContact O-N 2.93Å; E2412-D2414 WeakPolarHBondContact OE1-CB 3.4Å; E2412-D2414 PolarHBondContact OE1-N 3.15Å; E2412-M2417 HydrophobicContact CG-CB 3.85Å; E2412-R2418 HydrophobicContact CB-CB 4.22Å; E2412-R2418 HydrophobicContact CB-CG 4.35Å; E2412-R2418 HydrophobicContact CG-CB 3.98Å; E2412-R2418 PolarHBondContact O-NE 3.02Å; E2412-R2418 PolarHBondContact O-NH2 3.3Å; E2412-S2424 VanDerWaalsContact CD-OG 3.3Å; E2412-S2424 PolarHBondContact OE1-OG 3.32Å; E2412-S2424 VanDerWaalsContact OE1-OG 3.1Å; E2412-S2424 VanDerWaalsContact OE2-CB 3.29Å; E2412-S2424 WeakPolarHBondContact OE2-CB 3.35Å; E2412-S2424 PolarHBondContact OE2-N 3.14Å; E2412-S2424 PolarHBondContact OE2-OG 3.11Å
2413	P	85.9	Confident	91.6	Very high	41.75 Å²	41.75	52 Å²	52	27%	0.271	27%	0.27	S	S	.	.			trans	-71.7	-38.4	-179.6	30.5	-39.5	0	0	0	114	H2411 A2415 R2418 E2426	H2411-P2413 VanDerWaalsContact O-CD 3.29Å; H2411-P2413 WeakPolarHBondContact O-CD 3.39Å; P2413-A2415 PolarHBondContact O-N 2.82Å; P2413-R2418 PolarHBondContact O-NH2 2.89Å; P2413-E2426 HydrophobicContact CG-CB 4.08Å; P2413-E2426 HydrophobicContact CG-CG 4.32Å
2414	D	86	Confident	91.6	Very high	42 Å²	42	47.7 Å²	47.7	23%	0.225	25%	0.251	C	S	.	.			trans	-78.4	115.3	-174	-176.1	-41.6	0	0	0	110	R2378 E2412 V2416 M2417 R2418	R2378-D2414 IonicContact CZ-OD1 2.96Å; R2378-D2414 IonicContact CZ-OD2 3.23Å; R2378-D2414 VanDerWaalsContact CZ-OD2 3.3Å; R2378-D2414 IonicContact NE-OD1 3.72Å; R2378-D2414 IonicContact NE-OD2 3.27Å; R2378-D2414 PolarHBondContact NE-OD2 3.13Å; R2378-D2414 VanDerWaalsContact NH2-CG 3.26Å; R2378-D2414 IonicContact NH2-OD1 2.87Å; R2378-D2414 PolarHBondContact NH2-OD1 3.03Å; R2378-D2414 IonicContact NH2-OD2 3.45Å; R2378-D2414 PolarHBondContact NH2-OD2 2.96Å; E2412-D2414 WeakPolarHBondContact OE1-CB 3.4Å; E2412-D2414 PolarHBondContact OE1-N 3.15Å; D2414-V2416 PolarHBondContact O-N 2.97Å; D2414-V2416 VanDerWaalsContact O-N 3.16Å; D2414-V2416 VanDerWaalsContact OD1-CA 3.29Å; D2414-V2416 WeakPolarHBondContact OD1-CA 3.32Å; D2414-V2416 VanDerWaalsContact OD1-CB 3.23Å; D2414-V2416 WeakPolarHBondContact OD1-CB 3.39Å; D2414-V2416 PolarHBondContact OD1-N 3.1Å; D2414-M2417 HydrophobicContact CB-CB 4.09Å; D2414-M2417 HydrophobicContact CB-CG 3.96Å; D2414-M2417 WeakPolarHBondContact O-CA 3.33Å; D2414-M2417 PolarHBondContact O-N 3.27Å; D2414-M2417 VanDerWaalsContact O-N 3.1Å; D2414-M2417 PolarHBondContact OD1-N 3.21Å; D2414-R2418 WeakPolarHBondContact O-CB 3.32Å; D2414-R2418 PolarHBondContact O-N 3.19Å
2415	A	86	Confident	91.5	Very high	63 Å²	63	47.9 Å²	47.9	52%	0.521	25%	0.252	S	S	.	.	H	α-helix	trans	-58.9	-29.1	-178.6	0	0	0	0	0	113.4	P2413 S2419	P2413-A2415 PolarHBondContact O-N 2.82Å; A2415-S2419 VanDerWaalsContact O-CB 3.3Å; A2415-S2419 WeakPolarHBondContact O-CB 3.41Å; A2415-S2419 PolarHBondContact O-N 3.18Å; A2415-S2419 VanDerWaalsContact O-N 3.09Å; A2415-S2419 PolarHBondContact O-OG 3.21Å
2416	V	89.2	Confident	91.2	Very high	61.25 Å²	61.25	47.5 Å²	47.5	37%	0.371	25%	0.248	S	C	.	.	H	α-helix	trans	-74.7	-35.5	177.2	-175.7	0	0	0	0	111	D2414 S2419 K2420	D2414-V2416 PolarHBondContact O-N 2.97Å; D2414-V2416 VanDerWaalsContact O-N 3.16Å; D2414-V2416 VanDerWaalsContact OD1-CA 3.29Å; D2414-V2416 WeakPolarHBondContact OD1-CA 3.32Å; D2414-V2416 VanDerWaalsContact OD1-CB 3.23Å; D2414-V2416 WeakPolarHBondContact OD1-CB 3.39Å; D2414-V2416 PolarHBondContact OD1-N 3.1Å; V2416-S2419 WeakPolarHBondContact CA-OG 3.21Å; V2416-S2419 PolarHBondContact O-N 3.03Å; V2416-S2419 PolarHBondContact O-OG 3.2Å; V2416-K2420 HydrophobicContact CG1-CD 4.43Å; V2416-K2420 VanDerWaalsContact O-CD 3.3Å; V2416-K2420 WeakPolarHBondContact O-CD 3.29Å; V2416-K2420 VanDerWaalsContact O-CG 3.29Å; V2416-K2420 WeakPolarHBondContact O-CG 3.31Å; V2416-K2420 PolarHBondContact O-N 3.4Å
2417	M	89.1	Confident	91.1	Very high	11.5 Å²	11.5	43.4 Å²	43.4	6%	0.057	23%	0.228	C	C	.	.	H	α-helix	trans	-73.9	-43.6	175.1	-65.2	-61	-75.6	0	0	111.1	R2378 W2381 E2412 D2414 S2419 K2420 Q2421 R2422	R2378-M2417 HydrophobicContact CB-SD 4.37Å; R2378-M2417 HydrophobicContact CG-SD 4.32Å; W2381-M2417 HydrophobicContact CB-CE 3.48Å; W2381-M2417 VanDerWaalsContact CB-CE 3.41Å; W2381-M2417 HydrophobicContact CD2-CE 4.23Å; W2381-M2417 HydrophobicContact CE3-CE 4.15Å; W2381-M2417 HydrophobicContact CG-CE 3.98Å; E2412-M2417 HydrophobicContact CG-CB 3.85Å; D2414-M2417 HydrophobicContact CB-CB 4.09Å; D2414-M2417 HydrophobicContact CB-CG 3.96Å; D2414-M2417 WeakPolarHBondContact O-CA 3.33Å; D2414-M2417 PolarHBondContact O-N 3.27Å; D2414-M2417 VanDerWaalsContact O-N 3.1Å; D2414-M2417 PolarHBondContact OD1-N 3.21Å; M2417-S2419 PolarHBondContact O-N 2.94Å; M2417-K2420 CarbonylContact O-C 3.5Å; M2417-K2420 WeakPolarHBondContact O-CA 3.34Å; M2417-K2420 PolarHBondContact O-N 3.11Å; M2417-K2420 VanDerWaalsContact O-N 3.09Å; M2417-Q2421 PolarHBondContact O-N 3.14Å; M2417-R2422 CarbonylContact C-O 3.51Å; M2417-R2422 HydrophobicContact CE-CB 3.66Å; M2417-R2422 HydrophobicContact CE-CG 4.47Å; M2417-R2422 PolarHBondContact O-N 2.98Å; M2417-R2422 HydrophobicContact SD-CB 4.37Å
2418	R	91.2	Very high	91.2	Very high	83.75 Å²	83.75	42.6 Å²	42.6	32%	0.316	22%	0.224	S	C	.	.	H	α-helix	trans	-58.5	-48.3	176.7	-162.7	-170.4	-56.4	151.4	12.7	112.4	Q2344 A2409 E2412 P2413 D2414 K2420 Q2421	Q2344-R2418 VanDerWaalsContact CD-CZ 3.41Å; A2409-R2418 VanDerWaalsContact O-CD 3.27Å; A2409-R2418 WeakPolarHBondContact O-CD 3.29Å; A2409-R2418 PolarHBondContact O-NE 3.04Å; E2412-R2418 HydrophobicContact CB-CB 4.22Å; E2412-R2418 HydrophobicContact CB-CG 4.35Å; E2412-R2418 HydrophobicContact CG-CB 3.98Å; E2412-R2418 PolarHBondContact O-NE 3.02Å; E2412-R2418 PolarHBondContact O-NH2 3.3Å; P2413-R2418 PolarHBondContact O-NH2 2.89Å; D2414-R2418 WeakPolarHBondContact O-CB 3.32Å; D2414-R2418 PolarHBondContact O-N 3.19Å; R2418-K2420 PolarHBondContact O-N 2.89Å; R2418-Q2421 PolarHBondContact O-N 3.02Å
2419	S	91.6	Very high	91.1	Very high	93.5 Å²	93.5	42.5 Å²	42.5	65%	0.654	22%	0.224	S	C	*	.	H	α-helix	trans	-63	-23.4	176.9	57.6	0	0	0	0	113.5	A2415 V2416 M2417 Q2421	A2415-S2419 VanDerWaalsContact O-CB 3.3Å; A2415-S2419 WeakPolarHBondContact O-CB 3.41Å; A2415-S2419 PolarHBondContact O-N 3.18Å; A2415-S2419 VanDerWaalsContact O-N 3.09Å; A2415-S2419 PolarHBondContact O-OG 3.21Å; V2416-S2419 WeakPolarHBondContact CA-OG 3.21Å; V2416-S2419 PolarHBondContact O-N 3.03Å; V2416-S2419 PolarHBondContact O-OG 3.2Å; M2417-S2419 PolarHBondContact O-N 2.94Å; S2419-Q2421 VanDerWaalsContact C-N 3.32Å
2420	K	93.3	Very high	91.1	Very high	122.5 Å²	122.5	42.4 Å²	42.4	53%	0.533	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.3	6.9	175	-67.7	178.4	-177.7	-178	0	113.5	V2416 M2417 R2418 R2422	V2416-K2420 HydrophobicContact CG1-CD 4.43Å; V2416-K2420 VanDerWaalsContact O-CD 3.3Å; V2416-K2420 WeakPolarHBondContact O-CD 3.29Å; V2416-K2420 VanDerWaalsContact O-CG 3.29Å; V2416-K2420 WeakPolarHBondContact O-CG 3.31Å; V2416-K2420 PolarHBondContact O-N 3.4Å; M2417-K2420 CarbonylContact O-C 3.5Å; M2417-K2420 WeakPolarHBondContact O-CA 3.34Å; M2417-K2420 PolarHBondContact O-N 3.11Å; M2417-K2420 VanDerWaalsContact O-N 3.09Å; R2418-K2420 PolarHBondContact O-N 2.89Å; K2420-R2422 VanDerWaalsContact C-N 3.26Å; K2420-R2422 HydrophobicContact CB-CG 4.27Å; K2420-R2422 WeakPolarHBondContact O-CG 3.46Å; K2420-R2422 PolarHBondContact O-N 3.22Å
2421	Q	94	Very high	91.2	Very high	100.75 Å²	100.75	38.3 Å²	38.3	47%	0.471	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.8	43.5	-175.4	-57.1	178.6	-14.6	0	0	112.5	V2405 I2408 M2417 R2418 S2419	V2405-Q2421 HydrophobicContact CG1-CG 4.13Å; V2405-Q2421 VanDerWaalsContact CG1-NE2 3.35Å; V2405-Q2421 HydrophobicContact CG2-CG 4.43Å; I2408-Q2421 WeakPolarHBondContact CD1-O 3.38Å; M2417-Q2421 PolarHBondContact O-N 3.14Å; R2418-Q2421 PolarHBondContact O-N 3.02Å; S2419-Q2421 VanDerWaalsContact C-N 3.32Å
2422	R	93.8	Very high	91.2	Very high	82.25 Å²	82.25	38.8 Å²	38.8	31%	0.31	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	134.1	178.9	-69.8	174.1	-173.8	-157.9	-2.1	110.4	W2381 L2382 M2417 K2420	W2381-R2422 HydrophobicContact CB-CB 4.11Å; W2381-R2422 HydrophobicContact CB-CG 4.43Å; W2381-R2422 HydrophobicContact CG-CB 4.21Å; W2381-R2422 HydrophobicContact CG-CG 4.15Å; L2382-R2422 CarbonylContact O-C 3.36Å; L2382-R2422 WeakPolarHBondContact O-CA 3.42Å; M2417-R2422 CarbonylContact C-O 3.51Å; M2417-R2422 HydrophobicContact CE-CB 3.66Å; M2417-R2422 HydrophobicContact CE-CG 4.47Å; M2417-R2422 PolarHBondContact O-N 2.98Å; M2417-R2422 HydrophobicContact SD-CB 4.37Å; K2420-R2422 VanDerWaalsContact C-N 3.26Å; K2420-R2422 HydrophobicContact CB-CG 4.27Å; K2420-R2422 WeakPolarHBondContact O-CG 3.46Å; K2420-R2422 PolarHBondContact O-N 3.22Å
2423	M	93.3	Very high	91.1	Very high	0.25 Å²	0.25	39.5 Å²	39.5	0%	0.001	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	122	176.3	-175.5	179.3	-82.2	0	0	110.1	W2381 L2382 V2387 L2407 I2408 F2428 F2431	W2381-M2423 CarbonylContact C-O 3.55Å; W2381-M2423 VanDerWaalsContact CA-O 3.24Å; W2381-M2423 WeakPolarHBondContact CA-O 3.3Å; W2381-M2423 WeakPolarHBondContact CB-O 3.36Å; L2382-M2423 HydrophobicContact CB-CB 4.4Å; L2382-M2423 PolarHBondContact N-O 3.16Å; L2382-M2423 PolarHBondContact O-N 3.13Å; V2387-M2423 HydrophobicContact CG2-CB 4.46Å; V2387-M2423 HydrophobicContact CG2-CE 4.34Å; V2387-M2423 HydrophobicContact CG2-SD 4.1Å; L2407-M2423 HydrophobicContact CD2-CE 3.56Å; I2408-M2423 HydrophobicContact CB-CE 4.43Å; I2408-M2423 HydrophobicContact CD1-CB 4.43Å; I2408-M2423 HydrophobicContact CG1-CB 4.14Å; I2408-M2423 HydrophobicContact CG1-CE 4.03Å; I2408-M2423 HydrophobicContact CG2-CB 4.41Å; M2423-F2428 HydrophobicContact CG-CB 4.14Å; M2423-F2428 VanDerWaalsContact SD-CA 3.55Å; M2423-F2428 WeakPolarHBondContact SD-CA 3.19Å; M2423-F2428 HydrophobicContact SD-CB 3.84Å; M2423-F2428 HydrophobicContact SD-CD2 4.06Å; M2423-F2428 HydrophobicContact SD-CG 4.44Å; M2423-F2431 HydrophobicContact CE-CB 4.24Å
2424	S	93.1	Very high	91.2	Very high	14.25 Å²	14.25	38 Å²	38	10%	0.1	20%	0.196	C	C	.	.			trans	-75.4	173.1	171.2	67.3	0	0	0	0	111.3	E2412 E2426 G2427 F2428	E2412-S2424 VanDerWaalsContact CD-OG 3.3Å; E2412-S2424 PolarHBondContact OE1-OG 3.32Å; E2412-S2424 VanDerWaalsContact OE1-OG 3.1Å; E2412-S2424 VanDerWaalsContact OE2-CB 3.29Å; E2412-S2424 WeakPolarHBondContact OE2-CB 3.35Å; E2412-S2424 PolarHBondContact OE2-N 3.14Å; E2412-S2424 PolarHBondContact OE2-OG 3.11Å; S2424-E2426 PolarHBondContact O-N 2.98Å; S2424-E2426 PolarHBondContact OG-N 2.99Å; S2424-G2427 PolarHBondContact O-N 3.11Å; S2424-G2427 PolarHBondContact OG-N 3.04Å; S2424-G2427 VanDerWaalsContact OG-N 3.12Å; S2424-F2428 WeakPolarHBondContact O-CB 3.32Å; S2424-F2428 PolarHBondContact O-N 2.97Å
2425	F	92.2	Very high	91.1	Very high	4.75 Å²	4.75	36.8 Å²	36.8	2%	0.021	19%	0.191	C	C	.	.	H	α-helix	trans	-55.4	-40.1	168.7	164.1	-113	0	0	0	111.6	I2261 L2267 R2268 F2271 A2372 G2427 F2428 A2429	I2261-F2425 HydrophobicContact CG2-CE1 3.85Å; I2261-F2425 HydrophobicContact CG2-CZ 4.15Å; L2267-F2425 HydrophobicContact CB-CE2 4.16Å; R2268-F2425 HydrophobicContact CB-CD2 4.13Å; R2268-F2425 HydrophobicContact CB-CE1 4.38Å; R2268-F2425 HydrophobicContact CB-CE2 3.62Å; R2268-F2425 HydrophobicContact CB-CZ 3.84Å; R2268-F2425 HydrophobicContact CG-CD2 4.32Å; R2268-F2425 HydrophobicContact CG-CE1 4.45Å; R2268-F2425 HydrophobicContact CG-CE2 4.28Å; R2268-F2425 HydrophobicContact CG-CG 4.4Å; R2268-F2425 HydrophobicContact CG-CZ 4.38Å; R2268-F2425 VanDerWaalsContact N-CE2 3.31Å; R2268-F2425 VanDerWaalsContact NH1-CD1 3.34Å; F2271-F2425 HydrophobicContact CB-CD2 4.05Å; F2271-F2425 HydrophobicContact CD1-CB 3.83Å; F2271-F2425 HydrophobicContact CD1-CD2 4.38Å; F2271-F2425 HydrophobicContact CD1-CG 4.46Å; F2271-F2425 HydrophobicContact CD2-CB 4.49Å; F2271-F2425 HydrophobicContact CE1-CB 3.85Å; F2271-F2425 HydrophobicContact CE2-CB 4.49Å; F2271-F2425 HydrophobicContact CG-CB 4.2Å; F2271-F2425 HydrophobicContact CG-CD2 4.21Å; F2271-F2425 HydrophobicContact CZ-CB 4.23Å; F2271-F2425 VanDerWaalsContact CZ-N 3.3Å; A2372-F2425 HydrophobicContact CB-CE1 4.08Å; A2372-F2425 HydrophobicContact CB-CZ 3.95Å; F2425-G2427 VanDerWaalsContact C-N 3.32Å; F2425-G2427 PolarHBondContact O-N 3.1Å; F2425-F2428 PolarHBondContact O-N 3.1Å; F2425-A2429 HydrophobicContact CE2-CB 4.11Å; F2425-A2429 HydrophobicContact CZ-CB 4.22Å; F2425-A2429 VanDerWaalsContact O-CB 3.25Å; F2425-A2429 WeakPolarHBondContact O-CB 3.34Å; F2425-A2429 PolarHBondContact O-N 3.11Å
2426	E	90.2	Very high	90.9	Very high	35 Å²	35	36.6 Å²	36.6	16%	0.164	19%	0.186	C	C	.	.	H	α-helix	trans	-69.4	-37.2	-177.2	-147.2	-173.6	115.4	0	0	111.8	I2261 R2262 P2413 S2424 R2430	I2261-E2426 HydrophobicContact CD1-CG 3.89Å; I2261-E2426 HydrophobicContact CG2-CG 4.11Å; R2262-E2426 IonicContact CZ-OE2 2.97Å; R2262-E2426 IonicContact NH1-OE2 2.77Å; R2262-E2426 IonicContact NH2-OE2 3.33Å; R2262-E2426 PolarHBondContact NH2-OE2 2.92Å; R2262-E2426 VanDerWaalsContact NH2-OE2 3.11Å; P2413-E2426 HydrophobicContact CG-CB 4.08Å; P2413-E2426 HydrophobicContact CG-CG 4.32Å; S2424-E2426 PolarHBondContact O-N 2.98Å; S2424-E2426 PolarHBondContact OG-N 2.99Å; E2426-R2430 VanDerWaalsContact CD-NH1 3.28Å; E2426-R2430 VanDerWaalsContact CG-NH1 3.3Å; E2426-R2430 WeakPolarHBondContact O-CB 3.31Å; E2426-R2430 WeakPolarHBondContact O-CG 3.44Å; E2426-R2430 PolarHBondContact O-N 3.09Å; E2426-R2430 VanDerWaalsContact O-N 3.16Å; E2426-R2430 PolarHBondContact O-NH1 3.21Å; E2426-R2430 VanDerWaalsContact O-NH1 3.13Å; E2426-R2430 IonicContact OE1-CZ 3.42Å; E2426-R2430 VanDerWaalsContact OE1-CZ 3.27Å; E2426-R2430 IonicContact OE1-NH1 3.29Å; E2426-R2430 PolarHBondContact OE1-NH1 3.1Å; E2426-R2430 IonicContact OE1-NH2 3.18Å; E2426-R2430 PolarHBondContact OE1-NH2 3.04Å
2427	G	91.8	Very high	90.9	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-66.4	-40.9	171	0	0	0	0	0	112.8	H2411 S2424 F2425 R2430 F2431	H2411-G2427 WeakPolarHBondContact CB-O 3.33Å; H2411-G2427 WeakPolarHBondContact O-CA 3.39Å; S2424-G2427 PolarHBondContact O-N 3.11Å; S2424-G2427 PolarHBondContact OG-N 3.04Å; S2424-G2427 VanDerWaalsContact OG-N 3.12Å; F2425-G2427 VanDerWaalsContact C-N 3.32Å; F2425-G2427 PolarHBondContact O-N 3.1Å; G2427-R2430 PolarHBondContact O-N 3.13Å; G2427-F2431 WeakPolarHBondContact O-CB 3.28Å; G2427-F2431 PolarHBondContact O-N 3.17Å
2428	F	93.8	Very high	90.8	Very high	2 Å²	2	36.1 Å²	36.1	1%	0.009	18%	0.18	C	C	.	.	H	α-helix	trans	-66.4	-42.2	177	-178.2	-102.9	0	0	0	112.5	L2270 F2271 Q2274 L2382 F2390 M2423 S2424 F2425 F2431 L2432	L2270-F2428 HydrophobicContact CD2-CE1 4.17Å; L2270-F2428 HydrophobicContact CD2-CZ 4.1Å; L2270-F2428 HydrophobicContact CG-CE1 4.19Å; L2270-F2428 HydrophobicContact CG-CZ 4.17Å; F2271-F2428 HydrophobicContact CB-CD1 3.76Å; F2271-F2428 HydrophobicContact CB-CE1 3.99Å; F2271-F2428 HydrophobicContact CB-CG 4.47Å; F2271-F2428 HydrophobicContact CD2-CB 3.69Å; F2271-F2428 AromaticContact CD2-CD1 3.87Å; F2271-F2428 HydrophobicContact CD2-CD1 3.87Å; F2271-F2428 HydrophobicContact CD2-CD2 4.41Å; F2271-F2428 AromaticContact CD2-CG 3.75Å; F2271-F2428 HydrophobicContact CD2-CG 3.75Å; F2271-F2428 HydrophobicContact CE2-CB 4.12Å; F2271-F2428 HydrophobicContact CE2-CG 4.46Å; F2271-F2428 HydrophobicContact CG-CD1 4.28Å; Q2274-F2428 HydrophobicContact CG-CZ 4.46Å; L2382-F2428 HydrophobicContact CD1-CD2 3.76Å; L2382-F2428 HydrophobicContact CD1-CE2 4.09Å; L2382-F2428 HydrophobicContact CD1-CG 4.42Å; F2390-F2428 HydrophobicContact CD1-CE2 4.32Å; F2390-F2428 HydrophobicContact CD2-CE2 4.38Å; F2390-F2428 HydrophobicContact CD2-CZ 4.32Å; F2390-F2428 AromaticContact CE1-CE2 3.97Å; F2390-F2428 HydrophobicContact CE1-CE2 4.11Å; F2390-F2428 HydrophobicContact CE1-CZ 4.28Å; F2390-F2428 HydrophobicContact CE2-CE2 4.15Å; F2390-F2428 AromaticContact CE2-CZ 3.91Å; F2390-F2428 HydrophobicContact CE2-CZ 3.91Å; F2390-F2428 HydrophobicContact CG-CE2 4.33Å; F2390-F2428 AromaticContact CZ-CE2 3.96Å; F2390-F2428 HydrophobicContact CZ-CE2 4.02Å; F2390-F2428 AromaticContact CZ-CZ 3.85Å; F2390-F2428 HydrophobicContact CZ-CZ 3.89Å; M2423-F2428 HydrophobicContact CG-CB 4.14Å; M2423-F2428 VanDerWaalsContact SD-CA 3.55Å; M2423-F2428 WeakPolarHBondContact SD-CA 3.19Å; M2423-F2428 HydrophobicContact SD-CB 3.84Å; M2423-F2428 HydrophobicContact SD-CD2 4.06Å; M2423-F2428 HydrophobicContact SD-CG 4.44Å; S2424-F2428 WeakPolarHBondContact O-CB 3.32Å; S2424-F2428 PolarHBondContact O-N 2.97Å; F2425-F2428 PolarHBondContact O-N 3.1Å; F2428-F2431 HydrophobicContact CD2-CD1 4.45Å; F2428-F2431 WeakPolarHBondContact O-CB 3.45Å; F2428-F2431 PolarHBondContact O-N 3.09Å; F2428-L2432 HydrophobicContact CD1-CD1 4.05Å; F2428-L2432 HydrophobicContact CE1-CD1 3.42Å; F2428-L2432 VanDerWaalsContact CE1-CD1 3.45Å; F2428-L2432 HydrophobicContact CE1-CG 4.41Å; F2428-L2432 HydrophobicContact CE2-CD1 4.18Å; F2428-L2432 HydrophobicContact CE2-CG 4.47Å; F2428-L2432 HydrophobicContact CZ-CD1 3.51Å; F2428-L2432 VanDerWaalsContact CZ-CD1 3.47Å; F2428-L2432 HydrophobicContact CZ-CG 4.32Å; F2428-L2432 PolarHBondContact O-N 3.14Å
2429	A	92.7	Very high	90.5	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-64.9	-42.8	175.1	0	0	0	0	0	111.6	I2261 L2267 F2425 F2431 L2432 L2433	I2261-A2429 HydrophobicContact CG1-CB 4.35Å; I2261-A2429 HydrophobicContact CG2-CB 3.89Å; L2267-A2429 HydrophobicContact CD1-CB 4.17Å; F2425-A2429 HydrophobicContact CE2-CB 4.11Å; F2425-A2429 HydrophobicContact CZ-CB 4.22Å; F2425-A2429 VanDerWaalsContact O-CB 3.25Å; F2425-A2429 WeakPolarHBondContact O-CB 3.34Å; F2425-A2429 PolarHBondContact O-N 3.11Å; A2429-F2431 VanDerWaalsContact C-N 3.32Å; A2429-F2431 PolarHBondContact O-N 3.07Å; A2429-L2432 PolarHBondContact O-N 2.9Å; A2429-L2433 VanDerWaalsContact O-CB 3.26Å; A2429-L2433 WeakPolarHBondContact O-CB 3.35Å; A2429-L2433 VanDerWaalsContact O-CG 3.25Å; A2429-L2433 WeakPolarHBondContact O-CG 3.41Å; A2429-L2433 PolarHBondContact O-N 3.04Å
2430	R	91.3	Very high	89.9	Confident	34 Å²	34	33.8 Å²	33.8	13%	0.128	17%	0.169	C	C	.	.	H	α-helix	trans	-59	-45.3	173.1	-82.7	-171	-177.1	86	0.5	112.2	I2261 M2342 H2411 E2426 G2427 L2432 L2433 D2434	I2261-R2430 HydrophobicContact CD1-CG 3.86Å; M2342-R2430 HydrophobicContact CE-CG 3.96Å; M2342-R2430 WeakPolarHBondContact O-CB 3.45Å; M2342-R2430 VanDerWaalsContact O-CD 3.22Å; M2342-R2430 WeakPolarHBondContact O-CD 3.34Å; M2342-R2430 WeakPolarHBondContact O-CG 3.37Å; H2411-R2430 HydrophobicContact CB-CB 4.2Å; H2411-R2430 WeakPolarHBondContact O-CD 3.24Å; E2426-R2430 VanDerWaalsContact CD-NH1 3.28Å; E2426-R2430 VanDerWaalsContact CG-NH1 3.3Å; E2426-R2430 WeakPolarHBondContact O-CB 3.31Å; E2426-R2430 WeakPolarHBondContact O-CG 3.44Å; E2426-R2430 PolarHBondContact O-N 3.09Å; E2426-R2430 VanDerWaalsContact O-N 3.16Å; E2426-R2430 PolarHBondContact O-NH1 3.21Å; E2426-R2430 VanDerWaalsContact O-NH1 3.13Å; E2426-R2430 IonicContact OE1-CZ 3.42Å; E2426-R2430 VanDerWaalsContact OE1-CZ 3.27Å; E2426-R2430 IonicContact OE1-NH1 3.29Å; E2426-R2430 PolarHBondContact OE1-NH1 3.1Å; E2426-R2430 IonicContact OE1-NH2 3.18Å; E2426-R2430 PolarHBondContact OE1-NH2 3.04Å; G2427-R2430 PolarHBondContact O-N 3.13Å; R2430-L2432 PolarHBondContact O-N 2.8Å; R2430-L2433 CarbonylContact O-C 3.54Å; R2430-L2433 PolarHBondContact O-N 3.22Å; R2430-D2434 WeakPolarHBondContact O-CB 3.27Å; R2430-D2434 PolarHBondContact O-N 2.96Å
2431	F	92.4	Very high	89.2	Confident	6.25 Å²	6.25	29.8 Å²	29.8	3%	0.027	15%	0.154	C	C	.	.	H	α-helix	trans	-57.7	-51.7	176.1	160.7	-117.8	0	0	0	111.7	F2390 M2391 L2407 H2411 M2423 G2427 F2428 A2429 L2433 D2434 N2437	F2390-F2431 HydrophobicContact CD1-CE1 4.36Å; F2390-F2431 AromaticContact CE1-CE1 3.94Å; F2390-F2431 HydrophobicContact CE1-CE1 4Å; M2391-F2431 HydrophobicContact CE-CZ 4.22Å; M2391-F2431 HydrophobicContact SD-CE1 4.05Å; M2391-F2431 HydrophobicContact SD-CE2 4.31Å; M2391-F2431 HydrophobicContact SD-CZ 3.45Å; M2391-F2431 WeakPolarHBondContact SD-CZ 3.37Å; L2407-F2431 HydrophobicContact CD1-CD2 4.13Å; L2407-F2431 HydrophobicContact CD1-CE2 4.17Å; L2407-F2431 HydrophobicContact CD1-CZ 4.32Å; L2407-F2431 HydrophobicContact CD2-CB 4.18Å; L2407-F2431 HydrophobicContact CD2-CD1 4.17Å; L2407-F2431 HydrophobicContact CD2-CD2 4Å; L2407-F2431 HydrophobicContact CD2-CE2 4.04Å; L2407-F2431 HydrophobicContact CD2-CG 3.72Å; L2407-F2431 HydrophobicContact CG-CD2 4.13Å; L2407-F2431 HydrophobicContact CG-CE2 4.37Å; H2411-F2431 HydrophobicContact CB-CB 4.16Å; H2411-F2431 AromaticContact CD2-CD2 3.87Å; H2411-F2431 AromaticContact CE1-CD2 3.84Å; H2411-F2431 AromaticContact NE2-CD2 3.84Å; M2423-F2431 HydrophobicContact CE-CB 4.24Å; G2427-F2431 WeakPolarHBondContact O-CB 3.28Å; G2427-F2431 PolarHBondContact O-N 3.17Å; F2428-F2431 HydrophobicContact CD2-CD1 4.45Å; F2428-F2431 WeakPolarHBondContact O-CB 3.45Å; F2428-F2431 PolarHBondContact O-N 3.09Å; A2429-F2431 VanDerWaalsContact C-N 3.32Å; A2429-F2431 PolarHBondContact O-N 3.07Å; F2431-L2433 VanDerWaalsContact C-N 3.28Å; F2431-L2433 PolarHBondContact O-N 3.14Å; F2431-D2434 VanDerWaalsContact O-CB 3.28Å; F2431-D2434 WeakPolarHBondContact O-CB 3.39Å; F2431-D2434 PolarHBondContact O-N 3.05Å; F2431-D2434 VanDerWaalsContact O-N 3.13Å; F2431-N2437 WeakPolarHBondContact CD2-ND2 3.4Å; F2431-N2437 WeakPolarHBondContact CE2-ND2 3.23Å; F2431-N2437 WeakPolarHBondContact CZ-ND2 3.47Å; F2431-N2437 WeakPolarHBondContact O-CB 3.26Å; F2431-N2437 PolarHBondContact O-ND2 3.43Å
2432	L	92.8	Very high	88.3	Confident	15 Å²	15	27.4 Å²	27.4	8%	0.079	14%	0.144	C	C	.	.	H	α-helix	trans	-69.7	-24	-178.7	-69.3	179.3	0	0	0	113.8	L2267 L2270 F2390 F2428 A2429 R2430 D2434 N2437 H3024 F3041	L2267-L2432 HydrophobicContact CD1-CB 4.24Å; L2267-L2432 HydrophobicContact CD1-CD1 4.43Å; L2267-L2432 HydrophobicContact CD2-CB 4.37Å; L2267-L2432 HydrophobicContact CD2-CD1 3.7Å; L2270-L2432 HydrophobicContact CD2-CD1 4.08Å; F2390-L2432 HydrophobicContact CE1-CD2 4.13Å; F2390-L2432 HydrophobicContact CZ-CD1 4.48Å; F2390-L2432 HydrophobicContact CZ-CD2 4.18Å; F2428-L2432 HydrophobicContact CD1-CD1 4.05Å; F2428-L2432 HydrophobicContact CE1-CD1 3.42Å; F2428-L2432 VanDerWaalsContact CE1-CD1 3.45Å; F2428-L2432 HydrophobicContact CE1-CG 4.41Å; F2428-L2432 HydrophobicContact CE2-CD1 4.18Å; F2428-L2432 HydrophobicContact CE2-CG 4.47Å; F2428-L2432 HydrophobicContact CZ-CD1 3.51Å; F2428-L2432 VanDerWaalsContact CZ-CD1 3.47Å; F2428-L2432 HydrophobicContact CZ-CG 4.32Å; F2428-L2432 PolarHBondContact O-N 3.14Å; A2429-L2432 PolarHBondContact O-N 2.9Å; R2430-L2432 PolarHBondContact O-N 2.8Å; L2432-D2434 VanDerWaalsContact C-N 3.34Å; L2432-N2437 WeakPolarHBondContact CA-ND2 3.35Å; L2432-N2437 WeakPolarHBondContact CD2-ND2 3.45Å; L2432-N2437 PolarHBondContact O-ND2 3.07Å; L2432-H3024 PolarHBondContact O-CD2 3.35Å; L2432-F3041 HydrophobicContact CD1-CZ 4.32Å
2433	L	89.5	Confident	87.3	Confident	16.75 Å²	16.75	26.7 Å²	26.7	9%	0.088	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-3.8	174.1	-74.9	170.2	0	0	0	113.7	R2087 I2261 R2264 L2267 M2342 A2429 R2430 F2431	R2087-L2433 VanDerWaalsContact CZ-O 3.31Å; R2087-L2433 PolarHBondContact NH1-O 2.82Å; R2087-L2433 PolarHBondContact NH2-O 3.18Å; I2261-L2433 HydrophobicContact CG1-CD1 4.31Å; R2264-L2433 HydrophobicContact CG-CD1 4.46Å; R2264-L2433 VanDerWaalsContact NH1-CD2 3.3Å; L2267-L2433 HydrophobicContact CD1-CD1 4.41Å; L2267-L2433 HydrophobicContact CD1-CD2 4.49Å; L2267-L2433 HydrophobicContact CD1-CG 4.4Å; M2342-L2433 HydrophobicContact CE-CB 4.05Å; M2342-L2433 HydrophobicContact CE-CD1 3.76Å; M2342-L2433 HydrophobicContact CE-CG 4.41Å; M2342-L2433 HydrophobicContact CG-CB 4Å; A2429-L2433 VanDerWaalsContact O-CB 3.26Å; A2429-L2433 WeakPolarHBondContact O-CB 3.35Å; A2429-L2433 VanDerWaalsContact O-CG 3.25Å; A2429-L2433 WeakPolarHBondContact O-CG 3.41Å; A2429-L2433 PolarHBondContact O-N 3.04Å; R2430-L2433 CarbonylContact O-C 3.54Å; R2430-L2433 PolarHBondContact O-N 3.22Å; F2431-L2433 VanDerWaalsContact C-N 3.28Å; F2431-L2433 PolarHBondContact O-N 3.14Å
2434	D	88.3	Confident	86.4	Confident	9.75 Å²	9.75	31.3 Å²	31.3	5%	0.052	17%	0.169	C	C	.	.	S	Bend	trans	-70.9	149.1	180	-166.3	-73.8	0	0	0	111.1	R2343 H2411 R2430 F2431 L2432 S2436 N2437	R2343-D2434 WeakPolarHBondContact CG-OD2 3.09Å; R2343-D2434 IonicContact CZ-OD1 3.41Å; R2343-D2434 IonicContact CZ-OD2 3.09Å; R2343-D2434 IonicContact NE-OD1 2.79Å; R2343-D2434 IonicContact NE-OD2 3.31Å; R2343-D2434 PolarHBondContact NE-OD2 2.88Å; R2343-D2434 IonicContact NH1-OD1 2.78Å; R2343-D2434 PolarHBondContact NH1-OD1 3.17Å; R2343-D2434 IonicContact NH1-OD2 3.25Å; R2343-D2434 PolarHBondContact NH1-OD2 3.42Å; R2343-D2434 IonicContact NH2-OD1 3.56Å; R2343-D2434 PolarHBondContact NH2-OD1 3.47Å; R2343-D2434 IonicContact NH2-OD2 3.1Å; R2343-D2434 PolarHBondContact NH2-OD2 3.1Å; H2411-D2434 IonicContact CE1-OD2 3.56Å; H2411-D2434 PolarHBondContact CE1-OD2 3.24Å; H2411-D2434 IonicContact ND1-OD2 2.77Å; H2411-D2434 PolarHBondContact ND1-OD2 3.02Å; H2411-D2434 IonicContact NE2-OD2 2.78Å; R2430-D2434 WeakPolarHBondContact O-CB 3.27Å; R2430-D2434 PolarHBondContact O-N 2.96Å; F2431-D2434 VanDerWaalsContact O-CB 3.28Å; F2431-D2434 WeakPolarHBondContact O-CB 3.39Å; F2431-D2434 PolarHBondContact O-N 3.05Å; F2431-D2434 VanDerWaalsContact O-N 3.13Å; L2432-D2434 VanDerWaalsContact C-N 3.34Å; D2434-S2436 PolarHBondContact O-N 3.04Å; D2434-S2436 VanDerWaalsContact O-N 3.1Å; D2434-S2436 VanDerWaalsContact OD1-CB 3.25Å; D2434-S2436 WeakPolarHBondContact OD1-CB 3.32Å; D2434-S2436 PolarHBondContact OD1-N 3.04Å; D2434-S2436 PolarHBondContact OD1-OG 3.41Å; D2434-S2436 PolarHBondContact OD2-OG 3.05Å; D2434-S2436 VanDerWaalsContact OD2-OG 3.08Å; D2434-N2437 WeakPolarHBondContact O-CB 3.35Å; D2434-N2437 PolarHBondContact O-N 3.19Å
2435	S	82.6	Confident	85.6	Confident	17.25 Å²	17.25	33.4 Å²	33.4	12%	0.121	18%	0.179	C	C	.	.	G	3₁₀ helix	trans	-57.9	-29.3	177.6	58.5	0	0	0	0	113.1	D2339 N2437 F2438	D2339-S2435 PolarHBondContact O-OG 3.15Å; S2435-N2437 PolarHBondContact O-N 3.16Å; S2435-N2437 VanDerWaalsContact O-N 3.15Å; S2435-F2438 WeakPolarHBondContact O-CB 3.37Å; S2435-F2438 VanDerWaalsContact O-CD2 3.28Å; S2435-F2438 WeakPolarHBondContact O-CD2 3.36Å; S2435-F2438 WeakPolarHBondContact O-CG 3.46Å; S2435-F2438 PolarHBondContact O-N 3.24Å
2436	S	83.5	Confident	85.1	Confident	57.75 Å²	57.75	41.4 Å²	41.4	40%	0.404	21%	0.214	S	C	.	.	G	3₁₀ helix	trans	-65.8	-12.7	175.4	67.4	0	0	0	0	114	D2434 R3019	D2434-S2436 PolarHBondContact O-N 3.04Å; D2434-S2436 VanDerWaalsContact O-N 3.1Å; D2434-S2436 VanDerWaalsContact OD1-CB 3.25Å; D2434-S2436 WeakPolarHBondContact OD1-CB 3.32Å; D2434-S2436 PolarHBondContact OD1-N 3.04Å; D2434-S2436 PolarHBondContact OD1-OG 3.41Å; D2434-S2436 PolarHBondContact OD2-OG 3.05Å; D2434-S2436 VanDerWaalsContact OD2-OG 3.08Å; S2436-R3019 PolarHBondContact O-NH1 3.41Å; S2436-R3019 PolarHBondContact O-NH2 3.04Å
2437	N	88.5	Confident	84.8	Confident	20.5 Å²	20.5	42.9 Å²	42.9	11%	0.11	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-104.2	12.2	178.8	-145.6	35.1	0	0	0	113.5	Q2395 F2431 L2432 D2434 S2435 A2439 Y3022 R3023 H3024	Q2395-N2437 PolarHBondContact NE2-ND2 3.24Å; Q2395-N2437 PolarHBondContact NE2-OD1 3.14Å; Q2395-N2437 VanDerWaalsContact NE2-OD1 3.09Å; Q2395-N2437 PolarHBondContact OE1-OD1 2.97Å; F2431-N2437 WeakPolarHBondContact CD2-ND2 3.4Å; F2431-N2437 WeakPolarHBondContact CE2-ND2 3.23Å; F2431-N2437 WeakPolarHBondContact CZ-ND2 3.47Å; F2431-N2437 WeakPolarHBondContact O-CB 3.26Å; F2431-N2437 PolarHBondContact O-ND2 3.43Å; L2432-N2437 WeakPolarHBondContact CA-ND2 3.35Å; L2432-N2437 WeakPolarHBondContact CD2-ND2 3.45Å; L2432-N2437 PolarHBondContact O-ND2 3.07Å; D2434-N2437 WeakPolarHBondContact O-CB 3.35Å; D2434-N2437 PolarHBondContact O-N 3.19Å; S2435-N2437 PolarHBondContact O-N 3.16Å; S2435-N2437 VanDerWaalsContact O-N 3.15Å; N2437-A2439 PolarHBondContact O-N 2.75Å; N2437-Y3022 PolarHBondContact ND2-O 3.07Å; N2437-Y3022 PolarHBondContact OD1-O 3.03Å; N2437-R3023 VanDerWaalsContact OD1-CD 3.3Å; N2437-R3023 WeakPolarHBondContact OD1-CD 3.45Å; N2437-R3023 PolarHBondContact OD1-NH1 2.95Å; N2437-H3024 PolarHBondContact O-N 2.88Å
2438	F	86.6	Confident	84.3	Confident	42.5 Å²	42.5	46.1 Å²	46.1	19%	0.186	24%	0.239	C	C	.	.	B	Isolated β-bridge	trans	-67.8	137.1	172.3	-68.3	-18.4	0	0	0	110.9	H2084 D2085 S2435 Y2440 L2441 R3019 H3024 R3026	H2084-F2438 HydrophobicContact CB-CD2 4.12Å; H2084-F2438 HydrophobicContact CB-CE2 4.02Å; H2084-F2438 WeakPolarHBondContact O-CE2 3.45Å; D2085-F2438 HydrophobicContact CB-CE2 4.16Å; D2085-F2438 HydrophobicContact CB-CZ 4.29Å; S2435-F2438 WeakPolarHBondContact O-CB 3.37Å; S2435-F2438 VanDerWaalsContact O-CD2 3.28Å; S2435-F2438 WeakPolarHBondContact O-CD2 3.36Å; S2435-F2438 WeakPolarHBondContact O-CG 3.46Å; S2435-F2438 PolarHBondContact O-N 3.24Å; F2438-Y2440 VanDerWaalsContact C-N 3.32Å; F2438-Y2440 PolarHBondContact O-N 3.22Å; F2438-L2441 HydrophobicContact CB-CD2 3.9Å; F2438-L2441 HydrophobicContact CB-CG 4.35Å; F2438-L2441 HydrophobicContact CD2-CD2 3.91Å; F2438-L2441 HydrophobicContact CG-CD2 4.39Å; F2438-R3019 PolarHBondContact O-NH1 3.01Å; F2438-H3024 CarbonylContact C-O 3.52Å; F2438-H3024 WeakPolarHBondContact CA-O 3.4Å; F2438-H3024 HydrophobicContact CD1-CB 3.84Å; F2438-H3024 HydrophobicContact CE1-CB 4.23Å; F2438-R3026 HydrophobicContact CD1-CG 3.72Å; F2438-R3026 HydrophobicContact CD2-CG 4.41Å; F2438-R3026 HydrophobicContact CE1-CG 3.66Å; F2438-R3026 HydrophobicContact CE2-CG 4.34Å; F2438-R3026 HydrophobicContact CG-CG 4.14Å; F2438-R3026 HydrophobicContact CZ-CG 3.99Å
2439	A	84.5	Confident	84	Confident	57.25 Å²	57.25	53.3 Å²	53.3	47%	0.473	27%	0.27	S	S	.	.	S	Bend	trans	-68.5	-24.3	-176.6	0	0	0	0	0	113.4	N2437 L3018 R3019 R3023 H3024 V3025	N2437-A2439 PolarHBondContact O-N 2.75Å; A2439-L3018 HydrophobicContact CB-CD1 3.96Å; A2439-R3019 WeakPolarHBondContact O-CB 3.44Å; A2439-R3019 PolarHBondContact O-N 2.91Å; A2439-R3023 HydrophobicContact CB-CB 3.56Å; A2439-R3023 HydrophobicContact CB-CG 4.28Å; A2439-H3024 PolarHBondContact N-O 3.24Å; A2439-V3025 HydrophobicContact CB-CG2 3.8Å
2440	Y	80.7	Confident	83.6	Confident	70 Å²	70	61.3 Å²	61.3	28%	0.275	31%	0.305	S	S	.	.			trans	-151	131.7	-179.1	-179.1	-120.7	0	0	0	110.4	F2438 N2442 N2445 E2890 V3013 A3017 R3026	F2438-Y2440 VanDerWaalsContact C-N 3.32Å; F2438-Y2440 PolarHBondContact O-N 3.22Å; Y2440-N2442 HydrophobicContact CD1-CB 4.45Å; Y2440-N2442 VanDerWaalsContact CD1-OD1 3.24Å; Y2440-N2442 WeakPolarHBondContact CD1-OD1 3.35Å; Y2440-N2442 HydrophobicContact CE1-CB 3.77Å; Y2440-N2442 WeakPolarHBondContact CE1-OD1 3.27Å; Y2440-N2442 PolarHBondContact OH-OD1 3.16Å; Y2440-N2445 PolarHBondContact OH-ND2 3.13Å; Y2440-E2890 WeakPolarHBondContact CE1-OE2 3.44Å; Y2440-E2890 WeakPolarHBondContact OH-CB 3.49Å; Y2440-V3013 HydrophobicContact CD1-CG1 3.87Å; Y2440-V3013 HydrophobicContact CD1-CG2 4.43Å; Y2440-V3013 HydrophobicContact CD2-CG1 4.33Å; Y2440-V3013 HydrophobicContact CG-CG1 3.75Å; Y2440-A3017 HydrophobicContact CD2-CB 3.77Å; Y2440-A3017 HydrophobicContact CE2-CB 3.51Å; Y2440-R3026 PolarHBondContact O-NH2 2.88Å
2441	L	77.2	Confident	83.5	Confident	40 Å²	40	62.6 Å²	62.6	21%	0.209	31%	0.314	C	S	.	.			trans	-123.6	90.3	-177.4	-68.6	174.2	0	0	0	109.5	H2084 F2438 E2443 D2444	H2084-L2441 HydrophobicContact CB-CD2 3.9Å; H2084-L2441 VanDerWaalsContact CD2-CA 3.41Å; H2084-L2441 WeakPolarHBondContact CD2-CA 3.09Å; H2084-L2441 WeakPolarHBondContact NE2-CA 3.15Å; H2084-L2441 WeakPolarHBondContact NE2-CB 3.48Å; F2438-L2441 HydrophobicContact CB-CD2 3.9Å; F2438-L2441 HydrophobicContact CB-CG 4.35Å; F2438-L2441 HydrophobicContact CD2-CD2 3.91Å; F2438-L2441 HydrophobicContact CG-CD2 4.39Å; L2441-E2443 PolarHBondContact O-N 3.1Å; L2441-E2443 VanDerWaalsContact O-N 3.14Å; L2441-D2444 HydrophobicContact CB-CB 4.3Å; L2441-D2444 WeakPolarHBondContact CD1-OD2 3.36Å; L2441-D2444 PolarHBondContact O-N 3.3Å; L2441-D2444 VanDerWaalsContact O-N 3.13Å
2442	N	75.2	Confident	83.6	Confident	50.75 Å²	50.75	62.6 Å²	62.6	27%	0.271	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-28.5	178.5	-8.2	-55.6	0	0	0	114.2	H2084 Y2440 D2444 N2445 E2890 R3011	H2084-N2442 PolarHBondContact CD2-N 3.33Å; H2084-N2442 VanDerWaalsContact CD2-N 3.32Å; H2084-N2442 WeakPolarHBondContact NE2-CB 3.42Å; H2084-N2442 PolarHBondContact NE2-N 2.78Å; Y2440-N2442 HydrophobicContact CD1-CB 4.45Å; Y2440-N2442 VanDerWaalsContact CD1-OD1 3.24Å; Y2440-N2442 WeakPolarHBondContact CD1-OD1 3.35Å; Y2440-N2442 HydrophobicContact CE1-CB 3.77Å; Y2440-N2442 WeakPolarHBondContact CE1-OD1 3.27Å; Y2440-N2442 PolarHBondContact OH-OD1 3.16Å; N2442-D2444 PolarHBondContact O-N 3.42Å; N2442-N2445 VanDerWaalsContact O-CB 3.22Å; N2442-N2445 WeakPolarHBondContact O-CB 3.22Å; N2442-N2445 PolarHBondContact O-N 3.27Å; N2442-E2890 HydrophobicContact CB-CB 3.97Å; N2442-E2890 HydrophobicContact CB-CG 3.95Å; N2442-E2890 WeakPolarHBondContact CB-OE2 3.26Å; N2442-R3011 PolarHBondContact OD1-NH2 3.46Å
2443	E	73.3	Confident	83.6	Confident	67 Å²	67	66.7 Å²	66.7	31%	0.313	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76	-24	-177.7	-59.7	135.2	160.3	0	0	113.7	C2082 H2083 H2084 L2441 N2445 R3026	C2082-E2443 WeakPolarHBondContact CB-OE1 3.37Å; C2082-E2443 WeakPolarHBondContact O-CG 3.48Å; C2082-E2443 VanDerWaalsContact O-OE1 3.07Å; H2083-E2443 VanDerWaalsContact CA-OE1 3.29Å; H2083-E2443 WeakPolarHBondContact CA-OE1 3.44Å; H2083-E2443 PolarHBondContact N-OE1 3.2Å; H2083-E2443 VanDerWaalsContact N-OE1 3.08Å; H2083-E2443 IonicContact ND1-OE1 3.71Å; H2083-E2443 PolarHBondContact ND1-OE1 3.15Å; H2083-E2443 IonicContact ND1-OE2 3.9Å; H2084-E2443 IonicContact CD2-OE2 2.72Å; H2084-E2443 VanDerWaalsContact CE1-CB 3.41Å; H2084-E2443 WeakPolarHBondContact CE1-CB 3.23Å; H2084-E2443 WeakPolarHBondContact CE1-CG 3.29Å; H2084-E2443 PolarHBondContact CE1-N 3.28Å; H2084-E2443 IonicContact CE1-OE1 3.15Å; H2084-E2443 IonicContact CE1-OE2 3.63Å; H2084-E2443 PolarHBondContact CE1-OE2 3.4Å; H2084-E2443 IonicContact ND1-OE2 3.56Å; H2084-E2443 PolarHBondContact NE2-N 3.15Å; L2441-E2443 PolarHBondContact O-N 3.1Å; L2441-E2443 VanDerWaalsContact O-N 3.14Å; E2443-N2445 VanDerWaalsContact C-N 3.34Å; E2443-N2445 PolarHBondContact O-N 3.14Å; E2443-R3026 VanDerWaalsContact CD-NH2 3.33Å; E2443-R3026 IonicContact OE1-CZ 2.66Å; E2443-R3026 IonicContact OE1-NH1 2.72Å; E2443-R3026 PolarHBondContact OE1-NH1 3.33Å; E2443-R3026 IonicContact OE1-NH2 3.72Å; E2443-R3026 PolarHBondContact OE1-NH2 3.03Å; E2443-R3026 VanDerWaalsContact OE1-NH2 3.08Å; E2443-R3026 IonicContact OE2-CZ 2.96Å; E2443-R3026 IonicContact OE2-NH1 3.36Å; E2443-R3026 IonicContact OE2-NH2 2.72Å; E2443-R3026 PolarHBondContact OE2-NH2 3.09Å
2444	D	73.8	Confident	83.9	Confident	95.75 Å²	95.75	70.6 Å²	70.6	51%	0.512	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-20.5	175.4	-80.7	-36.1	0	0	0	112.3	H2084 L2441 N2442 K2446	H2084-D2444 IonicContact CE1-OD1 3.62Å; H2084-D2444 PolarHBondContact CE1-OD1 2.68Å; H2084-D2444 IonicContact CE1-OD2 2.64Å; H2084-D2444 PolarHBondContact CE1-OD2 3.14Å; H2084-D2444 IonicContact ND1-OD2 3.13Å; H2084-D2444 IonicContact NE2-OD1 2.77Å; H2084-D2444 IonicContact NE2-OD2 2.68Å; L2441-D2444 HydrophobicContact CB-CB 4.3Å; L2441-D2444 WeakPolarHBondContact CD1-OD2 3.36Å; L2441-D2444 PolarHBondContact O-N 3.3Å; L2441-D2444 VanDerWaalsContact O-N 3.13Å; N2442-D2444 PolarHBondContact O-N 3.42Å; D2444-K2446 PolarHBondContact O-N 3.24Å; D2444-K2446 VanDerWaalsContact O-N 3.13Å
2445	N	77.8	Confident	84.2	Confident	60 Å²	60	71.2 Å²	71.2	32%	0.321	36%	0.355	S	S	.	.			trans	-70	109.5	178.9	-74	-21.8	0	0	0	110.7	Y2440 N2442 E2443 M2447 E2890 Q2891 G2893	Y2440-N2445 PolarHBondContact OH-ND2 3.13Å; N2442-N2445 VanDerWaalsContact O-CB 3.22Å; N2442-N2445 WeakPolarHBondContact O-CB 3.22Å; N2442-N2445 PolarHBondContact O-N 3.27Å; E2443-N2445 VanDerWaalsContact C-N 3.34Å; E2443-N2445 PolarHBondContact O-N 3.14Å; N2445-M2447 PolarHBondContact O-N 3.23Å; N2445-E2890 WeakPolarHBondContact CB-O 3.42Å; N2445-E2890 PolarHBondContact ND2-O 3.26Å; N2445-Q2891 WeakPolarHBondContact CB-O 3.39Å; N2445-G2893 VanDerWaalsContact O-CA 3.24Å; N2445-G2893 WeakPolarHBondContact O-CA 3.29Å
2446	K	80.8	Confident	84.9	Confident	171.25 Å²	171.25	70.6 Å²	70.6	75%	0.745	35%	0.35	S	S	*	.			trans	-110.8	137.5	173.8	-71.2	174.1	-174.7	172.4	0	108.9	D2444 N2448	D2444-K2446 PolarHBondContact O-N 3.24Å; D2444-K2446 VanDerWaalsContact O-N 3.13Å; K2446-N2448 PolarHBondContact O-N 3.08Å; K2446-N2448 VanDerWaalsContact O-N 3.09Å
2447	M	83.1	Confident	85.4	Confident	66.75 Å²	66.75	68.9 Å²	68.9	33%	0.329	34%	0.339	S	S	.	.			trans	-53.8	113.6	178.5	-177.4	-171.7	71.2	0	0	111.1	N2445 K2449 M2452 L2537 N2892 C2895	N2445-M2447 PolarHBondContact O-N 3.23Å; M2447-K2449 HydrophobicContact CE-CG 4.07Å; M2447-K2449 PolarHBondContact O-N 2.97Å; M2447-K2449 VanDerWaalsContact O-N 3.1Å; M2447-M2452 HydrophobicContact CG-CE 3.5Å; M2447-M2452 VanDerWaalsContact CG-CE 3.5Å; M2447-M2452 HydrophobicContact CG-CG 4.04Å; M2447-M2452 HydrophobicContact CG-SD 4.26Å; M2447-M2452 HydrophobicContact SD-CE 4.02Å; M2447-M2452 HydrophobicContact SD-CG 4.28Å; M2447-M2452 HydrophobicContact SD-SD 4.44Å; M2447-L2537 HydrophobicContact SD-CD1 3.77Å; M2447-L2537 HydrophobicContact SD-CD2 4.1Å; M2447-L2537 HydrophobicContact SD-CG 3.98Å; M2447-N2892 WeakPolarHBondContact CA-O 3.39Å; M2447-N2892 VanDerWaalsContact CA-OD1 3.27Å; M2447-N2892 WeakPolarHBondContact CA-OD1 3.47Å; M2447-C2895 HydrophobicContact CB-CB 4.29Å; M2447-C2895 HydrophobicContact CG-CB 4.07Å; M2447-C2895 HydrophobicContact SD-CB 4.15Å
2448	N	83.1	Confident	85.8	Confident	67.75 Å²	67.75	70.5 Å²	70.5	36%	0.362	34%	0.344	S	S	.	.			trans	-76.7	104.8	175.7	-177.8	6.4	0	0	0	109.8	K2446 K2450 D2451 M2452 N2892	K2446-N2448 PolarHBondContact O-N 3.08Å; K2446-N2448 VanDerWaalsContact O-N 3.09Å; N2448-K2450 PolarHBondContact O-N 3.03Å; N2448-K2450 VanDerWaalsContact O-N 3.12Å; N2448-K2450 PolarHBondContact OD1-N 2.86Å; N2448-K2450 VanDerWaalsContact OD1-N 3.12Å; N2448-D2451 HydrophobicContact CB-CB 4.35Å; N2448-D2451 WeakPolarHBondContact CB-OD2 3.5Å; N2448-D2451 PolarHBondContact ND2-OD1 2.93Å; N2448-D2451 VanDerWaalsContact ND2-OD1 3.12Å; N2448-D2451 PolarHBondContact ND2-OD2 3.19Å; N2448-D2451 PolarHBondContact O-N 2.95Å; N2448-D2451 VanDerWaalsContact O-N 3.08Å; N2448-M2452 WeakPolarHBondContact O-CG 3.27Å; N2448-N2892 PolarHBondContact N-OD1 3.16Å
2449	K	85.7	Confident	86.3	Confident	152 Å²	152	69.1 Å²	69.1	66%	0.661	34%	0.337	S	S	*	.	G	3₁₀ helix	trans	-56.2	-31.4	-178.7	-69.9	-177.7	-179.8	176.6	0	113.7	M2447 D2451 M2452 L2587	M2447-K2449 HydrophobicContact CE-CG 4.07Å; M2447-K2449 PolarHBondContact O-N 2.97Å; M2447-K2449 VanDerWaalsContact O-N 3.1Å; K2449-D2451 VanDerWaalsContact C-N 3.28Å; K2449-D2451 PolarHBondContact O-N 3.01Å; K2449-M2452 PolarHBondContact O-N 3.12Å; K2449-M2452 VanDerWaalsContact O-N 3.16Å; K2449-L2587 WeakPolarHBondContact O-CD1 3.14Å
2450	K	85.8	Confident	86.8	Confident	168.25 Å²	168.25	69 Å²	69	73%	0.732	33%	0.326	S	S	*	.	G	3₁₀ helix	trans	-66.8	-29.9	-179.8	-66.7	-175.8	177.9	-179.2	0	112.5	N2448 M2452	N2448-K2450 PolarHBondContact O-N 3.03Å; N2448-K2450 VanDerWaalsContact O-N 3.12Å; N2448-K2450 PolarHBondContact OD1-N 2.86Å; N2448-K2450 VanDerWaalsContact OD1-N 3.12Å; K2450-M2452 VanDerWaalsContact C-N 3.3Å; K2450-M2452 PolarHBondContact O-N 3.24Å
2451	D	88.8	Confident	87.5	Confident	61.75 Å²	61.75	66.4 Å²	66.4	33%	0.33	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	-86.2	-4.2	-177	-60.5	-16.5	0	0	0	111.7	N2448 K2449 Y2454 Y2459 L2899	N2448-D2451 HydrophobicContact CB-CB 4.35Å; N2448-D2451 WeakPolarHBondContact CB-OD2 3.5Å; N2448-D2451 PolarHBondContact ND2-OD1 2.93Å; N2448-D2451 VanDerWaalsContact ND2-OD1 3.12Å; N2448-D2451 PolarHBondContact ND2-OD2 3.19Å; N2448-D2451 PolarHBondContact O-N 2.95Å; N2448-D2451 VanDerWaalsContact O-N 3.08Å; K2449-D2451 VanDerWaalsContact C-N 3.28Å; K2449-D2451 PolarHBondContact O-N 3.01Å; D2451-Y2454 WeakPolarHBondContact O-CD2 3.46Å; D2451-Y2459 VanDerWaalsContact O-CE1 3.27Å; D2451-Y2459 WeakPolarHBondContact O-CE1 3.32Å; D2451-Y2459 VanDerWaalsContact O-CZ 3.29Å; D2451-Y2459 PolarHBondContact O-OH 3.04Å; D2451-Y2459 VanDerWaalsContact O-OH 3.14Å; D2451-L2899 HydrophobicContact CB-CD2 4.09Å
2452	M	93.4	Very high	88.4	Confident	6.25 Å²	6.25	65.3 Å²	65.3	3%	0.031	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	-96.8	12.1	-174.7	-62.2	-64.3	144.1	0	0	114.2	M2447 N2448 K2449 K2450 Y2459 L2537 S2585 P2586 L2587 N2892	M2447-M2452 HydrophobicContact CG-CE 3.5Å; M2447-M2452 VanDerWaalsContact CG-CE 3.5Å; M2447-M2452 HydrophobicContact CG-CG 4.04Å; M2447-M2452 HydrophobicContact CG-SD 4.26Å; M2447-M2452 HydrophobicContact SD-CE 4.02Å; M2447-M2452 HydrophobicContact SD-CG 4.28Å; M2447-M2452 HydrophobicContact SD-SD 4.44Å; N2448-M2452 WeakPolarHBondContact O-CG 3.27Å; K2449-M2452 PolarHBondContact O-N 3.12Å; K2449-M2452 VanDerWaalsContact O-N 3.16Å; K2450-M2452 VanDerWaalsContact C-N 3.3Å; K2450-M2452 PolarHBondContact O-N 3.24Å; M2452-Y2459 VanDerWaalsContact CA-OH 3.24Å; M2452-Y2459 WeakPolarHBondContact CA-OH 3.38Å; M2452-Y2459 HydrophobicContact CE-CD1 4.13Å; M2452-Y2459 HydrophobicContact CE-CE1 3.64Å; M2452-Y2459 PolarHBondContact O-OH 3.03Å; M2452-Y2459 HydrophobicContact SD-CD1 4.26Å; M2452-Y2459 HydrophobicContact SD-CE1 4Å; M2452-L2537 HydrophobicContact CE-CD1 3.69Å; M2452-L2537 HydrophobicContact CE-CD2 3.75Å; M2452-L2537 HydrophobicContact CE-CG 4.3Å; M2452-L2537 HydrophobicContact SD-CD1 4.07Å; M2452-S2585 WeakPolarHBondContact O-CB 3.4Å; M2452-S2585 PolarHBondContact O-OG 3.15Å; M2452-P2586 HydrophobicContact CE-CB 3.75Å; M2452-P2586 HydrophobicContact CE-CG 4.14Å; M2452-P2586 WeakPolarHBondContact O-CD 3.43Å; M2452-P2586 HydrophobicContact SD-CB 4.44Å; M2452-P2586 HydrophobicContact SD-CG 4.44Å; M2452-L2587 HydrophobicContact CB-CB 4.34Å; M2452-L2587 HydrophobicContact CB-CD1 3.65Å; M2452-L2587 HydrophobicContact CB-CD2 3.88Å; M2452-L2587 HydrophobicContact CB-CG 3.56Å; M2452-L2587 VanDerWaalsContact O-CB 3.32Å; M2452-L2587 WeakPolarHBondContact O-CB 3.34Å; M2452-L2587 WeakPolarHBondContact O-CG 3.42Å; M2452-L2587 PolarHBondContact O-N 3.31Å; M2452-N2892 WeakPolarHBondContact CE-ND2 3.35Å; M2452-N2892 PolarHBondContact SD-ND2 2.83Å; M2452-N2892 VanDerWaalsContact SD-ND2 3.42Å
2453	D	93.9	Very high	89.5	Confident	100.5 Å²	100.5	63.9 Å²	63.9	54%	0.537	31%	0.308	S	S	.	.			trans	-107.8	6.1	-177.5	-109.9	-10.9	0	0	0	114.7	Y2459 S2585 L2587	D2453-Y2459 PolarHBondContact N-OH 3.11Å; D2453-S2585 VanDerWaalsContact C-CB 3.49Å; D2453-S2585 WeakPolarHBondContact O-CB 3.31Å; D2453-S2585 PolarHBondContact OD1-OG 2.99Å; D2453-L2587 WeakPolarHBondContact OD1-CD1 3.34Å
2454	Y	95	Very high	90.6	Very high	99.25 Å²	99.25	61 Å²	61	39%	0.389	30%	0.295	S	S	.	.	S	Bend	trans	-81.5	164.2	171.1	-62.6	-79.6	0	0	0	111.4	D2451 Y2458 Y2459 S2585 P2586 L2899 W2905	D2451-Y2454 WeakPolarHBondContact O-CD2 3.46Å; Y2454-Y2458 HydrophobicContact CD1-CD1 4.24Å; Y2454-Y2458 HydrophobicContact CD1-CD2 4.21Å; Y2454-Y2458 HydrophobicContact CD1-CE1 4.48Å; Y2454-Y2458 HydrophobicContact CD1-CE2 4.44Å; Y2454-Y2458 HydrophobicContact CG-CD1 4.25Å; Y2454-Y2458 HydrophobicContact CG-CD2 4.33Å; Y2454-Y2459 WeakPolarHBondContact CA-OH 3.47Å; Y2454-Y2459 WeakPolarHBondContact CB-OH 3.4Å; Y2454-Y2459 PolarHBondContact N-OH 2.91Å; Y2454-Y2459 WeakPolarHBondContact O-CE2 3.3Å; Y2454-Y2459 PolarHBondContact O-OH 3.07Å; Y2454-S2585 VanDerWaalsContact O-CA 3.3Å; Y2454-S2585 WeakPolarHBondContact O-CA 3.39Å; Y2454-S2585 WeakPolarHBondContact O-CB 3.39Å; Y2454-P2586 WeakPolarHBondContact O-CD 3.44Å; Y2454-L2899 HydrophobicContact CD2-CD1 3.7Å; Y2454-L2899 HydrophobicContact CD2-CD2 3.95Å; Y2454-L2899 HydrophobicContact CD2-CG 4.45Å; Y2454-L2899 HydrophobicContact CE2-CD1 4.46Å; Y2454-L2899 HydrophobicContact CE2-CD2 3.91Å; Y2454-L2899 HydrophobicContact CG-CD1 4.1Å; Y2454-W2905 AromaticContact CD1-CH2 3.94Å; Y2454-W2905 HydrophobicContact CD1-CH2 3.94Å; Y2454-W2905 AromaticContact CD1-CZ3 3.9Å; Y2454-W2905 HydrophobicContact CD1-CZ3 3.96Å; Y2454-W2905 AromaticContact CE1-CH2 3.52Å; Y2454-W2905 HydrophobicContact CE1-CH2 3.52Å; Y2454-W2905 VanDerWaalsContact CE1-CH2 3.46Å; Y2454-W2905 HydrophobicContact CE1-CZ2 4.47Å; Y2454-W2905 AromaticContact CE1-CZ3 3.71Å; Y2454-W2905 HydrophobicContact CE1-CZ3 3.71Å; Y2454-W2905 HydrophobicContact CE2-CH2 4.32Å; Y2454-W2905 HydrophobicContact CG-CH2 4.49Å; Y2454-W2905 AromaticContact CZ-CH2 3.73Å
2455	P	95.5	Very high	91.7	Very high	22.75 Å²	22.75	58.6 Å²	58.6	15%	0.148	28%	0.281	C	S	.	.			trans	-56.2	146.2	176	-27.6	36.7	0	0	0	113.7	S2457 Y2458 Y2459 K2582 L2583	P2455-S2457 PolarHBondContact O-N 3.1Å; P2455-Y2458 HydrophobicContact CB-CD1 4.26Å; P2455-Y2458 HydrophobicContact CB-CD2 4.04Å; P2455-Y2458 HydrophobicContact CB-CE1 4.41Å; P2455-Y2458 HydrophobicContact CB-CE2 4.31Å; P2455-Y2458 HydrophobicContact CG-CD2 4.29Å; P2455-Y2458 HydrophobicContact CG-CE1 4.38Å; P2455-Y2458 HydrophobicContact CG-CE2 4.27Å; P2455-Y2458 WeakPolarHBondContact O-CB 3.32Å; P2455-Y2458 PolarHBondContact O-N 3.05Å; P2455-Y2459 WeakPolarHBondContact O-CD2 3.4Å; P2455-Y2459 VanDerWaalsContact O-CE2 3.28Å; P2455-Y2459 WeakPolarHBondContact O-CE2 3.29Å; P2455-K2582 HydrophobicContact CB-CB 4.45Å; P2455-K2582 HydrophobicContact CG-CB 4.32Å; P2455-K2582 HydrophobicContact CG-CD 4.09Å; P2455-L2583 VanDerWaalsContact CA-O 3.25Å; P2455-L2583 WeakPolarHBondContact CA-O 3.36Å; P2455-L2583 HydrophobicContact CB-CB 4.39Å; P2455-L2583 VanDerWaalsContact CB-O 3.28Å; P2455-L2583 WeakPolarHBondContact CB-O 3.39Å
2456	L	96.2	Very high	92.6	Very high	4 Å²	4	56 Å²	56	2%	0.021	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-54.2	-29.5	-176.7	-165.4	62.4	0	0	0	114.5	Y2458 Y2459 I2461 L2583 P2584 P2586 L2589 L2594 I2843 Y2897	L2456-Y2458 PolarHBondContact O-N 2.97Å; L2456-Y2458 VanDerWaalsContact O-N 3.16Å; L2456-Y2459 PolarHBondContact O-N 3.18Å; L2456-I2461 HydrophobicContact CD1-CD1 4.03Å; L2456-I2461 HydrophobicContact CG-CD1 4.43Å; L2456-L2583 HydrophobicContact CB-CB 3.95Å; L2456-L2583 HydrophobicContact CB-CD1 4.36Å; L2456-P2584 WeakPolarHBondContact CB-O 3.32Å; L2456-P2584 PolarHBondContact N-O 3.29Å; L2456-P2584 VanDerWaalsContact N-O 3.11Å; L2456-P2586 HydrophobicContact CD1-CB 4.49Å; L2456-P2586 HydrophobicContact CD1-CG 3.93Å; L2456-L2589 HydrophobicContact CD2-CD1 4.41Å; L2456-L2594 HydrophobicContact CD2-CD1 4.11Å; L2456-I2843 HydrophobicContact CB-CD1 4.2Å; L2456-I2843 HydrophobicContact CD2-CD1 3.82Å; L2456-I2843 HydrophobicContact CG-CD1 3.83Å; L2456-Y2897 HydrophobicContact CD1-CD1 4.28Å; L2456-Y2897 HydrophobicContact CD1-CE1 3.55Å
2457	S	95.6	Very high	93.4	Very high	22.75 Å²	22.75	47.9 Å²	47.9	16%	0.159	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-66.7	-15.1	176.2	52.4	0	0	0	0	114.2	P2455 Y2459 K2840 Q2869 K2900	P2455-S2457 PolarHBondContact O-N 3.1Å; S2457-Y2459 VanDerWaalsContact C-N 3.27Å; S2457-Y2459 PolarHBondContact O-N 3.08Å; S2457-K2840 WeakPolarHBondContact CB-O 3.28Å; S2457-K2840 PolarHBondContact OG-O 3.06Å; S2457-Q2869 WeakPolarHBondContact O-CG 3.37Å; S2457-Q2869 PolarHBondContact O-NE2 3.16Å; S2457-K2900 WeakPolarHBondContact O-CE 3.33Å; S2457-K2900 PolarHBondContact O-NZ 3.25Å
2458	Y	96	Very high	94	Very high	53.5 Å²	53.5	44.7 Å²	44.7	21%	0.21	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-85.5	2.7	-178.6	-71.6	-53.6	0	0	0	112.6	Y2454 P2455 L2456 K2582 K2840 K2900 W2905	Y2454-Y2458 HydrophobicContact CD1-CD1 4.24Å; Y2454-Y2458 HydrophobicContact CD1-CD2 4.21Å; Y2454-Y2458 HydrophobicContact CD1-CE1 4.48Å; Y2454-Y2458 HydrophobicContact CD1-CE2 4.44Å; Y2454-Y2458 HydrophobicContact CG-CD1 4.25Å; Y2454-Y2458 HydrophobicContact CG-CD2 4.33Å; P2455-Y2458 HydrophobicContact CB-CD1 4.26Å; P2455-Y2458 HydrophobicContact CB-CD2 4.04Å; P2455-Y2458 HydrophobicContact CB-CE1 4.41Å; P2455-Y2458 HydrophobicContact CB-CE2 4.31Å; P2455-Y2458 HydrophobicContact CG-CD2 4.29Å; P2455-Y2458 HydrophobicContact CG-CE1 4.38Å; P2455-Y2458 HydrophobicContact CG-CE2 4.27Å; P2455-Y2458 WeakPolarHBondContact O-CB 3.32Å; P2455-Y2458 PolarHBondContact O-N 3.05Å; L2456-Y2458 PolarHBondContact O-N 2.97Å; L2456-Y2458 VanDerWaalsContact O-N 3.16Å; Y2458-K2582 PolarHBondContact OH-NZ 3.25Å; Y2458-K2840 VanDerWaalsContact CD1-O 3.24Å; Y2458-K2840 WeakPolarHBondContact CD1-O 3.44Å; Y2458-K2840 HydrophobicContact CE1-CG 3.85Å; Y2458-K2840 VanDerWaalsContact CE1-O 3.23Å; Y2458-K2840 WeakPolarHBondContact CE1-O 3.38Å; Y2458-K2900 VanDerWaalsContact O-CB 3.31Å; Y2458-K2900 WeakPolarHBondContact O-CB 3.41Å; Y2458-K2900 WeakPolarHBondContact O-CG 3.41Å; Y2458-K2900 PolarHBondContact O-N 3.48Å; Y2458-W2905 HydrophobicContact CD1-CB 4.21Å; Y2458-W2905 HydrophobicContact CD2-CB 3.96Å; Y2458-W2905 AromaticContact CD2-CD2 3.51Å; Y2458-W2905 HydrophobicContact CD2-CD2 3.51Å; Y2458-W2905 VanDerWaalsContact CD2-CD2 3.49Å; Y2458-W2905 AromaticContact CD2-CE3 3.53Å; Y2458-W2905 HydrophobicContact CD2-CE3 3.53Å; Y2458-W2905 VanDerWaalsContact CD2-CE3 3.5Å; Y2458-W2905 AromaticContact CD2-CG 3.74Å; Y2458-W2905 HydrophobicContact CD2-CG 3.74Å; Y2458-W2905 HydrophobicContact CD2-CZ3 4.19Å; Y2458-W2905 HydrophobicContact CE1-CB 4.15Å; Y2458-W2905 HydrophobicContact CE2-CB 3.89Å; Y2458-W2905 AromaticContact CE2-CD2 3.74Å; Y2458-W2905 HydrophobicContact CE2-CD2 3.74Å; Y2458-W2905 AromaticContact CE2-CE3 3.34Å; Y2458-W2905 HydrophobicContact CE2-CE3 3.34Å; Y2458-W2905 VanDerWaalsContact CE2-CE3 3.41Å; Y2458-W2905 AromaticContact CE2-CG 3.9Å; Y2458-W2905 HydrophobicContact CE2-CG 4.02Å; Y2458-W2905 HydrophobicContact CE2-CZ3 4.08Å; Y2458-W2905 HydrophobicContact CG-CB 4.14Å; Y2458-W2905 HydrophobicContact CG-CD2 4.31Å; Y2458-W2905 HydrophobicContact CG-CG 4.11Å
2459	Y	96	Very high	94.6	Very high	14 Å²	14	41.7 Å²	41.7	6%	0.055	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	142.6	-177.3	-56.6	-90.7	0	0	0	112.4	D2451 M2452 D2453 Y2454 P2455 L2456 S2457 P2586 Q2869 Y2897 M2898 L2899	D2451-Y2459 VanDerWaalsContact O-CE1 3.27Å; D2451-Y2459 WeakPolarHBondContact O-CE1 3.32Å; D2451-Y2459 VanDerWaalsContact O-CZ 3.29Å; D2451-Y2459 PolarHBondContact O-OH 3.04Å; D2451-Y2459 VanDerWaalsContact O-OH 3.14Å; M2452-Y2459 VanDerWaalsContact CA-OH 3.24Å; M2452-Y2459 WeakPolarHBondContact CA-OH 3.38Å; M2452-Y2459 HydrophobicContact CE-CD1 4.13Å; M2452-Y2459 HydrophobicContact CE-CE1 3.64Å; M2452-Y2459 PolarHBondContact O-OH 3.03Å; M2452-Y2459 HydrophobicContact SD-CD1 4.26Å; M2452-Y2459 HydrophobicContact SD-CE1 4Å; D2453-Y2459 PolarHBondContact N-OH 3.11Å; Y2454-Y2459 WeakPolarHBondContact CA-OH 3.47Å; Y2454-Y2459 WeakPolarHBondContact CB-OH 3.4Å; Y2454-Y2459 PolarHBondContact N-OH 2.91Å; Y2454-Y2459 WeakPolarHBondContact O-CE2 3.3Å; Y2454-Y2459 PolarHBondContact O-OH 3.07Å; P2455-Y2459 WeakPolarHBondContact O-CD2 3.4Å; P2455-Y2459 VanDerWaalsContact O-CE2 3.28Å; P2455-Y2459 WeakPolarHBondContact O-CE2 3.29Å; L2456-Y2459 PolarHBondContact O-N 3.18Å; S2457-Y2459 VanDerWaalsContact C-N 3.27Å; S2457-Y2459 PolarHBondContact O-N 3.08Å; Y2459-P2586 HydrophobicContact CD1-CG 4.37Å; Y2459-P2586 HydrophobicContact CD2-CG 3.69Å; Y2459-P2586 HydrophobicContact CE1-CG 4.27Å; Y2459-P2586 VanDerWaalsContact CE2-CD 3.43Å; Y2459-P2586 HydrophobicContact CE2-CG 3.47Å; Y2459-P2586 VanDerWaalsContact CE2-CG 3.46Å; Y2459-P2586 HydrophobicContact CG-CG 4.18Å; Y2459-Q2869 WeakPolarHBondContact O-CB 3.32Å; Y2459-Q2869 WeakPolarHBondContact O-CG 3.34Å; Y2459-Y2897 HydrophobicContact CG-CD1 4.28Å; Y2459-M2898 CarbonylContact C-O 3.47Å; Y2459-M2898 WeakPolarHBondContact CA-O 3.36Å; Y2459-M2898 WeakPolarHBondContact CB-O 3.38Å; Y2459-L2899 HydrophobicContact CD1-CB 4.16Å; Y2459-L2899 HydrophobicContact CD1-CD1 4.19Å; Y2459-L2899 HydrophobicContact CE1-CB 4.04Å; Y2459-L2899 HydrophobicContact CE1-CD1 3.7Å; Y2459-L2899 HydrophobicContact CE1-CG 4.42Å
2460	F	95.7	Very high	94.8	Very high	53.75 Å²	53.75	36.5 Å²	36.5	24%	0.236	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	138.4	155.1	-57.3	-65.9	0	0	0	109.4	W2864 I2868 M2888 F2889 Y2897 M2898 K2900 M2904 L2992	F2460-W2864 HydrophobicContact CD1-CB 4.09Å; F2460-W2864 AromaticContact CD1-CD1 3.33Å; F2460-W2864 AromaticContact CD1-CG 3.83Å; F2460-W2864 HydrophobicContact CD1-CG 3.83Å; F2460-W2864 HydrophobicContact CE1-CB 3.58Å; F2460-W2864 AromaticContact CE1-CD1 3.7Å; F2460-W2864 AromaticContact CE1-CG 3.86Å; F2460-W2864 HydrophobicContact CE1-CG 3.86Å; F2460-W2864 VanDerWaalsContact CE1-O 3.3Å; F2460-W2864 WeakPolarHBondContact CE1-O 3.36Å; F2460-W2864 HydrophobicContact CE2-CB 4.45Å; F2460-W2864 AromaticContact CG-CD1 3.98Å; F2460-W2864 HydrophobicContact CG-CG 4.33Å; F2460-W2864 HydrophobicContact CZ-CB 3.78Å; F2460-W2864 HydrophobicContact CZ-CG 4.33Å; F2460-W2864 WeakPolarHBondContact CZ-O 3.34Å; F2460-I2868 WeakPolarHBondContact CD1-O 3.4Å; F2460-M2888 HydrophobicContact CB-CE 4.22Å; F2460-M2888 HydrophobicContact CD2-CE 3.16Å; F2460-M2888 HydrophobicContact CE2-CE 3.68Å; F2460-M2888 HydrophobicContact CG-CE 3.94Å; F2460-F2889 HydrophobicContact CB-CE1 4.34Å; F2460-F2889 HydrophobicContact CB-CZ 4.18Å; F2460-Y2897 WeakPolarHBondContact O-CA 3.48Å; F2460-M2898 HydrophobicContact CB-CB 4.33Å; F2460-M2898 HydrophobicContact CD2-CB 4.46Å; F2460-M2898 PolarHBondContact N-O 3.42Å; F2460-M2898 PolarHBondContact O-N 2.99Å; F2460-K2900 HydrophobicContact CD1-CD 4.23Å; F2460-K2900 HydrophobicContact CD1-CG 4.12Å; F2460-K2900 HydrophobicContact CD2-CG 3.96Å; F2460-K2900 HydrophobicContact CE1-CD 3.72Å; F2460-K2900 HydrophobicContact CE1-CG 3.82Å; F2460-K2900 HydrophobicContact CE2-CB 4.26Å; F2460-K2900 HydrophobicContact CE2-CD 4.48Å; F2460-K2900 HydrophobicContact CE2-CG 3.73Å; F2460-K2900 HydrophobicContact CG-CG 4.2Å; F2460-K2900 HydrophobicContact CZ-CB 4.34Å; F2460-K2900 HydrophobicContact CZ-CD 3.89Å; F2460-K2900 HydrophobicContact CZ-CG 3.64Å; F2460-M2904 HydrophobicContact CZ-SD 4.26Å; F2460-L2992 HydrophobicContact CE2-CD1 4.36Å; F2460-L2992 HydrophobicContact CE2-CD2 4.03Å; F2460-L2992 HydrophobicContact CZ-CD1 4.07Å; F2460-L2992 HydrophobicContact CZ-CD2 4.49Å
2461	I	96.4	Very high	94.9	Very high	16 Å²	16	30 Å²	30	8%	0.082	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	120.3	-173.3	-52.5	178.7	0	0	0	108.5	L2456 S2463 R2492 C2493 I2540 I2843 Q2869 M2870 Y2897	L2456-I2461 HydrophobicContact CD1-CD1 4.03Å; L2456-I2461 HydrophobicContact CG-CD1 4.43Å; I2461-S2463 PolarHBondContact O-N 2.86Å; I2461-S2463 VanDerWaalsContact O-N 3.11Å; I2461-S2463 PolarHBondContact O-OG 3.15Å; I2461-R2492 HydrophobicContact CG2-CB 3.97Å; I2461-C2493 HydrophobicContact CG2-CB 4.22Å; I2461-I2540 HydrophobicContact CD1-CD1 3.97Å; I2461-I2843 HydrophobicContact CD1-CD1 4.37Å; I2461-Q2869 HydrophobicContact CD1-CB 4.4Å; I2461-Q2869 HydrophobicContact CG1-CB 4.34Å; I2461-Q2869 PolarHBondContact N-O 2.93Å; I2461-M2870 HydrophobicContact CB-CG 4.13Å; I2461-M2870 HydrophobicContact CD1-CG 4.12Å; I2461-Y2897 HydrophobicContact CB-CE1 4.32Å; I2461-Y2897 HydrophobicContact CD1-CD1 4.49Å; I2461-Y2897 HydrophobicContact CD1-CE1 3.83Å; I2461-Y2897 HydrophobicContact CG1-CD1 3.92Å; I2461-Y2897 HydrophobicContact CG1-CE1 3.67Å; I2461-Y2897 HydrophobicContact CG2-CD1 4.49Å; I2461-Y2897 HydrophobicContact CG2-CE1 3.89Å
2462	A	96.2	Very high	94.8	Very high	17 Å²	17	30.7 Å²	30.7	14%	0.14	16%	0.162	C	C	.	.			trans	-59.6	115.2	176.5	0	0	0	0	0	109.7	C2491 R2492 C2493 F2889 G2896	A2462-C2491 PolarHBondContact O-SG 3.37Å; A2462-C2491 VanDerWaalsContact O-SG 3.35Å; A2462-R2492 PolarHBondContact O-N 2.98Å; A2462-C2493 PolarHBondContact O-N 3.3Å; A2462-C2493 VanDerWaalsContact O-N 3.15Å; A2462-F2889 VanDerWaalsContact CA-CZ 3.5Å; A2462-F2889 HydrophobicContact CB-CD1 3.94Å; A2462-F2889 HydrophobicContact CB-CD2 3.73Å; A2462-F2889 HydrophobicContact CB-CE1 3.97Å; A2462-F2889 HydrophobicContact CB-CE2 3.77Å; A2462-F2889 HydrophobicContact CB-CG 3.84Å; A2462-F2889 HydrophobicContact CB-CZ 3.91Å; A2462-F2889 VanDerWaalsContact N-CZ 3.27Å; A2462-G2896 PolarHBondContact N-O 3.02Å
2463	S	97.3	Very high	94.7	Very high	22.25 Å²	22.25	31.8 Å²	31.8	16%	0.156	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	135.9	-169	-42.8	0	0	0	0	111.9	I2461 C2491 C2493 A2872 L2873 Y2875	I2461-S2463 PolarHBondContact O-N 2.86Å; I2461-S2463 VanDerWaalsContact O-N 3.11Å; I2461-S2463 PolarHBondContact O-OG 3.15Å; S2463-C2491 VanDerWaalsContact C-SG 3.6Å; S2463-C2493 CarbonylContact C-O 3.53Å; S2463-C2493 VanDerWaalsContact CA-O 3.27Å; S2463-C2493 WeakPolarHBondContact CA-O 3.48Å; S2463-C2493 WeakPolarHBondContact OG-CB 3.17Å; S2463-A2872 WeakPolarHBondContact O-CA 3.3Å; S2463-L2873 PolarHBondContact O-N 2.95Å; S2463-L2873 VanDerWaalsContact O-N 3.09Å; S2463-Y2875 WeakPolarHBondContact O-CE2 3.48Å
2464	S	97.1	Very high	94.4	Very high	6 Å²	6	30.9 Å²	30.9	4%	0.042	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	142	172.5	168.8	0	0	0	0	110.6	T2467 C2491 C2493 R2845 L2873	S2464-T2467 VanDerWaalsContact CB-OG1 3.31Å; S2464-T2467 WeakPolarHBondContact CB-OG1 3.31Å; S2464-T2467 PolarHBondContact O-OG1 3.43Å; S2464-T2467 WeakPolarHBondContact OG-CA 3.36Å; S2464-T2467 WeakPolarHBondContact OG-CB 3.36Å; S2464-T2467 PolarHBondContact OG-OG1 2.97Å; S2464-C2491 PolarHBondContact N-SG 3.31Å; S2464-C2491 VanDerWaalsContact N-SG 3.43Å; S2464-C2493 PolarHBondContact N-O 3.03Å; S2464-R2845 PolarHBondContact O-NH2 3.05Å; S2464-L2873 CarbonylContact C-O 3.53Å; S2464-L2873 WeakPolarHBondContact CA-O 3.42Å
2465	H	96.4	Very high	94.1	Very high	45.75 Å²	45.75	32.6 Å²	32.6	21%	0.212	17%	0.171	C	C	.	.	S	Bend	trans	-101.3	143.2	165.9	178.1	-24.4	0	0	0	109.4	T2467 E2495 P2848 A2872 L2873 N2874	H2465-T2467 VanDerWaalsContact C-N 3.26Å; H2465-T2467 PolarHBondContact O-N 3.37Å; H2465-T2467 VanDerWaalsContact O-N 3.12Å; H2465-E2495 VanDerWaalsContact CA-OE2 3.26Å; H2465-E2495 WeakPolarHBondContact CA-OE2 3.4Å; H2465-E2495 IonicContact CD2-OE2 2.83Å; H2465-E2495 PolarHBondContact CD2-OE2 3.09Å; H2465-E2495 VanDerWaalsContact CD2-OE2 3.27Å; H2465-E2495 IonicContact CE1-OE2 3.28Å; H2465-E2495 IonicContact CG-OE2 3.04Å; H2465-E2495 IonicContact ND1-OE2 3.14Å; H2465-E2495 PolarHBondContact ND1-OE2 3Å; H2465-P2848 HydrophobicContact CB-CG 4.33Å; H2465-P2848 VanDerWaalsContact CD2-CD 3.44Å; H2465-P2848 WeakPolarHBondContact CD2-CD 3.41Å; H2465-A2872 HydrophobicContact CB-CB 4.08Å; H2465-L2873 PolarHBondContact N-O 3.21Å; H2465-N2874 PolarHBondContact CD2-OD1 3.21Å
2466	N	96.3	Very high	93.7	Very high	5.25 Å²	5.25	32.6 Å²	32.6	3%	0.028	18%	0.176	C	C	.	.	S	Bend	trans	41.6	51.7	179.5	-71	-11.5	0	0	0	113.2	Y2468 L2469 Q2473 E2495	N2466-Y2468 HydrophobicContact CB-CE1 4.19Å; N2466-Y2468 PolarHBondContact O-N 3.17Å; N2466-Y2468 PolarHBondContact OD1-OH 3.2Å; N2466-L2469 HydrophobicContact CB-CD1 3.84Å; N2466-L2469 HydrophobicContact CB-CG 4.19Å; N2466-L2469 PolarHBondContact O-N 3.15Å; N2466-Q2473 PolarHBondContact ND2-OE1 3.02Å; N2466-E2495 PolarHBondContact N-OE2 3.26Å
2467	T	97.1	Very high	93.5	Very high	0.25 Å²	0.25	38.8 Å²	38.8	0%	0.002	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55	-19.4	-169.5	-51.6	0	0	0	0	114.5	S2464 H2465 L2482 Y2483 I2486 I2494 E2495	S2464-T2467 VanDerWaalsContact CB-OG1 3.31Å; S2464-T2467 WeakPolarHBondContact CB-OG1 3.31Å; S2464-T2467 PolarHBondContact O-OG1 3.43Å; S2464-T2467 WeakPolarHBondContact OG-CA 3.36Å; S2464-T2467 WeakPolarHBondContact OG-CB 3.36Å; S2464-T2467 PolarHBondContact OG-OG1 2.97Å; H2465-T2467 VanDerWaalsContact C-N 3.26Å; H2465-T2467 PolarHBondContact O-N 3.37Å; H2465-T2467 VanDerWaalsContact O-N 3.12Å; T2467-L2482 WeakPolarHBondContact O-CB 3.47Å; T2467-L2482 WeakPolarHBondContact O-CD2 3.37Å; T2467-L2482 WeakPolarHBondContact O-CG 3.42Å; T2467-Y2483 HydrophobicContact CG2-CD1 3.44Å; T2467-Y2483 VanDerWaalsContact CG2-CD1 3.44Å; T2467-Y2483 HydrophobicContact CG2-CE1 3.62Å; T2467-Y2483 HydrophobicContact CG2-CG 4.14Å; T2467-I2486 HydrophobicContact CG2-CB 4.23Å; T2467-I2486 HydrophobicContact CG2-CD1 3.6Å; T2467-I2486 HydrophobicContact CG2-CG1 4.33Å; T2467-I2486 HydrophobicContact CG2-CG2 4.16Å; T2467-I2494 HydrophobicContact CG2-CB 4.06Å; T2467-I2494 HydrophobicContact CG2-CG2 3.95Å; T2467-E2495 PolarHBondContact OG1-N 3.16Å
2468	Y	96.4	Very high	93.4	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80	-21	178	52	-86.6	0	0	0	113.8	N2466 S2478 S2479 D2497 I2508 H2510	N2466-Y2468 HydrophobicContact CB-CE1 4.19Å; N2466-Y2468 PolarHBondContact O-N 3.17Å; N2466-Y2468 PolarHBondContact OD1-OH 3.2Å; Y2468-S2478 WeakPolarHBondContact CD2-OG 3.35Å; Y2468-S2478 CarbonylContact O-C 3.54Å; Y2468-S2478 VanDerWaalsContact O-CA 3.25Å; Y2468-S2478 WeakPolarHBondContact O-CA 3.26Å; Y2468-S2479 PolarHBondContact O-N 3.11Å; Y2468-D2497 HydrophobicContact CD1-CB 4.46Å; Y2468-D2497 HydrophobicContact CE1-CB 3.53Å; Y2468-D2497 VanDerWaalsContact CE1-CB 3.46Å; Y2468-D2497 VanDerWaalsContact OH-CB 3.3Å; Y2468-D2497 WeakPolarHBondContact OH-CB 3.35Å; Y2468-D2497 PolarHBondContact OH-OD2 3.17Å; Y2468-I2508 HydrophobicContact CD1-CG2 3.6Å; Y2468-I2508 HydrophobicContact CD2-CG2 4.33Å; Y2468-I2508 HydrophobicContact CE1-CG2 4.14Å; Y2468-I2508 HydrophobicContact CG-CG2 3.73Å; Y2468-H2510 HydrophobicContact CE2-CB 4Å; Y2468-H2510 VanDerWaalsContact CE2-N 3.31Å; Y2468-H2510 WeakPolarHBondContact OH-CA 3.33Å; Y2468-H2510 VanDerWaalsContact OH-CB 3.29Å; Y2468-H2510 WeakPolarHBondContact OH-CB 3.12Å; Y2468-H2510 PolarHBondContact OH-N 3.19Å
2469	L	95.2	Very high	93.3	Very high	4.5 Å²	4.5	36.8 Å²	36.8	2%	0.024	20%	0.198	C	C	.	.	B	Isolated β-bridge	trans	-82.8	123.7	-172.2	-67.3	-179	0	0	0	113.9	N2466 G2471 Q2473 L2482 H2510 T2515	N2466-L2469 HydrophobicContact CB-CD1 3.84Å; N2466-L2469 HydrophobicContact CB-CG 4.19Å; N2466-L2469 PolarHBondContact O-N 3.15Å; L2469-G2471 VanDerWaalsContact C-N 3.3Å; L2469-G2471 PolarHBondContact O-N 3.05Å; L2469-Q2473 VanDerWaalsContact CD1-OE1 3.26Å; L2469-L2482 VanDerWaalsContact C-CD2 3.48Å; L2469-L2482 WeakPolarHBondContact O-CD2 3.31Å; L2469-H2510 HydrophobicContact CD1-CB 4.4Å; L2469-H2510 HydrophobicContact CD2-CB 4.49Å; L2469-T2515 HydrophobicContact CD1-CG2 4.41Å; L2469-T2515 HydrophobicContact CD2-CG2 3.63Å
2470	T	90.2	Very high	93.2	Very high	43.75 Å²	43.75	37.5 Å²	37.5	27%	0.268	20%	0.204	S	C	.	.	S	Bend	trans	-77.3	-9.1	174.9	59.4	0	0	0	0	114.3	T2049 E2477 L2482	T2049-T2470 VanDerWaalsContact CG2-O 3.27Å; T2049-T2470 WeakPolarHBondContact CG2-O 3.44Å; T2470-E2477 WeakPolarHBondContact CB-O 3.42Å; T2470-E2477 HydrophobicContact CG2-CB 4.45Å; T2470-E2477 VanDerWaalsContact CG2-O 3.3Å; T2470-E2477 WeakPolarHBondContact CG2-O 3.38Å; T2470-E2477 PolarHBondContact N-O 3Å; T2470-E2477 VanDerWaalsContact N-O 3.08Å; T2470-E2477 PolarHBondContact OG1-O 2.97Å; T2470-L2482 HydrophobicContact CG2-CD2 4.27Å
2471	G	88.1	Confident	93	Very high	30 Å²	30	36.5 Å²	36.5	31%	0.309	20%	0.2	S	C	.	.	S	Bend	trans	-167.7	-129.4	-174	0	0	0	0	0	113.5	L2469 S2855 Q2876	L2469-G2471 VanDerWaalsContact C-N 3.3Å; L2469-G2471 PolarHBondContact O-N 3.05Å; G2471-S2855 WeakPolarHBondContact O-CB 3.27Å; G2471-S2855 PolarHBondContact O-OG 3.24Å; G2471-Q2876 PolarHBondContact O-NE2 3.14Å
2472	H	87.4	Confident	92.9	Very high	78 Å²	78	36 Å²	36	36%	0.361	20%	0.197	S	C	.	.			trans	-59.2	139.9	-173.8	-170	-77.4	0	0	0	113	L2474 K2475 G2476 I2853	H2472-L2474 VanDerWaalsContact C-N 3.3Å; H2472-L2474 PolarHBondContact ND1-N 3.16Å; H2472-L2474 VanDerWaalsContact ND1-N 3.15Å; H2472-L2474 PolarHBondContact O-N 3.23Å; H2472-L2474 VanDerWaalsContact O-N 3.14Å; H2472-K2475 HydrophobicContact CB-CG 4.15Å; H2472-K2475 PolarHBondContact O-N 2.93Å; H2472-G2476 VanDerWaalsContact O-CA 3.24Å; H2472-G2476 WeakPolarHBondContact O-CA 3.28Å; H2472-G2476 PolarHBondContact O-N 3.25Å; H2472-I2853 PolarHBondContact CD2-O 3.4Å; H2472-I2853 PolarHBondContact CE1-O 2.94Å; H2472-I2853 PolarHBondContact ND1-O 2.98Å; H2472-I2853 VanDerWaalsContact ND1-O 3.16Å
2473	Q	90.2	Very high	93	Very high	29.5 Å²	29.5	35.2 Å²	35.2	14%	0.138	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-37.4	-173.6	-62.7	-65	-42.9	0	0	113.5	N2466 L2469 H2510 T2515 R2852 I2853 S2855 N2874	N2466-Q2473 PolarHBondContact ND2-OE1 3.02Å; L2469-Q2473 VanDerWaalsContact CD1-OE1 3.26Å; Q2473-H2510 PolarHBondContact O-CD2 3.25Å; Q2473-H2510 VanDerWaalsContact O-CD2 3.27Å; Q2473-H2510 PolarHBondContact O-ND1 2.96Å; Q2473-H2510 PolarHBondContact OE1-CE1 3.39Å; Q2473-H2510 PolarHBondContact OE1-ND1 2.86Å; Q2473-T2515 VanDerWaalsContact O-CG2 3.25Å; Q2473-T2515 WeakPolarHBondContact O-CG2 3.43Å; Q2473-R2852 WeakPolarHBondContact CG-O 3.44Å; Q2473-I2853 PolarHBondContact N-O 3.31Å; Q2473-S2855 WeakPolarHBondContact CG-OG 3.22Å; Q2473-S2855 PolarHBondContact N-OG 3.2Å; Q2473-S2855 PolarHBondContact NE2-OG 3.29Å; Q2473-N2874 PolarHBondContact NE2-OD1 2.72Å; Q2473-N2874 VanDerWaalsContact NE2-OD1 3.11Å
2474	L	88.7	Confident	92.8	Very high	80.75 Å²	80.75	35.2 Å²	35.2	42%	0.423	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-14.6	-174.2	-54.8	179.7	0	0	0	115.9	H2472 T2513 L2514 I2853	H2472-L2474 VanDerWaalsContact C-N 3.3Å; H2472-L2474 PolarHBondContact ND1-N 3.16Å; H2472-L2474 VanDerWaalsContact ND1-N 3.15Å; H2472-L2474 PolarHBondContact O-N 3.23Å; H2472-L2474 VanDerWaalsContact O-N 3.14Å; L2474-T2513 HydrophobicContact CB-CG2 4.47Å; L2474-T2513 HydrophobicContact CD2-CG2 3.96Å; L2474-T2513 WeakPolarHBondContact O-CB 3.35Å; L2474-L2514 WeakPolarHBondContact O-CB 3.31Å; L2474-L2514 PolarHBondContact O-N 3.2Å; L2474-I2853 HydrophobicContact CD1-CB 4.24Å; L2474-I2853 HydrophobicContact CD1-CG2 3.86Å; L2474-I2853 HydrophobicContact CG-CB 4.31Å; L2474-I2853 HydrophobicContact CG-CG2 4.13Å
2475	K	88	Confident	92.6	Very high	135.25 Å²	135.25	36.3 Å²	36.3	59%	0.588	19%	0.192	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-152.5	76.7	-171.8	6.3	-169.9	178.4	-175.5	0	112.9	H2472 L2514	H2472-K2475 HydrophobicContact CB-CG 4.15Å; H2472-K2475 PolarHBondContact O-N 2.93Å; K2475-L2514 WeakPolarHBondContact CA-O 3.46Å; K2475-L2514 HydrophobicContact CB-CB 4.2Å; K2475-L2514 HydrophobicContact CD-CD1 4.28Å; K2475-L2514 HydrophobicContact CG-CB 4.22Å; K2475-L2514 HydrophobicContact CG-CD1 4.17Å
2476	G	86.9	Confident	92.6	Very high	22.75 Å²	22.75	34.6 Å²	34.6	24%	0.235	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.5	171.4	178.3	0	0	0	0	0	112	H2472 L2514 T2515 T2516	H2472-G2476 VanDerWaalsContact O-CA 3.24Å; H2472-G2476 WeakPolarHBondContact O-CA 3.28Å; H2472-G2476 PolarHBondContact O-N 3.25Å; G2476-L2514 PolarHBondContact N-O 3.09Å; G2476-T2515 VanDerWaalsContact O-CA 3.32Å; G2476-T2515 WeakPolarHBondContact O-CA 3.4Å; G2476-T2515 WeakPolarHBondContact O-CB 3.47Å; G2476-T2515 WeakPolarHBondContact O-CG2 3.46Å; G2476-T2516 PolarHBondContact O-N 3.09Å; G2476-T2516 VanDerWaalsContact O-N 3.11Å
2477	E	91.7	Very high	92.6	Very high	134 Å²	134	34.3 Å²	34.3	63%	0.626	18%	0.183	S	C	*	.			trans	-81.7	131.7	-179.5	-83.7	-178	173.1	0	0	110.8	T2470 T2516	T2470-E2477 WeakPolarHBondContact CB-O 3.42Å; T2470-E2477 HydrophobicContact CG2-CB 4.45Å; T2470-E2477 VanDerWaalsContact CG2-O 3.3Å; T2470-E2477 WeakPolarHBondContact CG2-O 3.38Å; T2470-E2477 PolarHBondContact N-O 3Å; T2470-E2477 VanDerWaalsContact N-O 3.08Å; T2470-E2477 PolarHBondContact OG1-O 2.97Å; E2477-T2516 HydrophobicContact CG-CG2 4.47Å
2478	S	94.1	Very high	92.3	Very high	8 Å²	8	37.1 Å²	37.1	6%	0.056	20%	0.196	C	C	.	.	B	Isolated β-bridge	trans	-83.7	137.1	165	-57.1	0	0	0	0	109.6	Y2468 T2516 I2518	Y2468-S2478 WeakPolarHBondContact CD2-OG 3.35Å; Y2468-S2478 CarbonylContact O-C 3.54Å; Y2468-S2478 VanDerWaalsContact O-CA 3.25Å; Y2468-S2478 WeakPolarHBondContact O-CA 3.26Å; S2478-T2516 WeakPolarHBondContact CB-O 3.36Å; S2478-T2516 PolarHBondContact N-OG1 3.05Å; S2478-T2516 PolarHBondContact OG-O 3.14Å; S2478-I2518 VanDerWaalsContact O-CG2 3.28Å; S2478-I2518 WeakPolarHBondContact O-CG2 3.38Å
2479	S	93.7	Very high	92	Very high	25.75 Å²	25.75	40.3 Å²	40.3	18%	0.18	22%	0.216	C	C	.	.			trans	-132.5	128.6	-177	-179.2	0	0	0	0	112.5	Y2468 E2481 L2482	Y2468-S2479 PolarHBondContact O-N 3.11Å; S2479-E2481 VanDerWaalsContact C-N 3.28Å; S2479-E2481 PolarHBondContact O-N 3.07Å; S2479-E2481 PolarHBondContact OG-N 3.06Å; S2479-L2482 PolarHBondContact O-N 3.31Å; S2479-L2482 PolarHBondContact OG-N 3.29Å
2480	V	93.9	Very high	92	Very high	28.25 Å²	28.25	40.5 Å²	40.5	17%	0.171	22%	0.219	C	C	.	.	H	α-helix	trans	-61.7	-38.4	171.6	178	0	0	0	0	110.8	L2482 Y2483 I2518 Q2522 V2523 I2526	V2480-L2482 VanDerWaalsContact C-N 3.29Å; V2480-L2482 PolarHBondContact O-N 3.26Å; V2480-Y2483 WeakPolarHBondContact O-CB 3.47Å; V2480-Y2483 PolarHBondContact O-N 3.27Å; V2480-I2518 HydrophobicContact CG2-CB 3.91Å; V2480-I2518 HydrophobicContact CG2-CD1 4.15Å; V2480-I2518 HydrophobicContact CG2-CG1 4.48Å; V2480-I2518 HydrophobicContact CG2-CG2 4.18Å; V2480-Q2522 HydrophobicContact CG1-CB 4.29Å; V2480-Q2522 HydrophobicContact CG2-CB 4.32Å; V2480-V2523 HydrophobicContact CB-CG2 4.4Å; V2480-V2523 HydrophobicContact CG1-CG2 4.21Å; V2480-V2523 HydrophobicContact CG2-CG2 3.96Å; V2480-I2526 HydrophobicContact CG1-CB 4.06Å; V2480-I2526 HydrophobicContact CG1-CD1 4.03Å; V2480-I2526 HydrophobicContact CG1-CG2 3.67Å
2481	E	92.3	Very high	92.3	Very high	33.5 Å²	33.5	38.6 Å²	38.6	16%	0.157	21%	0.207	C	C	.	.	H	α-helix	trans	-68.2	-25.1	-176.1	178	55.1	-159.1	0	0	112.6	V2043 N2051 S2479 Y2483 R2484 Q2485 I2526	V2043-E2481 HydrophobicContact CG1-CG 4.07Å; N2051-E2481 HydrophobicContact CB-CB 4.22Å; N2051-E2481 HydrophobicContact CB-CG 3.71Å; N2051-E2481 WeakPolarHBondContact OD1-CG 3.43Å; S2479-E2481 VanDerWaalsContact C-N 3.28Å; S2479-E2481 PolarHBondContact O-N 3.07Å; S2479-E2481 PolarHBondContact OG-N 3.06Å; E2481-Y2483 VanDerWaalsContact C-N 3.28Å; E2481-Y2483 PolarHBondContact O-N 3.17Å; E2481-R2484 VanDerWaalsContact CD-NE 3.29Å; E2481-R2484 VanDerWaalsContact O-CB 3.31Å; E2481-R2484 WeakPolarHBondContact O-CB 3.34Å; E2481-R2484 PolarHBondContact O-N 3.2Å; E2481-R2484 VanDerWaalsContact O-N 3.1Å; E2481-R2484 VanDerWaalsContact OE1-CD 3.27Å; E2481-R2484 WeakPolarHBondContact OE1-CD 3.44Å; E2481-R2484 IonicContact OE1-CZ 3.03Å; E2481-R2484 VanDerWaalsContact OE1-CZ 3.27Å; E2481-R2484 IonicContact OE1-NE 2.86Å; E2481-R2484 PolarHBondContact OE1-NE 3.04Å; E2481-R2484 IonicContact OE1-NH2 3.49Å; E2481-R2484 PolarHBondContact OE1-NH2 3.38Å; E2481-R2484 WeakPolarHBondContact OE2-CD 3.4Å; E2481-R2484 IonicContact OE2-CZ 2.78Å; E2481-R2484 IonicContact OE2-NE 2.87Å; E2481-R2484 PolarHBondContact OE2-NE 2.99Å; E2481-R2484 IonicContact OE2-NH2 3.35Å; E2481-Q2485 HydrophobicContact CG-CG 4.4Å; E2481-Q2485 WeakPolarHBondContact O-CG 3.35Å; E2481-Q2485 PolarHBondContact O-N 3.29Å; E2481-Q2485 VanDerWaalsContact O-N 3.13Å; E2481-Q2485 PolarHBondContact OE1-NE2 2.96Å; E2481-I2526 WeakPolarHBondContact OE2-CD1 3.28Å
2482	L	93.9	Very high	92.7	Very high	5.75 Å²	5.75	37.4 Å²	37.4	3%	0.03	19%	0.194	C	C	.	.	H	α-helix	trans	-64.2	-32.6	179.1	-169.4	59.1	0	0	0	112.3	L2048 T2049 T2467 L2469 T2470 S2479 V2480 R2484 Q2485 I2486	L2048-L2482 HydrophobicContact CD2-CD1 4.24Å; L2048-L2482 HydrophobicContact CG-CD1 4.11Å; T2049-L2482 HydrophobicContact CG2-CD1 4.28Å; T2467-L2482 WeakPolarHBondContact O-CB 3.47Å; T2467-L2482 WeakPolarHBondContact O-CD2 3.37Å; T2467-L2482 WeakPolarHBondContact O-CG 3.42Å; L2469-L2482 VanDerWaalsContact C-CD2 3.48Å; L2469-L2482 WeakPolarHBondContact O-CD2 3.31Å; T2470-L2482 HydrophobicContact CG2-CD2 4.27Å; S2479-L2482 PolarHBondContact O-N 3.31Å; S2479-L2482 PolarHBondContact OG-N 3.29Å; V2480-L2482 VanDerWaalsContact C-N 3.29Å; V2480-L2482 PolarHBondContact O-N 3.26Å; L2482-R2484 VanDerWaalsContact C-N 3.32Å; L2482-R2484 PolarHBondContact O-N 3.07Å; L2482-Q2485 HydrophobicContact CD1-CB 4.4Å; L2482-Q2485 PolarHBondContact O-N 3.32Å; L2482-I2486 HydrophobicContact CD1-CD1 4.1Å; L2482-I2486 HydrophobicContact CD1-CG1 4.26Å; L2482-I2486 HydrophobicContact CD2-CD1 4.42Å; L2482-I2486 HydrophobicContact CG-CD1 3.78Å; L2482-I2486 HydrophobicContact CG-CG1 4.33Å; L2482-I2486 WeakPolarHBondContact O-CB 3.36Å; L2482-I2486 VanDerWaalsContact O-CG1 3.23Å; L2482-I2486 WeakPolarHBondContact O-CG1 3.33Å; L2482-I2486 PolarHBondContact O-N 2.96Å
2483	Y	97.2	Very high	93.2	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-59	-44.5	171.2	-74	-81.5	0	0	0	112.4	T2467 V2480 E2481 L2487 I2494 E2495 F2496 I2518 V2523 V2527	T2467-Y2483 HydrophobicContact CG2-CD1 3.44Å; T2467-Y2483 VanDerWaalsContact CG2-CD1 3.44Å; T2467-Y2483 HydrophobicContact CG2-CE1 3.62Å; T2467-Y2483 HydrophobicContact CG2-CG 4.14Å; V2480-Y2483 WeakPolarHBondContact O-CB 3.47Å; V2480-Y2483 PolarHBondContact O-N 3.27Å; E2481-Y2483 VanDerWaalsContact C-N 3.28Å; E2481-Y2483 PolarHBondContact O-N 3.17Å; Y2483-L2487 WeakPolarHBondContact O-CB 3.33Å; Y2483-L2487 WeakPolarHBondContact O-CD1 3.41Å; Y2483-L2487 VanDerWaalsContact O-CG 3.27Å; Y2483-L2487 WeakPolarHBondContact O-CG 3.36Å; Y2483-L2487 PolarHBondContact O-N 3.05Å; Y2483-I2494 HydrophobicContact CD1-CB 4.3Å; Y2483-I2494 HydrophobicContact CD1-CD1 4.07Å; Y2483-I2494 HydrophobicContact CE1-CB 4.4Å; Y2483-I2494 HydrophobicContact CE1-CD1 4.45Å; Y2483-E2495 VanDerWaalsContact CE1-O 3.27Å; Y2483-E2495 WeakPolarHBondContact CE1-O 3.37Å; Y2483-E2495 PolarHBondContact OH-O 3.13Å; Y2483-E2495 VanDerWaalsContact OH-O 3.04Å; Y2483-F2496 HydrophobicContact CD1-CD1 4.42Å; Y2483-F2496 AromaticContact CD1-CE1 3.91Å; Y2483-F2496 HydrophobicContact CD1-CE1 3.91Å; Y2483-F2496 AromaticContact CD1-CE2 3.95Å; Y2483-F2496 HydrophobicContact CD1-CE2 3.95Å; Y2483-F2496 AromaticContact CE1-CD1 3.52Å; Y2483-F2496 HydrophobicContact CE1-CD1 3.52Å; Y2483-F2496 VanDerWaalsContact CE1-CD1 3.44Å; Y2483-F2496 AromaticContact CE1-CD2 3.6Å; Y2483-F2496 HydrophobicContact CE1-CD2 3.6Å; Y2483-F2496 AromaticContact CE1-CE1 3.43Å; Y2483-F2496 HydrophobicContact CE1-CE1 3.43Å; Y2483-F2496 AromaticContact CE1-CE2 3.38Å; Y2483-F2496 HydrophobicContact CE1-CE2 3.38Å; Y2483-F2496 HydrophobicContact CE1-CZ 4.34Å; Y2483-F2496 AromaticContact CZ-CD1 3.84Å; Y2483-F2496 AromaticContact CZ-CD2 3.96Å; Y2483-F2496 AromaticContact CZ-CE1 3.97Å; Y2483-F2496 AromaticContact CZ-CE2 3.96Å; Y2483-I2518 HydrophobicContact CE2-CD1 4.06Å; Y2483-V2523 HydrophobicContact CD1-CG1 4.2Å; Y2483-V2523 HydrophobicContact CD2-CB 4.43Å; Y2483-V2523 HydrophobicContact CD2-CG1 3.56Å; Y2483-V2523 VanDerWaalsContact CD2-CG1 3.46Å; Y2483-V2523 HydrophobicContact CD2-CG2 4.14Å; Y2483-V2523 HydrophobicContact CE1-CG1 4.1Å; Y2483-V2523 HydrophobicContact CE2-CB 4.34Å; Y2483-V2523 HydrophobicContact CE2-CG1 3.42Å; Y2483-V2523 VanDerWaalsContact CE2-CG1 3.47Å; Y2483-V2523 HydrophobicContact CE2-CG2 3.87Å; Y2483-V2523 HydrophobicContact CG-CG1 3.93Å; Y2483-V2527 HydrophobicContact CD1-CG2 4.35Å; Y2483-V2527 HydrophobicContact CG-CG2 4.39Å
2484	R	94.3	Very high	93.6	Very high	23 Å²	23	32.5 Å²	32.5	9%	0.087	17%	0.171	C	C	.	.	H	α-helix	trans	-61.3	-51.7	176.2	-176.5	174.8	96	95.1	6.1	109.9	S2011 E2013 E2481 L2482 I2486 L2487 M2488 I2526 E2533	S2011-R2484 VanDerWaalsContact OG-CZ 3.22Å; S2011-R2484 PolarHBondContact OG-NH1 3.25Å; S2011-R2484 PolarHBondContact OG-NH2 3.23Å; E2013-R2484 IonicContact OE1-NH1 3.78Å; E2481-R2484 VanDerWaalsContact CD-NE 3.29Å; E2481-R2484 VanDerWaalsContact O-CB 3.31Å; E2481-R2484 WeakPolarHBondContact O-CB 3.34Å; E2481-R2484 PolarHBondContact O-N 3.2Å; E2481-R2484 VanDerWaalsContact O-N 3.1Å; E2481-R2484 VanDerWaalsContact OE1-CD 3.27Å; E2481-R2484 WeakPolarHBondContact OE1-CD 3.44Å; E2481-R2484 IonicContact OE1-CZ 3.03Å; E2481-R2484 VanDerWaalsContact OE1-CZ 3.27Å; E2481-R2484 IonicContact OE1-NE 2.86Å; E2481-R2484 PolarHBondContact OE1-NE 3.04Å; E2481-R2484 IonicContact OE1-NH2 3.49Å; E2481-R2484 PolarHBondContact OE1-NH2 3.38Å; E2481-R2484 WeakPolarHBondContact OE2-CD 3.4Å; E2481-R2484 IonicContact OE2-CZ 2.78Å; E2481-R2484 IonicContact OE2-NE 2.87Å; E2481-R2484 PolarHBondContact OE2-NE 2.99Å; E2481-R2484 IonicContact OE2-NH2 3.35Å; L2482-R2484 VanDerWaalsContact C-N 3.32Å; L2482-R2484 PolarHBondContact O-N 3.07Å; R2484-I2486 VanDerWaalsContact C-N 3.29Å; R2484-I2486 PolarHBondContact O-N 2.9Å; R2484-L2487 PolarHBondContact O-N 2.86Å; R2484-L2487 VanDerWaalsContact O-N 3.13Å; R2484-M2488 HydrophobicContact CG-CG 4.24Å; R2484-M2488 VanDerWaalsContact O-CG 3.25Å; R2484-M2488 WeakPolarHBondContact O-CG 3.45Å; R2484-M2488 PolarHBondContact O-N 3.07Å; R2484-I2526 HydrophobicContact CB-CD1 4.01Å; R2484-I2526 HydrophobicContact CB-CG1 3.95Å; R2484-I2526 HydrophobicContact CG-CD1 4.27Å; R2484-I2526 HydrophobicContact CG-CG1 4.05Å; R2484-E2533 IonicContact CZ-OE1 3.02Å; R2484-E2533 IonicContact CZ-OE2 3.47Å; R2484-E2533 IonicContact NH1-OE1 2.66Å; R2484-E2533 PolarHBondContact NH1-OE1 3.33Å; R2484-E2533 IonicContact NH1-OE2 2.72Å; R2484-E2533 IonicContact NH2-OE1 2.86Å; R2484-E2533 PolarHBondContact NH2-OE1 3.41Å; R2484-E2533 IonicContact NH2-OE2 3.72Å; R2484-E2533 PolarHBondContact NH2-OE2 2.97Å
2485	Q	92.9	Very high	94.1	Very high	28.25 Å²	28.25	29 Å²	29	13%	0.132	15%	0.153	C	C	.	.	H	α-helix	trans	-59.7	-43.5	-177.6	-65.9	-118.8	-17	0	0	112.3	L2048 N2051 E2481 L2482 L2487 M2488 T2489	L2048-Q2485 HydrophobicContact CD1-CB 3.73Å; L2048-Q2485 HydrophobicContact CG-CB 4.16Å; N2051-Q2485 WeakPolarHBondContact OD1-CG 3.14Å; E2481-Q2485 HydrophobicContact CG-CG 4.4Å; E2481-Q2485 WeakPolarHBondContact O-CG 3.35Å; E2481-Q2485 PolarHBondContact O-N 3.29Å; E2481-Q2485 VanDerWaalsContact O-N 3.13Å; E2481-Q2485 PolarHBondContact OE1-NE2 2.96Å; L2482-Q2485 HydrophobicContact CD1-CB 4.4Å; L2482-Q2485 PolarHBondContact O-N 3.32Å; Q2485-L2487 VanDerWaalsContact C-N 3.35Å; Q2485-L2487 PolarHBondContact O-N 2.66Å; Q2485-M2488 CarbonylContact O-C 3.4Å; Q2485-M2488 WeakPolarHBondContact O-CA 3.29Å; Q2485-M2488 WeakPolarHBondContact O-CB 3.41Å; Q2485-M2488 PolarHBondContact O-N 3.12Å; Q2485-M2488 VanDerWaalsContact O-N 3.13Å; Q2485-T2489 WeakPolarHBondContact O-CG2 3.24Å; Q2485-T2489 PolarHBondContact O-N 3.04Å; Q2485-T2489 VanDerWaalsContact O-N 3.13Å
2486	I	95.4	Very high	94.6	Very high	9.75 Å²	9.75	22.6 Å²	22.6	5%	0.05	13%	0.125	C	C	.	.	H	α-helix	trans	-65.8	-40.9	177.5	-71.1	-170.5	0	0	0	111.4	L2048 T2467 L2482 R2484 M2488 T2489 C2491 I2494 Y2875	L2048-I2486 HydrophobicContact CD2-CG1 3.94Å; T2467-I2486 HydrophobicContact CG2-CB 4.23Å; T2467-I2486 HydrophobicContact CG2-CD1 3.6Å; T2467-I2486 HydrophobicContact CG2-CG1 4.33Å; T2467-I2486 HydrophobicContact CG2-CG2 4.16Å; L2482-I2486 HydrophobicContact CD1-CD1 4.1Å; L2482-I2486 HydrophobicContact CD1-CG1 4.26Å; L2482-I2486 HydrophobicContact CD2-CD1 4.42Å; L2482-I2486 HydrophobicContact CG-CD1 3.78Å; L2482-I2486 HydrophobicContact CG-CG1 4.33Å; L2482-I2486 WeakPolarHBondContact O-CB 3.36Å; L2482-I2486 VanDerWaalsContact O-CG1 3.23Å; L2482-I2486 WeakPolarHBondContact O-CG1 3.33Å; L2482-I2486 PolarHBondContact O-N 2.96Å; R2484-I2486 VanDerWaalsContact C-N 3.29Å; R2484-I2486 PolarHBondContact O-N 2.9Å; I2486-M2488 VanDerWaalsContact C-N 3.28Å; I2486-M2488 PolarHBondContact O-N 3.13Å; I2486-T2489 WeakPolarHBondContact O-CB 3.31Å; I2486-T2489 PolarHBondContact O-N 3.17Å; I2486-T2489 VanDerWaalsContact O-N 3.14Å; I2486-T2489 PolarHBondContact O-OG1 3.39Å; I2486-C2491 HydrophobicContact CG2-CB 3.5Å; I2486-C2491 VanDerWaalsContact CG2-CB 3.47Å; I2486-C2491 VanDerWaalsContact O-CB 3.26Å; I2486-C2491 WeakPolarHBondContact O-CB 3.31Å; I2486-C2491 PolarHBondContact O-N 3.17Å; I2486-I2494 HydrophobicContact CG2-CG2 4.3Å; I2486-Y2875 HydrophobicContact CD1-CG 4.26Å; I2486-Y2875 HydrophobicContact CG1-CD1 4.05Å; I2486-Y2875 HydrophobicContact CG1-CG 4.17Å; I2486-Y2875 HydrophobicContact CG2-CD1 4.02Å; I2486-Y2875 HydrophobicContact CG2-CE1 4.29Å; I2486-Y2875 HydrophobicContact CG2-CG 4.33Å
2487	L	96.4	Very high	95.1	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-62.2	-37	173	-72.8	165.5	0	0	0	111.9	Y2483 R2484 Q2485 T2489 G2490 R2492 I2494 V2527 S2530 A2531 V2534 V2539	Y2483-L2487 WeakPolarHBondContact O-CB 3.33Å; Y2483-L2487 WeakPolarHBondContact O-CD1 3.41Å; Y2483-L2487 VanDerWaalsContact O-CG 3.27Å; Y2483-L2487 WeakPolarHBondContact O-CG 3.36Å; Y2483-L2487 PolarHBondContact O-N 3.05Å; R2484-L2487 PolarHBondContact O-N 2.86Å; R2484-L2487 VanDerWaalsContact O-N 3.13Å; Q2485-L2487 VanDerWaalsContact C-N 3.35Å; Q2485-L2487 PolarHBondContact O-N 2.66Å; L2487-T2489 VanDerWaalsContact C-N 3.27Å; L2487-T2489 PolarHBondContact O-N 2.92Å; L2487-G2490 PolarHBondContact O-N 3.06Å; L2487-G2490 VanDerWaalsContact O-N 3.08Å; L2487-R2492 PolarHBondContact O-NH2 3.09Å; L2487-I2494 HydrophobicContact CD1-CD1 4.29Å; L2487-I2494 HydrophobicContact CD2-CD1 4.41Å; L2487-I2494 HydrophobicContact CD2-CG2 4.15Å; L2487-I2494 HydrophobicContact CG-CG2 4.37Å; L2487-V2527 HydrophobicContact CD1-CB 4.35Å; L2487-V2527 HydrophobicContact CD1-CG1 4.11Å; L2487-V2527 HydrophobicContact CD1-CG2 4.08Å; L2487-S2530 WeakPolarHBondContact CD1-OG 3.44Å; L2487-A2531 HydrophobicContact CD1-CB 4.5Å; L2487-V2534 WeakPolarHBondContact O-CG2 3.26Å; L2487-V2539 HydrophobicContact CD2-CG1 4.05Å; L2487-V2539 HydrophobicContact CD2-CG2 4.08Å
2488	M	91.5	Very high	95.4	Very high	59 Å²	59	15.2 Å²	15.2	29%	0.291	8%	0.084	S	C	.	.	H	α-helix	trans	-69.8	-17.2	175.9	-64.8	-56.6	-76.3	0	0	114	L2048 R2484 Q2485 I2486 G2490 E2533 V2534	L2048-M2488 HydrophobicContact CD1-CB 4.02Å; R2484-M2488 HydrophobicContact CG-CG 4.24Å; R2484-M2488 VanDerWaalsContact O-CG 3.25Å; R2484-M2488 WeakPolarHBondContact O-CG 3.45Å; R2484-M2488 PolarHBondContact O-N 3.07Å; Q2485-M2488 CarbonylContact O-C 3.4Å; Q2485-M2488 WeakPolarHBondContact O-CA 3.29Å; Q2485-M2488 WeakPolarHBondContact O-CB 3.41Å; Q2485-M2488 PolarHBondContact O-N 3.12Å; Q2485-M2488 VanDerWaalsContact O-N 3.13Å; I2486-M2488 VanDerWaalsContact C-N 3.28Å; I2486-M2488 PolarHBondContact O-N 3.13Å; M2488-G2490 PolarHBondContact O-N 2.9Å; M2488-E2533 HydrophobicContact CE-CB 4.07Å; M2488-E2533 VanDerWaalsContact CE-OE2 3.28Å; M2488-E2533 WeakPolarHBondContact CE-OE2 3.23Å; M2488-E2533 HydrophobicContact SD-CB 3.59Å; M2488-E2533 VanDerWaalsContact SD-CB 3.56Å; M2488-E2533 HydrophobicContact SD-CG 4.33Å; M2488-E2533 VanDerWaalsContact SD-OE2 3.4Å; M2488-V2534 HydrophobicContact CB-CG1 4.42Å; M2488-V2534 HydrophobicContact CB-CG2 4.49Å; M2488-V2534 HydrophobicContact CE-CG1 3.46Å; M2488-V2534 VanDerWaalsContact CE-CG1 3.46Å; M2488-V2534 HydrophobicContact CE-CG2 3.63Å; M2488-V2534 HydrophobicContact SD-CG1 3.75Å; M2488-V2534 HydrophobicContact SD-CG2 3.76Å
2489	T	90.7	Very high	95.6	Very high	66 Å²	66	16.6 Å²	16.6	41%	0.405	9%	0.089	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-5.6	169.1	70.7	0	0	0	0	113.2	L2048 Q2485 I2486 L2487 C2491 Y2875	L2048-T2489 HydrophobicContact CD1-CG2 3.8Å; Q2485-T2489 WeakPolarHBondContact O-CG2 3.24Å; Q2485-T2489 PolarHBondContact O-N 3.04Å; Q2485-T2489 VanDerWaalsContact O-N 3.13Å; I2486-T2489 WeakPolarHBondContact O-CB 3.31Å; I2486-T2489 PolarHBondContact O-N 3.17Å; I2486-T2489 VanDerWaalsContact O-N 3.14Å; I2486-T2489 PolarHBondContact O-OG1 3.39Å; L2487-T2489 VanDerWaalsContact C-N 3.27Å; L2487-T2489 PolarHBondContact O-N 2.92Å; T2489-C2491 PolarHBondContact OG1-N 3.17Å; T2489-Y2875 WeakPolarHBondContact OG1-CE1 3.34Å
2490	G	93.5	Very high	95.7	Very high	9.5 Å²	9.5	18.3 Å²	18.3	10%	0.098	10%	0.096	C	C	.	.	T	Hydrogen-bonded Turn	trans	96	-3.9	-174.6	0	0	0	0	0	114.4	L2487 M2488 R2492 N2894 G2896	L2487-G2490 PolarHBondContact O-N 3.06Å; L2487-G2490 VanDerWaalsContact O-N 3.08Å; M2488-G2490 PolarHBondContact O-N 2.9Å; G2490-R2492 WeakPolarHBondContact O-CG 3.38Å; G2490-R2492 PolarHBondContact O-N 3.19Å; G2490-R2492 PolarHBondContact O-NE 2.95Å; G2490-N2894 VanDerWaalsContact CA-O 3.24Å; G2490-N2894 WeakPolarHBondContact CA-O 3.46Å; G2490-G2896 WeakPolarHBondContact O-CA 3.41Å
2491	C	96.8	Very high	95.6	Very high	3 Å²	3	17.4 Å²	17.4	2%	0.02	9%	0.092	C	C	.	.			trans	-55	136	175.9	-171.3	0	0	0	0	111.5	A2462 S2463 S2464 I2486 T2489 C2493 Y2875	A2462-C2491 PolarHBondContact O-SG 3.37Å; A2462-C2491 VanDerWaalsContact O-SG 3.35Å; S2463-C2491 VanDerWaalsContact C-SG 3.6Å; S2464-C2491 PolarHBondContact N-SG 3.31Å; S2464-C2491 VanDerWaalsContact N-SG 3.43Å; I2486-C2491 HydrophobicContact CG2-CB 3.5Å; I2486-C2491 VanDerWaalsContact CG2-CB 3.47Å; I2486-C2491 VanDerWaalsContact O-CB 3.26Å; I2486-C2491 WeakPolarHBondContact O-CB 3.31Å; I2486-C2491 PolarHBondContact O-N 3.17Å; T2489-C2491 PolarHBondContact OG1-N 3.17Å; C2491-C2493 PolarHBondContact SG-O 3.19Å; C2491-C2493 VanDerWaalsContact SG-O 3.33Å; C2491-Y2875 HydrophobicContact CB-CE1 3.95Å
2492	R	97.8	Very high	95.5	Very high	4.75 Å²	4.75	22.9 Å²	22.9	2%	0.018	12%	0.123	C	C	.	.			trans	-118.1	-12.4	-173.7	-63.1	-64.2	88.1	-170.9	-3.9	113.9	I2461 A2462 L2487 G2490 A2531 S2535 L2537 V2539 I2540 C2895 Y2897	I2461-R2492 HydrophobicContact CG2-CB 3.97Å; A2462-R2492 PolarHBondContact O-N 2.98Å; L2487-R2492 PolarHBondContact O-NH2 3.09Å; G2490-R2492 WeakPolarHBondContact O-CG 3.38Å; G2490-R2492 PolarHBondContact O-N 3.19Å; G2490-R2492 PolarHBondContact O-NE 2.95Å; R2492-A2531 PolarHBondContact NH1-O 3.19Å; R2492-A2531 PolarHBondContact NH2-O 3.14Å; R2492-S2535 PolarHBondContact NH1-O 3.05Å; R2492-L2537 PolarHBondContact NH1-O 2.94Å; R2492-L2537 VanDerWaalsContact NH1-O 3.16Å; R2492-V2539 VanDerWaalsContact NH1-CG2 3.31Å; R2492-V2539 CarbonylContact O-C 3.53Å; R2492-V2539 VanDerWaalsContact O-CA 3.3Å; R2492-V2539 WeakPolarHBondContact O-CA 3.44Å; R2492-I2540 PolarHBondContact O-N 2.92Å; R2492-C2895 WeakPolarHBondContact CD-O 3.42Å; R2492-Y2897 HydrophobicContact CB-CE2 3.82Å; R2492-Y2897 HydrophobicContact CG-CD2 3.8Å; R2492-Y2897 HydrophobicContact CG-CE2 3.45Å; R2492-Y2897 VanDerWaalsContact CG-CE2 3.45Å
2493	C	98.3	Very high	95.3	Very high	5 Å²	5	27.3 Å²	27.3	3%	0.034	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	124.1	167.8	-179.9	0	0	0	0	110.7	I2461 A2462 S2463 S2464 C2491 I2540 M2870	I2461-C2493 HydrophobicContact CG2-CB 4.22Å; A2462-C2493 PolarHBondContact O-N 3.3Å; A2462-C2493 VanDerWaalsContact O-N 3.15Å; S2463-C2493 CarbonylContact C-O 3.53Å; S2463-C2493 VanDerWaalsContact CA-O 3.27Å; S2463-C2493 WeakPolarHBondContact CA-O 3.48Å; S2463-C2493 WeakPolarHBondContact OG-CB 3.17Å; S2464-C2493 PolarHBondContact N-O 3.03Å; C2491-C2493 PolarHBondContact SG-O 3.19Å; C2491-C2493 VanDerWaalsContact SG-O 3.33Å; C2493-I2540 CarbonylContact C-O 3.1Å; C2493-I2540 VanDerWaalsContact CA-O 3.29Å; C2493-I2540 WeakPolarHBondContact CA-O 3.39Å; C2493-I2540 HydrophobicContact CB-CB 4.23Å; C2493-I2540 PolarHBondContact SG-O 2.92Å; C2493-M2870 HydrophobicContact CB-CE 3.68Å; C2493-M2870 WeakPolarHBondContact SG-CE 3.42Å
2494	I	98.4	Very high	95	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	152.3	179.4	57.6	179.9	0	0	0	110.3	T2467 Y2483 I2486 L2487 F2496 V2527 V2539 I2540 I2541 S2542	T2467-I2494 HydrophobicContact CG2-CB 4.06Å; T2467-I2494 HydrophobicContact CG2-CG2 3.95Å; Y2483-I2494 HydrophobicContact CD1-CB 4.3Å; Y2483-I2494 HydrophobicContact CD1-CD1 4.07Å; Y2483-I2494 HydrophobicContact CE1-CB 4.4Å; Y2483-I2494 HydrophobicContact CE1-CD1 4.45Å; I2486-I2494 HydrophobicContact CG2-CG2 4.3Å; L2487-I2494 HydrophobicContact CD1-CD1 4.29Å; L2487-I2494 HydrophobicContact CD2-CD1 4.41Å; L2487-I2494 HydrophobicContact CD2-CG2 4.15Å; L2487-I2494 HydrophobicContact CG-CG2 4.37Å; I2494-F2496 HydrophobicContact CD1-CE1 3.9Å; I2494-F2496 HydrophobicContact CD1-CE2 3.83Å; I2494-F2496 HydrophobicContact CD1-CZ 4.45Å; I2494-F2496 HydrophobicContact CG1-CE1 4.21Å; I2494-F2496 HydrophobicContact CG1-CE2 4.1Å; I2494-V2527 HydrophobicContact CD1-CB 4.46Å; I2494-V2527 HydrophobicContact CD1-CG1 3.96Å; I2494-V2527 HydrophobicContact CD1-CG2 3.7Å; I2494-V2539 HydrophobicContact CD1-CG1 4.25Å; I2494-V2539 HydrophobicContact CG1-CG1 4.35Å; I2494-I2540 PolarHBondContact N-O 3.13Å; I2494-I2540 VanDerWaalsContact N-O 3.08Å; I2494-I2541 HydrophobicContact CD1-CG1 4.28Å; I2494-I2541 HydrophobicContact CG1-CG1 4.16Å; I2494-I2541 WeakPolarHBondContact O-CA 3.43Å; I2494-S2542 PolarHBondContact O-N 3.03Å
2495	E	98.3	Very high	95	Very high	7.75 Å²	7.75	31.3 Å²	31.3	4%	0.036	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	132.9	-173	-176.8	147.2	-113.7	0	0	112.5	H2465 N2466 T2467 Y2483 S2542 R2845	H2465-E2495 VanDerWaalsContact CA-OE2 3.26Å; H2465-E2495 WeakPolarHBondContact CA-OE2 3.4Å; H2465-E2495 IonicContact CD2-OE2 2.83Å; H2465-E2495 PolarHBondContact CD2-OE2 3.09Å; H2465-E2495 VanDerWaalsContact CD2-OE2 3.27Å; H2465-E2495 IonicContact CE1-OE2 3.28Å; H2465-E2495 IonicContact CG-OE2 3.04Å; H2465-E2495 IonicContact ND1-OE2 3.14Å; H2465-E2495 PolarHBondContact ND1-OE2 3Å; N2466-E2495 PolarHBondContact N-OE2 3.26Å; T2467-E2495 PolarHBondContact OG1-N 3.16Å; Y2483-E2495 VanDerWaalsContact CE1-O 3.27Å; Y2483-E2495 WeakPolarHBondContact CE1-O 3.37Å; Y2483-E2495 PolarHBondContact OH-O 3.13Å; Y2483-E2495 VanDerWaalsContact OH-O 3.04Å; E2495-S2542 CarbonylContact C-O 3.52Å; E2495-S2542 VanDerWaalsContact CA-O 3.31Å; E2495-S2542 WeakPolarHBondContact CA-O 3.38Å; E2495-S2542 WeakPolarHBondContact OE1-CB 3.12Å; E2495-S2542 PolarHBondContact OE1-OG 3.09Å; E2495-R2845 IonicContact OE1-CZ 3.24Å; E2495-R2845 IonicContact OE1-NH1 3.33Å; E2495-R2845 PolarHBondContact OE1-NH1 2.97Å; E2495-R2845 IonicContact OE1-NH2 3.48Å; E2495-R2845 PolarHBondContact OE1-NH2 2.97Å; E2495-R2845 IonicContact OE2-CZ 2.67Å; E2495-R2845 IonicContact OE2-NH1 3.82Å; E2495-R2845 PolarHBondContact OE2-NH1 3.14Å; E2495-R2845 IonicContact OE2-NH2 2.75Å; E2495-R2845 PolarHBondContact OE2-NH2 3.23Å
2496	F	98.2	Very high	95.2	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	109	176.7	-75.5	17.1	0	0	0	108.3	Y2483 I2494 C2498 I2508 F2520 V2523 V2524 V2527 I2541 S2542 I2543 E2544 F2559	Y2483-F2496 HydrophobicContact CD1-CD1 4.42Å; Y2483-F2496 AromaticContact CD1-CE1 3.91Å; Y2483-F2496 HydrophobicContact CD1-CE1 3.91Å; Y2483-F2496 AromaticContact CD1-CE2 3.95Å; Y2483-F2496 HydrophobicContact CD1-CE2 3.95Å; Y2483-F2496 AromaticContact CE1-CD1 3.52Å; Y2483-F2496 HydrophobicContact CE1-CD1 3.52Å; Y2483-F2496 VanDerWaalsContact CE1-CD1 3.44Å; Y2483-F2496 AromaticContact CE1-CD2 3.6Å; Y2483-F2496 HydrophobicContact CE1-CD2 3.6Å; Y2483-F2496 AromaticContact CE1-CE1 3.43Å; Y2483-F2496 HydrophobicContact CE1-CE1 3.43Å; Y2483-F2496 AromaticContact CE1-CE2 3.38Å; Y2483-F2496 HydrophobicContact CE1-CE2 3.38Å; Y2483-F2496 HydrophobicContact CE1-CZ 4.34Å; Y2483-F2496 AromaticContact CZ-CD1 3.84Å; Y2483-F2496 AromaticContact CZ-CD2 3.96Å; Y2483-F2496 AromaticContact CZ-CE1 3.97Å; Y2483-F2496 AromaticContact CZ-CE2 3.96Å; I2494-F2496 HydrophobicContact CD1-CE1 3.9Å; I2494-F2496 HydrophobicContact CD1-CE2 3.83Å; I2494-F2496 HydrophobicContact CD1-CZ 4.45Å; I2494-F2496 HydrophobicContact CG1-CE1 4.21Å; I2494-F2496 HydrophobicContact CG1-CE2 4.1Å; F2496-C2498 PolarHBondContact O-N 3.15Å; F2496-I2508 HydrophobicContact CB-CD1 4.13Å; F2496-I2508 HydrophobicContact CD1-CD1 3.96Å; F2496-I2508 HydrophobicContact CD2-CD1 3.87Å; F2496-I2508 HydrophobicContact CE1-CD1 4.04Å; F2496-I2508 HydrophobicContact CE2-CD1 4.17Å; F2496-I2508 HydrophobicContact CG-CD1 3.94Å; F2496-F2520 HydrophobicContact CD1-CD2 4.13Å; F2496-F2520 AromaticContact CD1-CE2 3.75Å; F2496-F2520 HydrophobicContact CD1-CE2 3.75Å; F2496-F2520 HydrophobicContact CD2-CD2 4.31Å; F2496-F2520 AromaticContact CD2-CE2 3.83Å; F2496-F2520 HydrophobicContact CD2-CE2 3.83Å; F2496-F2520 HydrophobicContact CE1-CE2 4.13Å; F2496-F2520 HydrophobicContact CE2-CE2 4.28Å; F2496-V2523 HydrophobicContact CD1-CG1 4.32Å; F2496-V2523 HydrophobicContact CD2-CG1 4.48Å; F2496-V2523 HydrophobicContact CE1-CB 4.41Å; F2496-V2523 HydrophobicContact CE1-CG1 3.71Å; F2496-V2523 HydrophobicContact CE2-CB 4.46Å; F2496-V2523 HydrophobicContact CE2-CG1 3.94Å; F2496-V2523 HydrophobicContact CZ-CB 4.48Å; F2496-V2523 HydrophobicContact CZ-CG1 3.46Å; F2496-V2524 HydrophobicContact CE1-CG2 4.05Å; F2496-V2524 HydrophobicContact CE2-CG2 4.15Å; F2496-V2527 HydrophobicContact CE1-CG2 4.36Å; F2496-V2527 HydrophobicContact CE2-CG2 4.42Å; F2496-V2527 HydrophobicContact CZ-CG2 4.14Å; F2496-I2541 HydrophobicContact CB-CG2 4.32Å; F2496-I2541 HydrophobicContact CD1-CG2 3.88Å; F2496-I2541 HydrophobicContact CD2-CG2 3.83Å; F2496-I2541 HydrophobicContact CE1-CD1 4.47Å; F2496-I2541 HydrophobicContact CE1-CG1 4.45Å; F2496-I2541 HydrophobicContact CE1-CG2 4.04Å; F2496-I2541 HydrophobicContact CE2-CD1 4.36Å; F2496-I2541 HydrophobicContact CE2-CG2 4Å; F2496-I2541 HydrophobicContact CG-CG2 3.78Å; F2496-I2541 HydrophobicContact CZ-CD1 4.16Å; F2496-I2541 HydrophobicContact CZ-CG2 4.09Å; F2496-S2542 PolarHBondContact N-O 2.97Å; F2496-I2543 WeakPolarHBondContact O-CA 3.22Å; F2496-E2544 PolarHBondContact O-N 3.19Å; F2496-F2559 HydrophobicContact CD1-CZ 4.49Å; F2496-F2559 HydrophobicContact CD2-CE1 4.41Å; F2496-F2559 HydrophobicContact CD2-CZ 4.25Å; F2496-F2559 HydrophobicContact CE1-CE1 4.31Å; F2496-F2559 HydrophobicContact CE1-CZ 4.46Å; F2496-F2559 AromaticContact CE2-CE1 3.88Å; F2496-F2559 HydrophobicContact CE2-CE1 3.98Å; F2496-F2559 HydrophobicContact CE2-CZ 4.22Å
2497	D	97.7	Very high	95.3	Very high	1.75 Å²	1.75	30.3 Å²	30.3	1%	0.009	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	96.2	174.8	-172.8	-2.5	0	0	0	109.1	Y2468 W2499 I2508 Y2509 H2510 G2511 H2546	Y2468-D2497 HydrophobicContact CD1-CB 4.46Å; Y2468-D2497 HydrophobicContact CE1-CB 3.53Å; Y2468-D2497 VanDerWaalsContact CE1-CB 3.46Å; Y2468-D2497 VanDerWaalsContact OH-CB 3.3Å; Y2468-D2497 WeakPolarHBondContact OH-CB 3.35Å; Y2468-D2497 PolarHBondContact OH-OD2 3.17Å; D2497-W2499 PolarHBondContact OD1-NE1 3.01Å; D2497-I2508 VanDerWaalsContact O-CA 3.23Å; D2497-I2508 WeakPolarHBondContact O-CA 3.37Å; D2497-I2508 WeakPolarHBondContact O-CG2 3.15Å; D2497-Y2509 WeakPolarHBondContact CB-O 3.34Å; D2497-Y2509 VanDerWaalsContact CG-O 3.26Å; D2497-Y2509 PolarHBondContact O-N 2.97Å; D2497-Y2509 VanDerWaalsContact OD2-O 3.07Å; D2497-H2510 WeakPolarHBondContact OD2-CA 3.33Å; D2497-H2510 IonicContact OD2-CD2 2.97Å; D2497-H2510 IonicContact OD2-ND1 3.89Å; D2497-H2510 PolarHBondContact OD2-ND1 2.78Å; D2497-G2511 PolarHBondContact OD2-N 3.17Å; D2497-H2546 IonicContact OD1-CD2 3.35Å; D2497-H2546 PolarHBondContact OD1-CD2 3.17Å; D2497-H2546 VanDerWaalsContact OD1-CD2 3.28Å; D2497-H2546 IonicContact OD1-NE2 3.51Å; D2497-H2546 PolarHBondContact OD1-NE2 2.9Å
2498	C	98	Very high	95.4	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	127	-163.6	-60.6	0	0	0	0	112.3	F2496 V2507 E2544 H2546 C2547 M2555	F2496-C2498 PolarHBondContact O-N 3.15Å; C2498-V2507 WeakPolarHBondContact CA-O 3.34Å; C2498-E2544 WeakPolarHBondContact CB-O 2.9Å; C2498-E2544 PolarHBondContact N-O 3.4Å; C2498-H2546 CarbonylContact O-C 3.52Å; C2498-H2546 WeakPolarHBondContact O-CA 3.33Å; C2498-H2546 WeakPolarHBondContact O-CB 3.36Å; C2498-H2546 PolarHBondContact O-N 3.27Å; C2498-C2547 VanDerWaalsContact C-SG 3.57Å; C2498-C2547 PolarHBondContact O-N 2.97Å; C2498-C2547 PolarHBondContact O-SG 2.94Å; C2498-M2555 HydrophobicContact CB-CE 3.61Å; C2498-M2555 HydrophobicContact CB-SD 4.06Å; C2498-M2555 VanDerWaalsContact SG-CE 3.57Å; C2498-M2555 WeakPolarHBondContact SG-CE 3.44Å
2499	W	97.3	Very high	95.6	Very high	38 Å²	38	29 Å²	29	14%	0.144	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	160.9	-177.4	-69.1	80.4	0	0	0	112.2	D2497 G2501 P2506 V2507 Y2509 G2511 H2512 H2546 C2547	D2497-W2499 PolarHBondContact OD1-NE1 3.01Å; W2499-G2501 PolarHBondContact O-N 2.99Å; W2499-P2506 WeakPolarHBondContact O-CA 3.44Å; W2499-V2507 HydrophobicContact CB-CG2 4.16Å; W2499-V2507 PolarHBondContact N-O 3.04Å; W2499-V2507 WeakPolarHBondContact O-CG2 3.4Å; W2499-V2507 PolarHBondContact O-N 3.01Å; W2499-Y2509 HydrophobicContact CB-CD1 4.06Å; W2499-Y2509 HydrophobicContact CB-CE1 3.41Å; W2499-Y2509 AromaticContact CD1-CD1 3.89Å; W2499-Y2509 AromaticContact CD1-CE1 3.8Å; W2499-Y2509 AromaticContact CD2-CE1 3.92Å; W2499-Y2509 HydrophobicContact CD2-CE1 4.1Å; W2499-Y2509 AromaticContact CD2-CZ 3.93Å; W2499-Y2509 AromaticContact CG-CD1 4Å; W2499-Y2509 HydrophobicContact CG-CD1 4.06Å; W2499-Y2509 AromaticContact CG-CE1 3.46Å; W2499-Y2509 HydrophobicContact CG-CE1 3.46Å; W2499-Y2509 VanDerWaalsContact CG-CE1 3.41Å; W2499-Y2509 HydrophobicContact CG-CE2 4.5Å; W2499-Y2509 AromaticContact CG-CZ 3.81Å; W2499-Y2509 PolarHBondContact NE1-O 2.86Å; W2499-G2511 VanDerWaalsContact CE2-CA 3.46Å; W2499-H2512 AromaticContact CH2-CD2 3.81Å; W2499-H2512 AromaticContact CH2-NE2 3.64Å; W2499-H2512 WeakPolarHBondContact CH2-NE2 3.22Å; W2499-H2512 AromaticContact CZ3-NE2 3.68Å; W2499-H2546 HydrophobicContact CD2-CB 3.61Å; W2499-H2546 AromaticContact CD2-CG 3.98Å; W2499-H2546 AromaticContact CE2-CD2 3.29Å; W2499-H2546 AromaticContact CE2-CG 3.56Å; W2499-H2546 AromaticContact CE2-NE2 3.91Å; W2499-H2546 HydrophobicContact CE3-CB 3.72Å; W2499-H2546 HydrophobicContact CG-CB 4.19Å; W2499-H2546 HydrophobicContact CH2-CB 3.91Å; W2499-H2546 AromaticContact CH2-CD2 3.98Å; W2499-H2546 AromaticContact CH2-CG 3.73Å; W2499-H2546 AromaticContact CH2-ND1 3.92Å; W2499-H2546 HydrophobicContact CZ2-CB 3.79Å; W2499-H2546 AromaticContact CZ2-CD2 3.25Å; W2499-H2546 WeakPolarHBondContact CZ2-CD2 3.42Å; W2499-H2546 AromaticContact CZ2-CE1 3.94Å; W2499-H2546 AromaticContact CZ2-CG 3.35Å; W2499-H2546 VanDerWaalsContact CZ2-CG 3.4Å; W2499-H2546 AromaticContact CZ2-ND1 3.84Å; W2499-H2546 AromaticContact CZ2-NE2 3.62Å; W2499-H2546 HydrophobicContact CZ3-CB 3.87Å; W2499-H2546 AromaticContact NE1-CD2 3.38Å; W2499-H2546 PolarHBondContact NE1-CD2 3.06Å; W2499-H2546 VanDerWaalsContact NE1-CD2 3.31Å; W2499-C2547 PolarHBondContact N-SG 2.9Å; W2499-C2547 PolarHBondContact O-SG 3.03Å; W2499-C2547 VanDerWaalsContact O-SG 3.37Å
2500	D	96.3	Very high	95.8	Very high	61.5 Å²	61.5	28 Å²	28	33%	0.329	15%	0.154	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	122.6	172.2	-75.1	2.1	0	0	0	110.6	C2547 S2548 L2551	D2500-C2547 WeakPolarHBondContact OD1-CA 3.42Å; D2500-C2547 VanDerWaalsContact OD1-CB 3.22Å; D2500-C2547 WeakPolarHBondContact OD1-CB 3.44Å; D2500-C2547 PolarHBondContact OD1-SG 3.02Å; D2500-S2548 VanDerWaalsContact CG-N 3.33Å; D2500-S2548 PolarHBondContact OD1-N 2.91Å; D2500-S2548 PolarHBondContact OD1-OG 3.17Å; D2500-S2548 WeakPolarHBondContact OD2-CB 3.37Å; D2500-S2548 PolarHBondContact OD2-N 3.05Å; D2500-S2548 VanDerWaalsContact OD2-N 3.1Å; D2500-S2548 PolarHBondContact OD2-OG 3.19Å; D2500-L2551 HydrophobicContact CB-CD1 3.93Å; D2500-L2551 HydrophobicContact CB-CD2 3.89Å; D2500-L2551 VanDerWaalsContact CG-CD1 3.45Å; D2500-L2551 WeakPolarHBondContact OD1-CB 3.39Å; D2500-L2551 WeakPolarHBondContact OD1-CD1 3.49Å; D2500-L2551 WeakPolarHBondContact OD1-CD2 3.28Å
2501	G	93	Very high	95.6	Very high	9.75 Å²	9.75	28.1 Å²	28.1	10%	0.101	16%	0.156	C	C	.	.			trans	-84.4	151	174.9	0	0	0	0	0	112.5	W2499 D2503 G2504 Q2505	W2499-G2501 PolarHBondContact O-N 2.99Å; G2501-D2503 PolarHBondContact O-N 3.01Å; G2501-D2503 VanDerWaalsContact O-N 3.11Å; G2501-G2504 PolarHBondContact O-N 3.21Å; G2501-G2504 VanDerWaalsContact O-N 3.14Å; G2501-Q2505 WeakPolarHBondContact CA-O 3.43Å; G2501-Q2505 PolarHBondContact N-O 3.04Å
2502	D	90.4	Very high	95.3	Very high	148.25 Å²	148.25	36.2 Å²	36.2	79%	0.793	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-17.8	-178.4	-21.7	-51.2	0	0	0	112.6	G2504 K2517	D2502-G2504 VanDerWaalsContact C-N 3.3Å; D2502-K2517 VanDerWaalsContact CG-NZ 3.31Å; D2502-K2517 IonicContact OD1-NZ 3.23Å; D2502-K2517 PolarHBondContact OD1-NZ 2.96Å; D2502-K2517 IonicContact OD2-NZ 3.13Å; D2502-K2517 PolarHBondContact OD2-NZ 2.77Å
2503	D	89.6	Confident	95	Very high	98.5 Å²	98.5	37.4 Å²	37.4	53%	0.527	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.3	5.3	175.5	69.7	-18.3	0	0	0	113.8	G2501 Q2505	G2501-D2503 PolarHBondContact O-N 3.01Å; G2501-D2503 VanDerWaalsContact O-N 3.11Å; D2503-Q2505 VanDerWaalsContact C-N 3.31Å; D2503-Q2505 VanDerWaalsContact CG-CG 3.47Å; D2503-Q2505 PolarHBondContact O-N 3.24Å; D2503-Q2505 VanDerWaalsContact OD1-CB 3.28Å; D2503-Q2505 WeakPolarHBondContact OD1-CB 3.34Å; D2503-Q2505 WeakPolarHBondContact OD1-CG 3.41Å; D2503-Q2505 PolarHBondContact OD1-N 2.99Å; D2503-Q2505 VanDerWaalsContact OD2-CG 3.28Å; D2503-Q2505 WeakPolarHBondContact OD2-CG 3.38Å
2504	G	90.8	Very high	94.8	Very high	34.5 Å²	34.5	43.9 Å²	43.9	36%	0.356	23%	0.234	S	C	.	.	S	Bend	trans	70	23.2	-174.6	0	0	0	0	0	113.6	G2501 D2502 L2551 K2554	G2501-G2504 PolarHBondContact O-N 3.21Å; G2501-G2504 VanDerWaalsContact O-N 3.14Å; D2502-G2504 VanDerWaalsContact C-N 3.3Å; G2504-L2551 VanDerWaalsContact O-CD2 3.25Å; G2504-L2551 WeakPolarHBondContact O-CD2 3.28Å; G2504-K2554 PolarHBondContact O-NZ 3.19Å
2505	Q	94.2	Very high	94.5	Very high	72 Å²	72	44.4 Å²	44.4	34%	0.336	24%	0.237	S	C	.	.	S	Bend	trans	-109.6	151.7	168.3	-51.6	-66.6	-33.8	0	0	110	G2501 D2503 V2507 K2554	G2501-Q2505 WeakPolarHBondContact CA-O 3.43Å; G2501-Q2505 PolarHBondContact N-O 3.04Å; D2503-Q2505 VanDerWaalsContact C-N 3.31Å; D2503-Q2505 VanDerWaalsContact CG-CG 3.47Å; D2503-Q2505 PolarHBondContact O-N 3.24Å; D2503-Q2505 VanDerWaalsContact OD1-CB 3.28Å; D2503-Q2505 WeakPolarHBondContact OD1-CB 3.34Å; D2503-Q2505 WeakPolarHBondContact OD1-CG 3.41Å; D2503-Q2505 PolarHBondContact OD1-N 2.99Å; D2503-Q2505 VanDerWaalsContact OD2-CG 3.28Å; D2503-Q2505 WeakPolarHBondContact OD2-CG 3.38Å; Q2505-V2507 PolarHBondContact O-N 3.06Å; Q2505-K2554 VanDerWaalsContact NE2-NZ 3.11Å
2506	P	96.8	Very high	94.3	Very high	5 Å²	5	47.1 Å²	47.1	3%	0.032	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	138.8	167.5	15.6	-17	0	0	0	110.6	W2499 F2520 L2551 M2555	W2499-P2506 WeakPolarHBondContact O-CA 3.44Å; P2506-F2520 HydrophobicContact CB-CB 3.88Å; P2506-F2520 HydrophobicContact CB-CD1 4.4Å; P2506-F2520 HydrophobicContact CB-CD2 4.43Å; P2506-F2520 HydrophobicContact CB-CG 4.01Å; P2506-F2520 HydrophobicContact CG-CB 3.89Å; P2506-F2520 HydrophobicContact CG-CD1 3.82Å; P2506-F2520 HydrophobicContact CG-CE1 4.48Å; P2506-F2520 HydrophobicContact CG-CG 3.91Å; P2506-F2520 WeakPolarHBondContact O-CB 3.37Å; P2506-F2520 PolarHBondContact O-N 3.16Å; P2506-L2551 HydrophobicContact CG-CB 4.36Å; P2506-M2555 HydrophobicContact CB-CG 3.75Å; P2506-M2555 HydrophobicContact CB-SD 4.33Å; P2506-M2555 HydrophobicContact CG-CG 3.8Å
2507	V	97.3	Very high	94.1	Very high	12.25 Å²	12.25	51.5 Å²	51.5	7%	0.074	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	160.7	175.9	-65.8	0	0	0	0	110.3	C2498 W2499 Q2505 Y2509 K2517 I2518	C2498-V2507 WeakPolarHBondContact CA-O 3.34Å; W2499-V2507 HydrophobicContact CB-CG2 4.16Å; W2499-V2507 PolarHBondContact N-O 3.04Å; W2499-V2507 WeakPolarHBondContact O-CG2 3.4Å; W2499-V2507 PolarHBondContact O-N 3.01Å; Q2505-V2507 PolarHBondContact O-N 3.06Å; V2507-Y2509 HydrophobicContact CG2-CD1 4.11Å; V2507-Y2509 HydrophobicContact CG2-CE1 4.01Å; V2507-K2517 HydrophobicContact CB-CB 4.48Å; V2507-K2517 HydrophobicContact CG2-CD 4.31Å; V2507-I2518 CarbonylContact C-O 3.58Å; V2507-I2518 WeakPolarHBondContact CA-O 3.36Å
2508	I	97.8	Very high	94	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	128.5	174.7	-64.9	166.9	0	0	0	109.7	Y2468 F2496 D2497 I2518 F2520 V2523	Y2468-I2508 HydrophobicContact CD1-CG2 3.6Å; Y2468-I2508 HydrophobicContact CD2-CG2 4.33Å; Y2468-I2508 HydrophobicContact CE1-CG2 4.14Å; Y2468-I2508 HydrophobicContact CG-CG2 3.73Å; F2496-I2508 HydrophobicContact CB-CD1 4.13Å; F2496-I2508 HydrophobicContact CD1-CD1 3.96Å; F2496-I2508 HydrophobicContact CD2-CD1 3.87Å; F2496-I2508 HydrophobicContact CE1-CD1 4.04Å; F2496-I2508 HydrophobicContact CE2-CD1 4.17Å; F2496-I2508 HydrophobicContact CG-CD1 3.94Å; D2497-I2508 VanDerWaalsContact O-CA 3.23Å; D2497-I2508 WeakPolarHBondContact O-CA 3.37Å; D2497-I2508 WeakPolarHBondContact O-CG2 3.15Å; I2508-I2518 HydrophobicContact CB-CD1 4.41Å; I2508-I2518 HydrophobicContact CB-CG1 3.91Å; I2508-I2518 HydrophobicContact CG2-CD1 4.37Å; I2508-I2518 HydrophobicContact CG2-CG1 4.28Å; I2508-I2518 PolarHBondContact N-O 3.03Å; I2508-I2518 VanDerWaalsContact O-CG1 3.29Å; I2508-I2518 WeakPolarHBondContact O-CG1 3.43Å; I2508-I2518 PolarHBondContact O-N 2.98Å; I2508-F2520 HydrophobicContact CD1-CD2 3.96Å; I2508-F2520 HydrophobicContact CG1-CD2 4.2Å; I2508-V2523 HydrophobicContact CD1-CB 4.07Å; I2508-V2523 HydrophobicContact CD1-CG1 4.02Å; I2508-V2523 HydrophobicContact CD1-CG2 4.08Å
2509	Y	96.4	Very high	93.9	Very high	30.5 Å²	30.5	54.6 Å²	54.6	12%	0.12	29%	0.29	C	S	.	.			trans	-168.8	169.3	171.6	72.1	-76.1	0	0	0	109.6	D2497 W2499 V2507 G2511 T2516 K2517	D2497-Y2509 WeakPolarHBondContact CB-O 3.34Å; D2497-Y2509 VanDerWaalsContact CG-O 3.26Å; D2497-Y2509 PolarHBondContact O-N 2.97Å; D2497-Y2509 VanDerWaalsContact OD2-O 3.07Å; W2499-Y2509 HydrophobicContact CB-CD1 4.06Å; W2499-Y2509 HydrophobicContact CB-CE1 3.41Å; W2499-Y2509 AromaticContact CD1-CD1 3.89Å; W2499-Y2509 AromaticContact CD1-CE1 3.8Å; W2499-Y2509 AromaticContact CD2-CE1 3.92Å; W2499-Y2509 HydrophobicContact CD2-CE1 4.1Å; W2499-Y2509 AromaticContact CD2-CZ 3.93Å; W2499-Y2509 AromaticContact CG-CD1 4Å; W2499-Y2509 HydrophobicContact CG-CD1 4.06Å; W2499-Y2509 AromaticContact CG-CE1 3.46Å; W2499-Y2509 HydrophobicContact CG-CE1 3.46Å; W2499-Y2509 VanDerWaalsContact CG-CE1 3.41Å; W2499-Y2509 HydrophobicContact CG-CE2 4.5Å; W2499-Y2509 AromaticContact CG-CZ 3.81Å; W2499-Y2509 PolarHBondContact NE1-O 2.86Å; V2507-Y2509 HydrophobicContact CG2-CD1 4.11Å; V2507-Y2509 HydrophobicContact CG2-CE1 4.01Å; Y2509-G2511 PolarHBondContact O-N 3.02Å; Y2509-T2516 VanDerWaalsContact CB-O 3.29Å; Y2509-T2516 WeakPolarHBondContact CB-O 3.41Å; Y2509-K2517 HydrophobicContact CD1-CB 4.34Å; Y2509-K2517 HydrophobicContact CD1-CD 4.18Å; Y2509-K2517 HydrophobicContact CD1-CG 3.83Å; Y2509-K2517 HydrophobicContact CD2-CG 4.46Å; Y2509-K2517 HydrophobicContact CE1-CD 4.16Å; Y2509-K2517 HydrophobicContact CE1-CG 4.21Å; Y2509-K2517 HydrophobicContact CG-CD 4.42Å; Y2509-K2517 HydrophobicContact CG-CG 3.97Å
2510	H	94.6	Very high	93.9	Very high	46 Å²	46	52.8 Å²	52.8	21%	0.213	28%	0.283	C	S	.	.			trans	-81.2	113.4	176.2	-171	163.8	0	0	0	110.1	Y2468 L2469 Q2473 D2497 H2512 T2513 T2515	Y2468-H2510 HydrophobicContact CE2-CB 4Å; Y2468-H2510 VanDerWaalsContact CE2-N 3.31Å; Y2468-H2510 WeakPolarHBondContact OH-CA 3.33Å; Y2468-H2510 VanDerWaalsContact OH-CB 3.29Å; Y2468-H2510 WeakPolarHBondContact OH-CB 3.12Å; Y2468-H2510 PolarHBondContact OH-N 3.19Å; L2469-H2510 HydrophobicContact CD1-CB 4.4Å; L2469-H2510 HydrophobicContact CD2-CB 4.49Å; Q2473-H2510 PolarHBondContact O-CD2 3.25Å; Q2473-H2510 VanDerWaalsContact O-CD2 3.27Å; Q2473-H2510 PolarHBondContact O-ND1 2.96Å; Q2473-H2510 PolarHBondContact OE1-CE1 3.39Å; Q2473-H2510 PolarHBondContact OE1-ND1 2.86Å; D2497-H2510 WeakPolarHBondContact OD2-CA 3.33Å; D2497-H2510 IonicContact OD2-CD2 2.97Å; D2497-H2510 IonicContact OD2-ND1 3.89Å; D2497-H2510 PolarHBondContact OD2-ND1 2.78Å; H2510-H2512 PolarHBondContact O-N 3.11Å; H2510-T2513 HydrophobicContact CB-CG2 4.22Å; H2510-T2513 VanDerWaalsContact CD2-CG2 3.48Å; H2510-T2513 WeakPolarHBondContact CD2-CG2 3.33Å; H2510-T2513 VanDerWaalsContact CE1-CG2 3.45Å; H2510-T2513 WeakPolarHBondContact CE1-CG2 3.36Å; H2510-T2513 WeakPolarHBondContact ND1-CG2 3.38Å; H2510-T2513 WeakPolarHBondContact O-CB 3.39Å; H2510-T2513 WeakPolarHBondContact O-CG2 3.29Å; H2510-T2513 PolarHBondContact O-N 3.14Å; H2510-T2513 VanDerWaalsContact O-N 3.16Å; H2510-T2513 PolarHBondContact O-OG1 3.14Å; H2510-T2515 HydrophobicContact CB-CG2 4.13Å; H2510-T2515 WeakPolarHBondContact CB-OG1 3.23Å; H2510-T2515 PolarHBondContact N-OG1 3.23Å; H2510-T2515 VanDerWaalsContact N-OG1 3.14Å; H2510-T2515 PolarHBondContact O-OG1 3.16Å
2511	G	90.2	Very high	93.9	Very high	12 Å²	12	56 Å²	56	12%	0.124	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-48.5	139.2	-175.1	0	0	0	0	0	115.1	D2497 W2499 Y2509 T2513	D2497-G2511 PolarHBondContact OD2-N 3.17Å; W2499-G2511 VanDerWaalsContact CE2-CA 3.46Å; Y2509-G2511 PolarHBondContact O-N 3.02Å; G2511-T2513 VanDerWaalsContact O-CG2 3.24Å; G2511-T2513 WeakPolarHBondContact O-CG2 3.39Å; G2511-T2513 PolarHBondContact O-N 3.03Å; G2511-T2513 VanDerWaalsContact O-N 3.1Å
2512	H	90.1	Very high	94	Very high	171.75 Å²	171.75	59.8 Å²	59.8	80%	0.795	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.9	20.2	178	-54	-71.7	0	0	0	116.1	W2499 H2510	W2499-H2512 AromaticContact CH2-CD2 3.81Å; W2499-H2512 AromaticContact CH2-NE2 3.64Å; W2499-H2512 WeakPolarHBondContact CH2-NE2 3.22Å; W2499-H2512 AromaticContact CZ3-NE2 3.68Å; H2510-H2512 PolarHBondContact O-N 3.11Å
2513	T	92	Very high	94.3	Very high	31.25 Å²	31.25	52.8 Å²	52.8	19%	0.192	27%	0.268	C	S	.	.	S	Bend	trans	-113.8	-179.9	177.6	72.6	0	0	0	0	113.1	L2474 H2510 G2511 T2515	L2474-T2513 HydrophobicContact CB-CG2 4.47Å; L2474-T2513 HydrophobicContact CD2-CG2 3.96Å; L2474-T2513 WeakPolarHBondContact O-CB 3.35Å; H2510-T2513 HydrophobicContact CB-CG2 4.22Å; H2510-T2513 VanDerWaalsContact CD2-CG2 3.48Å; H2510-T2513 WeakPolarHBondContact CD2-CG2 3.33Å; H2510-T2513 VanDerWaalsContact CE1-CG2 3.45Å; H2510-T2513 WeakPolarHBondContact CE1-CG2 3.36Å; H2510-T2513 WeakPolarHBondContact ND1-CG2 3.38Å; H2510-T2513 WeakPolarHBondContact O-CB 3.39Å; H2510-T2513 WeakPolarHBondContact O-CG2 3.29Å; H2510-T2513 PolarHBondContact O-N 3.14Å; H2510-T2513 VanDerWaalsContact O-N 3.16Å; H2510-T2513 PolarHBondContact O-OG1 3.14Å; G2511-T2513 VanDerWaalsContact O-CG2 3.24Å; G2511-T2513 WeakPolarHBondContact O-CG2 3.39Å; G2511-T2513 PolarHBondContact O-N 3.03Å; G2511-T2513 VanDerWaalsContact O-N 3.1Å; T2513-T2515 VanDerWaalsContact C-N 3.28Å; T2513-T2515 PolarHBondContact O-N 3.31Å; T2513-T2515 WeakPolarHBondContact OG1-CB 3.49Å; T2513-T2515 VanDerWaalsContact OG1-CG2 3.28Å; T2513-T2515 WeakPolarHBondContact OG1-CG2 3.37Å; T2513-T2515 PolarHBondContact OG1-N 2.82Å; T2513-T2515 PolarHBondContact OG1-OG1 2.96Å
2514	L	92.2	Very high	94.7	Very high	140.5 Å²	140.5	48.1 Å²	48.1	74%	0.736	24%	0.243	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-92.7	24.7	174.7	-60.3	174.2	0	0	0	112.4	L2474 K2475 G2476	L2474-L2514 WeakPolarHBondContact O-CB 3.31Å; L2474-L2514 PolarHBondContact O-N 3.2Å; K2475-L2514 WeakPolarHBondContact CA-O 3.46Å; K2475-L2514 HydrophobicContact CB-CB 4.2Å; K2475-L2514 HydrophobicContact CD-CD1 4.28Å; K2475-L2514 HydrophobicContact CG-CB 4.22Å; K2475-L2514 HydrophobicContact CG-CD1 4.17Å; G2476-L2514 PolarHBondContact N-O 3.09Å
2515	T	92.9	Very high	95	Very high	10.5 Å²	10.5	49.6 Å²	49.6	6%	0.064	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	147.3	175.9	57.3	0	0	0	0	110.8	L2469 Q2473 G2476 H2510 T2513	L2469-T2515 HydrophobicContact CD1-CG2 4.41Å; L2469-T2515 HydrophobicContact CD2-CG2 3.63Å; Q2473-T2515 VanDerWaalsContact O-CG2 3.25Å; Q2473-T2515 WeakPolarHBondContact O-CG2 3.43Å; G2476-T2515 VanDerWaalsContact O-CA 3.32Å; G2476-T2515 WeakPolarHBondContact O-CA 3.4Å; G2476-T2515 WeakPolarHBondContact O-CB 3.47Å; G2476-T2515 WeakPolarHBondContact O-CG2 3.46Å; H2510-T2515 HydrophobicContact CB-CG2 4.13Å; H2510-T2515 WeakPolarHBondContact CB-OG1 3.23Å; H2510-T2515 PolarHBondContact N-OG1 3.23Å; H2510-T2515 VanDerWaalsContact N-OG1 3.14Å; H2510-T2515 PolarHBondContact O-OG1 3.16Å; T2513-T2515 VanDerWaalsContact C-N 3.28Å; T2513-T2515 PolarHBondContact O-N 3.31Å; T2513-T2515 WeakPolarHBondContact OG1-CB 3.49Å; T2513-T2515 VanDerWaalsContact OG1-CG2 3.28Å; T2513-T2515 WeakPolarHBondContact OG1-CG2 3.37Å; T2513-T2515 PolarHBondContact OG1-N 2.82Å; T2513-T2515 PolarHBondContact OG1-OG1 2.96Å
2516	T	94.1	Very high	95	Very high	64.5 Å²	64.5	46.8 Å²	46.8	40%	0.396	23%	0.228	S	C	.	.	P	Polyproline II helix	trans	-72.2	153	179.9	60	0	0	0	0	111.5	G2476 E2477 S2478 Y2509	G2476-T2516 PolarHBondContact O-N 3.09Å; G2476-T2516 VanDerWaalsContact O-N 3.11Å; E2477-T2516 HydrophobicContact CG-CG2 4.47Å; S2478-T2516 WeakPolarHBondContact CB-O 3.36Å; S2478-T2516 PolarHBondContact N-OG1 3.05Å; S2478-T2516 PolarHBondContact OG-O 3.14Å; Y2509-T2516 VanDerWaalsContact CB-O 3.29Å; Y2509-T2516 WeakPolarHBondContact CB-O 3.41Å
2517	K	95	Very high	95	Very high	94 Å²	94	46.5 Å²	46.5	41%	0.409	23%	0.226	S	C	.	.	P	Polyproline II helix	trans	-90.6	134.9	176.9	-56.3	-177.1	-179.1	-175.8	0	110.7	D2502 V2507 Y2509	D2502-K2517 VanDerWaalsContact CG-NZ 3.31Å; D2502-K2517 IonicContact OD1-NZ 3.23Å; D2502-K2517 PolarHBondContact OD1-NZ 2.96Å; D2502-K2517 IonicContact OD2-NZ 3.13Å; D2502-K2517 PolarHBondContact OD2-NZ 2.77Å; V2507-K2517 HydrophobicContact CB-CB 4.48Å; V2507-K2517 HydrophobicContact CG2-CD 4.31Å; Y2509-K2517 HydrophobicContact CD1-CB 4.34Å; Y2509-K2517 HydrophobicContact CD1-CD 4.18Å; Y2509-K2517 HydrophobicContact CD1-CG 3.83Å; Y2509-K2517 HydrophobicContact CD2-CG 4.46Å; Y2509-K2517 HydrophobicContact CE1-CD 4.16Å; Y2509-K2517 HydrophobicContact CE1-CG 4.21Å; Y2509-K2517 HydrophobicContact CG-CD 4.42Å; Y2509-K2517 HydrophobicContact CG-CG 3.97Å
2518	I	95.6	Very high	95	Very high	18 Å²	18	51.4 Å²	51.4	9%	0.092	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	150.9	171.7	58.7	175.5	0	0	0	111.5	S2478 V2480 Y2483 V2507 I2508 F2520 V2523	S2478-I2518 VanDerWaalsContact O-CG2 3.28Å; S2478-I2518 WeakPolarHBondContact O-CG2 3.38Å; V2480-I2518 HydrophobicContact CG2-CB 3.91Å; V2480-I2518 HydrophobicContact CG2-CD1 4.15Å; V2480-I2518 HydrophobicContact CG2-CG1 4.48Å; V2480-I2518 HydrophobicContact CG2-CG2 4.18Å; Y2483-I2518 HydrophobicContact CE2-CD1 4.06Å; V2507-I2518 CarbonylContact C-O 3.58Å; V2507-I2518 WeakPolarHBondContact CA-O 3.36Å; I2508-I2518 HydrophobicContact CB-CD1 4.41Å; I2508-I2518 HydrophobicContact CB-CG1 3.91Å; I2508-I2518 HydrophobicContact CG2-CD1 4.37Å; I2508-I2518 HydrophobicContact CG2-CG1 4.28Å; I2508-I2518 PolarHBondContact N-O 3.03Å; I2508-I2518 VanDerWaalsContact O-CG1 3.29Å; I2508-I2518 WeakPolarHBondContact O-CG1 3.43Å; I2508-I2518 PolarHBondContact O-N 2.98Å; I2518-F2520 PolarHBondContact O-N 3.27Å; I2518-V2523 HydrophobicContact CD1-CG2 3.69Å; I2518-V2523 HydrophobicContact CG1-CG2 4.21Å
2519	N	95.4	Very high	94.8	Very high	48.25 Å²	48.25	57.7 Å²	57.7	26%	0.258	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	125.7	-175.9	-176.1	-79.3	0	0	0	111.7	R2521 Q2522 V2523	N2519-R2521 VanDerWaalsContact C-N 3.31Å; N2519-R2521 PolarHBondContact O-N 3.06Å; N2519-R2521 WeakPolarHBondContact OD1-CA 3.3Å; N2519-R2521 VanDerWaalsContact OD1-CB 3.3Å; N2519-R2521 WeakPolarHBondContact OD1-CB 3.36Å; N2519-R2521 PolarHBondContact OD1-N 3.25Å; N2519-Q2522 HydrophobicContact CB-CB 4.3Å; N2519-Q2522 HydrophobicContact CB-CG 4.08Å; N2519-Q2522 PolarHBondContact O-N 2.85Å; N2519-Q2522 PolarHBondContact OD1-N 2.94Å; N2519-V2523 WeakPolarHBondContact O-CG2 3.32Å; N2519-V2523 PolarHBondContact O-N 2.99Å
2520	F	97.6	Very high	94.7	Very high	0.5 Å²	0.5	56.2 Å²	56.2	0%	0.002	26%	0.261	C	S	.	.	H	α-helix	trans	-57.3	-43.3	-178.8	174.8	-89.8	0	0	0	113	F2496 P2506 I2508 I2518 Q2522 V2523 V2524 M2555 T2558 F2559	F2496-F2520 HydrophobicContact CD1-CD2 4.13Å; F2496-F2520 AromaticContact CD1-CE2 3.75Å; F2496-F2520 HydrophobicContact CD1-CE2 3.75Å; F2496-F2520 HydrophobicContact CD2-CD2 4.31Å; F2496-F2520 AromaticContact CD2-CE2 3.83Å; F2496-F2520 HydrophobicContact CD2-CE2 3.83Å; F2496-F2520 HydrophobicContact CE1-CE2 4.13Å; F2496-F2520 HydrophobicContact CE2-CE2 4.28Å; P2506-F2520 HydrophobicContact CB-CB 3.88Å; P2506-F2520 HydrophobicContact CB-CD1 4.4Å; P2506-F2520 HydrophobicContact CB-CD2 4.43Å; P2506-F2520 HydrophobicContact CB-CG 4.01Å; P2506-F2520 HydrophobicContact CG-CB 3.89Å; P2506-F2520 HydrophobicContact CG-CD1 3.82Å; P2506-F2520 HydrophobicContact CG-CE1 4.48Å; P2506-F2520 HydrophobicContact CG-CG 3.91Å; P2506-F2520 WeakPolarHBondContact O-CB 3.37Å; P2506-F2520 PolarHBondContact O-N 3.16Å; I2508-F2520 HydrophobicContact CD1-CD2 3.96Å; I2508-F2520 HydrophobicContact CG1-CD2 4.2Å; I2518-F2520 PolarHBondContact O-N 3.27Å; F2520-Q2522 PolarHBondContact O-N 3.02Å; F2520-V2523 WeakPolarHBondContact O-CB 3.42Å; F2520-V2523 PolarHBondContact O-N 3.19Å; F2520-V2523 VanDerWaalsContact O-N 3.14Å; F2520-V2524 HydrophobicContact CD1-CG2 3.96Å; F2520-V2524 HydrophobicContact CE1-CG2 3.54Å; F2520-V2524 VanDerWaalsContact CE1-CG2 3.47Å; F2520-V2524 HydrophobicContact CE2-CG2 4.43Å; F2520-V2524 HydrophobicContact CG-CG2 4.47Å; F2520-V2524 HydrophobicContact CZ-CG2 3.81Å; F2520-V2524 VanDerWaalsContact O-CG2 3.3Å; F2520-V2524 WeakPolarHBondContact O-CG2 3.39Å; F2520-V2524 PolarHBondContact O-N 3.12Å; F2520-M2555 HydrophobicContact CD1-CG 4.42Å; F2520-M2555 HydrophobicContact CD2-CE 4.48Å; F2520-M2555 HydrophobicContact CD2-CG 4.41Å; F2520-M2555 HydrophobicContact CE1-CB 4.04Å; F2520-M2555 HydrophobicContact CE1-CG 4.02Å; F2520-M2555 HydrophobicContact CE2-CB 4.38Å; F2520-M2555 HydrophobicContact CE2-CE 3.87Å; F2520-M2555 HydrophobicContact CE2-CG 3.97Å; F2520-M2555 HydrophobicContact CZ-CB 3.75Å; F2520-M2555 HydrophobicContact CZ-CE 4.26Å; F2520-M2555 HydrophobicContact CZ-CG 3.77Å; F2520-T2558 HydrophobicContact CD1-CG2 4.12Å; F2520-T2558 HydrophobicContact CE1-CG2 3.84Å; F2520-F2559 HydrophobicContact CE2-CE1 4.5Å; F2520-F2559 HydrophobicContact CE2-CE2 4.41Å; F2520-F2559 AromaticContact CE2-CZ 3.96Å; F2520-F2559 HydrophobicContact CE2-CZ 3.96Å; F2520-F2559 HydrophobicContact CZ-CD1 4.41Å; F2520-F2559 HydrophobicContact CZ-CD2 4.32Å; F2520-F2559 AromaticContact CZ-CE1 3.86Å; F2520-F2559 HydrophobicContact CZ-CE1 3.86Å; F2520-F2559 AromaticContact CZ-CE2 3.73Å; F2520-F2559 HydrophobicContact CZ-CE2 3.73Å; F2520-F2559 AromaticContact CZ-CZ 3.49Å; F2520-F2559 HydrophobicContact CZ-CZ 3.49Å; F2520-F2559 VanDerWaalsContact CZ-CZ 3.46Å
2521	R	96	Very high	94.7	Very high	129 Å²	129	54.1 Å²	54.1	49%	0.487	25%	0.251	S	S	.	.	H	α-helix	trans	-64.7	-41	-176.9	-177.5	176.1	179.5	156.8	-0.5	111.7	N2519 V2523 V2524 E2525 T2558	N2519-R2521 VanDerWaalsContact C-N 3.31Å; N2519-R2521 PolarHBondContact O-N 3.06Å; N2519-R2521 WeakPolarHBondContact OD1-CA 3.3Å; N2519-R2521 VanDerWaalsContact OD1-CB 3.3Å; N2519-R2521 WeakPolarHBondContact OD1-CB 3.36Å; N2519-R2521 PolarHBondContact OD1-N 3.25Å; R2521-V2523 VanDerWaalsContact C-N 3.28Å; R2521-V2523 PolarHBondContact O-N 3Å; R2521-V2524 PolarHBondContact O-N 3.15Å; R2521-E2525 HydrophobicContact CG-CG 4.43Å; R2521-E2525 WeakPolarHBondContact CG-OE1 3.47Å; R2521-E2525 IonicContact CZ-OE1 2.95Å; R2521-E2525 IonicContact NE-OE1 3.31Å; R2521-E2525 PolarHBondContact NE-OE1 3.32Å; R2521-E2525 VanDerWaalsContact NE-OE1 3.13Å; R2521-E2525 IonicContact NH1-OE1 2.76Å; R2521-E2525 PolarHBondContact NH1-OE1 2.84Å; R2521-E2525 IonicContact NH2-OE1 3.47Å; R2521-E2525 PolarHBondContact NH2-OE1 2.88Å; R2521-E2525 WeakPolarHBondContact O-CB 3.39Å; R2521-E2525 WeakPolarHBondContact O-CG 3.25Å; R2521-E2525 PolarHBondContact O-N 2.94Å; R2521-T2558 HydrophobicContact CB-CG2 4.23Å; R2521-T2558 HydrophobicContact CG-CG2 4.07Å
2522	Q	94.8	Very high	95	Very high	89.25 Å²	89.25	55.4 Å²	55.4	42%	0.417	25%	0.254	S	S	.	.	H	α-helix	trans	-60.5	-39.1	174.5	-68.8	179.8	-21.3	0	0	111.6	V2480 N2519 F2520 E2525 I2526	V2480-Q2522 HydrophobicContact CG1-CB 4.29Å; V2480-Q2522 HydrophobicContact CG2-CB 4.32Å; N2519-Q2522 HydrophobicContact CB-CB 4.3Å; N2519-Q2522 HydrophobicContact CB-CG 4.08Å; N2519-Q2522 PolarHBondContact O-N 2.85Å; N2519-Q2522 PolarHBondContact OD1-N 2.94Å; F2520-Q2522 PolarHBondContact O-N 3.02Å; Q2522-E2525 PolarHBondContact O-N 3.2Å; Q2522-I2526 PolarHBondContact O-N 3.13Å
2523	V	97.4	Very high	95.1	Very high	0 Å²	0	52 Å²	52	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-64.3	-44.1	174.8	177.2	0	0	0	0	111.8	V2480 Y2483 F2496 I2508 I2518 N2519 F2520 R2521 E2525 I2526 V2527	V2480-V2523 HydrophobicContact CB-CG2 4.4Å; V2480-V2523 HydrophobicContact CG1-CG2 4.21Å; V2480-V2523 HydrophobicContact CG2-CG2 3.96Å; Y2483-V2523 HydrophobicContact CD1-CG1 4.2Å; Y2483-V2523 HydrophobicContact CD2-CB 4.43Å; Y2483-V2523 HydrophobicContact CD2-CG1 3.56Å; Y2483-V2523 VanDerWaalsContact CD2-CG1 3.46Å; Y2483-V2523 HydrophobicContact CD2-CG2 4.14Å; Y2483-V2523 HydrophobicContact CE1-CG1 4.1Å; Y2483-V2523 HydrophobicContact CE2-CB 4.34Å; Y2483-V2523 HydrophobicContact CE2-CG1 3.42Å; Y2483-V2523 VanDerWaalsContact CE2-CG1 3.47Å; Y2483-V2523 HydrophobicContact CE2-CG2 3.87Å; Y2483-V2523 HydrophobicContact CG-CG1 3.93Å; F2496-V2523 HydrophobicContact CD1-CG1 4.32Å; F2496-V2523 HydrophobicContact CD2-CG1 4.48Å; F2496-V2523 HydrophobicContact CE1-CB 4.41Å; F2496-V2523 HydrophobicContact CE1-CG1 3.71Å; F2496-V2523 HydrophobicContact CE2-CB 4.46Å; F2496-V2523 HydrophobicContact CE2-CG1 3.94Å; F2496-V2523 HydrophobicContact CZ-CB 4.48Å; F2496-V2523 HydrophobicContact CZ-CG1 3.46Å; I2508-V2523 HydrophobicContact CD1-CB 4.07Å; I2508-V2523 HydrophobicContact CD1-CG1 4.02Å; I2508-V2523 HydrophobicContact CD1-CG2 4.08Å; I2518-V2523 HydrophobicContact CD1-CG2 3.69Å; I2518-V2523 HydrophobicContact CG1-CG2 4.21Å; N2519-V2523 WeakPolarHBondContact O-CG2 3.32Å; N2519-V2523 PolarHBondContact O-N 2.99Å; F2520-V2523 WeakPolarHBondContact O-CB 3.42Å; F2520-V2523 PolarHBondContact O-N 3.19Å; F2520-V2523 VanDerWaalsContact O-N 3.14Å; R2521-V2523 VanDerWaalsContact C-N 3.28Å; R2521-V2523 PolarHBondContact O-N 3Å; V2523-E2525 VanDerWaalsContact C-N 3.31Å; V2523-E2525 PolarHBondContact O-N 3.23Å; V2523-I2526 VanDerWaalsContact O-CG2 3.28Å; V2523-I2526 WeakPolarHBondContact O-CG2 3.36Å; V2523-I2526 PolarHBondContact O-N 2.97Å; V2523-V2527 HydrophobicContact CG1-CG2 4.46Å; V2523-V2527 WeakPolarHBondContact O-CB 3.32Å; V2523-V2527 VanDerWaalsContact O-CG2 3.28Å; V2523-V2527 WeakPolarHBondContact O-CG2 3.34Å; V2523-V2527 PolarHBondContact O-N 2.94Å; V2523-V2527 VanDerWaalsContact O-N 3.12Å
2524	V	98	Very high	95	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-63	-39.6	176	-171.9	0	0	0	0	111.2	F2496 F2520 R2521 V2527 R2528 T2558 F2559 V2562 F2563	F2496-V2524 HydrophobicContact CE1-CG2 4.05Å; F2496-V2524 HydrophobicContact CE2-CG2 4.15Å; F2520-V2524 HydrophobicContact CD1-CG2 3.96Å; F2520-V2524 HydrophobicContact CE1-CG2 3.54Å; F2520-V2524 VanDerWaalsContact CE1-CG2 3.47Å; F2520-V2524 HydrophobicContact CE2-CG2 4.43Å; F2520-V2524 HydrophobicContact CG-CG2 4.47Å; F2520-V2524 HydrophobicContact CZ-CG2 3.81Å; F2520-V2524 VanDerWaalsContact O-CG2 3.3Å; F2520-V2524 WeakPolarHBondContact O-CG2 3.39Å; F2520-V2524 PolarHBondContact O-N 3.12Å; R2521-V2524 PolarHBondContact O-N 3.15Å; V2524-V2527 PolarHBondContact O-N 3.05Å; V2524-R2528 WeakPolarHBondContact O-CB 3.36Å; V2524-R2528 PolarHBondContact O-N 3.26Å; V2524-T2558 HydrophobicContact CB-CG2 4.36Å; V2524-T2558 HydrophobicContact CG2-CG2 4.16Å; V2524-F2559 HydrophobicContact CG1-CD1 3.94Å; V2524-F2559 HydrophobicContact CG1-CE1 4.37Å; V2524-F2559 HydrophobicContact CG2-CD1 4.03Å; V2524-F2559 HydrophobicContact CG2-CE1 3.84Å; V2524-V2562 HydrophobicContact CB-CB 4.49Å; V2524-V2562 HydrophobicContact CB-CG1 4.32Å; V2524-V2562 HydrophobicContact CG1-CB 3.69Å; V2524-V2562 HydrophobicContact CG1-CG1 3.68Å; V2524-V2562 HydrophobicContact CG1-CG2 4.31Å; V2524-F2563 HydrophobicContact CG1-CD1 4.39Å; V2524-F2563 HydrophobicContact CG1-CD2 4.15Å; V2524-F2563 HydrophobicContact CG1-CE1 4.03Å; V2524-F2563 HydrophobicContact CG1-CE2 3.7Å; V2524-F2563 HydrophobicContact CG1-CG 4.45Å; V2524-F2563 HydrophobicContact CG1-CZ 3.62Å; V2524-F2563 WeakPolarHBondContact O-CE1 3.45Å
2525	E	96.3	Very high	95.1	Very high	65.75 Å²	65.75	47.5 Å²	47.5	31%	0.307	22%	0.217	S	C	.	.	H	α-helix	trans	-68.2	-37.9	179.1	-74.3	177.2	-177.1	0	0	113.3	R2521 Q2522 V2523 R2528 R2529 V2562	R2521-E2525 HydrophobicContact CG-CG 4.43Å; R2521-E2525 WeakPolarHBondContact CG-OE1 3.47Å; R2521-E2525 IonicContact CZ-OE1 2.95Å; R2521-E2525 IonicContact NE-OE1 3.31Å; R2521-E2525 PolarHBondContact NE-OE1 3.32Å; R2521-E2525 VanDerWaalsContact NE-OE1 3.13Å; R2521-E2525 IonicContact NH1-OE1 2.76Å; R2521-E2525 PolarHBondContact NH1-OE1 2.84Å; R2521-E2525 IonicContact NH2-OE1 3.47Å; R2521-E2525 PolarHBondContact NH2-OE1 2.88Å; R2521-E2525 WeakPolarHBondContact O-CB 3.39Å; R2521-E2525 WeakPolarHBondContact O-CG 3.25Å; R2521-E2525 PolarHBondContact O-N 2.94Å; Q2522-E2525 PolarHBondContact O-N 3.2Å; V2523-E2525 VanDerWaalsContact C-N 3.31Å; V2523-E2525 PolarHBondContact O-N 3.23Å; E2525-R2528 WeakPolarHBondContact O-CB 3.39Å; E2525-R2528 PolarHBondContact O-N 2.97Å; E2525-R2529 WeakPolarHBondContact O-CG 3.29Å; E2525-R2529 PolarHBondContact O-N 3.03Å; E2525-R2529 PolarHBondContact O-NE 3.1Å; E2525-R2529 IonicContact OE2-NH2 3.67Å; E2525-V2562 HydrophobicContact CB-CG1 4.45Å; E2525-V2562 HydrophobicContact CG-CG1 3.86Å; E2525-V2562 HydrophobicContact CG-CG2 4.18Å
2526	I	94.6	Very high	95.2	Very high	12.75 Å²	12.75	49.4 Å²	49.4	7%	0.065	23%	0.23	C	C	.	.	H	α-helix	trans	-71.6	-37.8	176	-157.2	120.3	0	0	0	111.7	V2480 E2481 R2484 Q2522 V2523 R2528 R2529 S2530	V2480-I2526 HydrophobicContact CG1-CB 4.06Å; V2480-I2526 HydrophobicContact CG1-CD1 4.03Å; V2480-I2526 HydrophobicContact CG1-CG2 3.67Å; E2481-I2526 WeakPolarHBondContact OE2-CD1 3.28Å; R2484-I2526 HydrophobicContact CB-CD1 4.01Å; R2484-I2526 HydrophobicContact CB-CG1 3.95Å; R2484-I2526 HydrophobicContact CG-CD1 4.27Å; R2484-I2526 HydrophobicContact CG-CG1 4.05Å; Q2522-I2526 PolarHBondContact O-N 3.13Å; V2523-I2526 VanDerWaalsContact O-CG2 3.28Å; V2523-I2526 WeakPolarHBondContact O-CG2 3.36Å; V2523-I2526 PolarHBondContact O-N 2.97Å; I2526-R2528 VanDerWaalsContact C-N 3.33Å; I2526-R2528 PolarHBondContact O-N 3.19Å; I2526-R2529 VanDerWaalsContact CD1-NH2 3.34Å; I2526-R2529 PolarHBondContact O-N 3.28Å; I2526-S2530 PolarHBondContact O-N 2.93Å; I2526-S2530 VanDerWaalsContact O-N 3.1Å; I2526-S2530 PolarHBondContact O-OG 2.9Å
2527	V	97.6	Very high	95.3	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-64.2	-40.2	174.2	171.5	0	0	0	0	110.3	Y2483 L2487 I2494 F2496 V2523 V2524 R2529 S2530 A2531 I2541 F2563	Y2483-V2527 HydrophobicContact CD1-CG2 4.35Å; Y2483-V2527 HydrophobicContact CG-CG2 4.39Å; L2487-V2527 HydrophobicContact CD1-CB 4.35Å; L2487-V2527 HydrophobicContact CD1-CG1 4.11Å; L2487-V2527 HydrophobicContact CD1-CG2 4.08Å; I2494-V2527 HydrophobicContact CD1-CB 4.46Å; I2494-V2527 HydrophobicContact CD1-CG1 3.96Å; I2494-V2527 HydrophobicContact CD1-CG2 3.7Å; F2496-V2527 HydrophobicContact CE1-CG2 4.36Å; F2496-V2527 HydrophobicContact CE2-CG2 4.42Å; F2496-V2527 HydrophobicContact CZ-CG2 4.14Å; V2523-V2527 HydrophobicContact CG1-CG2 4.46Å; V2523-V2527 WeakPolarHBondContact O-CB 3.32Å; V2523-V2527 VanDerWaalsContact O-CG2 3.28Å; V2523-V2527 WeakPolarHBondContact O-CG2 3.34Å; V2523-V2527 PolarHBondContact O-N 2.94Å; V2523-V2527 VanDerWaalsContact O-N 3.12Å; V2524-V2527 PolarHBondContact O-N 3.05Å; V2527-R2529 VanDerWaalsContact C-N 3.28Å; V2527-R2529 PolarHBondContact O-N 3.2Å; V2527-S2530 PolarHBondContact O-N 2.89Å; V2527-A2531 HydrophobicContact CG1-CB 4.3Å; V2527-A2531 WeakPolarHBondContact O-CA 3.44Å; V2527-A2531 WeakPolarHBondContact O-CB 3.33Å; V2527-A2531 PolarHBondContact O-N 3.03Å; V2527-I2541 HydrophobicContact CG1-CD1 4.47Å; V2527-F2563 HydrophobicContact CB-CE1 4.33Å; V2527-F2563 HydrophobicContact CB-CZ 4.24Å; V2527-F2563 HydrophobicContact CG1-CE1 3.93Å; V2527-F2563 HydrophobicContact CG1-CZ 3.78Å
2528	R	96.1	Very high	95.5	Very high	115.5 Å²	115.5	42.2 Å²	42.2	44%	0.436	19%	0.194	S	C	.	.	H	α-helix	trans	-56.6	-40	175.9	-175.3	-158.8	156.1	125.3	-2.8	112.2	V2524 E2525 I2526 V2562 F2563 R2566	V2524-R2528 WeakPolarHBondContact O-CB 3.36Å; V2524-R2528 PolarHBondContact O-N 3.26Å; E2525-R2528 WeakPolarHBondContact O-CB 3.39Å; E2525-R2528 PolarHBondContact O-N 2.97Å; I2526-R2528 VanDerWaalsContact C-N 3.33Å; I2526-R2528 PolarHBondContact O-N 3.19Å; R2528-V2562 HydrophobicContact CB-CG1 4.01Å; R2528-V2562 WeakPolarHBondContact CD-O 3.25Å; R2528-V2562 HydrophobicContact CG-CG1 4.33Å; R2528-V2562 WeakPolarHBondContact CG-O 3.27Å; R2528-V2562 PolarHBondContact NE-O 2.93Å; R2528-V2562 PolarHBondContact NH1-O 3.39Å; R2528-F2563 HydrophobicContact CB-CD1 4.01Å; R2528-F2563 HydrophobicContact CB-CE1 3.99Å; R2528-F2563 HydrophobicContact CG-CD1 4.31Å; R2528-R2566 PolarHBondContact O-NH1 3.15Å
2529	R	93.1	Very high	95.6	Very high	131.5 Å²	131.5	41.4 Å²	41.4	50%	0.496	19%	0.19	S	C	.	.	H	α-helix	trans	-70.1	-49.5	179.5	-68.7	176.5	-95.9	173.8	-3.3	111.1	E2013 E2525 I2526 V2527	E2013-R2529 IonicContact OE2-CZ 3.28Å; E2013-R2529 IonicContact OE2-NH1 3.04Å; E2013-R2529 PolarHBondContact OE2-NH1 3.27Å; E2013-R2529 IonicContact OE2-NH2 2.86Å; E2013-R2529 PolarHBondContact OE2-NH2 2.66Å; E2525-R2529 WeakPolarHBondContact O-CG 3.29Å; E2525-R2529 PolarHBondContact O-N 3.03Å; E2525-R2529 PolarHBondContact O-NE 3.1Å; E2525-R2529 IonicContact OE2-NH2 3.67Å; I2526-R2529 VanDerWaalsContact CD1-NH2 3.34Å; I2526-R2529 PolarHBondContact O-N 3.28Å; V2527-R2529 VanDerWaalsContact C-N 3.28Å; V2527-R2529 PolarHBondContact O-N 3.2Å
2530	S	94.5	Very high	95.7	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-94.7	-18.8	-166.1	57.3	0	0	0	0	116.6	L2487 I2526 V2527 F2532 E2533	L2487-S2530 WeakPolarHBondContact CD1-OG 3.44Å; I2526-S2530 PolarHBondContact O-N 2.93Å; I2526-S2530 VanDerWaalsContact O-N 3.1Å; I2526-S2530 PolarHBondContact O-OG 2.9Å; V2527-S2530 PolarHBondContact O-N 2.89Å; S2530-F2532 PolarHBondContact O-N 2.95Å; S2530-E2533 VanDerWaalsContact CA-OE1 3.26Å; S2530-E2533 WeakPolarHBondContact CA-OE1 3.27Å; S2530-E2533 PolarHBondContact O-N 2.97Å
2531	A	95.7	Very high	95.8	Very high	0.5 Å²	0.5	39.2 Å²	39.2	0%	0.004	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.8	-33.5	-172.7	0	0	0	0	0	114.3	L2487 R2492 V2527 V2539	L2487-A2531 HydrophobicContact CD1-CB 4.5Å; R2492-A2531 PolarHBondContact NH1-O 3.19Å; R2492-A2531 PolarHBondContact NH2-O 3.14Å; V2527-A2531 HydrophobicContact CG1-CB 4.3Å; V2527-A2531 WeakPolarHBondContact O-CA 3.44Å; V2527-A2531 WeakPolarHBondContact O-CB 3.33Å; V2527-A2531 PolarHBondContact O-N 3.03Å; A2531-V2539 HydrophobicContact CB-CG2 4.03Å
2532	F	96.4	Very high	95.9	Very high	40.75 Å²	40.75	33.2 Å²	33.2	18%	0.179	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-121.2	15.9	-173.1	-51.7	-70.1	0	0	0	114.7	S2530 S2535 L2537 V2539 G2591 K2592 V2593	S2530-F2532 PolarHBondContact O-N 2.95Å; F2532-S2535 VanDerWaalsContact CA-O 3.25Å; F2532-S2535 WeakPolarHBondContact CA-O 3.33Å; F2532-L2537 VanDerWaalsContact CE1-O 3.32Å; F2532-L2537 WeakPolarHBondContact CE1-O 3.36Å; F2532-V2539 HydrophobicContact CE1-CG2 4.17Å; F2532-V2539 HydrophobicContact CZ-CG2 4.47Å; F2532-G2591 VanDerWaalsContact CZ-C 3.41Å; F2532-G2591 WeakPolarHBondContact CZ-O 3.39Å; F2532-K2592 WeakPolarHBondContact CZ-O 3.32Å; F2532-V2593 HydrophobicContact CE2-CG2 4.13Å; F2532-V2593 HydrophobicContact CZ-CG2 3.9Å
2533	E	91.4	Very high	96	Very high	100.25 Å²	100.25	29.4 Å²	29.4	47%	0.468	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-47.5	179.3	-75.8	-178.1	-140.9	0	0	112.3	R2484 M2488 S2530	R2484-E2533 IonicContact CZ-OE1 3.02Å; R2484-E2533 IonicContact CZ-OE2 3.47Å; R2484-E2533 IonicContact NH1-OE1 2.66Å; R2484-E2533 PolarHBondContact NH1-OE1 3.33Å; R2484-E2533 IonicContact NH1-OE2 2.72Å; R2484-E2533 IonicContact NH2-OE1 2.86Å; R2484-E2533 PolarHBondContact NH2-OE1 3.41Å; R2484-E2533 IonicContact NH2-OE2 3.72Å; R2484-E2533 PolarHBondContact NH2-OE2 2.97Å; M2488-E2533 HydrophobicContact CE-CB 4.07Å; M2488-E2533 VanDerWaalsContact CE-OE2 3.28Å; M2488-E2533 WeakPolarHBondContact CE-OE2 3.23Å; M2488-E2533 HydrophobicContact SD-CB 3.59Å; M2488-E2533 VanDerWaalsContact SD-CB 3.56Å; M2488-E2533 HydrophobicContact SD-CG 4.33Å; M2488-E2533 VanDerWaalsContact SD-OE2 3.4Å; S2530-E2533 VanDerWaalsContact CA-OE1 3.26Å; S2530-E2533 WeakPolarHBondContact CA-OE1 3.27Å; S2530-E2533 PolarHBondContact O-N 2.97Å
2534	V	90.1	Very high	96	Very high	66 Å²	66	33.2 Å²	33.2	40%	0.4	16%	0.156	S	C	.	.	S	Bend	trans	-95.9	-27	-178.3	-126.6	0	0	0	0	113.5	L2487 M2488	L2487-V2534 WeakPolarHBondContact O-CG2 3.26Å; M2488-V2534 HydrophobicContact CB-CG1 4.42Å; M2488-V2534 HydrophobicContact CB-CG2 4.49Å; M2488-V2534 HydrophobicContact CE-CG1 3.46Å; M2488-V2534 VanDerWaalsContact CE-CG1 3.46Å; M2488-V2534 HydrophobicContact CE-CG2 3.63Å; M2488-V2534 HydrophobicContact SD-CG1 3.75Å; M2488-V2534 HydrophobicContact SD-CG2 3.76Å
2535	S	93.8	Very high	95.8	Very high	11 Å²	11	34.8 Å²	34.8	8%	0.077	17%	0.165	C	C	.	.			trans	-143.9	127.4	-178.5	178.8	0	0	0	0	110.7	R2492 F2532 L2537 C2895	R2492-S2535 PolarHBondContact NH1-O 3.05Å; F2532-S2535 VanDerWaalsContact CA-O 3.25Å; F2532-S2535 WeakPolarHBondContact CA-O 3.33Å; S2535-L2537 VanDerWaalsContact C-N 3.27Å; S2535-L2537 PolarHBondContact O-N 3.22Å; S2535-L2537 WeakPolarHBondContact OG-CB 3.43Å; S2535-L2537 PolarHBondContact OG-N 3.31Å; S2535-C2895 WeakPolarHBondContact CB-O 3.31Å; S2535-C2895 WeakPolarHBondContact OG-CA 3.28Å; S2535-C2895 PolarHBondContact OG-O 3.14Å
2536	S	95.4	Very high	95.8	Very high	49.25 Å²	49.25	35.2 Å²	35.2	34%	0.344	17%	0.167	S	C	.	.			trans	-78.8	-3.8	176.1	65.7	0	0	0	0	114.1	K2590 G2591	S2536-K2590 CarbonylContact O-C 3.48Å; S2536-K2590 VanDerWaalsContact O-CA 3.31Å; S2536-K2590 WeakPolarHBondContact O-CA 3.44Å; S2536-K2590 VanDerWaalsContact O-CG 3.31Å; S2536-K2590 WeakPolarHBondContact O-CG 3.39Å; S2536-K2590 VanDerWaalsContact OG-CE 3.3Å; S2536-K2590 WeakPolarHBondContact OG-CE 3.33Å; S2536-G2591 PolarHBondContact O-N 2.92Å
2537	L	96.8	Very high	95.8	Very high	5.75 Å²	5.75	35 Å²	35	3%	0.03	17%	0.166	C	C	.	.	S	Bend	trans	-73.1	155.6	-179.5	-63.7	-177	0	0	0	111.4	M2447 M2452 R2492 F2532 S2535 P2586 L2587 C2895 Y2897	M2447-L2537 HydrophobicContact SD-CD1 3.77Å; M2447-L2537 HydrophobicContact SD-CD2 4.1Å; M2447-L2537 HydrophobicContact SD-CG 3.98Å; M2452-L2537 HydrophobicContact CE-CD1 3.69Å; M2452-L2537 HydrophobicContact CE-CD2 3.75Å; M2452-L2537 HydrophobicContact CE-CG 4.3Å; M2452-L2537 HydrophobicContact SD-CD1 4.07Å; R2492-L2537 PolarHBondContact NH1-O 2.94Å; R2492-L2537 VanDerWaalsContact NH1-O 3.16Å; F2532-L2537 VanDerWaalsContact CE1-O 3.32Å; F2532-L2537 WeakPolarHBondContact CE1-O 3.36Å; S2535-L2537 VanDerWaalsContact C-N 3.27Å; S2535-L2537 PolarHBondContact O-N 3.22Å; S2535-L2537 WeakPolarHBondContact OG-CB 3.43Å; S2535-L2537 PolarHBondContact OG-N 3.31Å; L2537-P2586 HydrophobicContact CD1-CB 4.4Å; L2537-P2586 HydrophobicContact CD2-CB 4.14Å; L2537-P2586 WeakPolarHBondContact CD2-O 3.36Å; L2537-L2587 HydrophobicContact CD2-CD2 4.21Å; L2537-C2895 HydrophobicContact CD1-CB 3.88Å; L2537-Y2897 HydrophobicContact CB-CD2 3.64Å; L2537-Y2897 HydrophobicContact CB-CE2 3.7Å; L2537-Y2897 HydrophobicContact CD1-CD2 3.52Å; L2537-Y2897 HydrophobicContact CD1-CE2 4.41Å; L2537-Y2897 HydrophobicContact CD1-CG 4.07Å; L2537-Y2897 HydrophobicContact CG-CD2 4.24Å
2538	P	97.9	Very high	95.7	Very high	2.5 Å²	2.5	37.2 Å²	37.2	2%	0.016	18%	0.182	C	C	.	.			trans	-57.8	150.9	-172.6	21.8	-35.4	0	0	0	114	P2586 L2589 K2592 L2594 Y2897	P2538-P2586 VanDerWaalsContact CD-O 3.27Å; P2538-P2586 WeakPolarHBondContact CD-O 3.41Å; P2538-L2589 HydrophobicContact CB-CB 3.91Å; P2538-L2589 WeakPolarHBondContact CB-O 3.19Å; P2538-L2589 HydrophobicContact CG-CB 3.74Å; P2538-L2589 HydrophobicContact CG-CD1 4.49Å; P2538-K2592 VanDerWaalsContact CA-O 3.25Å; P2538-K2592 WeakPolarHBondContact CA-O 3.44Å; P2538-K2592 WeakPolarHBondContact CB-O 3.42Å; P2538-L2594 HydrophobicContact CB-CD1 4.39Å; P2538-Y2897 HydrophobicContact CG-CE2 4.25Å; P2538-Y2897 WeakPolarHBondContact O-CE2 3.46Å; P2538-Y2897 PolarHBondContact O-OH 3.05Å
2539	V	98.5	Very high	95.6	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	131.5	173.8	174.7	0	0	0	0	109.7	L2487 R2492 I2494 A2531 F2532 K2592 V2593 L2594	L2487-V2539 HydrophobicContact CD2-CG1 4.05Å; L2487-V2539 HydrophobicContact CD2-CG2 4.08Å; R2492-V2539 VanDerWaalsContact NH1-CG2 3.31Å; R2492-V2539 CarbonylContact O-C 3.53Å; R2492-V2539 VanDerWaalsContact O-CA 3.3Å; R2492-V2539 WeakPolarHBondContact O-CA 3.44Å; I2494-V2539 HydrophobicContact CD1-CG1 4.25Å; I2494-V2539 HydrophobicContact CG1-CG1 4.35Å; A2531-V2539 HydrophobicContact CB-CG2 4.03Å; F2532-V2539 HydrophobicContact CE1-CG2 4.17Å; F2532-V2539 HydrophobicContact CZ-CG2 4.47Å; V2539-K2592 PolarHBondContact N-O 3.18Å; V2539-V2593 CarbonylContact O-C 3.51Å; V2539-V2593 VanDerWaalsContact O-CA 3.31Å; V2539-V2593 WeakPolarHBondContact O-CA 3.37Å; V2539-L2594 PolarHBondContact O-N 2.87Å
2540	I	98.6	Very high	95.7	Very high	3.5 Å²	3.5	33.2 Å²	33.2	2%	0.018	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	124.8	176.7	-54.9	173.9	0	0	0	108.7	I2461 R2492 C2493 I2494 L2594 K2596 M2870	I2461-I2540 HydrophobicContact CD1-CD1 3.97Å; R2492-I2540 PolarHBondContact O-N 2.92Å; C2493-I2540 CarbonylContact C-O 3.1Å; C2493-I2540 VanDerWaalsContact CA-O 3.29Å; C2493-I2540 WeakPolarHBondContact CA-O 3.39Å; C2493-I2540 HydrophobicContact CB-CB 4.23Å; C2493-I2540 PolarHBondContact SG-O 2.92Å; I2494-I2540 PolarHBondContact N-O 3.13Å; I2494-I2540 VanDerWaalsContact N-O 3.08Å; I2540-L2594 WeakPolarHBondContact CA-O 3.32Å; I2540-L2594 HydrophobicContact CG1-CB 4.3Å; I2540-L2594 HydrophobicContact CG1-CD1 4.13Å; I2540-K2596 HydrophobicContact CG2-CB 4.05Å; I2540-M2870 HydrophobicContact CD1-CE 4.25Å; I2540-M2870 HydrophobicContact CD1-SD 4.33Å; I2540-M2870 HydrophobicContact CG2-CE 4.25Å
2541	I	98.6	Very high	95.7	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	108	172.1	-59.1	178.1	0	0	0	107.8	I2494 F2496 V2527 I2543 F2559 F2563 V2593 L2594 I2595 K2596	I2494-I2541 HydrophobicContact CD1-CG1 4.28Å; I2494-I2541 HydrophobicContact CG1-CG1 4.16Å; I2494-I2541 WeakPolarHBondContact O-CA 3.43Å; F2496-I2541 HydrophobicContact CB-CG2 4.32Å; F2496-I2541 HydrophobicContact CD1-CG2 3.88Å; F2496-I2541 HydrophobicContact CD2-CG2 3.83Å; F2496-I2541 HydrophobicContact CE1-CD1 4.47Å; F2496-I2541 HydrophobicContact CE1-CG1 4.45Å; F2496-I2541 HydrophobicContact CE1-CG2 4.04Å; F2496-I2541 HydrophobicContact CE2-CD1 4.36Å; F2496-I2541 HydrophobicContact CE2-CG2 4Å; F2496-I2541 HydrophobicContact CG-CG2 3.78Å; F2496-I2541 HydrophobicContact CZ-CD1 4.16Å; F2496-I2541 HydrophobicContact CZ-CG2 4.09Å; V2527-I2541 HydrophobicContact CG1-CD1 4.47Å; I2541-I2543 HydrophobicContact CG2-CG1 4.07Å; I2541-I2543 PolarHBondContact O-N 3.24Å; I2541-F2559 HydrophobicContact CD1-CE1 4.13Å; I2541-F2559 HydrophobicContact CG2-CZ 4.38Å; I2541-F2563 HydrophobicContact CD1-CE2 3.56Å; I2541-F2563 HydrophobicContact CD1-CZ 3.68Å; I2541-V2593 HydrophobicContact CD1-CG1 3.63Å; I2541-V2593 HydrophobicContact CG1-CG1 4.01Å; I2541-L2594 PolarHBondContact N-O 3.25Å; I2541-I2595 HydrophobicContact CB-CD1 4.1Å; I2541-I2595 HydrophobicContact CD1-CD1 4.22Å; I2541-K2596 PolarHBondContact O-N 3.13Å
2542	S	98.3	Very high	95.8	Very high	3.5 Å²	3.5	34.4 Å²	34.4	2%	0.024	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	111.8	171.1	-176.7	0	0	0	0	108.8	I2494 E2495 F2496 K2596	I2494-S2542 PolarHBondContact O-N 3.03Å; E2495-S2542 CarbonylContact C-O 3.52Å; E2495-S2542 VanDerWaalsContact CA-O 3.31Å; E2495-S2542 WeakPolarHBondContact CA-O 3.38Å; E2495-S2542 WeakPolarHBondContact OE1-CB 3.12Å; E2495-S2542 PolarHBondContact OE1-OG 3.09Å; F2496-S2542 PolarHBondContact N-O 2.97Å; S2542-K2596 WeakPolarHBondContact OG-CD 3.44Å; S2542-K2596 PolarHBondContact OG-NZ 3.25Å
2543	I	97.6	Very high	95.8	Very high	9.25 Å²	9.25	33.6 Å²	33.6	5%	0.047	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	123.1	177.2	-53.2	-179.7	0	0	0	108.7	F2496 I2541 N2545 M2555 F2559 I2595 K2596 N2597 L2742	F2496-I2543 WeakPolarHBondContact O-CA 3.22Å; I2541-I2543 HydrophobicContact CG2-CG1 4.07Å; I2541-I2543 PolarHBondContact O-N 3.24Å; I2543-N2545 HydrophobicContact CG2-CB 3.97Å; I2543-M2555 HydrophobicContact CD1-CE 4.44Å; I2543-M2555 HydrophobicContact CG2-CE 3.95Å; I2543-F2559 HydrophobicContact CD1-CE2 3.58Å; I2543-F2559 HydrophobicContact CD1-CZ 3.82Å; I2543-I2595 HydrophobicContact CD1-CG2 3.55Å; I2543-I2595 HydrophobicContact CG1-CG2 4.27Å; I2543-K2596 PolarHBondContact N-O 3.3Å; I2543-N2597 HydrophobicContact CB-CB 4.36Å; I2543-N2597 HydrophobicContact CD1-CB 4.47Å; I2543-L2742 HydrophobicContact CD1-CD1 4.36Å
2544	E	95.8	Very high	96	Very high	78.75 Å²	78.75	31.5 Å²	31.5	37%	0.368	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	122	155.5	-161	176.2	145	0	0	107.3	F2496 C2498 H2546	F2496-E2544 PolarHBondContact O-N 3.19Å; C2498-E2544 WeakPolarHBondContact CB-O 2.9Å; C2498-E2544 PolarHBondContact N-O 3.4Å; E2544-H2546 WeakPolarHBondContact CG-NE2 3.37Å; E2544-H2546 IonicContact OE1-CD2 2.75Å; E2544-H2546 IonicContact OE1-CE1 2.97Å; E2544-H2546 PolarHBondContact OE1-CE1 3.01Å; E2544-H2546 IonicContact OE1-NE2 3.37Å; E2544-H2546 PolarHBondContact OE1-NE2 3.01Å
2545	N	95.1	Very high	96.4	Very high	33.5 Å²	33.5	28.4 Å²	28.4	18%	0.179	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	101.5	-160.7	-179.8	26.5	0	0	0	111.2	I2543 C2547 Q2552 N2597	I2543-N2545 HydrophobicContact CG2-CB 3.97Å; N2545-C2547 PolarHBondContact OD1-N 3.31Å; N2545-Q2552 VanDerWaalsContact ND2-CD 3.26Å; N2545-Q2552 PolarHBondContact ND2-NE2 3.07Å; N2545-Q2552 PolarHBondContact ND2-OE1 3.03Å; N2545-Q2552 VanDerWaalsContact ND2-OE1 3.13Å; N2545-Q2552 WeakPolarHBondContact OD1-CG 3.41Å; N2545-N2597 PolarHBondContact ND2-ND2 3.33Å
2546	H	95.1	Very high	96.6	Very high	75.25 Å²	75.25	27.9 Å²	27.9	35%	0.348	16%	0.158	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	8.4	176.3	-55.4	-75.3	0	0	0	112.4	D2497 C2498 W2499 E2544	D2497-H2546 IonicContact OD1-CD2 3.35Å; D2497-H2546 PolarHBondContact OD1-CD2 3.17Å; D2497-H2546 VanDerWaalsContact OD1-CD2 3.28Å; D2497-H2546 IonicContact OD1-NE2 3.51Å; D2497-H2546 PolarHBondContact OD1-NE2 2.9Å; C2498-H2546 CarbonylContact O-C 3.52Å; C2498-H2546 WeakPolarHBondContact O-CA 3.33Å; C2498-H2546 WeakPolarHBondContact O-CB 3.36Å; C2498-H2546 PolarHBondContact O-N 3.27Å; W2499-H2546 HydrophobicContact CD2-CB 3.61Å; W2499-H2546 AromaticContact CD2-CG 3.98Å; W2499-H2546 AromaticContact CE2-CD2 3.29Å; W2499-H2546 AromaticContact CE2-CG 3.56Å; W2499-H2546 AromaticContact CE2-NE2 3.91Å; W2499-H2546 HydrophobicContact CE3-CB 3.72Å; W2499-H2546 HydrophobicContact CG-CB 4.19Å; W2499-H2546 HydrophobicContact CH2-CB 3.91Å; W2499-H2546 AromaticContact CH2-CD2 3.98Å; W2499-H2546 AromaticContact CH2-CG 3.73Å; W2499-H2546 AromaticContact CH2-ND1 3.92Å; W2499-H2546 HydrophobicContact CZ2-CB 3.79Å; W2499-H2546 AromaticContact CZ2-CD2 3.25Å; W2499-H2546 WeakPolarHBondContact CZ2-CD2 3.42Å; W2499-H2546 AromaticContact CZ2-CE1 3.94Å; W2499-H2546 AromaticContact CZ2-CG 3.35Å; W2499-H2546 VanDerWaalsContact CZ2-CG 3.4Å; W2499-H2546 AromaticContact CZ2-ND1 3.84Å; W2499-H2546 AromaticContact CZ2-NE2 3.62Å; W2499-H2546 HydrophobicContact CZ3-CB 3.87Å; W2499-H2546 AromaticContact NE1-CD2 3.38Å; W2499-H2546 PolarHBondContact NE1-CD2 3.06Å; W2499-H2546 VanDerWaalsContact NE1-CD2 3.31Å; E2544-H2546 WeakPolarHBondContact CG-NE2 3.37Å; E2544-H2546 IonicContact OE1-CD2 2.75Å; E2544-H2546 IonicContact OE1-CE1 2.97Å; E2544-H2546 PolarHBondContact OE1-CE1 3.01Å; E2544-H2546 IonicContact OE1-NE2 3.37Å; E2544-H2546 PolarHBondContact OE1-NE2 3.01Å
2547	C	95.5	Very high	96.7	Very high	7.5 Å²	7.5	32 Å²	32	5%	0.051	17%	0.171	C	C	.	.			trans	-75.8	150	179.7	-70	0	0	0	0	113.2	C2498 W2499 D2500 N2545 L2551 Q2552 M2555	C2498-C2547 VanDerWaalsContact C-SG 3.57Å; C2498-C2547 PolarHBondContact O-N 2.97Å; C2498-C2547 PolarHBondContact O-SG 2.94Å; W2499-C2547 PolarHBondContact N-SG 2.9Å; W2499-C2547 PolarHBondContact O-SG 3.03Å; W2499-C2547 VanDerWaalsContact O-SG 3.37Å; D2500-C2547 WeakPolarHBondContact OD1-CA 3.42Å; D2500-C2547 VanDerWaalsContact OD1-CB 3.22Å; D2500-C2547 WeakPolarHBondContact OD1-CB 3.44Å; D2500-C2547 PolarHBondContact OD1-SG 3.02Å; N2545-C2547 PolarHBondContact OD1-N 3.31Å; C2547-L2551 HydrophobicContact CB-CB 4.17Å; C2547-Q2552 HydrophobicContact CB-CG 3.83Å; C2547-Q2552 WeakPolarHBondContact O-CG 3.39Å; C2547-Q2552 PolarHBondContact O-NE2 3.01Å; C2547-M2555 HydrophobicContact CB-SD 3.97Å; C2547-M2555 PolarHBondContact SG-SD 2.82Å
2548	S	95	Very high	96.7	Very high	47 Å²	47	32.4 Å²	32.4	33%	0.329	17%	0.174	S	C	.	.			trans	-66.5	155.6	167.4	58.4	0	0	0	0	112.1	D2500 P2550 L2551 Q2552	D2500-S2548 VanDerWaalsContact CG-N 3.33Å; D2500-S2548 PolarHBondContact OD1-N 2.91Å; D2500-S2548 PolarHBondContact OD1-OG 3.17Å; D2500-S2548 WeakPolarHBondContact OD2-CB 3.37Å; D2500-S2548 PolarHBondContact OD2-N 3.05Å; D2500-S2548 VanDerWaalsContact OD2-N 3.1Å; D2500-S2548 PolarHBondContact OD2-OG 3.19Å; S2548-P2550 VanDerWaalsContact C-CD 3.46Å; S2548-P2550 VanDerWaalsContact C-N 3.35Å; S2548-L2551 CarbonylContact O-C 3.56Å; S2548-L2551 WeakPolarHBondContact O-CA 3.33Å; S2548-L2551 PolarHBondContact O-N 3.02Å; S2548-Q2552 WeakPolarHBondContact O-CG 3.39Å; S2548-Q2552 PolarHBondContact O-N 2.96Å
2549	L	95.2	Very high	96.7	Very high	67.5 Å²	67.5	32.3 Å²	32.3	35%	0.353	17%	0.174	S	C	.	.	H	α-helix	trans	-51.8	-42.2	-176.5	-64	175.3	0	0	0	114.5	L2551 Q2552 A2553 P2736 V2738 A2739	L2549-L2551 VanDerWaalsContact C-N 3.32Å; L2549-L2551 PolarHBondContact O-N 3.04Å; L2549-Q2552 WeakPolarHBondContact O-CB 3.36Å; L2549-Q2552 PolarHBondContact O-N 2.95Å; L2549-A2553 PolarHBondContact O-N 3.05Å; L2549-P2736 WeakPolarHBondContact CD2-O 3.43Å; L2549-V2738 VanDerWaalsContact CD2-C 3.48Å; L2549-A2739 HydrophobicContact CD2-CB 4.17Å; L2549-A2739 VanDerWaalsContact CD2-N 3.34Å
2550	P	94.7	Very high	96.7	Very high	95 Å²	95	37 Å²	37	62%	0.617	19%	0.194	S	C	*	.	H	α-helix	trans	-63.1	-38.1	175.8	-22.4	35.2	0	0	0	113.1	S2548 A2553 K2554	S2548-P2550 VanDerWaalsContact C-CD 3.46Å; S2548-P2550 VanDerWaalsContact C-N 3.35Å; P2550-A2553 PolarHBondContact O-N 3.27Å; P2550-K2554 WeakPolarHBondContact O-CB 3.43Å; P2550-K2554 PolarHBondContact O-N 2.92Å; P2550-K2554 VanDerWaalsContact O-N 3.1Å
2551	L	95	Very high	96.6	Very high	19.25 Å²	19.25	40.6 Å²	40.6	10%	0.101	22%	0.219	C	C	.	.	H	α-helix	trans	-76.3	-30.6	178.4	-71.4	171.1	0	0	0	112.1	D2500 G2504 P2506 C2547 S2548 L2549 K2554 M2555	D2500-L2551 HydrophobicContact CB-CD1 3.93Å; D2500-L2551 HydrophobicContact CB-CD2 3.89Å; D2500-L2551 VanDerWaalsContact CG-CD1 3.45Å; D2500-L2551 WeakPolarHBondContact OD1-CB 3.39Å; D2500-L2551 WeakPolarHBondContact OD1-CD1 3.49Å; D2500-L2551 WeakPolarHBondContact OD1-CD2 3.28Å; G2504-L2551 VanDerWaalsContact O-CD2 3.25Å; G2504-L2551 WeakPolarHBondContact O-CD2 3.28Å; P2506-L2551 HydrophobicContact CG-CB 4.36Å; C2547-L2551 HydrophobicContact CB-CB 4.17Å; S2548-L2551 CarbonylContact O-C 3.56Å; S2548-L2551 WeakPolarHBondContact O-CA 3.33Å; S2548-L2551 PolarHBondContact O-N 3.02Å; L2549-L2551 VanDerWaalsContact C-N 3.32Å; L2549-L2551 PolarHBondContact O-N 3.04Å; L2551-K2554 HydrophobicContact CD2-CB 4.44Å; L2551-K2554 HydrophobicContact CD2-CD 3.82Å; L2551-K2554 CarbonylContact O-C 3.44Å; L2551-K2554 WeakPolarHBondContact O-CA 3.49Å; L2551-K2554 WeakPolarHBondContact O-CB 3.38Å; L2551-K2554 PolarHBondContact O-N 3.12Å; L2551-M2555 VanDerWaalsContact O-CG 3.3Å; L2551-M2555 WeakPolarHBondContact O-CG 3.24Å; L2551-M2555 PolarHBondContact O-N 3Å
2552	Q	97.2	Very high	96.5	Very high	6.25 Å²	6.25	41 Å²	41	3%	0.029	22%	0.222	C	C	.	.	H	α-helix	trans	-62.1	-42.9	168	-67	-176.1	35.3	0	0	112.4	N2545 C2547 S2548 L2549 K2554 M2555 A2556 Q2737 V2738 A2739 L2742	N2545-Q2552 VanDerWaalsContact ND2-CD 3.26Å; N2545-Q2552 PolarHBondContact ND2-NE2 3.07Å; N2545-Q2552 PolarHBondContact ND2-OE1 3.03Å; N2545-Q2552 VanDerWaalsContact ND2-OE1 3.13Å; N2545-Q2552 WeakPolarHBondContact OD1-CG 3.41Å; C2547-Q2552 HydrophobicContact CB-CG 3.83Å; C2547-Q2552 WeakPolarHBondContact O-CG 3.39Å; C2547-Q2552 PolarHBondContact O-NE2 3.01Å; S2548-Q2552 WeakPolarHBondContact O-CG 3.39Å; S2548-Q2552 PolarHBondContact O-N 2.96Å; L2549-Q2552 WeakPolarHBondContact O-CB 3.36Å; L2549-Q2552 PolarHBondContact O-N 2.95Å; Q2552-K2554 VanDerWaalsContact C-N 3.27Å; Q2552-K2554 PolarHBondContact O-N 3.11Å; Q2552-M2555 WeakPolarHBondContact O-CB 3.3Å; Q2552-M2555 PolarHBondContact O-N 3.23Å; Q2552-A2556 PolarHBondContact O-N 3.13Å; Q2552-Q2737 PolarHBondContact NE2-O 3.18Å; Q2552-Q2737 VanDerWaalsContact NE2-O 3.11Å; Q2552-V2738 VanDerWaalsContact OE1-CA 3.3Å; Q2552-A2739 HydrophobicContact CB-CB 3.61Å; Q2552-L2742 HydrophobicContact CB-CD2 3.93Å; Q2552-L2742 HydrophobicContact CG-CD2 4.19Å
2553	A	96.3	Very high	96.5	Very high	25 Å²	25	41.1 Å²	41.1	21%	0.207	22%	0.222	C	C	.	.	H	α-helix	trans	-62	-37.5	173.8	0	0	0	0	0	111.4	L2549 P2550 A2556 Q2557 A2739 E2741	L2549-A2553 PolarHBondContact O-N 3.05Å; P2550-A2553 PolarHBondContact O-N 3.27Å; A2553-A2556 WeakPolarHBondContact O-CB 3.42Å; A2553-A2556 PolarHBondContact O-N 3.23Å; A2553-Q2557 PolarHBondContact O-N 3.19Å; A2553-A2739 HydrophobicContact CB-CB 4.48Å; A2553-E2741 HydrophobicContact CB-CB 4.44Å; A2553-E2741 HydrophobicContact CB-CG 4.39Å
2554	K	96.1	Very high	96.4	Very high	56.75 Å²	56.75	42.5 Å²	42.5	25%	0.247	24%	0.239	C	C	.	.	H	α-helix	trans	-68	-36.5	174.9	-162.5	171	-179.2	179.4	0	113.2	G2504 Q2505 P2550 L2551 Q2552 A2556 Q2557 T2558	G2504-K2554 PolarHBondContact O-NZ 3.19Å; Q2505-K2554 VanDerWaalsContact NE2-NZ 3.11Å; P2550-K2554 WeakPolarHBondContact O-CB 3.43Å; P2550-K2554 PolarHBondContact O-N 2.92Å; P2550-K2554 VanDerWaalsContact O-N 3.1Å; L2551-K2554 HydrophobicContact CD2-CB 4.44Å; L2551-K2554 HydrophobicContact CD2-CD 3.82Å; L2551-K2554 CarbonylContact O-C 3.44Å; L2551-K2554 WeakPolarHBondContact O-CA 3.49Å; L2551-K2554 WeakPolarHBondContact O-CB 3.38Å; L2551-K2554 PolarHBondContact O-N 3.12Å; Q2552-K2554 VanDerWaalsContact C-N 3.27Å; Q2552-K2554 PolarHBondContact O-N 3.11Å; K2554-A2556 VanDerWaalsContact C-N 3.34Å; K2554-Q2557 PolarHBondContact O-N 3.18Å; K2554-T2558 WeakPolarHBondContact O-CB 3.33Å; K2554-T2558 PolarHBondContact O-N 2.91Å; K2554-T2558 PolarHBondContact O-OG1 3.25Å
2555	M	97.9	Very high	96.4	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-60.6	-47.3	169.6	-69.1	163.6	62.4	0	0	110.5	C2498 P2506 F2520 I2543 C2547 L2551 Q2552 Q2557 T2558 F2559 L2742	C2498-M2555 HydrophobicContact CB-CE 3.61Å; C2498-M2555 HydrophobicContact CB-SD 4.06Å; C2498-M2555 VanDerWaalsContact SG-CE 3.57Å; C2498-M2555 WeakPolarHBondContact SG-CE 3.44Å; P2506-M2555 HydrophobicContact CB-CG 3.75Å; P2506-M2555 HydrophobicContact CB-SD 4.33Å; P2506-M2555 HydrophobicContact CG-CG 3.8Å; F2520-M2555 HydrophobicContact CD1-CG 4.42Å; F2520-M2555 HydrophobicContact CD2-CE 4.48Å; F2520-M2555 HydrophobicContact CD2-CG 4.41Å; F2520-M2555 HydrophobicContact CE1-CB 4.04Å; F2520-M2555 HydrophobicContact CE1-CG 4.02Å; F2520-M2555 HydrophobicContact CE2-CB 4.38Å; F2520-M2555 HydrophobicContact CE2-CE 3.87Å; F2520-M2555 HydrophobicContact CE2-CG 3.97Å; F2520-M2555 HydrophobicContact CZ-CB 3.75Å; F2520-M2555 HydrophobicContact CZ-CE 4.26Å; F2520-M2555 HydrophobicContact CZ-CG 3.77Å; I2543-M2555 HydrophobicContact CD1-CE 4.44Å; I2543-M2555 HydrophobicContact CG2-CE 3.95Å; C2547-M2555 HydrophobicContact CB-SD 3.97Å; C2547-M2555 PolarHBondContact SG-SD 2.82Å; L2551-M2555 VanDerWaalsContact O-CG 3.3Å; L2551-M2555 WeakPolarHBondContact O-CG 3.24Å; L2551-M2555 PolarHBondContact O-N 3Å; Q2552-M2555 WeakPolarHBondContact O-CB 3.3Å; Q2552-M2555 PolarHBondContact O-N 3.23Å; M2555-Q2557 PolarHBondContact O-N 3.16Å; M2555-T2558 WeakPolarHBondContact O-CB 3.36Å; M2555-T2558 PolarHBondContact O-N 3.06Å; M2555-T2558 VanDerWaalsContact O-N 3.16Å; M2555-F2559 HydrophobicContact CB-CE2 4.47Å; M2555-F2559 VanDerWaalsContact O-CD2 3.27Å; M2555-F2559 WeakPolarHBondContact O-CD2 3.34Å; M2555-F2559 PolarHBondContact O-N 3.01Å; M2555-L2742 HydrophobicContact CE-CD2 4.29Å
2556	A	97.5	Very high	96.5	Very high	0.5 Å²	0.5	50.4 Å²	50.4	0%	0.004	27%	0.271	C	S	.	.	H	α-helix	trans	-61.7	-43	177.8	0	0	0	0	0	112.7	Q2552 A2553 K2554 T2558 F2559 K2560 E2741 L2742 L2745	Q2552-A2556 PolarHBondContact O-N 3.13Å; A2553-A2556 WeakPolarHBondContact O-CB 3.42Å; A2553-A2556 PolarHBondContact O-N 3.23Å; K2554-A2556 VanDerWaalsContact C-N 3.34Å; A2556-T2558 VanDerWaalsContact C-N 3.33Å; A2556-T2558 PolarHBondContact O-N 3.11Å; A2556-F2559 PolarHBondContact O-N 2.99Å; A2556-K2560 WeakPolarHBondContact O-CB 3.44Å; A2556-K2560 WeakPolarHBondContact O-CG 3.22Å; A2556-K2560 PolarHBondContact O-N 3.14Å; A2556-E2741 HydrophobicContact CB-CB 3.94Å; A2556-E2741 VanDerWaalsContact CB-O 3.3Å; A2556-E2741 WeakPolarHBondContact CB-O 3.41Å; A2556-L2742 HydrophobicContact CB-CB 4.1Å; A2556-L2742 HydrophobicContact CB-CD1 4.24Å; A2556-L2745 HydrophobicContact CB-CD1 3.89Å
2557	Q	97.2	Very high	96.6	Very high	134.5 Å²	134.5	47.4 Å²	47.4	63%	0.629	26%	0.257	S	S	*	.	H	α-helix	trans	-60.8	-42.4	173.4	-173	-175.6	13.9	0	0	111.6	A2553 K2554 M2555 K2560 S2561	A2553-Q2557 PolarHBondContact O-N 3.19Å; K2554-Q2557 PolarHBondContact O-N 3.18Å; M2555-Q2557 PolarHBondContact O-N 3.16Å; Q2557-K2560 PolarHBondContact O-N 3.23Å; Q2557-S2561 VanDerWaalsContact O-CB 3.27Å; Q2557-S2561 WeakPolarHBondContact O-CB 3.36Å; Q2557-S2561 PolarHBondContact O-N 3.36Å; Q2557-S2561 PolarHBondContact O-OG 2.91Å; Q2557-S2561 VanDerWaalsContact O-OG 3.06Å
2558	T	97.5	Very high	96.7	Very high	15.75 Å²	15.75	47.1 Å²	47.1	10%	0.097	26%	0.255	C	S	.	.	H	α-helix	trans	-64	-46.2	177.8	-58.8	0	0	0	0	111.1	F2520 R2521 V2524 K2554 M2555 A2556 K2560 S2561 V2562	F2520-T2558 HydrophobicContact CD1-CG2 4.12Å; F2520-T2558 HydrophobicContact CE1-CG2 3.84Å; R2521-T2558 HydrophobicContact CB-CG2 4.23Å; R2521-T2558 HydrophobicContact CG-CG2 4.07Å; V2524-T2558 HydrophobicContact CB-CG2 4.36Å; V2524-T2558 HydrophobicContact CG2-CG2 4.16Å; K2554-T2558 WeakPolarHBondContact O-CB 3.33Å; K2554-T2558 PolarHBondContact O-N 2.91Å; K2554-T2558 PolarHBondContact O-OG1 3.25Å; M2555-T2558 WeakPolarHBondContact O-CB 3.36Å; M2555-T2558 PolarHBondContact O-N 3.06Å; M2555-T2558 VanDerWaalsContact O-N 3.16Å; A2556-T2558 VanDerWaalsContact C-N 3.33Å; A2556-T2558 PolarHBondContact O-N 3.11Å; T2558-K2560 PolarHBondContact O-N 3.1Å; T2558-S2561 WeakPolarHBondContact CA-OG 3.28Å; T2558-S2561 PolarHBondContact O-N 2.95Å; T2558-S2561 PolarHBondContact O-OG 3.05Å; T2558-S2561 VanDerWaalsContact O-OG 3.1Å; T2558-V2562 HydrophobicContact CG2-CG2 4.1Å; T2558-V2562 VanDerWaalsContact O-CB 3.3Å; T2558-V2562 WeakPolarHBondContact O-CB 3.4Å; T2558-V2562 VanDerWaalsContact O-CG2 3.31Å; T2558-V2562 WeakPolarHBondContact O-CG2 3.3Å; T2558-V2562 PolarHBondContact O-N 3.08Å
2559	F	98.3	Very high	96.7	Very high	0 Å²	0	48 Å²	48	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-57.8	-49.2	174.4	-73.6	-49.6	0	0	0	112.3	F2496 F2520 V2524 I2541 I2543 M2555 A2556 S2561 V2562 F2563 L2567 I2595 L2742 L2745	F2496-F2559 HydrophobicContact CD1-CZ 4.49Å; F2496-F2559 HydrophobicContact CD2-CE1 4.41Å; F2496-F2559 HydrophobicContact CD2-CZ 4.25Å; F2496-F2559 HydrophobicContact CE1-CE1 4.31Å; F2496-F2559 HydrophobicContact CE1-CZ 4.46Å; F2496-F2559 AromaticContact CE2-CE1 3.88Å; F2496-F2559 HydrophobicContact CE2-CE1 3.98Å; F2496-F2559 HydrophobicContact CE2-CZ 4.22Å; F2520-F2559 HydrophobicContact CE2-CE1 4.5Å; F2520-F2559 HydrophobicContact CE2-CE2 4.41Å; F2520-F2559 AromaticContact CE2-CZ 3.96Å; F2520-F2559 HydrophobicContact CE2-CZ 3.96Å; F2520-F2559 HydrophobicContact CZ-CD1 4.41Å; F2520-F2559 HydrophobicContact CZ-CD2 4.32Å; F2520-F2559 AromaticContact CZ-CE1 3.86Å; F2520-F2559 HydrophobicContact CZ-CE1 3.86Å; F2520-F2559 AromaticContact CZ-CE2 3.73Å; F2520-F2559 HydrophobicContact CZ-CE2 3.73Å; F2520-F2559 AromaticContact CZ-CZ 3.49Å; F2520-F2559 HydrophobicContact CZ-CZ 3.49Å; F2520-F2559 VanDerWaalsContact CZ-CZ 3.46Å; V2524-F2559 HydrophobicContact CG1-CD1 3.94Å; V2524-F2559 HydrophobicContact CG1-CE1 4.37Å; V2524-F2559 HydrophobicContact CG2-CD1 4.03Å; V2524-F2559 HydrophobicContact CG2-CE1 3.84Å; I2541-F2559 HydrophobicContact CD1-CE1 4.13Å; I2541-F2559 HydrophobicContact CG2-CZ 4.38Å; I2543-F2559 HydrophobicContact CD1-CE2 3.58Å; I2543-F2559 HydrophobicContact CD1-CZ 3.82Å; M2555-F2559 HydrophobicContact CB-CE2 4.47Å; M2555-F2559 VanDerWaalsContact O-CD2 3.27Å; M2555-F2559 WeakPolarHBondContact O-CD2 3.34Å; M2555-F2559 PolarHBondContact O-N 3.01Å; A2556-F2559 PolarHBondContact O-N 2.99Å; F2559-S2561 PolarHBondContact O-N 2.98Å; F2559-V2562 PolarHBondContact O-N 3.44Å; F2559-F2563 HydrophobicContact CB-CD2 4.43Å; F2559-F2563 AromaticContact CD1-CD2 3.86Å; F2559-F2563 HydrophobicContact CD1-CD2 3.86Å; F2559-F2563 AromaticContact CD1-CE2 3.49Å; F2559-F2563 HydrophobicContact CD1-CE2 3.49Å; F2559-F2563 VanDerWaalsContact CD1-CE2 3.46Å; F2559-F2563 HydrophobicContact CD1-CZ 4.49Å; F2559-F2563 AromaticContact CE1-CE2 3.92Å; F2559-F2563 HydrophobicContact CE1-CE2 3.92Å; F2559-F2563 WeakPolarHBondContact O-CB 3.41Å; F2559-F2563 PolarHBondContact O-N 2.97Å; F2559-L2567 HydrophobicContact CB-CD2 3.95Å; F2559-I2595 HydrophobicContact CD1-CD1 4.35Å; F2559-I2595 HydrophobicContact CD2-CD1 4.34Å; F2559-I2595 HydrophobicContact CE1-CD1 4.21Å; F2559-I2595 HydrophobicContact CE2-CD1 4.22Å; F2559-I2595 HydrophobicContact CG-CD1 4.4Å; F2559-I2595 HydrophobicContact CZ-CD1 4.13Å; F2559-L2742 HydrophobicContact CD2-CD1 4.34Å; F2559-L2742 HydrophobicContact CE2-CD1 4.28Å; F2559-L2745 HydrophobicContact CB-CD1 4.03Å; F2559-L2745 HydrophobicContact CD2-CD1 4.24Å
2560	K	97.5	Very high	96.6	Very high	97.25 Å²	97.25	50.9 Å²	50.9	42%	0.423	27%	0.273	S	S	.	.	H	α-helix	trans	-59.5	-46.5	178.3	-72.4	175.8	-178.3	176.9	0	111.5	A2556 Q2557 T2558 G2564 L2567 L2745	A2556-K2560 WeakPolarHBondContact O-CB 3.44Å; A2556-K2560 WeakPolarHBondContact O-CG 3.22Å; A2556-K2560 PolarHBondContact O-N 3.14Å; Q2557-K2560 PolarHBondContact O-N 3.23Å; T2558-K2560 PolarHBondContact O-N 3.1Å; K2560-G2564 WeakPolarHBondContact O-CA 3.4Å; K2560-G2564 PolarHBondContact O-N 3.07Å; K2560-G2564 VanDerWaalsContact O-N 3.09Å; K2560-L2567 HydrophobicContact CG-CD2 4.05Å; K2560-L2745 HydrophobicContact CD-CD2 4.4Å; K2560-L2745 VanDerWaalsContact CE-CD2 3.45Å; K2560-L2745 HydrophobicContact CG-CD1 4.4Å; K2560-L2745 HydrophobicContact CG-CD2 4.04Å
2561	S	97.2	Very high	96.6	Very high	79.25 Å²	79.25	49.3 Å²	49.3	55%	0.554	26%	0.256	S	S	*	.	H	α-helix	trans	-69.8	-37.4	-178	80.7	0	0	0	0	113.8	Q2557 T2558 F2559	Q2557-S2561 VanDerWaalsContact O-CB 3.27Å; Q2557-S2561 WeakPolarHBondContact O-CB 3.36Å; Q2557-S2561 PolarHBondContact O-N 3.36Å; Q2557-S2561 PolarHBondContact O-OG 2.91Å; Q2557-S2561 VanDerWaalsContact O-OG 3.06Å; T2558-S2561 WeakPolarHBondContact CA-OG 3.28Å; T2558-S2561 PolarHBondContact O-N 2.95Å; T2558-S2561 PolarHBondContact O-OG 3.05Å; T2558-S2561 VanDerWaalsContact O-OG 3.1Å; F2559-S2561 PolarHBondContact O-N 2.98Å
2562	V	97.3	Very high	96.5	Very high	9.75 Å²	9.75	51.6 Å²	51.6	6%	0.059	27%	0.268	C	S	.	.	H	α-helix	trans	-88.9	-41.8	-174.8	179.5	0	0	0	0	112	V2524 E2525 R2528 T2558 F2559	V2524-V2562 HydrophobicContact CB-CB 4.49Å; V2524-V2562 HydrophobicContact CB-CG1 4.32Å; V2524-V2562 HydrophobicContact CG1-CB 3.69Å; V2524-V2562 HydrophobicContact CG1-CG1 3.68Å; V2524-V2562 HydrophobicContact CG1-CG2 4.31Å; E2525-V2562 HydrophobicContact CB-CG1 4.45Å; E2525-V2562 HydrophobicContact CG-CG1 3.86Å; E2525-V2562 HydrophobicContact CG-CG2 4.18Å; R2528-V2562 HydrophobicContact CB-CG1 4.01Å; R2528-V2562 WeakPolarHBondContact CD-O 3.25Å; R2528-V2562 HydrophobicContact CG-CG1 4.33Å; R2528-V2562 WeakPolarHBondContact CG-O 3.27Å; R2528-V2562 PolarHBondContact NE-O 2.93Å; R2528-V2562 PolarHBondContact NH1-O 3.39Å; T2558-V2562 HydrophobicContact CG2-CG2 4.1Å; T2558-V2562 VanDerWaalsContact O-CB 3.3Å; T2558-V2562 WeakPolarHBondContact O-CB 3.4Å; T2558-V2562 VanDerWaalsContact O-CG2 3.31Å; T2558-V2562 WeakPolarHBondContact O-CG2 3.3Å; T2558-V2562 PolarHBondContact O-N 3.08Å; F2559-V2562 PolarHBondContact O-N 3.44Å
2563	F	97.8	Very high	96.3	Very high	5 Å²	5	54 Å²	54	2%	0.022	28%	0.279	C	S	.	.	H	α-helix	trans	-85.2	-28.2	179.6	-68	-44.6	0	0	0	113.7	V2524 V2527 R2528 I2541 F2559 E2565 R2566 L2567 V2593	V2524-F2563 HydrophobicContact CG1-CD1 4.39Å; V2524-F2563 HydrophobicContact CG1-CD2 4.15Å; V2524-F2563 HydrophobicContact CG1-CE1 4.03Å; V2524-F2563 HydrophobicContact CG1-CE2 3.7Å; V2524-F2563 HydrophobicContact CG1-CG 4.45Å; V2524-F2563 HydrophobicContact CG1-CZ 3.62Å; V2524-F2563 WeakPolarHBondContact O-CE1 3.45Å; V2527-F2563 HydrophobicContact CB-CE1 4.33Å; V2527-F2563 HydrophobicContact CB-CZ 4.24Å; V2527-F2563 HydrophobicContact CG1-CE1 3.93Å; V2527-F2563 HydrophobicContact CG1-CZ 3.78Å; R2528-F2563 HydrophobicContact CB-CD1 4.01Å; R2528-F2563 HydrophobicContact CB-CE1 3.99Å; R2528-F2563 HydrophobicContact CG-CD1 4.31Å; I2541-F2563 HydrophobicContact CD1-CE2 3.56Å; I2541-F2563 HydrophobicContact CD1-CZ 3.68Å; F2559-F2563 HydrophobicContact CB-CD2 4.43Å; F2559-F2563 AromaticContact CD1-CD2 3.86Å; F2559-F2563 HydrophobicContact CD1-CD2 3.86Å; F2559-F2563 AromaticContact CD1-CE2 3.49Å; F2559-F2563 HydrophobicContact CD1-CE2 3.49Å; F2559-F2563 VanDerWaalsContact CD1-CE2 3.46Å; F2559-F2563 HydrophobicContact CD1-CZ 4.49Å; F2559-F2563 AromaticContact CE1-CE2 3.92Å; F2559-F2563 HydrophobicContact CE1-CE2 3.92Å; F2559-F2563 WeakPolarHBondContact O-CB 3.41Å; F2559-F2563 PolarHBondContact O-N 2.97Å; F2563-E2565 PolarHBondContact O-N 3.15Å; F2563-R2566 WeakPolarHBondContact O-CB 3.27Å; F2563-R2566 PolarHBondContact O-N 3.37Å; F2563-R2566 VanDerWaalsContact O-N 3.15Å; F2563-L2567 HydrophobicContact CB-CB 3.89Å; F2563-L2567 HydrophobicContact CD2-CD1 4.32Å; F2563-V2593 HydrophobicContact CD1-CG2 4.31Å; F2563-V2593 HydrophobicContact CD2-CG1 4.16Å; F2563-V2593 HydrophobicContact CE1-CG2 4.42Å; F2563-V2593 HydrophobicContact CE2-CG1 3.9Å; F2563-V2593 HydrophobicContact CG-CG2 4.47Å; F2563-V2593 HydrophobicContact CZ-CG1 4.27Å
2564	G	95.9	Very high	95.8	Very high	39 Å²	39	61.4 Å²	61.4	40%	0.402	31%	0.309	S	S	.	.	G	3₁₀ helix	trans	53.6	-132.5	-178	0	0	0	0	0	112	K2560 R2566 L2567	K2560-G2564 WeakPolarHBondContact O-CA 3.4Å; K2560-G2564 PolarHBondContact O-N 3.07Å; K2560-G2564 VanDerWaalsContact O-N 3.09Å; G2564-R2566 PolarHBondContact O-N 3.1Å; G2564-R2566 VanDerWaalsContact O-N 3.09Å; G2564-L2567 WeakPolarHBondContact O-CB 3.29Å; G2564-L2567 PolarHBondContact O-N 3.15Å
2565	E	95	Very high	95.4	Very high	178 Å²	178	62.9 Å²	62.9	83%	0.832	32%	0.32	S	S	*	.	G	3₁₀ helix	trans	-61.1	-14.2	-179	-60.3	178.8	178.7	0	0	115.2	F2563 L2567 K2592	F2563-E2565 PolarHBondContact O-N 3.15Å; E2565-L2567 VanDerWaalsContact C-N 3.31Å; E2565-K2592 PolarHBondContact O-NZ 3.18Å
2566	R	96.7	Very high	94.9	Very high	100.5 Å²	100.5	63.4 Å²	63.4	38%	0.379	32%	0.322	S	S	.	.	G	3₁₀ helix	trans	-74	-26.1	174.2	-60	-177.7	-179.2	-179.3	-1	111.4	R2528 F2563 G2564 K2592 V2593	R2528-R2566 PolarHBondContact O-NH1 3.15Å; F2563-R2566 WeakPolarHBondContact O-CB 3.27Å; F2563-R2566 PolarHBondContact O-N 3.37Å; F2563-R2566 VanDerWaalsContact O-N 3.15Å; G2564-R2566 PolarHBondContact O-N 3.1Å; G2564-R2566 VanDerWaalsContact O-N 3.09Å; R2566-K2592 CarbonylContact O-C 3.56Å; R2566-K2592 VanDerWaalsContact O-CA 3.26Å; R2566-K2592 WeakPolarHBondContact O-CA 3.29Å; R2566-K2592 WeakPolarHBondContact O-CD 3.49Å; R2566-V2593 HydrophobicContact CB-CG2 4.44Å; R2566-V2593 PolarHBondContact O-N 3Å
2567	L	98.3	Very high	94.3	Very high	11 Å²	11	69.5 Å²	69.5	6%	0.058	35%	0.354	C	S	.	.	B	Isolated β-bridge	trans	-75.2	132.6	178.1	-175.1	61.6	0	0	0	110.8	F2559 K2560 F2563 G2564 E2565 S2569 I2595 L2745	F2559-L2567 HydrophobicContact CB-CD2 3.95Å; K2560-L2567 HydrophobicContact CG-CD2 4.05Å; F2563-L2567 HydrophobicContact CB-CB 3.89Å; F2563-L2567 HydrophobicContact CD2-CD1 4.32Å; G2564-L2567 WeakPolarHBondContact O-CB 3.29Å; G2564-L2567 PolarHBondContact O-N 3.15Å; E2565-L2567 VanDerWaalsContact C-N 3.31Å; L2567-S2569 PolarHBondContact O-N 2.89Å; L2567-I2595 HydrophobicContact CD1-CD1 4.02Å; L2567-I2595 HydrophobicContact CD1-CG1 3.75Å; L2567-L2745 HydrophobicContact CD2-CD1 4.09Å; L2567-L2745 HydrophobicContact CD2-CD2 3.62Å; L2567-L2745 HydrophobicContact CD2-CG 4.45Å; L2567-L2745 HydrophobicContact CG-CD2 4.22Å
2568	V	97.3	Very high	93.8	Very high	2.75 Å²	2.75	65.3 Å²	65.3	2%	0.017	34%	0.34	C	S	.	.			trans	-84	113.1	169.8	-177.9	0	0	0	0	109.1	Q2570 L2572 L2589 K2592 V2593 L2594 I2747 Y2748	V2568-Q2570 VanDerWaalsContact CG1-O 3.29Å; V2568-Q2570 WeakPolarHBondContact CG1-O 3.32Å; V2568-L2572 HydrophobicContact CG1-CD1 4.2Å; V2568-L2572 HydrophobicContact CG1-CG 4.28Å; V2568-L2572 HydrophobicContact CG2-CD1 4.08Å; V2568-L2589 HydrophobicContact CG2-CD2 4.49Å; V2568-K2592 HydrophobicContact CG2-CB 3.77Å; V2568-K2592 HydrophobicContact CG2-CD 4.25Å; V2568-K2592 HydrophobicContact CG2-CG 4.13Å; V2568-V2593 PolarHBondContact N-O 2.99Å; V2568-V2593 VanDerWaalsContact N-O 3.08Å; V2568-L2594 HydrophobicContact CB-CD2 3.88Å; V2568-L2594 HydrophobicContact CG1-CD2 4.38Å; V2568-L2594 HydrophobicContact CG2-CD2 3.52Å; V2568-L2594 VanDerWaalsContact CG2-CD2 3.49Å; V2568-I2747 HydrophobicContact CG1-CB 4.1Å; V2568-I2747 HydrophobicContact CG1-CG1 4.08Å; V2568-I2747 HydrophobicContact CG1-CG2 4.3Å; V2568-Y2748 HydrophobicContact CG1-CD2 4.08Å; V2568-Y2748 HydrophobicContact CG1-CE2 3.83Å
2569	S	94.6	Very high	93	Very high	64.75 Å²	64.75	72.4 Å²	72.4	45%	0.453	38%	0.377	S	S	.	.			trans	-118.5	1.8	-179.4	60.2	0	0	0	0	114	L2567	L2567-S2569 PolarHBondContact O-N 2.89Å
2570	Q	93.7	Very high	92.4	Very high	128.5 Å²	128.5	78.8 Å²	78.8	60%	0.6	41%	0.411	S	S	*	.	S	Bend	trans	-156.1	165.1	175.5	60.8	-177.5	36.6	0	0	109.4	V2568 L2572	V2568-Q2570 VanDerWaalsContact CG1-O 3.29Å; V2568-Q2570 WeakPolarHBondContact CG1-O 3.32Å; Q2570-L2572 HydrophobicContact CG-CD2 4.24Å
2571	F	94.2	Very high	91.9	Very high	62.5 Å²	62.5	75.9 Å²	75.9	27%	0.274	40%	0.403	S	S	.	.			trans	-60.9	141	167.6	-68.6	-69.9	0	0	0	110.4	D2576 I2747 Y2748 Y2814	F2571-D2576 HydrophobicContact CB-CB 3.92Å; F2571-D2576 WeakPolarHBondContact CB-OD2 3.49Å; F2571-D2576 HydrophobicContact CD1-CB 3.72Å; F2571-D2576 HydrophobicContact CE1-CB 4.46Å; F2571-D2576 HydrophobicContact CG-CB 4Å; F2571-I2747 HydrophobicContact CD1-CG2 3.5Å; F2571-I2747 VanDerWaalsContact CD1-CG2 3.45Å; F2571-I2747 HydrophobicContact CD2-CG2 4.4Å; F2571-I2747 HydrophobicContact CE1-CG2 3.57Å; F2571-I2747 HydrophobicContact CE2-CG2 4.41Å; F2571-I2747 HydrophobicContact CG-CG2 3.94Å; F2571-I2747 HydrophobicContact CZ-CG2 4.08Å; F2571-Y2748 HydrophobicContact CD1-CD1 4.25Å; F2571-Y2748 AromaticContact CD1-CE1 3.62Å; F2571-Y2748 HydrophobicContact CD1-CE1 3.62Å; F2571-Y2748 HydrophobicContact CE1-CD1 4.17Å; F2571-Y2748 AromaticContact CE1-CE1 3.93Å; F2571-Y2748 HydrophobicContact CE1-CE1 3.99Å; F2571-Y2814 HydrophobicContact CD1-CE1 4.43Å; F2571-Y2814 HydrophobicContact CD1-CE2 4.3Å; F2571-Y2814 HydrophobicContact CE1-CD1 4.26Å; F2571-Y2814 AromaticContact CE1-CD2 3.83Å; F2571-Y2814 HydrophobicContact CE1-CD2 3.83Å; F2571-Y2814 AromaticContact CE1-CE1 3.74Å; F2571-Y2814 HydrophobicContact CE1-CE1 3.91Å; F2571-Y2814 AromaticContact CE1-CE2 3.43Å; F2571-Y2814 HydrophobicContact CE1-CE2 3.43Å; F2571-Y2814 HydrophobicContact CE1-CG 4.23Å; F2571-Y2814 AromaticContact CE1-CZ 3.48Å; F2571-Y2814 VanDerWaalsContact CE1-CZ 3.48Å; F2571-Y2814 AromaticContact CZ-CD2 3.84Å; F2571-Y2814 HydrophobicContact CZ-CD2 3.84Å; F2571-Y2814 AromaticContact CZ-CE2 3.64Å; F2571-Y2814 HydrophobicContact CZ-CE2 3.64Å; F2571-Y2814 HydrophobicContact CZ-CG 4.43Å
2572	L	93	Very high	91.6	Very high	66.5 Å²	66.5	76.9 Å²	76.9	35%	0.348	40%	0.397	S	S	.	.			trans	-111.2	-16.2	-168.9	-61.8	-179.4	0	0	0	113.4	V2568 Q2570 D2576 L2589 Y2748	V2568-L2572 HydrophobicContact CG1-CD1 4.2Å; V2568-L2572 HydrophobicContact CG1-CG 4.28Å; V2568-L2572 HydrophobicContact CG2-CD1 4.08Å; Q2570-L2572 HydrophobicContact CG-CD2 4.24Å; L2572-D2576 PolarHBondContact N-OD2 2.92Å; L2572-L2589 HydrophobicContact CD1-CD2 4.02Å; L2572-Y2748 PolarHBondContact N-OH 2.87Å
2573	F	92.8	Very high	91.4	Very high	56 Å²	56	77.3 Å²	77.3	25%	0.246	40%	0.399	C	S	.	.	S	Bend	trans	-129.7	146.8	-170.1	-50.8	-75.3	0	0	0	111.8	N2575 D2576 P2584 Q2588 L2589 Y2748	F2573-N2575 PolarHBondContact O-N 3.11Å; F2573-D2576 PolarHBondContact N-OD2 3.19Å; F2573-D2576 VanDerWaalsContact N-OD2 3.16Å; F2573-D2576 VanDerWaalsContact O-CB 3.26Å; F2573-D2576 WeakPolarHBondContact O-CB 3.33Å; F2573-D2576 VanDerWaalsContact O-CG 3.29Å; F2573-D2576 PolarHBondContact O-N 3.11Å; F2573-P2584 HydrophobicContact CD2-CB 3.67Å; F2573-P2584 VanDerWaalsContact CD2-CB 3.45Å; F2573-P2584 HydrophobicContact CD2-CG 3.68Å; F2573-P2584 HydrophobicContact CE2-CB 3.42Å; F2573-P2584 VanDerWaalsContact CE2-CB 3.47Å; F2573-P2584 HydrophobicContact CE2-CG 3.55Å; F2573-P2584 VanDerWaalsContact CE2-CG 3.47Å; F2573-P2584 HydrophobicContact CG-CB 4.39Å; F2573-P2584 HydrophobicContact CZ-CB 4.3Å; F2573-Q2588 HydrophobicContact CE1-CB 4.03Å; F2573-Q2588 HydrophobicContact CE1-CG 4.33Å; F2573-Q2588 HydrophobicContact CE2-CB 4.33Å; F2573-Q2588 HydrophobicContact CZ-CB 3.69Å; F2573-Q2588 HydrophobicContact CZ-CG 4.31Å; F2573-L2589 HydrophobicContact CE2-CD2 4.11Å; F2573-L2589 HydrophobicContact CE2-CG 4.34Å; F2573-L2589 HydrophobicContact CZ-CD2 4.19Å; F2573-Y2748 WeakPolarHBondContact CD2-OH 3.34Å
2574	E	86.5	Confident	91.4	Very high	181 Å²	181	77.3 Å²	77.3	85%	0.846	40%	0.399	S	S	*	.	G	3₁₀ helix	trans	-60.1	-33.7	179.2	-63.6	179.4	172	0	0	112.4	D2576 L2577	E2574-D2576 PolarHBondContact O-N 2.95Å; E2574-D2576 VanDerWaalsContact O-N 3.16Å; E2574-L2577 PolarHBondContact O-N 3.2Å
2575	N	86.7	Confident	91.4	Very high	88.5 Å²	88.5	75.5 Å²	75.5	47%	0.473	38%	0.38	S	S	.	.	G	3₁₀ helix	trans	-62.1	-22.5	177.2	-144.8	45.4	0	0	0	113.1	F2573 L2577 S2578 P2581 K2582	F2573-N2575 PolarHBondContact O-N 3.11Å; N2575-L2577 PolarHBondContact O-N 3.01Å; N2575-S2578 WeakPolarHBondContact O-CB 3.37Å; N2575-S2578 PolarHBondContact O-N 3.21Å; N2575-S2578 PolarHBondContact O-OG 3.15Å; N2575-S2578 PolarHBondContact OD1-OG 3.4Å; N2575-P2581 WeakPolarHBondContact O-CA 3.17Å; N2575-P2581 WeakPolarHBondContact O-CB 3.45Å; N2575-K2582 PolarHBondContact ND2-N 2.99Å
2576	D	87.9	Confident	91.5	Very high	9.5 Å²	9.5	67.1 Å²	67.1	5%	0.051	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-66.5	-19.7	176.1	-60.7	-34.2	0	0	0	112.3	F2571 L2572 F2573 E2574 Y2748 Y2814	F2571-D2576 HydrophobicContact CB-CB 3.92Å; F2571-D2576 WeakPolarHBondContact CB-OD2 3.49Å; F2571-D2576 HydrophobicContact CD1-CB 3.72Å; F2571-D2576 HydrophobicContact CE1-CB 4.46Å; F2571-D2576 HydrophobicContact CG-CB 4Å; L2572-D2576 PolarHBondContact N-OD2 2.92Å; F2573-D2576 PolarHBondContact N-OD2 3.19Å; F2573-D2576 VanDerWaalsContact N-OD2 3.16Å; F2573-D2576 VanDerWaalsContact O-CB 3.26Å; F2573-D2576 WeakPolarHBondContact O-CB 3.33Å; F2573-D2576 VanDerWaalsContact O-CG 3.29Å; F2573-D2576 PolarHBondContact O-N 3.11Å; E2574-D2576 PolarHBondContact O-N 2.95Å; E2574-D2576 VanDerWaalsContact O-N 3.16Å; D2576-Y2748 WeakPolarHBondContact OD1-CE1 3.32Å; D2576-Y2748 WeakPolarHBondContact OD2-CE1 3.24Å; D2576-Y2748 PolarHBondContact OD2-OH 2.89Å; D2576-Y2814 VanDerWaalsContact CA-OH 3.3Å; D2576-Y2814 WeakPolarHBondContact CA-OH 3.46Å; D2576-Y2814 VanDerWaalsContact CB-OH 3.3Å; D2576-Y2814 WeakPolarHBondContact CB-OH 3.41Å; D2576-Y2814 PolarHBondContact O-OH 2.82Å; D2576-Y2814 VanDerWaalsContact O-OH 3.06Å; D2576-Y2814 PolarHBondContact OD1-OH 3.13Å
2577	L	84.9	Confident	91.4	Very high	129.5 Å²	129.5	64.7 Å²	64.7	68%	0.678	34%	0.336	S	S	*	.	G	3₁₀ helix	trans	-104.5	5.6	-179.2	-55.1	177.2	0	0	0	112.9	E2574 N2575 P2807	E2574-L2577 PolarHBondContact O-N 3.2Å; N2575-L2577 PolarHBondContact O-N 3.01Å; L2577-P2807 HydrophobicContact CD2-CB 3.92Å
2578	S	86.2	Confident	91.3	Very high	45.75 Å²	45.75	68.9 Å²	68.9	32%	0.32	36%	0.355	S	S	.	.	S	Bend	trans	-78.6	167.2	178.2	71.4	0	0	0	0	112.4	N2575 N2580 P2581	N2575-S2578 WeakPolarHBondContact O-CB 3.37Å; N2575-S2578 PolarHBondContact O-N 3.21Å; N2575-S2578 PolarHBondContact O-OG 3.15Å; N2575-S2578 PolarHBondContact OD1-OG 3.4Å; S2578-N2580 VanDerWaalsContact C-N 3.28Å; S2578-N2580 PolarHBondContact O-N 3.18Å; S2578-P2581 WeakPolarHBondContact O-CD 3.33Å; S2578-P2581 WeakPolarHBondContact OG-CA 3.43Å
2579	D	82.1	Confident	91.3	Very high	166 Å²	166	68.8 Å²	68.8	89%	0.888	35%	0.354	S	S	*	.	S	Bend	trans	-67.1	-22.7	177.2	-62.9	-42.1	0	0	0	113.2	P2581	D2579-P2581 VanDerWaalsContact C-CD 3.46Å; D2579-P2581 WeakPolarHBondContact O-CD 3.34Å
2580	N	83.8	Confident	91.3	Very high	132.75 Å²	132.75	71.4 Å²	71.4	71%	0.71	36%	0.357	S	S	*	.	S	Bend	trans	-131.5	68.9	178.9	-121.2	-10.1	0	0	0	110.6	S2578 K2582	S2578-N2580 VanDerWaalsContact C-N 3.28Å; S2578-N2580 PolarHBondContact O-N 3.18Å; N2580-K2582 PolarHBondContact O-N 3.05Å
2581	P	88.5	Confident	91.5	Very high	38.25 Å²	38.25	66.4 Å²	66.4	25%	0.248	34%	0.34	C	S	.	.			trans	-68	144.5	-173.9	29.3	-34.5	0	0	0	111.2	N2575 S2578 D2579 V2811 C2813 Y2814	N2575-P2581 WeakPolarHBondContact O-CA 3.17Å; N2575-P2581 WeakPolarHBondContact O-CB 3.45Å; S2578-P2581 WeakPolarHBondContact O-CD 3.33Å; S2578-P2581 WeakPolarHBondContact OG-CA 3.43Å; D2579-P2581 VanDerWaalsContact C-CD 3.46Å; D2579-P2581 WeakPolarHBondContact O-CD 3.34Å; P2581-V2811 HydrophobicContact CG-CB 4.29Å; P2581-V2811 HydrophobicContact CG-CG1 3.56Å; P2581-V2811 HydrophobicContact CG-CG2 3.67Å; P2581-C2813 PolarHBondContact O-SG 3.26Å; P2581-C2813 VanDerWaalsContact O-SG 3.37Å; P2581-Y2814 WeakPolarHBondContact CB-OH 3.46Å
2582	K	89.8	Confident	91.7	Very high	98.75 Å²	98.75	66.2 Å²	66.2	43%	0.429	34%	0.34	S	S	.	.			trans	-123.1	147.1	174.9	-65.4	-171.4	178.1	-171.2	0	109.5	P2455 Y2458 N2575 N2580 D2841	P2455-K2582 HydrophobicContact CB-CB 4.45Å; P2455-K2582 HydrophobicContact CG-CB 4.32Å; P2455-K2582 HydrophobicContact CG-CD 4.09Å; Y2458-K2582 PolarHBondContact OH-NZ 3.25Å; N2575-K2582 PolarHBondContact ND2-N 2.99Å; N2580-K2582 PolarHBondContact O-N 3.05Å; K2582-D2841 IonicContact NZ-OD1 3.08Å
2583	L	94.7	Very high	92	Very high	18.25 Å²	18.25	63.1 Å²	63.1	10%	0.096	32%	0.323	C	S	.	.	P	Polyproline II helix	trans	-56.6	137.7	172.6	-72.2	167.6	0	0	0	110.5	P2455 L2456 Y2748 C2813 Y2814 I2843	P2455-L2583 VanDerWaalsContact CA-O 3.25Å; P2455-L2583 WeakPolarHBondContact CA-O 3.36Å; P2455-L2583 HydrophobicContact CB-CB 4.39Å; P2455-L2583 VanDerWaalsContact CB-O 3.28Å; P2455-L2583 WeakPolarHBondContact CB-O 3.39Å; L2456-L2583 HydrophobicContact CB-CB 3.95Å; L2456-L2583 HydrophobicContact CB-CD1 4.36Å; L2583-Y2748 HydrophobicContact CD2-CD1 4.24Å; L2583-C2813 WeakPolarHBondContact CD1-O 3.3Å; L2583-Y2814 HydrophobicContact CD2-CD1 3.8Å; L2583-Y2814 HydrophobicContact CD2-CE1 4.31Å; L2583-Y2814 HydrophobicContact CG-CD1 4.47Å; L2583-I2843 HydrophobicContact CD1-CD1 3.73Å; L2583-I2843 HydrophobicContact CD1-CG1 3.8Å
2584	P	95.8	Very high	92.2	Very high	4.5 Å²	4.5	60.6 Å²	60.6	3%	0.029	31%	0.312	C	S	.	.	P	Polyproline II helix	trans	-63.3	160.7	176.8	3.1	-2.1	0	0	0	112.3	L2456 F2573 Q2588 L2589 Y2748	L2456-P2584 WeakPolarHBondContact CB-O 3.32Å; L2456-P2584 PolarHBondContact N-O 3.29Å; L2456-P2584 VanDerWaalsContact N-O 3.11Å; F2573-P2584 HydrophobicContact CD2-CB 3.67Å; F2573-P2584 VanDerWaalsContact CD2-CB 3.45Å; F2573-P2584 HydrophobicContact CD2-CG 3.68Å; F2573-P2584 HydrophobicContact CE2-CB 3.42Å; F2573-P2584 VanDerWaalsContact CE2-CB 3.47Å; F2573-P2584 HydrophobicContact CE2-CG 3.55Å; F2573-P2584 VanDerWaalsContact CE2-CG 3.47Å; F2573-P2584 HydrophobicContact CG-CB 4.39Å; F2573-P2584 HydrophobicContact CZ-CB 4.3Å; P2584-Q2588 VanDerWaalsContact CA-OE1 3.32Å; P2584-Q2588 HydrophobicContact CB-CB 4.27Å; P2584-Q2588 VanDerWaalsContact CB-OE1 3.29Å; P2584-L2589 HydrophobicContact CB-CD1 3.89Å; P2584-L2589 HydrophobicContact CB-CD2 4.15Å; P2584-L2589 HydrophobicContact CB-CG 4.08Å; P2584-L2589 HydrophobicContact CG-CD1 4.04Å; P2584-L2589 HydrophobicContact CG-CD2 4.31Å; P2584-L2589 HydrophobicContact CG-CG 4.16Å; P2584-Y2748 HydrophobicContact CG-CD1 4.17Å; P2584-Y2748 HydrophobicContact CG-CD2 4.37Å; P2584-Y2748 HydrophobicContact CG-CE1 3.76Å; P2584-Y2748 HydrophobicContact CG-CE2 4.11Å; P2584-Y2748 HydrophobicContact CG-CG 4.42Å
2585	S	96.5	Very high	92.8	Very high	1.75 Å²	1.75	52.1 Å²	52.1	1%	0.012	27%	0.273	C	S	.	.	P	Polyproline II helix	trans	-74.7	155.7	179	79.5	0	0	0	0	112.9	M2452 D2453 Y2454 L2587 Q2588 L2589	M2452-S2585 WeakPolarHBondContact O-CB 3.4Å; M2452-S2585 PolarHBondContact O-OG 3.15Å; D2453-S2585 VanDerWaalsContact C-CB 3.49Å; D2453-S2585 WeakPolarHBondContact O-CB 3.31Å; D2453-S2585 PolarHBondContact OD1-OG 2.99Å; Y2454-S2585 VanDerWaalsContact O-CA 3.3Å; Y2454-S2585 WeakPolarHBondContact O-CA 3.39Å; Y2454-S2585 WeakPolarHBondContact O-CB 3.39Å; S2585-L2587 PolarHBondContact O-N 3.04Å; S2585-L2587 VanDerWaalsContact O-N 3.17Å; S2585-L2587 PolarHBondContact OG-N 3.07Å; S2585-Q2588 WeakPolarHBondContact O-CB 3.43Å; S2585-Q2588 PolarHBondContact O-N 3.06Å; S2585-Q2588 VanDerWaalsContact O-N 3.11Å; S2585-Q2588 WeakPolarHBondContact OG-CB 3.33Å; S2585-Q2588 VanDerWaalsContact OG-CG 3.32Å; S2585-Q2588 WeakPolarHBondContact OG-CG 3.24Å; S2585-Q2588 PolarHBondContact OG-N 3.14Å; S2585-Q2588 VanDerWaalsContact OG-N 3.07Å; S2585-L2589 PolarHBondContact O-N 3.33Å; S2585-L2589 VanDerWaalsContact O-N 3.13Å
2586	P	96.7	Very high	93.3	Very high	1.25 Å²	1.25	49.3 Å²	49.3	1%	0.008	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.3	-34.7	171.1	-25.5	32.4	0	0	0	113.2	M2452 Y2454 L2456 Y2459 L2537 P2538 L2589 K2590 Y2897	M2452-P2586 HydrophobicContact CE-CB 3.75Å; M2452-P2586 HydrophobicContact CE-CG 4.14Å; M2452-P2586 WeakPolarHBondContact O-CD 3.43Å; M2452-P2586 HydrophobicContact SD-CB 4.44Å; M2452-P2586 HydrophobicContact SD-CG 4.44Å; Y2454-P2586 WeakPolarHBondContact O-CD 3.44Å; L2456-P2586 HydrophobicContact CD1-CB 4.49Å; L2456-P2586 HydrophobicContact CD1-CG 3.93Å; Y2459-P2586 HydrophobicContact CD1-CG 4.37Å; Y2459-P2586 HydrophobicContact CD2-CG 3.69Å; Y2459-P2586 HydrophobicContact CE1-CG 4.27Å; Y2459-P2586 VanDerWaalsContact CE2-CD 3.43Å; Y2459-P2586 HydrophobicContact CE2-CG 3.47Å; Y2459-P2586 VanDerWaalsContact CE2-CG 3.46Å; Y2459-P2586 HydrophobicContact CG-CG 4.18Å; L2537-P2586 HydrophobicContact CD1-CB 4.4Å; L2537-P2586 HydrophobicContact CD2-CB 4.14Å; L2537-P2586 WeakPolarHBondContact CD2-O 3.36Å; P2538-P2586 VanDerWaalsContact CD-O 3.27Å; P2538-P2586 WeakPolarHBondContact CD-O 3.41Å; P2586-L2589 CarbonylContact O-C 3.46Å; P2586-L2589 PolarHBondContact O-N 3.04Å; P2586-K2590 PolarHBondContact O-N 2.93Å; P2586-Y2897 HydrophobicContact CB-CD1 4.33Å; P2586-Y2897 HydrophobicContact CB-CG 4.32Å; P2586-Y2897 HydrophobicContact CG-CD1 4.01Å; P2586-Y2897 HydrophobicContact CG-CE1 4.43Å; P2586-Y2897 HydrophobicContact CG-CG 4.35Å
2587	L	95.2	Very high	93.7	Very high	50.75 Å²	50.75	49.1 Å²	49.1	27%	0.266	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-37.5	177.6	-122.9	119.4	0	0	0	112.9	K2449 M2452 D2453 L2537 S2585 L2589 K2590	K2449-L2587 WeakPolarHBondContact O-CD1 3.14Å; M2452-L2587 HydrophobicContact CB-CB 4.34Å; M2452-L2587 HydrophobicContact CB-CD1 3.65Å; M2452-L2587 HydrophobicContact CB-CD2 3.88Å; M2452-L2587 HydrophobicContact CB-CG 3.56Å; M2452-L2587 VanDerWaalsContact O-CB 3.32Å; M2452-L2587 WeakPolarHBondContact O-CB 3.34Å; M2452-L2587 WeakPolarHBondContact O-CG 3.42Å; M2452-L2587 PolarHBondContact O-N 3.31Å; D2453-L2587 WeakPolarHBondContact OD1-CD1 3.34Å; L2537-L2587 HydrophobicContact CD2-CD2 4.21Å; S2585-L2587 PolarHBondContact O-N 3.04Å; S2585-L2587 VanDerWaalsContact O-N 3.17Å; S2585-L2587 PolarHBondContact OG-N 3.07Å; L2587-L2589 VanDerWaalsContact C-N 3.28Å; L2587-L2589 PolarHBondContact O-N 3.41Å; L2587-K2590 VanDerWaalsContact O-CB 3.26Å; L2587-K2590 WeakPolarHBondContact O-CB 3.41Å; L2587-K2590 WeakPolarHBondContact O-CD 3.39Å; L2587-K2590 VanDerWaalsContact O-CG 3.27Å; L2587-K2590 WeakPolarHBondContact O-CG 3.35Å; L2587-K2590 PolarHBondContact O-N 3.01Å
2588	Q	96	Very high	94.2	Very high	99 Å²	99	47.7 Å²	47.7	46%	0.463	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-33.7	173	-77.7	176.1	-34.5	0	0	112.1	F2573 P2584 S2585 K2590	F2573-Q2588 HydrophobicContact CE1-CB 4.03Å; F2573-Q2588 HydrophobicContact CE1-CG 4.33Å; F2573-Q2588 HydrophobicContact CE2-CB 4.33Å; F2573-Q2588 HydrophobicContact CZ-CB 3.69Å; F2573-Q2588 HydrophobicContact CZ-CG 4.31Å; P2584-Q2588 VanDerWaalsContact CA-OE1 3.32Å; P2584-Q2588 HydrophobicContact CB-CB 4.27Å; P2584-Q2588 VanDerWaalsContact CB-OE1 3.29Å; S2585-Q2588 WeakPolarHBondContact O-CB 3.43Å; S2585-Q2588 PolarHBondContact O-N 3.06Å; S2585-Q2588 VanDerWaalsContact O-N 3.11Å; S2585-Q2588 WeakPolarHBondContact OG-CB 3.33Å; S2585-Q2588 VanDerWaalsContact OG-CG 3.32Å; S2585-Q2588 WeakPolarHBondContact OG-CG 3.24Å; S2585-Q2588 PolarHBondContact OG-N 3.14Å; S2585-Q2588 VanDerWaalsContact OG-N 3.07Å; Q2588-K2590 VanDerWaalsContact C-N 3.32Å; Q2588-K2590 PolarHBondContact O-N 3.01Å
2589	L	97.1	Very high	94.4	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.6	20.1	178.8	-68.9	174.7	0	0	0	114	L2456 P2538 V2568 L2572 F2573 P2584 S2585 P2586 L2587 G2591 K2592 L2594 Y2748	L2456-L2589 HydrophobicContact CD2-CD1 4.41Å; P2538-L2589 HydrophobicContact CB-CB 3.91Å; P2538-L2589 WeakPolarHBondContact CB-O 3.19Å; P2538-L2589 HydrophobicContact CG-CB 3.74Å; P2538-L2589 HydrophobicContact CG-CD1 4.49Å; V2568-L2589 HydrophobicContact CG2-CD2 4.49Å; L2572-L2589 HydrophobicContact CD1-CD2 4.02Å; F2573-L2589 HydrophobicContact CE2-CD2 4.11Å; F2573-L2589 HydrophobicContact CE2-CG 4.34Å; F2573-L2589 HydrophobicContact CZ-CD2 4.19Å; P2584-L2589 HydrophobicContact CB-CD1 3.89Å; P2584-L2589 HydrophobicContact CB-CD2 4.15Å; P2584-L2589 HydrophobicContact CB-CG 4.08Å; P2584-L2589 HydrophobicContact CG-CD1 4.04Å; P2584-L2589 HydrophobicContact CG-CD2 4.31Å; P2584-L2589 HydrophobicContact CG-CG 4.16Å; S2585-L2589 PolarHBondContact O-N 3.33Å; S2585-L2589 VanDerWaalsContact O-N 3.13Å; P2586-L2589 CarbonylContact O-C 3.46Å; P2586-L2589 PolarHBondContact O-N 3.04Å; L2587-L2589 VanDerWaalsContact C-N 3.28Å; L2587-L2589 PolarHBondContact O-N 3.41Å; L2589-G2591 PolarHBondContact O-N 3.07Å; L2589-K2592 HydrophobicContact CB-CB 4.45Å; L2589-K2592 HydrophobicContact CD2-CB 4.44Å; L2589-K2592 HydrophobicContact CD2-CG 4.41Å; L2589-K2592 VanDerWaalsContact O-CB 3.27Å; L2589-K2592 WeakPolarHBondContact O-CB 3.29Å; L2589-K2592 WeakPolarHBondContact O-CG 3.49Å; L2589-K2592 PolarHBondContact O-N 3.32Å; L2589-K2592 VanDerWaalsContact O-N 3.11Å; L2589-L2594 HydrophobicContact CD1-CD1 4.06Å; L2589-L2594 HydrophobicContact CD1-CD2 4.25Å; L2589-L2594 HydrophobicContact CD2-CD2 4.42Å; L2589-Y2748 HydrophobicContact CD1-CD2 4.48Å; L2589-Y2748 HydrophobicContact CD2-CD2 4.45Å; L2589-Y2748 HydrophobicContact CD2-CE2 4.06Å
2590	K	96.1	Very high	94.8	Very high	120 Å²	120	43.2 Å²	43.2	52%	0.522	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.7	131.4	178.7	-156.1	-178.6	178.5	-179.5	0	112	S2536 P2586 L2587 Q2588 K2592	S2536-K2590 CarbonylContact O-C 3.48Å; S2536-K2590 VanDerWaalsContact O-CA 3.31Å; S2536-K2590 WeakPolarHBondContact O-CA 3.44Å; S2536-K2590 VanDerWaalsContact O-CG 3.31Å; S2536-K2590 WeakPolarHBondContact O-CG 3.39Å; S2536-K2590 VanDerWaalsContact OG-CE 3.3Å; S2536-K2590 WeakPolarHBondContact OG-CE 3.33Å; P2586-K2590 PolarHBondContact O-N 2.93Å; L2587-K2590 VanDerWaalsContact O-CB 3.26Å; L2587-K2590 WeakPolarHBondContact O-CB 3.41Å; L2587-K2590 WeakPolarHBondContact O-CD 3.39Å; L2587-K2590 VanDerWaalsContact O-CG 3.27Å; L2587-K2590 WeakPolarHBondContact O-CG 3.35Å; L2587-K2590 PolarHBondContact O-N 3.01Å; Q2588-K2590 VanDerWaalsContact C-N 3.32Å; Q2588-K2590 PolarHBondContact O-N 3.01Å; K2590-K2592 VanDerWaalsContact C-N 3.28Å; K2590-K2592 PolarHBondContact O-N 3.01Å
2591	G	96.9	Very high	94.2	Very high	23.5 Å²	23.5	41.8 Å²	41.8	24%	0.242	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.4	12.6	179.6	0	0	0	0	0	114.7	F2532 S2536 L2589	F2532-G2591 VanDerWaalsContact CZ-C 3.41Å; F2532-G2591 WeakPolarHBondContact CZ-O 3.39Å; S2536-G2591 PolarHBondContact O-N 2.92Å; L2589-G2591 PolarHBondContact O-N 3.07Å
2592	K	98.3	Very high	92.8	Very high	59 Å²	59	47.5 Å²	47.5	26%	0.257	24%	0.235	S	C	.	.			trans	-101.9	149.2	-178.2	-60.6	-59.9	-174.6	177.6	0	113.4	F2532 P2538 V2539 E2565 R2566 V2568 L2589 K2590	F2532-K2592 WeakPolarHBondContact CZ-O 3.32Å; P2538-K2592 VanDerWaalsContact CA-O 3.25Å; P2538-K2592 WeakPolarHBondContact CA-O 3.44Å; P2538-K2592 WeakPolarHBondContact CB-O 3.42Å; V2539-K2592 PolarHBondContact N-O 3.18Å; E2565-K2592 PolarHBondContact O-NZ 3.18Å; R2566-K2592 CarbonylContact O-C 3.56Å; R2566-K2592 VanDerWaalsContact O-CA 3.26Å; R2566-K2592 WeakPolarHBondContact O-CA 3.29Å; R2566-K2592 WeakPolarHBondContact O-CD 3.49Å; V2568-K2592 HydrophobicContact CG2-CB 3.77Å; V2568-K2592 HydrophobicContact CG2-CD 4.25Å; V2568-K2592 HydrophobicContact CG2-CG 4.13Å; L2589-K2592 HydrophobicContact CB-CB 4.45Å; L2589-K2592 HydrophobicContact CD2-CB 4.44Å; L2589-K2592 HydrophobicContact CD2-CG 4.41Å; L2589-K2592 VanDerWaalsContact O-CB 3.27Å; L2589-K2592 WeakPolarHBondContact O-CB 3.29Å; L2589-K2592 WeakPolarHBondContact O-CG 3.49Å; L2589-K2592 PolarHBondContact O-N 3.32Å; L2589-K2592 VanDerWaalsContact O-N 3.11Å; K2590-K2592 VanDerWaalsContact C-N 3.28Å; K2590-K2592 PolarHBondContact O-N 3.01Å
2593	V	98.5	Very high	90.7	Very high	0.5 Å²	0.5	51.1 Å²	51.1	0%	0.003	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	124.5	174.6	-178	0	0	0	0	108.4	F2532 V2539 I2541 F2563 R2566 V2568	F2532-V2593 HydrophobicContact CE2-CG2 4.13Å; F2532-V2593 HydrophobicContact CZ-CG2 3.9Å; V2539-V2593 CarbonylContact O-C 3.51Å; V2539-V2593 VanDerWaalsContact O-CA 3.31Å; V2539-V2593 WeakPolarHBondContact O-CA 3.37Å; I2541-V2593 HydrophobicContact CD1-CG1 3.63Å; I2541-V2593 HydrophobicContact CG1-CG1 4.01Å; F2563-V2593 HydrophobicContact CD1-CG2 4.31Å; F2563-V2593 HydrophobicContact CD2-CG1 4.16Å; F2563-V2593 HydrophobicContact CE1-CG2 4.42Å; F2563-V2593 HydrophobicContact CE2-CG1 3.9Å; F2563-V2593 HydrophobicContact CG-CG2 4.47Å; F2563-V2593 HydrophobicContact CZ-CG1 4.27Å; R2566-V2593 HydrophobicContact CB-CG2 4.44Å; R2566-V2593 PolarHBondContact O-N 3Å; V2568-V2593 PolarHBondContact N-O 2.99Å; V2568-V2593 VanDerWaalsContact N-O 3.08Å
2594	L	98.4	Very high	88	Confident	4 Å²	4	55.1 Å²	55.1	2%	0.021	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	137.3	178.7	-54.6	-177.1	0	0	0	109.9	L2456 P2538 V2539 I2540 I2541 V2568 L2589 Y2748	L2456-L2594 HydrophobicContact CD2-CD1 4.11Å; P2538-L2594 HydrophobicContact CB-CD1 4.39Å; V2539-L2594 PolarHBondContact O-N 2.87Å; I2540-L2594 WeakPolarHBondContact CA-O 3.32Å; I2540-L2594 HydrophobicContact CG1-CB 4.3Å; I2540-L2594 HydrophobicContact CG1-CD1 4.13Å; I2541-L2594 PolarHBondContact N-O 3.25Å; V2568-L2594 HydrophobicContact CB-CD2 3.88Å; V2568-L2594 HydrophobicContact CG1-CD2 4.38Å; V2568-L2594 HydrophobicContact CG2-CD2 3.52Å; V2568-L2594 VanDerWaalsContact CG2-CD2 3.49Å; L2589-L2594 HydrophobicContact CD1-CD1 4.06Å; L2589-L2594 HydrophobicContact CD1-CD2 4.25Å; L2589-L2594 HydrophobicContact CD2-CD2 4.42Å; L2594-Y2748 HydrophobicContact CD2-CD2 4.07Å
2595	I	98.4	Very high	85.2	Confident	2.5 Å²	2.5	60.3 Å²	60.3	1%	0.013	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	124.8	173	-56.2	-56.6	0	0	0	109.5	I2541 I2543 F2559 L2567 N2597 L2745 V2746	I2541-I2595 HydrophobicContact CB-CD1 4.1Å; I2541-I2595 HydrophobicContact CD1-CD1 4.22Å; I2543-I2595 HydrophobicContact CD1-CG2 3.55Å; I2543-I2595 HydrophobicContact CG1-CG2 4.27Å; F2559-I2595 HydrophobicContact CD1-CD1 4.35Å; F2559-I2595 HydrophobicContact CD2-CD1 4.34Å; F2559-I2595 HydrophobicContact CE1-CD1 4.21Å; F2559-I2595 HydrophobicContact CE2-CD1 4.22Å; F2559-I2595 HydrophobicContact CG-CD1 4.4Å; F2559-I2595 HydrophobicContact CZ-CD1 4.13Å; L2567-I2595 HydrophobicContact CD1-CD1 4.02Å; L2567-I2595 HydrophobicContact CD1-CG1 3.75Å; I2595-N2597 HydrophobicContact CG2-CB 4.27Å; I2595-L2745 HydrophobicContact CG1-CB 4.26Å; I2595-V2746 HydrophobicContact CG2-CG2 4.38Å
2596	K	97.6	Very high	82.6	Confident	29.5 Å²	29.5	65.5 Å²	65.5	13%	0.128	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	109.9	169.3	172.8	-139.7	175.9	-129.1	0	109.5	I2540 I2541 S2542 I2543 C2749 A2751 L2816 S2818	I2540-K2596 HydrophobicContact CG2-CB 4.05Å; I2541-K2596 PolarHBondContact O-N 3.13Å; S2542-K2596 WeakPolarHBondContact OG-CD 3.44Å; S2542-K2596 PolarHBondContact OG-NZ 3.25Å; I2543-K2596 PolarHBondContact N-O 3.3Å; K2596-C2749 VanDerWaalsContact CA-O 3.27Å; K2596-C2749 WeakPolarHBondContact CA-O 3.37Å; K2596-C2749 HydrophobicContact CB-CB 3.76Å; K2596-C2749 HydrophobicContact CG-CB 4.29Å; K2596-A2751 HydrophobicContact CG-CB 4.36Å; K2596-L2816 HydrophobicContact CG-CD1 4.32Å; K2596-L2816 HydrophobicContact CG-CD2 4.25Å; K2596-S2818 VanDerWaalsContact CE-OG 3.24Å; K2596-S2818 WeakPolarHBondContact CE-OG 3.45Å; K2596-S2818 PolarHBondContact NZ-OG 3.18Å; K2596-S2818 VanDerWaalsContact NZ-OG 3.14Å
2597	N	96.7	Very high	80.1	Confident	5.75 Å²	5.75	71.3 Å²	71.3	3%	0.031	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	173.5	177.1	-168	13.1	0	0	0	110.1	I2543 N2545 I2595 L2742 V2746 A2751	I2543-N2597 HydrophobicContact CB-CB 4.36Å; I2543-N2597 HydrophobicContact CD1-CB 4.47Å; N2545-N2597 PolarHBondContact ND2-ND2 3.33Å; I2595-N2597 HydrophobicContact CG2-CB 4.27Å; N2597-L2742 VanDerWaalsContact ND2-CD2 3.34Å; N2597-L2742 WeakPolarHBondContact ND2-CD2 3.46Å; N2597-L2742 WeakPolarHBondContact ND2-CG 3.34Å; N2597-V2746 HydrophobicContact CB-CG2 3.79Å; N2597-V2746 WeakPolarHBondContact O-CG1 3.34Å; N2597-A2751 VanDerWaalsContact C-CB 3.46Å; N2597-A2751 WeakPolarHBondContact O-CB 3.34Å; N2597-A2751 PolarHBondContact O-N 3.2Å
2598	K	93.9	Very high	77.5	Confident	100.5 Å²	100.5	77.7 Å²	77.7	44%	0.437	42%	0.418	S	S	.	.			trans	-61.5	139.8	169.3	-68.6	176.3	-179.4	171.8	0	109.8	E2721 V2738	K2598-E2721 IonicContact NZ-OE1 3.23Å; K2598-E2721 PolarHBondContact NZ-OE1 2.68Å; K2598-V2738 HydrophobicContact CB-CG2 3.75Å; K2598-V2738 HydrophobicContact CD-CG2 4.29Å
2599	K	92.1	Very high	74.7	Confident	64.5 Å²	64.5	76.1 Å²	76.1	28%	0.28	43%	0.429	S	S	.	.			trans	-115.6	138.1	176.9	-168.8	177.4	-173.8	114.8	0	110.5	S2743 V2746 Q2750	K2599-S2743 WeakPolarHBondContact CG-OG 3.24Å; K2599-S2743 PolarHBondContact NZ-O 2.99Å; K2599-V2746 HydrophobicContact CB-CB 4.28Å; K2599-V2746 HydrophobicContact CB-CG1 4.25Å; K2599-V2746 HydrophobicContact CD-CB 4.45Å; K2599-V2746 WeakPolarHBondContact CD-O 3.37Å; K2599-V2746 WeakPolarHBondContact CE-O 3.37Å; K2599-V2746 HydrophobicContact CG-CB 4.4Å; K2599-V2746 PolarHBondContact NZ-O 2.93Å; K2599-Q2750 HydrophobicContact CB-CG 4.46Å; K2599-Q2750 HydrophobicContact CD-CG 4.1Å
2600	L	88.8	Confident	71.9	Confident	52.5 Å²	52.5	83.4 Å²	83.4	28%	0.275	47%	0.468	S	S	.	.			trans	-70.9	127.9	172.6	-85.8	152.8	0	0	0	110.1	F2602 P2736 V2738 P2740 S2743	L2600-F2602 HydrophobicContact CB-CD2 4.49Å; L2600-F2602 HydrophobicContact CB-CE2 4.25Å; L2600-F2602 HydrophobicContact CD2-CE2 4.41Å; L2600-F2602 PolarHBondContact O-N 3.09Å; L2600-P2736 HydrophobicContact CD2-CB 4.34Å; L2600-V2738 HydrophobicContact CD2-CB 4.2Å; L2600-V2738 HydrophobicContact CG-CB 4.35Å; L2600-P2740 HydrophobicContact CD1-CB 4.37Å; L2600-P2740 HydrophobicContact CD1-CG 4.09Å; L2600-S2743 WeakPolarHBondContact CB-OG 3.15Å; L2600-S2743 PolarHBondContact N-OG 3.08Å
2601	S	73	Confident	68.9	Low	102 Å²	102	89.3 Å²	89.3	71%	0.713	49%	0.487	S	S	*	.			trans	-83.6	111	172	48.5	0	0	0	0	110.3	E2603	S2601-E2603 PolarHBondContact O-N 2.94Å
2602	F	58.2	Low	66	Low	160 Å²	160	92.8 Å²	92.8	70%	0.702	51%	0.508	S	S	*	.			trans	-86.6	98.6	165.1	-86.8	-88.1	0	0	0	109	L2600	L2600-F2602 HydrophobicContact CB-CD2 4.49Å; L2600-F2602 HydrophobicContact CB-CE2 4.25Å; L2600-F2602 HydrophobicContact CD2-CE2 4.41Å; L2600-F2602 PolarHBondContact O-N 3.09Å
2603	E	45.5	Very low	63.1	Low	172.333 Å²	172.333	95.3 Å²	95.3	81%	0.805	53%	0.532	S	S	*	.	P	Polyproline II helix	trans	-72.4	121.7	162	-169.2	165	-163.3	0	0	107.3	S2601	S2601-E2603 PolarHBondContact O-N 2.94Å
2604	P	38.2	Very low	60	Low	103.333 Å²	103.333	105.4 Å²	105.4	67%	0.671	58%	0.576	S	S	*	*	P	Polyproline II helix	trans	-61.3	132	178.8	11.3	-13.3	0	0	0	108.8
2605	P	36.9	Very low	57	Low	113.333 Å²	113.333	111.5 Å²	111.5	74%	0.736	61%	0.613	S	S	*	*	P	Polyproline II helix	trans	-58	134.7	178	23.4	-32	0	0	0	108.9
2606	P	41.8	Very low	54	Low	111.333 Å²	111.333	119.4 Å²	119.4	72%	0.723	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-56.9	139	-179.6	22.8	-32.5	0	0	0	109.2	L2608	P2606-L2608 PolarHBondContact O-N 2.91Å
2607	P	43.6	Very low	50.8	Low	123 Å²	123	120.9 Å²	120.9	80%	0.799	68%	0.679	S	S	*	*	P	Polyproline II helix	trans	-55.4	136.3	-179.1	22.6	-32.3	0	0	0	109.2	G2609	P2607-G2609 VanDerWaalsContact C-N 3.3Å; P2607-G2609 PolarHBondContact O-N 3.1Å
2608	L	40.9	Very low	47.9	Very low	184.667 Å²	184.667	129.7 Å²	129.7	97%	0.967	72%	0.72	S	S	*	*			trans	-65.5	79.2	-179.9	-73.2	166.8	0	0	0	110	P2606	P2606-L2608 PolarHBondContact O-N 2.91Å
2609	G	38.6	Very low	44.8	Very low	65.6667 Å²	65.6667	134.6 Å²	134.6	68%	0.677	74%	0.741	S	S	*	*			trans	-74.9	133.6	174.6	0	0	0	0	0	110.4	P2607	P2607-G2609 VanDerWaalsContact C-N 3.3Å; P2607-G2609 PolarHBondContact O-N 3.1Å
2610	D	36.6	Very low	41.9	Very low	153.333 Å²	153.333	137.3 Å²	137.3	82%	0.82	77%	0.765	S	S	*	*			trans	-61.8	147.1	-167.4	-154.8	-8.7	0	0	0	114	S2612	D2610-S2612 VanDerWaalsContact C-N 3.33Å; D2610-S2612 PolarHBondContact O-N 3.14Å
2611	R	33.6	Very low	39	Very low	245 Å²	245	144.1 Å²	144.1	93%	0.925	80%	0.796	S	S	*	*	S	Bend	trans	-79.9	72.3	-175.9	-74.6	-178.3	167.1	-170.9	-1.8	111.7
2612	S	36.4	Very low	37	Very low	96.6667 Å²	96.6667	149.1 Å²	149.1	68%	0.676	81%	0.805	S	S	*	*			trans	-153.7	134.4	162.5	68	0	0	0	0	114	D2610	D2610-S2612 VanDerWaalsContact C-N 3.33Å; D2610-S2612 PolarHBondContact O-N 3.14Å
2613	S	37.8	Very low	35.5	Very low	110.667 Å²	110.667	144.7 Å²	144.7	77%	0.774	81%	0.805	S	S	*	*			trans	107.2	106.8	162.9	32.3	0	0	0	0	114.4	V2615	S2613-V2615 PolarHBondContact O-N 3.36Å
2614	K	31.8	Very low	34.7	Very low	213.667 Å²	213.667	142 Å²	142	93%	0.929	81%	0.805	S	S	*	*			trans	-77.8	117.1	156.3	-68.6	178.2	176.9	-179.6	0	108.2
2615	V	36.8	Very low	34.3	Very low	131.333 Å²	131.333	143 Å²	143	80%	0.796	80%	0.804	S	S	*	*			trans	-137.4	128	159.7	-178.1	0	0	0	0	107.5	S2613 G2617	S2613-V2615 PolarHBondContact O-N 3.36Å; V2615-G2617 PolarHBondContact O-N 3.3Å
2616	D	34.4	Very low	33.8	Very low	168 Å²	168	144 Å²	144	90%	0.898	80%	0.8	S	S	*	*			trans	-65.9	135.2	174.9	-78.6	-61.2	0	0	0	111.7
2617	G	31.4	Very low	33.1	Very low	61.3333 Å²	61.3333	146.2 Å²	146.2	63%	0.632	80%	0.801	S	S	*	*			trans	160.9	98.8	166.4	0	0	0	0	0	114.7	V2615	V2615-G2617 PolarHBondContact O-N 3.3Å
2618	H	34.7	Very low	32.4	Very low	191 Å²	191	148.5 Å²	148.5	88%	0.884	79%	0.794	S	S	*	*			trans	58.7	113	145.6	-74.5	-73.5	0	0	0	115.6	P2620	H2618-P2620 WeakPolarHBondContact O-CD 3.42Å
2619	K	28.9	Very low	31.8	Very low	203.333 Å²	203.333	143 Å²	143	88%	0.884	77%	0.771	S	S	*	*			trans	-67.2	124	160.2	-79.6	-178.6	176	178.1	0	109.4	Q2621	K2619-Q2621 PolarHBondContact O-N 3.29Å
2620	P	31.7	Very low	31.7	Very low	121 Å²	121	146 Å²	146	79%	0.786	77%	0.769	S	S	*	*			trans	-66.9	138.5	164.6	14.2	-12.1	0	0	0	109	H2618 K2622	H2618-P2620 WeakPolarHBondContact O-CD 3.42Å; P2620-K2622 PolarHBondContact O-N 2.99Å; P2620-K2622 VanDerWaalsContact O-N 3.1Å
2621	Q	28.3	Very low	31.5	Very low	195.333 Å²	195.333	146.4 Å²	146.4	91%	0.913	77%	0.765	S	S	*	*			trans	-64.4	118.3	172.1	-75.3	170.6	-50.9	0	0	108.9	K2619 G2623	K2619-Q2621 PolarHBondContact O-N 3.29Å; Q2621-G2623 PolarHBondContact O-N 3.26Å
2622	K	30.1	Very low	31.4	Very low	206.667 Å²	206.667	142.9 Å²	142.9	90%	0.899	76%	0.76	S	S	*	*			trans	-60.9	117.8	160.9	-98.6	-173.7	171.7	-175.3	0	106.9	P2620 S2624	P2620-K2622 PolarHBondContact O-N 2.99Å; P2620-K2622 VanDerWaalsContact O-N 3.1Å; K2622-S2624 PolarHBondContact O-N 2.88Å
2623	G	28.5	Very low	31.1	Very low	68.6667 Å²	68.6667	146.1 Å²	146.1	71%	0.708	76%	0.764	S	S	*	*			trans	-55	138	168.7	0	0	0	0	0	109.6	Q2621 L2625	Q2621-G2623 PolarHBondContact O-N 3.26Å; G2623-L2625 VanDerWaalsContact C-N 3.3Å; G2623-L2625 PolarHBondContact O-N 2.89Å
2624	S	28	Very low	30.8	Very low	114.333 Å²	114.333	149.6 Å²	149.6	80%	0.8	77%	0.768	S	S	*	*			trans	-68.1	99.3	-177.7	-172.9	0	0	0	0	109.9	K2622 M2626	K2622-S2624 PolarHBondContact O-N 2.88Å; S2624-M2626 PolarHBondContact O-N 2.97Å
2625	L	28.7	Very low	30.7	Very low	125.667 Å²	125.667	146.3 Å²	146.3	66%	0.658	76%	0.761	S	S	*	*			trans	-82.3	107.4	162.7	-169.5	97.6	0	0	0	106	G2623 E2627	G2623-L2625 VanDerWaalsContact C-N 3.3Å; G2623-L2625 PolarHBondContact O-N 2.89Å; L2625-E2627 PolarHBondContact O-N 2.99Å; L2625-E2627 VanDerWaalsContact O-N 3.09Å
2626	M	26.5	Very low	30.5	Very low	132.667 Å²	132.667	148.2 Å²	148.2	65%	0.654	76%	0.761	S	S	*	*			trans	-67.8	98.4	176.2	-170.2	76.3	178.8	0	0	108	S2624 W2628	S2624-M2626 PolarHBondContact O-N 2.97Å; M2626-W2628 HydrophobicContact CE-CH2 4.2Å; M2626-W2628 HydrophobicContact CE-CZ2 3.97Å; M2626-W2628 HydrophobicContact CG-CD2 4.37Å; M2626-W2628 HydrophobicContact CG-CG 4.4Å; M2626-W2628 HydrophobicContact CG-CZ2 4.22Å; M2626-W2628 VanDerWaalsContact CG-NE1 3.31Å; M2626-W2628 PolarHBondContact O-N 3.24Å; M2626-W2628 VanDerWaalsContact O-N 3.12Å
2627	E	26.9	Very low	30.3	Very low	158.333 Å²	158.333	149.7 Å²	149.7	74%	0.74	76%	0.763	S	S	*	*			trans	-72.1	97.4	177.2	-176.4	164.5	-165.1	0	0	108.7	L2625 S2629	L2625-E2627 PolarHBondContact O-N 2.99Å; L2625-E2627 VanDerWaalsContact O-N 3.09Å; E2627-S2629 PolarHBondContact O-N 2.93Å
2628	W	29.4	Very low	30.3	Very low	171 Å²	171	151 Å²	151	65%	0.648	76%	0.758	S	S	*	*			trans	-75.5	84	168.3	-75.9	82.2	0	0	0	109.5	M2626 M2630 I2759	M2626-W2628 HydrophobicContact CE-CH2 4.2Å; M2626-W2628 HydrophobicContact CE-CZ2 3.97Å; M2626-W2628 HydrophobicContact CG-CD2 4.37Å; M2626-W2628 HydrophobicContact CG-CG 4.4Å; M2626-W2628 HydrophobicContact CG-CZ2 4.22Å; M2626-W2628 VanDerWaalsContact CG-NE1 3.31Å; M2626-W2628 PolarHBondContact O-N 3.24Å; M2626-W2628 VanDerWaalsContact O-N 3.12Å; W2628-M2630 PolarHBondContact O-N 2.75Å; W2628-I2759 HydrophobicContact CZ2-CD1 4.05Å
2629	S	29.7	Very low	30.1	Very low	69.3333 Å²	69.3333	149.8 Å²	149.8	49%	0.485	75%	0.753	S	S	.	*			trans	-63.5	122.8	153.4	-70.6	0	0	0	0	107.6	E2627 E2631	E2627-S2629 PolarHBondContact O-N 2.93Å; S2629-E2631 PolarHBondContact O-N 3.08Å; S2629-E2631 VanDerWaalsContact O-N 3.1Å
2630	M	36.5	Very low	30.3	Very low	129 Å²	129	149.5 Å²	149.5	64%	0.635	75%	0.748	S	S	*	*			trans	-72.8	92.1	155	-108.2	-178.1	143.1	0	0	105.9	W2628 E2632 T2823 K2826 K2830	W2628-M2630 PolarHBondContact O-N 2.75Å; M2630-E2632 HydrophobicContact CE-CG 4.38Å; M2630-E2632 PolarHBondContact O-N 3.27Å; M2630-E2632 VanDerWaalsContact O-N 3.15Å; M2630-T2823 HydrophobicContact SD-CG2 4.21Å; M2630-K2826 HydrophobicContact CE-CB 3.95Å; M2630-K2826 HydrophobicContact CE-CD 3.8Å; M2630-K2826 HydrophobicContact CE-CG 4.5Å; M2630-K2830 HydrophobicContact CE-CD 4.12Å
2631	E	30.6	Very low	30.3	Very low	160.667 Å²	160.667	150 Å²	150	75%	0.751	74%	0.744	S	S	*	*			trans	-64.4	127.7	155.8	-64.1	-174.8	166	0	0	105.7	S2629 E2633	S2629-E2631 PolarHBondContact O-N 3.08Å; S2629-E2631 VanDerWaalsContact O-N 3.1Å; E2631-E2633 VanDerWaalsContact C-N 3.25Å; E2631-E2633 PolarHBondContact O-N 3.08Å
2632	E	32.1	Very low	30.5	Very low	172.667 Å²	172.667	149.8 Å²	149.8	81%	0.807	74%	0.74	S	S	*	*			trans	-69.8	92.9	168.2	-68.5	175	162.4	0	0	105.4	M2630 E2634	M2630-E2632 HydrophobicContact CE-CG 4.38Å; M2630-E2632 PolarHBondContact O-N 3.27Å; M2630-E2632 VanDerWaalsContact O-N 3.15Å; E2632-E2634 VanDerWaalsContact C-N 3.31Å; E2632-E2634 PolarHBondContact O-N 2.86Å
2633	E	30.6	Very low	30.6	Very low	163 Å²	163	146 Å²	146	76%	0.762	73%	0.73	S	S	*	*			trans	-60.9	101	166.4	-73.9	-175.1	150.2	0	0	106.2	E2631 D2635	E2631-E2633 VanDerWaalsContact C-N 3.25Å; E2631-E2633 PolarHBondContact O-N 3.08Å; E2633-D2635 PolarHBondContact O-N 3.16Å
2634	E	30.2	Very low	30.8	Very low	184 Å²	184	149 Å²	149	86%	0.86	73%	0.73	S	S	*	*			trans	-54.3	90	164.1	-67.9	-177.4	152.9	0	0	107.6	E2632 E2636	E2632-E2634 VanDerWaalsContact C-N 3.31Å; E2632-E2634 PolarHBondContact O-N 2.86Å; E2634-E2636 PolarHBondContact O-N 3.12Å
2635	D	30.6	Very low	30.9	Very low	144.667 Å²	144.667	149 Å²	149	77%	0.774	72%	0.72	S	S	*	*			trans	-67.2	107.9	178	-89	-38.5	0	0	0	109.4	E2633 E2637	E2633-D2635 PolarHBondContact O-N 3.16Å; D2635-E2637 PolarHBondContact O-N 3.19Å; D2635-E2637 VanDerWaalsContact O-N 3.12Å
2636	E	33.6	Very low	31.2	Very low	171.667 Å²	171.667	150.4 Å²	150.4	80%	0.802	73%	0.729	S	S	*	*			trans	-61.8	132.7	-179.8	-68.2	-173.3	152.2	0	0	109.6	E2634 T2638	E2634-E2636 PolarHBondContact O-N 3.12Å; E2636-T2638 VanDerWaalsContact C-N 3.33Å; E2636-T2638 PolarHBondContact O-N 2.89Å; E2636-T2638 PolarHBondContact O-OG1 2.9Å
2637	E	29	Very low	31.4	Very low	200.333 Å²	200.333	152.1 Å²	152.1	94%	0.936	74%	0.735	S	S	*	*			trans	-21.8	69.1	173.3	-61.8	-177	150.6	0	0	114.6	D2635 Q2639	D2635-E2637 PolarHBondContact O-N 3.19Å; D2635-E2637 VanDerWaalsContact O-N 3.12Å; E2637-Q2639 PolarHBondContact O-N 3.08Å
2638	T	31.1	Very low	31.7	Very low	88.3333 Å²	88.3333	151.9 Å²	151.9	54%	0.542	74%	0.739	S	S	.	*			trans	-101.7	97.7	165.7	43.9	0	0	0	0	108.7	E2636 Y2640	E2636-T2638 VanDerWaalsContact C-N 3.33Å; E2636-T2638 PolarHBondContact O-N 2.89Å; E2636-T2638 PolarHBondContact O-OG1 2.9Å; T2638-Y2640 VanDerWaalsContact CB-CE2 3.4Å; T2638-Y2640 HydrophobicContact CG2-CE2 4.05Å; T2638-Y2640 WeakPolarHBondContact O-CD2 3.44Å; T2638-Y2640 PolarHBondContact O-N 3.04Å; T2638-Y2640 VanDerWaalsContact O-N 3.09Å; T2638-Y2640 WeakPolarHBondContact OG1-CE2 3.46Å
2639	Q	30.4	Very low	32	Very low	166 Å²	166	150.5 Å²	150.5	78%	0.776	74%	0.744	S	S	*	*			trans	-56.3	90.6	168.1	-178.1	-173.7	-14.3	0	0	109.8	E2637 D2641	E2637-Q2639 PolarHBondContact O-N 3.08Å; Q2639-D2641 PolarHBondContact NE2-OD1 2.92Å; Q2639-D2641 VanDerWaalsContact NE2-OD1 3.09Å; Q2639-D2641 PolarHBondContact O-N 2.8Å; Q2639-D2641 VanDerWaalsContact O-N 3.11Å
2640	Y	33.9	Very low	32.3	Very low	196.667 Å²	196.667	152.7 Å²	152.7	77%	0.771	75%	0.751	S	S	*	*			trans	-97.4	107.2	163.2	-71.3	-74.1	0	0	0	107.2	T2638 F2642	T2638-Y2640 VanDerWaalsContact CB-CE2 3.4Å; T2638-Y2640 HydrophobicContact CG2-CE2 4.05Å; T2638-Y2640 WeakPolarHBondContact O-CD2 3.44Å; T2638-Y2640 PolarHBondContact O-N 3.04Å; T2638-Y2640 VanDerWaalsContact O-N 3.09Å; T2638-Y2640 WeakPolarHBondContact OG1-CE2 3.46Å; Y2640-F2642 PolarHBondContact O-N 2.96Å; Y2640-F2642 VanDerWaalsContact O-N 3.16Å
2641	D	31.4	Very low	32.2	Very low	131.333 Å²	131.333	155.1 Å²	155.1	70%	0.702	76%	0.76	S	S	*	*			trans	-58.4	124.2	174.8	-68.8	-48.8	0	0	0	109.4	Q2639 D2643	Q2639-D2641 PolarHBondContact NE2-OD1 2.92Å; Q2639-D2641 VanDerWaalsContact NE2-OD1 3.09Å; Q2639-D2641 PolarHBondContact O-N 2.8Å; Q2639-D2641 VanDerWaalsContact O-N 3.11Å; D2641-D2643 PolarHBondContact O-N 2.94Å
2642	F	32.4	Very low	32.3	Very low	191.667 Å²	191.667	153.1 Å²	153.1	84%	0.841	76%	0.759	S	S	*	*			trans	-69.5	92.1	172.3	-131.8	-95.2	0	0	0	108.8	Y2640 D2644	Y2640-F2642 PolarHBondContact O-N 2.96Å; Y2640-F2642 VanDerWaalsContact O-N 3.16Å; F2642-D2644 VanDerWaalsContact C-N 3.27Å; F2642-D2644 HydrophobicContact CD1-CB 4.23Å; F2642-D2644 HydrophobicContact CE1-CB 3.74Å; F2642-D2644 HydrophobicContact CZ-CB 4.22Å; F2642-D2644 PolarHBondContact O-N 3.12Å
2643	D	31.8	Very low	32.3	Very low	126.667 Å²	126.667	151.9 Å²	151.9	68%	0.677	76%	0.758	S	S	*	*			trans	-97.7	71.2	174.4	-136	3.9	0	0	0	109.4	D2641 N2645	D2641-D2643 PolarHBondContact O-N 2.94Å; D2643-N2645 PolarHBondContact O-N 3.3Å; D2643-N2645 PolarHBondContact O-ND2 3.11Å; D2643-N2645 PolarHBondContact OD1-ND2 3.12Å; D2643-N2645 PolarHBondContact OD2-ND2 2.88Å
2644	D	32.9	Very low	32.4	Very low	131.333 Å²	131.333	155.1 Å²	155.1	70%	0.702	76%	0.763	S	S	*	*			trans	-67.2	75.6	161.7	-88	-26.1	0	0	0	108.9	F2642 D2646	F2642-D2644 VanDerWaalsContact C-N 3.27Å; F2642-D2644 HydrophobicContact CD1-CB 4.23Å; F2642-D2644 HydrophobicContact CE1-CB 3.74Å; F2642-D2644 HydrophobicContact CZ-CB 4.22Å; F2642-D2644 PolarHBondContact O-N 3.12Å; D2644-D2646 PolarHBondContact O-N 3.27Å
2645	N	30.9	Very low	32.4	Very low	113.333 Å²	113.333	154.4 Å²	154.4	61%	0.606	76%	0.76	S	S	*	*			trans	-108.1	55.5	170.5	-75.3	-63.3	0	0	0	110.1	D2643 E2647	D2643-N2645 PolarHBondContact O-N 3.3Å; D2643-N2645 PolarHBondContact O-ND2 3.11Å; D2643-N2645 PolarHBondContact OD1-ND2 3.12Å; D2643-N2645 PolarHBondContact OD2-ND2 2.88Å; N2645-E2647 PolarHBondContact O-N 3.29Å
2646	D	34.5	Very low	32.5	Very low	156.333 Å²	156.333	153.5 Å²	153.5	84%	0.836	76%	0.76	S	S	*	*			trans	-105.8	24.8	166	-90.3	-20.9	0	0	0	110.9	D2644 D2648	D2644-D2646 PolarHBondContact O-N 3.27Å; D2646-D2648 VanDerWaalsContact C-N 3.33Å; D2646-D2648 PolarHBondContact O-N 2.79Å
2647	E	30.7	Very low	32.4	Very low	168.667 Å²	168.667	154.2 Å²	154.2	79%	0.788	76%	0.76	S	S	*	*			trans	-98.7	57.2	171.4	-68.7	-165.2	148.7	0	0	111.8	N2645 D2649	N2645-E2647 PolarHBondContact O-N 3.29Å; E2647-D2649 PolarHBondContact O-N 2.91Å
2648	D	33.5	Very low	32.4	Very low	153 Å²	153	151.2 Å²	151.2	82%	0.818	76%	0.755	S	S	*	*			trans	-56.9	79	176.4	-76.6	-30.1	0	0	0	115	D2646	D2646-D2648 VanDerWaalsContact C-N 3.33Å; D2646-D2648 PolarHBondContact O-N 2.79Å
2649	D	36	Very low	32.4	Very low	142 Å²	142	151.6 Å²	151.6	76%	0.759	77%	0.767	S	S	*	*			trans	-128.7	38.6	168.6	-110.4	-8.5	0	0	0	114.8	E2647 K2825	E2647-D2649 PolarHBondContact O-N 2.91Å; D2649-K2825 IonicContact OD2-NZ 3.79Å; D2649-K2825 PolarHBondContact OD2-NZ 2.95Å
2650	D	35.6	Very low	32.4	Very low	116 Å²	116	151.3 Å²	151.3	62%	0.62	77%	0.771	S	S	*	*			trans	-126.6	32.7	177.1	-111	-26.3	0	0	0	113	V2652 R2852 R2966	D2650-V2652 PolarHBondContact O-N 2.69Å; D2650-R2852 IonicContact OD1-NH1 3.89Å; D2650-R2852 PolarHBondContact OD1-NH1 3.35Å; D2650-R2852 IonicContact OD1-NH2 2.68Å; D2650-R2966 IonicContact OD1-CZ 2.83Å; D2650-R2966 IonicContact OD1-NH1 3.21Å; D2650-R2966 IonicContact OD1-NH2 3.35Å; D2650-R2966 PolarHBondContact OD1-NH2 3Å; D2650-R2966 IonicContact OD2-CZ 2.81Å; D2650-R2966 IonicContact OD2-NH1 2.67Å; D2650-R2966 PolarHBondContact OD2-NH1 2.81Å; D2650-R2966 IonicContact OD2-NH2 3.52Å; D2650-R2966 PolarHBondContact OD2-NH2 3.1Å
2651	E	34	Very low	32.3	Very low	178.667 Å²	178.667	146.3 Å²	146.3	84%	0.835	77%	0.771	S	S	*	*			trans	-130.1	95.1	162.2	-141.2	-178.4	-164	0	0	116
2652	V	33.2	Very low	32.3	Very low	119.667 Å²	119.667	143.4 Å²	143.4	73%	0.725	77%	0.771	S	S	*	*			trans	-106.6	77.6	173.3	-107.1	0	0	0	0	112.7	D2650	D2650-V2652 PolarHBondContact O-N 2.69Å
2653	N	32.3	Very low	32.3	Very low	146 Å²	146	140.4 Å²	140.4	78%	0.781	77%	0.768	S	S	*	*			trans	176.3	100.9	141	-144.9	-10.2	0	0	0	114.3
2654	R	32.6	Very low	32.3	Very low	231 Å²	231	140.9 Å²	140.9	87%	0.872	77%	0.771	S	S	*	*			trans	-151.4	124.6	151.2	-88.1	157	-175.6	159.4	3.3	111.5	T2656	R2654-T2656 PolarHBondContact O-N 2.97Å
2655	E	30.2	Very low	32.2	Very low	170 Å²	170	143.6 Å²	143.6	79%	0.794	78%	0.776	S	S	*	*			trans	-68.1	124.9	156.5	-83	-162.9	165.2	0	0	114.2	K2657	E2655-K2657 IonicContact OE1-NZ 3.78Å; E2655-K2657 PolarHBondContact OE1-NZ 3.06Å; E2655-K2657 IonicContact OE2-NZ 3.02Å; E2655-K2657 PolarHBondContact OE2-NZ 2.7Å
2656	T	31.9	Very low	32.2	Very low	125.667 Å²	125.667	145.9 Å²	145.9	77%	0.771	79%	0.788	S	S	*	*			trans	-135	120.8	157.7	-42.3	0	0	0	0	110.3	R2654 V2658	R2654-T2656 PolarHBondContact O-N 2.97Å; T2656-V2658 PolarHBondContact O-N 3.48Å
2657	K	31	Very low	31.8	Very low	186 Å²	186	143.4 Å²	143.4	81%	0.809	78%	0.783	S	S	*	*			trans	-106.6	128.9	166.4	-77.4	168.9	-178	148.2	0	110.5	E2655	E2655-K2657 IonicContact OE1-NZ 3.78Å; E2655-K2657 PolarHBondContact OE1-NZ 3.06Å; E2655-K2657 IonicContact OE2-NZ 3.02Å; E2655-K2657 PolarHBondContact OE2-NZ 2.7Å
2658	V	30.4	Very low	31.9	Very low	136.333 Å²	136.333	140.8 Å²	140.8	83%	0.826	78%	0.78	S	S	*	*			trans	-110.3	118.7	139.3	178.5	0	0	0	0	111.1	T2656	T2656-V2658 PolarHBondContact O-N 3.48Å
2659	A	30	Very low	31.6	Very low	96.6667 Å²	96.6667	138.6 Å²	138.6	80%	0.799	78%	0.777	S	S	*	*			trans	-96.3	141.7	162.7	0	0	0	0	0	111.9
2660	D	30.7	Very low	31.5	Very low	160.333 Å²	160.333	137.4 Å²	137.4	86%	0.857	78%	0.78	S	S	*	*				-145.3	170	117.1	-159.6	6.7	0	0	0	112.4	G2662	D2660-G2662 PolarHBondContact O-N 3.29Å
2661	A	33.1	Very low	31.2	Very low	92.3333 Å²	92.3333	141.3 Å²	141.3	76%	0.763	79%	0.791	S	S	*	*			trans	-53.9	147.5	-169.7	0	0	0	0	0	117.9
2662	G	30.4	Very low	31	Very low	69 Å²	69	139.9 Å²	139.9	71%	0.711	79%	0.789	S	S	*	*				141.7	171.1	84.3	0	0	0	0	0	115.1	D2660	D2660-G2662 PolarHBondContact O-N 3.29Å
2663	V	32.7	Very low	30.9	Very low	129.667 Å²	129.667	142.3 Å²	142.3	79%	0.786	79%	0.792	S	S	*	*			trans	117.8	110.5	130.8	-179.2	0	0	0	0	114.7
2664	N	31.9	Very low	30.7	Very low	136.667 Å²	136.667	140.4 Å²	140.4	73%	0.731	79%	0.79	S	S	*	*			trans	52.4	116	138	-62.8	-19.1	0	0	0	120.1
2665	K	30	Very low	30.6	Very low	187.667 Å²	187.667	136.4 Å²	136.4	82%	0.816	79%	0.786	S	S	*	*				178.7	135.8	82.4	-101.8	178	177.4	178.7	0	111.4
2666	L	30.9	Very low	30.7	Very low	163 Å²	163	137.6 Å²	137.6	85%	0.853	79%	0.789	S	S	*	*			trans	-126.3	135.2	131.8	-77.6	138.4	0	0	0	114
2667	S	26.1	Very low	30.4	Very low	103 Å²	103	138.5 Å²	138.5	72%	0.72	79%	0.788	S	S	*	*			trans	-96	170.6	164.8	58.5	0	0	0	0	110.2
2668	P	34.2	Very low	30.4	Very low	114.333 Å²	114.333	139.1 Å²	139.1	74%	0.742	79%	0.787	S	S	*	*			cis	-124.8	154.2	11.9	38.3	-22.5	0	0	0	114.5
2669	S	26.9	Very low	30.4	Very low	106 Å²	106	141.6 Å²	141.6	74%	0.741	79%	0.786	S	S	*	*			trans	37.6	120.3	153.8	94	0	0	0	0	117.5
2670	S	33.6	Very low	30.4	Very low	117 Å²	117	141.4 Å²	141.4	82%	0.818	78%	0.779	S	S	*	*				-169.9	129.1	123.9	48.8	0	0	0	0	112.8
2671	K	28.8	Very low	30.5	Very low	198 Å²	198	142.5 Å²	142.5	86%	0.861	78%	0.776	S	S	*	*			trans	-47.5	131.6	162.9	-67	176.2	174	-179.7	0	114.2
2672	L	30.4	Very low	30.6	Very low	149.667 Å²	149.667	143.9 Å²	143.9	78%	0.784	77%	0.771	S	S	*	*			trans	171.4	132.2	139.1	-105.7	112.8	0	0	0	115.5
2673	Q	30.6	Very low	30.8	Very low	169.667 Å²	169.667	147.7 Å²	147.7	79%	0.793	78%	0.775	S	S	*	*			trans	36.7	111.7	155.6	-72.4	171.9	-15.8	0	0	119.7
2674	S	28.2	Very low	30.9	Very low	106.667 Å²	106.667	147 Å²	147	75%	0.746	78%	0.776	S	S	*	*			trans	64.3	136.3	130.7	69.8	0	0	0	0	118.9
2675	N	30.5	Very low	31	Very low	146.333 Å²	146.333	145 Å²	145	78%	0.783	78%	0.778	S	S	*	*			trans	103.1	99.7	155.5	-93.6	-17.4	0	0	0	118.3
2676	K	32.5	Very low	31	Very low	196.333 Å²	196.333	141.1 Å²	141.1	85%	0.854	78%	0.775	S	S	*	*			trans	76.9	116.3	133.9	-80.1	-174.5	177.1	174.6	0	117.4
2677	L	26.3	Very low	31.2	Very low	143 Å²	143	138.2 Å²	138.2	75%	0.749	77%	0.768	S	S	*	*			trans	72.8	140.9	141.8	-167.3	70.1	0	0	0	116.8
2678	Y	30	Very low	31.5	Very low	200.333 Å²	200.333	140 Å²	140	79%	0.786	77%	0.77	S	S	*	*			trans	107	131.1	155	-67.5	-69.2	0	0	0	114.2
2679	K	30.6	Very low	31.5	Very low	188.667 Å²	188.667	140.4 Å²	140.4	82%	0.82	77%	0.77	S	S	*	*				-176.3	124.6	79.5	-126.7	-178.3	175.4	178.9	0	110.9
2680	S	30.6	Very low	31.7	Very low	92.6667 Å²	92.6667	140.3 Å²	140.3	65%	0.648	77%	0.769	S	S	*	*				-172.8	152.4	92.8	27.1	0	0	0	0	112.7
2681	K	33.2	Very low	31.7	Very low	182 Å²	182	139.9 Å²	139.9	79%	0.791	77%	0.767	S	S	*	*			trans	159.9	130.2	153.6	-101	179.9	165.3	-149.7	0	113.6
2682	D	34.3	Very low	31.9	Very low	121.333 Å²	121.333	136.4 Å²	136.4	65%	0.649	76%	0.762	S	S	*	*				122.8	135	78.2	-74.9	-13.6	0	0	0	111.9
2683	D	33.8	Very low	32	Very low	149.667 Å²	149.667	138.3 Å²	138.3	80%	0.8	76%	0.764	S	S	*	*				-135.8	129.7	128.4	-76.4	-47.5	0	0	0	113.8
2684	S	35	Very low	32.1	Very low	115 Å²	115	137.1 Å²	137.1	80%	0.804	76%	0.763	S	S	*	*				164.5	153.9	104.4	-30.7	0	0	0	0	117.6
2685	A	33.6	Very low	32.3	Very low	94 Å²	94	139.4 Å²	139.4	78%	0.777	77%	0.767	S	S	*	*			trans	66.3	113.3	154.5	0	0	0	0	0	118.9
2686	S	31.7	Very low	32.8	Very low	107 Å²	107	138 Å²	138	75%	0.748	77%	0.766	S	S	*	*				-176.5	154	82.4	58	0	0	0	0	112.9
2687	S	34	Very low	32.7	Very low	100.667 Å²	100.667	133.2 Å²	133.2	70%	0.704	76%	0.762	S	S	*	*			trans	94.8	138.2	144.3	64.8	0	0	0	0	115.6
2688	D	31.9	Very low	33.1	Very low	142.667 Å²	142.667	134.4 Å²	134.4	76%	0.763	77%	0.766	S	S	*	*				162.8	158.9	83.8	-91.4	-43.9	0	0	0	114
2689	T	34.7	Very low	33.2	Very low	121.667 Å²	121.667	131.9 Å²	131.9	75%	0.746	77%	0.765	S	S	*	*			cis	171.3	151.8	47.6	12.2	0	0	0	0	115.5
2690	S	31.5	Very low	33.3	Very low	103.333 Å²	103.333	126.8 Å²	126.8	72%	0.723	76%	0.759	S	S	*	*			trans	22.4	123.2	151.6	64.3	0	0	0	0	119.2
2691	S	33.8	Very low	33.3	Very low	110 Å²	110	128.1 Å²	128.1	77%	0.769	76%	0.763	S	S	*	*				156.2	131.4	111.8	59.4	0	0	0	0	115
2692	T	32.1	Very low	33.3	Very low	123.667 Å²	123.667	125 Å²	125	76%	0.759	76%	0.759	S	S	*	*				26.1	129	111.6	26.7	0	0	0	0	117.8
2693	K	32.4	Very low	33.3	Very low	190.333 Å²	190.333	127.8 Å²	127.8	83%	0.828	77%	0.768	S	S	*	*				76.4	130.2	99.4	-85.5	179.6	177.8	-176.8	0	116.5
2694	N	34.3	Very low	33.1	Very low	144.667 Å²	144.667	123.8 Å²	123.8	77%	0.774	76%	0.762	S	S	*	*			trans	100.3	114	154.7	-65.5	-1.9	0	0	0	116.4
2695	D	32.1	Very low	32.9	Very low	154 Å²	154	125.5 Å²	125.5	82%	0.824	76%	0.762	S	S	*	*				-148.3	152.3	124.5	-93.1	-13.3	0	0	0	113.7
2696	P	40	Very low	32.8	Very low	117.667 Å²	117.667	128.7 Å²	128.7	76%	0.764	77%	0.765	S	S	*	*			trans	-128.1	172.8	-162.1	39.4	-24.9	0	0	0	114.8
2697	A	31.1	Very low	32.8	Very low	95 Å²	95	129.5 Å²	129.5	79%	0.785	77%	0.766	S	S	*	*			trans	81	146.3	162.3	0	0	0	0	0	116.5
2698	M	34.2	Very low	32.6	Very low	167.333 Å²	167.333	130.7 Å²	130.7	82%	0.824	77%	0.769	S	S	*	*				178.7	127.4	120.4	-100.9	-148.3	148.8	0	0	116.9
2699	L	31.9	Very low	32.6	Very low	148 Å²	148	129.3 Å²	129.3	78%	0.775	77%	0.767	S	S	*	*			trans	36.6	138.4	141.9	-86.6	86.9	0	0	0	120.3
2700	A	32.7	Very low	32.7	Very low	82 Å²	82	128.6 Å²	128.6	68%	0.678	77%	0.765	S	S	*	*			cis	-152.7	140.2	22.2	0	0	0	0	0	111.2
2701	T	31.4	Very low	32.6	Very low	120 Å²	120	132.2 Å²	132.2	74%	0.736	77%	0.77	S	S	*	*			trans	26.2	140.1	154	-20.9	0	0	0	0	117.6
2702	T	33	Very low	32.3	Very low	116.333 Å²	116.333	138.3 Å²	138.3	71%	0.714	78%	0.778	S	S	*	*			cis	-163.3	153.1	-14.2	-40.7	0	0	0	0	107.5
2703	H	34.8	Very low	32.1	Very low	181.333 Å²	181.333	136 Å²	136	84%	0.84	78%	0.779	S	S	*	*			trans	-111.7	154.1	-177.3	-75.3	-76	0	0	0	112.3
2704	G	29.9	Very low	31.9	Very low	64.6667 Å²	64.6667	132.6 Å²	132.6	67%	0.667	78%	0.779	S	S	*	*			cis	-159	162.5	-1.8	0	0	0	0	0	113.5
2705	N	30.6	Very low	31.7	Very low	151 Å²	151	133.7 Å²	133.7	81%	0.807	78%	0.78	S	S	*	*			trans	70.9	105.7	161.2	-67.6	5.7	0	0	0	121.1
2706	L	29.9	Very low	31.5	Very low	161 Å²	161	134 Å²	134	84%	0.843	78%	0.781	S	S	*	*				81.5	121.7	119.8	-99.6	82.1	0	0	0	114.7
2707	V	31.8	Very low	30.9	Very low	125 Å²	125	134.4 Å²	134.4	76%	0.758	78%	0.781	S	S	*	*				152.6	118.5	84.3	171.2	0	0	0	0	112.4
2708	T	30.6	Very low	30.7	Very low	125.667 Å²	125.667	134.4 Å²	134.4	77%	0.771	78%	0.781	S	S	*	*			trans	63.2	140.7	142.1	-13.5	0	0	0	0	118.6
2709	P	32.6	Very low	30.5	Very low	111.667 Å²	111.667	131.6 Å²	131.6	73%	0.725	78%	0.778	S	S	*	*			trans	-100.2	-174.6	-174.1	42.4	-36	0	0	0	113
2710	P	35.4	Very low	30.4	Very low	107 Å²	107	129.5 Å²	129.5	70%	0.695	78%	0.776	S	S	*	*				-146.5	171	83.2	40.5	-23.4	0	0	0	117.1
2711	Q	29.6	Very low	30.3	Very low	179 Å²	179	134.2 Å²	134.2	84%	0.836	78%	0.783	S	S	*	*			trans	79.5	115.4	148.1	-73	173.2	-7.3	0	0	121.5
2712	Y	27.6	Very low	30.2	Very low	238.667 Å²	238.667	136.2 Å²	136.2	94%	0.936	78%	0.784	S	S	*	*			trans	-116.1	120.4	146.6	-100	-100.9	0	0	0	113.1
2713	G	28.5	Very low	29.9	Very low	76.3333 Å²	76.3333	137.4 Å²	137.4	79%	0.787	79%	0.786	S	S	*	*			trans	-135.1	139.4	168.8	0	0	0	0	0	110.2	E2715	G2713-E2715 PolarHBondContact O-N 3.48Å; G2713-E2715 VanDerWaalsContact O-N 3.16Å
2714	S	28.7	Very low	29.6	Very low	118.667 Å²	118.667	139.6 Å²	139.6	83%	0.83	79%	0.788	S	S	*	*			trans	-106.4	120.9	173.9	-172.6	0	0	0	0	111.9
2715	E	28.5	Very low	29.5	Very low	167 Å²	167	146.1 Å²	146.1	78%	0.78	80%	0.798	S	S	*	*			trans	-155.2	116.2	159.4	-88.7	-179.1	141.1	0	0	114.5	G2713 T2717	G2713-E2715 PolarHBondContact O-N 3.48Å; G2713-E2715 VanDerWaalsContact O-N 3.16Å; E2715-T2717 HydrophobicContact CG-CG2 4.11Å
2716	L	28.7	Very low	29.4	Very low	161.333 Å²	161.333	143.5 Å²	143.5	85%	0.845	80%	0.797	S	S	*	*			trans	-169.2	79.5	147.4	-76.4	176	0	0	0	112.3
2717	T	26.5	Very low	29.4	Very low	126 Å²	126	141.5 Å²	141.5	77%	0.773	80%	0.797	S	S	*	*			trans	-68	116.2	153.6	50.6	0	0	0	0	112.9	E2715 S2719	E2715-T2717 HydrophobicContact CG-CG2 4.11Å; T2717-S2719 PolarHBondContact O-N 3.32Å
2718	A	28.2	Very low	29.3	Very low	94.3333 Å²	94.3333	138.9 Å²	138.9	78%	0.78	80%	0.795	S	S	*	*			trans	-107.7	112.1	164.6	0	0	0	0	0	109.5	S2720	A2718-S2720 VanDerWaalsContact C-N 3.32Å; A2718-S2720 WeakPolarHBondContact CB-OG 3.36Å; A2718-S2720 PolarHBondContact O-N 3.37Å; A2718-S2720 VanDerWaalsContact O-N 3.1Å
2719	S	29.2	Very low	29.2	Very low	108 Å²	108	143 Å²	143	76%	0.755	80%	0.803	S	S	*	*			trans	-92.7	105	164.7	54.8	0	0	0	0	109.9	T2717 E2721	T2717-S2719 PolarHBondContact O-N 3.32Å; S2719-E2721 VanDerWaalsContact C-N 3.27Å; S2719-E2721 PolarHBondContact O-N 3.33Å
2720	S	30.3	Very low	29.2	Very low	104.667 Å²	104.667	147.5 Å²	147.5	73%	0.732	81%	0.811	S	S	*	*			trans	-110.1	59	171.9	-75.4	0	0	0	0	112.5	A2718 E2722	A2718-S2720 VanDerWaalsContact C-N 3.32Å; A2718-S2720 WeakPolarHBondContact CB-OG 3.36Å; A2718-S2720 PolarHBondContact O-N 3.37Å; A2718-S2720 VanDerWaalsContact O-N 3.1Å; S2720-E2722 PolarHBondContact O-N 3.47Å
2721	E	31.2	Very low	29	Very low	179.667 Å²	179.667	148.4 Å²	148.4	84%	0.84	82%	0.82	S	S	*	*	S	Bend	trans	-91.5	22.8	159.6	-83.1	-160.3	137.5	0	0	111.6	K2598 S2719	K2598-E2721 IonicContact NZ-OE1 3.23Å; K2598-E2721 PolarHBondContact NZ-OE1 2.68Å; S2719-E2721 VanDerWaalsContact C-N 3.27Å; S2719-E2721 PolarHBondContact O-N 3.33Å
2722	E	28	Very low	29.1	Very low	162 Å²	162	143.4 Å²	143.4	76%	0.757	82%	0.816	S	S	*	*			trans	-146.7	49.1	-174.6	-108.2	-163.2	-177.1	0	0	114.9	S2720 K2725	S2720-E2722 PolarHBondContact O-N 3.47Å; E2722-K2725 IonicContact OE1-NZ 2.92Å; E2722-K2725 PolarHBondContact OE1-NZ 3.12Å
2723	L	27.1	Very low	29.5	Very low	141.667 Å²	141.667	134.7 Å²	134.7	74%	0.742	80%	0.8	S	S	*	*	S	Bend	trans	-140.3	42.5	168.3	-148.6	78.7	0	0	0	115.6
2724	Y	29.8	Very low	30.2	Very low	229 Å²	229	137.4 Å²	137.4	90%	0.898	80%	0.803	S	S	*	*			trans	-149	58.7	160.1	-73.7	-65.2	0	0	0	112.9	A2726	Y2724-A2726 PolarHBondContact O-N 2.95Å
2725	K	26.2	Very low	31.3	Very low	201 Å²	201	137.3 Å²	137.3	87%	0.874	80%	0.797	S	S	*	*			trans	-111	51.5	162.8	-79.8	-179.1	-176.2	160.9	0	111.5	E2722 S2727	E2722-K2725 IonicContact OE1-NZ 2.92Å; E2722-K2725 PolarHBondContact OE1-NZ 3.12Å; K2725-S2727 PolarHBondContact O-N 2.92Å
2726	A	29.4	Very low	32.9	Very low	95.6667 Å²	95.6667	132.8 Å²	132.8	79%	0.791	78%	0.782	S	S	*	*			trans	-113	70.9	175.3	0	0	0	0	0	112	Y2724	Y2724-A2726 PolarHBondContact O-N 2.95Å
2727	S	29.9	Very low	35.4	Very low	118.333 Å²	118.333	132 Å²	132	83%	0.828	77%	0.774	S	S	*	*			trans	-108.6	135.3	163.3	59.1	0	0	0	0	112.7	K2725	K2725-S2727 PolarHBondContact O-N 2.92Å
2728	G	30.1	Very low	38.5	Very low	70.6667 Å²	70.6667	126.4 Å²	126.4	73%	0.729	74%	0.74	S	S	*	*			trans	66	95.3	154.4	0	0	0	0	0	114.5	K2730	G2728-K2730 PolarHBondContact O-N 3.37Å
2729	K	28.4	Very low	41.6	Very low	212 Å²	212	122 Å²	122	92%	0.922	70%	0.703	S	S	*	*			trans	-91.1	104.9	152	-82.6	175.5	178.2	175.6	0	109.6	S2731	K2729-S2731 VanDerWaalsContact C-N 3.32Å; K2729-S2731 PolarHBondContact O-N 3.34Å
2730	K	31.5	Very low	44.7	Very low	206 Å²	206	119.9 Å²	119.9	90%	0.896	69%	0.687	S	S	*	*			trans	-98.5	123.2	159.8	-74.5	-176.8	175.7	179.2	0	108.7	G2728 G2732	G2728-K2730 PolarHBondContact O-N 3.37Å; K2730-G2732 PolarHBondContact O-N 2.95Å
2731	S	31.8	Very low	47.8	Very low	126.333 Å²	126.333	119 Å²	119	88%	0.883	67%	0.671	S	S	*	*			trans	-80.7	96.6	172.3	53.4	0	0	0	0	109.3	K2729 G2733	K2729-S2731 VanDerWaalsContact C-N 3.32Å; K2729-S2731 PolarHBondContact O-N 3.34Å; S2731-G2733 PolarHBondContact O-N 3.25Å
2732	G	30.8	Very low	50.9	Low	73.3333 Å²	73.3333	110.4 Å²	110.4	76%	0.756	63%	0.631	S	S	*	*			trans	-114.9	125.4	166.2	0	0	0	0	0	108.8	K2730	K2730-G2732 PolarHBondContact O-N 2.95Å
2733	G	35.7	Very low	54.1	Low	57.6667 Å²	57.6667	102.8 Å²	102.8	60%	0.595	60%	0.596	S	S	*	*	P	Polyproline II helix	trans	-67.7	159.5	169.8	0	0	0	0	0	110.8	S2731 V2735	S2731-G2733 PolarHBondContact O-N 3.25Å; G2733-V2735 PolarHBondContact O-N 3.15Å; G2733-V2735 VanDerWaalsContact O-N 3.14Å
2734	P	45.3	Very low	57.4	Low	132 Å²	132	100 Å²	100	86%	0.857	58%	0.582	S	S	*	*	P	Polyproline II helix	trans	-56.9	118.3	176.2	8.9	-11.6	0	0	0	109.8
2735	V	51.4	Low	60.6	Low	116.333 Å²	116.333	89.2 Å²	89.2	71%	0.705	54%	0.539	S	S	*	.	P	Polyproline II helix	trans	-61.9	129.3	175.9	-179.1	0	0	0	0	107.8	G2733 Q2737	G2733-V2735 PolarHBondContact O-N 3.15Å; G2733-V2735 VanDerWaalsContact O-N 3.14Å; V2735-Q2737 PolarHBondContact O-N 3.23Å; V2735-Q2737 VanDerWaalsContact O-N 3.14Å
2736	P	62.4	Low	64	Low	72 Å²	72	79.6 Å²	79.6	47%	0.468	50%	0.498	S	S	.	.	P	Polyproline II helix	trans	-57.7	124	177.4	-7.8	11.9	0	0	0	109.9	L2549 L2600 V2738	L2549-P2736 WeakPolarHBondContact CD2-O 3.43Å; L2600-P2736 HydrophobicContact CD2-CB 4.34Å; P2736-V2738 VanDerWaalsContact C-N 3.28Å; P2736-V2738 PolarHBondContact O-N 3.29Å
2737	Q	80.9	Confident	67.2	Low	144.333 Å²	144.333	75.6 Å²	75.6	67%	0.674	46%	0.463	S	S	*	.	S	Bend	trans	-76.4	-12.1	177.9	-98.6	-176.6	-13.1	0	0	112.8	Q2552 V2735	Q2552-Q2737 PolarHBondContact NE2-O 3.18Å; Q2552-Q2737 VanDerWaalsContact NE2-O 3.11Å; V2735-Q2737 PolarHBondContact O-N 3.23Å; V2735-Q2737 VanDerWaalsContact O-N 3.14Å
2738	V	90.6	Very high	70.3	Confident	8.66667 Å²	8.66667	70.2 Å²	70.2	5%	0.053	42%	0.424	C	S	.	.	S	Bend	trans	-127.2	133	-174.5	-172.7	0	0	0	0	109.6	L2549 Q2552 K2598 L2600 P2736	L2549-V2738 VanDerWaalsContact CD2-C 3.48Å; Q2552-V2738 VanDerWaalsContact OE1-CA 3.3Å; K2598-V2738 HydrophobicContact CB-CG2 3.75Å; K2598-V2738 HydrophobicContact CD-CG2 4.29Å; L2600-V2738 HydrophobicContact CD2-CB 4.2Å; L2600-V2738 HydrophobicContact CG-CB 4.35Å; P2736-V2738 VanDerWaalsContact C-N 3.28Å; P2736-V2738 PolarHBondContact O-N 3.29Å
2739	A	93.6	Very high	73.5	Confident	1.66667 Å²	1.66667	66.8 Å²	66.8	1%	0.014	39%	0.39	C	S	.	.			trans	-68.4	134.4	174.1	0	0	0	0	0	110.7	L2549 Q2552 A2553 E2741 L2742 S2743	L2549-A2739 HydrophobicContact CD2-CB 4.17Å; L2549-A2739 VanDerWaalsContact CD2-N 3.34Å; Q2552-A2739 HydrophobicContact CB-CB 3.61Å; A2553-A2739 HydrophobicContact CB-CB 4.48Å; A2739-E2741 VanDerWaalsContact C-N 3.25Å; A2739-E2741 PolarHBondContact O-N 3.09Å; A2739-L2742 PolarHBondContact O-N 3.03Å; A2739-L2742 VanDerWaalsContact O-N 3.1Å; A2739-S2743 PolarHBondContact O-N 3.04Å
2740	P	94.3	Very high	76.7	Confident	64 Å²	64	57.9 Å²	57.9	42%	0.416	35%	0.351	S	S	.	.	H	α-helix	trans	-53.4	-41.4	179.7	-11.8	14.6	0	0	0	112.8	L2600 L2742 S2743 D2744	L2600-P2740 HydrophobicContact CD1-CB 4.37Å; L2600-P2740 HydrophobicContact CD1-CG 4.09Å; P2740-L2742 VanDerWaalsContact C-N 3.28Å; P2740-L2742 PolarHBondContact O-N 3.41Å; P2740-L2742 VanDerWaalsContact O-N 3.15Å; P2740-S2743 CarbonylContact O-C 3.56Å; P2740-S2743 WeakPolarHBondContact O-CB 3.46Å; P2740-S2743 PolarHBondContact O-N 2.88Å; P2740-S2743 VanDerWaalsContact O-N 3.09Å; P2740-D2744 VanDerWaalsContact O-CG 3.23Å; P2740-D2744 PolarHBondContact O-N 3.26Å
2741	E	95.9	Very high	79.8	Confident	85.6667 Å²	85.6667	49.2 Å²	49.2	40%	0.4	32%	0.318	S	S	.	.	H	α-helix	trans	-61.5	-31.2	-178.1	-57	86.6	164.2	0	0	113.1	A2553 A2556 A2739	A2553-E2741 HydrophobicContact CB-CB 4.44Å; A2553-E2741 HydrophobicContact CB-CG 4.39Å; A2556-E2741 HydrophobicContact CB-CB 3.94Å; A2556-E2741 VanDerWaalsContact CB-O 3.3Å; A2556-E2741 WeakPolarHBondContact CB-O 3.41Å; A2739-E2741 VanDerWaalsContact C-N 3.25Å; A2739-E2741 PolarHBondContact O-N 3.09Å
2742	L	96.3	Very high	82.7	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-85.3	-38	176.5	-174.4	58.9	0	0	0	111.3	I2543 Q2552 M2555 A2556 F2559 N2597 A2739 P2740 D2744 L2745	I2543-L2742 HydrophobicContact CD1-CD1 4.36Å; Q2552-L2742 HydrophobicContact CB-CD2 3.93Å; Q2552-L2742 HydrophobicContact CG-CD2 4.19Å; M2555-L2742 HydrophobicContact CE-CD2 4.29Å; A2556-L2742 HydrophobicContact CB-CB 4.1Å; A2556-L2742 HydrophobicContact CB-CD1 4.24Å; F2559-L2742 HydrophobicContact CD2-CD1 4.34Å; F2559-L2742 HydrophobicContact CE2-CD1 4.28Å; N2597-L2742 VanDerWaalsContact ND2-CD2 3.34Å; N2597-L2742 WeakPolarHBondContact ND2-CD2 3.46Å; N2597-L2742 WeakPolarHBondContact ND2-CG 3.34Å; A2739-L2742 PolarHBondContact O-N 3.03Å; A2739-L2742 VanDerWaalsContact O-N 3.1Å; P2740-L2742 VanDerWaalsContact C-N 3.28Å; P2740-L2742 PolarHBondContact O-N 3.41Å; P2740-L2742 VanDerWaalsContact O-N 3.15Å; L2742-D2744 VanDerWaalsContact C-N 3.27Å; L2742-D2744 PolarHBondContact O-N 3.19Å; L2742-L2745 PolarHBondContact O-N 3Å; L2742-L2745 VanDerWaalsContact O-N 3.17Å
2743	S	95.8	Very high	85.6	Confident	2 Å²	2	50.2 Å²	50.2	1%	0.014	29%	0.289	C	S	.	.	H	α-helix	trans	-59.7	-36.1	172.8	169.2	0	0	0	0	112.4	K2599 L2600 A2739 P2740 L2745 V2746	K2599-S2743 WeakPolarHBondContact CG-OG 3.24Å; K2599-S2743 PolarHBondContact NZ-O 2.99Å; L2600-S2743 WeakPolarHBondContact CB-OG 3.15Å; L2600-S2743 PolarHBondContact N-OG 3.08Å; A2739-S2743 PolarHBondContact O-N 3.04Å; P2740-S2743 CarbonylContact O-C 3.56Å; P2740-S2743 WeakPolarHBondContact O-CB 3.46Å; P2740-S2743 PolarHBondContact O-N 2.88Å; P2740-S2743 VanDerWaalsContact O-N 3.09Å; S2743-L2745 VanDerWaalsContact C-N 3.25Å; S2743-L2745 PolarHBondContact O-N 3.22Å; S2743-V2746 WeakPolarHBondContact O-CB 3.23Å; S2743-V2746 PolarHBondContact O-N 3.05Å; S2743-V2746 VanDerWaalsContact O-N 3.13Å
2744	D	95.7	Very high	88.2	Confident	83.6667 Å²	83.6667	49.8 Å²	49.8	45%	0.447	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-25.1	178	-70.3	-13.9	0	0	0	113	P2740 L2742 V2746	P2740-D2744 VanDerWaalsContact O-CG 3.23Å; P2740-D2744 PolarHBondContact O-N 3.26Å; L2742-D2744 VanDerWaalsContact C-N 3.27Å; L2742-D2744 PolarHBondContact O-N 3.19Å; D2744-V2746 VanDerWaalsContact C-N 3.3Å; D2744-V2746 PolarHBondContact O-N 3.04Å
2745	L	97.2	Very high	90.2	Very high	1 Å²	1	50.8 Å²	50.8	1%	0.005	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-9.9	176.3	-63.7	-180	0	0	0	113.5	A2556 F2559 K2560 L2567 I2595 L2742 S2743 I2747	A2556-L2745 HydrophobicContact CB-CD1 3.89Å; F2559-L2745 HydrophobicContact CB-CD1 4.03Å; F2559-L2745 HydrophobicContact CD2-CD1 4.24Å; K2560-L2745 HydrophobicContact CD-CD2 4.4Å; K2560-L2745 VanDerWaalsContact CE-CD2 3.45Å; K2560-L2745 HydrophobicContact CG-CD1 4.4Å; K2560-L2745 HydrophobicContact CG-CD2 4.04Å; L2567-L2745 HydrophobicContact CD2-CD1 4.09Å; L2567-L2745 HydrophobicContact CD2-CD2 3.62Å; L2567-L2745 HydrophobicContact CD2-CG 4.45Å; L2567-L2745 HydrophobicContact CG-CD2 4.22Å; I2595-L2745 HydrophobicContact CG1-CB 4.26Å; L2742-L2745 PolarHBondContact O-N 3Å; L2742-L2745 VanDerWaalsContact O-N 3.17Å; S2743-L2745 VanDerWaalsContact C-N 3.25Å; S2743-L2745 PolarHBondContact O-N 3.22Å; L2745-I2747 PolarHBondContact O-N 3.48Å
2746	V	97.1	Very high	91.6	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.241	C	C	.	.			trans	-91	104.1	-179.9	-171.8	0	0	0	0	109.5	I2595 N2597 K2599 S2743 D2744 C2749 Q2750	I2595-V2746 HydrophobicContact CG2-CG2 4.38Å; N2597-V2746 HydrophobicContact CB-CG2 3.79Å; N2597-V2746 WeakPolarHBondContact O-CG1 3.34Å; K2599-V2746 HydrophobicContact CB-CB 4.28Å; K2599-V2746 HydrophobicContact CB-CG1 4.25Å; K2599-V2746 HydrophobicContact CD-CB 4.45Å; K2599-V2746 WeakPolarHBondContact CD-O 3.37Å; K2599-V2746 WeakPolarHBondContact CE-O 3.37Å; K2599-V2746 HydrophobicContact CG-CB 4.4Å; K2599-V2746 PolarHBondContact NZ-O 2.93Å; S2743-V2746 WeakPolarHBondContact O-CB 3.23Å; S2743-V2746 PolarHBondContact O-N 3.05Å; S2743-V2746 VanDerWaalsContact O-N 3.13Å; D2744-V2746 VanDerWaalsContact C-N 3.3Å; D2744-V2746 PolarHBondContact O-N 3.04Å; V2746-C2749 WeakPolarHBondContact CG1-O 3.4Å; V2746-Q2750 HydrophobicContact CG1-CB 4.29Å; V2746-Q2750 HydrophobicContact CG1-CG 3.99Å
2747	I	95.7	Very high	92.6	Very high	12 Å²	12	44.7 Å²	44.7	6%	0.062	23%	0.226	C	C	.	.	S	Bend	trans	-108.4	-78.2	-177.2	-54.8	-57.8	0	0	0	111.2	V2568 F2571 L2745 Q2750	V2568-I2747 HydrophobicContact CG1-CB 4.1Å; V2568-I2747 HydrophobicContact CG1-CG1 4.08Å; V2568-I2747 HydrophobicContact CG1-CG2 4.3Å; F2571-I2747 HydrophobicContact CD1-CG2 3.5Å; F2571-I2747 VanDerWaalsContact CD1-CG2 3.45Å; F2571-I2747 HydrophobicContact CD2-CG2 4.4Å; F2571-I2747 HydrophobicContact CE1-CG2 3.57Å; F2571-I2747 HydrophobicContact CE2-CG2 4.41Å; F2571-I2747 HydrophobicContact CG-CG2 3.94Å; F2571-I2747 HydrophobicContact CZ-CG2 4.08Å; L2745-I2747 PolarHBondContact O-N 3.48Å; I2747-Q2750 WeakPolarHBondContact O-CG 3.38Å; I2747-Q2750 PolarHBondContact O-NE2 2.88Å
2748	Y	96.6	Very high	91.7	Very high	4.33333 Å²	4.33333	42.1 Å²	42.1	2%	0.017	23%	0.229	C	C	.	.	S	Bend	trans	-86.9	-9.4	-173.6	-61.7	-64.6	0	0	0	115.1	V2568 F2571 L2572 F2573 D2576 L2583 P2584 L2589 L2594 Y2814	V2568-Y2748 HydrophobicContact CG1-CD2 4.08Å; V2568-Y2748 HydrophobicContact CG1-CE2 3.83Å; F2571-Y2748 HydrophobicContact CD1-CD1 4.25Å; F2571-Y2748 AromaticContact CD1-CE1 3.62Å; F2571-Y2748 HydrophobicContact CD1-CE1 3.62Å; F2571-Y2748 HydrophobicContact CE1-CD1 4.17Å; F2571-Y2748 AromaticContact CE1-CE1 3.93Å; F2571-Y2748 HydrophobicContact CE1-CE1 3.99Å; L2572-Y2748 PolarHBondContact N-OH 2.87Å; F2573-Y2748 WeakPolarHBondContact CD2-OH 3.34Å; D2576-Y2748 WeakPolarHBondContact OD1-CE1 3.32Å; D2576-Y2748 WeakPolarHBondContact OD2-CE1 3.24Å; D2576-Y2748 PolarHBondContact OD2-OH 2.89Å; L2583-Y2748 HydrophobicContact CD2-CD1 4.24Å; P2584-Y2748 HydrophobicContact CG-CD1 4.17Å; P2584-Y2748 HydrophobicContact CG-CD2 4.37Å; P2584-Y2748 HydrophobicContact CG-CE1 3.76Å; P2584-Y2748 HydrophobicContact CG-CE2 4.11Å; P2584-Y2748 HydrophobicContact CG-CG 4.42Å; L2589-Y2748 HydrophobicContact CD1-CD2 4.48Å; L2589-Y2748 HydrophobicContact CD2-CD2 4.45Å; L2589-Y2748 HydrophobicContact CD2-CE2 4.06Å; L2594-Y2748 HydrophobicContact CD2-CD2 4.07Å; Y2748-Y2814 AromaticContact CD1-CD1 3.91Å; Y2748-Y2814 HydrophobicContact CD1-CD1 3.91Å; Y2748-Y2814 AromaticContact CD1-CE1 3.77Å; Y2748-Y2814 HydrophobicContact CD1-CE1 3.77Å; Y2748-Y2814 HydrophobicContact CE1-CE1 4.13Å
2749	C	96.9	Very high	89.7	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	25%	0.25	C	S	.	.			trans	-128.8	62	-171.6	-57.6	0	0	0	0	111.7	K2596 V2746 A2751 L2816	K2596-C2749 VanDerWaalsContact CA-O 3.27Å; K2596-C2749 WeakPolarHBondContact CA-O 3.37Å; K2596-C2749 HydrophobicContact CB-CB 3.76Å; K2596-C2749 HydrophobicContact CG-CB 4.29Å; V2746-C2749 WeakPolarHBondContact CG1-O 3.4Å; C2749-A2751 PolarHBondContact O-N 3.12Å; C2749-L2816 HydrophobicContact CB-CD1 3.99Å
2750	Q	96.2	Very high	87.1	Confident	24.6667 Å²	24.6667	51.5 Å²	51.5	12%	0.115	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	109.2	-174.9	-53.8	179.1	21.7	0	0	110.2	K2599 V2746 I2747 V2752 Y2814 Q2815 L2816	K2599-Q2750 HydrophobicContact CB-CG 4.46Å; K2599-Q2750 HydrophobicContact CD-CG 4.1Å; V2746-Q2750 HydrophobicContact CG1-CB 4.29Å; V2746-Q2750 HydrophobicContact CG1-CG 3.99Å; I2747-Q2750 WeakPolarHBondContact O-CG 3.38Å; I2747-Q2750 PolarHBondContact O-NE2 2.88Å; Q2750-V2752 PolarHBondContact O-N 2.97Å; Q2750-Y2814 WeakPolarHBondContact CB-O 3.39Å; Q2750-Y2814 PolarHBondContact N-O 3.08Å; Q2750-Q2815 HydrophobicContact CB-CG 4.43Å; Q2750-Q2815 WeakPolarHBondContact O-CA 3.44Å; Q2750-L2816 PolarHBondContact O-N 2.87Å
2751	A	95.4	Very high	84	Confident	22.6667 Å²	22.6667	51.4 Å²	51.4	19%	0.187	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	123.5	-176.8	0	0	0	0	0	111	K2596 N2597 C2749 L2816	K2596-A2751 HydrophobicContact CG-CB 4.36Å; N2597-A2751 VanDerWaalsContact C-CB 3.46Å; N2597-A2751 WeakPolarHBondContact O-CB 3.34Å; N2597-A2751 PolarHBondContact O-N 3.2Å; C2749-A2751 PolarHBondContact O-N 3.12Å; A2751-L2816 WeakPolarHBondContact CA-O 3.37Å
2752	V	93.9	Very high	80.9	Confident	48.6667 Å²	48.6667	54.6 Å²	54.6	30%	0.295	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	154.2	-180	-63.4	0	0	0	0	111.5	Q2750 Q2815 L2816 P2817	Q2750-V2752 PolarHBondContact O-N 2.97Å; V2752-Q2815 HydrophobicContact CG1-CB 4.16Å; V2752-Q2815 HydrophobicContact CG1-CG 4.17Å; V2752-Q2815 HydrophobicContact CG2-CB 4.01Å; V2752-L2816 PolarHBondContact N-O 3.24Å; V2752-P2817 HydrophobicContact CG2-CB 4.44Å; V2752-P2817 HydrophobicContact CG2-CG 4.25Å; V2752-P2817 WeakPolarHBondContact O-CA 3.43Å
2753	K	91.4	Very high	77.7	Confident	173 Å²	173	61 Å²	61	75%	0.752	36%	0.355	S	S	*	.			trans	-72.4	134.5	164.6	-143.5	-179.4	179	-176.2	0	108.4	K2755	K2753-K2755 PolarHBondContact O-N 3.38Å
2754	F	90.2	Very high	74.3	Confident	48.6667 Å²	48.6667	68.6 Å²	68.6	21%	0.213	39%	0.39	C	S	.	.			trans	-65.8	131.8	174.8	-172.6	-109.2	0	0	0	110.1	G2756 F2757 P2817 M2819 L2827 F2838	F2754-G2756 VanDerWaalsContact CE1-CA 3.48Å; F2754-F2757 HydrophobicContact CE2-CE1 4.17Å; F2754-F2757 HydrophobicContact CZ-CD1 4.14Å; F2754-F2757 AromaticContact CZ-CE1 3.78Å; F2754-F2757 HydrophobicContact CZ-CE1 3.78Å; F2754-F2757 HydrophobicContact CZ-CE2 4.32Å; F2754-F2757 AromaticContact CZ-CZ 3.82Å; F2754-F2757 HydrophobicContact CZ-CZ 3.89Å; F2754-P2817 HydrophobicContact CB-CB 3.94Å; F2754-P2817 HydrophobicContact CD2-CB 3.97Å; F2754-P2817 HydrophobicContact CD2-CG 3.86Å; F2754-P2817 HydrophobicContact CE2-CG 4.5Å; F2754-P2817 HydrophobicContact CG-CB 4.28Å; F2754-M2819 HydrophobicContact CB-CE 3.72Å; F2754-M2819 HydrophobicContact CD1-CE 3.76Å; F2754-M2819 HydrophobicContact CD2-CE 4.19Å; F2754-M2819 HydrophobicContact CE1-CE 4.32Å; F2754-M2819 HydrophobicContact CG-CE 3.63Å; F2754-L2827 HydrophobicContact CD1-CD2 4.32Å; F2754-L2827 HydrophobicContact CE1-CD1 3.72Å; F2754-L2827 HydrophobicContact CE1-CD2 3.64Å; F2754-L2827 HydrophobicContact CE1-CG 4.36Å; F2754-L2827 HydrophobicContact CZ-CD1 4.15Å; F2754-L2827 HydrophobicContact CZ-CD2 3.79Å; F2754-F2838 HydrophobicContact CE2-CE1 4.34Å; F2754-F2838 HydrophobicContact CE2-CZ 4.27Å
2755	K	85.9	Confident	71.2	Confident	154.333 Å²	154.333	72.1 Å²	72.1	67%	0.671	41%	0.408	S	S	*	.			trans	-115.6	19.5	-176.5	-64.7	-170.7	177	-172.2	0	113.4	K2753	K2753-K2755 PolarHBondContact O-N 3.38Å
2756	G	82.9	Confident	67.9	Low	24.3333 Å²	24.3333	77.5 Å²	77.5	25%	0.251	44%	0.442	S	S	.	.			trans	79.1	-176.8	-170.1	0	0	0	0	0	112.9	F2754 A2758	F2754-G2756 VanDerWaalsContact CE1-CA 3.48Å; G2756-A2758 PolarHBondContact O-N 3.08Å
2757	F	82.6	Confident	64.6	Low	35.6667 Å²	35.6667	86.1 Å²	86.1	16%	0.156	48%	0.482	C	S	.	.			trans	-88.8	101.2	-178.9	-56.1	-67.3	0	0	0	111.6	F2754 I2759 F2809 L2827 H2831 E2834 L2835 F2838	F2754-F2757 HydrophobicContact CE2-CE1 4.17Å; F2754-F2757 HydrophobicContact CZ-CD1 4.14Å; F2754-F2757 AromaticContact CZ-CE1 3.78Å; F2754-F2757 HydrophobicContact CZ-CE1 3.78Å; F2754-F2757 HydrophobicContact CZ-CE2 4.32Å; F2754-F2757 AromaticContact CZ-CZ 3.82Å; F2754-F2757 HydrophobicContact CZ-CZ 3.89Å; F2757-I2759 PolarHBondContact O-N 3.14Å; F2757-I2759 VanDerWaalsContact O-N 3.11Å; F2757-F2809 HydrophobicContact CD1-CD1 4.27Å; F2757-F2809 AromaticContact CD1-CE1 3.59Å; F2757-F2809 HydrophobicContact CD1-CE1 3.59Å; F2757-F2809 HydrophobicContact CD1-CZ 4.38Å; F2757-F2809 HydrophobicContact CE1-CE1 4.1Å; F2757-F2809 HydrophobicContact CG-CE1 4.43Å; F2757-L2827 HydrophobicContact CD2-CD1 4.26Å; F2757-L2827 HydrophobicContact CE2-CD1 3.8Å; F2757-L2827 HydrophobicContact CE2-CG 4.36Å; F2757-L2827 HydrophobicContact CZ-CD1 3.99Å; F2757-L2827 HydrophobicContact CZ-CD2 4.44Å; F2757-L2827 HydrophobicContact CZ-CG 4.2Å; F2757-H2831 HydrophobicContact CD2-CB 3.92Å; F2757-H2831 AromaticContact CD2-CG 3.75Å; F2757-H2831 HydrophobicContact CE2-CB 3.46Å; F2757-H2831 AromaticContact CE2-CD2 3.92Å; F2757-H2831 AromaticContact CE2-CG 3.59Å; F2757-H2831 HydrophobicContact CZ-CB 3.72Å; F2757-E2834 HydrophobicContact CD1-CB 4.26Å; F2757-E2834 HydrophobicContact CD2-CB 3.76Å; F2757-E2834 HydrophobicContact CD2-CG 4.46Å; F2757-E2834 HydrophobicContact CE1-CB 4.15Å; F2757-E2834 HydrophobicContact CE2-CB 3.91Å; F2757-E2834 HydrophobicContact CG-CB 3.94Å; F2757-E2834 HydrophobicContact CZ-CB 4.22Å; F2757-L2835 HydrophobicContact CE1-CB 4.17Å; F2757-L2835 HydrophobicContact CE1-CD1 4.32Å; F2757-L2835 HydrophobicContact CE2-CB 4.27Å; F2757-L2835 HydrophobicContact CZ-CB 4.15Å; F2757-L2835 HydrophobicContact CZ-CD1 4.3Å; F2757-F2838 HydrophobicContact CD1-CB 3.87Å; F2757-F2838 HydrophobicContact CD1-CD2 4.32Å; F2757-F2838 HydrophobicContact CD1-CG 4.18Å; F2757-F2838 HydrophobicContact CE1-CB 3.8Å; F2757-F2838 HydrophobicContact CE1-CD1 4.42Å; F2757-F2838 AromaticContact CE1-CD2 3.96Å; F2757-F2838 HydrophobicContact CE1-CD2 3.96Å; F2757-F2838 AromaticContact CE1-CG 3.74Å; F2757-F2838 HydrophobicContact CE1-CG 4.04Å; F2757-F2838 HydrophobicContact CZ-CB 4.07Å; F2757-F2838 HydrophobicContact CZ-CG 4.41Å
2758	A	62.6	Low	61.4	Low	88.3333 Å²	88.3333	95.1 Å²	95.1	73%	0.73	52%	0.52	S	S	*	.			trans	-71.8	89.1	177.2	0	0	0	0	0	110.6	G2756 S2760	G2756-A2758 PolarHBondContact O-N 3.08Å; A2758-S2760 PolarHBondContact O-N 2.96Å; A2758-S2760 VanDerWaalsContact O-N 3.09Å
2759	I	47.8	Very low	58.2	Low	99.3333 Å²	99.3333	106.7 Å²	106.7	51%	0.509	56%	0.564	S	S	.	*			trans	-77.3	78.3	174.9	-57.3	175	0	0	0	108.1	W2628 F2757 G2761	W2628-I2759 HydrophobicContact CZ2-CD1 4.05Å; F2757-I2759 PolarHBondContact O-N 3.14Å; F2757-I2759 VanDerWaalsContact O-N 3.11Å; I2759-G2761 PolarHBondContact O-N 3.01Å
2760	S	38.3	Very low	54.9	Low	109.333 Å²	109.333	111.4 Å²	111.4	77%	0.765	60%	0.603	S	S	*	*			trans	-68.6	91.3	166.3	-93.7	0	0	0	0	107.9	A2758 D2762	A2758-S2760 PolarHBondContact O-N 2.96Å; A2758-S2760 VanDerWaalsContact O-N 3.09Å; S2760-D2762 PolarHBondContact O-N 3.12Å
2761	G	30.1	Very low	51.7	Low	61.3333 Å²	61.3333	114.5 Å²	114.5	63%	0.632	63%	0.633	S	S	*	*			trans	-72.3	110.8	-179.6	0	0	0	0	0	110.5	I2759 V2763	I2759-G2761 PolarHBondContact O-N 3.01Å; G2761-V2763 PolarHBondContact O-N 3.13Å
2762	D	29.9	Very low	48.7	Very low	152.333 Å²	152.333	119.8 Å²	119.8	82%	0.815	66%	0.663	S	S	*	*			trans	-54.3	129.9	171.3	-95.6	-40.2	0	0	0	109.4	S2760 E2764	S2760-D2762 PolarHBondContact O-N 3.12Å; D2762-E2764 PolarHBondContact O-N 2.83Å; D2762-E2764 VanDerWaalsContact O-N 3.07Å
2763	V	29.2	Very low	45.7	Very low	134.333 Å²	134.333	122.5 Å²	122.5	81%	0.814	68%	0.684	S	S	*	*			trans	-70.9	81.7	171.4	-178.2	0	0	0	0	107.5	G2761 L2765	G2761-V2763 PolarHBondContact O-N 3.13Å; V2763-L2765 PolarHBondContact O-N 3.01Å
2764	E	25.6	Very low	42.8	Very low	161.667 Å²	161.667	119.5 Å²	119.5	76%	0.755	69%	0.685	S	S	*	*			trans	-65.9	99.4	176.9	-107.1	-171.2	160.2	0	0	109.9	D2762 T2766	D2762-E2764 PolarHBondContact O-N 2.83Å; D2762-E2764 VanDerWaalsContact O-N 3.07Å; E2764-T2766 HydrophobicContact CB-CG2 4.16Å; E2764-T2766 PolarHBondContact O-N 3.07Å; E2764-T2766 PolarHBondContact O-OG1 2.99Å
2765	L	29.8	Very low	40	Very low	159 Å²	159	123.7 Å²	123.7	83%	0.832	71%	0.714	S	S	*	*			trans	-60.4	87.5	162.9	-88.6	161.3	0	0	0	109.5	V2763 Q2767	V2763-L2765 PolarHBondContact O-N 3.01Å; L2765-Q2767 VanDerWaalsContact C-N 3.34Å; L2765-Q2767 PolarHBondContact O-N 3.1Å
2766	T	27.7	Very low	37.4	Very low	114 Å²	114	125.7 Å²	125.7	70%	0.699	72%	0.723	S	S	*	*			trans	-63.2	82.3	175.1	38.1	0	0	0	0	110.9	E2764 K2768	E2764-T2766 HydrophobicContact CB-CG2 4.16Å; E2764-T2766 PolarHBondContact O-N 3.07Å; E2764-T2766 PolarHBondContact O-OG1 2.99Å; T2766-K2768 PolarHBondContact O-N 3.2Å
2767	Q	28.9	Very low	34.9	Very low	180.667 Å²	180.667	133.7 Å²	133.7	84%	0.844	75%	0.751	S	S	*	*			trans	-86.8	86.7	163.1	-81.2	-168.1	4.8	0	0	110.1	L2765 R2769	L2765-Q2767 VanDerWaalsContact C-N 3.34Å; L2765-Q2767 PolarHBondContact O-N 3.1Å; Q2767-R2769 PolarHBondContact O-N 3.11Å
2768	K	28.7	Very low	32.4	Very low	200 Å²	200	138.7 Å²	138.7	87%	0.87	79%	0.785	S	S	*	*			trans	-52.9	105.4	167.4	-90.7	177.9	172.7	171.6	0	110.5	T2766 A2770	T2766-K2768 PolarHBondContact O-N 3.2Å; K2768-A2770 PolarHBondContact O-N 3.16Å
2769	R	27.6	Very low	30.9	Very low	247.333 Å²	247.333	138 Å²	138	93%	0.933	79%	0.786	S	S	*	*			trans	-73.9	94.2	158.4	-107.4	176.4	168.6	178.7	-2.8	110.6	Q2767	Q2767-R2769 PolarHBondContact O-N 3.11Å
2770	A	28.6	Very low	30.1	Very low	100.667 Å²	100.667	140.7 Å²	140.7	83%	0.832	80%	0.801	S	S	*	*			trans	-96.5	122.5	164.6	0	0	0	0	0	109.2	K2768	K2768-A2770 PolarHBondContact O-N 3.16Å
2771	A	29.8	Very low	29.7	Very low	89 Å²	89	140.7 Å²	140.7	74%	0.736	80%	0.801	S	S	*	*			trans	-109.7	123.9	178.4	0	0	0	0	0	112
2772	T	31	Very low	29.9	Very low	134.333 Å²	134.333	141.5 Å²	141.5	82%	0.824	81%	0.81	S	S	*	*			trans	56.8	126.8	157.2	47.1	0	0	0	0	115.5
2773	S	31.2	Very low	30	Very low	105 Å²	105	143.4 Å²	143.4	73%	0.734	81%	0.814	S	S	*	*				156.9	126.8	98.8	55.1	0	0	0	0	115.4
2774	S	31.5	Very low	30.3	Very low	110 Å²	110	142.3 Å²	142.3	77%	0.769	81%	0.809	S	S	*	*			trans	65.9	124.3	138.1	7.5	0	0	0	0	119.9
2775	V	30.8	Very low	30.7	Very low	136.333 Å²	136.333	140.8 Å²	140.8	83%	0.826	81%	0.811	S	S	*	*				76.8	124.3	118.8	-178.5	0	0	0	0	115.8
2776	K	31.1	Very low	30.9	Very low	197.667 Å²	197.667	138.9 Å²	138.9	86%	0.859	81%	0.808	S	S	*	*			trans	-76.2	128.7	153.8	-70.5	177.5	178.2	173.4	0	114.3
2777	K	29.6	Very low	31.2	Very low	191.667 Å²	191.667	138.2 Å²	138.2	83%	0.833	81%	0.814	S	S	*	*				-61.3	131.6	120.8	-94.4	-178.7	174.8	-177.7	0	113.6
2778	T	31.5	Very low	31.3	Very low	140.333 Å²	140.333	135 Å²	135	86%	0.861	81%	0.811	S	S	*	*			trans	165.8	136.7	139.7	37.2	0	0	0	0	112.6
2779	G	29.4	Very low	31.7	Very low	73 Å²	73	131.5 Å²	131.5	75%	0.753	81%	0.809	S	S	*	*				-177.1	131.4	124.2	0	0	0	0	0	113.5
2780	N	32	Very low	31.9	Very low	157 Å²	157	124 Å²	124	84%	0.84	80%	0.8	S	S	*	*				-179.6	133.8	114.9	-131.5	30.4	0	0	0	115.4
2781	S	30.6	Very low	32	Very low	108.667 Å²	108.667	128 Å²	128	76%	0.76	80%	0.803	S	S	*	*			trans	15.7	121.5	151.3	59.5	0	0	0	0	118.8
2782	G	32.7	Very low	32.1	Very low	78.6667 Å²	78.6667	131.4 Å²	131.4	81%	0.811	81%	0.81	S	S	*	*			trans	-161.1	113	159.9	0	0	0	0	0	111.4
2783	Q	32.4	Very low	32	Very low	192 Å²	192	134.8 Å²	134.8	90%	0.897	81%	0.813	S	S	*	*			trans	-88.2	162.1	174.8	-85.9	-169.5	-47.5	0	0	111.1
2784	P	35.3	Very low	32	Very low	112 Å²	112	134.1 Å²	134.1	73%	0.727	81%	0.814	S	S	*	*			trans	-106.3	-170.7	-145.1	34.4	-21.8	0	0	0	111.1
2785	V	33.7	Very low	31.8	Very low	130.333 Å²	130.333	134.4 Å²	134.4	79%	0.79	82%	0.816	S	S	*	*			trans	-142.9	147	160.6	-121.9	0	0	0	0	111.8
2786	P	35.3	Very low	31.9	Very low	119 Å²	119	133.5 Å²	133.5	77%	0.773	82%	0.816	S	S	*	*			trans	-102.7	150.1	-157.9	32.9	-25.4	0	0	0	113.6	S2788	P2786-S2788 PolarHBondContact O-N 3.09Å
2787	A	32.7	Very low	31.7	Very low	99 Å²	99	133.3 Å²	133.3	82%	0.818	82%	0.818	S	S	*	*			trans	-87.2	136	171	0	0	0	0	0	113.1
2788	S	32	Very low	31.7	Very low	113.333 Å²	113.333	130.7 Å²	130.7	79%	0.793	81%	0.813	S	S	*	*			trans	-98.5	156.3	158.7	-59.7	0	0	0	0	109.8	P2786	P2786-S2788 PolarHBondContact O-N 3.09Å
2789	P	36.3	Very low	31.6	Very low	126.333 Å²	126.333	130.4 Å²	130.4	82%	0.82	81%	0.811	S	S	*	*			trans	-104	154	174.5	37	-28.1	0	0	0	111.7
2790	A	32	Very low	31.7	Very low	90 Å²	90	134.1 Å²	134.1	74%	0.744	81%	0.809	S	S	*	*			trans	-142.1	126.7	163.4	0	0	0	0	0	111.9	D2792	A2790-D2792 PolarHBondContact O-N 3.36Å
2791	M	30.8	Very low	31.5	Very low	183.333 Å²	183.333	132.8 Å²	132.8	90%	0.903	81%	0.806	S	S	*	*			trans	-89	117.9	168.9	-62.4	-156	-64.3	0	0	108.2
2792	D	31.2	Very low	31.6	Very low	162.333 Å²	162.333	135.6 Å²	135.6	87%	0.868	81%	0.807	S	S	*	*			trans	-116	116.2	163	-88.2	-39.5	0	0	0	109.1	A2790 A2794	A2790-D2792 PolarHBondContact O-N 3.36Å; D2792-A2794 PolarHBondContact O-N 3Å
2793	F	29.4	Very low	31.6	Very low	204 Å²	204	136.3 Å²	136.3	90%	0.895	81%	0.805	S	S	*	*			trans	-110.1	94.7	179.3	-156.1	-82.7	0	0	0	108.3
2794	A	31.8	Very low	31.8	Very low	92 Å²	92	136.2 Å²	136.2	76%	0.76	80%	0.798	S	S	*	*			trans	-141.9	127.5	173.7	0	0	0	0	0	111.1	D2792	D2792-A2794 PolarHBondContact O-N 3Å
2795	S	27.1	Very low	31.8	Very low	115.667 Å²	115.667	141.7 Å²	141.7	81%	0.809	80%	0.804	S	S	*	*			trans	-39	119.9	170.3	53.6	0	0	0	0	114.8
2796	S	32.8	Very low	32.2	Very low	117.667 Å²	117.667	140.4 Å²	140.4	82%	0.823	80%	0.799	S	S	*	*			trans	-146.2	120.7	144	-106.4	0	0	0	0	109.4	N2798	S2796-N2798 VanDerWaalsContact C-N 3.34Å; S2796-N2798 PolarHBondContact O-N 3.18Å; S2796-N2798 VanDerWaalsContact O-N 3.16Å
2797	E	27.7	Very low	32.7	Very low	193.333 Å²	193.333	137.3 Å²	137.3	90%	0.903	78%	0.778	S	S	*	*			trans	-64.6	114.2	170.6	-62.2	176	134	0	0	109.1
2798	N	29.9	Very low	33.1	Very low	136.667 Å²	136.667	137.9 Å²	137.9	73%	0.731	78%	0.775	S	S	*	*			trans	-150.2	104.6	156.9	-131	-20.2	0	0	0	108.8	S2796 Q2800	S2796-N2798 VanDerWaalsContact C-N 3.34Å; S2796-N2798 PolarHBondContact O-N 3.18Å; S2796-N2798 VanDerWaalsContact O-N 3.16Å; N2798-Q2800 PolarHBondContact O-N 3.1Å
2799	V	28.5	Very low	34.3	Very low	133.667 Å²	133.667	136.7 Å²	136.7	81%	0.81	76%	0.756	S	S	*	*			trans	-70.1	96.6	171.5	178.2	0	0	0	0	107.1	T2801	V2799-T2801 HydrophobicContact CG1-CG2 4.46Å; V2799-T2801 PolarHBondContact O-N 3.18Å
2800	Q	30.5	Very low	35.4	Very low	151.667 Å²	151.667	138.4 Å²	138.4	71%	0.709	75%	0.753	S	S	*	*			trans	-93.5	109.1	167.3	-73	-172.3	-0.2	0	0	108.2	N2798 H2802	N2798-Q2800 PolarHBondContact O-N 3.1Å; Q2800-H2802 PolarHBondContact O-N 2.88Å
2801	T	29	Very low	37.3	Very low	129 Å²	129	136 Å²	136	79%	0.791	73%	0.729	S	S	*	*			trans	-69.4	96.5	174.9	48	0	0	0	0	108.5	V2799 A2803	V2799-T2801 HydrophobicContact CG1-CG2 4.46Å; V2799-T2801 PolarHBondContact O-N 3.18Å; T2801-A2803 VanDerWaalsContact C-N 3.3Å; T2801-A2803 PolarHBondContact O-N 3.11Å
2802	H	33.2	Very low	39.9	Very low	168 Å²	168	129.4 Å²	129.4	78%	0.778	70%	0.701	S	S	*	*			trans	-59.9	116.6	165.5	-82.8	-81.8	0	0	0	108.2	Q2800 Y2804	Q2800-H2802 PolarHBondContact O-N 2.88Å; H2802-Y2804 PolarHBondContact O-N 2.86Å
2803	A	32.2	Very low	42.7	Very low	92 Å²	92	122.1 Å²	122.1	76%	0.76	66%	0.662	S	S	*	*			trans	-70.4	111.5	179.5	0	0	0	0	0	109.3	T2801 R2805	T2801-A2803 VanDerWaalsContact C-N 3.3Å; T2801-A2803 PolarHBondContact O-N 3.11Å; A2803-R2805 PolarHBondContact O-N 3.15Å; A2803-R2805 VanDerWaalsContact O-N 3.15Å
2804	Y	36	Very low	45.8	Very low	191 Å²	191	112.8 Å²	112.8	75%	0.749	62%	0.622	S	S	*	*			trans	-58.5	103.4	172.1	-88.1	-97	0	0	0	109	H2802 P2806 G2913 I2914	H2802-Y2804 PolarHBondContact O-N 2.86Å; Y2804-P2806 WeakPolarHBondContact O-CD 3.5Å; Y2804-G2913 WeakPolarHBondContact CE1-O 3.47Å; Y2804-I2914 HydrophobicContact CE2-CG2 3.94Å
2805	R	36.3	Very low	48.8	Very low	226.5 Å²	226.5	110.8 Å²	110.8	86%	0.855	60%	0.596	S	S	*	*	P	Polyproline II helix	trans	-69.9	129.1	162	-86.7	-174.2	173.3	176.7	-1	107.7	A2803	A2803-R2805 PolarHBondContact O-N 3.15Å; A2803-R2805 VanDerWaalsContact O-N 3.15Å
2806	P	41.5	Very low	52	Low	104.5 Å²	104.5	105.4 Å²	105.4	68%	0.679	56%	0.558	S	S	*	*	P	Polyproline II helix	trans	-59.1	140.8	168.9	-21	32.9	0	0	0	109.9	Y2804 C2808 F2809	Y2804-P2806 WeakPolarHBondContact O-CD 3.5Å; P2806-C2808 PolarHBondContact O-N 3.07Å; P2806-F2809 HydrophobicContact CB-CE2 4.25Å
2807	P	45	Very low	55.1	Low	54 Å²	54	99.9 Å²	99.9	35%	0.351	52%	0.52	S	S	.	.	P	Polyproline II helix	trans	-60.8	134.2	173.6	24.8	-33	0	0	0	110.3	L2577 F2809 A2837	L2577-P2807 HydrophobicContact CD2-CB 3.92Å; P2807-F2809 HydrophobicContact CB-CE1 4.01Å; P2807-F2809 HydrophobicContact CB-CE2 4.26Å; P2807-F2809 HydrophobicContact CB-CZ 3.77Å; P2807-F2809 HydrophobicContact CG-CE1 4.31Å; P2807-F2809 HydrophobicContact CG-CE2 4.06Å; P2807-F2809 HydrophobicContact CG-CZ 3.75Å; P2807-F2809 WeakPolarHBondContact O-CD2 3.25Å; P2807-F2809 WeakPolarHBondContact O-CE2 3.36Å; P2807-F2809 PolarHBondContact O-N 3.35Å; P2807-F2809 VanDerWaalsContact O-N 3.14Å; P2807-A2837 HydrophobicContact CG-CB 3.95Å
2808	C	42.7	Very low	58.3	Low	111.5 Å²	111.5	92.4 Å²	92.4	75%	0.753	49%	0.489	S	S	*	.			trans	-76.8	98.1	-177.7	-170.2	0	0	0	0	110.4	P2806 Q2810	P2806-C2808 PolarHBondContact O-N 3.07Å; C2808-Q2810 PolarHBondContact O-N 2.99Å; C2808-Q2810 VanDerWaalsContact O-N 3.11Å
2809	F	55.7	Low	61.5	Low	87 Å²	87	86.4 Å²	86.4	38%	0.382	46%	0.456	S	S	.	.			trans	-72.2	62.4	-175.5	-64.9	-71.5	0	0	0	113.4	F2757 P2806 P2807 V2811 F2838	F2757-F2809 HydrophobicContact CD1-CD1 4.27Å; F2757-F2809 AromaticContact CD1-CE1 3.59Å; F2757-F2809 HydrophobicContact CD1-CE1 3.59Å; F2757-F2809 HydrophobicContact CD1-CZ 4.38Å; F2757-F2809 HydrophobicContact CE1-CE1 4.1Å; F2757-F2809 HydrophobicContact CG-CE1 4.43Å; P2806-F2809 HydrophobicContact CB-CE2 4.25Å; P2807-F2809 HydrophobicContact CB-CE1 4.01Å; P2807-F2809 HydrophobicContact CB-CE2 4.26Å; P2807-F2809 HydrophobicContact CB-CZ 3.77Å; P2807-F2809 HydrophobicContact CG-CE1 4.31Å; P2807-F2809 HydrophobicContact CG-CE2 4.06Å; P2807-F2809 HydrophobicContact CG-CZ 3.75Å; P2807-F2809 WeakPolarHBondContact O-CD2 3.25Å; P2807-F2809 WeakPolarHBondContact O-CE2 3.36Å; P2807-F2809 PolarHBondContact O-N 3.35Å; P2807-F2809 VanDerWaalsContact O-N 3.14Å; F2809-V2811 HydrophobicContact CB-CB 4.32Å; F2809-V2811 HydrophobicContact CB-CG2 4.34Å; F2809-V2811 PolarHBondContact O-N 2.73Å; F2809-F2838 HydrophobicContact CD1-CD2 4.17Å; F2809-F2838 HydrophobicContact CD2-CD2 4.15Å; F2809-F2838 HydrophobicContact CE1-CB 4.44Å; F2809-F2838 HydrophobicContact CE1-CD2 4.24Å; F2809-F2838 HydrophobicContact CE2-CB 4.04Å; F2809-F2838 HydrophobicContact CE2-CD2 4.21Å; F2809-F2838 HydrophobicContact CG-CD2 4.13Å; F2809-F2838 HydrophobicContact CZ-CB 3.84Å; F2809-F2838 HydrophobicContact CZ-CD2 4.25Å
2810	Q	61	Low	64.7	Low	162.5 Å²	162.5	82.2 Å²	82.2	76%	0.759	43%	0.429	S	S	*	.	S	Bend	trans	-106.3	46	175.9	-68.4	-171.2	-23.1	0	0	112.5	C2808	C2808-Q2810 PolarHBondContact O-N 2.99Å; C2808-Q2810 VanDerWaalsContact O-N 3.11Å
2811	V	71.6	Confident	67.9	Low	40 Å²	40	75.5 Å²	75.5	24%	0.242	40%	0.398	C	S	.	.	S	Bend	trans	-95.5	137.3	177.3	176.2	0	0	0	0	108.6	P2581 F2809 C2813 Y2814 Q2815 H2842	P2581-V2811 HydrophobicContact CG-CB 4.29Å; P2581-V2811 HydrophobicContact CG-CG1 3.56Å; P2581-V2811 HydrophobicContact CG-CG2 3.67Å; F2809-V2811 HydrophobicContact CB-CB 4.32Å; F2809-V2811 HydrophobicContact CB-CG2 4.34Å; F2809-V2811 PolarHBondContact O-N 2.73Å; V2811-C2813 WeakPolarHBondContact CG1-SG 3.49Å; V2811-Y2814 HydrophobicContact CB-CD2 3.61Å; V2811-Y2814 HydrophobicContact CB-CE2 3.67Å; V2811-Y2814 HydrophobicContact CG1-CD2 3.6Å; V2811-Y2814 HydrophobicContact CG1-CE2 3.56Å; V2811-Y2814 HydrophobicContact CG1-CG 4.15Å; V2811-Y2814 HydrophobicContact CG2-CD2 4.47Å; V2811-Y2814 HydrophobicContact CG2-CE2 4.07Å; V2811-Q2815 HydrophobicContact CG1-CB 3.86Å; V2811-Q2815 VanDerWaalsContact CG1-OE1 3.3Å; V2811-H2842 PolarHBondContact O-NE2 3.4Å
2812	S	84	Confident	71.1	Confident	44 Å²	44	72.4 Å²	72.4	31%	0.308	38%	0.379	S	S	.	.			trans	-75.5	-132.6	179.7	112.3	0	0	0	0	111.6	Y2814 Q2815 H2842	S2812-Y2814 PolarHBondContact O-N 3.3Å; S2812-Y2814 WeakPolarHBondContact OG-CD2 3.35Å; S2812-Y2814 PolarHBondContact OG-N 3.1Å; S2812-Q2815 VanDerWaalsContact O-CB 3.26Å; S2812-Q2815 WeakPolarHBondContact O-CB 3.31Å; S2812-Q2815 WeakPolarHBondContact O-CG 3.2Å; S2812-Q2815 PolarHBondContact O-N 2.89Å; S2812-H2842 WeakPolarHBondContact CB-NE2 3.48Å; S2812-H2842 PolarHBondContact O-CD2 2.94Å; S2812-H2842 VanDerWaalsContact O-CD2 3.3Å; S2812-H2842 PolarHBondContact O-NE2 3.45Å
2813	C	91.4	Very high	74.1	Confident	9.5 Å²	9.5	67.1 Å²	67.1	6%	0.064	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-19.8	-178.5	65.7	0	0	0	0	114.7	P2581 L2583 V2811 Q2815 D2841	P2581-C2813 PolarHBondContact O-SG 3.26Å; P2581-C2813 VanDerWaalsContact O-SG 3.37Å; L2583-C2813 WeakPolarHBondContact CD1-O 3.3Å; V2811-C2813 WeakPolarHBondContact CG1-SG 3.49Å; C2813-Q2815 VanDerWaalsContact C-N 3.33Å; C2813-D2841 WeakPolarHBondContact CA-O 3.48Å; C2813-D2841 VanDerWaalsContact CB-O 3.3Å; C2813-D2841 WeakPolarHBondContact CB-O 3.33Å
2814	Y	94.7	Very high	77.1	Confident	9.5 Å²	9.5	62.7 Å²	62.7	4%	0.037	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-10.5	174.4	-50.4	-45.1	0	0	0	113.8	F2571 D2576 P2581 L2583 Y2748 Q2750 V2811 S2812	F2571-Y2814 HydrophobicContact CD1-CE1 4.43Å; F2571-Y2814 HydrophobicContact CD1-CE2 4.3Å; F2571-Y2814 HydrophobicContact CE1-CD1 4.26Å; F2571-Y2814 AromaticContact CE1-CD2 3.83Å; F2571-Y2814 HydrophobicContact CE1-CD2 3.83Å; F2571-Y2814 AromaticContact CE1-CE1 3.74Å; F2571-Y2814 HydrophobicContact CE1-CE1 3.91Å; F2571-Y2814 AromaticContact CE1-CE2 3.43Å; F2571-Y2814 HydrophobicContact CE1-CE2 3.43Å; F2571-Y2814 HydrophobicContact CE1-CG 4.23Å; F2571-Y2814 AromaticContact CE1-CZ 3.48Å; F2571-Y2814 VanDerWaalsContact CE1-CZ 3.48Å; F2571-Y2814 AromaticContact CZ-CD2 3.84Å; F2571-Y2814 HydrophobicContact CZ-CD2 3.84Å; F2571-Y2814 AromaticContact CZ-CE2 3.64Å; F2571-Y2814 HydrophobicContact CZ-CE2 3.64Å; F2571-Y2814 HydrophobicContact CZ-CG 4.43Å; D2576-Y2814 VanDerWaalsContact CA-OH 3.3Å; D2576-Y2814 WeakPolarHBondContact CA-OH 3.46Å; D2576-Y2814 VanDerWaalsContact CB-OH 3.3Å; D2576-Y2814 WeakPolarHBondContact CB-OH 3.41Å; D2576-Y2814 PolarHBondContact O-OH 2.82Å; D2576-Y2814 VanDerWaalsContact O-OH 3.06Å; D2576-Y2814 PolarHBondContact OD1-OH 3.13Å; P2581-Y2814 WeakPolarHBondContact CB-OH 3.46Å; L2583-Y2814 HydrophobicContact CD2-CD1 3.8Å; L2583-Y2814 HydrophobicContact CD2-CE1 4.31Å; L2583-Y2814 HydrophobicContact CG-CD1 4.47Å; Y2748-Y2814 AromaticContact CD1-CD1 3.91Å; Y2748-Y2814 HydrophobicContact CD1-CD1 3.91Å; Y2748-Y2814 AromaticContact CD1-CE1 3.77Å; Y2748-Y2814 HydrophobicContact CD1-CE1 3.77Å; Y2748-Y2814 HydrophobicContact CE1-CE1 4.13Å; Q2750-Y2814 WeakPolarHBondContact CB-O 3.39Å; Q2750-Y2814 PolarHBondContact N-O 3.08Å; V2811-Y2814 HydrophobicContact CB-CD2 3.61Å; V2811-Y2814 HydrophobicContact CB-CE2 3.67Å; V2811-Y2814 HydrophobicContact CG1-CD2 3.6Å; V2811-Y2814 HydrophobicContact CG1-CE2 3.56Å; V2811-Y2814 HydrophobicContact CG1-CG 4.15Å; V2811-Y2814 HydrophobicContact CG2-CD2 4.47Å; V2811-Y2814 HydrophobicContact CG2-CE2 4.07Å; S2812-Y2814 PolarHBondContact O-N 3.3Å; S2812-Y2814 WeakPolarHBondContact OG-CD2 3.35Å; S2812-Y2814 PolarHBondContact OG-N 3.1Å
2815	Q	94	Very high	80	Confident	49 Å²	49	56.3 Å²	56.3	23%	0.229	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	125.3	179.7	-62.9	179.6	-7.2	0	0	110.3	Q2750 V2752 V2811 S2812 C2813	Q2750-Q2815 HydrophobicContact CB-CG 4.43Å; Q2750-Q2815 WeakPolarHBondContact O-CA 3.44Å; V2752-Q2815 HydrophobicContact CG1-CB 4.16Å; V2752-Q2815 HydrophobicContact CG1-CG 4.17Å; V2752-Q2815 HydrophobicContact CG2-CB 4.01Å; V2811-Q2815 HydrophobicContact CG1-CB 3.86Å; V2811-Q2815 VanDerWaalsContact CG1-OE1 3.3Å; S2812-Q2815 VanDerWaalsContact O-CB 3.26Å; S2812-Q2815 WeakPolarHBondContact O-CB 3.31Å; S2812-Q2815 WeakPolarHBondContact O-CG 3.2Å; S2812-Q2815 PolarHBondContact O-N 2.89Å; C2813-Q2815 VanDerWaalsContact C-N 3.33Å
2816	L	95.2	Very high	82.8	Confident	2.5 Å²	2.5	51.1 Å²	51.1	1%	0.013	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	102.7	-170.3	-170	163.3	0	0	0	109.4	K2596 C2749 Q2750 A2751 V2752 I2843 R2845 M2870	K2596-L2816 HydrophobicContact CG-CD1 4.32Å; K2596-L2816 HydrophobicContact CG-CD2 4.25Å; C2749-L2816 HydrophobicContact CB-CD1 3.99Å; Q2750-L2816 PolarHBondContact O-N 2.87Å; A2751-L2816 WeakPolarHBondContact CA-O 3.37Å; V2752-L2816 PolarHBondContact N-O 3.24Å; L2816-I2843 WeakPolarHBondContact CA-O 3.34Å; L2816-I2843 HydrophobicContact CD1-CB 4.05Å; L2816-I2843 HydrophobicContact CD1-CG2 3.68Å; L2816-I2843 HydrophobicContact CG-CB 4.11Å; L2816-I2843 HydrophobicContact CG-CG2 3.89Å; L2816-R2845 HydrophobicContact CD2-CB 4.23Å; L2816-M2870 HydrophobicContact CD1-SD 3.97Å; L2816-M2870 HydrophobicContact CD2-SD 4.48Å
2817	P	96.1	Very high	85.3	Confident	3 Å²	3	47 Å²	47	2%	0.019	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	149.2	176	-5.6	22	0	0	0	111.6	V2752 F2754 F2838 I2843 L2844 R2845	V2752-P2817 HydrophobicContact CG2-CB 4.44Å; V2752-P2817 HydrophobicContact CG2-CG 4.25Å; V2752-P2817 WeakPolarHBondContact O-CA 3.43Å; F2754-P2817 HydrophobicContact CB-CB 3.94Å; F2754-P2817 HydrophobicContact CD2-CB 3.97Å; F2754-P2817 HydrophobicContact CD2-CG 3.86Å; F2754-P2817 HydrophobicContact CE2-CG 4.5Å; F2754-P2817 HydrophobicContact CG-CB 4.28Å; P2817-F2838 HydrophobicContact CG-CE1 4.13Å; P2817-F2838 HydrophobicContact CG-CZ 3.89Å; P2817-I2843 VanDerWaalsContact CD-O 3.25Å; P2817-I2843 WeakPolarHBondContact CD-O 3.22Å; P2817-L2844 HydrophobicContact CB-CD1 3.67Å; P2817-L2844 HydrophobicContact CG-CD1 3.85Å; P2817-R2845 PolarHBondContact O-N 3.28Å
2818	S	95.9	Very high	87.6	Confident	34.5 Å²	34.5	44.4 Å²	44.4	24%	0.241	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	135.7	171	-61.2	0	0	0	0	109.6	K2596 R2845	K2596-S2818 VanDerWaalsContact CE-OG 3.24Å; K2596-S2818 WeakPolarHBondContact CE-OG 3.45Å; K2596-S2818 PolarHBondContact NZ-OG 3.18Å; K2596-S2818 VanDerWaalsContact NZ-OG 3.14Å; S2818-R2845 WeakPolarHBondContact CA-O 3.32Å
2819	M	96.2	Very high	90	Very high	11 Å²	11	46.6 Å²	46.6	5%	0.054	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149	152.7	179	60.3	-175.1	62.1	0	0	111.6	F2754 T2823 A2824 L2827 L2844 R2845 T2846 Y2847	F2754-M2819 HydrophobicContact CB-CE 3.72Å; F2754-M2819 HydrophobicContact CD1-CE 3.76Å; F2754-M2819 HydrophobicContact CD2-CE 4.19Å; F2754-M2819 HydrophobicContact CE1-CE 4.32Å; F2754-M2819 HydrophobicContact CG-CE 3.63Å; M2819-T2823 HydrophobicContact CB-CG2 4.12Å; M2819-T2823 HydrophobicContact SD-CG2 4.23Å; M2819-A2824 HydrophobicContact CG-CB 4.06Å; M2819-A2824 HydrophobicContact SD-CB 3.99Å; M2819-L2827 HydrophobicContact CE-CD2 3.9Å; M2819-L2827 HydrophobicContact SD-CD2 3.9Å; M2819-L2844 HydrophobicContact CE-CD1 4.01Å; M2819-L2844 HydrophobicContact SD-CD1 4.44Å; M2819-R2845 PolarHBondContact N-O 3.12Å; M2819-R2845 VanDerWaalsContact N-O 3.09Å; M2819-T2846 VanDerWaalsContact O-CA 3.29Å; M2819-T2846 WeakPolarHBondContact O-CA 3.25Å; M2819-T2846 PolarHBondContact O-OG1 2.81Å; M2819-Y2847 WeakPolarHBondContact O-CD1 3.28Å; M2819-Y2847 VanDerWaalsContact O-CE1 3.28Å; M2819-Y2847 WeakPolarHBondContact O-CE1 3.39Å; M2819-Y2847 PolarHBondContact O-N 3.24Å
2820	N	96.5	Very high	91.8	Very high	45 Å²	45	48.6 Å²	48.6	24%	0.241	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	164.3	176.7	65.8	39.3	0	0	0	112.3	T2822 T2823 A2824 Y2847	N2820-T2822 PolarHBondContact O-N 2.93Å; N2820-T2822 VanDerWaalsContact O-N 3.15Å; N2820-T2822 WeakPolarHBondContact OD1-CB 3.29Å; N2820-T2822 PolarHBondContact OD1-N 3.38Å; N2820-T2822 VanDerWaalsContact OD1-N 3.12Å; N2820-T2823 PolarHBondContact O-N 3.1Å; N2820-T2823 VanDerWaalsContact O-N 3.14Å; N2820-T2823 WeakPolarHBondContact OD1-CB 3.4Å; N2820-T2823 PolarHBondContact OD1-N 2.9Å; N2820-T2823 PolarHBondContact OD1-OG1 3.13Å; N2820-A2824 WeakPolarHBondContact O-CB 3.41Å; N2820-A2824 PolarHBondContact O-N 3.12Å; N2820-Y2847 CarbonylContact C-O 3.56Å; N2820-Y2847 VanDerWaalsContact CA-O 3.32Å; N2820-Y2847 WeakPolarHBondContact CA-O 3.48Å; N2820-Y2847 HydrophobicContact CB-CD2 4.41Å; N2820-Y2847 HydrophobicContact CB-CE2 3.94Å
2821	E	96.8	Very high	93.3	Very high	11.5 Å²	11.5	43.9 Å²	43.9	5%	0.054	22%	0.216	C	C	.	.	H	α-helix	trans	-55.7	-34.1	-177.8	77.4	-175.5	-104.3	0	0	112.9	K2825 Y2847 P2848 S2849 R2852 F2858 F2863	E2821-K2825 VanDerWaalsContact O-CB 3.25Å; E2821-K2825 WeakPolarHBondContact O-CB 3.43Å; E2821-K2825 WeakPolarHBondContact O-CD 3.46Å; E2821-K2825 WeakPolarHBondContact O-CG 3.48Å; E2821-K2825 PolarHBondContact O-N 3.15Å; E2821-K2825 IonicContact OE1-NZ 3.07Å; E2821-K2825 PolarHBondContact OE1-NZ 2.9Å; E2821-Y2847 PolarHBondContact N-O 2.94Å; E2821-P2848 WeakPolarHBondContact OE2-CA 3.23Å; E2821-S2849 PolarHBondContact OE2-N 2.95Å; E2821-R2852 VanDerWaalsContact CD-NE 3.34Å; E2821-R2852 IonicContact OE1-CZ 3.04Å; E2821-R2852 IonicContact OE1-NE 3.24Å; E2821-R2852 PolarHBondContact OE1-NE 3.33Å; E2821-R2852 IonicContact OE1-NH2 2.99Å; E2821-R2852 PolarHBondContact OE1-NH2 2.97Å; E2821-R2852 WeakPolarHBondContact OE2-CD 3.34Å; E2821-R2852 IonicContact OE2-CZ 3.7Å; E2821-R2852 IonicContact OE2-NE 3.06Å; E2821-R2852 PolarHBondContact OE2-NE 3.32Å; E2821-R2852 IonicContact OE2-NH2 3.84Å; E2821-F2858 HydrophobicContact CB-CD1 3.87Å; E2821-F2858 HydrophobicContact CB-CE1 4.25Å; E2821-F2858 HydrophobicContact CB-CG 4.12Å; E2821-F2858 HydrophobicContact CG-CD1 4.38Å; E2821-F2858 WeakPolarHBondContact OE2-CD1 3.38Å; E2821-F2863 HydrophobicContact CB-CE2 4.31Å; E2821-F2863 HydrophobicContact CB-CZ 4.14Å
2822	T	96.7	Very high	94.3	Very high	64 Å²	64	43.1 Å²	43.1	39%	0.393	21%	0.212	S	C	.	.	H	α-helix	trans	-72	-44.7	-177.1	-49.6	0	0	0	0	111.2	N2820 A2824 K2825 K2826	N2820-T2822 PolarHBondContact O-N 2.93Å; N2820-T2822 VanDerWaalsContact O-N 3.15Å; N2820-T2822 WeakPolarHBondContact OD1-CB 3.29Å; N2820-T2822 PolarHBondContact OD1-N 3.38Å; N2820-T2822 VanDerWaalsContact OD1-N 3.12Å; T2822-A2824 VanDerWaalsContact C-N 3.3Å; T2822-K2825 WeakPolarHBondContact O-CB 3.32Å; T2822-K2825 PolarHBondContact O-N 3.21Å; T2822-K2826 WeakPolarHBondContact O-CG 3.3Å; T2822-K2826 PolarHBondContact O-N 3.05Å
2823	T	96.4	Very high	94.7	Very high	56 Å²	56	44.2 Å²	44.2	34%	0.344	21%	0.214	S	C	.	.	H	α-helix	trans	-66.5	-40.2	174.8	-58.3	0	0	0	0	110.6	M2630 M2819 N2820 K2826 L2827	M2630-T2823 HydrophobicContact SD-CG2 4.21Å; M2819-T2823 HydrophobicContact CB-CG2 4.12Å; M2819-T2823 HydrophobicContact SD-CG2 4.23Å; N2820-T2823 PolarHBondContact O-N 3.1Å; N2820-T2823 VanDerWaalsContact O-N 3.14Å; N2820-T2823 WeakPolarHBondContact OD1-CB 3.4Å; N2820-T2823 PolarHBondContact OD1-N 2.9Å; N2820-T2823 PolarHBondContact OD1-OG1 3.13Å; T2823-K2826 PolarHBondContact O-N 3Å; T2823-L2827 WeakPolarHBondContact O-CB 3.4Å; T2823-L2827 PolarHBondContact O-N 3.3Å
2824	A	96.2	Very high	94.8	Very high	0.5 Å²	0.5	47.4 Å²	47.4	0%	0.004	23%	0.228	C	C	.	.	H	α-helix	trans	-63.3	-45.7	173.3	0	0	0	0	0	111.8	M2819 N2820 T2822 K2826 L2827 I2828 T2846 F2863	M2819-A2824 HydrophobicContact CG-CB 4.06Å; M2819-A2824 HydrophobicContact SD-CB 3.99Å; N2820-A2824 WeakPolarHBondContact O-CB 3.41Å; N2820-A2824 PolarHBondContact O-N 3.12Å; T2822-A2824 VanDerWaalsContact C-N 3.3Å; A2824-K2826 PolarHBondContact O-N 3.16Å; A2824-L2827 PolarHBondContact O-N 3.26Å; A2824-I2828 WeakPolarHBondContact O-CD1 3.41Å; A2824-I2828 VanDerWaalsContact O-CG1 3.28Å; A2824-I2828 WeakPolarHBondContact O-CG1 3.42Å; A2824-I2828 PolarHBondContact O-N 3.17Å; A2824-T2846 WeakPolarHBondContact CB-OG1 3.32Å; A2824-F2863 HydrophobicContact CB-CD1 4.02Å; A2824-F2863 HydrophobicContact CB-CE1 3.43Å; A2824-F2863 HydrophobicContact CB-CZ 3.71Å
2825	K	95.5	Very high	94.8	Very high	56 Å²	56	47 Å²	47	24%	0.243	23%	0.226	C	C	.	.	H	α-helix	trans	-58	-37.4	173.7	-121.7	168.1	-178	171.8	0	111.8	D2649 E2821 T2822 I2828 R2829 M2862 F2863	D2649-K2825 IonicContact OD2-NZ 3.79Å; D2649-K2825 PolarHBondContact OD2-NZ 2.95Å; E2821-K2825 VanDerWaalsContact O-CB 3.25Å; E2821-K2825 WeakPolarHBondContact O-CB 3.43Å; E2821-K2825 WeakPolarHBondContact O-CD 3.46Å; E2821-K2825 WeakPolarHBondContact O-CG 3.48Å; E2821-K2825 PolarHBondContact O-N 3.15Å; E2821-K2825 IonicContact OE1-NZ 3.07Å; E2821-K2825 PolarHBondContact OE1-NZ 2.9Å; T2822-K2825 WeakPolarHBondContact O-CB 3.32Å; T2822-K2825 PolarHBondContact O-N 3.21Å; K2825-I2828 WeakPolarHBondContact O-CG1 3.47Å; K2825-R2829 WeakPolarHBondContact O-CD 3.25Å; K2825-R2829 VanDerWaalsContact O-CG 3.28Å; K2825-R2829 WeakPolarHBondContact O-CG 3.23Å; K2825-R2829 PolarHBondContact O-N 2.94Å; K2825-M2862 HydrophobicContact CB-CE 4.37Å; K2825-M2862 HydrophobicContact CD-CE 3.98Å; K2825-M2862 HydrophobicContact CD-SD 3.68Å; K2825-M2862 WeakPolarHBondContact CE-SD 3.25Å; K2825-M2862 HydrophobicContact CG-CE 3.76Å; K2825-M2862 VanDerWaalsContact CG-CE 3.45Å; K2825-M2862 HydrophobicContact CG-SD 3.93Å; K2825-F2863 HydrophobicContact CG-CZ 4.18Å
2826	K	95.9	Very high	94.8	Very high	117 Å²	117	45.2 Å²	45.2	51%	0.509	22%	0.219	S	C	.	.	H	α-helix	trans	-68	-41.7	171.7	-73.1	-179.1	179.3	-174.4	0	112.2	M2630 T2822 T2823 A2824 R2829 K2830	M2630-K2826 HydrophobicContact CE-CB 3.95Å; M2630-K2826 HydrophobicContact CE-CD 3.8Å; M2630-K2826 HydrophobicContact CE-CG 4.5Å; T2822-K2826 WeakPolarHBondContact O-CG 3.3Å; T2822-K2826 PolarHBondContact O-N 3.05Å; T2823-K2826 PolarHBondContact O-N 3Å; A2824-K2826 PolarHBondContact O-N 3.16Å; K2826-R2829 PolarHBondContact O-N 3.11Å; K2826-K2830 PolarHBondContact O-N 3.16Å; K2826-K2830 VanDerWaalsContact O-N 3.13Å
2827	L	94.3	Very high	94.7	Very high	18 Å²	18	47.1 Å²	47.1	9%	0.094	24%	0.235	C	C	.	.	H	α-helix	trans	-66.4	-47.1	-179.3	-175.8	61.3	0	0	0	112.6	F2754 F2757 M2819 T2823 A2824 R2829 K2830 H2831 L2835	F2754-L2827 HydrophobicContact CD1-CD2 4.32Å; F2754-L2827 HydrophobicContact CE1-CD1 3.72Å; F2754-L2827 HydrophobicContact CE1-CD2 3.64Å; F2754-L2827 HydrophobicContact CE1-CG 4.36Å; F2754-L2827 HydrophobicContact CZ-CD1 4.15Å; F2754-L2827 HydrophobicContact CZ-CD2 3.79Å; F2757-L2827 HydrophobicContact CD2-CD1 4.26Å; F2757-L2827 HydrophobicContact CE2-CD1 3.8Å; F2757-L2827 HydrophobicContact CE2-CG 4.36Å; F2757-L2827 HydrophobicContact CZ-CD1 3.99Å; F2757-L2827 HydrophobicContact CZ-CD2 4.44Å; F2757-L2827 HydrophobicContact CZ-CG 4.2Å; M2819-L2827 HydrophobicContact CE-CD2 3.9Å; M2819-L2827 HydrophobicContact SD-CD2 3.9Å; T2823-L2827 WeakPolarHBondContact O-CB 3.4Å; T2823-L2827 PolarHBondContact O-N 3.3Å; A2824-L2827 PolarHBondContact O-N 3.26Å; L2827-R2829 VanDerWaalsContact C-N 3.27Å; L2827-R2829 PolarHBondContact O-N 3.13Å; L2827-K2830 PolarHBondContact O-N 2.84Å; L2827-H2831 PolarHBondContact O-N 3.04Å; L2827-H2831 VanDerWaalsContact O-N 3.07Å; L2827-L2835 HydrophobicContact CD2-CD1 4.1Å; L2827-L2835 HydrophobicContact CG-CD2 4.36Å
2828	I	93.7	Very high	94.7	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-55.3	-45	175.6	-8.7	163.6	0	0	0	110.2	A2824 K2825 K2830 L2835 M2862 F2863 F2866 I2868 W2918	A2824-I2828 WeakPolarHBondContact O-CD1 3.41Å; A2824-I2828 VanDerWaalsContact O-CG1 3.28Å; A2824-I2828 WeakPolarHBondContact O-CG1 3.42Å; A2824-I2828 PolarHBondContact O-N 3.17Å; K2825-I2828 WeakPolarHBondContact O-CG1 3.47Å; I2828-K2830 PolarHBondContact O-N 2.86Å; I2828-L2835 HydrophobicContact CB-CD2 4.25Å; I2828-L2835 HydrophobicContact CG1-CD2 3.41Å; I2828-L2835 VanDerWaalsContact CG1-CD2 3.41Å; I2828-L2835 HydrophobicContact CG2-CD2 3.35Å; I2828-M2862 HydrophobicContact CD1-CG 3.6Å; I2828-M2862 HydrophobicContact CD1-SD 4.22Å; I2828-F2863 HydrophobicContact CD1-CD1 4.11Å; I2828-F2863 HydrophobicContact CD1-CE1 4.13Å; I2828-F2863 HydrophobicContact CG2-CD1 4.47Å; I2828-F2866 HydrophobicContact CB-CD1 4.4Å; I2828-F2866 HydrophobicContact CB-CD2 4.03Å; I2828-F2866 HydrophobicContact CB-CE1 4.39Å; I2828-F2866 HydrophobicContact CB-CE2 4.02Å; I2828-F2866 HydrophobicContact CB-CG 4.24Å; I2828-F2866 HydrophobicContact CB-CZ 4.21Å; I2828-F2866 HydrophobicContact CD1-CD2 4.44Å; I2828-F2866 HydrophobicContact CD1-CE2 4.1Å; I2828-F2866 HydrophobicContact CG1-CD2 4.32Å; I2828-F2866 HydrophobicContact CG1-CG 4.34Å; I2828-F2866 HydrophobicContact CG2-CB 3.97Å; I2828-F2866 HydrophobicContact CG2-CD1 4.03Å; I2828-F2866 HydrophobicContact CG2-CD2 3.49Å; I2828-F2866 VanDerWaalsContact CG2-CD2 3.47Å; I2828-F2866 HydrophobicContact CG2-CE1 3.73Å; I2828-F2866 HydrophobicContact CG2-CE2 3.64Å; I2828-F2866 HydrophobicContact CG2-CG 3.69Å; I2828-F2866 HydrophobicContact CG2-CZ 3.43Å; I2828-F2866 VanDerWaalsContact CG2-CZ 3.43Å; I2828-I2868 HydrophobicContact CD1-CD1 4.33Å; I2828-W2918 VanDerWaalsContact C-CH2 3.47Å; I2828-W2918 VanDerWaalsContact C-CZ3 3.45Å; I2828-W2918 HydrophobicContact CB-CH2 3.9Å; I2828-W2918 HydrophobicContact CB-CZ2 4.38Å; I2828-W2918 HydrophobicContact CB-CZ3 4.32Å; I2828-W2918 HydrophobicContact CD1-CH2 3.56Å; I2828-W2918 HydrophobicContact CD1-CZ2 3.53Å; I2828-W2918 HydrophobicContact CG1-CH2 3.52Å; I2828-W2918 HydrophobicContact CG1-CZ2 4.04Å; I2828-W2918 HydrophobicContact CG2-CE3 4.22Å; I2828-W2918 HydrophobicContact CG2-CH2 3.41Å; I2828-W2918 VanDerWaalsContact CG2-CH2 3.41Å; I2828-W2918 HydrophobicContact CG2-CZ2 3.95Å; I2828-W2918 HydrophobicContact CG2-CZ3 3.56Å; I2828-W2918 VanDerWaalsContact O-CZ3 3.26Å; I2828-W2918 WeakPolarHBondContact O-CZ3 3.48Å
2829	R	92.4	Very high	94.7	Very high	157.5 Å²	157.5	45.8 Å²	45.8	59%	0.594	23%	0.225	S	C	*	.	H	α-helix	trans	-65.3	-38.4	-179.2	-75.8	176.8	176.9	148.5	-7.4	114.1	K2825 K2826 L2827 W2918	K2825-R2829 WeakPolarHBondContact O-CD 3.25Å; K2825-R2829 VanDerWaalsContact O-CG 3.28Å; K2825-R2829 WeakPolarHBondContact O-CG 3.23Å; K2825-R2829 PolarHBondContact O-N 2.94Å; K2826-R2829 PolarHBondContact O-N 3.11Å; L2827-R2829 VanDerWaalsContact C-N 3.27Å; L2827-R2829 PolarHBondContact O-N 3.13Å; R2829-W2918 HydrophobicContact CB-CH2 4.14Å; R2829-W2918 HydrophobicContact CB-CZ3 4.36Å; R2829-W2918 HydrophobicContact CG-CH2 3.61Å; R2829-W2918 HydrophobicContact CG-CZ2 4.1Å; R2829-W2918 HydrophobicContact CG-CZ3 3.82Å; R2829-W2918 VanDerWaalsContact CG-CZ3 3.5Å
2830	K	93.5	Very high	94.6	Very high	130.5 Å²	130.5	46 Å²	46	57%	0.567	23%	0.225	S	C	*	.	H	α-helix	trans	-82.4	-33.7	-178.5	-69.9	-169.3	175.1	-169.5	0	113.2	M2630 K2826 L2827 I2828	M2630-K2830 HydrophobicContact CE-CD 4.12Å; K2826-K2830 PolarHBondContact O-N 3.16Å; K2826-K2830 VanDerWaalsContact O-N 3.13Å; L2827-K2830 PolarHBondContact O-N 2.84Å; I2828-K2830 PolarHBondContact O-N 2.86Å
2831	H	93	Very high	94.4	Very high	62 Å²	62	46.4 Å²	46.4	29%	0.287	23%	0.227	S	C	.	.			trans	-143.1	63.6	-168	-61.5	-67.4	0	0	0	113.2	F2757 L2827 E2834 L2835	F2757-H2831 HydrophobicContact CD2-CB 3.92Å; F2757-H2831 AromaticContact CD2-CG 3.75Å; F2757-H2831 HydrophobicContact CE2-CB 3.46Å; F2757-H2831 AromaticContact CE2-CD2 3.92Å; F2757-H2831 AromaticContact CE2-CG 3.59Å; F2757-H2831 HydrophobicContact CZ-CB 3.72Å; L2827-H2831 PolarHBondContact O-N 3.04Å; L2827-H2831 VanDerWaalsContact O-N 3.07Å; H2831-E2834 VanDerWaalsContact C-OE2 3.25Å; H2831-E2834 VanDerWaalsContact CA-OE2 3.29Å; H2831-E2834 WeakPolarHBondContact CA-OE2 3.45Å; H2831-E2834 HydrophobicContact CB-CB 4.29Å; H2831-E2834 WeakPolarHBondContact CB-OE2 3.38Å; H2831-E2834 IonicContact CE1-OE1 2.91Å; H2831-E2834 IonicContact CG-OE1 2.8Å; H2831-E2834 IonicContact ND1-OE1 3.88Å; H2831-E2834 PolarHBondContact ND1-OE1 3.4Å; H2831-L2835 WeakPolarHBondContact O-CB 3.39Å; H2831-L2835 PolarHBondContact O-N 3.39Å; H2831-L2835 VanDerWaalsContact O-N 3.12Å
2832	P	92.3	Very high	94.3	Very high	23.5 Å²	23.5	46.2 Å²	46.2	15%	0.153	23%	0.226	C	C	.	.	H	α-helix	trans	-67	-40.6	-172.2	25.6	-34.4	0	0	0	113.5	V2836 F2866 W2918	P2832-V2836 WeakPolarHBondContact O-CG2 3.33Å; P2832-V2836 PolarHBondContact O-N 2.94Å; P2832-F2866 HydrophobicContact CB-CD1 4.16Å; P2832-F2866 HydrophobicContact CB-CE1 3.6Å; P2832-W2918 HydrophobicContact CB-CZ3 4.49Å
2833	L	92.2	Very high	94.4	Very high	67.5 Å²	67.5	43.3 Å²	43.3	35%	0.353	21%	0.208	S	C	.	.	H	α-helix	trans	-77.6	-41.7	-176.2	-66.1	176.5	0	0	0	111.4	L2835 V2836 A2837 F2915 N2916	L2833-L2835 VanDerWaalsContact C-N 3.28Å; L2833-L2835 PolarHBondContact O-N 2.83Å; L2833-V2836 PolarHBondContact O-N 3.11Å; L2833-A2837 WeakPolarHBondContact O-CB 3.38Å; L2833-A2837 PolarHBondContact O-N 3.41Å; L2833-F2915 WeakPolarHBondContact CD2-O 3.42Å; L2833-N2916 HydrophobicContact CD2-CB 4.12Å
2834	E	93.8	Very high	94.4	Very high	76 Å²	76	40.6 Å²	40.6	36%	0.355	19%	0.192	S	C	.	.	H	α-helix	trans	-64.7	-33.1	177.5	-53.5	90.5	143.4	0	0	111.3	F2757 H2831 A2837 F2838	F2757-E2834 HydrophobicContact CD1-CB 4.26Å; F2757-E2834 HydrophobicContact CD2-CB 3.76Å; F2757-E2834 HydrophobicContact CD2-CG 4.46Å; F2757-E2834 HydrophobicContact CE1-CB 4.15Å; F2757-E2834 HydrophobicContact CE2-CB 3.91Å; F2757-E2834 HydrophobicContact CG-CB 3.94Å; F2757-E2834 HydrophobicContact CZ-CB 4.22Å; H2831-E2834 VanDerWaalsContact C-OE2 3.25Å; H2831-E2834 VanDerWaalsContact CA-OE2 3.29Å; H2831-E2834 WeakPolarHBondContact CA-OE2 3.45Å; H2831-E2834 HydrophobicContact CB-CB 4.29Å; H2831-E2834 WeakPolarHBondContact CB-OE2 3.38Å; H2831-E2834 IonicContact CE1-OE1 2.91Å; H2831-E2834 IonicContact CG-OE1 2.8Å; H2831-E2834 IonicContact ND1-OE1 3.88Å; H2831-E2834 PolarHBondContact ND1-OE1 3.4Å; E2834-A2837 PolarHBondContact O-N 3.09Å; E2834-F2838 VanDerWaalsContact O-CB 3.23Å; E2834-F2838 WeakPolarHBondContact O-CB 3.32Å; E2834-F2838 PolarHBondContact O-N 3.31Å
2835	L	94.8	Very high	94.5	Very high	1 Å²	1	40.8 Å²	40.8	1%	0.005	19%	0.193	C	C	.	.	H	α-helix	trans	-70.7	-42.7	174.5	-179.3	60.5	0	0	0	112.9	F2757 L2827 I2828 H2831 L2833 A2837 F2838 T2839 L2844 F2866 I2868	F2757-L2835 HydrophobicContact CE1-CB 4.17Å; F2757-L2835 HydrophobicContact CE1-CD1 4.32Å; F2757-L2835 HydrophobicContact CE2-CB 4.27Å; F2757-L2835 HydrophobicContact CZ-CB 4.15Å; F2757-L2835 HydrophobicContact CZ-CD1 4.3Å; L2827-L2835 HydrophobicContact CD2-CD1 4.1Å; L2827-L2835 HydrophobicContact CG-CD2 4.36Å; I2828-L2835 HydrophobicContact CB-CD2 4.25Å; I2828-L2835 HydrophobicContact CG1-CD2 3.41Å; I2828-L2835 VanDerWaalsContact CG1-CD2 3.41Å; I2828-L2835 HydrophobicContact CG2-CD2 3.35Å; H2831-L2835 WeakPolarHBondContact O-CB 3.39Å; H2831-L2835 PolarHBondContact O-N 3.39Å; H2831-L2835 VanDerWaalsContact O-N 3.12Å; L2833-L2835 VanDerWaalsContact C-N 3.28Å; L2833-L2835 PolarHBondContact O-N 2.83Å; L2835-A2837 VanDerWaalsContact C-N 3.31Å; L2835-A2837 PolarHBondContact O-N 2.88Å; L2835-F2838 HydrophobicContact CD1-CD1 4.48Å; L2835-F2838 PolarHBondContact O-N 2.95Å; L2835-T2839 HydrophobicContact CD1-CG2 4.11Å; L2835-T2839 WeakPolarHBondContact O-CG2 3.47Å; L2835-T2839 PolarHBondContact O-N 2.88Å; L2835-T2839 PolarHBondContact O-OG1 3.07Å; L2835-L2844 HydrophobicContact CD1-CD2 3.79Å; L2835-F2866 HydrophobicContact CD2-CB 3.93Å; L2835-F2866 HydrophobicContact CD2-CG 4.41Å; L2835-F2866 HydrophobicContact CG-CB 4.28Å; L2835-I2868 HydrophobicContact CD2-CD1 4.32Å
2836	V	94	Very high	94.7	Very high	13 Å²	13	38.1 Å²	38.1	8%	0.079	18%	0.181	C	C	.	.	H	α-helix	trans	-60.1	-44.9	172.7	172.5	0	0	0	0	110.1	P2832 L2833 F2838 T2839 K2840 F2866 M2904	P2832-V2836 WeakPolarHBondContact O-CG2 3.33Å; P2832-V2836 PolarHBondContact O-N 2.94Å; L2833-V2836 PolarHBondContact O-N 3.11Å; V2836-F2838 PolarHBondContact O-N 3.43Å; V2836-T2839 PolarHBondContact O-N 3.37Å; V2836-T2839 PolarHBondContact O-OG1 3.17Å; V2836-K2840 PolarHBondContact O-N 3.23Å; V2836-F2866 HydrophobicContact CG2-CB 4.36Å; V2836-F2866 HydrophobicContact CG2-CD1 4.24Å; V2836-M2904 HydrophobicContact CG1-CB 4.38Å; V2836-M2904 HydrophobicContact CG1-CG 4.47Å
2837	A	93.6	Very high	94.8	Very high	42 Å²	42	35.7 Å²	35.7	35%	0.347	17%	0.169	S	C	.	.	H	α-helix	trans	-62.4	-44.2	175.2	0	0	0	0	0	112.6	P2807 L2833 E2834 L2835 T2839 K2840	P2807-A2837 HydrophobicContact CG-CB 3.95Å; L2833-A2837 WeakPolarHBondContact O-CB 3.38Å; L2833-A2837 PolarHBondContact O-N 3.41Å; E2834-A2837 PolarHBondContact O-N 3.09Å; L2835-A2837 VanDerWaalsContact C-N 3.31Å; L2835-A2837 PolarHBondContact O-N 2.88Å; A2837-T2839 VanDerWaalsContact C-N 3.35Å; A2837-T2839 PolarHBondContact O-N 2.89Å; A2837-K2840 VanDerWaalsContact O-CB 3.31Å; A2837-K2840 WeakPolarHBondContact O-CB 3.38Å; A2837-K2840 PolarHBondContact O-N 3.16Å; A2837-K2840 VanDerWaalsContact O-N 3.09Å
2838	F	94.5	Very high	94.9	Very high	9.5 Å²	9.5	35.1 Å²	35.1	4%	0.042	17%	0.166	C	C	.	.	H	α-helix	trans	-61.4	-43.9	178.8	178.6	-98.5	0	0	0	112.4	F2754 F2757 F2809 P2817 E2834 L2835 V2836 K2840 D2841 H2842 L2844	F2754-F2838 HydrophobicContact CE2-CE1 4.34Å; F2754-F2838 HydrophobicContact CE2-CZ 4.27Å; F2757-F2838 HydrophobicContact CD1-CB 3.87Å; F2757-F2838 HydrophobicContact CD1-CD2 4.32Å; F2757-F2838 HydrophobicContact CD1-CG 4.18Å; F2757-F2838 HydrophobicContact CE1-CB 3.8Å; F2757-F2838 HydrophobicContact CE1-CD1 4.42Å; F2757-F2838 AromaticContact CE1-CD2 3.96Å; F2757-F2838 HydrophobicContact CE1-CD2 3.96Å; F2757-F2838 AromaticContact CE1-CG 3.74Å; F2757-F2838 HydrophobicContact CE1-CG 4.04Å; F2757-F2838 HydrophobicContact CZ-CB 4.07Å; F2757-F2838 HydrophobicContact CZ-CG 4.41Å; F2809-F2838 HydrophobicContact CD1-CD2 4.17Å; F2809-F2838 HydrophobicContact CD2-CD2 4.15Å; F2809-F2838 HydrophobicContact CE1-CB 4.44Å; F2809-F2838 HydrophobicContact CE1-CD2 4.24Å; F2809-F2838 HydrophobicContact CE2-CB 4.04Å; F2809-F2838 HydrophobicContact CE2-CD2 4.21Å; F2809-F2838 HydrophobicContact CG-CD2 4.13Å; F2809-F2838 HydrophobicContact CZ-CB 3.84Å; F2809-F2838 HydrophobicContact CZ-CD2 4.25Å; P2817-F2838 HydrophobicContact CG-CE1 4.13Å; P2817-F2838 HydrophobicContact CG-CZ 3.89Å; E2834-F2838 VanDerWaalsContact O-CB 3.23Å; E2834-F2838 WeakPolarHBondContact O-CB 3.32Å; E2834-F2838 PolarHBondContact O-N 3.31Å; L2835-F2838 HydrophobicContact CD1-CD1 4.48Å; L2835-F2838 PolarHBondContact O-N 2.95Å; V2836-F2838 PolarHBondContact O-N 3.43Å; F2838-K2840 PolarHBondContact O-N 3.45Å; F2838-D2841 PolarHBondContact O-N 3.25Å; F2838-H2842 HydrophobicContact CD1-CB 4.18Å; F2838-H2842 HydrophobicContact CD2-CB 4.4Å; F2838-H2842 AromaticContact CD2-CG 3.99Å; F2838-H2842 AromaticContact CD2-ND1 3.66Å; F2838-H2842 HydrophobicContact CE1-CB 3.69Å; F2838-H2842 HydrophobicContact CE2-CB 3.93Å; F2838-H2842 AromaticContact CE2-CD2 3.89Å; F2838-H2842 AromaticContact CE2-CE1 3.82Å; F2838-H2842 AromaticContact CE2-CG 3.52Å; F2838-H2842 VanDerWaalsContact CE2-CG 3.49Å; F2838-H2842 AromaticContact CE2-ND1 3.57Å; F2838-H2842 WeakPolarHBondContact CE2-ND1 3.48Å; F2838-H2842 HydrophobicContact CG-CB 4.49Å; F2838-H2842 HydrophobicContact CZ-CB 3.54Å; F2838-H2842 AromaticContact CZ-CD2 3.99Å; F2838-H2842 AromaticContact CZ-CG 3.63Å; F2838-H2842 WeakPolarHBondContact O-CB 3.29Å; F2838-H2842 PolarHBondContact O-N 2.99Å; F2838-H2842 PolarHBondContact O-ND1 2.97Å; F2838-L2844 HydrophobicContact CE1-CB 4.49Å; F2838-L2844 HydrophobicContact CE1-CD1 4.3Å
2839	T	95.7	Very high	95	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-73.2	-6.1	179.7	68.4	0	0	0	0	113.7	L2835 V2836 A2837 H2842 L2844 F2866 G2867 I2868 Q2869 K2900	L2835-T2839 HydrophobicContact CD1-CG2 4.11Å; L2835-T2839 WeakPolarHBondContact O-CG2 3.47Å; L2835-T2839 PolarHBondContact O-N 2.88Å; L2835-T2839 PolarHBondContact O-OG1 3.07Å; V2836-T2839 PolarHBondContact O-N 3.37Å; V2836-T2839 PolarHBondContact O-OG1 3.17Å; A2837-T2839 VanDerWaalsContact C-N 3.35Å; A2837-T2839 PolarHBondContact O-N 2.89Å; T2839-H2842 WeakPolarHBondContact CA-O 3.37Å; T2839-L2844 HydrophobicContact CG2-CB 4.34Å; T2839-F2866 PolarHBondContact OG1-O 3.15Å; T2839-G2867 WeakPolarHBondContact CB-O 3.33Å; T2839-G2867 WeakPolarHBondContact OG1-CA 3.34Å; T2839-G2867 PolarHBondContact OG1-O 2.83Å; T2839-I2868 HydrophobicContact CG2-CG1 4.35Å; T2839-Q2869 PolarHBondContact O-NE2 3.09Å; T2839-K2900 PolarHBondContact O-NZ 3.33Å; T2839-K2900 PolarHBondContact OG1-NZ 3.05Å
2840	K	94.9	Very high	95	Very high	14.5 Å²	14.5	32.8 Å²	32.8	6%	0.063	18%	0.18	C	C	.	.	H	α-helix	trans	-61.6	-54.6	167.3	-177.6	-173.1	175.8	-174.4	0	110	S2457 Y2458 V2836 A2837 F2838 W2905 E2907 Y2912	S2457-K2840 WeakPolarHBondContact CB-O 3.28Å; S2457-K2840 PolarHBondContact OG-O 3.06Å; Y2458-K2840 VanDerWaalsContact CD1-O 3.24Å; Y2458-K2840 WeakPolarHBondContact CD1-O 3.44Å; Y2458-K2840 HydrophobicContact CE1-CG 3.85Å; Y2458-K2840 VanDerWaalsContact CE1-O 3.23Å; Y2458-K2840 WeakPolarHBondContact CE1-O 3.38Å; V2836-K2840 PolarHBondContact O-N 3.23Å; A2837-K2840 VanDerWaalsContact O-CB 3.31Å; A2837-K2840 WeakPolarHBondContact O-CB 3.38Å; A2837-K2840 PolarHBondContact O-N 3.16Å; A2837-K2840 VanDerWaalsContact O-N 3.09Å; F2838-K2840 PolarHBondContact O-N 3.45Å; K2840-W2905 HydrophobicContact CG-CB 4.23Å; K2840-E2907 IonicContact NZ-OE1 3.23Å; K2840-E2907 PolarHBondContact NZ-OE1 3.12Å; K2840-Y2912 HydrophobicContact CD-CE2 4.44Å; K2840-Y2912 PolarHBondContact NZ-OH 2.87Å
2841	D	92.8	Very high	95.1	Very high	53.5 Å²	53.5	32.1 Å²	32.1	29%	0.286	19%	0.186	S	C	.	.	H	α-helix	trans	-103.8	-12.1	-169.1	-58	-60.6	0	0	0	113.8	K2582 C2813 F2838	K2582-D2841 IonicContact NZ-OD1 3.08Å; C2813-D2841 WeakPolarHBondContact CA-O 3.48Å; C2813-D2841 VanDerWaalsContact CB-O 3.3Å; C2813-D2841 WeakPolarHBondContact CB-O 3.33Å; F2838-D2841 PolarHBondContact O-N 3.25Å
2842	H	95	Very high	95.2	Very high	7.5 Å²	7.5	31.5 Å²	31.5	4%	0.035	18%	0.182	C	C	.	.	S	Bend	trans	-120.6	150.9	177.6	-56.3	79.6	0	0	0	112.1	V2811 S2812 F2838 T2839 Q2869	V2811-H2842 PolarHBondContact O-NE2 3.4Å; S2812-H2842 WeakPolarHBondContact CB-NE2 3.48Å; S2812-H2842 PolarHBondContact O-CD2 2.94Å; S2812-H2842 VanDerWaalsContact O-CD2 3.3Å; S2812-H2842 PolarHBondContact O-NE2 3.45Å; F2838-H2842 HydrophobicContact CD1-CB 4.18Å; F2838-H2842 HydrophobicContact CD2-CB 4.4Å; F2838-H2842 AromaticContact CD2-CG 3.99Å; F2838-H2842 AromaticContact CD2-ND1 3.66Å; F2838-H2842 HydrophobicContact CE1-CB 3.69Å; F2838-H2842 HydrophobicContact CE2-CB 3.93Å; F2838-H2842 AromaticContact CE2-CD2 3.89Å; F2838-H2842 AromaticContact CE2-CE1 3.82Å; F2838-H2842 AromaticContact CE2-CG 3.52Å; F2838-H2842 VanDerWaalsContact CE2-CG 3.49Å; F2838-H2842 AromaticContact CE2-ND1 3.57Å; F2838-H2842 WeakPolarHBondContact CE2-ND1 3.48Å; F2838-H2842 HydrophobicContact CG-CB 4.49Å; F2838-H2842 HydrophobicContact CZ-CB 3.54Å; F2838-H2842 AromaticContact CZ-CD2 3.99Å; F2838-H2842 AromaticContact CZ-CG 3.63Å; F2838-H2842 WeakPolarHBondContact O-CB 3.29Å; F2838-H2842 PolarHBondContact O-N 2.99Å; F2838-H2842 PolarHBondContact O-ND1 2.97Å; T2839-H2842 WeakPolarHBondContact CA-O 3.37Å; H2842-Q2869 PolarHBondContact O-NE2 3.1Å
2843	I	97.3	Very high	95.3	Very high	3 Å²	3	33.9 Å²	33.9	2%	0.015	19%	0.192	C	C	.	.			trans	-89.6	131.2	168.5	-65.7	175	0	0	0	109.5	L2456 I2461 L2583 L2816 P2817 Q2869 M2870	L2456-I2843 HydrophobicContact CB-CD1 4.2Å; L2456-I2843 HydrophobicContact CD2-CD1 3.82Å; L2456-I2843 HydrophobicContact CG-CD1 3.83Å; I2461-I2843 HydrophobicContact CD1-CD1 4.37Å; L2583-I2843 HydrophobicContact CD1-CD1 3.73Å; L2583-I2843 HydrophobicContact CD1-CG1 3.8Å; L2816-I2843 WeakPolarHBondContact CA-O 3.34Å; L2816-I2843 HydrophobicContact CD1-CB 4.05Å; L2816-I2843 HydrophobicContact CD1-CG2 3.68Å; L2816-I2843 HydrophobicContact CG-CB 4.11Å; L2816-I2843 HydrophobicContact CG-CG2 3.89Å; P2817-I2843 VanDerWaalsContact CD-O 3.25Å; P2817-I2843 WeakPolarHBondContact CD-O 3.22Å; I2843-Q2869 HydrophobicContact CG2-CB 4.31Å; I2843-M2870 HydrophobicContact CG2-CG 3.9Å; I2843-M2870 HydrophobicContact CG2-SD 3.42Å; I2843-M2870 WeakPolarHBondContact CG2-SD 3.44Å
2844	L	97.7	Very high	95.5	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	20%	0.2	C	C	.	.			trans	-116.7	137.4	172.7	-173.4	66.6	0	0	0	110.8	P2817 M2819 L2835 F2838 T2839 I2868 M2870	P2817-L2844 HydrophobicContact CB-CD1 3.67Å; P2817-L2844 HydrophobicContact CG-CD1 3.85Å; M2819-L2844 HydrophobicContact CE-CD1 4.01Å; M2819-L2844 HydrophobicContact SD-CD1 4.44Å; L2835-L2844 HydrophobicContact CD1-CD2 3.79Å; F2838-L2844 HydrophobicContact CE1-CB 4.49Å; F2838-L2844 HydrophobicContact CE1-CD1 4.3Å; T2839-L2844 HydrophobicContact CG2-CB 4.34Å; L2844-I2868 HydrophobicContact CB-CG2 4.23Å; L2844-I2868 HydrophobicContact CD2-CD1 3.87Å; L2844-I2868 HydrophobicContact CD2-CG1 3.96Å; L2844-I2868 HydrophobicContact CD2-CG2 4.33Å; L2844-I2868 HydrophobicContact CG-CG2 4.27Å; L2844-I2868 WeakPolarHBondContact O-CG2 3.46Å; L2844-M2870 PolarHBondContact O-N 3.26Å; L2844-M2870 VanDerWaalsContact O-N 3.13Å
2845	R	98.3	Very high	95.6	Very high	4 Å²	4	31.6 Å²	31.6	2%	0.015	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	131.6	171.7	-174.2	-177	-172.6	-125.1	8.6	112.1	S2464 E2495 L2816 P2817 S2818 M2819 M2870	S2464-R2845 PolarHBondContact O-NH2 3.05Å; E2495-R2845 IonicContact OE1-CZ 3.24Å; E2495-R2845 IonicContact OE1-NH1 3.33Å; E2495-R2845 PolarHBondContact OE1-NH1 2.97Å; E2495-R2845 IonicContact OE1-NH2 3.48Å; E2495-R2845 PolarHBondContact OE1-NH2 2.97Å; E2495-R2845 IonicContact OE2-CZ 2.67Å; E2495-R2845 IonicContact OE2-NH1 3.82Å; E2495-R2845 PolarHBondContact OE2-NH1 3.14Å; E2495-R2845 IonicContact OE2-NH2 2.75Å; E2495-R2845 PolarHBondContact OE2-NH2 3.23Å; L2816-R2845 HydrophobicContact CD2-CB 4.23Å; P2817-R2845 PolarHBondContact O-N 3.28Å; S2818-R2845 WeakPolarHBondContact CA-O 3.32Å; M2819-R2845 PolarHBondContact N-O 3.12Å; M2819-R2845 VanDerWaalsContact N-O 3.09Å; R2845-M2870 VanDerWaalsContact CA-O 3.31Å; R2845-M2870 WeakPolarHBondContact CA-O 3.41Å; R2845-M2870 HydrophobicContact CB-CB 3.91Å; R2845-M2870 HydrophobicContact CB-SD 4.5Å; R2845-M2870 HydrophobicContact CG-CB 3.94Å; R2845-M2870 WeakPolarHBondContact CG-O 3.19Å
2846	T	98.3	Very high	95.7	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	149.6	163.8	-172.4	0	0	0	0	110.6	M2819 A2824 F2858 F2863 I2868 M2870 V2871 A2872	M2819-T2846 VanDerWaalsContact O-CA 3.29Å; M2819-T2846 WeakPolarHBondContact O-CA 3.25Å; M2819-T2846 PolarHBondContact O-OG1 2.81Å; A2824-T2846 WeakPolarHBondContact CB-OG1 3.32Å; T2846-F2858 HydrophobicContact CG2-CE2 4.22Å; T2846-F2858 HydrophobicContact CG2-CZ 4.19Å; T2846-F2863 HydrophobicContact CG2-CB 4.2Å; T2846-F2863 HydrophobicContact CG2-CD1 3.83Å; T2846-F2863 HydrophobicContact CG2-CD2 4.11Å; T2846-F2863 HydrophobicContact CG2-CE1 4.35Å; T2846-F2863 HydrophobicContact CG2-CE2 4.19Å; T2846-F2863 HydrophobicContact CG2-CG 3.91Å; T2846-I2868 HydrophobicContact CG2-CG2 4.12Å; T2846-M2870 PolarHBondContact N-O 3.24Å; T2846-V2871 HydrophobicContact CG2-CB 4.18Å; T2846-V2871 HydrophobicContact CG2-CG1 4.03Å; T2846-V2871 HydrophobicContact CG2-CG2 3.9Å; T2846-A2872 WeakPolarHBondContact O-CB 3.26Å; T2846-A2872 PolarHBondContact O-N 3.19Å
2847	Y	98.3	Very high	95.9	Very high	67 Å²	67	32.6 Å²	32.6	26%	0.263	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	163.2	-178.3	61.4	-90.8	0	0	0	110.7	M2819 N2820 E2821	M2819-Y2847 WeakPolarHBondContact O-CD1 3.28Å; M2819-Y2847 VanDerWaalsContact O-CE1 3.28Å; M2819-Y2847 WeakPolarHBondContact O-CE1 3.39Å; M2819-Y2847 PolarHBondContact O-N 3.24Å; N2820-Y2847 CarbonylContact C-O 3.56Å; N2820-Y2847 VanDerWaalsContact CA-O 3.32Å; N2820-Y2847 WeakPolarHBondContact CA-O 3.48Å; N2820-Y2847 HydrophobicContact CB-CD2 4.41Å; N2820-Y2847 HydrophobicContact CB-CE2 3.94Å; E2821-Y2847 PolarHBondContact N-O 2.94Å
2848	P	97.9	Very high	96.1	Very high	4.5 Å²	4.5	30.9 Å²	30.9	3%	0.029	17%	0.174	C	C	.	.			trans	-57.6	149.2	-175.8	-26.7	37.2	0	0	0	113.2	H2465 E2821 F2858 A2872	H2465-P2848 HydrophobicContact CB-CG 4.33Å; H2465-P2848 VanDerWaalsContact CD2-CD 3.44Å; H2465-P2848 WeakPolarHBondContact CD2-CD 3.41Å; E2821-P2848 WeakPolarHBondContact OE2-CA 3.23Å; P2848-F2858 HydrophobicContact CB-CD1 4.42Å; P2848-F2858 HydrophobicContact CB-CE1 4.37Å; P2848-F2858 HydrophobicContact CG-CD1 4.27Å; P2848-F2858 HydrophobicContact CG-CE1 3.88Å; P2848-A2872 WeakPolarHBondContact CD-O 3.36Å
2849	S	95.2	Very high	96.1	Very high	16.5 Å²	16.5	33.8 Å²	33.8	12%	0.115	19%	0.19	C	C	.	.			trans	-71.2	145.4	170.2	-178.3	0	0	0	0	110.9	E2821 V2851 R2852	E2821-S2849 PolarHBondContact OE2-N 2.95Å; S2849-V2851 PolarHBondContact O-N 3.1Å; S2849-R2852 WeakPolarHBondContact O-CB 3.27Å; S2849-R2852 PolarHBondContact O-N 2.97Å
2850	A	92.5	Very high	96.2	Very high	93 Å²	93	33.8 Å²	33.8	77%	0.769	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-17.7	179.7	0	0	0	0	0	113.9	R2852 I2853	A2850-R2852 VanDerWaalsContact C-N 3.26Å; A2850-R2852 PolarHBondContact O-N 2.99Å; A2850-I2853 WeakPolarHBondContact O-CG2 3.33Å
2851	V	94.3	Very high	96.2	Very high	116 Å²	116	33.2 Å²	33.2	70%	0.703	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-21.1	173	-54.4	0	0	0	0	113.3	S2849 I2853	S2849-V2851 PolarHBondContact O-N 3.1Å; V2851-I2853 PolarHBondContact O-N 3.24Å
2852	R	95.7	Very high	96.3	Very high	49 Å²	49	32.5 Å²	32.5	19%	0.185	18%	0.184	C	C	.	.			trans	-78.8	56.4	176.8	-62.4	-166.7	-177.4	-82.6	-3.2	111.6	Q2473 D2650 E2821 S2849 A2850 D2854 S2855 S2856	Q2473-R2852 WeakPolarHBondContact CG-O 3.44Å; D2650-R2852 IonicContact OD1-NH1 3.89Å; D2650-R2852 PolarHBondContact OD1-NH1 3.35Å; D2650-R2852 IonicContact OD1-NH2 2.68Å; E2821-R2852 VanDerWaalsContact CD-NE 3.34Å; E2821-R2852 IonicContact OE1-CZ 3.04Å; E2821-R2852 IonicContact OE1-NE 3.24Å; E2821-R2852 PolarHBondContact OE1-NE 3.33Å; E2821-R2852 IonicContact OE1-NH2 2.99Å; E2821-R2852 PolarHBondContact OE1-NH2 2.97Å; E2821-R2852 WeakPolarHBondContact OE2-CD 3.34Å; E2821-R2852 IonicContact OE2-CZ 3.7Å; E2821-R2852 IonicContact OE2-NE 3.06Å; E2821-R2852 PolarHBondContact OE2-NE 3.32Å; E2821-R2852 IonicContact OE2-NH2 3.84Å; S2849-R2852 WeakPolarHBondContact O-CB 3.27Å; S2849-R2852 PolarHBondContact O-N 2.97Å; A2850-R2852 VanDerWaalsContact C-N 3.26Å; A2850-R2852 PolarHBondContact O-N 2.99Å; R2852-D2854 PolarHBondContact O-N 2.86Å; R2852-S2855 WeakPolarHBondContact O-CA 3.42Å; R2852-S2855 PolarHBondContact O-N 3.31Å; R2852-S2856 VanDerWaalsContact CD-O 3.22Å; R2852-S2856 WeakPolarHBondContact CD-O 3.43Å; R2852-S2856 WeakPolarHBondContact CD-OG 3.39Å; R2852-S2856 WeakPolarHBondContact CG-OG 3.29Å; R2852-S2856 PolarHBondContact NH1-OG 3.42Å; R2852-S2856 VanDerWaalsContact NH1-OG 3.07Å
2853	I	95.4	Very high	96.4	Very high	74 Å²	74	32.2 Å²	32.2	38%	0.379	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-24	-177.5	62.6	171.6	0	0	0	112.9	H2472 Q2473 L2474 A2850 V2851 S2855	H2472-I2853 PolarHBondContact CD2-O 3.4Å; H2472-I2853 PolarHBondContact CE1-O 2.94Å; H2472-I2853 PolarHBondContact ND1-O 2.98Å; H2472-I2853 VanDerWaalsContact ND1-O 3.16Å; Q2473-I2853 PolarHBondContact N-O 3.31Å; L2474-I2853 HydrophobicContact CD1-CB 4.24Å; L2474-I2853 HydrophobicContact CD1-CG2 3.86Å; L2474-I2853 HydrophobicContact CG-CB 4.31Å; L2474-I2853 HydrophobicContact CG-CG2 4.13Å; A2850-I2853 WeakPolarHBondContact O-CG2 3.33Å; V2851-I2853 PolarHBondContact O-N 3.24Å; I2853-S2855 PolarHBondContact O-N 3.03Å
2854	D	95.5	Very high	96.4	Very high	95.5 Å²	95.5	32.1 Å²	32.1	51%	0.511	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76	-5.6	174.6	71.9	-26.3	0	0	0	113.7	R2852 S2856	R2852-D2854 PolarHBondContact O-N 2.86Å; D2854-S2856 VanDerWaalsContact C-N 3.31Å; D2854-S2856 VanDerWaalsContact OD1-CB 3.29Å; D2854-S2856 WeakPolarHBondContact OD1-CB 3.35Å; D2854-S2856 PolarHBondContact OD1-N 2.73Å; D2854-S2856 PolarHBondContact OD1-OG 3.35Å; D2854-S2856 WeakPolarHBondContact OD2-CB 3.15Å; D2854-S2856 PolarHBondContact OD2-OG 3.03Å
2855	S	95.9	Very high	96.3	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	18%	0.183	C	C	.	.			trans	66.1	25.1	-172.8	-54.9	0	0	0	0	114.6	G2471 Q2473 R2852 I2853 N2874 Q2876 T2877	G2471-S2855 WeakPolarHBondContact O-CB 3.27Å; G2471-S2855 PolarHBondContact O-OG 3.24Å; Q2473-S2855 WeakPolarHBondContact CG-OG 3.22Å; Q2473-S2855 PolarHBondContact N-OG 3.2Å; Q2473-S2855 PolarHBondContact NE2-OG 3.29Å; R2852-S2855 WeakPolarHBondContact O-CA 3.42Å; R2852-S2855 PolarHBondContact O-N 3.31Å; I2853-S2855 PolarHBondContact O-N 3.03Å; S2855-N2874 WeakPolarHBondContact CA-ND2 3.35Å; S2855-N2874 VanDerWaalsContact O-CB 3.27Å; S2855-N2874 WeakPolarHBondContact O-CB 3.36Å; S2855-N2874 PolarHBondContact O-ND2 3.07Å; S2855-N2874 VanDerWaalsContact O-ND2 3.13Å; S2855-Q2876 PolarHBondContact OG-NE2 3.23Å; S2855-T2877 VanDerWaalsContact O-CB 3.29Å; S2855-T2877 WeakPolarHBondContact O-CB 3.35Å; S2855-T2877 PolarHBondContact O-OG1 3.31Å
2856	S	97.1	Very high	96.1	Very high	23.5 Å²	23.5	32.1 Å²	32.1	16%	0.164	18%	0.182	C	C	.	.	P	Polyproline II helix	trans	-55.4	155.5	166.8	52	0	0	0	0	112.1	R2852 D2854 N2874	R2852-S2856 VanDerWaalsContact CD-O 3.22Å; R2852-S2856 WeakPolarHBondContact CD-O 3.43Å; R2852-S2856 WeakPolarHBondContact CD-OG 3.39Å; R2852-S2856 WeakPolarHBondContact CG-OG 3.29Å; R2852-S2856 PolarHBondContact NH1-OG 3.42Å; R2852-S2856 VanDerWaalsContact NH1-OG 3.07Å; D2854-S2856 VanDerWaalsContact C-N 3.31Å; D2854-S2856 VanDerWaalsContact OD1-CB 3.29Å; D2854-S2856 WeakPolarHBondContact OD1-CB 3.35Å; D2854-S2856 PolarHBondContact OD1-N 2.73Å; D2854-S2856 PolarHBondContact OD1-OG 3.35Å; D2854-S2856 WeakPolarHBondContact OD2-CB 3.15Å; D2854-S2856 PolarHBondContact OD2-OG 3.03Å; S2856-N2874 PolarHBondContact O-ND2 3.14Å; S2856-N2874 VanDerWaalsContact O-ND2 3.13Å
2857	N	97.8	Very high	96	Very high	11.5 Å²	11.5	32.1 Å²	32.1	6%	0.061	18%	0.182	C	C	.	.	P	Polyproline II helix	trans	-106.8	154.2	173.8	-68.6	-62.2	0	0	0	112.2	L2873 N2874 T2877 D2879 P2881	N2857-L2873 HydrophobicContact CB-CD2 4.16Å; N2857-L2873 WeakPolarHBondContact OD1-CA 3.37Å; N2857-L2873 WeakPolarHBondContact OD1-CB 3.42Å; N2857-N2874 PolarHBondContact ND2-O 3.18Å; N2857-N2874 WeakPolarHBondContact OD1-CB 3.34Å; N2857-N2874 PolarHBondContact OD1-N 3.25Å; N2857-T2877 PolarHBondContact ND2-O 3.3Å; N2857-D2879 VanDerWaalsContact CB-OD2 3.3Å; N2857-D2879 WeakPolarHBondContact CB-OD2 3.5Å; N2857-D2879 PolarHBondContact N-OD2 2.98Å; N2857-D2879 PolarHBondContact ND2-OD1 3.14Å; N2857-D2879 PolarHBondContact ND2-OD2 3.17Å; N2857-P2881 HydrophobicContact CB-CB 3.56Å; N2857-P2881 HydrophobicContact CB-CG 3.9Å
2858	F	97.1	Very high	96	Very high	6 Å²	6	29 Å²	29	3%	0.026	17%	0.17	C	C	.	.	P	Polyproline II helix	trans	-93.3	159.3	168.3	59.7	-95.6	0	0	0	110.7	E2821 T2846 P2848 P2860 F2863 V2871 L2873 P2881	E2821-F2858 HydrophobicContact CB-CD1 3.87Å; E2821-F2858 HydrophobicContact CB-CE1 4.25Å; E2821-F2858 HydrophobicContact CB-CG 4.12Å; E2821-F2858 HydrophobicContact CG-CD1 4.38Å; E2821-F2858 WeakPolarHBondContact OE2-CD1 3.38Å; T2846-F2858 HydrophobicContact CG2-CE2 4.22Å; T2846-F2858 HydrophobicContact CG2-CZ 4.19Å; P2848-F2858 HydrophobicContact CB-CD1 4.42Å; P2848-F2858 HydrophobicContact CB-CE1 4.37Å; P2848-F2858 HydrophobicContact CG-CD1 4.27Å; P2848-F2858 HydrophobicContact CG-CE1 3.88Å; F2858-P2860 WeakPolarHBondContact O-CD 3.4Å; F2858-F2863 AromaticContact CD2-CD2 3.79Å; F2858-F2863 HydrophobicContact CD2-CD2 3.79Å; F2858-F2863 AromaticContact CD2-CE2 3.33Å; F2858-F2863 HydrophobicContact CD2-CE2 3.33Å; F2858-F2863 VanDerWaalsContact CD2-CE2 3.48Å; F2858-F2863 AromaticContact CD2-CZ 3.97Å; F2858-F2863 HydrophobicContact CD2-CZ 3.97Å; F2858-F2863 AromaticContact CE2-CD2 3.54Å; F2858-F2863 HydrophobicContact CE2-CD2 3.54Å; F2858-F2863 AromaticContact CE2-CE2 3.44Å; F2858-F2863 HydrophobicContact CE2-CE2 3.44Å; F2858-F2863 HydrophobicContact CE2-CG 4.4Å; F2858-F2863 HydrophobicContact CE2-CZ 4.03Å; F2858-F2863 HydrophobicContact CG-CE2 4.22Å; F2858-F2863 HydrophobicContact CZ-CD2 4.42Å; F2858-F2863 HydrophobicContact CZ-CE2 4.39Å; F2858-V2871 HydrophobicContact CE2-CG1 3.47Å; F2858-V2871 VanDerWaalsContact CE2-CG1 3.47Å; F2858-V2871 HydrophobicContact CZ-CG1 3.74Å; F2858-L2873 HydrophobicContact CD1-CD2 4.45Å; F2858-L2873 HydrophobicContact CD2-CD2 4.49Å; F2858-L2873 HydrophobicContact CE1-CD2 4.06Å; F2858-L2873 HydrophobicContact CE2-CD2 4.04Å; F2858-L2873 HydrophobicContact CZ-CD2 3.8Å; F2858-P2881 VanDerWaalsContact O-CB 3.32Å; F2858-P2881 WeakPolarHBondContact O-CB 3.34Å; F2858-P2881 WeakPolarHBondContact O-CG 3.2Å
2859	N	96.2	Very high	96.1	Very high	71 Å²	71	28.7 Å²	28.7	38%	0.38	17%	0.168	S	C	.	.	P	Polyproline II helix	trans	-67	119.5	178.1	-177.4	-10.1	0	0	0	111.9	L2861 F2863	N2859-L2861 VanDerWaalsContact C-N 3.34Å; N2859-L2861 PolarHBondContact O-N 3.41Å; N2859-L2861 WeakPolarHBondContact OD1-CB 3.33Å; N2859-L2861 PolarHBondContact OD1-N 3.18Å; N2859-F2863 WeakPolarHBondContact O-CD2 3.39Å; N2859-F2863 WeakPolarHBondContact O-CE2 3.49Å
2860	P	97.6	Very high	96.2	Very high	0 Å²	0	28 Å²	28	0%	0	16%	0.163	C	C	.	.	S	Bend	trans	-74	-22	-176.5	31	-37.4	0	0	0	114.2	F2858 M2862 F2863 W2864 V2871 I2884	F2858-P2860 WeakPolarHBondContact O-CD 3.4Å; P2860-M2862 VanDerWaalsContact C-N 3.29Å; P2860-M2862 PolarHBondContact O-N 3.04Å; P2860-F2863 PolarHBondContact O-N 2.86Å; P2860-W2864 HydrophobicContact CB-CD2 4.15Å; P2860-W2864 HydrophobicContact CB-CE3 4.19Å; P2860-W2864 HydrophobicContact CB-CH2 3.66Å; P2860-W2864 HydrophobicContact CB-CZ2 3.66Å; P2860-W2864 HydrophobicContact CB-CZ3 3.96Å; P2860-W2864 HydrophobicContact CG-CE3 4.39Å; P2860-W2864 HydrophobicContact CG-CH2 3.62Å; P2860-W2864 HydrophobicContact CG-CZ2 4.14Å; P2860-W2864 HydrophobicContact CG-CZ3 3.79Å; P2860-W2864 PolarHBondContact O-N 3.37Å; P2860-V2871 HydrophobicContact CB-CB 4.48Å; P2860-V2871 HydrophobicContact CB-CG1 3.72Å; P2860-I2884 HydrophobicContact CG-CB 4.3Å; P2860-I2884 HydrophobicContact CG-CG2 3.89Å
2861	L	95.3	Very high	96.5	Very high	1.5 Å²	1.5	23.6 Å²	23.6	1%	0.008	13%	0.127	C	C	.	.	H	α-helix	trans	-61.8	-37.4	-176.2	-66.5	166.8	0	0	0	112.2	N2859 F2863 W2864 T2865 I2884 M2956 F2994	N2859-L2861 VanDerWaalsContact C-N 3.34Å; N2859-L2861 PolarHBondContact O-N 3.41Å; N2859-L2861 WeakPolarHBondContact OD1-CB 3.33Å; N2859-L2861 PolarHBondContact OD1-N 3.18Å; L2861-F2863 PolarHBondContact O-N 3.09Å; L2861-F2863 VanDerWaalsContact O-N 3.11Å; L2861-W2864 HydrophobicContact CD2-CE3 3.98Å; L2861-W2864 HydrophobicContact CD2-CZ3 4.25Å; L2861-W2864 PolarHBondContact O-N 2.94Å; L2861-T2865 WeakPolarHBondContact O-CB 3.43Å; L2861-T2865 VanDerWaalsContact O-CG2 3.22Å; L2861-T2865 WeakPolarHBondContact O-CG2 3.41Å; L2861-T2865 PolarHBondContact O-N 3.39Å; L2861-T2865 VanDerWaalsContact O-N 3.08Å; L2861-T2865 PolarHBondContact O-OG1 2.91Å; L2861-I2884 HydrophobicContact CD1-CD1 4.24Å; L2861-I2884 HydrophobicContact CD1-CG2 4.3Å; L2861-I2884 HydrophobicContact CD2-CG2 4.24Å; L2861-I2884 HydrophobicContact CG-CG2 4.07Å; L2861-M2956 HydrophobicContact CD1-CB 3.55Å; L2861-F2994 HydrophobicContact CD1-CD2 4.44Å; L2861-F2994 HydrophobicContact CD2-CD2 3.57Å; L2861-F2994 HydrophobicContact CD2-CE2 3.47Å; L2861-F2994 VanDerWaalsContact CD2-CE2 3.41Å; L2861-F2994 HydrophobicContact CD2-CZ 4.46Å
2862	M	93.6	Very high	96.7	Very high	39.5 Å²	39.5	18.1 Å²	18.1	20%	0.195	9%	0.093	C	C	.	.	H	α-helix	trans	-60	-19.3	175.9	-176.2	-173.7	61.2	0	0	113	K2825 I2828 P2860 T2865 F2866 W2918	K2825-M2862 HydrophobicContact CB-CE 4.37Å; K2825-M2862 HydrophobicContact CD-CE 3.98Å; K2825-M2862 HydrophobicContact CD-SD 3.68Å; K2825-M2862 WeakPolarHBondContact CE-SD 3.25Å; K2825-M2862 HydrophobicContact CG-CE 3.76Å; K2825-M2862 VanDerWaalsContact CG-CE 3.45Å; K2825-M2862 HydrophobicContact CG-SD 3.93Å; I2828-M2862 HydrophobicContact CD1-CG 3.6Å; I2828-M2862 HydrophobicContact CD1-SD 4.22Å; P2860-M2862 VanDerWaalsContact C-N 3.29Å; P2860-M2862 PolarHBondContact O-N 3.04Å; M2862-T2865 PolarHBondContact O-OG1 3.27Å; M2862-F2866 VanDerWaalsContact O-CD2 3.28Å; M2862-F2866 WeakPolarHBondContact O-CD2 3.46Å; M2862-F2866 WeakPolarHBondContact O-CE2 3.22Å; M2862-W2918 HydrophobicContact CG-CZ2 4.06Å; M2862-W2918 HydrophobicContact SD-CZ2 4.44Å
2863	F	97.2	Very high	96.9	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-104.5	-39.3	177.6	-60.3	-69.8	0	0	0	112.3	E2821 A2824 K2825 I2828 T2846 F2858 N2859 P2860 L2861 T2865 F2866 G2867 I2868 V2871	E2821-F2863 HydrophobicContact CB-CE2 4.31Å; E2821-F2863 HydrophobicContact CB-CZ 4.14Å; A2824-F2863 HydrophobicContact CB-CD1 4.02Å; A2824-F2863 HydrophobicContact CB-CE1 3.43Å; A2824-F2863 HydrophobicContact CB-CZ 3.71Å; K2825-F2863 HydrophobicContact CG-CZ 4.18Å; I2828-F2863 HydrophobicContact CD1-CD1 4.11Å; I2828-F2863 HydrophobicContact CD1-CE1 4.13Å; I2828-F2863 HydrophobicContact CG2-CD1 4.47Å; T2846-F2863 HydrophobicContact CG2-CB 4.2Å; T2846-F2863 HydrophobicContact CG2-CD1 3.83Å; T2846-F2863 HydrophobicContact CG2-CD2 4.11Å; T2846-F2863 HydrophobicContact CG2-CE1 4.35Å; T2846-F2863 HydrophobicContact CG2-CE2 4.19Å; T2846-F2863 HydrophobicContact CG2-CG 3.91Å; F2858-F2863 AromaticContact CD2-CD2 3.79Å; F2858-F2863 HydrophobicContact CD2-CD2 3.79Å; F2858-F2863 AromaticContact CD2-CE2 3.33Å; F2858-F2863 HydrophobicContact CD2-CE2 3.33Å; F2858-F2863 VanDerWaalsContact CD2-CE2 3.48Å; F2858-F2863 AromaticContact CD2-CZ 3.97Å; F2858-F2863 HydrophobicContact CD2-CZ 3.97Å; F2858-F2863 AromaticContact CE2-CD2 3.54Å; F2858-F2863 HydrophobicContact CE2-CD2 3.54Å; F2858-F2863 AromaticContact CE2-CE2 3.44Å; F2858-F2863 HydrophobicContact CE2-CE2 3.44Å; F2858-F2863 HydrophobicContact CE2-CG 4.4Å; F2858-F2863 HydrophobicContact CE2-CZ 4.03Å; F2858-F2863 HydrophobicContact CG-CE2 4.22Å; F2858-F2863 HydrophobicContact CZ-CD2 4.42Å; F2858-F2863 HydrophobicContact CZ-CE2 4.39Å; N2859-F2863 WeakPolarHBondContact O-CD2 3.39Å; N2859-F2863 WeakPolarHBondContact O-CE2 3.49Å; P2860-F2863 PolarHBondContact O-N 2.86Å; L2861-F2863 PolarHBondContact O-N 3.09Å; L2861-F2863 VanDerWaalsContact O-N 3.11Å; F2863-T2865 VanDerWaalsContact C-N 3.29Å; F2863-T2865 PolarHBondContact O-N 2.99Å; F2863-F2866 PolarHBondContact O-N 3.05Å; F2863-G2867 PolarHBondContact O-N 3.12Å; F2863-I2868 HydrophobicContact CB-CB 4.19Å; F2863-I2868 HydrophobicContact CB-CD1 4.04Å; F2863-I2868 HydrophobicContact CB-CG1 4.41Å; F2863-I2868 HydrophobicContact CD1-CD1 3.88Å; F2863-I2868 HydrophobicContact CG-CD1 4.39Å; F2863-I2868 WeakPolarHBondContact O-CB 3.42Å; F2863-I2868 WeakPolarHBondContact O-CG1 3.29Å; F2863-I2868 PolarHBondContact O-N 2.96Å; F2863-V2871 HydrophobicContact CB-CG2 3.77Å
2864	W	97.7	Very high	97	Very high	1.5 Å²	1.5	12.2 Å²	12.2	1%	0.006	7%	0.066	C	C	.	.	H	α-helix	trans	-63.6	-33.7	175.5	-67.4	-27.4	0	0	0	113	F2460 P2860 L2861 F2866 G2867 V2871 I2884 N2885 M2888 F2889 M2904 L2992	F2460-W2864 HydrophobicContact CD1-CB 4.09Å; F2460-W2864 AromaticContact CD1-CD1 3.33Å; F2460-W2864 AromaticContact CD1-CG 3.83Å; F2460-W2864 HydrophobicContact CD1-CG 3.83Å; F2460-W2864 HydrophobicContact CE1-CB 3.58Å; F2460-W2864 AromaticContact CE1-CD1 3.7Å; F2460-W2864 AromaticContact CE1-CG 3.86Å; F2460-W2864 HydrophobicContact CE1-CG 3.86Å; F2460-W2864 VanDerWaalsContact CE1-O 3.3Å; F2460-W2864 WeakPolarHBondContact CE1-O 3.36Å; F2460-W2864 HydrophobicContact CE2-CB 4.45Å; F2460-W2864 AromaticContact CG-CD1 3.98Å; F2460-W2864 HydrophobicContact CG-CG 4.33Å; F2460-W2864 HydrophobicContact CZ-CB 3.78Å; F2460-W2864 HydrophobicContact CZ-CG 4.33Å; F2460-W2864 WeakPolarHBondContact CZ-O 3.34Å; P2860-W2864 HydrophobicContact CB-CD2 4.15Å; P2860-W2864 HydrophobicContact CB-CE3 4.19Å; P2860-W2864 HydrophobicContact CB-CH2 3.66Å; P2860-W2864 HydrophobicContact CB-CZ2 3.66Å; P2860-W2864 HydrophobicContact CB-CZ3 3.96Å; P2860-W2864 HydrophobicContact CG-CE3 4.39Å; P2860-W2864 HydrophobicContact CG-CH2 3.62Å; P2860-W2864 HydrophobicContact CG-CZ2 4.14Å; P2860-W2864 HydrophobicContact CG-CZ3 3.79Å; P2860-W2864 PolarHBondContact O-N 3.37Å; L2861-W2864 HydrophobicContact CD2-CE3 3.98Å; L2861-W2864 HydrophobicContact CD2-CZ3 4.25Å; L2861-W2864 PolarHBondContact O-N 2.94Å; W2864-F2866 PolarHBondContact O-N 3.09Å; W2864-G2867 WeakPolarHBondContact O-CA 3.43Å; W2864-G2867 PolarHBondContact O-N 3.27Å; W2864-V2871 VanDerWaalsContact CD1-CG2 3.43Å; W2864-V2871 HydrophobicContact CG-CG2 4.41Å; W2864-V2871 VanDerWaalsContact NE1-CG2 3.31Å; W2864-I2884 HydrophobicContact CH2-CG2 4.37Å; W2864-I2884 HydrophobicContact CZ3-CG2 3.86Å; W2864-N2885 HydrophobicContact CH2-CB 4.48Å; W2864-M2888 HydrophobicContact CE3-CG 4.26Å; W2864-M2888 HydrophobicContact CH2-CB 3.71Å; W2864-M2888 HydrophobicContact CH2-CG 3.81Å; W2864-M2888 HydrophobicContact CZ2-CG 4.25Å; W2864-M2888 HydrophobicContact CZ3-CB 3.77Å; W2864-M2888 HydrophobicContact CZ3-CG 3.79Å; W2864-F2889 HydrophobicContact CZ2-CE2 4.1Å; W2864-F2889 HydrophobicContact CZ2-CZ 4.44Å; W2864-M2904 WeakPolarHBondContact O-CE 3.27Å; W2864-L2992 HydrophobicContact CB-CD1 3.98Å
2865	T	94.6	Very high	97.1	Very high	4 Å²	4	8.2 Å²	8.2	3%	0.025	4%	0.044	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-22.4	176.4	46.4	0	0	0	0	113.5	L2861 M2862 F2863 M2904 P2917 I2958 L2992	L2861-T2865 WeakPolarHBondContact O-CB 3.43Å; L2861-T2865 VanDerWaalsContact O-CG2 3.22Å; L2861-T2865 WeakPolarHBondContact O-CG2 3.41Å; L2861-T2865 PolarHBondContact O-N 3.39Å; L2861-T2865 VanDerWaalsContact O-N 3.08Å; L2861-T2865 PolarHBondContact O-OG1 2.91Å; M2862-T2865 PolarHBondContact O-OG1 3.27Å; F2863-T2865 VanDerWaalsContact C-N 3.29Å; F2863-T2865 PolarHBondContact O-N 2.99Å; T2865-M2904 VanDerWaalsContact O-CE 3.27Å; T2865-M2904 WeakPolarHBondContact O-CE 3.21Å; T2865-P2917 WeakPolarHBondContact O-CG 3.39Å; T2865-I2958 HydrophobicContact CG2-CG2 3.62Å; T2865-L2992 HydrophobicContact CG2-CD1 4.05Å
2866	F	95.5	Very high	97	Very high	0 Å²	0	9.1 Å²	9.1	0%	0	5%	0.048	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.1	13.6	171.9	-61	-91.4	0	0	0	113.1	I2828 P2832 L2835 V2836 T2839 M2862 F2863 W2864 I2868 P2917 W2918	I2828-F2866 HydrophobicContact CB-CD1 4.4Å; I2828-F2866 HydrophobicContact CB-CD2 4.03Å; I2828-F2866 HydrophobicContact CB-CE1 4.39Å; I2828-F2866 HydrophobicContact CB-CE2 4.02Å; I2828-F2866 HydrophobicContact CB-CG 4.24Å; I2828-F2866 HydrophobicContact CB-CZ 4.21Å; I2828-F2866 HydrophobicContact CD1-CD2 4.44Å; I2828-F2866 HydrophobicContact CD1-CE2 4.1Å; I2828-F2866 HydrophobicContact CG1-CD2 4.32Å; I2828-F2866 HydrophobicContact CG1-CG 4.34Å; I2828-F2866 HydrophobicContact CG2-CB 3.97Å; I2828-F2866 HydrophobicContact CG2-CD1 4.03Å; I2828-F2866 HydrophobicContact CG2-CD2 3.49Å; I2828-F2866 VanDerWaalsContact CG2-CD2 3.47Å; I2828-F2866 HydrophobicContact CG2-CE1 3.73Å; I2828-F2866 HydrophobicContact CG2-CE2 3.64Å; I2828-F2866 HydrophobicContact CG2-CG 3.69Å; I2828-F2866 HydrophobicContact CG2-CZ 3.43Å; I2828-F2866 VanDerWaalsContact CG2-CZ 3.43Å; P2832-F2866 HydrophobicContact CB-CD1 4.16Å; P2832-F2866 HydrophobicContact CB-CE1 3.6Å; L2835-F2866 HydrophobicContact CD2-CB 3.93Å; L2835-F2866 HydrophobicContact CD2-CG 4.41Å; L2835-F2866 HydrophobicContact CG-CB 4.28Å; V2836-F2866 HydrophobicContact CG2-CB 4.36Å; V2836-F2866 HydrophobicContact CG2-CD1 4.24Å; T2839-F2866 PolarHBondContact OG1-O 3.15Å; M2862-F2866 VanDerWaalsContact O-CD2 3.28Å; M2862-F2866 WeakPolarHBondContact O-CD2 3.46Å; M2862-F2866 WeakPolarHBondContact O-CE2 3.22Å; F2863-F2866 PolarHBondContact O-N 3.05Å; W2864-F2866 PolarHBondContact O-N 3.09Å; F2866-I2868 PolarHBondContact O-N 2.82Å; F2866-P2917 HydrophobicContact CD1-CG 4.04Å; F2866-P2917 HydrophobicContact CD2-CG 4.29Å; F2866-P2917 HydrophobicContact CE1-CB 4.22Å; F2866-P2917 HydrophobicContact CE1-CG 3.73Å; F2866-P2917 HydrophobicContact CE2-CB 4.02Å; F2866-P2917 HydrophobicContact CE2-CG 4.01Å; F2866-P2917 HydrophobicContact CG-CG 4.31Å; F2866-P2917 HydrophobicContact CZ-CB 3.74Å; F2866-P2917 HydrophobicContact CZ-CG 3.72Å; F2866-W2918 HydrophobicContact CE1-CE3 4.04Å; F2866-W2918 HydrophobicContact CE1-CH2 4.48Å; F2866-W2918 AromaticContact CE1-CZ3 3.98Å; F2866-W2918 HydrophobicContact CE1-CZ3 3.98Å; F2866-W2918 HydrophobicContact CE2-CD2 4.27Å; F2866-W2918 HydrophobicContact CE2-CH2 4.2Å; F2866-W2918 HydrophobicContact CE2-CZ2 4.2Å; F2866-W2918 HydrophobicContact CE2-CZ3 4.44Å; F2866-W2918 AromaticContact CZ-CD2 3.73Å; F2866-W2918 HydrophobicContact CZ-CD2 3.73Å; F2866-W2918 AromaticContact CZ-CE2 3.82Å; F2866-W2918 AromaticContact CZ-CE3 3.54Å; F2866-W2918 HydrophobicContact CZ-CE3 3.8Å; F2866-W2918 HydrophobicContact CZ-CG 4.06Å; F2866-W2918 AromaticContact CZ-CH2 3.74Å; F2866-W2918 HydrophobicContact CZ-CH2 3.74Å; F2866-W2918 AromaticContact CZ-CZ2 3.87Å; F2866-W2918 HydrophobicContact CZ-CZ2 3.87Å; F2866-W2918 AromaticContact CZ-CZ3 3.55Å; F2866-W2918 HydrophobicContact CZ-CZ3 3.55Å
2867	G	96.3	Very high	96.9	Very high	0 Å²	0	9.6 Å²	9.6	0%	0	5%	0.05	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.7	8.2	173.5	0	0	0	0	0	116.2	T2839 F2863 W2864 Q2869 K2900	T2839-G2867 WeakPolarHBondContact CB-O 3.33Å; T2839-G2867 WeakPolarHBondContact OG1-CA 3.34Å; T2839-G2867 PolarHBondContact OG1-O 2.83Å; F2863-G2867 PolarHBondContact O-N 3.12Å; W2864-G2867 WeakPolarHBondContact O-CA 3.43Å; W2864-G2867 PolarHBondContact O-N 3.27Å; G2867-Q2869 PolarHBondContact O-N 2.83Å; G2867-K2900 WeakPolarHBondContact O-CD 3.32Å; G2867-K2900 PolarHBondContact O-NZ 3.47Å
2868	I	98.2	Very high	96.7	Very high	1 Å²	1	12.4 Å²	12.4	1%	0.005	6%	0.063	C	C	.	.			trans	-63.8	120.9	178.7	-56.9	-175	0	0	0	109.6	F2460 I2828 L2835 T2839 L2844 T2846 F2863 F2866 V2871	F2460-I2868 WeakPolarHBondContact CD1-O 3.4Å; I2828-I2868 HydrophobicContact CD1-CD1 4.33Å; L2835-I2868 HydrophobicContact CD2-CD1 4.32Å; T2839-I2868 HydrophobicContact CG2-CG1 4.35Å; L2844-I2868 HydrophobicContact CB-CG2 4.23Å; L2844-I2868 HydrophobicContact CD2-CD1 3.87Å; L2844-I2868 HydrophobicContact CD2-CG1 3.96Å; L2844-I2868 HydrophobicContact CD2-CG2 4.33Å; L2844-I2868 HydrophobicContact CG-CG2 4.27Å; L2844-I2868 WeakPolarHBondContact O-CG2 3.46Å; T2846-I2868 HydrophobicContact CG2-CG2 4.12Å; F2863-I2868 HydrophobicContact CB-CB 4.19Å; F2863-I2868 HydrophobicContact CB-CD1 4.04Å; F2863-I2868 HydrophobicContact CB-CG1 4.41Å; F2863-I2868 HydrophobicContact CD1-CD1 3.88Å; F2863-I2868 HydrophobicContact CG-CD1 4.39Å; F2863-I2868 WeakPolarHBondContact O-CB 3.42Å; F2863-I2868 WeakPolarHBondContact O-CG1 3.29Å; F2863-I2868 PolarHBondContact O-N 2.96Å; F2866-I2868 PolarHBondContact O-N 2.82Å; I2868-V2871 HydrophobicContact CG2-CG2 4.27Å
2869	Q	98.6	Very high	96.6	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	7%	0.07	C	C	.	.			trans	-80.3	-48.2	-168.1	-60.8	88.5	-12.8	0	0	113.1	S2457 Y2459 I2461 T2839 H2842 I2843 G2867 V2871	S2457-Q2869 WeakPolarHBondContact O-CG 3.37Å; S2457-Q2869 PolarHBondContact O-NE2 3.16Å; Y2459-Q2869 WeakPolarHBondContact O-CB 3.32Å; Y2459-Q2869 WeakPolarHBondContact O-CG 3.34Å; I2461-Q2869 HydrophobicContact CD1-CB 4.4Å; I2461-Q2869 HydrophobicContact CG1-CB 4.34Å; I2461-Q2869 PolarHBondContact N-O 2.93Å; T2839-Q2869 PolarHBondContact O-NE2 3.09Å; H2842-Q2869 PolarHBondContact O-NE2 3.1Å; I2843-Q2869 HydrophobicContact CG2-CB 4.31Å; G2867-Q2869 PolarHBondContact O-N 2.83Å; Q2869-V2871 PolarHBondContact O-N 3.12Å
2870	M	98.5	Very high	96.6	Very high	0 Å²	0	13 Å²	13	0%	0	7%	0.066	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	79.6	-170.9	-65.5	173.7	70.4	0	0	109.8	I2461 C2493 I2540 L2816 I2843 L2844 R2845 T2846 A2872	I2461-M2870 HydrophobicContact CB-CG 4.13Å; I2461-M2870 HydrophobicContact CD1-CG 4.12Å; C2493-M2870 HydrophobicContact CB-CE 3.68Å; C2493-M2870 WeakPolarHBondContact SG-CE 3.42Å; I2540-M2870 HydrophobicContact CD1-CE 4.25Å; I2540-M2870 HydrophobicContact CD1-SD 4.33Å; I2540-M2870 HydrophobicContact CG2-CE 4.25Å; L2816-M2870 HydrophobicContact CD1-SD 3.97Å; L2816-M2870 HydrophobicContact CD2-SD 4.48Å; I2843-M2870 HydrophobicContact CG2-CG 3.9Å; I2843-M2870 HydrophobicContact CG2-SD 3.42Å; I2843-M2870 WeakPolarHBondContact CG2-SD 3.44Å; L2844-M2870 PolarHBondContact O-N 3.26Å; L2844-M2870 VanDerWaalsContact O-N 3.13Å; R2845-M2870 VanDerWaalsContact CA-O 3.31Å; R2845-M2870 WeakPolarHBondContact CA-O 3.41Å; R2845-M2870 HydrophobicContact CB-CB 3.91Å; R2845-M2870 HydrophobicContact CB-SD 4.5Å; R2845-M2870 HydrophobicContact CG-CB 3.94Å; R2845-M2870 WeakPolarHBondContact CG-O 3.19Å; T2846-M2870 PolarHBondContact N-O 3.24Å; M2870-A2872 PolarHBondContact O-N 3.11Å
2871	V	98.6	Very high	96.7	Very high	1.5 Å²	1.5	13.9 Å²	13.9	1%	0.009	7%	0.072	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	98.1	173	-178	0	0	0	0	108.1	T2846 F2858 P2860 F2863 W2864 I2868 Q2869 L2873	T2846-V2871 HydrophobicContact CG2-CB 4.18Å; T2846-V2871 HydrophobicContact CG2-CG1 4.03Å; T2846-V2871 HydrophobicContact CG2-CG2 3.9Å; F2858-V2871 HydrophobicContact CE2-CG1 3.47Å; F2858-V2871 VanDerWaalsContact CE2-CG1 3.47Å; F2858-V2871 HydrophobicContact CZ-CG1 3.74Å; P2860-V2871 HydrophobicContact CB-CB 4.48Å; P2860-V2871 HydrophobicContact CB-CG1 3.72Å; F2863-V2871 HydrophobicContact CB-CG2 3.77Å; W2864-V2871 VanDerWaalsContact CD1-CG2 3.43Å; W2864-V2871 HydrophobicContact CG-CG2 4.41Å; W2864-V2871 VanDerWaalsContact NE1-CG2 3.31Å; I2868-V2871 HydrophobicContact CG2-CG2 4.27Å; Q2869-V2871 PolarHBondContact O-N 3.12Å; V2871-L2873 HydrophobicContact CG1-CD2 4.34Å
2872	A	98.6	Very high	96.8	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	7%	0.073	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	127.9	-174.4	0	0	0	0	0	111.5	S2463 H2465 T2846 P2848 M2870	S2463-A2872 WeakPolarHBondContact O-CA 3.3Å; H2465-A2872 HydrophobicContact CB-CB 4.08Å; T2846-A2872 WeakPolarHBondContact O-CB 3.26Å; T2846-A2872 PolarHBondContact O-N 3.19Å; P2848-A2872 WeakPolarHBondContact CD-O 3.36Å; M2870-A2872 PolarHBondContact O-N 3.11Å
2873	L	98.5	Very high	96.9	Very high	0 Å²	0	12.3 Å²	12.3	0%	0	6%	0.064	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	158.1	-178.3	-60.9	-175.7	0	0	0	112.3	S2463 S2464 H2465 N2857 F2858 V2871 Y2875 M2882 N2885	S2463-L2873 PolarHBondContact O-N 2.95Å; S2463-L2873 VanDerWaalsContact O-N 3.09Å; S2464-L2873 CarbonylContact C-O 3.53Å; S2464-L2873 WeakPolarHBondContact CA-O 3.42Å; H2465-L2873 PolarHBondContact N-O 3.21Å; N2857-L2873 HydrophobicContact CB-CD2 4.16Å; N2857-L2873 WeakPolarHBondContact OD1-CA 3.37Å; N2857-L2873 WeakPolarHBondContact OD1-CB 3.42Å; F2858-L2873 HydrophobicContact CD1-CD2 4.45Å; F2858-L2873 HydrophobicContact CD2-CD2 4.49Å; F2858-L2873 HydrophobicContact CE1-CD2 4.06Å; F2858-L2873 HydrophobicContact CE2-CD2 4.04Å; F2858-L2873 HydrophobicContact CZ-CD2 3.8Å; V2871-L2873 HydrophobicContact CG1-CD2 4.34Å; L2873-Y2875 HydrophobicContact CB-CD2 4.5Å; L2873-Y2875 HydrophobicContact CB-CE2 4.47Å; L2873-Y2875 WeakPolarHBondContact O-CD2 3.34Å; L2873-Y2875 PolarHBondContact O-N 3.22Å; L2873-M2882 HydrophobicContact CB-CE 3.57Å; L2873-M2882 HydrophobicContact CD1-CE 3.99Å; L2873-M2882 HydrophobicContact CG-CE 4.46Å; L2873-N2885 HydrophobicContact CD1-CB 3.71Å
2874	N	98	Very high	97	Very high	0 Å²	0	12.4 Å²	12.4	0%	0	7%	0.065	C	C	.	.			trans	-78	95.8	170.8	-70.2	-47.7	0	0	0	109.8	H2465 Q2473 S2855 S2856 N2857 Q2876 T2877 M2882	H2465-N2874 PolarHBondContact CD2-OD1 3.21Å; Q2473-N2874 PolarHBondContact NE2-OD1 2.72Å; Q2473-N2874 VanDerWaalsContact NE2-OD1 3.11Å; S2855-N2874 WeakPolarHBondContact CA-ND2 3.35Å; S2855-N2874 VanDerWaalsContact O-CB 3.27Å; S2855-N2874 WeakPolarHBondContact O-CB 3.36Å; S2855-N2874 PolarHBondContact O-ND2 3.07Å; S2855-N2874 VanDerWaalsContact O-ND2 3.13Å; S2856-N2874 PolarHBondContact O-ND2 3.14Å; S2856-N2874 VanDerWaalsContact O-ND2 3.13Å; N2857-N2874 PolarHBondContact ND2-O 3.18Å; N2857-N2874 WeakPolarHBondContact OD1-CB 3.34Å; N2857-N2874 PolarHBondContact OD1-N 3.25Å; N2874-Q2876 VanDerWaalsContact C-N 3.25Å; N2874-Q2876 PolarHBondContact O-N 2.78Å; N2874-T2877 PolarHBondContact O-N 3.09Å; N2874-T2877 VanDerWaalsContact O-N 3.09Å; N2874-M2882 WeakPolarHBondContact O-CE 3.4Å
2875	Y	97.3	Very high	97	Very high	10.5 Å²	10.5	12.6 Å²	12.6	4%	0.041	7%	0.066	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-20.9	-176.4	-88.2	-122.5	0	0	0	113.9	L2048 S2463 I2486 T2489 C2491 L2873 T2877 Q2878 M2882 N2885	L2048-Y2875 WeakPolarHBondContact CD2-O 3.29Å; S2463-Y2875 WeakPolarHBondContact O-CE2 3.48Å; I2486-Y2875 HydrophobicContact CD1-CG 4.26Å; I2486-Y2875 HydrophobicContact CG1-CD1 4.05Å; I2486-Y2875 HydrophobicContact CG1-CG 4.17Å; I2486-Y2875 HydrophobicContact CG2-CD1 4.02Å; I2486-Y2875 HydrophobicContact CG2-CE1 4.29Å; I2486-Y2875 HydrophobicContact CG2-CG 4.33Å; T2489-Y2875 WeakPolarHBondContact OG1-CE1 3.34Å; C2491-Y2875 HydrophobicContact CB-CE1 3.95Å; L2873-Y2875 HydrophobicContact CB-CD2 4.5Å; L2873-Y2875 HydrophobicContact CB-CE2 4.47Å; L2873-Y2875 WeakPolarHBondContact O-CD2 3.34Å; L2873-Y2875 PolarHBondContact O-N 3.22Å; Y2875-T2877 PolarHBondContact O-N 2.92Å; Y2875-Q2878 PolarHBondContact O-NE2 3Å; Y2875-M2882 HydrophobicContact CD1-SD 4.35Å; Y2875-M2882 HydrophobicContact CD2-CE 3.81Å; Y2875-M2882 HydrophobicContact CD2-SD 4.21Å; Y2875-M2882 HydrophobicContact CE1-SD 4.49Å; Y2875-M2882 HydrophobicContact CE2-CE 4.2Å; Y2875-M2882 HydrophobicContact CE2-SD 4.35Å; Y2875-M2882 HydrophobicContact CG-CE 4.17Å; Y2875-M2882 HydrophobicContact CG-SD 4.21Å; Y2875-N2885 VanDerWaalsContact CZ-ND2 3.34Å; Y2875-N2885 PolarHBondContact OH-ND2 2.99Å; Y2875-N2885 VanDerWaalsContact OH-ND2 3.08Å
2876	Q	94.4	Very high	97.1	Very high	20.5 Å²	20.5	13.6 Å²	13.6	10%	0.096	7%	0.074	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-25.9	171	68.5	-82.2	33.5	0	0	112.5	T2049 G2471 S2855 N2874	T2049-Q2876 HydrophobicContact CG2-CB 3.57Å; G2471-Q2876 PolarHBondContact O-NE2 3.14Å; S2855-Q2876 PolarHBondContact OG-NE2 3.23Å; N2874-Q2876 VanDerWaalsContact C-N 3.25Å; N2874-Q2876 PolarHBondContact O-N 2.78Å
2877	T	95.5	Very high	97.1	Very high	33.5 Å²	33.5	13.6 Å²	13.6	21%	0.206	7%	0.074	C	C	.	.			trans	-96.8	111.3	-177.2	-50.9	0	0	0	0	110.4	S2855 N2857 N2874 Y2875 D2879 M2882	S2855-T2877 VanDerWaalsContact O-CB 3.29Å; S2855-T2877 WeakPolarHBondContact O-CB 3.35Å; S2855-T2877 PolarHBondContact O-OG1 3.31Å; N2857-T2877 PolarHBondContact ND2-O 3.3Å; N2874-T2877 PolarHBondContact O-N 3.09Å; N2874-T2877 VanDerWaalsContact O-N 3.09Å; Y2875-T2877 PolarHBondContact O-N 2.92Å; T2877-D2879 HydrophobicContact CG2-CB 4.26Å; T2877-D2879 VanDerWaalsContact CG2-OD2 3.29Å; T2877-D2879 WeakPolarHBondContact CG2-OD2 3.44Å; T2877-D2879 PolarHBondContact O-N 2.89Å; T2877-M2882 WeakPolarHBondContact O-CB 3.4Å
2878	Q	93.5	Very high	97.1	Very high	69 Å²	69	13.8 Å²	13.8	32%	0.322	8%	0.075	S	C	.	.			trans	-93.5	73.4	-178.2	-65.9	-62.3	-48.8	0	0	111.2	Y2875 N3031	Y2875-Q2878 PolarHBondContact O-NE2 3Å; Q2878-N3031 HydrophobicContact CB-CB 3.85Å
2879	D	95.1	Very high	97.1	Very high	35 Å²	35	14.3 Å²	14.3	19%	0.187	8%	0.078	C	C	.	.	S	Bend	trans	-106.8	-173.7	-179.1	56.5	27.3	0	0	0	113	N2857 T2877 P2881 M2882 A2883	N2857-D2879 VanDerWaalsContact CB-OD2 3.3Å; N2857-D2879 WeakPolarHBondContact CB-OD2 3.5Å; N2857-D2879 PolarHBondContact N-OD2 2.98Å; N2857-D2879 PolarHBondContact ND2-OD1 3.14Å; N2857-D2879 PolarHBondContact ND2-OD2 3.17Å; T2877-D2879 HydrophobicContact CG2-CB 4.26Å; T2877-D2879 VanDerWaalsContact CG2-OD2 3.29Å; T2877-D2879 WeakPolarHBondContact CG2-OD2 3.44Å; T2877-D2879 PolarHBondContact O-N 2.89Å; D2879-P2881 WeakPolarHBondContact OD1-CB 3.36Å; D2879-P2881 VanDerWaalsContact OD1-CD 3.31Å; D2879-P2881 WeakPolarHBondContact OD1-CD 3.42Å; D2879-M2882 PolarHBondContact O-N 3.13Å; D2879-M2882 WeakPolarHBondContact OD1-CB 3.4Å; D2879-M2882 PolarHBondContact OD1-N 3.15Å; D2879-A2883 PolarHBondContact O-N 2.9Å
2880	I	96.8	Very high	96.9	Very high	56 Å²	56	14.9 Å²	14.9	29%	0.287	8%	0.08	S	C	.	.	H	α-helix	trans	-63.5	-47.9	178.9	-61.7	171.1	0	0	0	111.5	M2882 A2883 I2884 M2956	I2880-M2882 VanDerWaalsContact C-N 3.28Å; I2880-M2882 PolarHBondContact O-N 2.89Å; I2880-A2883 WeakPolarHBondContact O-CA 3.32Å; I2880-A2883 WeakPolarHBondContact O-CB 3.34Å; I2880-A2883 PolarHBondContact O-N 2.93Å; I2880-I2884 HydrophobicContact CG2-CD1 4.1Å; I2880-I2884 HydrophobicContact CG2-CG1 4.45Å; I2880-I2884 WeakPolarHBondContact O-CG1 3.37Å; I2880-I2884 PolarHBondContact O-N 3.15Å; I2880-M2956 HydrophobicContact CG2-SD 4.37Å
2881	P	97.9	Very high	96.6	Very high	19 Å²	19	16.7 Å²	16.7	12%	0.123	9%	0.089	C	C	.	.	H	α-helix	trans	-49.9	-43.2	169.8	-32	37	0	0	0	114.6	N2857 F2858 D2879 A2883 I2884 N2885	N2857-P2881 HydrophobicContact CB-CB 3.56Å; N2857-P2881 HydrophobicContact CB-CG 3.9Å; F2858-P2881 VanDerWaalsContact O-CB 3.32Å; F2858-P2881 WeakPolarHBondContact O-CB 3.34Å; F2858-P2881 WeakPolarHBondContact O-CG 3.2Å; D2879-P2881 WeakPolarHBondContact OD1-CB 3.36Å; D2879-P2881 VanDerWaalsContact OD1-CD 3.31Å; D2879-P2881 WeakPolarHBondContact OD1-CD 3.42Å; P2881-A2883 VanDerWaalsContact C-N 3.35Å; P2881-A2883 PolarHBondContact O-N 3.36Å; P2881-I2884 WeakPolarHBondContact O-CB 3.42Å; P2881-I2884 PolarHBondContact O-N 3.05Å; P2881-N2885 WeakPolarHBondContact O-CB 3.35Å; P2881-N2885 PolarHBondContact O-N 3.18Å
2882	M	97.3	Very high	96.3	Very high	6 Å²	6	17.3 Å²	17.3	3%	0.03	9%	0.092	C	C	.	.	H	α-helix	trans	-67.5	-34.7	177.2	-168.5	53	53.1	0	0	112.5	L2873 N2874 Y2875 T2877 D2879 I2880 N2885 A2886	L2873-M2882 HydrophobicContact CB-CE 3.57Å; L2873-M2882 HydrophobicContact CD1-CE 3.99Å; L2873-M2882 HydrophobicContact CG-CE 4.46Å; N2874-M2882 WeakPolarHBondContact O-CE 3.4Å; Y2875-M2882 HydrophobicContact CD1-SD 4.35Å; Y2875-M2882 HydrophobicContact CD2-CE 3.81Å; Y2875-M2882 HydrophobicContact CD2-SD 4.21Å; Y2875-M2882 HydrophobicContact CE1-SD 4.49Å; Y2875-M2882 HydrophobicContact CE2-CE 4.2Å; Y2875-M2882 HydrophobicContact CE2-SD 4.35Å; Y2875-M2882 HydrophobicContact CG-CE 4.17Å; Y2875-M2882 HydrophobicContact CG-SD 4.21Å; T2877-M2882 WeakPolarHBondContact O-CB 3.4Å; D2879-M2882 PolarHBondContact O-N 3.13Å; D2879-M2882 WeakPolarHBondContact OD1-CB 3.4Å; D2879-M2882 PolarHBondContact OD1-N 3.15Å; I2880-M2882 VanDerWaalsContact C-N 3.28Å; I2880-M2882 PolarHBondContact O-N 2.89Å; M2882-N2885 PolarHBondContact O-N 3.09Å; M2882-N2885 HydrophobicContact SD-CB 4.39Å; M2882-A2886 PolarHBondContact O-N 3.05Å
2883	A	97.2	Very high	96	Very high	1 Å²	1	18.4 Å²	18.4	1%	0.008	10%	0.104	C	C	.	.	H	α-helix	trans	-68	-36.3	172.8	0	0	0	0	0	112.8	D2879 I2880 P2881 A2887 V3012 N3032	D2879-A2883 PolarHBondContact O-N 2.9Å; I2880-A2883 WeakPolarHBondContact O-CA 3.32Å; I2880-A2883 WeakPolarHBondContact O-CB 3.34Å; I2880-A2883 PolarHBondContact O-N 2.93Å; P2881-A2883 VanDerWaalsContact C-N 3.35Å; P2881-A2883 PolarHBondContact O-N 3.36Å; A2883-A2887 WeakPolarHBondContact O-CB 3.33Å; A2883-A2887 PolarHBondContact O-N 2.98Å; A2883-V3012 HydrophobicContact CB-CG2 3.88Å; A2883-N3032 HydrophobicContact CB-CB 4.47Å
2884	I	97.9	Very high	95.7	Very high	2 Å²	2	21.1 Å²	21.1	1%	0.01	12%	0.118	C	C	.	.	H	α-helix	trans	-64.5	-45.1	171.1	-63.6	166.1	0	0	0	110.3	P2860 L2861 W2864 I2880 P2881 A2886 A2887 M2888 M2956 V3012	P2860-I2884 HydrophobicContact CG-CB 4.3Å; P2860-I2884 HydrophobicContact CG-CG2 3.89Å; L2861-I2884 HydrophobicContact CD1-CD1 4.24Å; L2861-I2884 HydrophobicContact CD1-CG2 4.3Å; L2861-I2884 HydrophobicContact CD2-CG2 4.24Å; L2861-I2884 HydrophobicContact CG-CG2 4.07Å; W2864-I2884 HydrophobicContact CH2-CG2 4.37Å; W2864-I2884 HydrophobicContact CZ3-CG2 3.86Å; I2880-I2884 HydrophobicContact CG2-CD1 4.1Å; I2880-I2884 HydrophobicContact CG2-CG1 4.45Å; I2880-I2884 WeakPolarHBondContact O-CG1 3.37Å; I2880-I2884 PolarHBondContact O-N 3.15Å; P2881-I2884 WeakPolarHBondContact O-CB 3.42Å; P2881-I2884 PolarHBondContact O-N 3.05Å; I2884-A2886 PolarHBondContact O-N 3.4Å; I2884-A2887 PolarHBondContact O-N 3.04Å; I2884-M2888 WeakPolarHBondContact O-CB 3.35Å; I2884-M2888 PolarHBondContact O-N 2.88Å; I2884-M2956 HydrophobicContact CD1-CE 4.03Å; I2884-M2956 HydrophobicContact CD1-SD 3.72Å; I2884-M2956 HydrophobicContact CG1-CE 3.71Å; I2884-M2956 HydrophobicContact CG1-SD 4.07Å; I2884-V3012 HydrophobicContact CG1-CG1 4.37Å
2885	N	98	Very high	95.6	Very high	5 Å²	5	21.4 Å²	21.4	3%	0.027	12%	0.12	C	C	.	.	H	α-helix	trans	-58.6	-46.9	175.9	-178.4	67	0	0	0	112.6	W2864 L2873 Y2875 P2881 M2882 M2888 F2889	W2864-N2885 HydrophobicContact CH2-CB 4.48Å; L2873-N2885 HydrophobicContact CD1-CB 3.71Å; Y2875-N2885 VanDerWaalsContact CZ-ND2 3.34Å; Y2875-N2885 PolarHBondContact OH-ND2 2.99Å; Y2875-N2885 VanDerWaalsContact OH-ND2 3.08Å; P2881-N2885 WeakPolarHBondContact O-CB 3.35Å; P2881-N2885 PolarHBondContact O-N 3.18Å; M2882-N2885 PolarHBondContact O-N 3.09Å; M2882-N2885 HydrophobicContact SD-CB 4.39Å; N2885-M2888 PolarHBondContact O-N 3.05Å; N2885-F2889 VanDerWaalsContact O-CD2 3.26Å; N2885-F2889 WeakPolarHBondContact O-CD2 3.32Å; N2885-F2889 PolarHBondContact O-N 2.91Å; N2885-F2889 WeakPolarHBondContact OD1-CD2 3.49Å; N2885-F2889 VanDerWaalsContact OD1-CE2 3.31Å; N2885-F2889 WeakPolarHBondContact OD1-CE2 3.37Å
2886	A	96.4	Very high	95.6	Very high	25.5 Å²	25.5	20.9 Å²	20.9	21%	0.211	12%	0.118	C	C	.	.	H	α-helix	trans	-58.7	-49.2	172.7	0	0	0	0	0	111.9	M2882 I2884 M2888 F2889 E2890 N3032	M2882-A2886 PolarHBondContact O-N 3.05Å; I2884-A2886 PolarHBondContact O-N 3.4Å; A2886-M2888 VanDerWaalsContact C-N 3.29Å; A2886-M2888 PolarHBondContact O-N 2.8Å; A2886-F2889 PolarHBondContact O-N 2.86Å; A2886-E2890 VanDerWaalsContact O-CB 3.29Å; A2886-E2890 WeakPolarHBondContact O-CB 3.47Å; A2886-E2890 WeakPolarHBondContact O-CG 3.29Å; A2886-E2890 PolarHBondContact O-N 2.96Å; A2886-N3032 WeakPolarHBondContact CB-ND2 3.41Å
2887	A	96.8	Very high	95.8	Very high	0 Å²	0	20 Å²	20	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-60.2	-37.3	179.5	0	0	0	0	0	112.9	A2883 I2884 F2994 V3012 P3014	A2883-A2887 WeakPolarHBondContact O-CB 3.33Å; A2883-A2887 PolarHBondContact O-N 2.98Å; I2884-A2887 PolarHBondContact O-N 3.04Å; A2887-F2994 HydrophobicContact CB-CD1 4.06Å; A2887-F2994 HydrophobicContact CB-CE1 4.09Å; A2887-V3012 HydrophobicContact CB-CB 4.04Å; A2887-V3012 HydrophobicContact CB-CG1 3.73Å; A2887-P3014 HydrophobicContact CB-CG 4.38Å; A2887-P3014 WeakPolarHBondContact O-CG 3.48Å
2888	M	97	Very high	95.9	Very high	3.5 Å²	3.5	19.5 Å²	19.5	2%	0.017	11%	0.11	C	C	.	.	H	α-helix	trans	-62.6	-51.2	178.5	179.1	51.2	168	0	0	111.9	F2460 W2864 I2884 N2885 A2886 Q2891 M2898 L2992 F2994	F2460-M2888 HydrophobicContact CB-CE 4.22Å; F2460-M2888 HydrophobicContact CD2-CE 3.16Å; F2460-M2888 HydrophobicContact CE2-CE 3.68Å; F2460-M2888 HydrophobicContact CG-CE 3.94Å; W2864-M2888 HydrophobicContact CE3-CG 4.26Å; W2864-M2888 HydrophobicContact CH2-CB 3.71Å; W2864-M2888 HydrophobicContact CH2-CG 3.81Å; W2864-M2888 HydrophobicContact CZ2-CG 4.25Å; W2864-M2888 HydrophobicContact CZ3-CB 3.77Å; W2864-M2888 HydrophobicContact CZ3-CG 3.79Å; I2884-M2888 WeakPolarHBondContact O-CB 3.35Å; I2884-M2888 PolarHBondContact O-N 2.88Å; N2885-M2888 PolarHBondContact O-N 3.05Å; A2886-M2888 VanDerWaalsContact C-N 3.29Å; A2886-M2888 PolarHBondContact O-N 2.8Å; M2888-Q2891 PolarHBondContact O-NE2 3Å; M2888-Q2891 PolarHBondContact SD-NE2 2.87Å; M2888-Q2891 VanDerWaalsContact SD-NE2 3.37Å; M2888-M2898 HydrophobicContact CE-CB 3.88Å; M2888-M2898 HydrophobicContact CE-CG 4.22Å; M2888-M2898 HydrophobicContact CG-CG 4.48Å; M2888-M2898 WeakPolarHBondContact O-CG 3.19Å; M2888-M2898 HydrophobicContact SD-CE 4.49Å; M2888-M2898 HydrophobicContact SD-CG 4.32Å; M2888-L2992 HydrophobicContact CE-CD2 3.81Å; M2888-L2992 HydrophobicContact SD-CD2 4.37Å; M2888-F2994 HydrophobicContact CB-CE1 4.19Å; M2888-F2994 HydrophobicContact CB-CZ 4.01Å; M2888-F2994 HydrophobicContact CG-CZ 4.43Å; M2888-F2994 HydrophobicContact SD-CZ 3.84Å
2889	F	97	Very high	96	Very high	13 Å²	13	18.1 Å²	18.1	6%	0.057	10%	0.104	C	C	.	.	H	α-helix	trans	-84.8	-15.1	-175.4	-65.5	-71.7	0	0	0	114.4	F2460 A2462 W2864 N2885 A2886 Q2891 N2894 G2896 M2898	F2460-F2889 HydrophobicContact CB-CE1 4.34Å; F2460-F2889 HydrophobicContact CB-CZ 4.18Å; A2462-F2889 VanDerWaalsContact CA-CZ 3.5Å; A2462-F2889 HydrophobicContact CB-CD1 3.94Å; A2462-F2889 HydrophobicContact CB-CD2 3.73Å; A2462-F2889 HydrophobicContact CB-CE1 3.97Å; A2462-F2889 HydrophobicContact CB-CE2 3.77Å; A2462-F2889 HydrophobicContact CB-CG 3.84Å; A2462-F2889 HydrophobicContact CB-CZ 3.91Å; A2462-F2889 VanDerWaalsContact N-CZ 3.27Å; W2864-F2889 HydrophobicContact CZ2-CE2 4.1Å; W2864-F2889 HydrophobicContact CZ2-CZ 4.44Å; N2885-F2889 VanDerWaalsContact O-CD2 3.26Å; N2885-F2889 WeakPolarHBondContact O-CD2 3.32Å; N2885-F2889 PolarHBondContact O-N 2.91Å; N2885-F2889 WeakPolarHBondContact OD1-CD2 3.49Å; N2885-F2889 VanDerWaalsContact OD1-CE2 3.31Å; N2885-F2889 WeakPolarHBondContact OD1-CE2 3.37Å; A2886-F2889 PolarHBondContact O-N 2.86Å; F2889-Q2891 PolarHBondContact O-N 3.11Å; F2889-N2894 WeakPolarHBondContact O-CA 3.21Å; F2889-N2894 PolarHBondContact O-N 3.1Å; F2889-G2896 WeakPolarHBondContact CE1-O 3.41Å; F2889-M2898 HydrophobicContact CD1-CB 4.37Å; F2889-M2898 HydrophobicContact CD1-CG 3.66Å; F2889-M2898 HydrophobicContact CE1-CB 4.15Å; F2889-M2898 HydrophobicContact CE1-CG 3.93Å; F2889-M2898 HydrophobicContact CG-CG 4.47Å
2890	E	94.2	Very high	96.1	Very high	11 Å²	11	16.6 Å²	16.6	5%	0.051	10%	0.096	C	C	.	.	H	α-helix	trans	-58.1	-26.3	167.7	-86.9	172	-161.6	0	0	112.8	Y2440 N2442 N2445 A2886 N2892 G2893 N2894 R3011 R3028	Y2440-E2890 WeakPolarHBondContact CE1-OE2 3.44Å; Y2440-E2890 WeakPolarHBondContact OH-CB 3.49Å; N2442-E2890 HydrophobicContact CB-CB 3.97Å; N2442-E2890 HydrophobicContact CB-CG 3.95Å; N2442-E2890 WeakPolarHBondContact CB-OE2 3.26Å; N2445-E2890 WeakPolarHBondContact CB-O 3.42Å; N2445-E2890 PolarHBondContact ND2-O 3.26Å; A2886-E2890 VanDerWaalsContact O-CB 3.29Å; A2886-E2890 WeakPolarHBondContact O-CB 3.47Å; A2886-E2890 WeakPolarHBondContact O-CG 3.29Å; A2886-E2890 PolarHBondContact O-N 2.96Å; E2890-N2892 PolarHBondContact O-N 2.99Å; E2890-G2893 PolarHBondContact O-N 3.3Å; E2890-N2894 VanDerWaalsContact CA-OD1 3.31Å; E2890-N2894 WeakPolarHBondContact CA-OD1 3.44Å; E2890-R3011 IonicContact OE1-NH1 3.34Å; E2890-R3011 IonicContact OE2-CZ 3.97Å; E2890-R3011 VanDerWaalsContact OE2-CZ 3.29Å; E2890-R3011 IonicContact OE2-NH1 2.67Å; E2890-R3011 PolarHBondContact OE2-NH1 3.33Å; E2890-R3011 IonicContact OE2-NH2 3.12Å; E2890-R3011 PolarHBondContact OE2-NH2 2.9Å; E2890-R3028 IonicContact OE1-CZ 2.74Å; E2890-R3028 IonicContact OE1-NH1 3.24Å; E2890-R3028 PolarHBondContact OE1-NH1 2.78Å; E2890-R3028 IonicContact OE1-NH2 2.76Å; E2890-R3028 PolarHBondContact OE1-NH2 3.33Å; E2890-R3028 IonicContact OE2-NH2 2.61Å; E2890-R3028 PolarHBondContact OE2-NH2 3.2Å
2891	Q	92.3	Very high	95.9	Very high	39 Å²	39	14.3 Å²	14.3	18%	0.182	9%	0.085	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-37.2	-173.9	-67.9	178.5	100.8	0	0	114.5	N2445 M2888 F2889 M2898 P3014	N2445-Q2891 WeakPolarHBondContact CB-O 3.39Å; M2888-Q2891 PolarHBondContact O-NE2 3Å; M2888-Q2891 PolarHBondContact SD-NE2 2.87Å; M2888-Q2891 VanDerWaalsContact SD-NE2 3.37Å; F2889-Q2891 PolarHBondContact O-N 3.11Å; Q2891-M2898 HydrophobicContact CB-CE 3.67Å; Q2891-M2898 HydrophobicContact CB-SD 3.8Å; Q2891-M2898 HydrophobicContact CG-CE 4.42Å; Q2891-P3014 HydrophobicContact CG-CB 4.06Å; Q2891-P3014 HydrophobicContact CG-CG 3.57Å; Q2891-P3014 VanDerWaalsContact OE1-CB 3.27Å
2892	N	92.9	Very high	95.5	Very high	13 Å²	13	16.5 Å²	16.5	7%	0.07	9%	0.091	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.2	34.6	-177.4	-166.4	35	0	0	0	111.7	M2447 N2448 M2452 E2890 C2895 Y2897 M2898	M2447-N2892 WeakPolarHBondContact CA-O 3.39Å; M2447-N2892 VanDerWaalsContact CA-OD1 3.27Å; M2447-N2892 WeakPolarHBondContact CA-OD1 3.47Å; N2448-N2892 PolarHBondContact N-OD1 3.16Å; M2452-N2892 WeakPolarHBondContact CE-ND2 3.35Å; M2452-N2892 PolarHBondContact SD-ND2 2.83Å; M2452-N2892 VanDerWaalsContact SD-ND2 3.42Å; E2890-N2892 PolarHBondContact O-N 2.99Å; N2892-C2895 PolarHBondContact ND2-SG 2.97Å; N2892-C2895 PolarHBondContact O-SG 3.25Å; N2892-C2895 VanDerWaalsContact O-SG 3.38Å; N2892-Y2897 PolarHBondContact ND2-O 3.14Å; N2892-M2898 HydrophobicContact CB-SD 3.38Å; N2892-M2898 WeakPolarHBondContact CB-SD 3.33Å
2893	G	91.2	Very high	95.1	Very high	24.5 Å²	24.5	16.4 Å²	16.4	25%	0.253	9%	0.09	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.2	39.9	175.3	0	0	0	0	0	114.4	N2445 E2890 C2895	N2445-G2893 VanDerWaalsContact O-CA 3.24Å; N2445-G2893 WeakPolarHBondContact O-CA 3.29Å; E2890-G2893 PolarHBondContact O-N 3.3Å; G2893-C2895 PolarHBondContact O-N 3.36Å
2894	N	93.5	Very high	94.9	Very high	56.5 Å²	56.5	16.4 Å²	16.4	30%	0.302	9%	0.09	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.8	23.5	-179.2	-62.6	-32.6	0	0	0	114.7	G2490 F2889 E2890 G2896	G2490-N2894 VanDerWaalsContact CA-O 3.24Å; G2490-N2894 WeakPolarHBondContact CA-O 3.46Å; F2889-N2894 WeakPolarHBondContact O-CA 3.21Å; F2889-N2894 PolarHBondContact O-N 3.1Å; E2890-N2894 VanDerWaalsContact CA-OD1 3.31Å; E2890-N2894 WeakPolarHBondContact CA-OD1 3.44Å; N2894-G2896 PolarHBondContact O-N 2.93Å
2895	C	95.7	Very high	94.7	Very high	5.5 Å²	5.5	17.4 Å²	17.4	4%	0.037	9%	0.094	C	C	.	.			trans	-71.6	-13.7	179.1	73.6	0	0	0	0	113.4	M2447 R2492 S2535 L2537 N2892 G2893 Y2897	M2447-C2895 HydrophobicContact CB-CB 4.29Å; M2447-C2895 HydrophobicContact CG-CB 4.07Å; M2447-C2895 HydrophobicContact SD-CB 4.15Å; R2492-C2895 WeakPolarHBondContact CD-O 3.42Å; S2535-C2895 WeakPolarHBondContact CB-O 3.31Å; S2535-C2895 WeakPolarHBondContact OG-CA 3.28Å; S2535-C2895 PolarHBondContact OG-O 3.14Å; L2537-C2895 HydrophobicContact CD1-CB 3.88Å; N2892-C2895 PolarHBondContact ND2-SG 2.97Å; N2892-C2895 PolarHBondContact O-SG 3.25Å; N2892-C2895 VanDerWaalsContact O-SG 3.38Å; G2893-C2895 PolarHBondContact O-N 3.36Å; C2895-Y2897 VanDerWaalsContact C-N 3.35Å; C2895-Y2897 PolarHBondContact SG-O 3.12Å; C2895-Y2897 VanDerWaalsContact SG-O 3.39Å
2896	G	97.2	Very high	94.3	Very high	1 Å²	1	18.5 Å²	18.5	1%	0.01	10%	0.1	C	C	.	.	S	Bend	trans	80	5.4	177.4	0	0	0	0	0	116.1	A2462 G2490 F2889 N2894	A2462-G2896 PolarHBondContact N-O 3.02Å; G2490-G2896 WeakPolarHBondContact O-CA 3.41Å; F2889-G2896 WeakPolarHBondContact CE1-O 3.41Å; N2894-G2896 PolarHBondContact O-N 2.93Å
2897	Y	98.3	Very high	94	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	127.6	171.4	-72.5	-89.4	0	0	0	110.1	L2456 Y2459 F2460 I2461 R2492 L2537 P2538 P2586 N2892 C2895	L2456-Y2897 HydrophobicContact CD1-CD1 4.28Å; L2456-Y2897 HydrophobicContact CD1-CE1 3.55Å; Y2459-Y2897 HydrophobicContact CG-CD1 4.28Å; F2460-Y2897 WeakPolarHBondContact O-CA 3.48Å; I2461-Y2897 HydrophobicContact CB-CE1 4.32Å; I2461-Y2897 HydrophobicContact CD1-CD1 4.49Å; I2461-Y2897 HydrophobicContact CD1-CE1 3.83Å; I2461-Y2897 HydrophobicContact CG1-CD1 3.92Å; I2461-Y2897 HydrophobicContact CG1-CE1 3.67Å; I2461-Y2897 HydrophobicContact CG2-CD1 4.49Å; I2461-Y2897 HydrophobicContact CG2-CE1 3.89Å; R2492-Y2897 HydrophobicContact CB-CE2 3.82Å; R2492-Y2897 HydrophobicContact CG-CD2 3.8Å; R2492-Y2897 HydrophobicContact CG-CE2 3.45Å; R2492-Y2897 VanDerWaalsContact CG-CE2 3.45Å; L2537-Y2897 HydrophobicContact CB-CD2 3.64Å; L2537-Y2897 HydrophobicContact CB-CE2 3.7Å; L2537-Y2897 HydrophobicContact CD1-CD2 3.52Å; L2537-Y2897 HydrophobicContact CD1-CE2 4.41Å; L2537-Y2897 HydrophobicContact CD1-CG 4.07Å; L2537-Y2897 HydrophobicContact CG-CD2 4.24Å; P2538-Y2897 HydrophobicContact CG-CE2 4.25Å; P2538-Y2897 WeakPolarHBondContact O-CE2 3.46Å; P2538-Y2897 PolarHBondContact O-OH 3.05Å; P2586-Y2897 HydrophobicContact CB-CD1 4.33Å; P2586-Y2897 HydrophobicContact CB-CG 4.32Å; P2586-Y2897 HydrophobicContact CG-CD1 4.01Å; P2586-Y2897 HydrophobicContact CG-CE1 4.43Å; P2586-Y2897 HydrophobicContact CG-CG 4.35Å; N2892-Y2897 PolarHBondContact ND2-O 3.14Å; C2895-Y2897 VanDerWaalsContact C-N 3.35Å; C2895-Y2897 PolarHBondContact SG-O 3.12Å; C2895-Y2897 VanDerWaalsContact SG-O 3.39Å
2898	M	96.8	Very high	93.4	Very high	25 Å²	25	27.3 Å²	27.3	12%	0.123	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	120.5	178.6	-79.2	-61.4	-57.4	0	0	109.7	Y2459 F2460 M2888 F2889 Q2891 N2892 K2900	Y2459-M2898 CarbonylContact C-O 3.47Å; Y2459-M2898 WeakPolarHBondContact CA-O 3.36Å; Y2459-M2898 WeakPolarHBondContact CB-O 3.38Å; F2460-M2898 HydrophobicContact CB-CB 4.33Å; F2460-M2898 HydrophobicContact CD2-CB 4.46Å; F2460-M2898 PolarHBondContact N-O 3.42Å; F2460-M2898 PolarHBondContact O-N 2.99Å; M2888-M2898 HydrophobicContact CE-CB 3.88Å; M2888-M2898 HydrophobicContact CE-CG 4.22Å; M2888-M2898 HydrophobicContact CG-CG 4.48Å; M2888-M2898 WeakPolarHBondContact O-CG 3.19Å; M2888-M2898 HydrophobicContact SD-CE 4.49Å; M2888-M2898 HydrophobicContact SD-CG 4.32Å; F2889-M2898 HydrophobicContact CD1-CB 4.37Å; F2889-M2898 HydrophobicContact CD1-CG 3.66Å; F2889-M2898 HydrophobicContact CE1-CB 4.15Å; F2889-M2898 HydrophobicContact CE1-CG 3.93Å; F2889-M2898 HydrophobicContact CG-CG 4.47Å; Q2891-M2898 HydrophobicContact CB-CE 3.67Å; Q2891-M2898 HydrophobicContact CB-SD 3.8Å; Q2891-M2898 HydrophobicContact CG-CE 4.42Å; N2892-M2898 HydrophobicContact CB-SD 3.38Å; N2892-M2898 WeakPolarHBondContact CB-SD 3.33Å; M2898-K2900 PolarHBondContact O-N 3.43Å
2899	L	96.6	Very high	92.6	Very high	38 Å²	38	28.7 Å²	28.7	20%	0.199	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.5	133.8	179.1	-174.2	67	0	0	0	110.1	D2451 Y2454 Y2459 W2905	D2451-L2899 HydrophobicContact CB-CD2 4.09Å; Y2454-L2899 HydrophobicContact CD2-CD1 3.7Å; Y2454-L2899 HydrophobicContact CD2-CD2 3.95Å; Y2454-L2899 HydrophobicContact CD2-CG 4.45Å; Y2454-L2899 HydrophobicContact CE2-CD1 4.46Å; Y2454-L2899 HydrophobicContact CE2-CD2 3.91Å; Y2454-L2899 HydrophobicContact CG-CD1 4.1Å; Y2459-L2899 HydrophobicContact CD1-CB 4.16Å; Y2459-L2899 HydrophobicContact CD1-CD1 4.19Å; Y2459-L2899 HydrophobicContact CE1-CB 4.04Å; Y2459-L2899 HydrophobicContact CE1-CD1 3.7Å; Y2459-L2899 HydrophobicContact CE1-CG 4.42Å; L2899-W2905 HydrophobicContact CD1-CZ2 4.29Å; L2899-W2905 HydrophobicContact CD2-CZ2 4.09Å; L2899-W2905 HydrophobicContact CG-CZ2 4.31Å
2900	K	96.9	Very high	91.6	Very high	4 Å²	4	31.7 Å²	31.7	2%	0.017	18%	0.177	C	C	.	.	P	Polyproline II helix	trans	-66.7	151.6	179.5	-72.1	-161	-71.5	-175.2	0	111.4	S2457 Y2458 F2460 T2839 G2867 M2898 R2902 M2904 W2905	S2457-K2900 WeakPolarHBondContact O-CE 3.33Å; S2457-K2900 PolarHBondContact O-NZ 3.25Å; Y2458-K2900 VanDerWaalsContact O-CB 3.31Å; Y2458-K2900 WeakPolarHBondContact O-CB 3.41Å; Y2458-K2900 WeakPolarHBondContact O-CG 3.41Å; Y2458-K2900 PolarHBondContact O-N 3.48Å; F2460-K2900 HydrophobicContact CD1-CD 4.23Å; F2460-K2900 HydrophobicContact CD1-CG 4.12Å; F2460-K2900 HydrophobicContact CD2-CG 3.96Å; F2460-K2900 HydrophobicContact CE1-CD 3.72Å; F2460-K2900 HydrophobicContact CE1-CG 3.82Å; F2460-K2900 HydrophobicContact CE2-CB 4.26Å; F2460-K2900 HydrophobicContact CE2-CD 4.48Å; F2460-K2900 HydrophobicContact CE2-CG 3.73Å; F2460-K2900 HydrophobicContact CG-CG 4.2Å; F2460-K2900 HydrophobicContact CZ-CB 4.34Å; F2460-K2900 HydrophobicContact CZ-CD 3.89Å; F2460-K2900 HydrophobicContact CZ-CG 3.64Å; T2839-K2900 PolarHBondContact O-NZ 3.33Å; T2839-K2900 PolarHBondContact OG1-NZ 3.05Å; G2867-K2900 WeakPolarHBondContact O-CD 3.32Å; G2867-K2900 PolarHBondContact O-NZ 3.47Å; M2898-K2900 PolarHBondContact O-N 3.43Å; K2900-R2902 PolarHBondContact O-N 3.01Å; K2900-M2904 HydrophobicContact CB-SD 4.25Å; K2900-M2904 HydrophobicContact CD-SD 4.03Å; K2900-M2904 HydrophobicContact CG-SD 4.5Å; K2900-W2905 PolarHBondContact O-NE1 3Å
2901	P	92.4	Very high	91.1	Very high	8.5 Å²	8.5	32.9 Å²	32.9	6%	0.055	18%	0.183	C	C	.	.	P	Polyproline II helix	trans	-50.6	136	170.7	-26.7	33.6	0	0	0	111.6	V2903 M2904 F2989 D2991 L2992	P2901-V2903 HydrophobicContact CB-CG1 4.06Å; P2901-V2903 PolarHBondContact O-N 3.26Å; P2901-V2903 VanDerWaalsContact O-N 3.09Å; P2901-M2904 HydrophobicContact CB-CE 4.38Å; P2901-M2904 HydrophobicContact CG-CE 3.99Å; P2901-M2904 HydrophobicContact CG-SD 4.4Å; P2901-M2904 PolarHBondContact O-N 2.98Å; P2901-F2989 HydrophobicContact CB-CE2 4.25Å; P2901-F2989 HydrophobicContact CB-CZ 3.64Å; P2901-F2989 HydrophobicContact CG-CE1 4.26Å; P2901-F2989 HydrophobicContact CG-CZ 3.77Å; P2901-D2991 HydrophobicContact CB-CB 4.01Å; P2901-D2991 HydrophobicContact CG-CB 3.84Å; P2901-L2992 HydrophobicContact CG-CD1 4.29Å; P2901-L2992 HydrophobicContact CG-CG 4.07Å
2902	R	89.8	Confident	90.7	Very high	65 Å²	65	34.3 Å²	34.3	25%	0.245	19%	0.187	C	C	.	.	G	3₁₀ helix	trans	-53.4	-35.5	-173.7	-74.4	175.7	67.4	-167.8	1.8	112.9	K2900 M2904 W2905 D2906	K2900-R2902 PolarHBondContact O-N 3.01Å; R2902-M2904 PolarHBondContact O-N 3.08Å; R2902-W2905 HydrophobicContact CG-CH2 4.46Å; R2902-W2905 HydrophobicContact CG-CZ2 4Å; R2902-W2905 PolarHBondContact O-N 3.07Å; R2902-D2906 HydrophobicContact CB-CB 3.98Å; R2902-D2906 HydrophobicContact CG-CB 4.46Å; R2902-D2906 IonicContact CZ-OD2 3.42Å; R2902-D2906 IonicContact NE-OD2 3.45Å; R2902-D2906 PolarHBondContact NE-OD2 3.01Å; R2902-D2906 IonicContact NH2-OD2 3.08Å; R2902-D2906 PolarHBondContact NH2-OD2 2.99Å; R2902-D2906 VanDerWaalsContact O-CB 3.28Å; R2902-D2906 WeakPolarHBondContact O-CB 3.34Å; R2902-D2906 PolarHBondContact O-N 3.1Å
2903	V	88.5	Confident	90.4	Very high	3.5 Å²	3.5	35.8 Å²	35.8	2%	0.021	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-51.9	-25.1	177.3	68.8	0	0	0	0	114.7	P2901 H2909 L2911 F2915 F2989	P2901-V2903 HydrophobicContact CB-CG1 4.06Å; P2901-V2903 PolarHBondContact O-N 3.26Å; P2901-V2903 VanDerWaalsContact O-N 3.09Å; V2903-H2909 WeakPolarHBondContact CB-ND1 3.42Å; V2903-H2909 WeakPolarHBondContact CG2-ND1 3.48Å; V2903-L2911 HydrophobicContact CG2-CB 3.7Å; V2903-F2915 HydrophobicContact CG1-CD1 4.03Å; V2903-F2915 HydrophobicContact CG1-CE1 4.16Å; V2903-F2915 HydrophobicContact CG1-CG 4.26Å; V2903-F2915 HydrophobicContact CG1-CZ 4.41Å; V2903-F2915 HydrophobicContact CG2-CB 3.38Å; V2903-F2915 HydrophobicContact CG2-CD1 4.05Å; V2903-F2915 HydrophobicContact CG2-CD2 4.05Å; V2903-F2915 HydrophobicContact CG2-CG 3.57Å; V2903-F2989 HydrophobicContact CG1-CE2 3.72Å; V2903-F2989 HydrophobicContact CG1-CZ 3.85Å
2904	M	93.1	Very high	90.2	Very high	1.5 Å²	1.5	39.5 Å²	39.5	1%	0.007	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-87.9	-10.1	-177.4	-56.9	179.5	-177.6	0	0	114.4	F2460 V2836 W2864 T2865 K2900 P2901 R2902 F2915 F2989 L2992	F2460-M2904 HydrophobicContact CZ-SD 4.26Å; V2836-M2904 HydrophobicContact CG1-CB 4.38Å; V2836-M2904 HydrophobicContact CG1-CG 4.47Å; W2864-M2904 WeakPolarHBondContact O-CE 3.27Å; T2865-M2904 VanDerWaalsContact O-CE 3.27Å; T2865-M2904 WeakPolarHBondContact O-CE 3.21Å; K2900-M2904 HydrophobicContact CB-SD 4.25Å; K2900-M2904 HydrophobicContact CD-SD 4.03Å; K2900-M2904 HydrophobicContact CG-SD 4.5Å; P2901-M2904 HydrophobicContact CB-CE 4.38Å; P2901-M2904 HydrophobicContact CG-CE 3.99Å; P2901-M2904 HydrophobicContact CG-SD 4.4Å; P2901-M2904 PolarHBondContact O-N 2.98Å; R2902-M2904 PolarHBondContact O-N 3.08Å; M2904-F2915 HydrophobicContact CE-CE1 4.33Å; M2904-F2989 HydrophobicContact CE-CE1 4.38Å; M2904-F2989 HydrophobicContact CE-CZ 4.22Å; M2904-L2992 HydrophobicContact CE-CD1 4.13Å
2905	W	93.3	Very high	89.8	Confident	21.5 Å²	21.5	37.2 Å²	37.2	8%	0.081	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-151.3	-22.2	-171.1	61.8	-96.4	0	0	0	115.9	Y2454 Y2458 K2840 L2899 K2900 R2902	Y2454-W2905 AromaticContact CD1-CH2 3.94Å; Y2454-W2905 HydrophobicContact CD1-CH2 3.94Å; Y2454-W2905 AromaticContact CD1-CZ3 3.9Å; Y2454-W2905 HydrophobicContact CD1-CZ3 3.96Å; Y2454-W2905 AromaticContact CE1-CH2 3.52Å; Y2454-W2905 HydrophobicContact CE1-CH2 3.52Å; Y2454-W2905 VanDerWaalsContact CE1-CH2 3.46Å; Y2454-W2905 HydrophobicContact CE1-CZ2 4.47Å; Y2454-W2905 AromaticContact CE1-CZ3 3.71Å; Y2454-W2905 HydrophobicContact CE1-CZ3 3.71Å; Y2454-W2905 HydrophobicContact CE2-CH2 4.32Å; Y2454-W2905 HydrophobicContact CG-CH2 4.49Å; Y2454-W2905 AromaticContact CZ-CH2 3.73Å; Y2458-W2905 HydrophobicContact CD1-CB 4.21Å; Y2458-W2905 HydrophobicContact CD2-CB 3.96Å; Y2458-W2905 AromaticContact CD2-CD2 3.51Å; Y2458-W2905 HydrophobicContact CD2-CD2 3.51Å; Y2458-W2905 VanDerWaalsContact CD2-CD2 3.49Å; Y2458-W2905 AromaticContact CD2-CE3 3.53Å; Y2458-W2905 HydrophobicContact CD2-CE3 3.53Å; Y2458-W2905 VanDerWaalsContact CD2-CE3 3.5Å; Y2458-W2905 AromaticContact CD2-CG 3.74Å; Y2458-W2905 HydrophobicContact CD2-CG 3.74Å; Y2458-W2905 HydrophobicContact CD2-CZ3 4.19Å; Y2458-W2905 HydrophobicContact CE1-CB 4.15Å; Y2458-W2905 HydrophobicContact CE2-CB 3.89Å; Y2458-W2905 AromaticContact CE2-CD2 3.74Å; Y2458-W2905 HydrophobicContact CE2-CD2 3.74Å; Y2458-W2905 AromaticContact CE2-CE3 3.34Å; Y2458-W2905 HydrophobicContact CE2-CE3 3.34Å; Y2458-W2905 VanDerWaalsContact CE2-CE3 3.41Å; Y2458-W2905 AromaticContact CE2-CG 3.9Å; Y2458-W2905 HydrophobicContact CE2-CG 4.02Å; Y2458-W2905 HydrophobicContact CE2-CZ3 4.08Å; Y2458-W2905 HydrophobicContact CG-CB 4.14Å; Y2458-W2905 HydrophobicContact CG-CD2 4.31Å; Y2458-W2905 HydrophobicContact CG-CG 4.11Å; K2840-W2905 HydrophobicContact CG-CB 4.23Å; L2899-W2905 HydrophobicContact CD1-CZ2 4.29Å; L2899-W2905 HydrophobicContact CD2-CZ2 4.09Å; L2899-W2905 HydrophobicContact CG-CZ2 4.31Å; K2900-W2905 PolarHBondContact O-NE1 3Å; R2902-W2905 HydrophobicContact CG-CH2 4.46Å; R2902-W2905 HydrophobicContact CG-CZ2 4Å; R2902-W2905 PolarHBondContact O-N 3.07Å
2906	D	89.8	Confident	89.5	Confident	28 Å²	28	38.7 Å²	38.7	15%	0.15	21%	0.214	C	C	.	.			trans	-92.8	109.1	-177.4	-174.9	-5.4	0	0	0	110.8	R2902 A2908 H2909 Y2912	R2902-D2906 HydrophobicContact CB-CB 3.98Å; R2902-D2906 HydrophobicContact CG-CB 4.46Å; R2902-D2906 IonicContact CZ-OD2 3.42Å; R2902-D2906 IonicContact NE-OD2 3.45Å; R2902-D2906 PolarHBondContact NE-OD2 3.01Å; R2902-D2906 IonicContact NH2-OD2 3.08Å; R2902-D2906 PolarHBondContact NH2-OD2 2.99Å; R2902-D2906 VanDerWaalsContact O-CB 3.28Å; R2902-D2906 WeakPolarHBondContact O-CB 3.34Å; R2902-D2906 PolarHBondContact O-N 3.1Å; D2906-A2908 PolarHBondContact O-N 3.07Å; D2906-A2908 VanDerWaalsContact O-N 3.15Å; D2906-A2908 WeakPolarHBondContact OD1-CB 3.3Å; D2906-A2908 PolarHBondContact OD1-N 3.12Å; D2906-H2909 HydrophobicContact CB-CB 4.47Å; D2906-H2909 VanDerWaalsContact O-CB 3.26Å; D2906-H2909 WeakPolarHBondContact O-CB 3.45Å; D2906-H2909 PolarHBondContact O-N 3.16Å; D2906-Y2912 WeakPolarHBondContact O-CB 3.42Å; D2906-Y2912 WeakPolarHBondContact O-CD2 3.37Å
2907	E	90.1	Very high	88.9	Confident	135.5 Å²	135.5	38.8 Å²	38.8	63%	0.633	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-17	-179.8	-69.1	164.8	-147.2	0	0	113.4	K2840 H2909 Y2912	K2840-E2907 IonicContact NZ-OE1 3.23Å; K2840-E2907 PolarHBondContact NZ-OE1 3.12Å; E2907-H2909 VanDerWaalsContact C-N 3.32Å; E2907-Y2912 HydrophobicContact CB-CD1 4.43Å; E2907-Y2912 HydrophobicContact CB-CE1 4.37Å; E2907-Y2912 HydrophobicContact CG-CD1 4.16Å; E2907-Y2912 HydrophobicContact CG-CE1 3.63Å; E2907-Y2912 HydrophobicContact CG-CE2 4.25Å
2908	A	84.5	Confident	88.3	Confident	76 Å²	76	42.1 Å²	42.1	63%	0.628	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-2.1	173.9	0	0	0	0	0	113.6	D2906	D2906-A2908 PolarHBondContact O-N 3.07Å; D2906-A2908 VanDerWaalsContact O-N 3.15Å; D2906-A2908 WeakPolarHBondContact OD1-CB 3.3Å; D2906-A2908 PolarHBondContact OD1-N 3.12Å
2909	H	80.6	Confident	87.4	Confident	33 Å²	33	42.5 Å²	42.5	15%	0.153	23%	0.233	C	C	.	.	S	Bend	trans	-82	130.3	179.7	-172.2	-89.6	0	0	0	111.7	V2903 D2906 E2907 L2911 Y2912	V2903-H2909 WeakPolarHBondContact CB-ND1 3.42Å; V2903-H2909 WeakPolarHBondContact CG2-ND1 3.48Å; D2906-H2909 HydrophobicContact CB-CB 4.47Å; D2906-H2909 VanDerWaalsContact O-CB 3.26Å; D2906-H2909 WeakPolarHBondContact O-CB 3.45Å; D2906-H2909 PolarHBondContact O-N 3.16Å; E2907-H2909 VanDerWaalsContact C-N 3.32Å; H2909-L2911 PolarHBondContact ND1-N 2.84Å; H2909-L2911 PolarHBondContact O-N 3.09Å; H2909-Y2912 VanDerWaalsContact O-CB 3.25Å; H2909-Y2912 WeakPolarHBondContact O-CB 3.35Å; H2909-Y2912 PolarHBondContact O-N 3.06Å
2910	P	76.8	Confident	86.1	Confident	76 Å²	76	46.1 Å²	46.1	49%	0.494	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-24	-173.7	-28.6	35.7	0	0	0	116.6	L3063	P2910-L3063 HydrophobicContact CB-CD2 4.4Å; P2910-L3063 HydrophobicContact CB-CG 3.93Å
2911	L	82.3	Confident	84.7	Confident	35 Å²	35	50.4 Å²	50.4	18%	0.183	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.7	6	177.1	-59.6	177.3	0	0	0	113.9	V2903 H2909 G2913 I2914 F2915 I2925 L3063	V2903-L2911 HydrophobicContact CG2-CB 3.7Å; H2909-L2911 PolarHBondContact ND1-N 2.84Å; H2909-L2911 PolarHBondContact O-N 3.09Å; L2911-G2913 PolarHBondContact O-N 3.35Å; L2911-I2914 HydrophobicContact CB-CG1 4.46Å; L2911-I2914 HydrophobicContact CD2-CD1 4.12Å; L2911-I2914 HydrophobicContact CD2-CG1 4.31Å; L2911-I2914 WeakPolarHBondContact O-CG1 3.37Å; L2911-I2914 PolarHBondContact O-N 2.98Å; L2911-F2915 HydrophobicContact CB-CB 4.28Å; L2911-F2915 VanDerWaalsContact O-CB 3.31Å; L2911-F2915 WeakPolarHBondContact O-CB 3.24Å; L2911-F2915 PolarHBondContact O-N 3.16Å; L2911-I2925 HydrophobicContact CD1-CD1 4.07Å; L2911-I2925 HydrophobicContact CD2-CD1 4.09Å; L2911-L3063 HydrophobicContact CD2-CD2 3.7Å; L2911-L3063 HydrophobicContact CG-CD2 4.21Å
2912	Y	85.1	Confident	83.5	Confident	70 Å²	70	50.8 Å²	50.8	28%	0.275	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	137.2	178.2	177.5	-93.5	0	0	0	111	K2840 D2906 E2907 H2909 I2914	K2840-Y2912 HydrophobicContact CD-CE2 4.44Å; K2840-Y2912 PolarHBondContact NZ-OH 2.87Å; D2906-Y2912 WeakPolarHBondContact O-CB 3.42Å; D2906-Y2912 WeakPolarHBondContact O-CD2 3.37Å; E2907-Y2912 HydrophobicContact CB-CD1 4.43Å; E2907-Y2912 HydrophobicContact CB-CE1 4.37Å; E2907-Y2912 HydrophobicContact CG-CD1 4.16Å; E2907-Y2912 HydrophobicContact CG-CE1 3.63Å; E2907-Y2912 HydrophobicContact CG-CE2 4.25Å; H2909-Y2912 VanDerWaalsContact O-CB 3.25Å; H2909-Y2912 WeakPolarHBondContact O-CB 3.35Å; H2909-Y2912 PolarHBondContact O-N 3.06Å; Y2912-I2914 PolarHBondContact O-N 2.95Å; Y2912-I2914 VanDerWaalsContact O-N 3.1Å
2913	G	85.9	Confident	82.1	Confident	43 Å²	43	54.7 Å²	54.7	44%	0.443	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	74	-14.4	-177.9	0	0	0	0	0	116.1	Y2804 L2911	Y2804-G2913 WeakPolarHBondContact CE1-O 3.47Å; L2911-G2913 PolarHBondContact O-N 3.35Å
2914	I	87.3	Confident	80.6	Confident	103 Å²	103	62.2 Å²	62.2	53%	0.528	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.7	-9.2	179.8	62.2	171.3	0	0	0	114.2	Y2804 L2911 Y2912 N2916	Y2804-I2914 HydrophobicContact CE2-CG2 3.94Å; L2911-I2914 HydrophobicContact CB-CG1 4.46Å; L2911-I2914 HydrophobicContact CD2-CD1 4.12Å; L2911-I2914 HydrophobicContact CD2-CG1 4.31Å; L2911-I2914 WeakPolarHBondContact O-CG1 3.37Å; L2911-I2914 PolarHBondContact O-N 2.98Å; Y2912-I2914 PolarHBondContact O-N 2.95Å; Y2912-I2914 VanDerWaalsContact O-N 3.1Å; I2914-N2916 PolarHBondContact O-N 3Å
2915	F	85.9	Confident	79.3	Confident	8 Å²	8	64.4 Å²	64.4	4%	0.035	33%	0.332	C	S	.	.			trans	-68.7	116.7	178.6	175	-106.2	0	0	0	112.3	L2833 V2903 M2904 L2911 P2917 L2922 F2989	L2833-F2915 WeakPolarHBondContact CD2-O 3.42Å; V2903-F2915 HydrophobicContact CG1-CD1 4.03Å; V2903-F2915 HydrophobicContact CG1-CE1 4.16Å; V2903-F2915 HydrophobicContact CG1-CG 4.26Å; V2903-F2915 HydrophobicContact CG1-CZ 4.41Å; V2903-F2915 HydrophobicContact CG2-CB 3.38Å; V2903-F2915 HydrophobicContact CG2-CD1 4.05Å; V2903-F2915 HydrophobicContact CG2-CD2 4.05Å; V2903-F2915 HydrophobicContact CG2-CG 3.57Å; M2904-F2915 HydrophobicContact CE-CE1 4.33Å; L2911-F2915 HydrophobicContact CB-CB 4.28Å; L2911-F2915 VanDerWaalsContact O-CB 3.31Å; L2911-F2915 WeakPolarHBondContact O-CB 3.24Å; L2911-F2915 PolarHBondContact O-N 3.16Å; F2915-P2917 HydrophobicContact CD1-CG 4.45Å; F2915-P2917 HydrophobicContact CE1-CG 3.72Å; F2915-P2917 HydrophobicContact CZ-CG 4.02Å; F2915-L2922 HydrophobicContact CD2-CD2 4.39Å; F2915-L2922 HydrophobicContact CE2-CD1 4.21Å; F2915-F2989 HydrophobicContact CE1-CE1 4.42Å; F2915-F2989 HydrophobicContact CE1-CZ 4.28Å; F2915-F2989 HydrophobicContact CE2-CD2 4.04Å; F2915-F2989 HydrophobicContact CE2-CE2 4.12Å; F2915-F2989 HydrophobicContact CE2-CG 4.38Å; F2915-F2989 HydrophobicContact CE2-CZ 4.42Å; F2915-F2989 HydrophobicContact CZ-CD1 4.16Å; F2915-F2989 HydrophobicContact CZ-CD2 4.1Å; F2915-F2989 AromaticContact CZ-CE1 3.87Å; F2915-F2989 HydrophobicContact CZ-CE1 3.94Å; F2915-F2989 AromaticContact CZ-CE2 3.91Å; F2915-F2989 HydrophobicContact CZ-CE2 3.91Å; F2915-F2989 HydrophobicContact CZ-CG 4.22Å; F2915-F2989 AromaticContact CZ-CZ 3.81Å; F2915-F2989 HydrophobicContact CZ-CZ 3.81Å
2916	N	88.4	Confident	77.8	Confident	38 Å²	38	66.3 Å²	66.3	20%	0.203	35%	0.348	C	S	.	.			trans	-121.6	113.9	170.3	174.3	1.2	0	0	0	109.2	L2833 I2914 W2918 A2919 L2922	L2833-N2916 HydrophobicContact CD2-CB 4.12Å; I2914-N2916 PolarHBondContact O-N 3Å; N2916-W2918 PolarHBondContact O-N 3.13Å; N2916-W2918 VanDerWaalsContact O-N 3.11Å; N2916-W2918 PolarHBondContact OD1-N 2.68Å; N2916-W2918 VanDerWaalsContact OD1-N 3.15Å; N2916-A2919 HydrophobicContact CB-CB 4.02Å; N2916-A2919 WeakPolarHBondContact O-CB 3.24Å; N2916-A2919 PolarHBondContact O-N 2.85Å; N2916-L2922 WeakPolarHBondContact O-CD1 3.22Å
2917	P	85.8	Confident	77.1	Confident	2 Å²	2	65.4 Å²	65.4	1%	0.013	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.6	-27.3	179.2	-30.4	34.8	0	0	0	116.8	T2865 F2866 F2915 I2958	T2865-P2917 WeakPolarHBondContact O-CG 3.39Å; F2866-P2917 HydrophobicContact CD1-CG 4.04Å; F2866-P2917 HydrophobicContact CD2-CG 4.29Å; F2866-P2917 HydrophobicContact CE1-CB 4.22Å; F2866-P2917 HydrophobicContact CE1-CG 3.73Å; F2866-P2917 HydrophobicContact CE2-CB 4.02Å; F2866-P2917 HydrophobicContact CE2-CG 4.01Å; F2866-P2917 HydrophobicContact CG-CG 4.31Å; F2866-P2917 HydrophobicContact CZ-CB 3.74Å; F2866-P2917 HydrophobicContact CZ-CG 3.72Å; F2915-P2917 HydrophobicContact CD1-CG 4.45Å; F2915-P2917 HydrophobicContact CE1-CG 3.72Å; F2915-P2917 HydrophobicContact CZ-CG 4.02Å; P2917-I2958 HydrophobicContact CB-CG2 3.99Å
2918	W	84.2	Confident	76.9	Confident	70.5 Å²	70.5	59.5 Å²	59.5	27%	0.267	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.6	-1.2	179.4	-64.9	-42.6	0	0	0	114.1	I2828 R2829 P2832 M2862 F2866 N2916 H2920	I2828-W2918 VanDerWaalsContact C-CH2 3.47Å; I2828-W2918 VanDerWaalsContact C-CZ3 3.45Å; I2828-W2918 HydrophobicContact CB-CH2 3.9Å; I2828-W2918 HydrophobicContact CB-CZ2 4.38Å; I2828-W2918 HydrophobicContact CB-CZ3 4.32Å; I2828-W2918 HydrophobicContact CD1-CH2 3.56Å; I2828-W2918 HydrophobicContact CD1-CZ2 3.53Å; I2828-W2918 HydrophobicContact CG1-CH2 3.52Å; I2828-W2918 HydrophobicContact CG1-CZ2 4.04Å; I2828-W2918 HydrophobicContact CG2-CE3 4.22Å; I2828-W2918 HydrophobicContact CG2-CH2 3.41Å; I2828-W2918 VanDerWaalsContact CG2-CH2 3.41Å; I2828-W2918 HydrophobicContact CG2-CZ2 3.95Å; I2828-W2918 HydrophobicContact CG2-CZ3 3.56Å; I2828-W2918 VanDerWaalsContact O-CZ3 3.26Å; I2828-W2918 WeakPolarHBondContact O-CZ3 3.48Å; R2829-W2918 HydrophobicContact CB-CH2 4.14Å; R2829-W2918 HydrophobicContact CB-CZ3 4.36Å; R2829-W2918 HydrophobicContact CG-CH2 3.61Å; R2829-W2918 HydrophobicContact CG-CZ2 4.1Å; R2829-W2918 HydrophobicContact CG-CZ3 3.82Å; R2829-W2918 VanDerWaalsContact CG-CZ3 3.5Å; P2832-W2918 HydrophobicContact CB-CZ3 4.49Å; M2862-W2918 HydrophobicContact CG-CZ2 4.06Å; M2862-W2918 HydrophobicContact SD-CZ2 4.44Å; F2866-W2918 HydrophobicContact CE1-CE3 4.04Å; F2866-W2918 HydrophobicContact CE1-CH2 4.48Å; F2866-W2918 AromaticContact CE1-CZ3 3.98Å; F2866-W2918 HydrophobicContact CE1-CZ3 3.98Å; F2866-W2918 HydrophobicContact CE2-CD2 4.27Å; F2866-W2918 HydrophobicContact CE2-CH2 4.2Å; F2866-W2918 HydrophobicContact CE2-CZ2 4.2Å; F2866-W2918 HydrophobicContact CE2-CZ3 4.44Å; F2866-W2918 AromaticContact CZ-CD2 3.73Å; F2866-W2918 HydrophobicContact CZ-CD2 3.73Å; F2866-W2918 AromaticContact CZ-CE2 3.82Å; F2866-W2918 AromaticContact CZ-CE3 3.54Å; F2866-W2918 HydrophobicContact CZ-CE3 3.8Å; F2866-W2918 HydrophobicContact CZ-CG 4.06Å; F2866-W2918 AromaticContact CZ-CH2 3.74Å; F2866-W2918 HydrophobicContact CZ-CH2 3.74Å; F2866-W2918 AromaticContact CZ-CZ2 3.87Å; F2866-W2918 HydrophobicContact CZ-CZ2 3.87Å; F2866-W2918 AromaticContact CZ-CZ3 3.55Å; F2866-W2918 HydrophobicContact CZ-CZ3 3.55Å; N2916-W2918 PolarHBondContact O-N 3.13Å; N2916-W2918 VanDerWaalsContact O-N 3.11Å; N2916-W2918 PolarHBondContact OD1-N 2.68Å; N2916-W2918 VanDerWaalsContact OD1-N 3.15Å; W2918-H2920 PolarHBondContact O-N 3.2Å
2919	A	77.9	Confident	77.1	Confident	32 Å²	32	58.6 Å²	58.6	26%	0.264	30%	0.299	S	S	.	.			trans	-65.9	111.3	178	0	0	0	0	0	109.9	N2916 D2921 L2922	N2916-A2919 HydrophobicContact CB-CB 4.02Å; N2916-A2919 WeakPolarHBondContact O-CB 3.24Å; N2916-A2919 PolarHBondContact O-N 2.85Å; A2919-D2921 PolarHBondContact O-N 3.34Å; A2919-L2922 HydrophobicContact CB-CG 4.29Å; A2919-L2922 WeakPolarHBondContact O-CB 3.28Å; A2919-L2922 VanDerWaalsContact O-CG 3.29Å; A2919-L2922 WeakPolarHBondContact O-CG 3.35Å; A2919-L2922 PolarHBondContact O-N 2.91Å
2920	H	69.5	Low	77.6	Confident	114 Å²	114	57 Å²	57	53%	0.528	29%	0.292	S	S	.	.	G	3₁₀ helix	trans	-55.2	-23.8	175.6	-66.7	-24.3	0	0	0	113.1	W2918 L2922 R2923 E2959	W2918-H2920 PolarHBondContact O-N 3.2Å; H2920-L2922 PolarHBondContact O-N 3.2Å; H2920-R2923 VanDerWaalsContact CG-NH2 3.3Å; H2920-R2923 PolarHBondContact ND1-NH2 3.13Å; H2920-R2923 WeakPolarHBondContact O-CB 3.17Å; H2920-R2923 WeakPolarHBondContact O-CG 3.48Å; H2920-R2923 PolarHBondContact O-N 3.16Å; H2920-R2923 VanDerWaalsContact O-N 3.12Å; H2920-R2923 PolarHBondContact O-NE 3.21Å; H2920-E2959 IonicContact CE1-OE1 2.86Å; H2920-E2959 PolarHBondContact CE1-OE1 3.03Å; H2920-E2959 IonicContact ND1-OE1 2.76Å; H2920-E2959 PolarHBondContact ND1-OE1 3.37Å
2921	D	66.8	Low	78.5	Confident	94.5 Å²	94.5	54.3 Å²	54.3	51%	0.505	27%	0.272	S	S	.	.	G	3₁₀ helix	trans	-65.2	-16.2	175.1	-82.3	-9.7	0	0	0	114.3	A2919 R2923 K2924	A2919-D2921 PolarHBondContact O-N 3.34Å; D2921-R2923 PolarHBondContact O-N 3.45Å; D2921-R2923 VanDerWaalsContact O-N 3.16Å; D2921-K2924 HydrophobicContact CB-CD 4.28Å; D2921-K2924 VanDerWaalsContact O-CB 3.3Å; D2921-K2924 WeakPolarHBondContact O-CB 3.46Å; D2921-K2924 PolarHBondContact O-N 2.93Å; D2921-K2924 WeakPolarHBondContact OD1-CD 3.36Å; D2921-K2924 WeakPolarHBondContact OD1-CE 3.39Å; D2921-K2924 IonicContact OD1-NZ 3.36Å; D2921-K2924 PolarHBondContact OD1-NZ 3.12Å; D2921-K2924 IonicContact OD2-NZ 2.81Å; D2921-K2924 PolarHBondContact OD2-NZ 3.32Å
2922	L	67.7	Low	79.2	Confident	17.5 Å²	17.5	52.6 Å²	52.6	9%	0.092	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-56.6	-28.9	169	-69.3	178	0	0	0	111.8	F2915 N2916 A2919 H2920 K2924 I2925 I2958 N2988	F2915-L2922 HydrophobicContact CD2-CD2 4.39Å; F2915-L2922 HydrophobicContact CE2-CD1 4.21Å; N2916-L2922 WeakPolarHBondContact O-CD1 3.22Å; A2919-L2922 HydrophobicContact CB-CG 4.29Å; A2919-L2922 WeakPolarHBondContact O-CB 3.28Å; A2919-L2922 VanDerWaalsContact O-CG 3.29Å; A2919-L2922 WeakPolarHBondContact O-CG 3.35Å; A2919-L2922 PolarHBondContact O-N 2.91Å; H2920-L2922 PolarHBondContact O-N 3.2Å; L2922-K2924 PolarHBondContact O-N 3.35Å; L2922-K2924 VanDerWaalsContact O-N 3.15Å; L2922-I2925 HydrophobicContact CD2-CD1 3.9Å; L2922-I2925 WeakPolarHBondContact O-CB 3.49Å; L2922-I2925 PolarHBondContact O-N 3.04Å; L2922-I2925 VanDerWaalsContact O-N 3.15Å; L2922-I2958 HydrophobicContact CD1-CD1 3.74Å; L2922-N2988 PolarHBondContact O-ND2 3.38Å
2923	R	60.5	Low	79.9	Confident	145.5 Å²	145.5	50.6 Å²	50.6	55%	0.549	26%	0.258	S	S	.	.	G	3₁₀ helix	trans	-66.7	-12.2	174.4	-64.9	-172.4	-85.8	-157.5	-8.2	114.1	H2920 D2921 A2960	H2920-R2923 VanDerWaalsContact CG-NH2 3.3Å; H2920-R2923 PolarHBondContact ND1-NH2 3.13Å; H2920-R2923 WeakPolarHBondContact O-CB 3.17Å; H2920-R2923 WeakPolarHBondContact O-CG 3.48Å; H2920-R2923 PolarHBondContact O-N 3.16Å; H2920-R2923 VanDerWaalsContact O-N 3.12Å; H2920-R2923 PolarHBondContact O-NE 3.21Å; D2921-R2923 PolarHBondContact O-N 3.45Å; D2921-R2923 VanDerWaalsContact O-N 3.16Å; R2923-A2960 HydrophobicContact CG-CB 3.94Å
2924	K	57.9	Low	80.5	Confident	162 Å²	162	48.6 Å²	48.6	70%	0.704	24%	0.237	S	C	*	.	G	3₁₀ helix	trans	-88	-13.3	173.8	-60.7	172.5	178	165.3	0	112.8	D2921 L2922	D2921-K2924 HydrophobicContact CB-CD 4.28Å; D2921-K2924 VanDerWaalsContact O-CB 3.3Å; D2921-K2924 WeakPolarHBondContact O-CB 3.46Å; D2921-K2924 PolarHBondContact O-N 2.93Å; D2921-K2924 WeakPolarHBondContact OD1-CD 3.36Å; D2921-K2924 WeakPolarHBondContact OD1-CE 3.39Å; D2921-K2924 IonicContact OD1-NZ 3.36Å; D2921-K2924 PolarHBondContact OD1-NZ 3.12Å; D2921-K2924 IonicContact OD2-NZ 2.81Å; D2921-K2924 PolarHBondContact OD2-NZ 3.32Å; L2922-K2924 PolarHBondContact O-N 3.35Å; L2922-K2924 VanDerWaalsContact O-N 3.15Å
2925	I	64.7	Low	81	Confident	48 Å²	48	44.2 Å²	44.2	25%	0.246	21%	0.214	C	C	.	.	S	Bend	trans	-85.2	137.6	175	-50	178.1	0	0	0	107.7	L2911 L2922 G2927 N2988 Q3064	L2911-I2925 HydrophobicContact CD1-CD1 4.07Å; L2911-I2925 HydrophobicContact CD2-CD1 4.09Å; L2922-I2925 HydrophobicContact CD2-CD1 3.9Å; L2922-I2925 WeakPolarHBondContact O-CB 3.49Å; L2922-I2925 PolarHBondContact O-N 3.04Å; L2922-I2925 VanDerWaalsContact O-N 3.15Å; I2925-G2927 VanDerWaalsContact C-N 3.29Å; I2925-G2927 PolarHBondContact O-N 2.88Å; I2925-N2988 PolarHBondContact O-ND2 2.79Å; I2925-Q3064 HydrophobicContact CG2-CG 4.22Å
2926	S	63.1	Low	81.6	Confident	60.5 Å²	60.5	43.9 Å²	43.9	42%	0.423	21%	0.213	S	C	.	.			trans	-61	96.3	178.3	-57.2	0	0	0	0	111.7
2927	G	75	Confident	82	Confident	9 Å²	9	42.2 Å²	42.2	9%	0.093	20%	0.204	C	C	.	.			trans	-81.5	174	173.5	0	0	0	0	0	112.9	I2925 Q2986 V2987	I2925-G2927 VanDerWaalsContact C-N 3.29Å; I2925-G2927 PolarHBondContact O-N 2.88Å; G2927-Q2986 VanDerWaalsContact CA-NE2 3.34Å; G2927-Q2986 PolarHBondContact O-NE2 2.97Å; G2927-V2987 CarbonylContact C-O 3.59Å; G2927-V2987 WeakPolarHBondContact CA-O 3.37Å
2928	I	84.5	Confident	82.4	Confident	11 Å²	11	42.4 Å²	42.4	6%	0.056	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	128.7	177.3	-64.1	167.9	0	0	0	109.1	L2930 V2987 L2990 M3046 E3047 I3074	I2928-L2930 PolarHBondContact O-N 3.13Å; I2928-V2987 PolarHBondContact N-O 3.19Å; I2928-V2987 PolarHBondContact O-N 3.21Å; I2928-L2990 HydrophobicContact CD1-CB 4.43Å; I2928-L2990 HydrophobicContact CD1-CD2 3.79Å; I2928-M3046 HydrophobicContact CG2-CB 3.77Å; I2928-M3046 HydrophobicContact CG2-CG 4.09Å; I2928-E3047 CarbonylContact C-O 3.6Å; I2928-E3047 WeakPolarHBondContact CA-O 3.39Å; I2928-I3074 HydrophobicContact CD1-CD1 3.73Å; I2928-I3074 HydrophobicContact CD1-CG1 4.48Å
2929	R	88.9	Confident	82.8	Confident	57.5 Å²	57.5	40.3 Å²	40.3	22%	0.217	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	110.9	170	-178	169.9	63.3	-130.4	-3	109.9	I2931 F2985 E3047 E3049	R2929-I2931 HydrophobicContact CG-CD1 4.49Å; R2929-I2931 HydrophobicContact CG-CG1 4.29Å; R2929-F2985 CarbonylContact C-O 3.54Å; R2929-F2985 WeakPolarHBondContact CA-O 3.41Å; R2929-E3047 HydrophobicContact CB-CB 4.38Å; R2929-E3047 IonicContact CZ-OE2 3.83Å; R2929-E3047 VanDerWaalsContact CZ-OE2 3.24Å; R2929-E3047 PolarHBondContact N-O 3.3Å; R2929-E3047 IonicContact NE-OE2 3.02Å; R2929-E3047 PolarHBondContact NE-OE2 3.28Å; R2929-E3047 IonicContact NH2-OE2 2.72Å; R2929-E3047 PolarHBondContact NH2-OE2 3.33Å; R2929-E3047 PolarHBondContact O-N 2.99Å; R2929-E3049 IonicContact CZ-OE1 3.53Å; R2929-E3049 IonicContact NH1-OE1 2.71Å; R2929-E3049 PolarHBondContact NH1-OE1 2.92Å; R2929-E3049 IonicContact NH2-OE1 3.4Å
2930	L	92.6	Very high	83.6	Confident	1 Å²	1	38.8 Å²	38.8	1%	0.005	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	123.6	169.7	175.9	65.6	0	0	0	109.6	I2928 L2932 L2955 Q2984 F2985 V2987 L3015 M3046	I2928-L2930 PolarHBondContact O-N 3.13Å; L2930-L2932 HydrophobicContact CG-CB 4.43Å; L2930-L2955 HydrophobicContact CD2-CD1 4.26Å; L2930-L2955 HydrophobicContact CD2-CD2 4.09Å; L2930-Q2984 WeakPolarHBondContact O-CA 3.45Å; L2930-F2985 HydrophobicContact CB-CB 4.46Å; L2930-F2985 HydrophobicContact CD2-CD2 4.1Å; L2930-F2985 HydrophobicContact CG-CD2 4.45Å; L2930-F2985 PolarHBondContact N-O 2.77Å; L2930-F2985 PolarHBondContact O-N 3.07Å; L2930-V2987 HydrophobicContact CB-CG2 4.43Å; L2930-L3015 HydrophobicContact CD1-CD1 4.19Å; L2930-L3015 HydrophobicContact CD2-CD1 3.76Å; L2930-L3015 HydrophobicContact CD2-CD2 4.02Å; L2930-M3046 HydrophobicContact CD1-CG 4.19Å
2931	I	95.2	Very high	84.7	Confident	17.5 Å²	17.5	33.5 Å²	33.5	9%	0.09	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	118.8	168.2	-56.9	-176.4	0	0	0	108	R2929 T2982 Q2984 S3044 R3045 E3047	R2929-I2931 HydrophobicContact CG-CD1 4.49Å; R2929-I2931 HydrophobicContact CG-CG1 4.29Å; I2931-T2982 HydrophobicContact CG2-CG2 3.84Å; I2931-Q2984 HydrophobicContact CD1-CG 4.5Å; I2931-Q2984 HydrophobicContact CG1-CG 4.15Å; I2931-Q2984 HydrophobicContact CG2-CG 4.4Å; I2931-S3044 CarbonylContact O-C 3.41Å; I2931-S3044 WeakPolarHBondContact O-CA 3.27Å; I2931-R3045 HydrophobicContact CB-CB 4.43Å; I2931-R3045 PolarHBondContact N-O 3Å; I2931-R3045 PolarHBondContact O-N 2.93Å; I2931-E3047 WeakPolarHBondContact CD1-OE1 3.44Å; I2931-E3047 WeakPolarHBondContact CD1-OE2 3.25Å
2932	L	97.4	Very high	85.7	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	115	-175	178.7	62.2	0	0	0	110.6	L2930 I2934 V2953 T2982 F2983 F2985 L2995 I3042	L2930-L2932 HydrophobicContact CG-CB 4.43Å; L2932-I2934 HydrophobicContact CD1-CD1 4.3Å; L2932-I2934 HydrophobicContact CD2-CD1 4.23Å; L2932-I2934 HydrophobicContact CG-CD1 4.06Å; L2932-V2953 HydrophobicContact CD2-CG1 3.76Å; L2932-T2982 WeakPolarHBondContact O-CA 3.38Å; L2932-F2983 PolarHBondContact N-O 3.13Å; L2932-F2983 PolarHBondContact O-N 2.96Å; L2932-F2985 HydrophobicContact CD2-CE2 4.48Å; L2932-L2995 HydrophobicContact CD2-CD1 3.81Å; L2932-L2995 HydrophobicContact CD2-CD2 3.84Å; L2932-L2995 HydrophobicContact CD2-CG 4.47Å; L2932-I3042 HydrophobicContact CD1-CB 4.2Å; L2932-I3042 HydrophobicContact CD1-CD1 3.96Å; L2932-I3042 HydrophobicContact CD1-CG2 4.47Å
2933	N	98.1	Very high	86.4	Confident	29 Å²	29	34.9 Å²	34.9	16%	0.155	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	116.7	175.9	-178.9	3	0	0	0	110.4	I2935 Q2981 T2982 I3042 Y3043	N2933-I2935 PolarHBondContact O-N 3.09Å; N2933-Q2981 WeakPolarHBondContact CA-O 3.32Å; N2933-Q2981 PolarHBondContact OD1-N 2.91Å; N2933-Q2981 PolarHBondContact OD1-O 3.1Å; N2933-T2982 HydrophobicContact CB-CG2 4.36Å; N2933-T2982 WeakPolarHBondContact CB-OG1 3.16Å; N2933-T2982 VanDerWaalsContact CG-OG1 3.23Å; N2933-T2982 PolarHBondContact OD1-OG1 3.18Å; N2933-I3042 CarbonylContact O-C 3.42Å; N2933-I3042 VanDerWaalsContact O-CA 3.25Å; N2933-I3042 WeakPolarHBondContact O-CA 3.36Å; N2933-Y3043 PolarHBondContact N-O 2.92Å; N2933-Y3043 PolarHBondContact O-N 2.82Å
2934	I	98.4	Very high	87.7	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	101.4	173.1	-53.8	-55.7	0	0	0	107.7	L2932 V2951 V2953 T2967 W2979 L2980 Q2981 F2983 L2997 I3040 I3042	L2932-I2934 HydrophobicContact CD1-CD1 4.3Å; L2932-I2934 HydrophobicContact CD2-CD1 4.23Å; L2932-I2934 HydrophobicContact CG-CD1 4.06Å; I2934-V2951 HydrophobicContact CG2-CB 4.36Å; I2934-V2951 HydrophobicContact CG2-CG1 4.45Å; I2934-V2951 HydrophobicContact CG2-CG2 4.25Å; I2934-V2953 HydrophobicContact CD1-CG2 4.1Å; I2934-V2953 HydrophobicContact CG1-CG2 3.79Å; I2934-T2967 HydrophobicContact CB-CG2 4.07Å; I2934-T2967 HydrophobicContact CG1-CG2 4.34Å; I2934-T2967 HydrophobicContact CG2-CG2 4.02Å; I2934-W2979 HydrophobicContact CG2-CB 4.44Å; I2934-W2979 HydrophobicContact CG2-CD2 4.38Å; I2934-W2979 HydrophobicContact CG2-CE3 3.84Å; I2934-W2979 HydrophobicContact CG2-CZ3 4.46Å; I2934-L2980 WeakPolarHBondContact O-CA 3.37Å; I2934-L2980 PolarHBondContact O-N 3.06Å; I2934-Q2981 PolarHBondContact N-O 3.25Å; I2934-Q2981 PolarHBondContact O-N 3.23Å; I2934-Q2981 VanDerWaalsContact O-N 3.11Å; I2934-F2983 HydrophobicContact CG1-CD2 4.25Å; I2934-F2983 HydrophobicContact CG1-CE2 3.87Å; I2934-L2997 HydrophobicContact CD1-CD2 3.97Å; I2934-I3040 HydrophobicContact CG2-CG2 4.04Å; I2934-I3042 HydrophobicContact CD1-CG2 3.71Å
2935	I	98.3	Very high	89	Confident	10 Å²	10	26.7 Å²	26.7	5%	0.051	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	-60.1	-170	-62.6	169	0	0	0	110.6	D2266 N2933 W2979 L2980 Y3022 F3041	D2266-I2935 HydrophobicContact CB-CG2 4.09Å; N2933-I2935 PolarHBondContact O-N 3.09Å; I2935-W2979 PolarHBondContact O-N 3.43Å; I2935-L2980 HydrophobicContact CG2-CD2 3.9Å; I2935-L2980 PolarHBondContact O-N 3.11Å; I2935-Y3022 HydrophobicContact CD1-CD1 3.75Å; I2935-Y3022 HydrophobicContact CD1-CE1 3.74Å; I2935-F3041 HydrophobicContact CB-CD1 3.86Å; I2935-F3041 WeakPolarHBondContact CB-O 3.35Å; I2935-F3041 HydrophobicContact CD1-CD1 3.9Å; I2935-F3041 HydrophobicContact CD1-CE1 3.8Å; I2935-F3041 HydrophobicContact CG1-CD1 4.49Å; I2935-F3041 HydrophobicContact CG2-CD1 3.72Å; I2935-F3041 HydrophobicContact CG2-CE1 4.18Å; I2935-F3041 PolarHBondContact N-O 3Å
2936	S	98.2	Very high	90.1	Very high	2 Å²	2	29.5 Å²	29.5	1%	0.014	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	166.4	-171.7	68.2	0	0	0	0	112.3	D2266 P2977 I3040 F3041	D2266-S2936 WeakPolarHBondContact OD2-CB 3.21Å; D2266-S2936 PolarHBondContact OD2-OG 2.95Å; S2936-P2977 CarbonylContact C-O 3.57Å; S2936-P2977 WeakPolarHBondContact CA-O 3.2Å; S2936-P2977 VanDerWaalsContact CB-O 3.3Å; S2936-P2977 WeakPolarHBondContact CB-O 3.29Å; S2936-I3040 WeakPolarHBondContact O-CA 3.16Å; S2936-I3040 WeakPolarHBondContact O-CG2 3.37Å; S2936-F3041 PolarHBondContact N-O 3.46Å; S2936-F3041 PolarHBondContact O-N 3.25Å; S2936-F3041 WeakPolarHBondContact OG-CB 3.23Å
2937	G	96.8	Very high	91.6	Very high	2 Å²	2	27 Å²	27	2%	0.021	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	160.2	173.3	0	0	0	0	0	111.9	N2976 P2977 W2979 S3039	G2937-N2976 WeakPolarHBondContact O-CA 3.33Å; G2937-P2977 PolarHBondContact N-O 3.05Å; G2937-W2979 VanDerWaalsContact N-CZ3 3.34Å; G2937-S3039 CarbonylContact C-O 3.59Å; G2937-S3039 WeakPolarHBondContact CA-O 3.34Å
2938	Q	94.4	Very high	92.6	Very high	7 Å²	7	27.3 Å²	27.3	3%	0.033	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	124.9	168.6	-58.1	-179.5	115.5	0	0	108.4	M2263 R2264 V2940 L2975 H3024 Y3037 S3038 S3039	M2263-Q2938 HydrophobicContact CE-CB 4.14Å; M2263-Q2938 HydrophobicContact CE-CG 4.13Å; R2264-Q2938 VanDerWaalsContact NH1-OE1 3.17Å; Q2938-V2940 VanDerWaalsContact C-N 3.28Å; Q2938-V2940 PolarHBondContact O-N 3.24Å; Q2938-L2975 CarbonylContact C-O 3.58Å; Q2938-L2975 WeakPolarHBondContact CA-O 3.4Å; Q2938-H3024 PolarHBondContact NE2-CE1 2.8Å; Q2938-H3024 VanDerWaalsContact NE2-CE1 3.26Å; Q2938-Y3037 HydrophobicContact CB-CE1 4.07Å; Q2938-S3038 WeakPolarHBondContact O-CA 3.42Å; Q2938-S3039 PolarHBondContact N-O 3.13Å; Q2938-S3039 PolarHBondContact NE2-OG 3.38Å; Q2938-S3039 PolarHBondContact O-N 3.02Å
2939	F	93.2	Very high	93.2	Very high	26 Å²	26	26.8 Å²	26.8	11%	0.114	17%	0.167	C	C	.	.	S	Bend	trans	49.3	45.6	176.5	-59.7	-96.1	0	0	0	113.6	F2118 F2256 F2259 M2263 C2941 G2974 L2975 Y3037 S3038	F2118-F2939 VanDerWaalsContact O-CE1 3.22Å; F2118-F2939 WeakPolarHBondContact O-CE1 3.29Å; F2256-F2939 HydrophobicContact CE2-CZ 4.49Å; F2259-F2939 HydrophobicContact CE1-CZ 4.11Å; M2263-F2939 HydrophobicContact CE-CD2 4.14Å; M2263-F2939 HydrophobicContact CE-CE2 3.8Å; M2263-F2939 HydrophobicContact CE-CZ 4.33Å; M2263-F2939 HydrophobicContact SD-CE2 3.99Å; M2263-F2939 HydrophobicContact SD-CZ 4.32Å; F2939-C2941 VanDerWaalsContact C-N 3.32Å; F2939-C2941 PolarHBondContact O-N 2.9Å; F2939-G2974 CarbonylContact C-O 3.54Å; F2939-G2974 WeakPolarHBondContact CA-O 3.41Å; F2939-L2975 HydrophobicContact CD1-CD1 3.88Å; F2939-L2975 HydrophobicContact CD2-CD1 4.21Å; F2939-L2975 HydrophobicContact CE1-CD1 3.54Å; F2939-L2975 VanDerWaalsContact CE1-CD1 3.43Å; F2939-L2975 HydrophobicContact CE2-CD1 3.86Å; F2939-L2975 HydrophobicContact CG-CD1 4.36Å; F2939-L2975 HydrophobicContact CZ-CD1 3.73Å; F2939-L2975 PolarHBondContact N-O 2.78Å; F2939-Y3037 HydrophobicContact CB-CD1 4.24Å; F2939-Y3037 AromaticContact CD2-CD1 3.25Å; F2939-Y3037 HydrophobicContact CD2-CD1 3.25Å; F2939-Y3037 AromaticContact CD2-CE1 3.37Å; F2939-Y3037 HydrophobicContact CD2-CE1 3.37Å; F2939-Y3037 HydrophobicContact CD2-CG 4.28Å; F2939-Y3037 AromaticContact CE2-CD1 3.7Å; F2939-Y3037 HydrophobicContact CE2-CD1 3.7Å; F2939-Y3037 AromaticContact CE2-CE1 3.47Å; F2939-Y3037 HydrophobicContact CE2-CE1 3.47Å; F2939-Y3037 VanDerWaalsContact CE2-CE1 3.47Å; F2939-Y3037 AromaticContact CG-CD1 3.92Å; F2939-Y3037 HydrophobicContact CG-CD1 3.92Å; F2939-Y3037 HydrophobicContact CG-CE1 4.44Å; F2939-S3038 VanDerWaalsContact O-CB 3.28Å; F2939-S3038 WeakPolarHBondContact O-CB 3.35Å; F2939-S3038 PolarHBondContact O-OG 3.27Å
2940	V	94.4	Very high	93.7	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	16%	0.159	C	C	.	.			trans	-77.3	-19.7	-167.5	-58.7	0	0	0	0	113.4	Q2938 P2949 G2974 P2977 W2979 V2999 T3008 L3027	Q2938-V2940 VanDerWaalsContact C-N 3.28Å; Q2938-V2940 PolarHBondContact O-N 3.24Å; V2940-P2949 HydrophobicContact CG2-CB 3.8Å; V2940-P2949 HydrophobicContact CG2-CG 3.75Å; V2940-G2974 PolarHBondContact N-O 3.4Å; V2940-P2977 HydrophobicContact CG1-CG 4.45Å; V2940-P2977 HydrophobicContact CG2-CG 3.82Å; V2940-W2979 HydrophobicContact CG1-CH2 4.24Å; V2940-W2979 HydrophobicContact CG2-CH2 4.29Å; V2940-V2999 HydrophobicContact CB-CB 4.46Å; V2940-V2999 HydrophobicContact CB-CG1 3.81Å; V2940-V2999 HydrophobicContact CB-CG2 4.05Å; V2940-V2999 HydrophobicContact CG1-CG2 4.46Å; V2940-V2999 HydrophobicContact CG2-CG1 3.86Å; V2940-T3008 PolarHBondContact O-OG1 3.36Å; V2940-L3027 HydrophobicContact CG1-CD1 4.42Å
2941	C	92.9	Very high	94	Very high	4 Å²	4	24.8 Å²	24.8	3%	0.027	16%	0.159	C	C	.	.	S	Bend	trans	-117.3	91.3	168.9	-57	0	0	0	0	108.6	F2939 G2943 Q2944 A2947 T3008	F2939-C2941 VanDerWaalsContact C-N 3.32Å; F2939-C2941 PolarHBondContact O-N 2.9Å; C2941-G2943 PolarHBondContact O-N 2.91Å; C2941-Q2944 HydrophobicContact CB-CB 4.06Å; C2941-Q2944 PolarHBondContact O-N 3.19Å; C2941-A2947 HydrophobicContact CB-CB 3.63Å; C2941-T3008 HydrophobicContact CB-CG2 4.16Å; C2941-T3008 PolarHBondContact SG-OG1 2.89Å; C2941-T3008 VanDerWaalsContact SG-OG1 3.35Å
2942	P	87.1	Confident	94.1	Very high	55 Å²	55	25.5 Å²	25.5	36%	0.357	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.4	128.7	-177.3	-28.9	36.3	0	0	0	112.7	Q2944 L3035	P2942-Q2944 VanDerWaalsContact C-N 3.25Å; P2942-Q2944 PolarHBondContact O-N 3.09Å; P2942-L3035 HydrophobicContact CG-CD1 4.11Å; P2942-L3035 HydrophobicContact CG-CD2 4.2Å
2943	G	82.6	Confident	94.2	Very high	86 Å²	86	25.5 Å²	25.5	89%	0.887	16%	0.162	S	C	*	.	T	Hydrogen-bonded Turn	trans	74.6	-0.9	-177.2	0	0	0	0	0	116	C2941	C2941-G2943 PolarHBondContact O-N 2.91Å
2944	Q	87.1	Confident	94.1	Very high	92 Å²	92	25.6 Å²	25.6	43%	0.43	16%	0.162	S	C	.	.			trans	-127	76.4	-174.9	-59.8	-177.5	-15.4	0	0	111.3	C2941 P2942 D2946 A2947	C2941-Q2944 HydrophobicContact CB-CB 4.06Å; C2941-Q2944 PolarHBondContact O-N 3.19Å; P2942-Q2944 VanDerWaalsContact C-N 3.25Å; P2942-Q2944 PolarHBondContact O-N 3.09Å; Q2944-D2946 VanDerWaalsContact C-N 3.31Å; Q2944-D2946 PolarHBondContact O-N 3.39Å; Q2944-A2947 HydrophobicContact CB-CB 3.9Å; Q2944-A2947 WeakPolarHBondContact O-CB 3.34Å; Q2944-A2947 PolarHBondContact O-N 3.17Å; Q2944-A2947 VanDerWaalsContact O-N 3.15Å
2945	A	85.4	Confident	94.1	Very high	42.5 Å²	42.5	25.7 Å²	25.7	35%	0.351	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-29.1	-176.4	0	0	0	0	0	114	G2974	A2945-G2974 PolarHBondContact O-N 3.29Å
2946	D	89.2	Confident	94	Very high	107.5 Å²	107.5	25.8 Å²	25.8	58%	0.575	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.5	14.2	177.8	-2	-46.7	0	0	0	113.7	Q2944 R2972	Q2944-D2946 VanDerWaalsContact C-N 3.31Å; Q2944-D2946 PolarHBondContact O-N 3.39Å; D2946-R2972 VanDerWaalsContact O-CA 3.32Å; D2946-R2972 WeakPolarHBondContact O-CA 3.46Å
2947	A	93.1	Very high	93.7	Very high	7.5 Å²	7.5	26.3 Å²	26.3	6%	0.062	17%	0.168	C	C	.	.			trans	-59.4	157.9	170.4	0	0	0	0	0	112.7	C2941 Q2944 P2949 R2972 N2973 G2974 E3001	C2941-A2947 HydrophobicContact CB-CB 3.63Å; Q2944-A2947 HydrophobicContact CB-CB 3.9Å; Q2944-A2947 WeakPolarHBondContact O-CB 3.34Å; Q2944-A2947 PolarHBondContact O-N 3.17Å; Q2944-A2947 VanDerWaalsContact O-N 3.15Å; A2947-P2949 VanDerWaalsContact C-CD 3.49Å; A2947-P2949 VanDerWaalsContact O-CD 3.24Å; A2947-P2949 WeakPolarHBondContact O-CD 3.41Å; A2947-R2972 CarbonylContact O-C 3.45Å; A2947-R2972 VanDerWaalsContact O-CA 3.27Å; A2947-R2972 WeakPolarHBondContact O-CA 3.35Å; A2947-N2973 CarbonylContact O-C 3.53Å; A2947-N2973 VanDerWaalsContact O-C 3.29Å; A2947-N2973 PolarHBondContact O-N 3.27Å; A2947-G2974 PolarHBondContact O-N 2.96Å; A2947-E3001 HydrophobicContact CB-CG 4Å
2948	S	97.1	Very high	93.4	Very high	15.5 Å²	15.5	26.4 Å²	26.4	11%	0.108	17%	0.168	C	C	.	.			trans	-113.9	81	177	-57.1	0	0	0	0	112.2	T2969 V2970 R2972 E3001 S3002	S2948-T2969 VanDerWaalsContact O-CG2 3.29Å; S2948-T2969 WeakPolarHBondContact O-CG2 3.44Å; S2948-V2970 CarbonylContact C-O 3.56Å; S2948-V2970 WeakPolarHBondContact CA-O 3.25Å; S2948-V2970 WeakPolarHBondContact CB-O 3.43Å; S2948-R2972 PolarHBondContact OG-N 2.8Å; S2948-E3001 PolarHBondContact N-OE1 3.07Å; S2948-S3002 WeakPolarHBondContact O-CB 3.24Å; S2948-S3002 PolarHBondContact O-N 3.4Å
2949	P	97.7	Very high	93.1	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	147.7	-171.1	33.2	-37.7	0	0	0	114.5	V2940 A2947 V2970 N2973 P2977 W2979 V2999 I3000	V2940-P2949 HydrophobicContact CG2-CB 3.8Å; V2940-P2949 HydrophobicContact CG2-CG 3.75Å; A2947-P2949 VanDerWaalsContact C-CD 3.49Å; A2947-P2949 VanDerWaalsContact O-CD 3.24Å; A2947-P2949 WeakPolarHBondContact O-CD 3.41Å; P2949-V2970 WeakPolarHBondContact CD-O 3.35Å; P2949-V2970 PolarHBondContact O-N 2.91Å; P2949-N2973 WeakPolarHBondContact CD-O 3.34Å; P2949-N2973 WeakPolarHBondContact CG-O 3.22Å; P2949-P2977 HydrophobicContact CG-CB 4.09Å; P2949-P2977 HydrophobicContact CG-CG 4Å; P2949-W2979 HydrophobicContact CB-CZ2 4.12Å; P2949-W2979 HydrophobicContact CG-CZ2 4.08Å; P2949-W2979 PolarHBondContact O-NE1 2.9Å; P2949-V2999 HydrophobicContact CB-CG1 3.86Å; P2949-I3000 WeakPolarHBondContact CA-O 3.36Å
2950	Y	98.1	Very high	92.7	Very high	17.5 Å²	17.5	30.8 Å²	30.8	7%	0.069	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	167.2	155.8	69.8	-89.8	0	0	0	110.5	E2952 R2966 V2999 I3000	Y2950-E2952 HydrophobicContact CD2-CG 4.09Å; Y2950-E2952 HydrophobicContact CE2-CG 3.72Å; Y2950-E2952 VanDerWaalsContact CE2-CG 3.43Å; Y2950-E2952 VanDerWaalsContact CE2-OE1 3.24Å; Y2950-E2952 WeakPolarHBondContact CE2-OE1 3.46Å; Y2950-E2952 PolarHBondContact OH-OE1 3.12Å; Y2950-R2966 HydrophobicContact CD2-CB 4.07Å; Y2950-R2966 HydrophobicContact CE2-CB 4.19Å; Y2950-V2999 WeakPolarHBondContact O-CA 3.26Å; Y2950-I3000 HydrophobicContact CD1-CB 4.13Å; Y2950-I3000 HydrophobicContact CD1-CG2 4.48Å; Y2950-I3000 HydrophobicContact CD2-CB 4.21Å; Y2950-I3000 HydrophobicContact CD2-CG1 4.4Å; Y2950-I3000 HydrophobicContact CE1-CB 3.66Å; Y2950-I3000 HydrophobicContact CE1-CG1 4.36Å; Y2950-I3000 HydrophobicContact CE1-CG2 3.7Å; Y2950-I3000 HydrophobicContact CE2-CB 3.91Å; Y2950-I3000 HydrophobicContact CE2-CG1 3.9Å; Y2950-I3000 HydrophobicContact CE2-CG2 4.32Å; Y2950-I3000 HydrophobicContact CG-CB 4.47Å; Y2950-I3000 PolarHBondContact N-O 2.85Å; Y2950-I3000 PolarHBondContact O-N 3.3Å; Y2950-I3000 WeakPolarHBondContact OH-CG2 3.24Å
2951	V	98.5	Very high	92.5	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	122.7	177.7	-178.3	0	0	0	0	109.2	I2934 V2953 R2966 T2967 W2979 L2997 A2998 V2999 I3040	I2934-V2951 HydrophobicContact CG2-CB 4.36Å; I2934-V2951 HydrophobicContact CG2-CG1 4.45Å; I2934-V2951 HydrophobicContact CG2-CG2 4.25Å; V2951-V2953 HydrophobicContact CG1-CG2 4.11Å; V2951-R2966 CarbonylContact O-C 3.51Å; V2951-R2966 WeakPolarHBondContact O-CA 3.34Å; V2951-T2967 HydrophobicContact CB-CG2 3.99Å; V2951-T2967 PolarHBondContact N-OG1 3.43Å; V2951-T2967 PolarHBondContact O-N 2.99Å; V2951-W2979 HydrophobicContact CG2-CD2 4.14Å; V2951-W2979 HydrophobicContact CG2-CE3 4.01Å; V2951-W2979 HydrophobicContact CG2-CH2 3.45Å; V2951-W2979 VanDerWaalsContact CG2-CH2 3.45Å; V2951-W2979 HydrophobicContact CG2-CZ2 3.61Å; V2951-W2979 HydrophobicContact CG2-CZ3 3.66Å; V2951-L2997 HydrophobicContact CG1-CB 4.49Å; V2951-L2997 HydrophobicContact CG1-CD2 4.45Å; V2951-A2998 CarbonylContact C-O 3.58Å; V2951-A2998 VanDerWaalsContact CA-O 3.3Å; V2951-A2998 WeakPolarHBondContact CA-O 3.37Å; V2951-V2999 HydrophobicContact CG2-CG2 4.49Å; V2951-I3040 HydrophobicContact CG1-CD1 3.97Å; V2951-I3040 HydrophobicContact CG2-CD1 4.03Å
2952	E	98.3	Very high	92.5	Very high	31.5 Å²	31.5	33.3 Å²	33.3	15%	0.147	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	133.3	161.5	-64.8	-174.9	155.8	0	0	109	Y2950 K2964 E2965 R2966 R2996 L2997 A2998 I3000	Y2950-E2952 HydrophobicContact CD2-CG 4.09Å; Y2950-E2952 HydrophobicContact CE2-CG 3.72Å; Y2950-E2952 VanDerWaalsContact CE2-CG 3.43Å; Y2950-E2952 VanDerWaalsContact CE2-OE1 3.24Å; Y2950-E2952 WeakPolarHBondContact CE2-OE1 3.46Å; Y2950-E2952 PolarHBondContact OH-OE1 3.12Å; E2952-K2964 WeakPolarHBondContact OE1-CE 3.34Å; E2952-K2964 IonicContact OE1-NZ 2.74Å; E2952-K2964 PolarHBondContact OE1-NZ 2.82Å; E2952-E2965 WeakPolarHBondContact CA-O 3.43Å; E2952-R2966 HydrophobicContact CG-CB 4.27Å; E2952-R2996 IonicContact OE2-CZ 2.72Å; E2952-R2996 IonicContact OE2-NH1 2.73Å; E2952-R2996 PolarHBondContact OE2-NH1 3.28Å; E2952-R2996 IonicContact OE2-NH2 3.61Å; E2952-R2996 PolarHBondContact OE2-NH2 2.85Å; E2952-L2997 WeakPolarHBondContact O-CA 3.36Å; E2952-A2998 HydrophobicContact CB-CB 4.37Å; E2952-A2998 PolarHBondContact N-O 3.19Å; E2952-A2998 PolarHBondContact O-N 2.92Å; E2952-I3000 HydrophobicContact CG-CD1 4.46Å; E2952-I3000 HydrophobicContact CG-CG1 3.87Å
2953	V	98.3	Very high	92.8	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	113.3	179.9	-178.4	0	0	0	0	106.8	L2932 I2934 V2951 E2965 F2983 F2985 L2995 L2997	L2932-V2953 HydrophobicContact CD2-CG1 3.76Å; I2934-V2953 HydrophobicContact CD1-CG2 4.1Å; I2934-V2953 HydrophobicContact CG1-CG2 3.79Å; V2951-V2953 HydrophobicContact CG1-CG2 4.11Å; V2953-E2965 HydrophobicContact CB-CB 4.43Å; V2953-E2965 PolarHBondContact N-O 3.07Å; V2953-E2965 PolarHBondContact O-N 3.05Å; V2953-F2983 HydrophobicContact CB-CE2 4.44Å; V2953-F2983 HydrophobicContact CG2-CD2 4.26Å; V2953-F2983 HydrophobicContact CG2-CE2 3.78Å; V2953-F2983 HydrophobicContact CG2-CZ 4.27Å; V2953-F2985 HydrophobicContact CG1-CE2 4.13Å; V2953-F2985 HydrophobicContact CG1-CZ 4.01Å; V2953-L2995 HydrophobicContact CG1-CD1 4Å; V2953-L2997 HydrophobicContact CB-CD2 4.35Å; V2953-L2997 HydrophobicContact CG1-CD2 4.11Å; V2953-L2997 HydrophobicContact CG2-CD2 3.96Å
2954	E	97.8	Very high	93.5	Very high	32 Å²	32	38.6 Å²	38.6	15%	0.15	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	121	-171.1	-174.6	179.8	-154.6	0	0	109.5	M2956 W2963 K2964 R2996	E2954-M2956 HydrophobicContact CG-CG 3.89Å; E2954-W2963 CarbonylContact C-O 3.47Å; E2954-W2963 VanDerWaalsContact CA-O 3.27Å; E2954-W2963 WeakPolarHBondContact CA-O 3.42Å; E2954-K2964 HydrophobicContact CB-CG 4.43Å; E2954-K2964 HydrophobicContact CG-CB 4.41Å; E2954-K2964 HydrophobicContact CG-CG 4.32Å; E2954-K2964 VanDerWaalsContact OE1-CD 3.28Å; E2954-K2964 WeakPolarHBondContact OE1-CD 3.31Å; E2954-K2964 WeakPolarHBondContact OE1-CE 3.21Å; E2954-K2964 IonicContact OE1-NZ 3.25Å; E2954-K2964 PolarHBondContact OE1-NZ 3.01Å; E2954-R2996 HydrophobicContact CB-CB 4.18Å; E2954-R2996 PolarHBondContact N-O 3.41Å; E2954-R2996 PolarHBondContact O-N 3.06Å; E2954-R2996 VanDerWaalsContact OE2-CD 3.3Å; E2954-R2996 WeakPolarHBondContact OE2-CD 3.41Å; E2954-R2996 IonicContact OE2-CZ 3.39Å; E2954-R2996 IonicContact OE2-NE 3.59Å; E2954-R2996 IonicContact OE2-NH1 3.17Å; E2954-R2996 PolarHBondContact OE2-NH1 2.89Å
2955	L	96.9	Very high	94	Very high	2 Å²	2	38.3 Å²	38.3	1%	0.01	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	126.8	166.7	-68.3	-178.2	0	0	0	108.3	L2930 D2961 S2962 W2963 F2985 V2987 F2994 L2995 L3015	L2930-L2955 HydrophobicContact CD2-CD1 4.26Å; L2930-L2955 HydrophobicContact CD2-CD2 4.09Å; L2955-D2961 WeakPolarHBondContact CB-O 3.24Å; L2955-S2962 WeakPolarHBondContact O-CA 3.37Å; L2955-W2963 HydrophobicContact CB-CB 4.37Å; L2955-W2963 PolarHBondContact N-O 3Å; L2955-W2963 PolarHBondContact O-N 2.8Å; L2955-F2985 HydrophobicContact CD1-CB 3.44Å; L2955-F2985 VanDerWaalsContact CD1-CB 3.44Å; L2955-F2985 HydrophobicContact CD1-CD1 4.03Å; L2955-F2985 HydrophobicContact CD1-CD2 3.76Å; L2955-F2985 HydrophobicContact CD1-CE2 4.47Å; L2955-F2985 HydrophobicContact CD1-CG 3.48Å; L2955-F2985 VanDerWaalsContact CD1-CG 3.48Å; L2955-F2985 HydrophobicContact CG-CD2 4.39Å; L2955-F2985 HydrophobicContact CG-CG 4.39Å; L2955-V2987 HydrophobicContact CD1-CG2 4.11Å; L2955-F2994 WeakPolarHBondContact CA-O 3.42Å; L2955-L2995 HydrophobicContact CD2-CB 4.15Å; L2955-L2995 HydrophobicContact CD2-CD1 3.87Å; L2955-L3015 HydrophobicContact CD2-CD2 4.35Å
2956	M	96.2	Very high	94.6	Very high	12.5 Å²	12.5	42.7 Å²	42.7	6%	0.062	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	119.8	-178.7	-50.8	171.1	-63	0	0	107.6	L2861 I2880 I2884 E2954 F2994 R2996 V3012	L2861-M2956 HydrophobicContact CD1-CB 3.55Å; I2880-M2956 HydrophobicContact CG2-SD 4.37Å; I2884-M2956 HydrophobicContact CD1-CE 4.03Å; I2884-M2956 HydrophobicContact CD1-SD 3.72Å; I2884-M2956 HydrophobicContact CG1-CE 3.71Å; I2884-M2956 HydrophobicContact CG1-SD 4.07Å; E2954-M2956 HydrophobicContact CG-CG 3.89Å; M2956-F2994 HydrophobicContact CE-CB 3.83Å; M2956-F2994 PolarHBondContact N-O 3.25Å; M2956-F2994 PolarHBondContact O-N 2.92Å; M2956-R2996 HydrophobicContact CE-CB 3.63Å; M2956-R2996 HydrophobicContact SD-CB 4.05Å; M2956-V3012 HydrophobicContact CE-CG1 3.7Å; M2956-V3012 HydrophobicContact CE-CG2 4.24Å
2957	G	92.2	Very high	95	Very high	12 Å²	12	37.9 Å²	37.9	12%	0.124	18%	0.179	C	C	.	.	S	Bend	trans	-164	-135.4	-177.3	0	0	0	0	0	112.4	S2962 L2992	G2957-S2962 PolarHBondContact N-OG 2.74Å; G2957-L2992 WeakPolarHBondContact CA-O 3.26Å
2958	I	90.6	Very high	95.2	Very high	3 Å²	3	45.5 Å²	45.5	2%	0.015	21%	0.211	C	C	.	.	S	Bend	trans	-68.8	159.7	161	59.8	168.6	0	0	0	109.9	T2865 P2917 L2922 A2960 D2961 S2962 N2988 F2989	T2865-I2958 HydrophobicContact CG2-CG2 3.62Å; P2917-I2958 HydrophobicContact CB-CG2 3.99Å; L2922-I2958 HydrophobicContact CD1-CD1 3.74Å; I2958-A2960 VanDerWaalsContact C-N 3.28Å; I2958-A2960 HydrophobicContact CD1-CB 4.09Å; I2958-A2960 HydrophobicContact CG1-CB 4.4Å; I2958-A2960 PolarHBondContact O-N 3.04Å; I2958-A2960 VanDerWaalsContact O-N 3.12Å; I2958-D2961 HydrophobicContact CG1-CB 3.8Å; I2958-D2961 VanDerWaalsContact CG1-CG 3.48Å; I2958-D2961 WeakPolarHBondContact O-CA 3.09Å; I2958-D2961 PolarHBondContact O-N 2.94Å; I2958-S2962 PolarHBondContact O-N 3.12Å; I2958-S2962 VanDerWaalsContact O-N 3.14Å; I2958-S2962 PolarHBondContact O-OG 3.2Å; I2958-N2988 HydrophobicContact CD1-CB 4.46Å; I2958-F2989 HydrophobicContact CD1-CB 3.69Å; I2958-F2989 HydrophobicContact CG1-CB 4.06Å; I2958-F2989 HydrophobicContact CG2-CB 4.4Å; I2958-F2989 HydrophobicContact CG2-CD1 3.95Å; I2958-F2989 HydrophobicContact CG2-CG 4.5Å
2959	E	88.3	Confident	95.2	Very high	109 Å²	109	47.1 Å²	47.1	51%	0.509	22%	0.22	S	C	.	.	G	3₁₀ helix	trans	-55.6	-37.7	-178.5	-167.9	-168.6	131.2	0	0	112.8	H2920 D2961 S2962	H2920-E2959 IonicContact CE1-OE1 2.86Å; H2920-E2959 PolarHBondContact CE1-OE1 3.03Å; H2920-E2959 IonicContact ND1-OE1 2.76Å; H2920-E2959 PolarHBondContact ND1-OE1 3.37Å; E2959-D2961 VanDerWaalsContact C-N 3.29Å; E2959-D2961 PolarHBondContact O-N 3.2Å; E2959-D2961 VanDerWaalsContact O-N 3.16Å; E2959-S2962 PolarHBondContact O-N 2.69Å
2960	A	85.9	Confident	95.2	Very high	17 Å²	17	48.3 Å²	48.3	14%	0.14	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-67.7	-18.6	176.8	0	0	0	0	0	114.8	R2923 I2958 N2988	R2923-A2960 HydrophobicContact CG-CB 3.94Å; I2958-A2960 VanDerWaalsContact C-N 3.28Å; I2958-A2960 HydrophobicContact CD1-CB 4.09Å; I2958-A2960 HydrophobicContact CG1-CB 4.4Å; I2958-A2960 PolarHBondContact O-N 3.04Å; I2958-A2960 VanDerWaalsContact O-N 3.12Å; A2960-N2988 PolarHBondContact O-ND2 2.91Å
2961	D	89.4	Confident	95.1	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-106.5	-4.3	-177.9	-70	9.6	0	0	0	112.3	L2955 I2958 E2959 W2963 V2987 N2988 F2989	L2955-D2961 WeakPolarHBondContact CB-O 3.24Å; I2958-D2961 HydrophobicContact CG1-CB 3.8Å; I2958-D2961 VanDerWaalsContact CG1-CG 3.48Å; I2958-D2961 WeakPolarHBondContact O-CA 3.09Å; I2958-D2961 PolarHBondContact O-N 2.94Å; E2959-D2961 VanDerWaalsContact C-N 3.29Å; E2959-D2961 PolarHBondContact O-N 3.2Å; E2959-D2961 VanDerWaalsContact O-N 3.16Å; D2961-W2963 VanDerWaalsContact O-CD1 3.31Å; D2961-V2987 WeakPolarHBondContact OD2-CG1 3.14Å; D2961-N2988 VanDerWaalsContact OD1-CB 3.32Å; D2961-N2988 WeakPolarHBondContact OD1-CB 3.43Å; D2961-N2988 PolarHBondContact OD1-N 3.01Å; D2961-N2988 PolarHBondContact OD1-ND2 3.1Å; D2961-N2988 PolarHBondContact OD2-N 3.06Å; D2961-F2989 WeakPolarHBondContact OD2-CA 3.46Å; D2961-F2989 PolarHBondContact OD2-N 2.96Å
2962	S	92.5	Very high	94.9	Very high	56 Å²	56	61.3 Å²	61.3	39%	0.392	28%	0.282	S	S	.	.			trans	-85.1	124.1	-173.9	-67.4	0	0	0	0	111.3	L2955 G2957 I2958 E2959	L2955-S2962 WeakPolarHBondContact O-CA 3.37Å; G2957-S2962 PolarHBondContact N-OG 2.74Å; I2958-S2962 PolarHBondContact O-N 3.12Å; I2958-S2962 VanDerWaalsContact O-N 3.14Å; I2958-S2962 PolarHBondContact O-OG 3.2Å; E2959-S2962 PolarHBondContact O-N 2.69Å
2963	W	94.4	Very high	94.7	Very high	128 Å²	128	60 Å²	60	49%	0.485	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	141.7	-177.2	-68.6	90.6	0	0	0	110.3	E2954 L2955 D2961 F2985	E2954-W2963 CarbonylContact C-O 3.47Å; E2954-W2963 VanDerWaalsContact CA-O 3.27Å; E2954-W2963 WeakPolarHBondContact CA-O 3.42Å; L2955-W2963 HydrophobicContact CB-CB 4.37Å; L2955-W2963 PolarHBondContact N-O 3Å; L2955-W2963 PolarHBondContact O-N 2.8Å; D2961-W2963 VanDerWaalsContact O-CD1 3.31Å; W2963-F2985 HydrophobicContact CB-CD1 3.68Å; W2963-F2985 HydrophobicContact CB-CE1 3.75Å; W2963-F2985 HydrophobicContact CD2-CD1 4.17Å; W2963-F2985 AromaticContact CG-CD1 3.68Å; W2963-F2985 HydrophobicContact CG-CD1 3.68Å; W2963-F2985 HydrophobicContact CG-CE1 4.22Å
2964	K	96.7	Very high	94.4	Very high	124.5 Å²	124.5	60.1 Å²	60.1	54%	0.541	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	122.2	174.7	-170.4	176.1	-176.3	165.7	0	110.2	E2952 E2954	E2952-K2964 WeakPolarHBondContact OE1-CE 3.34Å; E2952-K2964 IonicContact OE1-NZ 2.74Å; E2952-K2964 PolarHBondContact OE1-NZ 2.82Å; E2954-K2964 HydrophobicContact CB-CG 4.43Å; E2954-K2964 HydrophobicContact CG-CB 4.41Å; E2954-K2964 HydrophobicContact CG-CG 4.32Å; E2954-K2964 VanDerWaalsContact OE1-CD 3.28Å; E2954-K2964 WeakPolarHBondContact OE1-CD 3.31Å; E2954-K2964 WeakPolarHBondContact OE1-CE 3.21Å; E2954-K2964 IonicContact OE1-NZ 3.25Å; E2954-K2964 PolarHBondContact OE1-NZ 3.01Å
2965	E	97.3	Very high	94.2	Very high	86.5 Å²	86.5	59.1 Å²	59.1	40%	0.404	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	161.7	-172.8	-90.8	-68.3	179.2	0	0	110.8	E2952 V2953 F2983 F2985	E2952-E2965 WeakPolarHBondContact CA-O 3.43Å; V2953-E2965 HydrophobicContact CB-CB 4.43Å; V2953-E2965 PolarHBondContact N-O 3.07Å; V2953-E2965 PolarHBondContact O-N 3.05Å; E2965-F2983 HydrophobicContact CB-CD1 3.79Å; E2965-F2983 HydrophobicContact CB-CE1 3.64Å; E2965-F2983 HydrophobicContact CB-CZ 4.4Å; E2965-F2983 HydrophobicContact CG-CD1 3.89Å; E2965-F2983 HydrophobicContact CG-CE1 4.07Å; E2965-F2983 WeakPolarHBondContact OE2-CE1 3.37Å; E2965-F2985 HydrophobicContact CB-CE1 4.38Å; E2965-F2985 HydrophobicContact CB-CZ 4.25Å; E2965-F2985 HydrophobicContact CG-CE1 4.13Å; E2965-F2985 HydrophobicContact CG-CZ 4.31Å
2966	R	97.2	Very high	94.2	Very high	135 Å²	135	59.2 Å²	59.2	51%	0.509	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	146.6	177.7	65.4	178	174.5	-177.6	-4.5	115	D2650 Y2950 V2951 E2952 Q2981	D2650-R2966 IonicContact OD1-CZ 2.83Å; D2650-R2966 IonicContact OD1-NH1 3.21Å; D2650-R2966 IonicContact OD1-NH2 3.35Å; D2650-R2966 PolarHBondContact OD1-NH2 3Å; D2650-R2966 IonicContact OD2-CZ 2.81Å; D2650-R2966 IonicContact OD2-NH1 2.67Å; D2650-R2966 PolarHBondContact OD2-NH1 2.81Å; D2650-R2966 IonicContact OD2-NH2 3.52Å; D2650-R2966 PolarHBondContact OD2-NH2 3.1Å; Y2950-R2966 HydrophobicContact CD2-CB 4.07Å; Y2950-R2966 HydrophobicContact CE2-CB 4.19Å; V2951-R2966 CarbonylContact O-C 3.51Å; V2951-R2966 WeakPolarHBondContact O-CA 3.34Å; E2952-R2966 HydrophobicContact CG-CB 4.27Å; R2966-Q2981 PolarHBondContact O-NE2 3.09Å
2967	T	98.4	Very high	94.2	Very high	6 Å²	6	58.6 Å²	58.6	4%	0.037	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-76.9	161.4	173	70.9	0	0	0	0	112.1	I2934 V2951 W2979 Q2981 F2983	I2934-T2967 HydrophobicContact CB-CG2 4.07Å; I2934-T2967 HydrophobicContact CG1-CG2 4.34Å; I2934-T2967 HydrophobicContact CG2-CG2 4.02Å; V2951-T2967 HydrophobicContact CB-CG2 3.99Å; V2951-T2967 PolarHBondContact N-OG1 3.43Å; V2951-T2967 PolarHBondContact O-N 2.99Å; T2967-W2979 HydrophobicContact CG2-CB 4.3Å; T2967-W2979 HydrophobicContact CG2-CG 4.29Å; T2967-W2979 VanDerWaalsContact OG1-CD1 3.29Å; T2967-W2979 PolarHBondContact OG1-NE1 2.86Å; T2967-Q2981 VanDerWaalsContact CA-OE1 3.27Å; T2967-Q2981 HydrophobicContact CG2-CB 4.23Å; T2967-F2983 HydrophobicContact CG2-CE2 4.06Å; T2967-F2983 HydrophobicContact CG2-CZ 4.03Å
2968	K	97.4	Very high	94.5	Very high	168 Å²	168	59.6 Å²	59.6	73%	0.73	27%	0.272	S	S	*	.	P	Polyproline II helix	trans	-63.8	140.4	167.8	-64.2	172.5	-175.5	173.1	0	111.1	V2970 W2979 Q2981	K2968-V2970 PolarHBondContact O-N 3.37Å; K2968-W2979 PolarHBondContact O-NE1 3.04Å; K2968-Q2981 VanDerWaalsContact N-OE1 3.16Å
2969	T	97.8	Very high	94.9	Very high	49 Å²	49	60.7 Å²	60.7	30%	0.301	28%	0.276	S	S	.	.	P	Polyproline II helix	trans	-65.3	126.2	175.1	-49.7	0	0	0	0	112.2	S2948	S2948-T2969 VanDerWaalsContact O-CG2 3.29Å; S2948-T2969 WeakPolarHBondContact O-CG2 3.44Å
2970	V	97.3	Very high	95.3	Very high	24 Å²	24	61 Å²	61	15%	0.145	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-87	123.7	169.2	175.7	0	0	0	0	108.5	S2948 P2949 K2968 N2973 P2977 I2978 W2979	S2948-V2970 CarbonylContact C-O 3.56Å; S2948-V2970 WeakPolarHBondContact CA-O 3.25Å; S2948-V2970 WeakPolarHBondContact CB-O 3.43Å; P2949-V2970 WeakPolarHBondContact CD-O 3.35Å; P2949-V2970 PolarHBondContact O-N 2.91Å; K2968-V2970 PolarHBondContact O-N 3.37Å; V2970-N2973 HydrophobicContact CG1-CB 3.98Å; V2970-P2977 HydrophobicContact CB-CB 3.94Å; V2970-P2977 HydrophobicContact CG1-CB 3.93Å; V2970-P2977 HydrophobicContact CG2-CB 3.99Å; V2970-I2978 WeakPolarHBondContact CG2-O 3.38Å; V2970-W2979 HydrophobicContact CG2-CG 4.32Å
2971	Q	95.8	Very high	95.8	Very high	121.5 Å²	121.5	62.2 Å²	62.2	57%	0.568	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	120.5	-172.5	-66.4	-67.2	-39.7	0	0	112.1	N2973	Q2971-N2973 PolarHBondContact O-N 3Å
2972	R	93.9	Very high	96.2	Very high	170 Å²	170	65.8 Å²	65.8	64%	0.642	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.3	54	176	-58.6	-179.6	-122.1	-173.7	-1.7	114.4	Q2369 D2946 A2947 S2948	Q2369-R2972 PolarHBondContact NE2-O 3.25Å; D2946-R2972 VanDerWaalsContact O-CA 3.32Å; D2946-R2972 WeakPolarHBondContact O-CA 3.46Å; A2947-R2972 CarbonylContact O-C 3.45Å; A2947-R2972 VanDerWaalsContact O-CA 3.27Å; A2947-R2972 WeakPolarHBondContact O-CA 3.35Å; S2948-R2972 PolarHBondContact OG-N 2.8Å
2973	N	94.7	Very high	96.5	Very high	5 Å²	5	63.7 Å²	63.7	3%	0.027	29%	0.289	C	S	.	.			trans	-153.8	88.9	170	-171.7	-6.7	0	0	0	111.4	Q2369 A2947 P2949 V2970 Q2971 L2975 N2976 P2977	Q2369-N2973 PolarHBondContact OE1-ND2 2.81Å; A2947-N2973 CarbonylContact O-C 3.53Å; A2947-N2973 VanDerWaalsContact O-C 3.29Å; A2947-N2973 PolarHBondContact O-N 3.27Å; P2949-N2973 WeakPolarHBondContact CD-O 3.34Å; P2949-N2973 WeakPolarHBondContact CG-O 3.22Å; V2970-N2973 HydrophobicContact CG1-CB 3.98Å; Q2971-N2973 PolarHBondContact O-N 3Å; N2973-L2975 VanDerWaalsContact C-N 3.34Å; N2973-L2975 PolarHBondContact OD1-N 2.98Å; N2973-L2975 VanDerWaalsContact OD1-N 3.14Å; N2973-N2976 PolarHBondContact ND2-O 3.22Å; N2973-N2976 PolarHBondContact ND2-OD1 2.91Å; N2973-N2976 PolarHBondContact OD1-N 2.83Å; N2973-N2976 PolarHBondContact OD1-OD1 3.27Å; N2973-N2976 VanDerWaalsContact OD1-OD1 3.12Å; N2973-P2977 WeakPolarHBondContact O-CB 3.34Å; N2973-P2977 WeakPolarHBondContact O-CD 3.37Å
2974	G	92.6	Very high	96.5	Very high	1 Å²	1	63.6 Å²	63.6	1%	0.01	29%	0.294	C	S	.	.	S	Bend	trans	-83.7	-9.5	168.1	0	0	0	0	0	114	F2939 V2940 A2945 A2947	F2939-G2974 CarbonylContact C-O 3.54Å; F2939-G2974 WeakPolarHBondContact CA-O 3.41Å; V2940-G2974 PolarHBondContact N-O 3.4Å; A2945-G2974 PolarHBondContact O-N 3.29Å; A2947-G2974 PolarHBondContact O-N 2.96Å
2975	L	93.1	Very high	96.3	Very high	11 Å²	11	58.1 Å²	58.1	6%	0.058	27%	0.27	C	S	.	.	S	Bend	trans	-82.4	-56.3	-175.3	177.2	67.1	0	0	0	112.7	F2259 M2263 Q2938 F2939 N2973	F2259-L2975 HydrophobicContact CE1-CD1 4.35Å; F2259-L2975 HydrophobicContact CZ-CD1 4.31Å; F2259-L2975 HydrophobicContact CZ-CD2 4.03Å; M2263-L2975 HydrophobicContact CE-CD1 4.18Å; M2263-L2975 HydrophobicContact CE-CG 4.27Å; M2263-L2975 VanDerWaalsContact CE-O 3.27Å; M2263-L2975 WeakPolarHBondContact CE-O 3.33Å; Q2938-L2975 CarbonylContact C-O 3.58Å; Q2938-L2975 WeakPolarHBondContact CA-O 3.4Å; F2939-L2975 HydrophobicContact CD1-CD1 3.88Å; F2939-L2975 HydrophobicContact CD2-CD1 4.21Å; F2939-L2975 HydrophobicContact CE1-CD1 3.54Å; F2939-L2975 VanDerWaalsContact CE1-CD1 3.43Å; F2939-L2975 HydrophobicContact CE2-CD1 3.86Å; F2939-L2975 HydrophobicContact CG-CD1 4.36Å; F2939-L2975 HydrophobicContact CZ-CD1 3.73Å; F2939-L2975 PolarHBondContact N-O 2.78Å; N2973-L2975 VanDerWaalsContact C-N 3.34Å; N2973-L2975 PolarHBondContact OD1-N 2.98Å; N2973-L2975 VanDerWaalsContact OD1-N 3.14Å
2976	N	95.6	Very high	95.8	Very high	4 Å²	4	57.9 Å²	57.9	2%	0.021	27%	0.269	C	S	.	.	S	Bend	trans	-141.8	56.5	-177.8	65.9	-10.7	0	0	0	113.2	M2263 Q2369 N2370 G2937 N2973	M2263-N2976 HydrophobicContact CB-CB 4.38Å; M2263-N2976 HydrophobicContact CE-CB 3.96Å; M2263-N2976 PolarHBondContact O-ND2 3.03Å; Q2369-N2976 PolarHBondContact O-ND2 3.23Å; Q2369-N2976 PolarHBondContact O-OD1 3.18Å; N2370-N2976 WeakPolarHBondContact CB-ND2 3.38Å; N2370-N2976 PolarHBondContact ND2-O 2.82Å; N2370-N2976 PolarHBondContact O-ND2 3.18Å; G2937-N2976 WeakPolarHBondContact O-CA 3.33Å; N2973-N2976 PolarHBondContact ND2-O 3.22Å; N2973-N2976 PolarHBondContact ND2-OD1 2.91Å; N2973-N2976 PolarHBondContact OD1-N 2.83Å; N2973-N2976 PolarHBondContact OD1-OD1 3.27Å; N2973-N2976 VanDerWaalsContact OD1-OD1 3.12Å
2977	P	97.2	Very high	95.4	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	25%	0.245	C	C	.	.			trans	-60.6	147.4	175.7	26.7	-34.4	0	0	0	111.6	S2936 G2937 V2940 P2949 V2970 N2973 W2979	S2936-P2977 CarbonylContact C-O 3.57Å; S2936-P2977 WeakPolarHBondContact CA-O 3.2Å; S2936-P2977 VanDerWaalsContact CB-O 3.3Å; S2936-P2977 WeakPolarHBondContact CB-O 3.29Å; G2937-P2977 PolarHBondContact N-O 3.05Å; V2940-P2977 HydrophobicContact CG1-CG 4.45Å; V2940-P2977 HydrophobicContact CG2-CG 3.82Å; P2949-P2977 HydrophobicContact CG-CB 4.09Å; P2949-P2977 HydrophobicContact CG-CG 4Å; V2970-P2977 HydrophobicContact CB-CB 3.94Å; V2970-P2977 HydrophobicContact CG1-CB 3.93Å; V2970-P2977 HydrophobicContact CG2-CB 3.99Å; N2973-P2977 WeakPolarHBondContact O-CB 3.34Å; N2973-P2977 WeakPolarHBondContact O-CD 3.37Å; P2977-W2979 HydrophobicContact CB-CH2 4Å; P2977-W2979 HydrophobicContact CB-CZ2 3.76Å; P2977-W2979 HydrophobicContact CB-CZ3 4.43Å; P2977-W2979 HydrophobicContact CG-CH2 3.47Å; P2977-W2979 VanDerWaalsContact CG-CH2 3.47Å; P2977-W2979 HydrophobicContact CG-CZ2 3.69Å; P2977-W2979 HydrophobicContact CG-CZ3 4.04Å
2978	I	98.3	Very high	94.8	Very high	33.5 Å²	33.5	52.3 Å²	52.3	17%	0.172	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	121.2	174.6	-65.3	179.3	0	0	0	107.3	K2265 D2266 N2370 V2970 L2980	K2265-I2978 HydrophobicContact CB-CD1 4.31Å; D2266-I2978 HydrophobicContact CB-CD1 4.05Å; D2266-I2978 HydrophobicContact CB-CG1 4.45Å; N2370-I2978 HydrophobicContact CB-CD1 3.86Å; N2370-I2978 HydrophobicContact CB-CG1 4.42Å; V2970-I2978 WeakPolarHBondContact CG2-O 3.38Å; I2978-L2980 HydrophobicContact CG2-CD1 3.63Å; I2978-L2980 HydrophobicContact CG2-CG 3.67Å
2979	W	98	Very high	94.3	Very high	25.5 Å²	25.5	45.4 Å²	45.4	10%	0.097	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	-43.8	-176.7	-66.5	-72.1	0	0	0	112.4	I2934 I2935 G2937 V2940 P2949 V2951 T2967 K2968 V2970 P2977 Q2981	I2934-W2979 HydrophobicContact CG2-CB 4.44Å; I2934-W2979 HydrophobicContact CG2-CD2 4.38Å; I2934-W2979 HydrophobicContact CG2-CE3 3.84Å; I2934-W2979 HydrophobicContact CG2-CZ3 4.46Å; I2935-W2979 PolarHBondContact O-N 3.43Å; G2937-W2979 VanDerWaalsContact N-CZ3 3.34Å; V2940-W2979 HydrophobicContact CG1-CH2 4.24Å; V2940-W2979 HydrophobicContact CG2-CH2 4.29Å; P2949-W2979 HydrophobicContact CB-CZ2 4.12Å; P2949-W2979 HydrophobicContact CG-CZ2 4.08Å; P2949-W2979 PolarHBondContact O-NE1 2.9Å; V2951-W2979 HydrophobicContact CG2-CD2 4.14Å; V2951-W2979 HydrophobicContact CG2-CE3 4.01Å; V2951-W2979 HydrophobicContact CG2-CH2 3.45Å; V2951-W2979 VanDerWaalsContact CG2-CH2 3.45Å; V2951-W2979 HydrophobicContact CG2-CZ2 3.61Å; V2951-W2979 HydrophobicContact CG2-CZ3 3.66Å; T2967-W2979 HydrophobicContact CG2-CB 4.3Å; T2967-W2979 HydrophobicContact CG2-CG 4.29Å; T2967-W2979 VanDerWaalsContact OG1-CD1 3.29Å; T2967-W2979 PolarHBondContact OG1-NE1 2.86Å; K2968-W2979 PolarHBondContact O-NE1 3.04Å; V2970-W2979 HydrophobicContact CG2-CG 4.32Å; P2977-W2979 HydrophobicContact CB-CH2 4Å; P2977-W2979 HydrophobicContact CB-CZ2 3.76Å; P2977-W2979 HydrophobicContact CB-CZ3 4.43Å; P2977-W2979 HydrophobicContact CG-CH2 3.47Å; P2977-W2979 VanDerWaalsContact CG-CH2 3.47Å; P2977-W2979 HydrophobicContact CG-CZ2 3.69Å; P2977-W2979 HydrophobicContact CG-CZ3 4.04Å; W2979-Q2981 VanDerWaalsContact C-N 3.28Å; W2979-Q2981 PolarHBondContact O-N 3.23Å
2980	L	97	Very high	93.9	Very high	114.5 Å²	114.5	43.8 Å²	43.8	60%	0.599	21%	0.208	S	C	*	.	E	Extended strand (participates in β ladder)	trans	49.3	44.8	-177.9	-69.2	164.8	0	0	0	113.3	I2934 I2935 I2978	I2934-L2980 WeakPolarHBondContact O-CA 3.37Å; I2934-L2980 PolarHBondContact O-N 3.06Å; I2935-L2980 HydrophobicContact CG2-CD2 3.9Å; I2935-L2980 PolarHBondContact O-N 3.11Å; I2978-L2980 HydrophobicContact CG2-CD1 3.63Å; I2978-L2980 HydrophobicContact CG2-CG 3.67Å
2981	Q	97.9	Very high	93.4	Very high	43.5 Å²	43.5	45 Å²	45	20%	0.203	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	120.1	-177.7	-169.7	165.5	-34.7	0	0	110.7	N2933 I2934 R2966 T2967 K2968 W2979 F2983	N2933-Q2981 WeakPolarHBondContact CA-O 3.32Å; N2933-Q2981 PolarHBondContact OD1-N 2.91Å; N2933-Q2981 PolarHBondContact OD1-O 3.1Å; I2934-Q2981 PolarHBondContact N-O 3.25Å; I2934-Q2981 PolarHBondContact O-N 3.23Å; I2934-Q2981 VanDerWaalsContact O-N 3.11Å; R2966-Q2981 PolarHBondContact O-NE2 3.09Å; T2967-Q2981 VanDerWaalsContact CA-OE1 3.27Å; T2967-Q2981 HydrophobicContact CG2-CB 4.23Å; K2968-Q2981 VanDerWaalsContact N-OE1 3.16Å; W2979-Q2981 VanDerWaalsContact C-N 3.28Å; W2979-Q2981 PolarHBondContact O-N 3.23Å; Q2981-F2983 HydrophobicContact CB-CE2 4.34Å; Q2981-F2983 HydrophobicContact CB-CZ 4.44Å; Q2981-F2983 HydrophobicContact CG-CE1 4.21Å; Q2981-F2983 HydrophobicContact CG-CE2 4.03Å; Q2981-F2983 HydrophobicContact CG-CZ 3.74Å; Q2981-F2983 VanDerWaalsContact NE2-CE1 3.3Å
2982	T	97.7	Very high	93.3	Very high	74.5 Å²	74.5	39.3 Å²	39.3	46%	0.457	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	131.9	177.9	-55.1	0	0	0	0	110.8	I2931 L2932 N2933	I2931-T2982 HydrophobicContact CG2-CG2 3.84Å; L2932-T2982 WeakPolarHBondContact O-CA 3.38Å; N2933-T2982 HydrophobicContact CB-CG2 4.36Å; N2933-T2982 WeakPolarHBondContact CB-OG1 3.16Å; N2933-T2982 VanDerWaalsContact CG-OG1 3.23Å; N2933-T2982 PolarHBondContact OD1-OG1 3.18Å
2983	F	97.2	Very high	93.3	Very high	13.5 Å²	13.5	31.4 Å²	31.4	6%	0.059	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	153.4	171.9	-53.3	-85.7	0	0	0	109.4	L2932 I2934 V2953 E2965 T2967 Q2981 F2985	L2932-F2983 PolarHBondContact N-O 3.13Å; L2932-F2983 PolarHBondContact O-N 2.96Å; I2934-F2983 HydrophobicContact CG1-CD2 4.25Å; I2934-F2983 HydrophobicContact CG1-CE2 3.87Å; V2953-F2983 HydrophobicContact CB-CE2 4.44Å; V2953-F2983 HydrophobicContact CG2-CD2 4.26Å; V2953-F2983 HydrophobicContact CG2-CE2 3.78Å; V2953-F2983 HydrophobicContact CG2-CZ 4.27Å; E2965-F2983 HydrophobicContact CB-CD1 3.79Å; E2965-F2983 HydrophobicContact CB-CE1 3.64Å; E2965-F2983 HydrophobicContact CB-CZ 4.4Å; E2965-F2983 HydrophobicContact CG-CD1 3.89Å; E2965-F2983 HydrophobicContact CG-CE1 4.07Å; E2965-F2983 WeakPolarHBondContact OE2-CE1 3.37Å; T2967-F2983 HydrophobicContact CG2-CE2 4.06Å; T2967-F2983 HydrophobicContact CG2-CZ 4.03Å; Q2981-F2983 HydrophobicContact CB-CE2 4.34Å; Q2981-F2983 HydrophobicContact CB-CZ 4.44Å; Q2981-F2983 HydrophobicContact CG-CE1 4.21Å; Q2981-F2983 HydrophobicContact CG-CE2 4.03Å; Q2981-F2983 HydrophobicContact CG-CZ 3.74Å; Q2981-F2983 VanDerWaalsContact NE2-CE1 3.3Å; F2983-F2985 HydrophobicContact CB-CD2 4.32Å; F2983-F2985 HydrophobicContact CB-CE1 4.33Å; F2983-F2985 HydrophobicContact CB-CE2 3.47Å; F2983-F2985 VanDerWaalsContact CB-CE2 3.47Å; F2983-F2985 HydrophobicContact CB-CZ 3.48Å; F2983-F2985 VanDerWaalsContact CB-CZ 3.47Å; F2983-F2985 HydrophobicContact CD1-CZ 4.43Å; F2983-F2985 HydrophobicContact CG-CE2 4.35Å; F2983-F2985 HydrophobicContact CG-CZ 4.05Å
2984	Q	94.7	Very high	93.4	Very high	126 Å²	126	31.2 Å²	31.2	59%	0.589	16%	0.157	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-131.3	130.8	173.3	-60.5	-170	-8.8	0	0	108.3	L2930 I2931	L2930-Q2984 WeakPolarHBondContact O-CA 3.45Å; I2931-Q2984 HydrophobicContact CD1-CG 4.5Å; I2931-Q2984 HydrophobicContact CG1-CG 4.15Å; I2931-Q2984 HydrophobicContact CG2-CG 4.4Å
2985	F	92.1	Very high	93.7	Very high	8.5 Å²	8.5	31.2 Å²	31.2	4%	0.037	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	147.2	-177.2	-51.9	-77.2	0	0	0	109.9	R2929 L2930 L2932 V2953 L2955 W2963 E2965 F2983	R2929-F2985 CarbonylContact C-O 3.54Å; R2929-F2985 WeakPolarHBondContact CA-O 3.41Å; L2930-F2985 HydrophobicContact CB-CB 4.46Å; L2930-F2985 HydrophobicContact CD2-CD2 4.1Å; L2930-F2985 HydrophobicContact CG-CD2 4.45Å; L2930-F2985 PolarHBondContact N-O 2.77Å; L2930-F2985 PolarHBondContact O-N 3.07Å; L2932-F2985 HydrophobicContact CD2-CE2 4.48Å; V2953-F2985 HydrophobicContact CG1-CE2 4.13Å; V2953-F2985 HydrophobicContact CG1-CZ 4.01Å; L2955-F2985 HydrophobicContact CD1-CB 3.44Å; L2955-F2985 VanDerWaalsContact CD1-CB 3.44Å; L2955-F2985 HydrophobicContact CD1-CD1 4.03Å; L2955-F2985 HydrophobicContact CD1-CD2 3.76Å; L2955-F2985 HydrophobicContact CD1-CE2 4.47Å; L2955-F2985 HydrophobicContact CD1-CG 3.48Å; L2955-F2985 VanDerWaalsContact CD1-CG 3.48Å; L2955-F2985 HydrophobicContact CG-CD2 4.39Å; L2955-F2985 HydrophobicContact CG-CG 4.39Å; W2963-F2985 HydrophobicContact CB-CD1 3.68Å; W2963-F2985 HydrophobicContact CB-CE1 3.75Å; W2963-F2985 HydrophobicContact CD2-CD1 4.17Å; W2963-F2985 AromaticContact CG-CD1 3.68Å; W2963-F2985 HydrophobicContact CG-CD1 3.68Å; W2963-F2985 HydrophobicContact CG-CE1 4.22Å; E2965-F2985 HydrophobicContact CB-CE1 4.38Å; E2965-F2985 HydrophobicContact CB-CZ 4.25Å; E2965-F2985 HydrophobicContact CG-CE1 4.13Å; E2965-F2985 HydrophobicContact CG-CZ 4.31Å; F2983-F2985 HydrophobicContact CB-CD2 4.32Å; F2983-F2985 HydrophobicContact CB-CE1 4.33Å; F2983-F2985 HydrophobicContact CB-CE2 3.47Å; F2983-F2985 VanDerWaalsContact CB-CE2 3.47Å; F2983-F2985 HydrophobicContact CB-CZ 3.48Å; F2983-F2985 VanDerWaalsContact CB-CZ 3.47Å; F2983-F2985 HydrophobicContact CD1-CZ 4.43Å; F2983-F2985 HydrophobicContact CG-CE2 4.35Å; F2983-F2985 HydrophobicContact CG-CZ 4.05Å
2986	Q	88.3	Confident	93.9	Very high	82.5 Å²	82.5	31.4 Å²	31.4	39%	0.386	16%	0.157	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	131.1	170.5	-173.7	118.4	-6.9	0	0	108.8	G2927	G2927-Q2986 VanDerWaalsContact CA-NE2 3.34Å; G2927-Q2986 PolarHBondContact O-NE2 2.97Å
2987	V	88.8	Confident	94.1	Very high	2 Å²	2	31.3 Å²	31.3	1%	0.012	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	109.9	-176.5	-178.9	0	0	0	0	108.7	G2927 I2928 L2930 L2955 D2961 L2990 C2993 L3015	G2927-V2987 CarbonylContact C-O 3.59Å; G2927-V2987 WeakPolarHBondContact CA-O 3.37Å; I2928-V2987 PolarHBondContact N-O 3.19Å; I2928-V2987 PolarHBondContact O-N 3.21Å; L2930-V2987 HydrophobicContact CB-CG2 4.43Å; L2955-V2987 HydrophobicContact CD1-CG2 4.11Å; D2961-V2987 WeakPolarHBondContact OD2-CG1 3.14Å; V2987-L2990 HydrophobicContact CG1-CB 4.42Å; V2987-L2990 HydrophobicContact CG1-CD1 4.47Å; V2987-C2993 HydrophobicContact CG1-CB 3.99Å; V2987-L3015 HydrophobicContact CG1-CD2 4.15Å; V2987-L3015 HydrophobicContact CG2-CD2 3.94Å
2988	N	85	Confident	94.1	Very high	21.5 Å²	21.5	31.3 Å²	31.3	12%	0.115	16%	0.156	C	C	.	.	S	Bend	trans	-90.7	-22.1	-177.1	-57.7	-163.4	0	0	0	112.4	L2922 I2925 I2958 A2960 D2961 Q3064	L2922-N2988 PolarHBondContact O-ND2 3.38Å; I2925-N2988 PolarHBondContact O-ND2 2.79Å; I2958-N2988 HydrophobicContact CD1-CB 4.46Å; A2960-N2988 PolarHBondContact O-ND2 2.91Å; D2961-N2988 VanDerWaalsContact OD1-CB 3.32Å; D2961-N2988 WeakPolarHBondContact OD1-CB 3.43Å; D2961-N2988 PolarHBondContact OD1-N 3.01Å; D2961-N2988 PolarHBondContact OD1-ND2 3.1Å; D2961-N2988 PolarHBondContact OD2-N 3.06Å; N2988-Q3064 PolarHBondContact O-NE2 2.92Å
2989	F	87.4	Confident	94.1	Very high	22 Å²	22	29.7 Å²	29.7	10%	0.096	15%	0.148	C	C	.	.			trans	-136.8	70.3	-176.7	-165.4	-119.3	0	0	0	113.5	P2901 V2903 M2904 F2915 I2958 D2961 D2991 L2992	P2901-F2989 HydrophobicContact CB-CE2 4.25Å; P2901-F2989 HydrophobicContact CB-CZ 3.64Å; P2901-F2989 HydrophobicContact CG-CE1 4.26Å; P2901-F2989 HydrophobicContact CG-CZ 3.77Å; V2903-F2989 HydrophobicContact CG1-CE2 3.72Å; V2903-F2989 HydrophobicContact CG1-CZ 3.85Å; M2904-F2989 HydrophobicContact CE-CE1 4.38Å; M2904-F2989 HydrophobicContact CE-CZ 4.22Å; F2915-F2989 HydrophobicContact CE1-CE1 4.42Å; F2915-F2989 HydrophobicContact CE1-CZ 4.28Å; F2915-F2989 HydrophobicContact CE2-CD2 4.04Å; F2915-F2989 HydrophobicContact CE2-CE2 4.12Å; F2915-F2989 HydrophobicContact CE2-CG 4.38Å; F2915-F2989 HydrophobicContact CE2-CZ 4.42Å; F2915-F2989 HydrophobicContact CZ-CD1 4.16Å; F2915-F2989 HydrophobicContact CZ-CD2 4.1Å; F2915-F2989 AromaticContact CZ-CE1 3.87Å; F2915-F2989 HydrophobicContact CZ-CE1 3.94Å; F2915-F2989 AromaticContact CZ-CE2 3.91Å; F2915-F2989 HydrophobicContact CZ-CE2 3.91Å; F2915-F2989 HydrophobicContact CZ-CG 4.22Å; F2915-F2989 AromaticContact CZ-CZ 3.81Å; F2915-F2989 HydrophobicContact CZ-CZ 3.81Å; I2958-F2989 HydrophobicContact CD1-CB 3.69Å; I2958-F2989 HydrophobicContact CG1-CB 4.06Å; I2958-F2989 HydrophobicContact CG2-CB 4.4Å; I2958-F2989 HydrophobicContact CG2-CD1 3.95Å; I2958-F2989 HydrophobicContact CG2-CG 4.5Å; D2961-F2989 WeakPolarHBondContact OD2-CA 3.46Å; D2961-F2989 PolarHBondContact OD2-N 2.96Å; F2989-D2991 VanDerWaalsContact C-N 3.25Å; F2989-D2991 HydrophobicContact CZ-CB 4.41Å; F2989-D2991 PolarHBondContact O-N 3.19Å; F2989-D2991 VanDerWaalsContact O-N 3.1Å; F2989-L2992 HydrophobicContact CD1-CB 4.17Å; F2989-L2992 HydrophobicContact CE1-CB 3.98Å; F2989-L2992 HydrophobicContact CE1-CD1 4.09Å; F2989-L2992 HydrophobicContact CE1-CG 4.11Å; F2989-L2992 PolarHBondContact O-N 3.24Å
2990	L	89	Confident	94.1	Very high	15 Å²	15	29 Å²	29	8%	0.079	15%	0.146	C	C	.	.	G	3₁₀ helix	trans	-53.7	-31.5	-176.2	-177.1	61.9	0	0	0	115.1	I2928 V2987 L2992 C2993 L3015 K3016 M3046 I3072	I2928-L2990 HydrophobicContact CD1-CB 4.43Å; I2928-L2990 HydrophobicContact CD1-CD2 3.79Å; V2987-L2990 HydrophobicContact CG1-CB 4.42Å; V2987-L2990 HydrophobicContact CG1-CD1 4.47Å; L2990-L2992 VanDerWaalsContact C-N 3.26Å; L2990-L2992 PolarHBondContact O-N 3.33Å; L2990-C2993 PolarHBondContact O-N 3.09Å; L2990-L3015 HydrophobicContact CD1-CB 3.94Å; L2990-L3015 HydrophobicContact CD1-CD2 3.76Å; L2990-L3015 HydrophobicContact CD1-CG 3.65Å; L2990-K3016 HydrophobicContact CG-CB 4.29Å; L2990-M3046 HydrophobicContact CD1-CE 4.06Å; L2990-M3046 HydrophobicContact CD2-SD 4.26Å; L2990-I3072 HydrophobicContact CD2-CD1 3.61Å
2991	D	87.8	Confident	94	Very high	51 Å²	51	24.4 Å²	24.4	27%	0.273	12%	0.121	S	C	.	.	G	3₁₀ helix	trans	-64.6	-22.2	-174.2	-81.7	-15.4	0	0	0	114.5	P2901 F2989 K3016	P2901-D2991 HydrophobicContact CB-CB 4.01Å; P2901-D2991 HydrophobicContact CG-CB 3.84Å; F2989-D2991 VanDerWaalsContact C-N 3.25Å; F2989-D2991 HydrophobicContact CZ-CB 4.41Å; F2989-D2991 PolarHBondContact O-N 3.19Å; F2989-D2991 VanDerWaalsContact O-N 3.1Å; D2991-K3016 WeakPolarHBondContact OD1-CD 2.98Å; D2991-K3016 WeakPolarHBondContact OD1-CE 3.02Å; D2991-K3016 IonicContact OD1-NZ 3.07Å; D2991-K3016 PolarHBondContact OD1-NZ 2.86Å
2992	L	93	Very high	93.9	Very high	1.5 Å²	1.5	24.5 Å²	24.5	1%	0.008	13%	0.127	C	C	.	.	G	3₁₀ helix	trans	-127.4	26.7	173.6	-72.1	-178.4	0	0	0	112.7	F2460 W2864 T2865 M2888 P2901 M2904 G2957 F2989 L2990 F2994	F2460-L2992 HydrophobicContact CE2-CD1 4.36Å; F2460-L2992 HydrophobicContact CE2-CD2 4.03Å; F2460-L2992 HydrophobicContact CZ-CD1 4.07Å; F2460-L2992 HydrophobicContact CZ-CD2 4.49Å; W2864-L2992 HydrophobicContact CB-CD1 3.98Å; T2865-L2992 HydrophobicContact CG2-CD1 4.05Å; M2888-L2992 HydrophobicContact CE-CD2 3.81Å; M2888-L2992 HydrophobicContact SD-CD2 4.37Å; P2901-L2992 HydrophobicContact CG-CD1 4.29Å; P2901-L2992 HydrophobicContact CG-CG 4.07Å; M2904-L2992 HydrophobicContact CE-CD1 4.13Å; G2957-L2992 WeakPolarHBondContact CA-O 3.26Å; F2989-L2992 HydrophobicContact CD1-CB 4.17Å; F2989-L2992 HydrophobicContact CE1-CB 3.98Å; F2989-L2992 HydrophobicContact CE1-CD1 4.09Å; F2989-L2992 HydrophobicContact CE1-CG 4.11Å; F2989-L2992 PolarHBondContact O-N 3.24Å; L2990-L2992 VanDerWaalsContact C-N 3.26Å; L2990-L2992 PolarHBondContact O-N 3.33Å; L2992-F2994 WeakPolarHBondContact O-CD2 3.23Å
2993	C	94	Very high	93.5	Very high	2.5 Å²	2.5	24.1 Å²	24.1	2%	0.017	14%	0.138	C	C	.	.			trans	-95.2	133.8	174.1	-172	0	0	0	0	111.3	V2987 L2990 L3015	V2987-C2993 HydrophobicContact CG1-CB 3.99Å; L2990-C2993 PolarHBondContact O-N 3.09Å; C2993-L3015 HydrophobicContact CB-CB 4.25Å; C2993-L3015 HydrophobicContact CB-CD2 4.23Å; C2993-L3015 VanDerWaalsContact O-CB 3.25Å; C2993-L3015 WeakPolarHBondContact O-CB 3.47Å; C2993-L3015 PolarHBondContact O-N 3.33Å
2994	F	97.7	Very high	93.2	Very high	2.5 Å²	2.5	26.9 Å²	26.9	1%	0.011	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	133.6	-177.6	-66.2	-101.6	0	0	0	110.6	L2861 A2887 M2888 L2955 M2956 L2992 V3012 V3013 P3014	L2861-F2994 HydrophobicContact CD1-CD2 4.44Å; L2861-F2994 HydrophobicContact CD2-CD2 3.57Å; L2861-F2994 HydrophobicContact CD2-CE2 3.47Å; L2861-F2994 VanDerWaalsContact CD2-CE2 3.41Å; L2861-F2994 HydrophobicContact CD2-CZ 4.46Å; A2887-F2994 HydrophobicContact CB-CD1 4.06Å; A2887-F2994 HydrophobicContact CB-CE1 4.09Å; M2888-F2994 HydrophobicContact CB-CE1 4.19Å; M2888-F2994 HydrophobicContact CB-CZ 4.01Å; M2888-F2994 HydrophobicContact CG-CZ 4.43Å; M2888-F2994 HydrophobicContact SD-CZ 3.84Å; L2955-F2994 WeakPolarHBondContact CA-O 3.42Å; M2956-F2994 HydrophobicContact CE-CB 3.83Å; M2956-F2994 PolarHBondContact N-O 3.25Å; M2956-F2994 PolarHBondContact O-N 2.92Å; L2992-F2994 WeakPolarHBondContact O-CD2 3.23Å; F2994-V3012 HydrophobicContact CB-CG1 4.08Å; F2994-V3012 HydrophobicContact CD1-CG1 4.08Å; F2994-V3013 CarbonylContact C-O 3.48Å; F2994-V3013 WeakPolarHBondContact CA-O 3.22Å; F2994-P3014 HydrophobicContact CD1-CB 4.14Å; F2994-P3014 HydrophobicContact CD1-CG 4.17Å; F2994-P3014 HydrophobicContact CE1-CB 3.98Å; F2994-P3014 HydrophobicContact CE1-CG 3.89Å
2995	L	97.8	Very high	93.1	Very high	1 Å²	1	25.3 Å²	25.3	1%	0.005	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	116.8	172.6	175.6	64.3	0	0	0	109.7	L2932 V2953 L2955 L2997 V3012 V3013 L3018	L2932-L2995 HydrophobicContact CD2-CD1 3.81Å; L2932-L2995 HydrophobicContact CD2-CD2 3.84Å; L2932-L2995 HydrophobicContact CD2-CG 4.47Å; V2953-L2995 HydrophobicContact CG1-CD1 4Å; L2955-L2995 HydrophobicContact CD2-CB 4.15Å; L2955-L2995 HydrophobicContact CD2-CD1 3.87Å; L2995-L2997 HydrophobicContact CD1-CD2 4.01Å; L2995-L2997 HydrophobicContact CD2-CD2 4.39Å; L2995-L2997 HydrophobicContact CD2-CG 4.39Å; L2995-L2997 HydrophobicContact CG-CD2 4.22Å; L2995-L2997 HydrophobicContact CG-CG 4.24Å; L2995-V3012 CarbonylContact O-C 3.39Å; L2995-V3012 WeakPolarHBondContact O-CA 3.17Å; L2995-V3013 PolarHBondContact N-O 3.37Å; L2995-V3013 PolarHBondContact O-N 3.44Å; L2995-L3018 HydrophobicContact CD2-CD2 3.85Å
2996	R	98.1	Very high	93.2	Very high	15 Å²	15	31.7 Å²	31.7	6%	0.057	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	127.1	165.8	172.4	169.3	175	-84.6	-3	109.4	E2952 E2954 M2956 A2998 R3011 V3012	E2952-R2996 IonicContact OE2-CZ 2.72Å; E2952-R2996 IonicContact OE2-NH1 2.73Å; E2952-R2996 PolarHBondContact OE2-NH1 3.28Å; E2952-R2996 IonicContact OE2-NH2 3.61Å; E2952-R2996 PolarHBondContact OE2-NH2 2.85Å; E2954-R2996 HydrophobicContact CB-CB 4.18Å; E2954-R2996 PolarHBondContact N-O 3.41Å; E2954-R2996 PolarHBondContact O-N 3.06Å; E2954-R2996 VanDerWaalsContact OE2-CD 3.3Å; E2954-R2996 WeakPolarHBondContact OE2-CD 3.41Å; E2954-R2996 IonicContact OE2-CZ 3.39Å; E2954-R2996 IonicContact OE2-NE 3.59Å; E2954-R2996 IonicContact OE2-NH1 3.17Å; E2954-R2996 PolarHBondContact OE2-NH1 2.89Å; M2956-R2996 HydrophobicContact CE-CB 3.63Å; M2956-R2996 HydrophobicContact SD-CB 4.05Å; R2996-A2998 VanDerWaalsContact NH2-CB 3.3Å; R2996-R3011 WeakPolarHBondContact CA-O 3.13Å; R2996-V3012 HydrophobicContact CB-CG2 4.18Å; R2996-V3012 HydrophobicContact CG-CG2 4.24Å
2997	L	98.3	Very high	93.6	Very high	2 Å²	2	29.4 Å²	29.4	1%	0.01	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	119.7	167.1	-60.1	179.5	0	0	0	107.7	I2934 V2951 E2952 V2953 L2995 Q3010 R3011 V3025 I3040 I3042	I2934-L2997 HydrophobicContact CD1-CD2 3.97Å; V2951-L2997 HydrophobicContact CG1-CB 4.49Å; V2951-L2997 HydrophobicContact CG1-CD2 4.45Å; E2952-L2997 WeakPolarHBondContact O-CA 3.36Å; V2953-L2997 HydrophobicContact CB-CD2 4.35Å; V2953-L2997 HydrophobicContact CG1-CD2 4.11Å; V2953-L2997 HydrophobicContact CG2-CD2 3.96Å; L2995-L2997 HydrophobicContact CD1-CD2 4.01Å; L2995-L2997 HydrophobicContact CD2-CD2 4.39Å; L2995-L2997 HydrophobicContact CD2-CG 4.39Å; L2995-L2997 HydrophobicContact CG-CD2 4.22Å; L2995-L2997 HydrophobicContact CG-CG 4.24Å; L2997-Q3010 CarbonylContact O-C 3.55Å; L2997-Q3010 WeakPolarHBondContact O-CA 3.23Å; L2997-R3011 PolarHBondContact N-O 3.42Å; L2997-R3011 PolarHBondContact O-N 2.74Å; L2997-V3025 HydrophobicContact CD1-CB 4.4Å; L2997-V3025 HydrophobicContact CD1-CG1 4.32Å; L2997-V3025 HydrophobicContact CD1-CG2 4.07Å; L2997-I3040 HydrophobicContact CB-CD1 4.19Å; L2997-I3040 HydrophobicContact CD1-CD1 4.32Å; L2997-I3042 HydrophobicContact CD1-CG2 4.45Å
2998	A	98.2	Very high	93.9	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	131.4	177.2	0	0	0	0	0	110.8	V2951 E2952 R2996 I3000 Q3010	V2951-A2998 CarbonylContact C-O 3.58Å; V2951-A2998 VanDerWaalsContact CA-O 3.3Å; V2951-A2998 WeakPolarHBondContact CA-O 3.37Å; E2952-A2998 HydrophobicContact CB-CB 4.37Å; E2952-A2998 PolarHBondContact N-O 3.19Å; E2952-A2998 PolarHBondContact O-N 2.92Å; R2996-A2998 VanDerWaalsContact NH2-CB 3.3Å; A2998-I3000 HydrophobicContact CB-CD1 4.29Å; A2998-Q3010 HydrophobicContact CB-CB 4.15Å
2999	V	98.1	Very high	94.4	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	120.2	175.5	-176.6	0	0	0	0	107.8	V2940 P2949 Y2950 V2951 C3007 T3008 A3009 L3027 I3040	V2940-V2999 HydrophobicContact CB-CB 4.46Å; V2940-V2999 HydrophobicContact CB-CG1 3.81Å; V2940-V2999 HydrophobicContact CB-CG2 4.05Å; V2940-V2999 HydrophobicContact CG1-CG2 4.46Å; V2940-V2999 HydrophobicContact CG2-CG1 3.86Å; P2949-V2999 HydrophobicContact CB-CG1 3.86Å; Y2950-V2999 WeakPolarHBondContact O-CA 3.26Å; V2951-V2999 HydrophobicContact CG2-CG2 4.49Å; V2999-C3007 CarbonylContact O-C 3.58Å; V2999-C3007 VanDerWaalsContact O-CA 3.31Å; V2999-C3007 WeakPolarHBondContact O-CA 3.5Å; V2999-T3008 PolarHBondContact O-N 2.91Å; V2999-T3008 PolarHBondContact O-OG1 3.39Å; V2999-A3009 HydrophobicContact CB-CB 4.41Å; V2999-A3009 HydrophobicContact CG2-CB 4.41Å; V2999-A3009 PolarHBondContact N-O 3Å; V2999-L3027 HydrophobicContact CG2-CD1 3.87Å; V2999-I3040 HydrophobicContact CG2-CD1 4.09Å
3000	I	97.8	Very high	94.9	Very high	9 Å²	9	28.8 Å²	28.8	5%	0.046	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	134.3	178.8	-47.9	-56.6	0	0	0	109.4	P2949 Y2950 E2952 A2998 K3006 C3007	P2949-I3000 WeakPolarHBondContact CA-O 3.36Å; Y2950-I3000 HydrophobicContact CD1-CB 4.13Å; Y2950-I3000 HydrophobicContact CD1-CG2 4.48Å; Y2950-I3000 HydrophobicContact CD2-CB 4.21Å; Y2950-I3000 HydrophobicContact CD2-CG1 4.4Å; Y2950-I3000 HydrophobicContact CE1-CB 3.66Å; Y2950-I3000 HydrophobicContact CE1-CG1 4.36Å; Y2950-I3000 HydrophobicContact CE1-CG2 3.7Å; Y2950-I3000 HydrophobicContact CE2-CB 3.91Å; Y2950-I3000 HydrophobicContact CE2-CG1 3.9Å; Y2950-I3000 HydrophobicContact CE2-CG2 4.32Å; Y2950-I3000 HydrophobicContact CG-CB 4.47Å; Y2950-I3000 PolarHBondContact N-O 2.85Å; Y2950-I3000 PolarHBondContact O-N 3.3Å; Y2950-I3000 WeakPolarHBondContact OH-CG2 3.24Å; E2952-I3000 HydrophobicContact CG-CD1 4.46Å; E2952-I3000 HydrophobicContact CG-CG1 3.87Å; A2998-I3000 HydrophobicContact CB-CD1 4.29Å; I3000-K3006 WeakPolarHBondContact CA-O 3.35Å; I3000-C3007 HydrophobicContact CD1-CB 3.76Å
3001	E	95.6	Very high	95.3	Very high	19 Å²	19	28.5 Å²	28.5	9%	0.089	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	115.3	172.5	-157.5	-63.9	116.8	0	0	110.1	A2947 S2948 G3003 N3004 N3005 K3006 T3008	A2947-E3001 HydrophobicContact CB-CG 4Å; S2948-E3001 PolarHBondContact N-OE1 3.07Å; E3001-G3003 VanDerWaalsContact C-N 3.26Å; E3001-G3003 VanDerWaalsContact CD-N 3.31Å; E3001-G3003 PolarHBondContact O-N 2.87Å; E3001-G3003 PolarHBondContact OE1-N 2.9Å; E3001-G3003 WeakPolarHBondContact OE2-CA 3.41Å; E3001-G3003 PolarHBondContact OE2-N 2.83Å; E3001-N3004 PolarHBondContact O-N 3.31Å; E3001-N3004 PolarHBondContact OE2-N 3.03Å; E3001-N3004 VanDerWaalsContact OE2-N 3.14Å; E3001-N3004 PolarHBondContact OE2-ND2 2.88Å; E3001-N3005 WeakPolarHBondContact O-CA 3.47Å; E3001-N3005 PolarHBondContact O-N 3.46Å; E3001-K3006 PolarHBondContact N-O 2.69Å; E3001-T3008 HydrophobicContact CB-CG2 3.97Å
3002	S	94.6	Very high	95.7	Very high	45 Å²	45	26.1 Å²	26.1	32%	0.315	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-9.4	-169	-171.9	0	0	0	0	115.5	S2948	S2948-S3002 WeakPolarHBondContact O-CB 3.24Å; S2948-S3002 PolarHBondContact O-N 3.4Å
3003	G	89.9	Confident	95.9	Very high	67 Å²	67	26.2 Å²	26.2	69%	0.691	15%	0.153	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.8	-19.3	174.8	0	0	0	0	0	114	E3001	E3001-G3003 VanDerWaalsContact C-N 3.26Å; E3001-G3003 VanDerWaalsContact CD-N 3.31Å; E3001-G3003 PolarHBondContact O-N 2.87Å; E3001-G3003 PolarHBondContact OE1-N 2.9Å; E3001-G3003 WeakPolarHBondContact OE2-CA 3.41Å; E3001-G3003 PolarHBondContact OE2-N 2.83Å
3004	N	90.8	Very high	96	Very high	71 Å²	71	26.2 Å²	26.2	38%	0.38	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-136	-0.1	-178.3	68.2	67.8	0	0	0	115	E3001 K3006	E3001-N3004 PolarHBondContact O-N 3.31Å; E3001-N3004 PolarHBondContact OE2-N 3.03Å; E3001-N3004 VanDerWaalsContact OE2-N 3.14Å; E3001-N3004 PolarHBondContact OE2-ND2 2.88Å; N3004-K3006 PolarHBondContact O-N 3.4Å; N3004-K3006 VanDerWaalsContact O-N 3.14Å; N3004-K3006 WeakPolarHBondContact OD1-CB 3.43Å; N3004-K3006 WeakPolarHBondContact OD1-CD 3.38Å; N3004-K3006 WeakPolarHBondContact OD1-CG 3.28Å; N3004-K3006 PolarHBondContact OD1-N 3.35Å
3005	N	93.5	Very high	95.8	Very high	93 Å²	93	26.1 Å²	26.1	50%	0.497	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.6	20.7	-179.1	-65.2	-8.7	0	0	0	115.7	E3001	E3001-N3005 WeakPolarHBondContact O-CA 3.47Å; E3001-N3005 PolarHBondContact O-N 3.46Å
3006	K	93.7	Very high	95.4	Very high	143 Å²	143	29.1 Å²	29.1	62%	0.622	17%	0.166	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-87.6	139.2	174.7	-59.6	175.6	-177.2	-173.9	0	111.2	I3000 E3001 N3004 T3008	I3000-K3006 WeakPolarHBondContact CA-O 3.35Å; E3001-K3006 PolarHBondContact N-O 2.69Å; N3004-K3006 PolarHBondContact O-N 3.4Å; N3004-K3006 VanDerWaalsContact O-N 3.14Å; N3004-K3006 WeakPolarHBondContact OD1-CB 3.43Å; N3004-K3006 WeakPolarHBondContact OD1-CD 3.38Å; N3004-K3006 WeakPolarHBondContact OD1-CG 3.28Å; N3004-K3006 PolarHBondContact OD1-N 3.35Å; K3006-T3008 PolarHBondContact O-N 3.26Å
3007	C	95.8	Very high	95	Very high	34 Å²	34	30 Å²	30	23%	0.23	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	122.9	162.5	-178.5	0	0	0	0	109.7	V2999 I3000 A3009 P3030	V2999-C3007 CarbonylContact O-C 3.58Å; V2999-C3007 VanDerWaalsContact O-CA 3.31Å; V2999-C3007 WeakPolarHBondContact O-CA 3.5Å; I3000-C3007 HydrophobicContact CD1-CB 3.76Å; C3007-A3009 PolarHBondContact SG-O 2.9Å; C3007-P3030 HydrophobicContact CB-CG 4.4Å; C3007-P3030 WeakPolarHBondContact O-CG 3.46Å
3008	T	95.5	Very high	94.7	Very high	25 Å²	25	30.5 Å²	30.5	15%	0.153	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	-24.9	175	58.3	0	0	0	0	112.4	V2940 C2941 V2999 E3001 K3006	V2940-T3008 PolarHBondContact O-OG1 3.36Å; C2941-T3008 HydrophobicContact CB-CG2 4.16Å; C2941-T3008 PolarHBondContact SG-OG1 2.89Å; C2941-T3008 VanDerWaalsContact SG-OG1 3.35Å; V2999-T3008 PolarHBondContact O-N 2.91Å; V2999-T3008 PolarHBondContact O-OG1 3.39Å; E3001-T3008 HydrophobicContact CB-CG2 3.97Å; K3006-T3008 PolarHBondContact O-N 3.26Å
3009	A	96.9	Very high	94.4	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.1	146.9	179.7	0	0	0	0	0	110.7	V2999 C3007 L3027 R3028 L3035	V2999-A3009 HydrophobicContact CB-CB 4.41Å; V2999-A3009 HydrophobicContact CG2-CB 4.41Å; V2999-A3009 PolarHBondContact N-O 3Å; C3007-A3009 PolarHBondContact SG-O 2.9Å; A3009-L3027 HydrophobicContact CB-CB 4.12Å; A3009-L3027 HydrophobicContact CB-CD1 3.87Å; A3009-L3027 HydrophobicContact CB-CG 4.48Å; A3009-R3028 CarbonylContact C-O 3.23Å; A3009-R3028 WeakPolarHBondContact CA-O 3.37Å; A3009-R3028 WeakPolarHBondContact CB-O 3.42Å; A3009-L3035 HydrophobicContact CB-CD1 3.63Å
3010	Q	97.1	Very high	94.2	Very high	8 Å²	8	34.3 Å²	34.3	4%	0.037	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	163.2	172.5	64.5	169.2	-13	0	0	113	L2997 A2998 R3028 P3030	L2997-Q3010 CarbonylContact O-C 3.55Å; L2997-Q3010 WeakPolarHBondContact O-CA 3.23Å; A2998-Q3010 HydrophobicContact CB-CB 4.15Å; Q3010-R3028 PolarHBondContact N-O 2.83Å; Q3010-R3028 CarbonylContact O-C 3.59Å; Q3010-R3028 WeakPolarHBondContact O-CA 3.29Å; Q3010-R3028 WeakPolarHBondContact O-CB 3.31Å; Q3010-R3028 PolarHBondContact O-N 2.95Å; Q3010-R3028 VanDerWaalsContact O-O 3.09Å; Q3010-P3030 PolarHBondContact NE2-O 3.31Å
3011	R	96.8	Very high	94	Very high	9 Å²	9	33.9 Å²	33.9	3%	0.034	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	129.8	161.1	-178.3	60.1	163	131	-15.8	109.7	N2442 E2890 R2996 L2997 V3013 V3025 L3027 R3028	N2442-R3011 PolarHBondContact OD1-NH2 3.46Å; E2890-R3011 IonicContact OE1-NH1 3.34Å; E2890-R3011 IonicContact OE2-CZ 3.97Å; E2890-R3011 VanDerWaalsContact OE2-CZ 3.29Å; E2890-R3011 IonicContact OE2-NH1 2.67Å; E2890-R3011 PolarHBondContact OE2-NH1 3.33Å; E2890-R3011 IonicContact OE2-NH2 3.12Å; E2890-R3011 PolarHBondContact OE2-NH2 2.9Å; R2996-R3011 WeakPolarHBondContact CA-O 3.13Å; L2997-R3011 PolarHBondContact N-O 3.42Å; L2997-R3011 PolarHBondContact O-N 2.74Å; R3011-V3013 HydrophobicContact CG-CG2 3.67Å; R3011-V3025 HydrophobicContact CB-CG1 4.13Å; R3011-V3025 HydrophobicContact CG-CG1 4.03Å; R3011-L3027 HydrophobicContact CB-CD2 4.31Å; R3011-R3028 VanDerWaalsContact NH2-NH2 3.14Å
3012	V	97.6	Very high	94.1	Very high	1 Å²	1	34.5 Å²	34.5	1%	0.006	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	134.8	162.3	-174.1	0	0	0	0	108.3	A2883 I2884 A2887 M2956 F2994 L2995 R2996	A2883-V3012 HydrophobicContact CB-CG2 3.88Å; I2884-V3012 HydrophobicContact CG1-CG1 4.37Å; A2887-V3012 HydrophobicContact CB-CB 4.04Å; A2887-V3012 HydrophobicContact CB-CG1 3.73Å; M2956-V3012 HydrophobicContact CE-CG1 3.7Å; M2956-V3012 HydrophobicContact CE-CG2 4.24Å; F2994-V3012 HydrophobicContact CB-CG1 4.08Å; F2994-V3012 HydrophobicContact CD1-CG1 4.08Å; L2995-V3012 CarbonylContact O-C 3.39Å; L2995-V3012 WeakPolarHBondContact O-CA 3.17Å; R2996-V3012 HydrophobicContact CB-CG2 4.18Å; R2996-V3012 HydrophobicContact CG-CG2 4.24Å
3013	V	96.1	Very high	94.2	Very high	3 Å²	3	32.5 Å²	32.5	2%	0.018	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	131.2	177.3	-175.2	0	0	0	0	108.6	Y2440 F2994 L2995 R3011 L3015 L3018 V3025	Y2440-V3013 HydrophobicContact CD1-CG1 3.87Å; Y2440-V3013 HydrophobicContact CD1-CG2 4.43Å; Y2440-V3013 HydrophobicContact CD2-CG1 4.33Å; Y2440-V3013 HydrophobicContact CG-CG1 3.75Å; F2994-V3013 CarbonylContact C-O 3.48Å; F2994-V3013 WeakPolarHBondContact CA-O 3.22Å; L2995-V3013 PolarHBondContact N-O 3.37Å; L2995-V3013 PolarHBondContact O-N 3.44Å; R3011-V3013 HydrophobicContact CG-CG2 3.67Å; V3013-L3015 PolarHBondContact O-N 3.07Å; V3013-L3018 HydrophobicContact CG1-CB 4.47Å; V3013-L3018 HydrophobicContact CG1-CD1 4.17Å; V3013-V3025 HydrophobicContact CG2-CG1 4.46Å
3014	P	95.2	Very high	94.5	Very high	2 Å²	2	29.5 Å²	29.5	1%	0.013	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.1	124.6	169.8	-16.8	30.9	0	0	0	109.3	A2887 Q2891 F2994 K3016 A3017 L3018	A2887-P3014 HydrophobicContact CB-CG 4.38Å; A2887-P3014 WeakPolarHBondContact O-CG 3.48Å; Q2891-P3014 HydrophobicContact CG-CB 4.06Å; Q2891-P3014 HydrophobicContact CG-CG 3.57Å; Q2891-P3014 VanDerWaalsContact OE1-CB 3.27Å; F2994-P3014 HydrophobicContact CD1-CB 4.14Å; F2994-P3014 HydrophobicContact CD1-CG 4.17Å; F2994-P3014 HydrophobicContact CE1-CB 3.98Å; F2994-P3014 HydrophobicContact CE1-CG 3.89Å; P3014-K3016 PolarHBondContact O-N 2.87Å; P3014-A3017 HydrophobicContact CB-CB 4.32Å; P3014-A3017 PolarHBondContact O-N 2.61Å; P3014-L3018 PolarHBondContact O-N 2.76Å
3015	L	93.7	Very high	94.7	Very high	2 Å²	2	26.4 Å²	26.4	1%	0.01	13%	0.132	C	C	.	.	G	3₁₀ helix	trans	-63.4	-35.6	-171	-177.5	60.6	0	0	0	111.5	L2930 L2955 V2987 L2990 C2993 V3013 A3017 L3018 M3046	L2930-L3015 HydrophobicContact CD1-CD1 4.19Å; L2930-L3015 HydrophobicContact CD2-CD1 3.76Å; L2930-L3015 HydrophobicContact CD2-CD2 4.02Å; L2955-L3015 HydrophobicContact CD2-CD2 4.35Å; V2987-L3015 HydrophobicContact CG1-CD2 4.15Å; V2987-L3015 HydrophobicContact CG2-CD2 3.94Å; L2990-L3015 HydrophobicContact CD1-CB 3.94Å; L2990-L3015 HydrophobicContact CD1-CD2 3.76Å; L2990-L3015 HydrophobicContact CD1-CG 3.65Å; C2993-L3015 HydrophobicContact CB-CB 4.25Å; C2993-L3015 HydrophobicContact CB-CD2 4.23Å; C2993-L3015 VanDerWaalsContact O-CB 3.25Å; C2993-L3015 WeakPolarHBondContact O-CB 3.47Å; C2993-L3015 PolarHBondContact O-N 3.33Å; V3013-L3015 PolarHBondContact O-N 3.07Å; L3015-A3017 PolarHBondContact O-N 3.26Å; L3015-A3017 VanDerWaalsContact O-N 3.14Å; L3015-L3018 HydrophobicContact CD1-CB 4.38Å; L3015-L3018 HydrophobicContact CD1-CD2 3.92Å; L3015-L3018 WeakPolarHBondContact O-CB 3.19Å; L3015-L3018 PolarHBondContact O-N 3.46Å; L3015-L3018 VanDerWaalsContact O-N 3.11Å; L3015-M3046 HydrophobicContact CD1-CE 3.75Å; L3015-M3046 HydrophobicContact CD2-CE 4.43Å; L3015-M3046 HydrophobicContact CG-CE 3.68Å; L3015-M3046 WeakPolarHBondContact O-CE 3.37Å
3016	K	90	Very high	94.7	Very high	64 Å²	64	24 Å²	24	28%	0.278	12%	0.116	S	C	.	.	G	3₁₀ helix	trans	-54.2	-25.5	171.1	-177.4	161.2	-173.9	174.4	0	114.3	L2990 D2991 P3014 I3072	L2990-K3016 HydrophobicContact CG-CB 4.29Å; D2991-K3016 WeakPolarHBondContact OD1-CD 2.98Å; D2991-K3016 WeakPolarHBondContact OD1-CE 3.02Å; D2991-K3016 IonicContact OD1-NZ 3.07Å; D2991-K3016 PolarHBondContact OD1-NZ 2.86Å; P3014-K3016 PolarHBondContact O-N 2.87Å; K3016-I3072 HydrophobicContact CG-CD1 3.81Å
3017	A	90.2	Very high	94.8	Very high	33 Å²	33	17.3 Å²	17.3	27%	0.273	9%	0.087	S	C	.	.	G	3₁₀ helix	trans	-104.6	4.5	-178.7	0	0	0	0	0	114	Y2440 P3014 L3015 R3019	Y2440-A3017 HydrophobicContact CD2-CB 3.77Å; Y2440-A3017 HydrophobicContact CE2-CB 3.51Å; P3014-A3017 HydrophobicContact CB-CB 4.32Å; P3014-A3017 PolarHBondContact O-N 2.61Å; L3015-A3017 PolarHBondContact O-N 3.26Å; L3015-A3017 VanDerWaalsContact O-N 3.14Å; A3017-R3019 PolarHBondContact O-N 2.95Å
3018	L	92.1	Very high	94.7	Very high	12 Å²	12	16.7 Å²	16.7	6%	0.063	8%	0.08	C	C	.	.			trans	-80.2	112.5	179	-173.9	71.4	0	0	0	110.7	A2439 L2995 V3013 P3014 L3015 A3020 I3042	A2439-L3018 HydrophobicContact CB-CD1 3.96Å; L2995-L3018 HydrophobicContact CD2-CD2 3.85Å; V3013-L3018 HydrophobicContact CG1-CB 4.47Å; V3013-L3018 HydrophobicContact CG1-CD1 4.17Å; P3014-L3018 PolarHBondContact O-N 2.76Å; L3015-L3018 HydrophobicContact CD1-CB 4.38Å; L3015-L3018 HydrophobicContact CD1-CD2 3.92Å; L3015-L3018 WeakPolarHBondContact O-CB 3.19Å; L3015-L3018 PolarHBondContact O-N 3.46Å; L3015-L3018 VanDerWaalsContact O-N 3.11Å; L3018-A3020 PolarHBondContact O-N 3.26Å; L3018-I3042 HydrophobicContact CD1-CD1 4.21Å
3019	R	92.5	Very high	94.6	Very high	70 Å²	70	16.2 Å²	16.2	26%	0.264	8%	0.078	S	C	.	.			trans	-62.4	136.2	175.2	-70.2	169.5	69	-162.1	13.5	111.1	E2397 S2436 F2438 A2439 A3017 R3023 S3044	E2397-R3019 IonicContact OE1-CZ 3.93Å; E2397-R3019 IonicContact OE1-NE 3.55Å; E2397-R3019 PolarHBondContact OE1-NE 3.1Å; E2397-R3019 IonicContact OE1-NH2 2.75Å; E2397-R3019 PolarHBondContact OE1-NH2 3.1Å; E2397-R3019 IonicContact OE2-NH2 2.73Å; S2436-R3019 PolarHBondContact O-NH1 3.41Å; S2436-R3019 PolarHBondContact O-NH2 3.04Å; F2438-R3019 PolarHBondContact O-NH1 3.01Å; A2439-R3019 WeakPolarHBondContact O-CB 3.44Å; A2439-R3019 PolarHBondContact O-N 2.91Å; A3017-R3019 PolarHBondContact O-N 2.95Å; R3019-R3023 HydrophobicContact CB-CG 4.45Å; R3019-S3044 PolarHBondContact O-OG 2.86Å
3020	A	92.3	Very high	94.5	Very high	11 Å²	11	18.8 Å²	18.8	9%	0.091	9%	0.094	C	C	.	.			trans	-66	153.7	174.1	0	0	0	0	0	112.1	M2396 L3018 R3023 S3044 P3073	M2396-A3020 HydrophobicContact CB-CB 4.1Å; M2396-A3020 HydrophobicContact CG-CB 3.91Å; L3018-A3020 PolarHBondContact O-N 3.26Å; A3020-R3023 VanDerWaalsContact O-CZ 3.32Å; A3020-R3023 PolarHBondContact O-NE 3.44Å; A3020-R3023 PolarHBondContact O-NH2 3.32Å; A3020-S3044 WeakPolarHBondContact CA-OG 3.45Å; A3020-P3073 HydrophobicContact CB-CG 4.2Å
3021	G	95	Very high	94.2	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	96.8	-161.2	168.9	0	0	0	0	0	116.3	H2394 Q2395 R3023 Y3043 S3044	H2394-G3021 WeakPolarHBondContact O-CA 3.24Å; Q2395-G3021 VanDerWaalsContact OE1-CA 3.3Å; G3021-R3023 PolarHBondContact O-N 3.28Å; G3021-R3023 VanDerWaalsContact O-N 3.17Å; G3021-Y3043 WeakPolarHBondContact O-CA 3.15Å; G3021-S3044 PolarHBondContact N-O 2.88Å; G3021-S3044 PolarHBondContact N-OG 2.94Å; G3021-S3044 PolarHBondContact O-N 2.62Å
3022	Y	97.6	Very high	94	Very high	32 Å²	32	22.2 Å²	22.2	13%	0.125	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	91.6	-177.7	-71.1	-71.5	0	0	0	111	L2270 F2390 H2394 Q2395 N2437 I2935 F3041 I3042 Y3043	L2270-Y3022 HydrophobicContact CD1-CE1 3.97Å; L2270-Y3022 HydrophobicContact CD1-CE2 3.9Å; L2270-Y3022 HydrophobicContact CD2-CD1 3.8Å; L2270-Y3022 HydrophobicContact CD2-CD2 4.23Å; L2270-Y3022 HydrophobicContact CD2-CE1 3.87Å; L2270-Y3022 HydrophobicContact CD2-CE2 4.29Å; L2270-Y3022 HydrophobicContact CD2-CG 3.99Å; F2390-Y3022 AromaticContact CE2-CD2 3.69Å; F2390-Y3022 HydrophobicContact CE2-CD2 3.69Å; F2390-Y3022 AromaticContact CE2-CE2 3.91Å; F2390-Y3022 HydrophobicContact CE2-CE2 3.91Å; F2390-Y3022 AromaticContact CZ-CD2 3.58Å; F2390-Y3022 HydrophobicContact CZ-CD2 3.58Å; F2390-Y3022 HydrophobicContact CZ-CE2 4.29Å; F2390-Y3022 HydrophobicContact CZ-CG 4.33Å; H2394-Y3022 HydrophobicContact CB-CD2 3.84Å; H2394-Y3022 HydrophobicContact CB-CE2 3.74Å; H2394-Y3022 AromaticContact CG-CE2 3.64Å; H2394-Y3022 AromaticContact ND1-CE2 3.73Å; Q2395-Y3022 PolarHBondContact NE2-O 3.5Å; N2437-Y3022 PolarHBondContact ND2-O 3.07Å; N2437-Y3022 PolarHBondContact OD1-O 3.03Å; I2935-Y3022 HydrophobicContact CD1-CD1 3.75Å; I2935-Y3022 HydrophobicContact CD1-CE1 3.74Å; Y3022-F3041 HydrophobicContact CD1-CE1 4.17Å; Y3022-F3041 AromaticContact CD1-CZ 3.84Å; Y3022-F3041 HydrophobicContact CD1-CZ 3.84Å; Y3022-F3041 HydrophobicContact CG-CZ 4.23Å; Y3022-I3042 WeakPolarHBondContact CA-O 3.41Å; Y3022-Y3043 AromaticContact CD1-CD2 3.87Å; Y3022-Y3043 HydrophobicContact CD1-CD2 3.87Å; Y3022-Y3043 HydrophobicContact CD1-CG 4.28Å; Y3022-Y3043 AromaticContact CD2-CD2 3.78Å; Y3022-Y3043 HydrophobicContact CD2-CD2 3.78Å; Y3022-Y3043 HydrophobicContact CD2-CE2 4.21Å; Y3022-Y3043 AromaticContact CE1-CD2 3.81Å; Y3022-Y3043 HydrophobicContact CE1-CD2 3.81Å; Y3022-Y3043 HydrophobicContact CE1-CG 4.05Å; Y3022-Y3043 AromaticContact CE2-CD2 3.72Å; Y3022-Y3043 HydrophobicContact CE2-CD2 3.72Å; Y3022-Y3043 HydrophobicContact CE2-CE2 4Å; Y3022-Y3043 AromaticContact CG-CD2 3.85Å; Y3022-Y3043 HydrophobicContact CG-CD2 3.85Å; Y3022-Y3043 AromaticContact CZ-CD2 3.73Å
3023	R	96.6	Very high	93.5	Very high	3 Å²	3	24.6 Å²	24.6	1%	0.011	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	157.5	-171.2	-54.2	-57.7	177.8	172.3	7.6	113	Q2395 E2397 N2437 A2439 R3019 A3020 G3021 F3041 I3042	Q2395-R3023 PolarHBondContact O-NH2 3.46Å; E2397-R3023 IonicContact OE1-CZ 3.01Å; E2397-R3023 IonicContact OE1-NH1 2.7Å; E2397-R3023 IonicContact OE1-NH2 3.94Å; E2397-R3023 PolarHBondContact OE1-NH2 3.49Å; E2397-R3023 IonicContact OE2-CZ 2.78Å; E2397-R3023 VanDerWaalsContact OE2-CZ 3.31Å; E2397-R3023 IonicContact OE2-NH1 3.27Å; E2397-R3023 PolarHBondContact OE2-NH1 3.2Å; E2397-R3023 IonicContact OE2-NH2 3.79Å; E2397-R3023 PolarHBondContact OE2-NH2 2.91Å; N2437-R3023 VanDerWaalsContact OD1-CD 3.3Å; N2437-R3023 WeakPolarHBondContact OD1-CD 3.45Å; N2437-R3023 PolarHBondContact OD1-NH1 2.95Å; A2439-R3023 HydrophobicContact CB-CB 3.56Å; A2439-R3023 HydrophobicContact CB-CG 4.28Å; R3019-R3023 HydrophobicContact CB-CG 4.45Å; A3020-R3023 VanDerWaalsContact O-CZ 3.32Å; A3020-R3023 PolarHBondContact O-NE 3.44Å; A3020-R3023 PolarHBondContact O-NH2 3.32Å; G3021-R3023 PolarHBondContact O-N 3.28Å; G3021-R3023 VanDerWaalsContact O-N 3.17Å; R3023-F3041 WeakPolarHBondContact O-CA 3.43Å; R3023-F3041 WeakPolarHBondContact O-CD2 3.38Å; R3023-I3042 PolarHBondContact N-O 3.47Å; R3023-I3042 PolarHBondContact O-N 3.49Å
3024	H	95.2	Very high	93.1	Very high	4 Å²	4	27.3 Å²	27.3	2%	0.019	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	120.9	168.5	-85.7	-79.1	0	0	0	111.6	R2264 L2432 N2437 F2438 A2439 Q2938 I3040 F3041	R2264-H3024 PolarHBondContact NH1-CE1 3.21Å; R2264-H3024 PolarHBondContact NH1-NE2 3.47Å; R2264-H3024 PolarHBondContact NH2-CE1 2.91Å; R2264-H3024 PolarHBondContact NH2-NE2 3.3Å; L2432-H3024 PolarHBondContact O-CD2 3.35Å; N2437-H3024 PolarHBondContact O-N 2.88Å; F2438-H3024 CarbonylContact C-O 3.52Å; F2438-H3024 WeakPolarHBondContact CA-O 3.4Å; F2438-H3024 HydrophobicContact CD1-CB 3.84Å; F2438-H3024 HydrophobicContact CE1-CB 4.23Å; A2439-H3024 PolarHBondContact N-O 3.24Å; Q2938-H3024 PolarHBondContact NE2-CE1 2.8Å; Q2938-H3024 VanDerWaalsContact NE2-CE1 3.26Å; H3024-I3040 CarbonylContact C-O 3.45Å; H3024-I3040 WeakPolarHBondContact CA-O 3.46Å; H3024-F3041 AromaticContact CD2-CD2 3.7Å; H3024-F3041 AromaticContact CE1-CD2 3.83Å; H3024-F3041 AromaticContact NE2-CD2 3.46Å; H3024-F3041 WeakPolarHBondContact NE2-CD2 3.35Å
3025	V	95.9	Very high	92.9	Very high	5 Å²	5	29.1 Å²	29.1	3%	0.03	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	118.5	165.9	-175.6	0	0	0	0	107.9	A2439 L2997 R3011 V3013 S3039 I3040 I3042	A2439-V3025 HydrophobicContact CB-CG2 3.8Å; L2997-V3025 HydrophobicContact CD1-CB 4.4Å; L2997-V3025 HydrophobicContact CD1-CG1 4.32Å; L2997-V3025 HydrophobicContact CD1-CG2 4.07Å; R3011-V3025 HydrophobicContact CB-CG1 4.13Å; R3011-V3025 HydrophobicContact CG-CG1 4.03Å; V3013-V3025 HydrophobicContact CG2-CG1 4.46Å; V3025-S3039 CarbonylContact O-C 3.59Å; V3025-S3039 WeakPolarHBondContact O-CA 3.39Å; V3025-S3039 VanDerWaalsContact O-CB 3.24Å; V3025-S3039 WeakPolarHBondContact O-CB 3.35Å; V3025-I3040 PolarHBondContact N-O 3.16Å; V3025-I3040 PolarHBondContact O-N 2.9Å; V3025-I3042 HydrophobicContact CG2-CD1 3.64Å; V3025-I3042 HydrophobicContact CG2-CG1 4.05Å; V3025-I3042 HydrophobicContact CG2-CG2 4.37Å
3026	R	93.8	Very high	92.4	Very high	43 Å²	43	30.9 Å²	30.9	16%	0.162	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	129	170.8	-66.6	178.8	-68.1	149.9	8.9	109.1	F2438 Y2440 E2443	F2438-R3026 HydrophobicContact CD1-CG 3.72Å; F2438-R3026 HydrophobicContact CD2-CG 4.41Å; F2438-R3026 HydrophobicContact CE1-CG 3.66Å; F2438-R3026 HydrophobicContact CE2-CG 4.34Å; F2438-R3026 HydrophobicContact CG-CG 4.14Å; F2438-R3026 HydrophobicContact CZ-CG 3.99Å; Y2440-R3026 PolarHBondContact O-NH2 2.88Å; E2443-R3026 VanDerWaalsContact CD-NH2 3.33Å; E2443-R3026 IonicContact OE1-CZ 2.66Å; E2443-R3026 IonicContact OE1-NH1 2.72Å; E2443-R3026 PolarHBondContact OE1-NH1 3.33Å; E2443-R3026 IonicContact OE1-NH2 3.72Å; E2443-R3026 PolarHBondContact OE1-NH2 3.03Å; E2443-R3026 VanDerWaalsContact OE1-NH2 3.08Å; E2443-R3026 IonicContact OE2-CZ 2.96Å; E2443-R3026 IonicContact OE2-NH1 3.36Å; E2443-R3026 IonicContact OE2-NH2 2.72Å; E2443-R3026 PolarHBondContact OE2-NH2 3.09Å
3027	L	95.1	Very high	92.2	Very high	2 Å²	2	28.6 Å²	28.6	1%	0.01	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	159.8	178.6	-65.5	173.1	0	0	0	111.9	V2940 V2999 A3009 R3011 L3035 S3038 I3040	V2940-L3027 HydrophobicContact CG1-CD1 4.42Å; V2999-L3027 HydrophobicContact CG2-CD1 3.87Å; A3009-L3027 HydrophobicContact CB-CB 4.12Å; A3009-L3027 HydrophobicContact CB-CD1 3.87Å; A3009-L3027 HydrophobicContact CB-CG 4.48Å; R3011-L3027 HydrophobicContact CB-CD2 4.31Å; L3027-L3035 HydrophobicContact CB-CD1 4.21Å; L3027-L3035 PolarHBondContact O-N 2.94Å; L3027-L3035 VanDerWaalsContact O-N 3.14Å; L3027-S3038 WeakPolarHBondContact CB-O 3.22Å; L3027-S3038 PolarHBondContact N-O 2.88Å; L3027-I3040 HydrophobicContact CD1-CD1 4.47Å; L3027-I3040 HydrophobicContact CD1-CG1 4.01Å; L3027-I3040 HydrophobicContact CD2-CD1 4.01Å; L3027-I3040 HydrophobicContact CD2-CG1 4.11Å; L3027-I3040 HydrophobicContact CG-CG1 4.29Å
3028	R	94.4	Very high	92.3	Very high	21 Å²	21	27.4 Å²	27.4	8%	0.079	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	164.9	169.7	-56.7	-175.2	167.2	177.7	-1.2	108.4	E2890 A3009 Q3010 R3011 N3032 S3033 L3035	E2890-R3028 IonicContact OE1-CZ 2.74Å; E2890-R3028 IonicContact OE1-NH1 3.24Å; E2890-R3028 PolarHBondContact OE1-NH1 2.78Å; E2890-R3028 IonicContact OE1-NH2 2.76Å; E2890-R3028 PolarHBondContact OE1-NH2 3.33Å; E2890-R3028 IonicContact OE2-NH2 2.61Å; E2890-R3028 PolarHBondContact OE2-NH2 3.2Å; A3009-R3028 CarbonylContact C-O 3.23Å; A3009-R3028 WeakPolarHBondContact CA-O 3.37Å; A3009-R3028 WeakPolarHBondContact CB-O 3.42Å; Q3010-R3028 PolarHBondContact N-O 2.83Å; Q3010-R3028 CarbonylContact O-C 3.59Å; Q3010-R3028 WeakPolarHBondContact O-CA 3.29Å; Q3010-R3028 WeakPolarHBondContact O-CB 3.31Å; Q3010-R3028 PolarHBondContact O-N 2.95Å; Q3010-R3028 VanDerWaalsContact O-O 3.09Å; R3011-R3028 VanDerWaalsContact NH2-NH2 3.14Å; R3028-N3032 WeakPolarHBondContact CD-O 3.39Å; R3028-N3032 WeakPolarHBondContact CD-OD1 3.45Å; R3028-N3032 PolarHBondContact NH1-OD1 3.34Å; R3028-S3033 CarbonylContact C-O 3.57Å; R3028-S3033 VanDerWaalsContact CA-O 3.23Å; R3028-S3033 WeakPolarHBondContact CA-O 3.49Å; R3028-S3033 WeakPolarHBondContact CB-O 3.46Å; R3028-L3035 WeakPolarHBondContact O-CD1 3.27Å
3029	S	93.7	Very high	92.4	Very high	16 Å²	16	27.1 Å²	27.1	11%	0.112	14%	0.144	C	C	.	.			trans	-66.6	170.5	170.1	59.5	0	0	0	0	110.7	N3031 N3032 S3033	S3029-N3031 VanDerWaalsContact C-N 3.27Å; S3029-N3031 WeakPolarHBondContact CB-OD1 3.4Å; S3029-N3031 PolarHBondContact O-N 3.2Å; S3029-N3031 PolarHBondContact OG-OD1 3.49Å; S3029-N3032 PolarHBondContact O-N 3.06Å; S3029-S3033 PolarHBondContact N-O 2.78Å; S3029-S3033 WeakPolarHBondContact OG-CA 3.45Å; S3029-S3033 VanDerWaalsContact OG-CB 3.29Å; S3029-S3033 WeakPolarHBondContact OG-CB 3.32Å; S3029-S3033 PolarHBondContact OG-N 3.19Å; S3029-S3033 PolarHBondContact OG-O 3.07Å
3030	P	93.5	Very high	92.7	Very high	53 Å²	53	23.8 Å²	23.8	34%	0.344	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.7	-43.1	174.8	-28.8	37.9	0	0	0	112.7	C3007 Q3010 N3032	C3007-P3030 HydrophobicContact CB-CG 4.4Å; C3007-P3030 WeakPolarHBondContact O-CG 3.46Å; Q3010-P3030 PolarHBondContact NE2-O 3.31Å; P3030-N3032 PolarHBondContact O-N 3.26Å
3031	N	90.8	Very high	92.9	Very high	67 Å²	67	23.4 Å²	23.4	36%	0.358	13%	0.128	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	35.9	173.5	70.9	-35.7	0	0	0	113.8	Q2878 S3029 S3033	Q2878-N3031 HydrophobicContact CB-CB 3.85Å; S3029-N3031 VanDerWaalsContact C-N 3.27Å; S3029-N3031 WeakPolarHBondContact CB-OD1 3.4Å; S3029-N3031 PolarHBondContact O-N 3.2Å; S3029-N3031 PolarHBondContact OG-OD1 3.49Å; N3031-S3033 PolarHBondContact O-N 3.15Å; N3031-S3033 PolarHBondContact O-OG 2.86Å
3032	N	92	Very high	93.1	Very high	22 Å²	22	23.4 Å²	23.4	12%	0.118	13%	0.128	C	C	.	.	S	Bend	trans	54.6	19.5	171	-162.8	25	0	0	0	116.3	A2883 A2886 R3028 S3029 P3030	A2883-N3032 HydrophobicContact CB-CB 4.47Å; A2886-N3032 WeakPolarHBondContact CB-ND2 3.41Å; R3028-N3032 WeakPolarHBondContact CD-O 3.39Å; R3028-N3032 WeakPolarHBondContact CD-OD1 3.45Å; R3028-N3032 PolarHBondContact NH1-OD1 3.34Å; S3029-N3032 PolarHBondContact O-N 3.06Å; P3030-N3032 PolarHBondContact O-N 3.26Å
3033	S	88.4	Confident	93.1	Very high	52 Å²	52	23.5 Å²	23.5	36%	0.364	13%	0.128	S	C	.	.	P	Polyproline II helix	trans	-89.9	134.5	178.6	-55.8	0	0	0	0	110.5	R3028 S3029 N3031 L3035	R3028-S3033 CarbonylContact C-O 3.57Å; R3028-S3033 VanDerWaalsContact CA-O 3.23Å; R3028-S3033 WeakPolarHBondContact CA-O 3.49Å; R3028-S3033 WeakPolarHBondContact CB-O 3.46Å; S3029-S3033 PolarHBondContact N-O 2.78Å; S3029-S3033 WeakPolarHBondContact OG-CA 3.45Å; S3029-S3033 VanDerWaalsContact OG-CB 3.29Å; S3029-S3033 WeakPolarHBondContact OG-CB 3.32Å; S3029-S3033 PolarHBondContact OG-N 3.19Å; S3029-S3033 PolarHBondContact OG-O 3.07Å; N3031-S3033 PolarHBondContact O-N 3.15Å; N3031-S3033 PolarHBondContact O-OG 2.86Å; S3033-L3035 PolarHBondContact O-N 3.22Å
3034	P	88.1	Confident	93.1	Very high	60 Å²	60	23.6 Å²	23.6	39%	0.39	13%	0.129	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67	132.2	-171.4	-19.9	31.4	0	0	0	114.3
3035	L	89.6	Confident	92.9	Very high	40 Å²	40	26.2 Å²	26.2	21%	0.209	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	136.6	174.2	-63.1	171.4	0	0	0	109.8	P2942 A3009 L3027 R3028 S3033 Y3037	P2942-L3035 HydrophobicContact CG-CD1 4.11Å; P2942-L3035 HydrophobicContact CG-CD2 4.2Å; A3009-L3035 HydrophobicContact CB-CD1 3.63Å; L3027-L3035 HydrophobicContact CB-CD1 4.21Å; L3027-L3035 PolarHBondContact O-N 2.94Å; L3027-L3035 VanDerWaalsContact O-N 3.14Å; R3028-L3035 WeakPolarHBondContact O-CD1 3.27Å; S3033-L3035 PolarHBondContact O-N 3.22Å; L3035-Y3037 VanDerWaalsContact C-N 3.29Å; L3035-Y3037 PolarHBondContact O-N 3.15Å
3036	E	84.3	Confident	92.7	Very high	39 Å²	39	26.6 Å²	26.6	18%	0.182	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	-17.9	-167.4	-56.8	167.5	177	0	0	113.8
3037	Y	84.8	Confident	92.3	Very high	15 Å²	15	25 Å²	25	6%	0.059	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	-33.1	-179.1	-161.2	-79.7	0	0	0	114.4	F2256 S2260 Q2938 F2939 L3035 S3039	F2256-Y3037 HydrophobicContact CE1-CD2 4.47Å; F2256-Y3037 AromaticContact CE1-CE2 3.54Å; F2256-Y3037 HydrophobicContact CE1-CE2 3.54Å; F2256-Y3037 HydrophobicContact CZ-CD2 4.13Å; F2256-Y3037 AromaticContact CZ-CE2 3.34Å; F2256-Y3037 HydrophobicContact CZ-CE2 3.34Å; F2256-Y3037 AromaticContact CZ-CZ 3.62Å; S2260-Y3037 PolarHBondContact OG-OH 3.27Å; Q2938-Y3037 HydrophobicContact CB-CE1 4.07Å; F2939-Y3037 HydrophobicContact CB-CD1 4.24Å; F2939-Y3037 AromaticContact CD2-CD1 3.25Å; F2939-Y3037 HydrophobicContact CD2-CD1 3.25Å; F2939-Y3037 AromaticContact CD2-CE1 3.37Å; F2939-Y3037 HydrophobicContact CD2-CE1 3.37Å; F2939-Y3037 HydrophobicContact CD2-CG 4.28Å; F2939-Y3037 AromaticContact CE2-CD1 3.7Å; F2939-Y3037 HydrophobicContact CE2-CD1 3.7Å; F2939-Y3037 AromaticContact CE2-CE1 3.47Å; F2939-Y3037 HydrophobicContact CE2-CE1 3.47Å; F2939-Y3037 VanDerWaalsContact CE2-CE1 3.47Å; F2939-Y3037 AromaticContact CG-CD1 3.92Å; F2939-Y3037 HydrophobicContact CG-CD1 3.92Å; F2939-Y3037 HydrophobicContact CG-CE1 4.44Å; L3035-Y3037 VanDerWaalsContact C-N 3.29Å; L3035-Y3037 PolarHBondContact O-N 3.15Å; Y3037-S3039 PolarHBondContact O-N 3.07Å; Y3037-S3039 PolarHBondContact O-OG 2.71Å
3038	S	92.9	Very high	91.6	Very high	8 Å²	8	25.7 Å²	25.7	6%	0.056	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.7	126.7	-171	-54.9	0	0	0	0	112.5	Q2938 F2939 L3027	Q2938-S3038 WeakPolarHBondContact O-CA 3.42Å; F2939-S3038 VanDerWaalsContact O-CB 3.28Å; F2939-S3038 WeakPolarHBondContact O-CB 3.35Å; F2939-S3038 PolarHBondContact O-OG 3.27Å; L3027-S3038 WeakPolarHBondContact CB-O 3.22Å; L3027-S3038 PolarHBondContact N-O 2.88Å
3039	S	94.9	Very high	90.6	Very high	7 Å²	7	27.2 Å²	27.2	5%	0.049	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	155.3	-175.2	48.8	0	0	0	0	113.4	G2937 Q2938 V3025 Y3037	G2937-S3039 CarbonylContact C-O 3.59Å; G2937-S3039 WeakPolarHBondContact CA-O 3.34Å; Q2938-S3039 PolarHBondContact N-O 3.13Å; Q2938-S3039 PolarHBondContact NE2-OG 3.38Å; Q2938-S3039 PolarHBondContact O-N 3.02Å; V3025-S3039 CarbonylContact O-C 3.59Å; V3025-S3039 WeakPolarHBondContact O-CA 3.39Å; V3025-S3039 VanDerWaalsContact O-CB 3.24Å; V3025-S3039 WeakPolarHBondContact O-CB 3.35Å; Y3037-S3039 PolarHBondContact O-N 3.07Å; Y3037-S3039 PolarHBondContact O-OG 2.71Å
3040	I	97.2	Very high	89.3	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	136.7	168.9	-57.3	179.2	0	0	0	108	I2934 S2936 V2951 L2997 V2999 H3024 V3025 L3027 I3042	I2934-I3040 HydrophobicContact CG2-CG2 4.04Å; S2936-I3040 WeakPolarHBondContact O-CA 3.16Å; S2936-I3040 WeakPolarHBondContact O-CG2 3.37Å; V2951-I3040 HydrophobicContact CG1-CD1 3.97Å; V2951-I3040 HydrophobicContact CG2-CD1 4.03Å; L2997-I3040 HydrophobicContact CB-CD1 4.19Å; L2997-I3040 HydrophobicContact CD1-CD1 4.32Å; V2999-I3040 HydrophobicContact CG2-CD1 4.09Å; H3024-I3040 CarbonylContact C-O 3.45Å; H3024-I3040 WeakPolarHBondContact CA-O 3.46Å; V3025-I3040 PolarHBondContact N-O 3.16Å; V3025-I3040 PolarHBondContact O-N 2.9Å; L3027-I3040 HydrophobicContact CD1-CD1 4.47Å; L3027-I3040 HydrophobicContact CD1-CG1 4.01Å; L3027-I3040 HydrophobicContact CD2-CD1 4.01Å; L3027-I3040 HydrophobicContact CD2-CG1 4.11Å; L3027-I3040 HydrophobicContact CG-CG1 4.29Å; I3040-I3042 HydrophobicContact CG2-CG2 3.76Å
3041	F	97.9	Very high	88.1	Confident	2 Å²	2	29.1 Å²	29.1	1%	0.009	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	124.6	169.4	-173.3	-126.1	0	0	0	108.9	D2266 L2267 L2270 L2432 I2935 S2936 Y3022 R3023 H3024	D2266-F3041 WeakPolarHBondContact OD2-CD1 3.44Å; L2267-F3041 HydrophobicContact CD2-CD1 4.23Å; L2267-F3041 HydrophobicContact CD2-CE1 3.49Å; L2267-F3041 VanDerWaalsContact CD2-CE1 3.49Å; L2267-F3041 HydrophobicContact CD2-CE2 4.15Å; L2267-F3041 HydrophobicContact CD2-CZ 3.44Å; L2267-F3041 VanDerWaalsContact CD2-CZ 3.44Å; L2270-F3041 HydrophobicContact CD2-CE1 4.46Å; L2270-F3041 HydrophobicContact CD2-CZ 4.25Å; L2432-F3041 HydrophobicContact CD1-CZ 4.32Å; I2935-F3041 HydrophobicContact CB-CD1 3.86Å; I2935-F3041 WeakPolarHBondContact CB-O 3.35Å; I2935-F3041 HydrophobicContact CD1-CD1 3.9Å; I2935-F3041 HydrophobicContact CD1-CE1 3.8Å; I2935-F3041 HydrophobicContact CG1-CD1 4.49Å; I2935-F3041 HydrophobicContact CG2-CD1 3.72Å; I2935-F3041 HydrophobicContact CG2-CE1 4.18Å; I2935-F3041 PolarHBondContact N-O 3Å; S2936-F3041 PolarHBondContact N-O 3.46Å; S2936-F3041 PolarHBondContact O-N 3.25Å; S2936-F3041 WeakPolarHBondContact OG-CB 3.23Å; Y3022-F3041 HydrophobicContact CD1-CE1 4.17Å; Y3022-F3041 AromaticContact CD1-CZ 3.84Å; Y3022-F3041 HydrophobicContact CD1-CZ 3.84Å; Y3022-F3041 HydrophobicContact CG-CZ 4.23Å; R3023-F3041 WeakPolarHBondContact O-CA 3.43Å; R3023-F3041 WeakPolarHBondContact O-CD2 3.38Å; H3024-F3041 AromaticContact CD2-CD2 3.7Å; H3024-F3041 AromaticContact CE1-CD2 3.83Å; H3024-F3041 AromaticContact NE2-CD2 3.46Å; H3024-F3041 WeakPolarHBondContact NE2-CD2 3.35Å
3042	I	98.1	Very high	87.1	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	160.5	-177.2	64.7	168.8	0	0	0	111.2	L2932 N2933 I2934 L2997 L3018 Y3022 R3023 V3025 I3040	L2932-I3042 HydrophobicContact CD1-CB 4.2Å; L2932-I3042 HydrophobicContact CD1-CD1 3.96Å; L2932-I3042 HydrophobicContact CD1-CG2 4.47Å; N2933-I3042 CarbonylContact O-C 3.42Å; N2933-I3042 VanDerWaalsContact O-CA 3.25Å; N2933-I3042 WeakPolarHBondContact O-CA 3.36Å; I2934-I3042 HydrophobicContact CD1-CG2 3.71Å; L2997-I3042 HydrophobicContact CD1-CG2 4.45Å; L3018-I3042 HydrophobicContact CD1-CD1 4.21Å; Y3022-I3042 WeakPolarHBondContact CA-O 3.41Å; R3023-I3042 PolarHBondContact N-O 3.47Å; R3023-I3042 PolarHBondContact O-N 3.49Å; V3025-I3042 HydrophobicContact CG2-CD1 3.64Å; V3025-I3042 HydrophobicContact CG2-CG1 4.05Å; V3025-I3042 HydrophobicContact CG2-CG2 4.37Å; I3040-I3042 HydrophobicContact CG2-CG2 3.76Å
3043	Y	97.9	Very high	86.3	Confident	34 Å²	34	31.6 Å²	31.6	13%	0.133	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	120.6	157.4	175.6	-95.8	0	0	0	109.8	H2394 N2933 G3021 Y3022 R3045	H2394-Y3043 HydrophobicContact CB-CE2 4.29Å; H2394-Y3043 AromaticContact ND1-CE2 3.88Å; H2394-Y3043 WeakPolarHBondContact O-CE2 3.34Å; N2933-Y3043 PolarHBondContact N-O 2.92Å; N2933-Y3043 PolarHBondContact O-N 2.82Å; G3021-Y3043 WeakPolarHBondContact O-CA 3.15Å; Y3022-Y3043 AromaticContact CD1-CD2 3.87Å; Y3022-Y3043 HydrophobicContact CD1-CD2 3.87Å; Y3022-Y3043 HydrophobicContact CD1-CG 4.28Å; Y3022-Y3043 AromaticContact CD2-CD2 3.78Å; Y3022-Y3043 HydrophobicContact CD2-CD2 3.78Å; Y3022-Y3043 HydrophobicContact CD2-CE2 4.21Å; Y3022-Y3043 AromaticContact CE1-CD2 3.81Å; Y3022-Y3043 HydrophobicContact CE1-CD2 3.81Å; Y3022-Y3043 HydrophobicContact CE1-CG 4.05Å; Y3022-Y3043 AromaticContact CE2-CD2 3.72Å; Y3022-Y3043 HydrophobicContact CE2-CD2 3.72Å; Y3022-Y3043 HydrophobicContact CE2-CE2 4Å; Y3022-Y3043 AromaticContact CG-CD2 3.85Å; Y3022-Y3043 HydrophobicContact CG-CD2 3.85Å; Y3022-Y3043 AromaticContact CZ-CD2 3.73Å; Y3043-R3045 HydrophobicContact CE1-CB 4.34Å
3044	S	96	Very high	85.6	Confident	5 Å²	5	30.5 Å²	30.5	4%	0.035	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	142.9	-179.9	50.2	0	0	0	0	111.7	I2931 R3019 A3020 G3021	I2931-S3044 CarbonylContact O-C 3.41Å; I2931-S3044 WeakPolarHBondContact O-CA 3.27Å; R3019-S3044 PolarHBondContact O-OG 2.86Å; A3020-S3044 WeakPolarHBondContact CA-OG 3.45Å; G3021-S3044 PolarHBondContact N-O 2.88Å; G3021-S3044 PolarHBondContact N-OG 2.94Å; G3021-S3044 PolarHBondContact O-N 2.62Å
3045	R	92.1	Very high	84.4	Confident	59 Å²	59	29.9 Å²	29.9	22%	0.223	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	137.4	169.2	-170	-179	-170.2	-158.9	9.7	110	I2931 Y3043 E3047 F3075	I2931-R3045 HydrophobicContact CB-CB 4.43Å; I2931-R3045 PolarHBondContact N-O 3Å; I2931-R3045 PolarHBondContact O-N 2.93Å; Y3043-R3045 HydrophobicContact CE1-CB 4.34Å; R3045-E3047 VanDerWaalsContact CD-OE1 3.32Å; R3045-E3047 WeakPolarHBondContact CD-OE1 3.46Å; R3045-E3047 HydrophobicContact CG-CG 4.08Å; R3045-E3047 IonicContact CZ-OE1 2.83Å; R3045-E3047 VanDerWaalsContact CZ-OE1 3.28Å; R3045-E3047 IonicContact NE-OE1 3.84Å; R3045-E3047 PolarHBondContact NE-OE1 3.41Å; R3045-E3047 IonicContact NH1-OE1 3.24Å; R3045-E3047 PolarHBondContact NH1-OE1 3.36Å; R3045-F3075 VanDerWaalsContact NH2-CE1 3.32Å; R3045-F3075 VanDerWaalsContact NH2-CE2 3.28Å
3046	M	90.3	Very high	82.6	Confident	13 Å²	13	30.4 Å²	30.4	6%	0.064	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	134.7	168.6	-69.8	179.6	-174.3	0	0	109.1	I2928 L2930 L2990 L3015 I3072 I3074 F3075	I2928-M3046 HydrophobicContact CG2-CB 3.77Å; I2928-M3046 HydrophobicContact CG2-CG 4.09Å; L2930-M3046 HydrophobicContact CD1-CG 4.19Å; L2990-M3046 HydrophobicContact CD1-CE 4.06Å; L2990-M3046 HydrophobicContact CD2-SD 4.26Å; L3015-M3046 HydrophobicContact CD1-CE 3.75Å; L3015-M3046 HydrophobicContact CD2-CE 4.43Å; L3015-M3046 HydrophobicContact CG-CE 3.68Å; L3015-M3046 WeakPolarHBondContact O-CE 3.37Å; M3046-I3072 HydrophobicContact SD-CG2 3.84Å; M3046-I3074 HydrophobicContact CB-CG1 4.28Å; M3046-F3075 WeakPolarHBondContact O-CB 3.26Å; M3046-F3075 PolarHBondContact O-N 2.98Å
3047	E	86.3	Confident	80.9	Confident	10 Å²	10	34 Å²	34	5%	0.047	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	137.8	-179.1	-56.1	178.9	158.5	0	0	109.3	I2928 R2929 I2931 R3045 F3075	I2928-E3047 CarbonylContact C-O 3.6Å; I2928-E3047 WeakPolarHBondContact CA-O 3.39Å; R2929-E3047 HydrophobicContact CB-CB 4.38Å; R2929-E3047 IonicContact CZ-OE2 3.83Å; R2929-E3047 VanDerWaalsContact CZ-OE2 3.24Å; R2929-E3047 PolarHBondContact N-O 3.3Å; R2929-E3047 IonicContact NE-OE2 3.02Å; R2929-E3047 PolarHBondContact NE-OE2 3.28Å; R2929-E3047 IonicContact NH2-OE2 2.72Å; R2929-E3047 PolarHBondContact NH2-OE2 3.33Å; R2929-E3047 PolarHBondContact O-N 2.99Å; I2931-E3047 WeakPolarHBondContact CD1-OE1 3.44Å; I2931-E3047 WeakPolarHBondContact CD1-OE2 3.25Å; R3045-E3047 VanDerWaalsContact CD-OE1 3.32Å; R3045-E3047 WeakPolarHBondContact CD-OE1 3.46Å; R3045-E3047 HydrophobicContact CG-CG 4.08Å; R3045-E3047 IonicContact CZ-OE1 2.83Å; R3045-E3047 VanDerWaalsContact CZ-OE1 3.28Å; R3045-E3047 IonicContact NE-OE1 3.84Å; R3045-E3047 PolarHBondContact NE-OE1 3.41Å; R3045-E3047 IonicContact NH1-OE1 3.24Å; R3045-E3047 PolarHBondContact NH1-OE1 3.36Å; E3047-F3075 VanDerWaalsContact CA-O 3.28Å; E3047-F3075 WeakPolarHBondContact CA-O 3.29Å; E3047-F3075 HydrophobicContact CG-CB 4.35Å; E3047-F3075 HydrophobicContact CG-CD1 4.17Å
3048	E	81.3	Confident	78.8	Confident	16 Å²	16	37.7 Å²	37.7	8%	0.075	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	130.2	-179.8	177.3	-171.6	-169.8	0	0	108	E3050 T3065 I3074 F3075 K3076 Q3077	E3048-E3050 PolarHBondContact O-N 3.2Å; E3048-T3065 WeakPolarHBondContact OE1-CG2 3.47Å; E3048-T3065 PolarHBondContact OE1-OG1 2.82Å; E3048-I3074 HydrophobicContact CB-CG2 3.4Å; E3048-I3074 VanDerWaalsContact CB-CG2 3.4Å; E3048-I3074 HydrophobicContact CG-CG2 4.47Å; E3048-F3075 PolarHBondContact N-O 2.97Å; E3048-K3076 CarbonylContact O-C 3.48Å; E3048-K3076 WeakPolarHBondContact O-CA 3.3Å; E3048-K3076 IonicContact OE1-NZ 3.89Å; E3048-K3076 PolarHBondContact OE1-NZ 3.01Å; E3048-K3076 WeakPolarHBondContact OE2-CE 3.48Å; E3048-K3076 WeakPolarHBondContact OE2-CG 3.45Å; E3048-K3076 IonicContact OE2-NZ 3.27Å; E3048-K3076 PolarHBondContact OE2-NZ 3.29Å; E3048-Q3077 PolarHBondContact O-N 2.82Å
3049	E	71.7	Confident	76.3	Confident	54 Å²	54	43.3 Å²	43.3	25%	0.252	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	101.8	-174.2	-64.1	-166.2	154.1	0	0	110.8	R2929 F3051 I3079	R2929-E3049 IonicContact CZ-OE1 3.53Å; R2929-E3049 IonicContact NH1-OE1 2.71Å; R2929-E3049 PolarHBondContact NH1-OE1 2.92Å; R2929-E3049 IonicContact NH2-OE1 3.4Å; E3049-F3051 HydrophobicContact CB-CE2 3.9Å; E3049-F3051 HydrophobicContact CB-CZ 4.03Å; E3049-F3051 WeakPolarHBondContact O-CD2 3.15Å; E3049-F3051 PolarHBondContact O-N 2.94Å; E3049-I3079 HydrophobicContact CB-CD1 3.9Å; E3049-I3079 HydrophobicContact CB-CG1 4.47Å; E3049-I3079 VanDerWaalsContact CD-CD1 3.42Å; E3049-I3079 HydrophobicContact CG-CD1 3.88Å
3050	E	68	Low	73.9	Confident	68 Å²	68	50.1 Å²	50.1	32%	0.318	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	95.8	179.9	-176.6	171.8	-120.8	0	0	109.3	E3048 I3052 K3076 Q3077 Q3078 I3079	E3048-E3050 PolarHBondContact O-N 3.2Å; E3050-I3052 HydrophobicContact CG-CD1 4.43Å; E3050-I3052 HydrophobicContact CG-CG1 4.17Å; E3050-I3052 PolarHBondContact O-N 3.39Å; E3050-K3076 HydrophobicContact CB-CB 4.49Å; E3050-Q3077 PolarHBondContact N-O 2.96Å; E3050-Q3078 HydrophobicContact CB-CG 4.35Å; E3050-Q3078 WeakPolarHBondContact O-CA 3.19Å; E3050-Q3078 VanDerWaalsContact OE2-CG 3.29Å; E3050-Q3078 WeakPolarHBondContact OE2-CG 3.49Å; E3050-Q3078 PolarHBondContact OE2-NE2 2.9Å; E3050-I3079 PolarHBondContact O-N 2.92Å
3051	F	66.8	Low	71.2	Confident	41 Å²	41	53.9 Å²	53.9	18%	0.18	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	106.9	-179.3	-68.6	-76	0	0	0	112.1	E3049 N3061 I3079 V3081 Q3097	E3049-F3051 HydrophobicContact CB-CE2 3.9Å; E3049-F3051 HydrophobicContact CB-CZ 4.03Å; E3049-F3051 WeakPolarHBondContact O-CD2 3.15Å; E3049-F3051 PolarHBondContact O-N 2.94Å; F3051-N3061 VanDerWaalsContact CB-ND2 3.3Å; F3051-N3061 WeakPolarHBondContact CB-ND2 3.14Å; F3051-I3079 CarbonylContact C-O 3.39Å; F3051-I3079 VanDerWaalsContact CA-O 3.31Å; F3051-I3079 WeakPolarHBondContact CA-O 3.22Å; F3051-I3079 HydrophobicContact CD1-CB 3.84Å; F3051-I3079 HydrophobicContact CD1-CG2 3.8Å; F3051-I3079 HydrophobicContact CE1-CB 3.98Å; F3051-I3079 HydrophobicContact CE1-CD1 3.94Å; F3051-I3079 HydrophobicContact CE1-CG1 4.5Å; F3051-I3079 HydrophobicContact CE1-CG2 3.78Å; F3051-I3079 HydrophobicContact CZ-CD1 4.26Å; F3051-V3081 HydrophobicContact CB-CG2 4.3Å; F3051-V3081 HydrophobicContact CD1-CG2 3.98Å; F3051-Q3097 HydrophobicContact CE1-CG 4.39Å
3052	I	71.1	Confident	68.5	Low	56 Å²	56	63 Å²	63	29%	0.287	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	106.8	-178.1	-61.4	177	0	0	0	109.6	E3050 V3054 Q3078 I3079 Y3080 V3081	E3050-I3052 HydrophobicContact CG-CD1 4.43Å; E3050-I3052 HydrophobicContact CG-CG1 4.17Å; E3050-I3052 PolarHBondContact O-N 3.39Å; I3052-V3054 PolarHBondContact O-N 3.47Å; I3052-Q3078 HydrophobicContact CD1-CB 4Å; I3052-Q3078 VanDerWaalsContact CD1-CD 3.44Å; I3052-Q3078 HydrophobicContact CD1-CG 3.74Å; I3052-I3079 PolarHBondContact N-O 3.1Å; I3052-Y3080 HydrophobicContact CB-CD1 3.88Å; I3052-Y3080 HydrophobicContact CB-CE1 4.29Å; I3052-Y3080 HydrophobicContact CD1-CD1 4.27Å; I3052-Y3080 HydrophobicContact CD1-CE1 3.79Å; I3052-Y3080 HydrophobicContact CG2-CD1 3.97Å; I3052-Y3080 HydrophobicContact CG2-CE1 4.33Å; I3052-Y3080 CarbonylContact O-C 3.54Å; I3052-Y3080 VanDerWaalsContact O-CA 3.3Å; I3052-Y3080 WeakPolarHBondContact O-CA 3.34Å; I3052-V3081 PolarHBondContact O-N 2.99Å
3053	Y	74.6	Confident	65.8	Low	84 Å²	84	66.6 Å²	66.6	33%	0.329	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	117.9	175.2	-64.5	-79.7	0	0	0	111.1	N3061 V3081	Y3053-N3061 VanDerWaalsContact CE2-ND2 3.29Å; Y3053-N3061 WeakPolarHBondContact CE2-ND2 3.42Å; Y3053-V3081 HydrophobicContact CD1-CB 3.57Å; Y3053-V3081 HydrophobicContact CD1-CG1 3.71Å; Y3053-V3081 HydrophobicContact CD1-CG2 4.13Å; Y3053-V3081 HydrophobicContact CE1-CB 3.85Å; Y3053-V3081 HydrophobicContact CE1-CG1 3.71Å; Y3053-V3081 HydrophobicContact CE1-CG2 4.03Å; Y3053-V3081 HydrophobicContact CG-CB 4.36Å
3054	V	73	Confident	63.3	Low	30 Å²	30	67.4 Å²	67.4	18%	0.182	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-25.9	-176.3	177.3	0	0	0	0	112.4	I3052 G3056 V3081 L3082 V3159 W3162	I3052-V3054 PolarHBondContact O-N 3.47Å; V3054-G3056 VanDerWaalsContact C-N 3.27Å; V3054-G3056 PolarHBondContact O-N 3.45Å; V3054-V3081 PolarHBondContact N-O 2.67Å; V3054-L3082 HydrophobicContact CB-CD2 4.13Å; V3054-L3082 HydrophobicContact CG2-CD2 3.7Å; V3054-V3159 HydrophobicContact CG1-CG1 3.84Å; V3054-V3159 HydrophobicContact CG1-CG2 4.25Å; V3054-W3162 HydrophobicContact CG1-CE3 4.47Å; V3054-W3162 HydrophobicContact CG1-CH2 3.8Å; V3054-W3162 HydrophobicContact CG1-CZ3 3.62Å
3055	D	64.2	Low	60.8	Low	46 Å²	46	70.2 Å²	70.2	25%	0.246	37%	0.369	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82	11.8	-179.8	-75.2	61.1	0	0	0	114.4	D3057 K3083 Y3085	D3055-D3057 PolarHBondContact O-N 3.46Å; D3055-K3083 HydrophobicContact CB-CD 3.8Å; D3055-K3083 HydrophobicContact CB-CG 4.14Å; D3055-K3083 PolarHBondContact OD1-N 2.85Å; D3055-K3083 WeakPolarHBondContact OD2-CB 3.47Å; D3055-K3083 WeakPolarHBondContact OD2-CD 3.43Å; D3055-Y3085 PolarHBondContact OD2-OH 3.48Å
3056	G	51.7	Low	58.1	Low	52 Å²	52	72 Å²	72	54%	0.536	38%	0.383	S	S	.	.	S	Bend	trans	92.6	-25.6	164.2	0	0	0	0	0	118.3	V3054 S3058	V3054-G3056 VanDerWaalsContact C-N 3.27Å; V3054-G3056 PolarHBondContact O-N 3.45Å; G3056-S3058 PolarHBondContact O-N 3.32Å; G3056-S3058 PolarHBondContact O-OG 2.88Å
3057	D	48.2	Very low	55.3	Low	114 Å²	114	76.2 Å²	76.2	61%	0.61	41%	0.411	S	S	*	.			trans	-68.5	85.4	175.4	-68.2	-49.3	0	0	0	111.4	D3055 K3083	D3055-D3057 PolarHBondContact O-N 3.46Å; D3057-K3083 IonicContact OD2-NZ 3.8Å; D3057-K3083 PolarHBondContact OD2-NZ 3.41Å
3058	S	40.5	Very low	53	Low	93 Å²	93	79.5 Å²	79.5	65%	0.65	43%	0.427	S	S	*	.			trans	-108	33.9	-161.3	-52.5	0	0	0	0	114.7	G3056	G3056-S3058 PolarHBondContact O-N 3.32Å; G3056-S3058 PolarHBondContact O-OG 2.88Å
3059	T	40.6	Very low	50.8	Low	125 Å²	125	85.8 Å²	85.8	77%	0.767	46%	0.461	S	S	*	.			trans	-97.5	-21.9	-163.2	31.8	0	0	0	0	117.8
3060	E	43.6	Very low	49.6	Very low	150 Å²	150	86.5 Å²	86.5	70%	0.701	48%	0.482	S	S	*	.	S	Bend	trans	-106	-25.1	-159.4	-58.7	-166.2	144.5	0	0	116.3	K3062	E3060-K3062 VanDerWaalsContact C-N 3.33Å; E3060-K3062 PolarHBondContact O-N 3.2Å
3061	N	40.3	Very low	49	Very low	80 Å²	80	91.4 Å²	91.4	43%	0.428	51%	0.505	S	S	.	.			trans	-89.2	51.2	-171.1	-70.2	-17.5	0	0	0	114.5	F3051 Y3053	F3051-N3061 VanDerWaalsContact CB-ND2 3.3Å; F3051-N3061 WeakPolarHBondContact CB-ND2 3.14Å; Y3053-N3061 VanDerWaalsContact CE2-ND2 3.29Å; Y3053-N3061 WeakPolarHBondContact CE2-ND2 3.42Å
3062	K	42.5	Very low	48.7	Very low	193 Å²	193	91.5 Å²	91.5	84%	0.839	51%	0.507	S	S	*	.			trans	-113	19.4	176.1	-105.4	-176.2	179.8	179.3	0	114.9	E3060	E3060-K3062 VanDerWaalsContact C-N 3.33Å; E3060-K3062 PolarHBondContact O-N 3.2Å
3063	L	41.6	Very low	48.3	Very low	76 Å²	76	91.6 Å²	91.6	40%	0.398	51%	0.511	S	S	.	.			trans	-85.4	140.7	167.4	-79.2	81.5	0	0	0	110.1	P2910 L2911	P2910-L3063 HydrophobicContact CB-CD2 4.4Å; P2910-L3063 HydrophobicContact CB-CG 3.93Å; L2911-L3063 HydrophobicContact CD2-CD2 3.7Å; L2911-L3063 HydrophobicContact CG-CD2 4.21Å
3064	Q	44.6	Very low	48.2	Very low	51 Å²	51	89.2 Å²	89.2	24%	0.238	50%	0.504	C	S	.	.	S	Bend	trans	75.1	158	-172.8	-44.1	-153.7	9.8	0	0	115.3	I2925 N2988 L3066	I2925-Q3064 HydrophobicContact CG2-CG 4.22Å; N2988-Q3064 PolarHBondContact O-NE2 2.92Å; Q3064-L3066 PolarHBondContact O-N 3Å
3065	T	42.9	Very low	48.1	Very low	63 Å²	63	91.4 Å²	91.4	39%	0.387	51%	0.511	S	S	.	.			trans	51.9	44.8	-177.3	64.6	0	0	0	0	119.2	E3048 I3074 K3076	E3048-T3065 WeakPolarHBondContact OE1-CG2 3.47Å; E3048-T3065 PolarHBondContact OE1-OG1 2.82Å; T3065-I3074 HydrophobicContact CG2-CD1 4.11Å; T3065-K3076 PolarHBondContact OG1-NZ 3.32Å
3066	L	35.5	Very low	48.4	Very low	98 Å²	98	93.3 Å²	93.3	51%	0.513	52%	0.517	S	S	.	.	P	Polyproline II helix	trans	-64.2	123.4	152.1	-93.5	172.6	0	0	0	109.4	Q3064 Q3068	Q3064-L3066 PolarHBondContact O-N 3Å; L3066-Q3068 PolarHBondContact O-N 2.99Å
3067	P	33.1	Very low	49.2	Very low	100 Å²	100	92.4 Å²	92.4	65%	0.649	50%	0.499	S	S	*	.	P	Polyproline II helix	trans	-69.2	122.5	-169.7	25.8	-34.1	0	0	0	112.6
3068	Q	38	Very low	50.4	Low	80 Å²	80	90.7 Å²	90.7	37%	0.374	49%	0.487	S	S	.	.	P	Polyproline II helix	trans	-90.6	155.6	158.6	-73.8	-175	-32.8	0	0	109.6	L3066 G3070	L3066-Q3068 PolarHBondContact O-N 2.99Å; Q3068-G3070 PolarHBondContact O-N 3.43Å
3069	N	35.3	Very low	52.1	Low	148 Å²	148	86.5 Å²	86.5	79%	0.791	46%	0.458	S	S	*	.	S	Bend	trans	-61	129.6	177.9	-71.4	-71.6	0	0	0	110.8
3070	G	46.6	Very low	54	Low	68 Å²	68	82.3 Å²	82.3	70%	0.701	43%	0.428	S	S	*	.	S	Bend	trans	92.7	72.2	-172.1	0	0	0	0	0	111.2	Q3068 I3072	Q3068-G3070 PolarHBondContact O-N 3.43Å; G3070-I3072 PolarHBondContact O-N 3.28Å; G3070-I3072 VanDerWaalsContact O-N 3.08Å
3071	E	54	Low	55.9	Low	171 Å²	171	75.7 Å²	75.7	80%	0.799	40%	0.398	S	S	*	.			trans	-58.8	112.7	178.4	-66.3	-178.5	157.8	0	0	110.7
3072	I	60.3	Low	58.2	Low	44 Å²	44	71.9 Å²	71.9	23%	0.226	38%	0.378	C	S	.	.			trans	-62.2	128.1	165.8	-49	170	0	0	0	106.2	L2990 K3016 M3046 G3070 I3074	L2990-I3072 HydrophobicContact CD2-CD1 3.61Å; K3016-I3072 HydrophobicContact CG-CD1 3.81Å; M3046-I3072 HydrophobicContact SD-CG2 3.84Å; G3070-I3072 PolarHBondContact O-N 3.28Å; G3070-I3072 VanDerWaalsContact O-N 3.08Å; I3072-I3074 HydrophobicContact CB-CD1 4.42Å; I3072-I3074 HydrophobicContact CB-CG1 4.26Å; I3072-I3074 HydrophobicContact CG2-CG1 4.19Å; I3072-I3074 PolarHBondContact O-N 3.48Å
3073	P	63.8	Low	60.4	Low	57 Å²	57	65.1 Å²	65.1	37%	0.37	35%	0.348	S	S	.	.			trans	-75.6	72.9	-176.1	30.1	-35.5	0	0	0	111.6	M2396 A3020	M2396-P3073 HydrophobicContact CB-CB 3.81Å; M2396-P3073 HydrophobicContact CB-CG 4.09Å; M2396-P3073 HydrophobicContact CE-CB 4.29Å; A3020-P3073 HydrophobicContact CB-CG 4.2Å
3074	I	71.1	Confident	62.6	Low	35 Å²	35	61.5 Å²	61.5	18%	0.179	33%	0.329	C	S	.	.			trans	-76.6	126.8	174.5	-63.9	167.4	0	0	0	108.3	I2928 M3046 E3048 T3065 I3072 K3076	I2928-I3074 HydrophobicContact CD1-CD1 3.73Å; I2928-I3074 HydrophobicContact CD1-CG1 4.48Å; M3046-I3074 HydrophobicContact CB-CG1 4.28Å; E3048-I3074 HydrophobicContact CB-CG2 3.4Å; E3048-I3074 VanDerWaalsContact CB-CG2 3.4Å; E3048-I3074 HydrophobicContact CG-CG2 4.47Å; T3065-I3074 HydrophobicContact CG2-CD1 4.11Å; I3072-I3074 HydrophobicContact CB-CD1 4.42Å; I3072-I3074 HydrophobicContact CB-CG1 4.26Å; I3072-I3074 HydrophobicContact CG2-CG1 4.19Å; I3072-I3074 PolarHBondContact O-N 3.48Å; I3074-K3076 PolarHBondContact O-N 3.3Å
3075	F	71.2	Confident	64.7	Low	76 Å²	76	61.7 Å²	61.7	33%	0.333	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	98.8	173.4	178.1	-100.8	0	0	0	109.8	M2396 R3045 M3046 E3047 E3048 Q3077	M2396-F3075 HydrophobicContact CE-CB 4.37Å; R3045-F3075 VanDerWaalsContact NH2-CE1 3.32Å; R3045-F3075 VanDerWaalsContact NH2-CE2 3.28Å; M3046-F3075 WeakPolarHBondContact O-CB 3.26Å; M3046-F3075 PolarHBondContact O-N 2.98Å; E3047-F3075 VanDerWaalsContact CA-O 3.28Å; E3047-F3075 WeakPolarHBondContact CA-O 3.29Å; E3047-F3075 HydrophobicContact CG-CB 4.35Å; E3047-F3075 HydrophobicContact CG-CD1 4.17Å; E3048-F3075 PolarHBondContact N-O 2.97Å; F3075-Q3077 HydrophobicContact CD1-CB 4.27Å; F3075-Q3077 HydrophobicContact CE1-CB 3.99Å; F3075-Q3077 PolarHBondContact O-N 2.88Å; F3075-Q3077 VanDerWaalsContact O-N 3.1Å
3076	K	71.3	Confident	66.4	Low	86 Å²	86	60.1 Å²	60.1	37%	0.374	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	108.2	170.6	-70.8	-176.8	-177.3	-72.2	0	109.7	E3048 E3050 T3065 I3074	E3048-K3076 CarbonylContact O-C 3.48Å; E3048-K3076 WeakPolarHBondContact O-CA 3.3Å; E3048-K3076 IonicContact OE1-NZ 3.89Å; E3048-K3076 PolarHBondContact OE1-NZ 3.01Å; E3048-K3076 WeakPolarHBondContact OE2-CE 3.48Å; E3048-K3076 WeakPolarHBondContact OE2-CG 3.45Å; E3048-K3076 IonicContact OE2-NZ 3.27Å; E3048-K3076 PolarHBondContact OE2-NZ 3.29Å; E3050-K3076 HydrophobicContact CB-CB 4.49Å; T3065-K3076 PolarHBondContact OG1-NZ 3.32Å; I3074-K3076 PolarHBondContact O-N 3.3Å
3077	Q	68.3	Low	68.3	Low	32 Å²	32	56.2 Å²	56.2	15%	0.15	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	109.9	172.8	-179.4	167.9	13.3	0	0	108.5	E3048 E3050 F3075 I3079	E3048-Q3077 PolarHBondContact O-N 2.82Å; E3050-Q3077 PolarHBondContact N-O 2.96Å; F3075-Q3077 HydrophobicContact CD1-CB 4.27Å; F3075-Q3077 HydrophobicContact CE1-CB 3.99Å; F3075-Q3077 PolarHBondContact O-N 2.88Å; F3075-Q3077 VanDerWaalsContact O-N 3.1Å; Q3077-I3079 PolarHBondContact O-N 3.31Å
3078	Q	73.4	Confident	70.2	Confident	79 Å²	79	52.6 Å²	52.6	37%	0.369	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	118.6	178.8	-68	-171.2	-18.3	0	0	110.8	E3050 I3052 Y3080	E3050-Q3078 HydrophobicContact CB-CG 4.35Å; E3050-Q3078 WeakPolarHBondContact O-CA 3.19Å; E3050-Q3078 VanDerWaalsContact OE2-CG 3.29Å; E3050-Q3078 WeakPolarHBondContact OE2-CG 3.49Å; E3050-Q3078 PolarHBondContact OE2-NE2 2.9Å; I3052-Q3078 HydrophobicContact CD1-CB 4Å; I3052-Q3078 VanDerWaalsContact CD1-CD 3.44Å; I3052-Q3078 HydrophobicContact CD1-CG 3.74Å; Q3078-Y3080 HydrophobicContact CB-CE1 4.23Å; Q3078-Y3080 HydrophobicContact CB-CE2 4.11Å; Q3078-Y3080 PolarHBondContact OE1-OH 3.03Å
3079	I	76.2	Confident	71.6	Confident	5 Å²	5	55.1 Å²	55.1	3%	0.026	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	105.1	174	-59.5	-170.8	0	0	0	107.7	E3049 E3050 F3051 I3052 Q3077 V3081 Q3097 A3098	E3049-I3079 HydrophobicContact CB-CD1 3.9Å; E3049-I3079 HydrophobicContact CB-CG1 4.47Å; E3049-I3079 VanDerWaalsContact CD-CD1 3.42Å; E3049-I3079 HydrophobicContact CG-CD1 3.88Å; E3050-I3079 PolarHBondContact O-N 2.92Å; F3051-I3079 CarbonylContact C-O 3.39Å; F3051-I3079 VanDerWaalsContact CA-O 3.31Å; F3051-I3079 WeakPolarHBondContact CA-O 3.22Å; F3051-I3079 HydrophobicContact CD1-CB 3.84Å; F3051-I3079 HydrophobicContact CD1-CG2 3.8Å; F3051-I3079 HydrophobicContact CE1-CB 3.98Å; F3051-I3079 HydrophobicContact CE1-CD1 3.94Å; F3051-I3079 HydrophobicContact CE1-CG1 4.5Å; F3051-I3079 HydrophobicContact CE1-CG2 3.78Å; F3051-I3079 HydrophobicContact CZ-CD1 4.26Å; I3052-I3079 PolarHBondContact N-O 3.1Å; Q3077-I3079 PolarHBondContact O-N 3.31Å; I3079-V3081 PolarHBondContact O-N 2.73Å; I3079-Q3097 HydrophobicContact CG2-CB 3.64Å; I3079-Q3097 HydrophobicContact CG2-CG 3.9Å; I3079-A3098 CarbonylContact C-O 3.57Å; I3079-A3098 WeakPolarHBondContact CA-O 3.41Å
3080	Y	80.6	Confident	73.4	Confident	36 Å²	36	54 Å²	54	14%	0.141	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	116.5	178.8	-52.5	-78.2	0	0	0	109.1	I3052 Q3078 A3098 M3156	I3052-Y3080 HydrophobicContact CB-CD1 3.88Å; I3052-Y3080 HydrophobicContact CB-CE1 4.29Å; I3052-Y3080 HydrophobicContact CD1-CD1 4.27Å; I3052-Y3080 HydrophobicContact CD1-CE1 3.79Å; I3052-Y3080 HydrophobicContact CG2-CD1 3.97Å; I3052-Y3080 HydrophobicContact CG2-CE1 4.33Å; I3052-Y3080 CarbonylContact O-C 3.54Å; I3052-Y3080 VanDerWaalsContact O-CA 3.3Å; I3052-Y3080 WeakPolarHBondContact O-CA 3.34Å; Q3078-Y3080 HydrophobicContact CB-CE1 4.23Å; Q3078-Y3080 HydrophobicContact CB-CE2 4.11Å; Q3078-Y3080 PolarHBondContact OE1-OH 3.03Å; Y3080-A3098 PolarHBondContact N-O 3.39Å; Y3080-A3098 PolarHBondContact O-N 2.97Å; Y3080-M3156 HydrophobicContact CD1-CE 3.44Å; Y3080-M3156 VanDerWaalsContact CD1-CE 3.44Å; Y3080-M3156 HydrophobicContact CD1-SD 4.22Å; Y3080-M3156 HydrophobicContact CD2-CE 3.6Å; Y3080-M3156 HydrophobicContact CD2-CG 3.57Å; Y3080-M3156 HydrophobicContact CD2-SD 3.39Å; Y3080-M3156 WeakPolarHBondContact CD2-SD 3.09Å; Y3080-M3156 HydrophobicContact CE1-CE 3.74Å; Y3080-M3156 HydrophobicContact CE2-CE 3.87Å; Y3080-M3156 HydrophobicContact CE2-CG 3.72Å; Y3080-M3156 HydrophobicContact CE2-SD 4.04Å; Y3080-M3156 HydrophobicContact CG-CE 3.36Å; Y3080-M3156 HydrophobicContact CG-CG 4.28Å; Y3080-M3156 HydrophobicContact CG-SD 3.49Å
3081	V	84.5	Confident	74.5	Confident	11 Å²	11	53.3 Å²	53.3	7%	0.067	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	112.2	176.5	-173.3	0	0	0	0	108.4	F3051 I3052 Y3053 V3054 I3079 T3095	F3051-V3081 HydrophobicContact CB-CG2 4.3Å; F3051-V3081 HydrophobicContact CD1-CG2 3.98Å; I3052-V3081 PolarHBondContact O-N 2.99Å; Y3053-V3081 HydrophobicContact CD1-CB 3.57Å; Y3053-V3081 HydrophobicContact CD1-CG1 3.71Å; Y3053-V3081 HydrophobicContact CD1-CG2 4.13Å; Y3053-V3081 HydrophobicContact CE1-CB 3.85Å; Y3053-V3081 HydrophobicContact CE1-CG1 3.71Å; Y3053-V3081 HydrophobicContact CE1-CG2 4.03Å; Y3053-V3081 HydrophobicContact CG-CB 4.36Å; V3054-V3081 PolarHBondContact N-O 2.67Å; I3079-V3081 PolarHBondContact O-N 2.73Å; V3081-T3095 HydrophobicContact CG1-CG2 3.98Å
3082	L	87	Confident	75.6	Confident	1 Å²	1	47.5 Å²	47.5	1%	0.005	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	133.7	-176	-50.1	176.2	0	0	0	109.8	V3054 I3084 T3095 V3096 A3098 V3107 I3155 F3169	V3054-L3082 HydrophobicContact CB-CD2 4.13Å; V3054-L3082 HydrophobicContact CG2-CD2 3.7Å; L3082-I3084 HydrophobicContact CB-CD1 3.8Å; L3082-I3084 HydrophobicContact CD1-CD1 4.38Å; L3082-T3095 CarbonylContact O-C 3.51Å; L3082-T3095 VanDerWaalsContact O-CA 3.31Å; L3082-T3095 WeakPolarHBondContact O-CA 3.08Å; L3082-V3096 PolarHBondContact N-O 3.14Å; L3082-V3096 PolarHBondContact O-N 3.46Å; L3082-A3098 HydrophobicContact CD1-CB 3.58Å; L3082-A3098 HydrophobicContact CG-CB 4.09Å; L3082-V3107 HydrophobicContact CD1-CG1 4.38Å; L3082-V3107 HydrophobicContact CD1-CG2 3.93Å; L3082-I3155 HydrophobicContact CD1-CG2 3.65Å; L3082-I3155 HydrophobicContact CD2-CG2 4.37Å; L3082-F3169 HydrophobicContact CD2-CD2 4.5Å; L3082-F3169 HydrophobicContact CD2-CE2 4.18Å
3083	K	88.7	Confident	76.8	Confident	50 Å²	50	47.4 Å²	47.4	22%	0.217	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	116.9	165.2	-58.9	-176.1	-167.3	160.5	0	109.1	D3055 D3057 Y3085 T3095	D3055-K3083 HydrophobicContact CB-CD 3.8Å; D3055-K3083 HydrophobicContact CB-CG 4.14Å; D3055-K3083 PolarHBondContact OD1-N 2.85Å; D3055-K3083 WeakPolarHBondContact OD2-CB 3.47Å; D3055-K3083 WeakPolarHBondContact OD2-CD 3.43Å; D3057-K3083 IonicContact OD2-NZ 3.8Å; D3057-K3083 PolarHBondContact OD2-NZ 3.41Å; K3083-Y3085 HydrophobicContact CB-CE2 3.67Å; K3083-Y3085 WeakPolarHBondContact O-CD2 3.41Å; K3083-Y3085 WeakPolarHBondContact O-CE2 3.4Å; K3083-T3095 HydrophobicContact CG-CG2 4.44Å
3084	I	89.4	Confident	77.8	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	111	179.3	-46.7	-55.7	0	0	0	108.9	L3082 V3087 S3093 T3094 V3096 V3107 A3111 L3127 F3169 L3171	L3082-I3084 HydrophobicContact CB-CD1 3.8Å; L3082-I3084 HydrophobicContact CD1-CD1 4.38Å; I3084-V3087 HydrophobicContact CB-CG2 4.43Å; I3084-V3087 HydrophobicContact CG2-CG2 3.88Å; I3084-S3093 VanDerWaalsContact O-CA 3.22Å; I3084-S3093 WeakPolarHBondContact O-CA 3.31Å; I3084-S3093 WeakPolarHBondContact O-CB 3.3Å; I3084-T3094 HydrophobicContact CB-CG2 4.06Å; I3084-T3094 PolarHBondContact N-O 2.91Å; I3084-T3094 PolarHBondContact O-N 3.01Å; I3084-V3096 HydrophobicContact CG1-CB 4.04Å; I3084-V3096 HydrophobicContact CG1-CG2 3.69Å; I3084-V3107 HydrophobicContact CD1-CG1 3.5Å; I3084-V3107 HydrophobicContact CG1-CG1 3.91Å; I3084-A3111 HydrophobicContact CB-CB 4.31Å; I3084-A3111 HydrophobicContact CG1-CB 4.37Å; I3084-A3111 HydrophobicContact CG2-CB 4.04Å; I3084-L3127 HydrophobicContact CG2-CD1 3.99Å; I3084-F3169 HydrophobicContact CD1-CB 3.74Å; I3084-F3169 HydrophobicContact CD1-CD2 4.31Å; I3084-F3169 HydrophobicContact CD1-CG 4.41Å; I3084-L3171 HydrophobicContact CG2-CB 4.04Å
3085	Y	87.2	Confident	78.5	Confident	56 Å²	56	47.4 Å²	47.4	22%	0.22	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	153.3	-174.7	-61.3	-97.5	0	0	0	111.6	D3055 K3083 V3087 S3093 R3168 F3169 V3170 L3171	D3055-Y3085 PolarHBondContact OD2-OH 3.48Å; K3083-Y3085 HydrophobicContact CB-CE2 3.67Å; K3083-Y3085 WeakPolarHBondContact O-CD2 3.41Å; K3083-Y3085 WeakPolarHBondContact O-CE2 3.4Å; Y3085-V3087 VanDerWaalsContact C-N 3.35Å; Y3085-V3087 PolarHBondContact O-N 3.19Å; Y3085-S3093 WeakPolarHBondContact CE1-OG 3.48Å; Y3085-R3168 HydrophobicContact CD2-CB 3.94Å; Y3085-R3168 HydrophobicContact CD2-CG 4.31Å; Y3085-R3168 HydrophobicContact CE2-CB 3.85Å; Y3085-F3169 WeakPolarHBondContact CD2-O 3.49Å; Y3085-F3169 PolarHBondContact N-O 2.93Å; Y3085-V3170 CarbonylContact O-C 3.53Å; Y3085-V3170 WeakPolarHBondContact O-CA 3.15Å; Y3085-L3171 PolarHBondContact O-N 3.14Å
3086	G	78.9	Confident	79.3	Confident	30 Å²	30	43.9 Å²	43.9	31%	0.309	26%	0.258	S	S	.	.	S	Bend	trans	80.9	9.2	171.1	0	0	0	0	0	115.8
3087	V	75.3	Confident	80.1	Confident	15 Å²	15	45 Å²	45	9%	0.091	27%	0.265	C	S	.	.	S	Bend	trans	-79.3	-48.4	167.4	-160	0	0	0	0	110.1	I3084 Y3085 T3094 A3111 L3112 C3115 L3171	I3084-V3087 HydrophobicContact CB-CG2 4.43Å; I3084-V3087 HydrophobicContact CG2-CG2 3.88Å; Y3085-V3087 VanDerWaalsContact C-N 3.35Å; Y3085-V3087 PolarHBondContact O-N 3.19Å; V3087-T3094 HydrophobicContact CB-CG2 4.44Å; V3087-T3094 HydrophobicContact CG2-CG2 3.9Å; V3087-A3111 HydrophobicContact CG2-CB 4.13Å; V3087-L3112 HydrophobicContact CG1-CD2 4.4Å; V3087-C3115 HydrophobicContact CB-CB 4.44Å; V3087-C3115 HydrophobicContact CG1-CB 3.63Å; V3087-C3115 WeakPolarHBondContact CG1-SG 3.16Å; V3087-L3171 HydrophobicContact CB-CD2 4.35Å; V3087-L3171 HydrophobicContact CG1-CD2 3.97Å; V3087-L3171 HydrophobicContact CG2-CB 3.83Å; V3087-L3171 HydrophobicContact CG2-CD2 3.8Å; V3087-L3171 HydrophobicContact CG2-CG 4.45Å
3088	C	73.7	Confident	80.8	Confident	25 Å²	25	43.5 Å²	43.5	17%	0.169	26%	0.258	C	S	.	.	S	Bend	trans	-73.3	139.4	-176.1	-53.6	0	0	0	0	111.8	D3090 G3091 S3092	C3088-D3090 WeakPolarHBondContact CB-OD1 3.2Å; C3088-D3090 PolarHBondContact O-N 3.32Å; C3088-G3091 PolarHBondContact O-N 2.92Å; C3088-S3092 WeakPolarHBondContact CB-OG 3.31Å; C3088-S3092 PolarHBondContact SG-OG 2.96Å
3089	P	66.7	Low	81.3	Confident	133 Å²	133	43.2 Å²	43.2	86%	0.864	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-22.4	-179.5	-25.5	35.2	0	0	0	115.7
3090	D	73.9	Confident	81.5	Confident	125 Å²	125	46.4 Å²	46.4	67%	0.668	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.4	-8.8	176.7	65.1	-11.4	0	0	0	113.4	C3088 S3092	C3088-D3090 WeakPolarHBondContact CB-OD1 3.2Å; C3088-D3090 PolarHBondContact O-N 3.32Å; D3090-S3092 VanDerWaalsContact CG-OG 3.3Å; D3090-S3092 VanDerWaalsContact OD1-CB 3.3Å; D3090-S3092 WeakPolarHBondContact OD1-CB 3.43Å; D3090-S3092 PolarHBondContact OD1-N 2.83Å; D3090-S3092 PolarHBondContact OD1-OG 2.68Å; D3090-S3092 PolarHBondContact OD2-OG 2.76Å
3091	G	68.6	Low	81.7	Confident	52 Å²	52	49.3 Å²	49.3	54%	0.536	30%	0.301	S	S	.	.	S	Bend	trans	85.6	5.1	-175.2	0	0	0	0	0	115.1	C3088	C3088-G3091 PolarHBondContact O-N 2.92Å
3092	S	78.3	Confident	81.9	Confident	49 Å²	49	49.3 Å²	49.3	34%	0.343	30%	0.301	S	S	.	.			trans	-65.1	169.2	170.8	65.2	0	0	0	0	112.1	C3088 D3090	C3088-S3092 WeakPolarHBondContact CB-OG 3.31Å; C3088-S3092 PolarHBondContact SG-OG 2.96Å; D3090-S3092 VanDerWaalsContact CG-OG 3.3Å; D3090-S3092 VanDerWaalsContact OD1-CB 3.3Å; D3090-S3092 WeakPolarHBondContact OD1-CB 3.43Å; D3090-S3092 PolarHBondContact OD1-N 2.83Å; D3090-S3092 PolarHBondContact OD1-OG 2.68Å; D3090-S3092 PolarHBondContact OD2-OG 2.76Å
3093	S	83.7	Confident	82.2	Confident	42 Å²	42	50.3 Å²	50.3	29%	0.294	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	142	172.7	44.2	0	0	0	0	111.6	I3084 Y3085	I3084-S3093 VanDerWaalsContact O-CA 3.22Å; I3084-S3093 WeakPolarHBondContact O-CA 3.31Å; I3084-S3093 WeakPolarHBondContact O-CB 3.3Å; Y3085-S3093 WeakPolarHBondContact CE1-OG 3.48Å
3094	T	86	Confident	82.3	Confident	17 Å²	17	47.9 Å²	47.9	10%	0.104	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	144.5	163	-178.9	0	0	0	0	109.4	I3084 V3087 V3096 A3111 N3114	I3084-T3094 HydrophobicContact CB-CG2 4.06Å; I3084-T3094 PolarHBondContact N-O 2.91Å; I3084-T3094 PolarHBondContact O-N 3.01Å; V3087-T3094 HydrophobicContact CB-CG2 4.44Å; V3087-T3094 HydrophobicContact CG2-CG2 3.9Å; T3094-V3096 HydrophobicContact CG2-CG2 4.47Å; T3094-A3111 HydrophobicContact CG2-CB 4.03Å; T3094-N3114 VanDerWaalsContact OG1-CB 3.24Å; T3094-N3114 WeakPolarHBondContact OG1-CB 3.44Å
3095	T	86.1	Confident	82.4	Confident	76 Å²	76	52.1 Å²	52.1	47%	0.466	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	147.4	164.2	43.2	0	0	0	0	110.3	V3081 L3082 K3083 N3114	V3081-T3095 HydrophobicContact CG1-CG2 3.98Å; L3082-T3095 CarbonylContact O-C 3.51Å; L3082-T3095 VanDerWaalsContact O-CA 3.31Å; L3082-T3095 WeakPolarHBondContact O-CA 3.08Å; K3083-T3095 HydrophobicContact CG-CG2 4.44Å; T3095-N3114 PolarHBondContact O-ND2 3.28Å
3096	V	87.9	Confident	82.6	Confident	1 Å²	1	53.7 Å²	53.7	1%	0.006	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	136.8	171.2	171.2	0	0	0	0	108.4	L3082 I3084 T3094 V3107 M3110 A3111	L3082-V3096 PolarHBondContact N-O 3.14Å; L3082-V3096 PolarHBondContact O-N 3.46Å; I3084-V3096 HydrophobicContact CG1-CB 4.04Å; I3084-V3096 HydrophobicContact CG1-CG2 3.69Å; T3094-V3096 HydrophobicContact CG2-CG2 4.47Å; V3096-V3107 HydrophobicContact CG1-CB 4.46Å; V3096-V3107 HydrophobicContact CG1-CG1 4.22Å; V3096-V3107 HydrophobicContact CG1-CG2 4.07Å; V3096-M3110 HydrophobicContact CG1-CB 3.67Å; V3096-M3110 HydrophobicContact CG1-CE 3.65Å; V3096-M3110 HydrophobicContact CG1-CG 4.41Å; V3096-M3110 HydrophobicContact CG1-SD 3.96Å; V3096-M3110 HydrophobicContact CG2-CB 4.13Å; V3096-A3111 HydrophobicContact CG2-CB 3.98Å
3097	Q	87.1	Confident	83.2	Confident	111 Å²	111	52.2 Å²	52.2	52%	0.519	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	122.2	174.1	-71.8	175.5	-6	0	0	109.4	F3051 I3079 M3110	F3051-Q3097 HydrophobicContact CE1-CG 4.39Å; I3079-Q3097 HydrophobicContact CG2-CB 3.64Å; I3079-Q3097 HydrophobicContact CG2-CG 3.9Å; Q3097-M3110 WeakPolarHBondContact O-CE 3.47Å
3098	A	84.1	Confident	84	Confident	0 Å²	0	52 Å²	52	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	147.7	179.2	0	0	0	0	0	111.1	I3079 Y3080 L3082 T3102 V3107	I3079-A3098 CarbonylContact C-O 3.57Å; I3079-A3098 WeakPolarHBondContact CA-O 3.41Å; Y3080-A3098 PolarHBondContact N-O 3.39Å; Y3080-A3098 PolarHBondContact O-N 2.97Å; L3082-A3098 HydrophobicContact CD1-CB 3.58Å; L3082-A3098 HydrophobicContact CG-CB 4.09Å; A3098-T3102 HydrophobicContact CB-CG2 3.98Å; A3098-V3107 HydrophobicContact CB-CG2 4.35Å
3099	Q	83.9	Confident	84.8	Confident	73 Å²	73	53.2 Å²	53.2	34%	0.341	31%	0.31	S	S	.	.			trans	-104.8	169.4	174.1	-60.3	178.4	12.2	0	0	109.4	T3101 T3102	Q3099-T3101 PolarHBondContact O-N 2.88Å; Q3099-T3102 PolarHBondContact N-OG1 3.46Å; Q3099-T3102 WeakPolarHBondContact O-CB 3.24Å; Q3099-T3102 PolarHBondContact O-N 3.24Å; Q3099-T3102 PolarHBondContact O-OG1 3.48Å
3100	S	78.8	Confident	85.9	Confident	72 Å²	72	49.5 Å²	49.5	50%	0.503	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-20.4	176.7	54.7	0	0	0	0	114
3101	T	85	Confident	86.7	Confident	96 Å²	96	43.5 Å²	43.5	59%	0.589	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.9	-2.9	175.7	51.9	0	0	0	0	114.7	Q3099 L3154	Q3099-T3101 PolarHBondContact O-N 2.88Å; T3101-L3154 WeakPolarHBondContact O-CD2 3.43Å
3102	T	89.3	Confident	87.7	Confident	11 Å²	11	41.3 Å²	41.3	7%	0.067	23%	0.225	C	C	.	.			trans	-75.3	130	-173.3	-64.1	0	0	0	0	112	A3098 Q3099 E3106 V3107 M3110 L3154 I3155	A3098-T3102 HydrophobicContact CB-CG2 3.98Å; Q3099-T3102 PolarHBondContact N-OG1 3.46Å; Q3099-T3102 WeakPolarHBondContact O-CB 3.24Å; Q3099-T3102 PolarHBondContact O-N 3.24Å; Q3099-T3102 PolarHBondContact O-OG1 3.48Å; T3102-E3106 VanDerWaalsContact CA-OE2 3.24Å; T3102-E3106 WeakPolarHBondContact CA-OE2 3.41Å; T3102-E3106 HydrophobicContact CG2-CB 3.93Å; T3102-E3106 WeakPolarHBondContact CG2-OE2 3.23Å; T3102-V3107 HydrophobicContact CG2-CG2 3.78Å; T3102-M3110 HydrophobicContact CG2-CE 3.95Å; T3102-L3154 WeakPolarHBondContact O-CA 3.25Å; T3102-I3155 PolarHBondContact O-N 2.99Å
3103	V	93.3	Very high	88.1	Confident	22 Å²	22	43.3 Å²	43.3	13%	0.133	23%	0.228	C	C	.	.	B	Isolated β-bridge	trans	-96.8	161.3	179.8	-63.5	0	0	0	0	113	R3105 E3106 V3107 E3153 L3154	V3103-R3105 VanDerWaalsContact C-N 3.27Å; V3103-R3105 HydrophobicContact CG2-CB 4.47Å; V3103-R3105 PolarHBondContact O-N 3.28Å; V3103-E3106 HydrophobicContact CG2-CB 4.43Å; V3103-E3106 HydrophobicContact CG2-CG 3.77Å; V3103-E3106 PolarHBondContact N-OE2 2.89Å; V3103-E3106 WeakPolarHBondContact O-CB 3.28Å; V3103-E3106 PolarHBondContact O-N 3.29Å; V3103-V3107 PolarHBondContact O-N 3.43Å; V3103-E3153 CarbonylContact C-O 3.45Å; V3103-E3153 VanDerWaalsContact CA-O 3.3Å; V3103-E3153 WeakPolarHBondContact CA-O 3.47Å; V3103-L3154 HydrophobicContact CG1-CD2 3.91Å
3104	A	91.2	Very high	88.1	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-54.6	-38.1	-178.4	0	0	0	0	0	114.1	E3106 V3107 I3108 L3127 L3149 E3150 E3153 I3155	A3104-E3106 VanDerWaalsContact C-N 3.28Å; A3104-E3106 PolarHBondContact O-N 2.99Å; A3104-V3107 PolarHBondContact O-N 2.96Å; A3104-I3108 VanDerWaalsContact O-CG1 3.29Å; A3104-I3108 WeakPolarHBondContact O-CG1 3.32Å; A3104-I3108 PolarHBondContact O-N 3.19Å; A3104-L3127 HydrophobicContact CB-CD2 4.35Å; A3104-L3149 HydrophobicContact CB-CB 3.99Å; A3104-L3149 HydrophobicContact CB-CD1 4.4Å; A3104-E3150 WeakPolarHBondContact CB-O 3.38Å; A3104-E3153 PolarHBondContact N-O 2.96Å; A3104-I3155 HydrophobicContact CB-CD1 3.93Å
3105	R	91.9	Very high	88	Confident	88 Å²	88	46.8 Å²	46.8	33%	0.332	24%	0.244	S	C	.	.	H	α-helix	trans	-60.6	-35.1	176.1	-166	-173.9	-61.5	100.3	-1.6	113	V3103 I3108 D3109 P3151 D3152	V3103-R3105 VanDerWaalsContact C-N 3.27Å; V3103-R3105 HydrophobicContact CG2-CB 4.47Å; V3103-R3105 PolarHBondContact O-N 3.28Å; R3105-I3108 PolarHBondContact O-N 3.41Å; R3105-D3109 PolarHBondContact O-N 2.86Å; R3105-D3109 VanDerWaalsContact O-N 3.1Å; R3105-P3151 HydrophobicContact CB-CB 4.36Å; R3105-P3151 WeakPolarHBondContact CB-O 3.48Å; R3105-P3151 PolarHBondContact N-O 2.88Å; R3105-D3152 IonicContact CZ-OD1 3.21Å; R3105-D3152 VanDerWaalsContact CZ-OD1 3.23Å; R3105-D3152 IonicContact NH1-OD1 3.97Å; R3105-D3152 PolarHBondContact NH1-OD1 3Å; R3105-D3152 VanDerWaalsContact NH2-CG 3.31Å; R3105-D3152 IonicContact NH2-OD1 2.82Å; R3105-D3152 PolarHBondContact NH2-OD1 3.24Å; R3105-D3152 IonicContact NH2-OD2 3.07Å; R3105-D3152 PolarHBondContact NH2-OD2 2.76Å; R3105-D3152 VanDerWaalsContact NH2-OD2 3.1Å
3106	E	91.7	Very high	87.7	Confident	89 Å²	89	46.2 Å²	46.2	42%	0.416	25%	0.254	S	S	.	.	H	α-helix	trans	-74.4	-37.2	-180	-65	168.1	160.7	0	0	111.3	T3102 V3103 A3104 I3108 D3109 M3110	T3102-E3106 VanDerWaalsContact CA-OE2 3.24Å; T3102-E3106 WeakPolarHBondContact CA-OE2 3.41Å; T3102-E3106 HydrophobicContact CG2-CB 3.93Å; T3102-E3106 WeakPolarHBondContact CG2-OE2 3.23Å; V3103-E3106 HydrophobicContact CG2-CB 4.43Å; V3103-E3106 HydrophobicContact CG2-CG 3.77Å; V3103-E3106 PolarHBondContact N-OE2 2.89Å; V3103-E3106 WeakPolarHBondContact O-CB 3.28Å; V3103-E3106 PolarHBondContact O-N 3.29Å; A3104-E3106 VanDerWaalsContact C-N 3.28Å; A3104-E3106 PolarHBondContact O-N 2.99Å; E3106-I3108 VanDerWaalsContact C-N 3.34Å; E3106-D3109 PolarHBondContact O-N 2.74Å; E3106-M3110 HydrophobicContact CB-CE 4.25Å; E3106-M3110 WeakPolarHBondContact O-CE 3.31Å; E3106-M3110 WeakPolarHBondContact O-CG 3.47Å; E3106-M3110 PolarHBondContact O-N 2.73Å
3107	V	91.6	Very high	87.3	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-68	-33.4	172.4	171	0	0	0	0	112	L3082 I3084 V3096 A3098 T3102 V3103 A3104 M3110 A3111 L3127 I3155	L3082-V3107 HydrophobicContact CD1-CG1 4.38Å; L3082-V3107 HydrophobicContact CD1-CG2 3.93Å; I3084-V3107 HydrophobicContact CD1-CG1 3.5Å; I3084-V3107 HydrophobicContact CG1-CG1 3.91Å; V3096-V3107 HydrophobicContact CG1-CB 4.46Å; V3096-V3107 HydrophobicContact CG1-CG1 4.22Å; V3096-V3107 HydrophobicContact CG1-CG2 4.07Å; A3098-V3107 HydrophobicContact CB-CG2 4.35Å; T3102-V3107 HydrophobicContact CG2-CG2 3.78Å; V3103-V3107 PolarHBondContact O-N 3.43Å; A3104-V3107 PolarHBondContact O-N 2.96Å; V3107-M3110 HydrophobicContact CG2-CE 4.19Å; V3107-A3111 WeakPolarHBondContact O-CB 3.42Å; V3107-A3111 PolarHBondContact O-N 2.92Å; V3107-L3127 HydrophobicContact CB-CD2 4.01Å; V3107-L3127 HydrophobicContact CG1-CD1 4.49Å; V3107-L3127 HydrophobicContact CG1-CD2 3.69Å; V3107-I3155 HydrophobicContact CB-CG1 4.4Å; V3107-I3155 HydrophobicContact CG2-CD1 4.41Å; V3107-I3155 HydrophobicContact CG2-CG1 3.79Å
3108	I	90.9	Very high	86.6	Confident	10 Å²	10	50.9 Å²	50.9	5%	0.051	28%	0.276	C	S	.	.	H	α-helix	trans	-61.5	-48.6	170.9	-65.8	168.3	0	0	0	110.4	A3104 R3105 E3106 A3111 L3112 L3122 L3127 L3171	A3104-I3108 VanDerWaalsContact O-CG1 3.29Å; A3104-I3108 WeakPolarHBondContact O-CG1 3.32Å; A3104-I3108 PolarHBondContact O-N 3.19Å; R3105-I3108 PolarHBondContact O-N 3.41Å; E3106-I3108 VanDerWaalsContact C-N 3.34Å; I3108-A3111 PolarHBondContact O-N 2.56Å; I3108-L3112 HydrophobicContact CG2-CD1 3.86Å; I3108-L3112 WeakPolarHBondContact O-CG 3.4Å; I3108-L3112 PolarHBondContact O-N 3.34Å; I3108-L3122 HydrophobicContact CG2-CD2 4Å; I3108-L3127 HydrophobicContact CD1-CB 4.12Å; I3108-L3127 HydrophobicContact CG1-CB 3.95Å; I3108-L3171 HydrophobicContact CB-CD1 4.24Å; I3108-L3171 HydrophobicContact CG1-CD1 3.68Å; I3108-L3171 HydrophobicContact CG2-CD1 4.11Å
3109	D	91.1	Very high	86.1	Confident	51 Å²	51	55.7 Å²	55.7	27%	0.273	32%	0.315	S	S	.	.	H	α-helix	trans	-60.6	-50	178.9	177.1	63.9	0	0	0	112.3	R3105 E3106 A3111 L3112 K3113 L3122	R3105-D3109 PolarHBondContact O-N 2.86Å; R3105-D3109 VanDerWaalsContact O-N 3.1Å; E3106-D3109 PolarHBondContact O-N 2.74Å; D3109-A3111 PolarHBondContact O-N 2.86Å; D3109-L3112 PolarHBondContact O-N 2.71Å; D3109-K3113 WeakPolarHBondContact O-CB 3.49Å; D3109-K3113 VanDerWaalsContact O-CG 3.29Å; D3109-K3113 WeakPolarHBondContact O-CG 3.36Å; D3109-K3113 PolarHBondContact O-N 3.49Å; D3109-K3113 WeakPolarHBondContact OD1-CE 3.44Å; D3109-K3113 IonicContact OD1-NZ 3.49Å; D3109-K3113 PolarHBondContact OD1-NZ 3.12Å; D3109-K3113 IonicContact OD2-NZ 2.77Å; D3109-K3113 PolarHBondContact OD2-NZ 3.45Å; D3109-L3122 HydrophobicContact CB-CD2 3.77Å
3110	M	90.5	Very high	85.9	Confident	54 Å²	54	54.5 Å²	54.5	27%	0.266	31%	0.311	S	S	.	.	H	α-helix	trans	-63.4	-39.1	177.2	-70.2	-175.2	-77.4	0	0	112.8	V3096 Q3097 T3102 E3106 V3107 K3113 N3114	V3096-M3110 HydrophobicContact CG1-CB 3.67Å; V3096-M3110 HydrophobicContact CG1-CE 3.65Å; V3096-M3110 HydrophobicContact CG1-CG 4.41Å; V3096-M3110 HydrophobicContact CG1-SD 3.96Å; V3096-M3110 HydrophobicContact CG2-CB 4.13Å; Q3097-M3110 WeakPolarHBondContact O-CE 3.47Å; T3102-M3110 HydrophobicContact CG2-CE 3.95Å; E3106-M3110 HydrophobicContact CB-CE 4.25Å; E3106-M3110 WeakPolarHBondContact O-CE 3.31Å; E3106-M3110 WeakPolarHBondContact O-CG 3.47Å; E3106-M3110 PolarHBondContact O-N 2.73Å; V3107-M3110 HydrophobicContact CG2-CE 4.19Å; M3110-K3113 PolarHBondContact O-N 2.86Å; M3110-N3114 WeakPolarHBondContact O-CB 3.38Å; M3110-N3114 VanDerWaalsContact O-CG 3.22Å; M3110-N3114 PolarHBondContact O-N 2.93Å; M3110-N3114 PolarHBondContact O-OD1 2.88Å
3111	A	89.3	Confident	86	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-66.5	-41.8	177.6	0	0	0	0	0	112.3	I3084 V3087 T3094 V3096 V3107 I3108 D3109 C3115	I3084-A3111 HydrophobicContact CB-CB 4.31Å; I3084-A3111 HydrophobicContact CG1-CB 4.37Å; I3084-A3111 HydrophobicContact CG2-CB 4.04Å; V3087-A3111 HydrophobicContact CG2-CB 4.13Å; T3094-A3111 HydrophobicContact CG2-CB 4.03Å; V3096-A3111 HydrophobicContact CG2-CB 3.98Å; V3107-A3111 WeakPolarHBondContact O-CB 3.42Å; V3107-A3111 PolarHBondContact O-N 2.92Å; I3108-A3111 PolarHBondContact O-N 2.56Å; D3109-A3111 PolarHBondContact O-N 2.86Å; A3111-C3115 PolarHBondContact O-N 3.26Å
3112	L	89.4	Confident	85.9	Confident	5 Å²	5	55.2 Å²	55.2	3%	0.026	31%	0.305	C	S	.	.	H	α-helix	trans	-66.8	-40.4	176.8	-70.7	170.1	0	0	0	111.5	V3087 I3108 D3109 C3115 G3116 H3117 L3122 Y3125 L3171	V3087-L3112 HydrophobicContact CG1-CD2 4.4Å; I3108-L3112 HydrophobicContact CG2-CD1 3.86Å; I3108-L3112 WeakPolarHBondContact O-CG 3.4Å; I3108-L3112 PolarHBondContact O-N 3.34Å; D3109-L3112 PolarHBondContact O-N 2.71Å; L3112-C3115 CarbonylContact O-C 3.58Å; L3112-C3115 PolarHBondContact O-N 3.1Å; L3112-G3116 PolarHBondContact O-N 3.24Å; L3112-G3116 VanDerWaalsContact O-N 3.15Å; L3112-H3117 HydrophobicContact CB-CB 4.23Å; L3112-H3117 HydrophobicContact CD2-CB 3.79Å; L3112-H3117 PolarHBondContact O-N 3.28Å; L3112-L3122 HydrophobicContact CD1-CD2 4.11Å; L3112-Y3125 HydrophobicContact CD1-CD2 4.07Å; L3112-Y3125 HydrophobicContact CD1-CE2 4.33Å; L3112-Y3125 HydrophobicContact CD1-CG 4.39Å; L3112-Y3125 HydrophobicContact CD2-CD1 4.38Å; L3112-Y3125 HydrophobicContact CD2-CD2 4.42Å; L3112-Y3125 HydrophobicContact CD2-CE1 3.96Å; L3112-Y3125 HydrophobicContact CD2-CE2 4.06Å; L3112-L3171 HydrophobicContact CD2-CD2 3.93Å; L3112-L3171 HydrophobicContact CG-CD2 4.19Å
3113	K	86.8	Confident	85.5	Confident	92 Å²	92	60.6 Å²	60.6	40%	0.4	33%	0.333	S	S	.	.	H	α-helix	trans	-60.1	-50.5	174.8	-75.1	169.6	174.2	165.8	0	112.5	D3109 M3110 C3115 G3116 E3118	D3109-K3113 WeakPolarHBondContact O-CB 3.49Å; D3109-K3113 VanDerWaalsContact O-CG 3.29Å; D3109-K3113 WeakPolarHBondContact O-CG 3.36Å; D3109-K3113 PolarHBondContact O-N 3.49Å; D3109-K3113 WeakPolarHBondContact OD1-CE 3.44Å; D3109-K3113 IonicContact OD1-NZ 3.49Å; D3109-K3113 PolarHBondContact OD1-NZ 3.12Å; D3109-K3113 IonicContact OD2-NZ 2.77Å; D3109-K3113 PolarHBondContact OD2-NZ 3.45Å; M3110-K3113 PolarHBondContact O-N 2.86Å; K3113-C3115 PolarHBondContact O-N 3.49Å; K3113-C3115 VanDerWaalsContact O-N 3.13Å; K3113-G3116 PolarHBondContact O-N 3.34Å; K3113-E3118 HydrophobicContact CG-CG 4.01Å
3114	N	85.1	Confident	85.1	Confident	100 Å²	100	62.6 Å²	62.6	54%	0.535	34%	0.343	S	S	.	.	H	α-helix	trans	-63.3	-21.3	-179.6	-68.7	-0.2	0	0	0	113.1	T3094 T3095 M3110	T3094-N3114 VanDerWaalsContact OG1-CB 3.24Å; T3094-N3114 WeakPolarHBondContact OG1-CB 3.44Å; T3095-N3114 PolarHBondContact O-ND2 3.28Å; M3110-N3114 WeakPolarHBondContact O-CB 3.38Å; M3110-N3114 VanDerWaalsContact O-CG 3.22Å; M3110-N3114 PolarHBondContact O-N 2.93Å; M3110-N3114 PolarHBondContact O-OD1 2.88Å
3115	C	82.3	Confident	84.9	Confident	31 Å²	31	64 Å²	64	21%	0.209	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.8	8.6	173.7	-63	0	0	0	0	114.6	V3087 A3111 L3112 K3113 H3117	V3087-C3115 HydrophobicContact CB-CB 4.44Å; V3087-C3115 HydrophobicContact CG1-CB 3.63Å; V3087-C3115 WeakPolarHBondContact CG1-SG 3.16Å; A3111-C3115 PolarHBondContact O-N 3.26Å; L3112-C3115 CarbonylContact O-C 3.58Å; L3112-C3115 PolarHBondContact O-N 3.1Å; K3113-C3115 PolarHBondContact O-N 3.49Å; K3113-C3115 VanDerWaalsContact O-N 3.13Å; C3115-H3117 VanDerWaalsContact C-N 3.33Å; C3115-H3117 PolarHBondContact O-CD2 3.42Å; C3115-H3117 PolarHBondContact O-N 3.32Å
3116	G	79.7	Confident	84.6	Confident	64 Å²	64	60.5 Å²	60.5	66%	0.66	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.9	16.4	177.2	0	0	0	0	0	115.7	L3112 K3113	L3112-G3116 PolarHBondContact O-N 3.24Å; L3112-G3116 VanDerWaalsContact O-N 3.15Å; K3113-G3116 PolarHBondContact O-N 3.34Å
3117	H	79.8	Confident	84.5	Confident	67 Å²	67	56.3 Å²	56.3	31%	0.31	32%	0.317	S	S	.	.			trans	-96.6	34.4	-179.2	-75.4	-72.2	0	0	0	113.2	L3112 C3115 A3119 D3120	L3112-H3117 HydrophobicContact CB-CB 4.23Å; L3112-H3117 HydrophobicContact CD2-CB 3.79Å; L3112-H3117 PolarHBondContact O-N 3.28Å; C3115-H3117 VanDerWaalsContact C-N 3.33Å; C3115-H3117 PolarHBondContact O-CD2 3.42Å; C3115-H3117 PolarHBondContact O-N 3.32Å; H3117-A3119 PolarHBondContact O-N 3.48Å; H3117-A3119 VanDerWaalsContact O-N 3.11Å; H3117-D3120 PolarHBondContact O-N 3.4Å; H3117-D3120 VanDerWaalsContact O-N 3.17Å
3118	E	73.8	Confident	84.3	Confident	144 Å²	144	56.8 Å²	56.8	67%	0.673	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-21.1	-176.4	-56.9	-161.8	128.3	0	0	115	K3113 D3120	K3113-E3118 HydrophobicContact CG-CG 4.01Å; E3118-D3120 VanDerWaalsContact C-N 3.35Å
3119	A	73.8	Confident	84.1	Confident	101 Å²	101	56.5 Å²	56.5	84%	0.835	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-8.7	-179.2	0	0	0	0	0	114	H3117	H3117-A3119 PolarHBondContact O-N 3.48Å; H3117-A3119 VanDerWaalsContact O-N 3.11Å
3120	D	78.2	Confident	83.8	Confident	48 Å²	48	54.2 Å²	54.2	26%	0.257	31%	0.306	S	S	.	.	S	Bend	trans	-84.4	143.7	-177.1	-94.6	39.3	0	0	0	112.1	H3117 E3118 L3122 Y3125 K3173	H3117-D3120 PolarHBondContact O-N 3.4Å; H3117-D3120 VanDerWaalsContact O-N 3.17Å; E3118-D3120 VanDerWaalsContact C-N 3.35Å; D3120-L3122 PolarHBondContact O-N 3.31Å; D3120-Y3125 HydrophobicContact CB-CE2 3.97Å; D3120-Y3125 WeakPolarHBondContact OD2-CE2 3.45Å; D3120-Y3125 PolarHBondContact OD2-OH 3.12Å; D3120-Y3125 VanDerWaalsContact OD2-OH 3.07Å; D3120-K3173 IonicContact OD2-NZ 3.13Å; D3120-K3173 PolarHBondContact OD2-NZ 3.35Å
3121	L	81.5	Confident	83.4	Confident	120 Å²	120	53 Å²	53	63%	0.628	30%	0.3	S	S	*	.			trans	-70.8	123.8	179.1	-65.1	174.8	0	0	0	110.7	D3123 D3124	L3121-D3123 PolarHBondContact O-N 2.95Å; L3121-D3123 VanDerWaalsContact O-N 3.14Å; L3121-D3124 HydrophobicContact CB-CB 4.47Å; L3121-D3124 WeakPolarHBondContact O-CB 3.49Å; L3121-D3124 PolarHBondContact O-N 3.38Å
3122	L	82.1	Confident	82.8	Confident	63 Å²	63	56.8 Å²	56.8	33%	0.33	32%	0.315	S	S	.	.	G	3₁₀ helix	trans	-51.4	-38.2	174.5	-62.9	172.9	0	0	0	112.3	I3108 D3109 L3112 D3120 D3124 Y3125	I3108-L3122 HydrophobicContact CG2-CD2 4Å; D3109-L3122 HydrophobicContact CB-CD2 3.77Å; L3112-L3122 HydrophobicContact CD1-CD2 4.11Å; D3120-L3122 PolarHBondContact O-N 3.31Å; L3122-D3124 VanDerWaalsContact C-N 3.25Å; L3122-D3124 PolarHBondContact O-N 3.42Å; L3122-Y3125 PolarHBondContact O-N 3.36Å; L3122-Y3125 VanDerWaalsContact O-N 3.12Å
3123	D	82.7	Confident	81.8	Confident	123 Å²	123	62.6 Å²	62.6	66%	0.658	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-71.1	-10.9	178.2	-75.2	-40.1	0	0	0	114.3	L3121 Y3125 K3174	L3121-D3123 PolarHBondContact O-N 2.95Å; L3121-D3123 VanDerWaalsContact O-N 3.14Å; D3123-Y3125 VanDerWaalsContact C-N 3.26Å; D3123-K3174 WeakPolarHBondContact O-CD 3.49Å; D3123-K3174 WeakPolarHBondContact O-CE 3.29Å; D3123-K3174 PolarHBondContact O-NZ 2.92Å
3124	D	83.6	Confident	80.5	Confident	65 Å²	65	61.8 Å²	61.8	35%	0.348	35%	0.349	S	S	.	.	G	3₁₀ helix	trans	-79.1	-11.3	169.5	-82	-9.4	0	0	0	112.2	L3121 L3122 K3173 K3174	L3121-D3124 HydrophobicContact CB-CB 4.47Å; L3121-D3124 WeakPolarHBondContact O-CB 3.49Å; L3121-D3124 PolarHBondContact O-N 3.38Å; L3122-D3124 VanDerWaalsContact C-N 3.25Å; L3122-D3124 PolarHBondContact O-N 3.42Å; D3124-K3173 HydrophobicContact CB-CG 4.25Å; D3124-K3173 CarbonylContact O-C 3.43Å; D3124-K3173 IonicContact OD2-NZ 2.7Å; D3124-K3174 WeakPolarHBondContact O-CB 3.39Å; D3124-K3174 VanDerWaalsContact O-CG 3.29Å; D3124-K3174 WeakPolarHBondContact O-CG 3.46Å; D3124-K3174 PolarHBondContact O-N 2.92Å
3125	Y	86.3	Confident	79.1	Confident	29 Å²	29	61.7 Å²	61.7	11%	0.114	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	159.9	-174.9	-74.7	-96.4	0	0	0	113	L3112 D3120 L3122 D3123 L3171 R3172 K3173 K3174	L3112-Y3125 HydrophobicContact CD1-CD2 4.07Å; L3112-Y3125 HydrophobicContact CD1-CE2 4.33Å; L3112-Y3125 HydrophobicContact CD1-CG 4.39Å; L3112-Y3125 HydrophobicContact CD2-CD1 4.38Å; L3112-Y3125 HydrophobicContact CD2-CD2 4.42Å; L3112-Y3125 HydrophobicContact CD2-CE1 3.96Å; L3112-Y3125 HydrophobicContact CD2-CE2 4.06Å; D3120-Y3125 HydrophobicContact CB-CE2 3.97Å; D3120-Y3125 WeakPolarHBondContact OD2-CE2 3.45Å; D3120-Y3125 PolarHBondContact OD2-OH 3.12Å; D3120-Y3125 VanDerWaalsContact OD2-OH 3.07Å; L3122-Y3125 PolarHBondContact O-N 3.36Å; L3122-Y3125 VanDerWaalsContact O-N 3.12Å; D3123-Y3125 VanDerWaalsContact C-N 3.26Å; Y3125-L3171 HydrophobicContact CD1-CD1 4.32Å; Y3125-L3171 HydrophobicContact CD1-CD2 3.7Å; Y3125-L3171 HydrophobicContact CD1-CG 3.77Å; Y3125-L3171 HydrophobicContact CE1-CD2 4.03Å; Y3125-L3171 HydrophobicContact CE1-CG 4.43Å; Y3125-L3171 HydrophobicContact CG-CD2 4.49Å; Y3125-R3172 CarbonylContact C-O 3.58Å; Y3125-R3172 WeakPolarHBondContact CA-O 3.41Å; Y3125-K3173 HydrophobicContact CD1-CB 4.08Å; Y3125-K3173 HydrophobicContact CD1-CG 4.48Å; Y3125-K3173 HydrophobicContact CD2-CG 4.36Å; Y3125-K3173 HydrophobicContact CE1-CB 3.74Å; Y3125-K3173 HydrophobicContact CE1-CD 4.45Å; Y3125-K3173 HydrophobicContact CE1-CG 4.15Å; Y3125-K3173 HydrophobicContact CE2-CB 4.44Å; Y3125-K3173 HydrophobicContact CE2-CD 3.91Å; Y3125-K3173 HydrophobicContact CE2-CG 3.94Å; Y3125-K3174 WeakPolarHBondContact O-CE 3.46Å; Y3125-K3174 PolarHBondContact O-NZ 2.92Å
3126	V	87.4	Confident	77.4	Confident	14 Å²	14	64.9 Å²	64.9	9%	0.085	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	141.5	165.8	-64.8	0	0	0	0	109.5	M3128 V3148 R3172 K3174	V3126-M3128 HydrophobicContact CG2-CG 3.99Å; V3126-M3128 HydrophobicContact CG2-SD 4.44Å; V3126-V3148 HydrophobicContact CB-CG1 4.01Å; V3126-V3148 HydrophobicContact CG1-CG1 4.1Å; V3126-R3172 HydrophobicContact CG2-CB 4.12Å; V3126-R3172 PolarHBondContact N-O 2.95Å; V3126-R3172 PolarHBondContact O-N 3.17Å; V3126-K3174 HydrophobicContact CG1-CD 4.44Å; V3126-K3174 HydrophobicContact CG1-CG 4.29Å
3127	L	89.3	Confident	75.6	Confident	1 Å²	1	66.5 Å²	66.5	1%	0.005	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	123	166.6	-165.5	62.3	0	0	0	108.4	I3084 A3104 V3107 I3108 L3149 I3155 F3169 L3171	I3084-L3127 HydrophobicContact CG2-CD1 3.99Å; A3104-L3127 HydrophobicContact CB-CD2 4.35Å; V3107-L3127 HydrophobicContact CB-CD2 4.01Å; V3107-L3127 HydrophobicContact CG1-CD1 4.49Å; V3107-L3127 HydrophobicContact CG1-CD2 3.69Å; I3108-L3127 HydrophobicContact CD1-CB 4.12Å; I3108-L3127 HydrophobicContact CG1-CB 3.95Å; L3127-L3149 HydrophobicContact CD2-CD1 4.08Å; L3127-L3149 HydrophobicContact CG-CD1 4.28Å; L3127-L3149 PolarHBondContact O-N 3.19Å; L3127-I3155 HydrophobicContact CD2-CD1 3.64Å; L3127-F3169 HydrophobicContact CD1-CB 4.05Å; L3127-F3169 HydrophobicContact CG-CB 4.42Å; L3127-L3171 HydrophobicContact CD1-CB 4.48Å; L3127-L3171 HydrophobicContact CD1-CD1 4.07Å
3128	M	85.9	Confident	73.7	Confident	11 Å²	11	69 Å²	69	5%	0.054	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	149	179.1	-48.1	-166.5	-45.2	0	0	110.6	V3126 R3147 V3148 F3169 V3170 R3172	V3126-M3128 HydrophobicContact CG2-CG 3.99Å; V3126-M3128 HydrophobicContact CG2-SD 4.44Å; M3128-R3147 CarbonylContact C-O 3.56Å; M3128-R3147 WeakPolarHBondContact CA-O 3.11Å; M3128-V3148 HydrophobicContact CG-CG2 4.28Å; M3128-F3169 CarbonylContact O-C 3.52Å; M3128-F3169 WeakPolarHBondContact O-CA 3.37Å; M3128-V3170 WeakPolarHBondContact CB-O 3.42Å; M3128-V3170 HydrophobicContact CE-CB 4.32Å; M3128-V3170 HydrophobicContact CE-CG1 4.35Å; M3128-V3170 PolarHBondContact N-O 3.33Å; M3128-V3170 PolarHBondContact O-N 2.88Å; M3128-R3172 HydrophobicContact CE-CG 3.59Å; M3128-R3172 HydrophobicContact SD-CB 4.37Å; M3128-R3172 HydrophobicContact SD-CG 3.93Å
3129	E	87.7	Confident	72	Confident	4 Å²	4	68.2 Å²	68.2	2%	0.019	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	112	174	170	171.6	-122.5	0	0	107.7	L3131 R3146 R3147 L3149 A3158 W3162 F3169	E3129-L3131 HydrophobicContact CG-CD1 4.32Å; E3129-L3131 HydrophobicContact CG-CD2 3.74Å; E3129-L3131 HydrophobicContact CG-CG 3.84Å; E3129-R3146 WeakPolarHBondContact O-CA 3.42Å; E3129-R3147 HydrophobicContact CB-CB 4.36Å; E3129-R3147 PolarHBondContact N-O 3.05Å; E3129-R3147 PolarHBondContact O-N 3.4Å; E3129-R3147 IonicContact OE2-CZ 2.89Å; E3129-R3147 IonicContact OE2-NE 2.68Å; E3129-R3147 PolarHBondContact OE2-NE 3.43Å; E3129-R3147 IonicContact OE2-NH2 2.68Å; E3129-R3147 PolarHBondContact OE2-NH2 2.77Å; E3129-L3149 HydrophobicContact CB-CD2 4.12Å; E3129-L3149 HydrophobicContact CB-CG 4.47Å; E3129-A3158 WeakPolarHBondContact OE1-CB 3.25Å; E3129-W3162 PolarHBondContact OE1-NE1 2.96Å; E3129-F3169 HydrophobicContact CB-CD1 4.44Å; E3129-F3169 HydrophobicContact CB-CE1 4.3Å
3130	D	84.2	Confident	70.3	Confident	3 Å²	3	68.2 Å²	68.2	2%	0.016	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	113.7	172.3	-103.1	5.9	0	0	0	106.8	W3132 R3146 G3167 R3168 V3170	D3130-W3132 WeakPolarHBondContact O-CZ3 3.21Å; D3130-R3146 WeakPolarHBondContact OD1-CD 3.24Å; D3130-R3146 WeakPolarHBondContact OD1-CG 3.21Å; D3130-R3146 IonicContact OD1-CZ 2.85Å; D3130-R3146 IonicContact OD1-NE 2.67Å; D3130-R3146 PolarHBondContact OD1-NE 3.21Å; D3130-R3146 IonicContact OD1-NH2 3.76Å; D3130-R3146 IonicContact OD2-NH2 3.86Å; D3130-G3167 CarbonylContact O-C 3.58Å; D3130-G3167 WeakPolarHBondContact O-CA 3.43Å; D3130-R3168 HydrophobicContact CB-CG 3.78Å; D3130-R3168 PolarHBondContact N-O 2.99Å; D3130-R3168 PolarHBondContact O-N 3.33Å; D3130-R3168 IonicContact OD2-CZ 3.15Å; D3130-R3168 IonicContact OD2-NE 3.6Å; D3130-R3168 PolarHBondContact OD2-NE 3.05Å; D3130-R3168 VanDerWaalsContact OD2-NE 3.14Å; D3130-R3168 IonicContact OD2-NH2 3.73Å; D3130-R3168 PolarHBondContact OD2-NH2 3.44Å; D3130-V3170 HydrophobicContact CB-CG2 4.26Å
3131	L	81.8	Confident	68.6	Low	28 Å²	28	74.6 Å²	74.6	15%	0.147	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	138.6	176.3	-54.5	179.5	0	0	0	111.5	E3129 V3144 S3145 W3162 N3166	E3129-L3131 HydrophobicContact CG-CD1 4.32Å; E3129-L3131 HydrophobicContact CG-CD2 3.74Å; E3129-L3131 HydrophobicContact CG-CG 3.84Å; L3131-V3144 CarbonylContact O-C 3.51Å; L3131-V3144 VanDerWaalsContact O-CA 3.28Å; L3131-V3144 WeakPolarHBondContact O-CA 3.49Å; L3131-S3145 PolarHBondContact N-O 2.97Å; L3131-S3145 PolarHBondContact O-N 2.77Å; L3131-W3162 VanDerWaalsContact CD2-CD1 3.42Å; L3131-W3162 HydrophobicContact CD2-CD2 4.18Å; L3131-W3162 HydrophobicContact CD2-CG 3.86Å; L3131-N3166 WeakPolarHBondContact CA-O 3.33Å
3132	W	77.2	Confident	67.1	Low	80 Å²	80	72.8 Å²	72.8	30%	0.303	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	148.9	171.8	66.6	98.6	0	0	0	112	D3130 V3142 N3166 R3168	D3130-W3132 WeakPolarHBondContact O-CZ3 3.21Å; W3132-V3142 HydrophobicContact CB-CG1 4.09Å; W3132-N3166 HydrophobicContact CD2-CB 4.01Å; W3132-N3166 VanDerWaalsContact CE3-O 3.31Å; W3132-N3166 HydrophobicContact CG-CB 4.43Å; W3132-N3166 HydrophobicContact CH2-CB 4.25Å; W3132-N3166 HydrophobicContact CZ2-CB 3.67Å; W3132-N3166 PolarHBondContact N-O 3.2Å; W3132-N3166 PolarHBondContact O-N 3.07Å; W3132-R3168 HydrophobicContact CH2-CB 4.23Å; W3132-R3168 HydrophobicContact CH2-CG 4.22Å; W3132-R3168 HydrophobicContact CZ3-CB 4.19Å; W3132-R3168 HydrophobicContact CZ3-CG 3.85Å
3133	I	69.6	Low	65.6	Low	126 Å²	126	78.3 Å²	78.3	65%	0.646	44%	0.439	S	S	*	.			trans	-95.8	131.7	174.7	-59.3	171.5	0	0	0	108.1	E3135 A3165	I3133-E3135 PolarHBondContact O-N 3.38Å; I3133-A3165 HydrophobicContact CG1-CB 4.16Å
3134	P	59.1	Low	64.6	Low	76 Å²	76	75.6 Å²	75.6	49%	0.494	43%	0.427	S	S	.	.			trans	-65.2	114.3	170	-20.6	33.4	0	0	0	111.1	A3136	P3134-A3136 PolarHBondContact O-N 3.06Å
3135	E	54.2	Low	63.9	Low	97 Å²	97	75.2 Å²	75.2	45%	0.453	43%	0.429	S	S	.	.			trans	-72.6	119	177.5	-80.3	-167.2	170	0	0	111.8	I3133 S3137 C3140	I3133-E3135 PolarHBondContact O-N 3.38Å; E3135-S3137 VanDerWaalsContact C-N 3.28Å; E3135-S3137 PolarHBondContact O-N 2.96Å; E3135-C3140 VanDerWaalsContact OE1-CB 3.23Å; E3135-C3140 WeakPolarHBondContact OE1-CB 3.39Å; E3135-C3140 PolarHBondContact OE2-N 2.89Å
3136	A	47.1	Very low	63.5	Low	98 Å²	98	75.9 Å²	75.9	81%	0.81	43%	0.431	S	S	*	.			trans	-79.1	75.6	167.5	0	0	0	0	0	110.9	P3134	P3134-A3136 PolarHBondContact O-N 3.06Å
3137	S	41.9	Very low	63.3	Low	99 Å²	99	78.1 Å²	78.1	69%	0.692	44%	0.438	S	S	*	.	S	Bend	trans	70.7	143.4	171.1	76.7	0	0	0	0	118.9	E3135	E3135-S3137 VanDerWaalsContact C-N 3.28Å; E3135-S3137 PolarHBondContact O-N 2.96Å
3138	T	41.5	Very low	63.1	Low	119 Å²	119	79 Å²	79	73%	0.73	44%	0.444	S	S	*	.	S	Bend	trans	77.3	72.1	161.6	-22.8	0	0	0	0	118.5
3139	T	37.5	Very low	63.1	Low	128 Å²	128	78.9 Å²	78.9	79%	0.785	44%	0.443	S	S	*	.			trans	55.8	74.6	148.6	48	0	0	0	0	117.6
3140	C	36.9	Very low	63.1	Low	100 Å²	100	82.9 Å²	82.9	68%	0.676	46%	0.462	S	S	*	.			trans	-125.7	173.8	144.9	-94.5	0	0	0	0	111.4	E3135	E3135-C3140 VanDerWaalsContact OE1-CB 3.23Å; E3135-C3140 WeakPolarHBondContact OE1-CB 3.39Å; E3135-C3140 PolarHBondContact OE2-N 2.89Å
3141	Q	42.4	Very low	63.2	Low	182 Å²	182	85 Å²	85	85%	0.85	48%	0.476	S	S	*	.			trans	-86.5	119.1	177.3	-68.8	-176.8	-1.3	0	0	109.2	Q3143	Q3141-Q3143 PolarHBondContact O-N 3.44Å
3142	V	50.2	Low	63.5	Low	83 Å²	83	89 Å²	89	50%	0.503	50%	0.497	S	S	.	.			trans	-51.2	105.7	179.2	-177.7	0	0	0	0	110.6	W3132 V3144	W3132-V3142 HydrophobicContact CB-CG1 4.09Å; V3142-V3144 VanDerWaalsContact C-N 3.35Å; V3142-V3144 HydrophobicContact CG1-CG2 4.08Å; V3142-V3144 PolarHBondContact O-N 3.03Å
3143	Q	51.9	Low	64.1	Low	179 Å²	179	86.9 Å²	86.9	84%	0.836	49%	0.491	S	S	*	.			trans	-75.2	87.9	176.4	-70.5	-165.1	-4.2	0	0	110	Q3141 S3145	Q3141-Q3143 PolarHBondContact O-N 3.44Å; Q3143-S3145 PolarHBondContact O-N 3.28Å; Q3143-S3145 VanDerWaalsContact O-N 3.17Å
3144	V	60.7	Low	65	Low	66 Å²	66	83.5 Å²	83.5	40%	0.4	47%	0.474	S	S	.	.			trans	-72.4	105.3	169.9	-173.8	0	0	0	0	108.6	L3131 V3142 R3146	L3131-V3144 CarbonylContact O-C 3.51Å; L3131-V3144 VanDerWaalsContact O-CA 3.28Å; L3131-V3144 WeakPolarHBondContact O-CA 3.49Å; V3142-V3144 VanDerWaalsContact C-N 3.35Å; V3142-V3144 HydrophobicContact CG1-CG2 4.08Å; V3142-V3144 PolarHBondContact O-N 3.03Å; V3144-R3146 HydrophobicContact CG1-CG 3.97Å; V3144-R3146 PolarHBondContact O-N 3.06Å
3145	S	69.7	Low	66.4	Low	56 Å²	56	79.9 Å²	79.9	39%	0.392	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	121.1	172.1	-179	0	0	0	0	108.8	L3131 Q3143	L3131-S3145 PolarHBondContact N-O 2.97Å; L3131-S3145 PolarHBondContact O-N 2.77Å; Q3143-S3145 PolarHBondContact O-N 3.28Å; Q3143-S3145 VanDerWaalsContact O-N 3.17Å
3146	R	78.4	Confident	67.9	Low	43 Å²	43	76.4 Å²	76.4	16%	0.162	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	130.5	-178.5	-64.8	-170.5	155	148.6	-7.5	111.2	E3129 D3130 V3144 M3309 W3311	E3129-R3146 WeakPolarHBondContact O-CA 3.42Å; D3130-R3146 WeakPolarHBondContact OD1-CD 3.24Å; D3130-R3146 WeakPolarHBondContact OD1-CG 3.21Å; D3130-R3146 IonicContact OD1-CZ 2.85Å; D3130-R3146 IonicContact OD1-NE 2.67Å; D3130-R3146 PolarHBondContact OD1-NE 3.21Å; D3130-R3146 IonicContact OD1-NH2 3.76Å; D3130-R3146 IonicContact OD2-NH2 3.86Å; V3144-R3146 HydrophobicContact CG1-CG 3.97Å; V3144-R3146 PolarHBondContact O-N 3.06Å; R3146-M3309 PolarHBondContact NH1-O 2.91Å; R3146-W3311 PolarHBondContact NH1-O 3.33Å
3147	R	82.7	Confident	69.7	Low	61 Å²	61	76 Å²	76	23%	0.23	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	144.5	175.5	-167.4	168.2	69.9	111.3	-6.7	110.2	M3128 E3129 E3153	M3128-R3147 CarbonylContact C-O 3.56Å; M3128-R3147 WeakPolarHBondContact CA-O 3.11Å; E3129-R3147 HydrophobicContact CB-CB 4.36Å; E3129-R3147 PolarHBondContact N-O 3.05Å; E3129-R3147 PolarHBondContact O-N 3.4Å; E3129-R3147 IonicContact OE2-CZ 2.89Å; E3129-R3147 IonicContact OE2-NE 2.68Å; E3129-R3147 PolarHBondContact OE2-NE 3.43Å; E3129-R3147 IonicContact OE2-NH2 2.68Å; E3129-R3147 PolarHBondContact OE2-NH2 2.77Å; R3147-E3153 IonicContact CZ-OE1 2.91Å; R3147-E3153 IonicContact CZ-OE2 3.01Å; R3147-E3153 IonicContact NH1-OE1 2.7Å; R3147-E3153 PolarHBondContact NH1-OE1 3.44Å; R3147-E3153 IonicContact NH1-OE2 3.98Å; R3147-E3153 PolarHBondContact NH1-OE2 3.23Å; R3147-E3153 IonicContact NH2-OE1 3.6Å; R3147-E3153 PolarHBondContact NH2-OE1 2.87Å; R3147-E3153 IonicContact NH2-OE2 3.83Å
3148	V	84.7	Confident	71.6	Confident	21 Å²	21	71.2 Å²	71.2	13%	0.127	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	126.8	163.6	173.6	0	0	0	0	107	V3126 M3128 I3187 I3188	V3126-V3148 HydrophobicContact CB-CG1 4.01Å; V3126-V3148 HydrophobicContact CG1-CG1 4.1Å; M3128-V3148 HydrophobicContact CG-CG2 4.28Å; V3148-I3187 HydrophobicContact CG2-CG2 4.02Å; V3148-I3188 HydrophobicContact CB-CG1 4.21Å; V3148-I3188 HydrophobicContact CG1-CG1 4.45Å; V3148-I3188 HydrophobicContact CG2-CG1 3.99Å
3149	L	86.2	Confident	73.7	Confident	7 Å²	7	66.8 Å²	66.8	4%	0.037	36%	0.358	C	S	.	.	P	Polyproline II helix	trans	-73.3	139.7	174.7	-58	-177.4	0	0	0	109.5	A3104 L3127 E3129 I3155 A3158 F3169	A3104-L3149 HydrophobicContact CB-CB 3.99Å; A3104-L3149 HydrophobicContact CB-CD1 4.4Å; L3127-L3149 HydrophobicContact CD2-CD1 4.08Å; L3127-L3149 HydrophobicContact CG-CD1 4.28Å; L3127-L3149 PolarHBondContact O-N 3.19Å; E3129-L3149 HydrophobicContact CB-CD2 4.12Å; E3129-L3149 HydrophobicContact CB-CG 4.47Å; L3149-I3155 HydrophobicContact CD1-CD1 3.6Å; L3149-A3158 HydrophobicContact CD1-CB 4.28Å; L3149-A3158 HydrophobicContact CD2-CB 3.82Å; L3149-F3169 HydrophobicContact CD1-CD1 4.06Å; L3149-F3169 HydrophobicContact CD1-CE1 3.83Å
3150	E	86.6	Confident	75.7	Confident	89 Å²	89	63.9 Å²	63.9	42%	0.416	35%	0.347	S	S	.	.	P	Polyproline II helix	trans	-70.8	145	171.4	-66.5	-72.5	-179.8	0	0	109.4	A3104 D3152 E3153 K3192	A3104-E3150 WeakPolarHBondContact CB-O 3.38Å; E3150-D3152 PolarHBondContact O-N 3.26Å; E3150-E3153 HydrophobicContact CB-CB 4.27Å; E3150-E3153 PolarHBondContact N-OE2 3.45Å; E3150-E3153 WeakPolarHBondContact O-CB 3.38Å; E3150-E3153 PolarHBondContact O-N 3.16Å; E3150-K3192 WeakPolarHBondContact OE1-CE 3.5Å; E3150-K3192 IonicContact OE1-NZ 3.14Å; E3150-K3192 PolarHBondContact OE1-NZ 3.46Å; E3150-K3192 IonicContact OE2-NZ 2.68Å
3151	P	87	Confident	77.8	Confident	48 Å²	48	63.5 Å²	63.5	31%	0.312	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-28.4	-172.1	-29	37	0	0	0	115.3	R3105	R3105-P3151 HydrophobicContact CB-CB 4.36Å; R3105-P3151 WeakPolarHBondContact CB-O 3.48Å; R3105-P3151 PolarHBondContact N-O 2.88Å
3152	D	89	Confident	79.7	Confident	110 Å²	110	56.1 Å²	56.1	59%	0.588	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.8	10	-179.6	-53.3	-69.8	0	0	0	112.6	R3105 E3150	R3105-D3152 IonicContact CZ-OD1 3.21Å; R3105-D3152 VanDerWaalsContact CZ-OD1 3.23Å; R3105-D3152 IonicContact NH1-OD1 3.97Å; R3105-D3152 PolarHBondContact NH1-OD1 3Å; R3105-D3152 VanDerWaalsContact NH2-CG 3.31Å; R3105-D3152 IonicContact NH2-OD1 2.82Å; R3105-D3152 PolarHBondContact NH2-OD1 3.24Å; R3105-D3152 IonicContact NH2-OD2 3.07Å; R3105-D3152 PolarHBondContact NH2-OD2 2.76Å; R3105-D3152 VanDerWaalsContact NH2-OD2 3.1Å; E3150-D3152 PolarHBondContact O-N 3.26Å
3153	E	89	Confident	80.5	Confident	36 Å²	36	59 Å²	59	17%	0.168	32%	0.315	C	S	.	.	S	Bend	trans	-78	130.3	174.9	-171	174.1	173.1	0	0	110.9	V3103 A3104 R3147 E3150 I3155	V3103-E3153 CarbonylContact C-O 3.45Å; V3103-E3153 VanDerWaalsContact CA-O 3.3Å; V3103-E3153 WeakPolarHBondContact CA-O 3.47Å; A3104-E3153 PolarHBondContact N-O 2.96Å; R3147-E3153 IonicContact CZ-OE1 2.91Å; R3147-E3153 IonicContact CZ-OE2 3.01Å; R3147-E3153 IonicContact NH1-OE1 2.7Å; R3147-E3153 PolarHBondContact NH1-OE1 3.44Å; R3147-E3153 IonicContact NH1-OE2 3.98Å; R3147-E3153 PolarHBondContact NH1-OE2 3.23Å; R3147-E3153 IonicContact NH2-OE1 3.6Å; R3147-E3153 PolarHBondContact NH2-OE1 2.87Å; R3147-E3153 IonicContact NH2-OE2 3.83Å; E3150-E3153 HydrophobicContact CB-CB 4.27Å; E3150-E3153 PolarHBondContact N-OE2 3.45Å; E3150-E3153 WeakPolarHBondContact O-CB 3.38Å; E3150-E3153 PolarHBondContact O-N 3.16Å; E3153-I3155 PolarHBondContact O-N 3.2Å
3154	L	89.4	Confident	81.1	Confident	55 Å²	55	54 Å²	54	29%	0.288	31%	0.312	S	S	.	.	B	Isolated β-bridge	trans	-65.1	124	174.6	-68.4	173.4	0	0	0	110.6	T3101 T3102 V3103 M3156 N3157 A3158	T3101-L3154 WeakPolarHBondContact O-CD2 3.43Å; T3102-L3154 WeakPolarHBondContact O-CA 3.25Å; V3103-L3154 HydrophobicContact CG1-CD2 3.91Å; L3154-M3156 VanDerWaalsContact C-N 3.25Å; L3154-M3156 PolarHBondContact O-N 3.42Å; L3154-N3157 HydrophobicContact CB-CB 4.28Å; L3154-N3157 WeakPolarHBondContact O-CB 3.42Å; L3154-N3157 PolarHBondContact O-N 3.16Å; L3154-A3158 PolarHBondContact O-N 2.79Å
3155	I	88.3	Confident	81.6	Confident	0 Å²	0	52 Å²	52	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-60.1	-38	-178.7	-64.8	-61.9	0	0	0	111.7	L3082 T3102 A3104 V3107 L3127 L3149 E3153 N3157 A3158 V3159 F3169	L3082-I3155 HydrophobicContact CD1-CG2 3.65Å; L3082-I3155 HydrophobicContact CD2-CG2 4.37Å; T3102-I3155 PolarHBondContact O-N 2.99Å; A3104-I3155 HydrophobicContact CB-CD1 3.93Å; V3107-I3155 HydrophobicContact CB-CG1 4.4Å; V3107-I3155 HydrophobicContact CG2-CD1 4.41Å; V3107-I3155 HydrophobicContact CG2-CG1 3.79Å; L3127-I3155 HydrophobicContact CD2-CD1 3.64Å; L3149-I3155 HydrophobicContact CD1-CD1 3.6Å; E3153-I3155 PolarHBondContact O-N 3.2Å; I3155-N3157 PolarHBondContact O-N 3.36Å; I3155-A3158 WeakPolarHBondContact O-CA 3.25Å; I3155-A3158 VanDerWaalsContact O-CB 3.27Å; I3155-A3158 WeakPolarHBondContact O-CB 3.29Å; I3155-A3158 PolarHBondContact O-N 3.16Å; I3155-V3159 HydrophobicContact CG2-CG2 4.25Å; I3155-V3159 PolarHBondContact O-N 2.98Å; I3155-F3169 HydrophobicContact CG2-CE2 3.81Å; I3155-F3169 HydrophobicContact CG2-CZ 3.88Å
3156	M	84.3	Confident	81.9	Confident	25 Å²	25	53 Å²	53	12%	0.123	30%	0.303	C	S	.	.	H	α-helix	trans	-71	-18.5	-179.7	-58.8	-44.4	-59	0	0	113.4	Y3080 L3154 V3159 A3160	Y3080-M3156 HydrophobicContact CD1-CE 3.44Å; Y3080-M3156 VanDerWaalsContact CD1-CE 3.44Å; Y3080-M3156 HydrophobicContact CD1-SD 4.22Å; Y3080-M3156 HydrophobicContact CD2-CE 3.6Å; Y3080-M3156 HydrophobicContact CD2-CG 3.57Å; Y3080-M3156 HydrophobicContact CD2-SD 3.39Å; Y3080-M3156 WeakPolarHBondContact CD2-SD 3.09Å; Y3080-M3156 HydrophobicContact CE1-CE 3.74Å; Y3080-M3156 HydrophobicContact CE2-CE 3.87Å; Y3080-M3156 HydrophobicContact CE2-CG 3.72Å; Y3080-M3156 HydrophobicContact CE2-SD 4.04Å; Y3080-M3156 HydrophobicContact CG-CE 3.36Å; Y3080-M3156 HydrophobicContact CG-CG 4.28Å; Y3080-M3156 HydrophobicContact CG-SD 3.49Å; L3154-M3156 VanDerWaalsContact C-N 3.25Å; L3154-M3156 PolarHBondContact O-N 3.42Å; M3156-V3159 HydrophobicContact CE-CB 3.86Å; M3156-V3159 HydrophobicContact CE-CG1 3.96Å; M3156-V3159 HydrophobicContact CE-CG2 4.08Å; M3156-V3159 HydrophobicContact SD-CB 4.45Å; M3156-V3159 HydrophobicContact SD-CG2 4.14Å; M3156-A3160 WeakPolarHBondContact O-CB 3.32Å; M3156-A3160 PolarHBondContact O-N 3.37Å
3157	N	84.7	Confident	82	Confident	88 Å²	88	51.3 Å²	51.3	47%	0.471	30%	0.299	S	S	.	.	H	α-helix	trans	-72.8	-35.3	166.7	-68.9	-7	0	0	0	111.3	L3154 I3155 N3161	L3154-N3157 HydrophobicContact CB-CB 4.28Å; L3154-N3157 WeakPolarHBondContact O-CB 3.42Å; L3154-N3157 PolarHBondContact O-N 3.16Å; I3155-N3157 PolarHBondContact O-N 3.36Å; N3157-N3161 PolarHBondContact O-N 3.42Å; N3157-N3161 PolarHBondContact O-ND2 3.4Å
3158	A	83.4	Confident	82.2	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-64.8	-52.8	172.9	0	0	0	0	0	110.4	E3129 L3149 L3154 I3155 A3160 N3161 W3162 F3169	E3129-A3158 WeakPolarHBondContact OE1-CB 3.25Å; L3149-A3158 HydrophobicContact CD1-CB 4.28Å; L3149-A3158 HydrophobicContact CD2-CB 3.82Å; L3154-A3158 PolarHBondContact O-N 2.79Å; I3155-A3158 WeakPolarHBondContact O-CA 3.25Å; I3155-A3158 VanDerWaalsContact O-CB 3.27Å; I3155-A3158 WeakPolarHBondContact O-CB 3.29Å; I3155-A3158 PolarHBondContact O-N 3.16Å; A3158-A3160 VanDerWaalsContact C-N 3.33Å; A3158-A3160 PolarHBondContact O-N 3.02Å; A3158-N3161 WeakPolarHBondContact O-CA 3.43Å; A3158-N3161 WeakPolarHBondContact O-CB 3.29Å; A3158-N3161 PolarHBondContact O-N 2.73Å; A3158-W3162 PolarHBondContact O-NE1 3.47Å; A3158-F3169 HydrophobicContact CB-CE1 4.16Å; A3158-F3169 HydrophobicContact CB-CZ 4.2Å
3159	V	83.8	Confident	82.5	Confident	25 Å²	25	51.7 Å²	51.7	15%	0.152	30%	0.298	C	S	.	.	H	α-helix	trans	-56.1	-43.2	175.7	-179.2	0	0	0	0	112.2	V3054 I3155 M3156 N3161 W3162 F3169	V3054-V3159 HydrophobicContact CG1-CG1 3.84Å; V3054-V3159 HydrophobicContact CG1-CG2 4.25Å; I3155-V3159 HydrophobicContact CG2-CG2 4.25Å; I3155-V3159 PolarHBondContact O-N 2.98Å; M3156-V3159 HydrophobicContact CE-CB 3.86Å; M3156-V3159 HydrophobicContact CE-CG1 3.96Å; M3156-V3159 HydrophobicContact CE-CG2 4.08Å; M3156-V3159 HydrophobicContact SD-CB 4.45Å; M3156-V3159 HydrophobicContact SD-CG2 4.14Å; V3159-N3161 PolarHBondContact O-N 3.07Å; V3159-W3162 HydrophobicContact CG1-CD2 4.48Å; V3159-W3162 HydrophobicContact CG1-CE3 4.49Å; V3159-W3162 HydrophobicContact CG2-CZ2 4.24Å; V3159-W3162 VanDerWaalsContact O-CB 3.28Å; V3159-W3162 WeakPolarHBondContact O-CB 3.25Å; V3159-W3162 VanDerWaalsContact O-CG 3.29Å; V3159-W3162 PolarHBondContact O-N 2.83Å; V3159-W3162 VanDerWaalsContact O-N 3.08Å; V3159-F3169 HydrophobicContact CG2-CE2 3.68Å; V3159-F3169 HydrophobicContact CG2-CZ 3.65Å
3160	A	80.4	Confident	82.5	Confident	67 Å²	67	51.7 Å²	51.7	55%	0.554	30%	0.299	S	S	*	.	H	α-helix	trans	-62.7	-28.8	176.5	0	0	0	0	0	113.3	M3156 A3158 W3162	M3156-A3160 WeakPolarHBondContact O-CB 3.32Å; M3156-A3160 PolarHBondContact O-N 3.37Å; A3158-A3160 VanDerWaalsContact C-N 3.33Å; A3158-A3160 PolarHBondContact O-N 3.02Å; A3160-W3162 PolarHBondContact O-N 2.94Å
3161	N	81.2	Confident	82.6	Confident	93 Å²	93	47.5 Å²	47.5	50%	0.497	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-7.6	176	-71.6	-37.7	0	0	0	113.7	N3157 A3158 V3159 N3163	N3157-N3161 PolarHBondContact O-N 3.42Å; N3157-N3161 PolarHBondContact O-ND2 3.4Å; A3158-N3161 WeakPolarHBondContact O-CA 3.43Å; A3158-N3161 WeakPolarHBondContact O-CB 3.29Å; A3158-N3161 PolarHBondContact O-N 2.73Å; V3159-N3161 PolarHBondContact O-N 3.07Å; N3161-N3163 VanDerWaalsContact C-N 3.25Å; N3161-N3163 VanDerWaalsContact C-ND2 3.32Å; N3161-N3163 PolarHBondContact O-N 3.4Å; N3161-N3163 PolarHBondContact O-ND2 3.45Å
3162	W	81	Confident	82.4	Confident	27 Å²	27	50.1 Å²	50.1	10%	0.102	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-28.7	-179.2	-65.2	6.9	0	0	0	112.4	V3054 E3129 L3131 A3158 V3159 A3160 G3164 A3165 G3167 F3169	V3054-W3162 HydrophobicContact CG1-CE3 4.47Å; V3054-W3162 HydrophobicContact CG1-CH2 3.8Å; V3054-W3162 HydrophobicContact CG1-CZ3 3.62Å; E3129-W3162 PolarHBondContact OE1-NE1 2.96Å; L3131-W3162 VanDerWaalsContact CD2-CD1 3.42Å; L3131-W3162 HydrophobicContact CD2-CD2 4.18Å; L3131-W3162 HydrophobicContact CD2-CG 3.86Å; A3158-W3162 PolarHBondContact O-NE1 3.47Å; V3159-W3162 HydrophobicContact CG1-CD2 4.48Å; V3159-W3162 HydrophobicContact CG1-CE3 4.49Å; V3159-W3162 HydrophobicContact CG2-CZ2 4.24Å; V3159-W3162 VanDerWaalsContact O-CB 3.28Å; V3159-W3162 WeakPolarHBondContact O-CB 3.25Å; V3159-W3162 VanDerWaalsContact O-CG 3.29Å; V3159-W3162 PolarHBondContact O-N 2.83Å; V3159-W3162 VanDerWaalsContact O-N 3.08Å; A3160-W3162 PolarHBondContact O-N 2.94Å; W3162-G3164 PolarHBondContact O-N 3.49Å; W3162-A3165 VanDerWaalsContact O-CB 3.31Å; W3162-A3165 WeakPolarHBondContact O-CB 3.49Å; W3162-A3165 PolarHBondContact O-N 3.16Å; W3162-G3167 WeakPolarHBondContact CH2-O 3.42Å; W3162-G3167 WeakPolarHBondContact CZ3-O 3.42Å; W3162-F3169 HydrophobicContact CH2-CE2 4.2Å; W3162-F3169 HydrophobicContact CH2-CZ 4.49Å; W3162-F3169 HydrophobicContact CZ2-CD2 4.34Å; W3162-F3169 HydrophobicContact CZ2-CE1 4.12Å; W3162-F3169 AromaticContact CZ2-CE2 3.69Å; W3162-F3169 HydrophobicContact CZ2-CE2 3.69Å; W3162-F3169 AromaticContact CZ2-CZ 3.56Å; W3162-F3169 HydrophobicContact CZ2-CZ 3.56Å
3163	N	68.4	Low	82	Confident	143 Å²	143	49.3 Å²	49.3	77%	0.765	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.1	34.6	170.4	-71.5	-68.7	0	0	0	115.2	N3161	N3161-N3163 VanDerWaalsContact C-N 3.25Å; N3161-N3163 VanDerWaalsContact C-ND2 3.32Å; N3161-N3163 PolarHBondContact O-N 3.4Å; N3161-N3163 PolarHBondContact O-ND2 3.45Å
3164	G	64.8	Low	81.4	Confident	74 Å²	74	52.2 Å²	52.2	76%	0.763	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.2	1.1	-178.9	0	0	0	0	0	115.6	W3162	W3162-G3164 PolarHBondContact O-N 3.49Å
3165	A	70.4	Confident	80.2	Confident	23 Å²	23	50.9 Å²	50.9	19%	0.19	29%	0.286	C	S	.	.	S	Bend	trans	-75.1	152.8	161.3	0	0	0	0	0	110.6	I3133 W3162	I3133-A3165 HydrophobicContact CG1-CB 4.16Å; W3162-A3165 VanDerWaalsContact O-CB 3.31Å; W3162-A3165 WeakPolarHBondContact O-CB 3.49Å; W3162-A3165 PolarHBondContact O-N 3.16Å
3166	N	76.8	Confident	78.8	Confident	77 Å²	77	56.2 Å²	56.2	41%	0.412	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	125.4	169.2	-70.2	26	0	0	0	108.2	L3131 W3132	L3131-N3166 WeakPolarHBondContact CA-O 3.33Å; W3132-N3166 HydrophobicContact CD2-CB 4.01Å; W3132-N3166 VanDerWaalsContact CE3-O 3.31Å; W3132-N3166 HydrophobicContact CG-CB 4.43Å; W3132-N3166 HydrophobicContact CH2-CB 4.25Å; W3132-N3166 HydrophobicContact CZ2-CB 3.67Å; W3132-N3166 PolarHBondContact N-O 3.2Å; W3132-N3166 PolarHBondContact O-N 3.07Å
3167	G	79.6	Confident	78.2	Confident	9 Å²	9	57.5 Å²	57.5	9%	0.093	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	162.2	174.4	0	0	0	0	0	112.3	D3130 W3162	D3130-G3167 CarbonylContact O-C 3.58Å; D3130-G3167 WeakPolarHBondContact O-CA 3.43Å; W3162-G3167 WeakPolarHBondContact CH2-O 3.42Å; W3162-G3167 WeakPolarHBondContact CZ3-O 3.42Å
3168	R	87	Confident	77.7	Confident	86 Å²	86	54.8 Å²	54.8	33%	0.325	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151	154.6	164.2	73.6	-169.9	176.8	174.3	-1.1	110.6	Y3085 D3130 W3132 V3170	Y3085-R3168 HydrophobicContact CD2-CB 3.94Å; Y3085-R3168 HydrophobicContact CD2-CG 4.31Å; Y3085-R3168 HydrophobicContact CE2-CB 3.85Å; D3130-R3168 HydrophobicContact CB-CG 3.78Å; D3130-R3168 PolarHBondContact N-O 2.99Å; D3130-R3168 PolarHBondContact O-N 3.33Å; D3130-R3168 IonicContact OD2-CZ 3.15Å; D3130-R3168 IonicContact OD2-NE 3.6Å; D3130-R3168 PolarHBondContact OD2-NE 3.05Å; D3130-R3168 VanDerWaalsContact OD2-NE 3.14Å; D3130-R3168 IonicContact OD2-NH2 3.73Å; D3130-R3168 PolarHBondContact OD2-NH2 3.44Å; W3132-R3168 HydrophobicContact CH2-CB 4.23Å; W3132-R3168 HydrophobicContact CH2-CG 4.22Å; W3132-R3168 HydrophobicContact CZ3-CB 4.19Å; W3132-R3168 HydrophobicContact CZ3-CG 3.85Å; R3168-V3170 HydrophobicContact CG-CG2 3.93Å
3169	F	90.4	Very high	77.4	Confident	3 Å²	3	54.9 Å²	54.9	1%	0.013	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	128.9	171.8	-62.1	-61.6	0	0	0	111.1	L3082 I3084 Y3085 L3127 M3128 E3129 L3149 I3155 A3158 V3159 W3162	L3082-F3169 HydrophobicContact CD2-CD2 4.5Å; L3082-F3169 HydrophobicContact CD2-CE2 4.18Å; I3084-F3169 HydrophobicContact CD1-CB 3.74Å; I3084-F3169 HydrophobicContact CD1-CD2 4.31Å; I3084-F3169 HydrophobicContact CD1-CG 4.41Å; Y3085-F3169 WeakPolarHBondContact CD2-O 3.49Å; Y3085-F3169 PolarHBondContact N-O 2.93Å; L3127-F3169 HydrophobicContact CD1-CB 4.05Å; L3127-F3169 HydrophobicContact CG-CB 4.42Å; M3128-F3169 CarbonylContact O-C 3.52Å; M3128-F3169 WeakPolarHBondContact O-CA 3.37Å; E3129-F3169 HydrophobicContact CB-CD1 4.44Å; E3129-F3169 HydrophobicContact CB-CE1 4.3Å; L3149-F3169 HydrophobicContact CD1-CD1 4.06Å; L3149-F3169 HydrophobicContact CD1-CE1 3.83Å; I3155-F3169 HydrophobicContact CG2-CE2 3.81Å; I3155-F3169 HydrophobicContact CG2-CZ 3.88Å; A3158-F3169 HydrophobicContact CB-CE1 4.16Å; A3158-F3169 HydrophobicContact CB-CZ 4.2Å; V3159-F3169 HydrophobicContact CG2-CE2 3.68Å; V3159-F3169 HydrophobicContact CG2-CZ 3.65Å; W3162-F3169 HydrophobicContact CH2-CE2 4.2Å; W3162-F3169 HydrophobicContact CH2-CZ 4.49Å; W3162-F3169 HydrophobicContact CZ2-CD2 4.34Å; W3162-F3169 HydrophobicContact CZ2-CE1 4.12Å; W3162-F3169 AromaticContact CZ2-CE2 3.69Å; W3162-F3169 HydrophobicContact CZ2-CE2 3.69Å; W3162-F3169 AromaticContact CZ2-CZ 3.56Å; W3162-F3169 HydrophobicContact CZ2-CZ 3.56Å
3170	V	87.2	Confident	76.8	Confident	7 Å²	7	54.7 Å²	54.7	4%	0.042	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	116.3	-179.5	-171.8	0	0	0	0	109	Y3085 M3128 D3130 R3168 R3172	Y3085-V3170 CarbonylContact O-C 3.53Å; Y3085-V3170 WeakPolarHBondContact O-CA 3.15Å; M3128-V3170 WeakPolarHBondContact CB-O 3.42Å; M3128-V3170 HydrophobicContact CE-CB 4.32Å; M3128-V3170 HydrophobicContact CE-CG1 4.35Å; M3128-V3170 PolarHBondContact N-O 3.33Å; M3128-V3170 PolarHBondContact O-N 2.88Å; D3130-V3170 HydrophobicContact CB-CG2 4.26Å; R3168-V3170 HydrophobicContact CG-CG2 3.93Å; V3170-R3172 HydrophobicContact CG1-CG 4.35Å
3171	L	88.1	Confident	76.6	Confident	1 Å²	1	58.3 Å²	58.3	1%	0.005	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	136.6	172.9	-165	73.5	0	0	0	109.7	I3084 Y3085 V3087 I3108 L3112 Y3125 L3127	I3084-L3171 HydrophobicContact CG2-CB 4.04Å; Y3085-L3171 PolarHBondContact O-N 3.14Å; V3087-L3171 HydrophobicContact CB-CD2 4.35Å; V3087-L3171 HydrophobicContact CG1-CD2 3.97Å; V3087-L3171 HydrophobicContact CG2-CB 3.83Å; V3087-L3171 HydrophobicContact CG2-CD2 3.8Å; V3087-L3171 HydrophobicContact CG2-CG 4.45Å; I3108-L3171 HydrophobicContact CB-CD1 4.24Å; I3108-L3171 HydrophobicContact CG1-CD1 3.68Å; I3108-L3171 HydrophobicContact CG2-CD1 4.11Å; L3112-L3171 HydrophobicContact CD2-CD2 3.93Å; L3112-L3171 HydrophobicContact CG-CD2 4.19Å; Y3125-L3171 HydrophobicContact CD1-CD1 4.32Å; Y3125-L3171 HydrophobicContact CD1-CD2 3.7Å; Y3125-L3171 HydrophobicContact CD1-CG 3.77Å; Y3125-L3171 HydrophobicContact CE1-CD2 4.03Å; Y3125-L3171 HydrophobicContact CE1-CG 4.43Å; Y3125-L3171 HydrophobicContact CG-CD2 4.49Å; L3127-L3171 HydrophobicContact CD1-CB 4.48Å; L3127-L3171 HydrophobicContact CD1-CD1 4.07Å
3172	R	82.6	Confident	76.3	Confident	103 Å²	103	54 Å²	54	39%	0.389	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	138.5	173.8	-69.3	-61.1	-162.9	-167.9	8.1	111.6	Y3125 V3126 M3128 V3170	Y3125-R3172 CarbonylContact C-O 3.58Å; Y3125-R3172 WeakPolarHBondContact CA-O 3.41Å; V3126-R3172 HydrophobicContact CG2-CB 4.12Å; V3126-R3172 PolarHBondContact N-O 2.95Å; V3126-R3172 PolarHBondContact O-N 3.17Å; M3128-R3172 HydrophobicContact CE-CG 3.59Å; M3128-R3172 HydrophobicContact SD-CB 4.37Å; M3128-R3172 HydrophobicContact SD-CG 3.93Å; V3170-R3172 HydrophobicContact CG1-CG 4.35Å
3173	K	81.6	Confident	76.1	Confident	93 Å²	93	54.3 Å²	54.3	40%	0.404	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	140.7	168.2	-159.5	169.1	-167.5	163	0	110.3	D3120 D3124 Y3125 G3175	D3120-K3173 IonicContact OD2-NZ 3.13Å; D3120-K3173 PolarHBondContact OD2-NZ 3.35Å; D3124-K3173 HydrophobicContact CB-CG 4.25Å; D3124-K3173 CarbonylContact O-C 3.43Å; D3124-K3173 IonicContact OD2-NZ 2.7Å; Y3125-K3173 HydrophobicContact CD1-CB 4.08Å; Y3125-K3173 HydrophobicContact CD1-CG 4.48Å; Y3125-K3173 HydrophobicContact CD2-CG 4.36Å; Y3125-K3173 HydrophobicContact CE1-CB 3.74Å; Y3125-K3173 HydrophobicContact CE1-CD 4.45Å; Y3125-K3173 HydrophobicContact CE1-CG 4.15Å; Y3125-K3173 HydrophobicContact CE2-CB 4.44Å; Y3125-K3173 HydrophobicContact CE2-CD 3.91Å; Y3125-K3173 HydrophobicContact CE2-CG 3.94Å; K3173-G3175 PolarHBondContact O-N 3.41Å
3174	K	75	Confident	76.3	Confident	97 Å²	97	48.8 Å²	48.8	42%	0.422	27%	0.266	S	S	.	.			trans	-69.1	91.3	178.2	-68.7	166.9	-170.4	167.7	0	109.4	D3123 D3124 Y3125 V3126 M3184	D3123-K3174 WeakPolarHBondContact O-CD 3.49Å; D3123-K3174 WeakPolarHBondContact O-CE 3.29Å; D3123-K3174 PolarHBondContact O-NZ 2.92Å; D3124-K3174 WeakPolarHBondContact O-CB 3.39Å; D3124-K3174 VanDerWaalsContact O-CG 3.29Å; D3124-K3174 WeakPolarHBondContact O-CG 3.46Å; D3124-K3174 PolarHBondContact O-N 2.92Å; Y3125-K3174 WeakPolarHBondContact O-CE 3.46Å; Y3125-K3174 PolarHBondContact O-NZ 2.92Å; V3126-K3174 HydrophobicContact CG1-CD 4.44Å; V3126-K3174 HydrophobicContact CG1-CG 4.29Å; K3174-M3184 HydrophobicContact CB-CE 4.46Å
3175	G	64.8	Low	76.7	Confident	27 Å²	27	48.8 Å²	48.8	28%	0.278	25%	0.249	S	C	.	.			trans	-53.4	147.2	-176.5	0	0	0	0	0	114.6	K3173 R3181	K3173-G3175 PolarHBondContact O-N 3.41Å; G3175-R3181 WeakPolarHBondContact O-CD 3.46Å; G3175-R3181 WeakPolarHBondContact O-CG 3.29Å
3176	S	59.3	Low	76.9	Confident	113 Å²	113	48 Å²	48	79%	0.79	24%	0.241	S	C	*	.	S	Bend	trans	-77	-24.6	-177.2	53.7	0	0	0	0	113.9
3177	D	70.8	Confident	76.7	Confident	52 Å²	52	44.4 Å²	44.4	28%	0.278	22%	0.222	S	C	.	.	S	Bend	trans	-78.1	150.9	-171.7	82.1	83.1	0	0	0	113.6	S3179 S3180 R3181	D3177-S3179 VanDerWaalsContact C-N 3.32Å; D3177-S3179 PolarHBondContact O-N 2.77Å; D3177-S3179 WeakPolarHBondContact OD1-CA 3.45Å; D3177-S3179 WeakPolarHBondContact OD1-CB 3.29Å; D3177-S3179 PolarHBondContact OD1-N 2.81Å; D3177-S3180 PolarHBondContact OD1-N 3.32Å; D3177-S3180 PolarHBondContact OD1-OG 3.02Å; D3177-S3180 WeakPolarHBondContact OD2-CB 3.47Å; D3177-S3180 PolarHBondContact OD2-OG 3.25Å; D3177-R3181 WeakPolarHBondContact O-CB 3.33Å; D3177-R3181 VanDerWaalsContact O-CG 3.25Å; D3177-R3181 WeakPolarHBondContact O-CG 3.34Å; D3177-R3181 PolarHBondContact O-N 2.98Å; D3177-R3181 VanDerWaalsContact O-N 3.09Å
3178	P	75.1	Confident	76.2	Confident	31 Å²	31	46.6 Å²	46.6	20%	0.201	23%	0.231	C	C	.	.	H	α-helix	trans	-62.2	-29	-178	-27.5	37.3	0	0	0	115.7	A3182 C3213 Y3223	P3178-A3182 VanDerWaalsContact O-CB 3.29Å; P3178-A3182 WeakPolarHBondContact O-CB 3.48Å; P3178-A3182 PolarHBondContact O-N 2.95Å; P3178-C3213 VanDerWaalsContact CB-SG 3.54Å; P3178-Y3223 HydrophobicContact CB-CD2 3.94Å; P3178-Y3223 HydrophobicContact CB-CE2 3.88Å; P3178-Y3223 HydrophobicContact CB-CG 4.37Å; P3178-Y3223 HydrophobicContact CG-CD1 4.13Å; P3178-Y3223 HydrophobicContact CG-CD2 4.18Å; P3178-Y3223 HydrophobicContact CG-CE1 3.9Å; P3178-Y3223 HydrophobicContact CG-CE2 3.95Å; P3178-Y3223 HydrophobicContact CG-CG 4.28Å
3179	S	77.4	Confident	75.4	Confident	1 Å²	1	47 Å²	47	1%	0.007	23%	0.233	C	C	.	.	H	α-helix	trans	-78.8	-47.2	-176.7	-70.1	0	0	0	0	111.6	D3177 R3181 A3182 W3183 H3215	D3177-S3179 VanDerWaalsContact C-N 3.32Å; D3177-S3179 PolarHBondContact O-N 2.77Å; D3177-S3179 WeakPolarHBondContact OD1-CA 3.45Å; D3177-S3179 WeakPolarHBondContact OD1-CB 3.29Å; D3177-S3179 PolarHBondContact OD1-N 2.81Å; S3179-R3181 VanDerWaalsContact C-N 3.28Å; S3179-R3181 PolarHBondContact O-N 3.38Å; S3179-A3182 PolarHBondContact O-N 3.48Å; S3179-W3183 WeakPolarHBondContact O-CB 3.47Å; S3179-W3183 PolarHBondContact O-N 2.73Å; S3179-H3215 PolarHBondContact OG-CD2 2.85Å; S3179-H3215 PolarHBondContact OG-NE2 2.89Å
3180	S	71.8	Confident	74.3	Confident	21 Å²	21	48.5 Å²	48.5	15%	0.147	24%	0.243	C	C	.	.	H	α-helix	trans	-60.8	-39.8	172.2	-58.9	0	0	0	0	110.6	D3177 W3183 M3184	D3177-S3180 PolarHBondContact OD1-N 3.32Å; D3177-S3180 PolarHBondContact OD1-OG 3.02Å; D3177-S3180 WeakPolarHBondContact OD2-CB 3.47Å; D3177-S3180 PolarHBondContact OD2-OG 3.25Å; S3180-W3183 PolarHBondContact O-N 3.01Å; S3180-M3184 WeakPolarHBondContact O-CB 3.37Å; S3180-M3184 WeakPolarHBondContact O-CE 3.36Å; S3180-M3184 WeakPolarHBondContact O-CG 3.42Å; S3180-M3184 PolarHBondContact O-N 3.28Å
3181	R	74.7	Confident	73	Confident	144 Å²	144	49.1 Å²	49.1	54%	0.543	25%	0.248	S	C	.	.	H	α-helix	trans	-65.3	-39.9	174.8	-70.3	178.7	71	170.4	3.7	112.8	G3175 D3177 S3179 M3184 N3185	G3175-R3181 WeakPolarHBondContact O-CD 3.46Å; G3175-R3181 WeakPolarHBondContact O-CG 3.29Å; D3177-R3181 WeakPolarHBondContact O-CB 3.33Å; D3177-R3181 VanDerWaalsContact O-CG 3.25Å; D3177-R3181 WeakPolarHBondContact O-CG 3.34Å; D3177-R3181 PolarHBondContact O-N 2.98Å; D3177-R3181 VanDerWaalsContact O-N 3.09Å; S3179-R3181 VanDerWaalsContact C-N 3.28Å; S3179-R3181 PolarHBondContact O-N 3.38Å; R3181-M3184 HydrophobicContact CG-CE 4.18Å; R3181-N3185 WeakPolarHBondContact O-CB 3.43Å; R3181-N3185 PolarHBondContact O-N 3.09Å; R3181-N3185 VanDerWaalsContact O-N 3.08Å; R3181-N3185 PolarHBondContact O-ND2 3.19Å
3182	A	76.1	Confident	71.7	Confident	3 Å²	3	55 Å²	55	3%	0.025	27%	0.273	C	S	.	.	H	α-helix	trans	-66.1	-39.2	175.2	0	0	0	0	0	112	P3178 S3179 T3186 L3211 C3213	P3178-A3182 VanDerWaalsContact O-CB 3.29Å; P3178-A3182 WeakPolarHBondContact O-CB 3.48Å; P3178-A3182 PolarHBondContact O-N 2.95Å; S3179-A3182 PolarHBondContact O-N 3.48Å; A3182-T3186 WeakPolarHBondContact O-CB 3.24Å; A3182-T3186 PolarHBondContact O-N 3.49Å; A3182-T3186 PolarHBondContact O-OG1 3.09Å; A3182-L3211 CarbonylContact C-O 3.59Å; A3182-L3211 HydrophobicContact CB-CB 4.15Å; A3182-L3211 WeakPolarHBondContact CB-O 3.22Å; A3182-C3213 HydrophobicContact CB-CB 3.94Å
3183	W	76.1	Confident	70.5	Confident	33 Å²	33	55.3 Å²	55.3	13%	0.125	28%	0.279	C	S	.	.	H	α-helix	trans	-65.8	-51.8	175.6	180	63.2	0	0	0	113	S3179 S3180 N3185 T3186 I3187 Q3308	S3179-W3183 WeakPolarHBondContact O-CB 3.47Å; S3179-W3183 PolarHBondContact O-N 2.73Å; S3180-W3183 PolarHBondContact O-N 3.01Å; W3183-N3185 VanDerWaalsContact C-N 3.34Å; W3183-N3185 PolarHBondContact O-N 3.23Å; W3183-T3186 WeakPolarHBondContact O-CA 3.47Å; W3183-T3186 VanDerWaalsContact O-CB 3.28Å; W3183-T3186 WeakPolarHBondContact O-CB 3.47Å; W3183-T3186 PolarHBondContact O-N 2.97Å; W3183-I3187 HydrophobicContact CD2-CD1 3.99Å; W3183-I3187 HydrophobicContact CE3-CD1 4.47Å; W3183-I3187 HydrophobicContact CG-CD1 4.48Å; W3183-I3187 HydrophobicContact CH2-CD1 4.26Å; W3183-I3187 HydrophobicContact CZ2-CD1 3.75Å; W3183-I3187 PolarHBondContact O-N 3.42Å; W3183-Q3308 PolarHBondContact NE1-O 3.45Å
3184	M	71.6	Confident	69	Low	26 Å²	26	58.3 Å²	58.3	13%	0.128	29%	0.292	C	S	.	.	H	α-helix	trans	-59.4	-43.4	176.5	-70.5	-178.4	-62.9	0	0	111.6	K3174 S3180 R3181 T3186 I3187 I3188	K3174-M3184 HydrophobicContact CB-CE 4.46Å; S3180-M3184 WeakPolarHBondContact O-CB 3.37Å; S3180-M3184 WeakPolarHBondContact O-CE 3.36Å; S3180-M3184 WeakPolarHBondContact O-CG 3.42Å; S3180-M3184 PolarHBondContact O-N 3.28Å; R3181-M3184 HydrophobicContact CG-CE 4.18Å; M3184-T3186 PolarHBondContact O-N 2.99Å; M3184-I3187 PolarHBondContact O-N 3.32Å; M3184-I3188 WeakPolarHBondContact O-CB 3.44Å; M3184-I3188 WeakPolarHBondContact O-CD1 3.29Å; M3184-I3188 WeakPolarHBondContact O-CG1 3.19Å; M3184-I3188 PolarHBondContact O-N 2.92Å
3185	N	74.2	Confident	67	Low	75 Å²	75	59.4 Å²	59.4	40%	0.401	30%	0.302	S	S	.	.	H	α-helix	trans	-64.4	-28.8	175.3	-78.5	-60.3	0	0	0	113	R3181 W3183 R3189 L3211	R3181-N3185 WeakPolarHBondContact O-CB 3.43Å; R3181-N3185 PolarHBondContact O-N 3.09Å; R3181-N3185 VanDerWaalsContact O-N 3.08Å; R3181-N3185 PolarHBondContact O-ND2 3.19Å; W3183-N3185 VanDerWaalsContact C-N 3.34Å; W3183-N3185 PolarHBondContact O-N 3.23Å; N3185-R3189 WeakPolarHBondContact O-CB 3.17Å; N3185-R3189 WeakPolarHBondContact O-CG 3.42Å; N3185-R3189 PolarHBondContact O-N 3.32Å; N3185-R3189 VanDerWaalsContact O-N 3.12Å; N3185-L3211 HydrophobicContact CB-CD1 3.82Å
3186	T	74.7	Confident	65.5	Low	5 Å²	5	64.2 Å²	64.2	3%	0.031	33%	0.328	C	S	.	.	H	α-helix	trans	-67.4	-50.6	171.7	-65.2	0	0	0	0	110.8	A3182 W3183 M3184 I3188 R3189 S3190 F3210 L3211 F3305 M3309	A3182-T3186 WeakPolarHBondContact O-CB 3.24Å; A3182-T3186 PolarHBondContact O-N 3.49Å; A3182-T3186 PolarHBondContact O-OG1 3.09Å; W3183-T3186 WeakPolarHBondContact O-CA 3.47Å; W3183-T3186 VanDerWaalsContact O-CB 3.28Å; W3183-T3186 WeakPolarHBondContact O-CB 3.47Å; W3183-T3186 PolarHBondContact O-N 2.97Å; M3184-T3186 PolarHBondContact O-N 2.99Å; T3186-I3188 VanDerWaalsContact C-N 3.34Å; T3186-I3188 PolarHBondContact O-N 3.26Å; T3186-R3189 PolarHBondContact O-N 3.06Å; T3186-S3190 PolarHBondContact O-N 3.06Å; T3186-S3190 PolarHBondContact O-OG 3.41Å; T3186-F3210 HydrophobicContact CG2-CB 3.63Å; T3186-L3211 PolarHBondContact OG1-N 3.48Å; T3186-L3211 PolarHBondContact OG1-O 3.38Å; T3186-F3305 HydrophobicContact CG2-CD2 4.38Å; T3186-F3305 HydrophobicContact CG2-CE2 3.93Å; T3186-M3309 HydrophobicContact CG2-SD 4.23Å
3187	I	71.7	Confident	64.3	Low	2 Å²	2	67.4 Å²	67.4	1%	0.01	33%	0.328	C	S	.	.	H	α-helix	trans	-60	-43.6	178.4	-62.8	173.7	0	0	0	111.1	V3148 W3183 M3184 R3189 S3190 S3191 M3309	V3148-I3187 HydrophobicContact CG2-CG2 4.02Å; W3183-I3187 HydrophobicContact CD2-CD1 3.99Å; W3183-I3187 HydrophobicContact CE3-CD1 4.47Å; W3183-I3187 HydrophobicContact CG-CD1 4.48Å; W3183-I3187 HydrophobicContact CH2-CD1 4.26Å; W3183-I3187 HydrophobicContact CZ2-CD1 3.75Å; W3183-I3187 PolarHBondContact O-N 3.42Å; M3184-I3187 PolarHBondContact O-N 3.32Å; I3187-R3189 VanDerWaalsContact C-N 3.34Å; I3187-R3189 PolarHBondContact O-N 2.89Å; I3187-S3190 WeakPolarHBondContact CA-OG 3.45Å; I3187-S3190 PolarHBondContact O-N 3.42Å; I3187-S3190 PolarHBondContact O-OG 2.91Å; I3187-S3191 WeakPolarHBondContact O-CB 3.21Å; I3187-S3191 PolarHBondContact O-N 3.4Å; I3187-S3191 PolarHBondContact O-OG 3.16Å; I3187-M3309 HydrophobicContact CG1-CE 4.14Å; I3187-M3309 HydrophobicContact CG1-SD 4.11Å
3188	I	70.1	Confident	62.6	Low	56 Å²	56	74.3 Å²	74.3	29%	0.287	36%	0.359	S	S	.	.	H	α-helix	trans	-62.8	-39.3	178.2	-68	163.8	0	0	0	111.1	V3148 M3184 T3186 S3191 K3192	V3148-I3188 HydrophobicContact CB-CG1 4.21Å; V3148-I3188 HydrophobicContact CG1-CG1 4.45Å; V3148-I3188 HydrophobicContact CG2-CG1 3.99Å; M3184-I3188 WeakPolarHBondContact O-CB 3.44Å; M3184-I3188 WeakPolarHBondContact O-CD1 3.29Å; M3184-I3188 WeakPolarHBondContact O-CG1 3.19Å; M3184-I3188 PolarHBondContact O-N 2.92Å; T3186-I3188 VanDerWaalsContact C-N 3.34Å; T3186-I3188 PolarHBondContact O-N 3.26Å; I3188-S3191 PolarHBondContact O-N 3.5Å; I3188-K3192 PolarHBondContact O-N 3.23Å
3189	R	70.4	Confident	60.4	Low	95 Å²	95	78.4 Å²	78.4	36%	0.358	39%	0.388	S	S	.	.	H	α-helix	trans	-67.8	-48.6	174.3	-78.3	-178.6	178.1	174.1	1.6	112.5	N3185 T3186 I3187 S3191 K3192 E3193	N3185-R3189 WeakPolarHBondContact O-CB 3.17Å; N3185-R3189 WeakPolarHBondContact O-CG 3.42Å; N3185-R3189 PolarHBondContact O-N 3.32Å; N3185-R3189 VanDerWaalsContact O-N 3.12Å; T3186-R3189 PolarHBondContact O-N 3.06Å; I3187-R3189 VanDerWaalsContact C-N 3.34Å; I3187-R3189 PolarHBondContact O-N 2.89Å; R3189-S3191 PolarHBondContact O-N 3.4Å; R3189-S3191 VanDerWaalsContact O-N 3.17Å; R3189-K3192 PolarHBondContact O-N 3.22Å; R3189-E3193 PolarHBondContact O-N 2.94Å; R3189-E3193 VanDerWaalsContact O-N 3.15Å
3190	S	67.5	Low	58.2	Low	33 Å²	33	84.7 Å²	84.7	23%	0.231	43%	0.431	C	S	.	.	H	α-helix	trans	-63.5	-22.2	178	58.6	0	0	0	0	113.3	T3186 I3187	T3186-S3190 PolarHBondContact O-N 3.06Å; T3186-S3190 PolarHBondContact O-OG 3.41Å; I3187-S3190 WeakPolarHBondContact CA-OG 3.45Å; I3187-S3190 PolarHBondContact O-N 3.42Å; I3187-S3190 PolarHBondContact O-OG 2.91Å
3191	S	60.2	Low	56.5	Low	21 Å²	21	93.6 Å²	93.6	15%	0.147	47%	0.467	C	S	.	.	H	α-helix	trans	-71.6	-34.6	171.8	-58.1	0	0	0	0	112.3	I3187 I3188 R3189	I3187-S3191 WeakPolarHBondContact O-CB 3.21Å; I3187-S3191 PolarHBondContact O-N 3.4Å; I3187-S3191 PolarHBondContact O-OG 3.16Å; I3188-S3191 PolarHBondContact O-N 3.5Å; R3189-S3191 PolarHBondContact O-N 3.4Å; R3189-S3191 VanDerWaalsContact O-N 3.17Å
3192	K	59.8	Low	54.5	Low	124 Å²	124	91.7 Å²	91.7	54%	0.539	48%	0.482	S	S	.	.	H	α-helix	trans	-85.7	-28.2	-176.8	-66.5	-176.7	-170.9	-120.7	0	113.8	E3150 I3188 R3189 K3194	E3150-K3192 WeakPolarHBondContact OE1-CE 3.5Å; E3150-K3192 IonicContact OE1-NZ 3.14Å; E3150-K3192 PolarHBondContact OE1-NZ 3.46Å; E3150-K3192 IonicContact OE2-NZ 2.68Å; I3188-K3192 PolarHBondContact O-N 3.23Å; R3189-K3192 PolarHBondContact O-N 3.22Å; K3192-K3194 VanDerWaalsContact C-N 3.27Å; K3192-K3194 PolarHBondContact O-N 3.13Å
3193	E	57.2	Low	52.3	Low	109 Å²	109	97.3 Å²	97.3	51%	0.509	52%	0.521	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-8.8	179.8	-70.1	175	179.6	0	0	113.8	R3189	R3189-E3193 PolarHBondContact O-N 2.94Å; R3189-E3193 VanDerWaalsContact O-N 3.15Å
3194	K	50.4	Low	50.5	Low	157 Å²	157	104.7 Å²	104.7	68%	0.683	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.6	9	-175.1	-81.7	-170.6	174.6	-173.6	0	116.7	K3192 P3196	K3192-K3194 VanDerWaalsContact C-N 3.27Å; K3192-K3194 PolarHBondContact O-N 3.13Å; K3194-P3196 WeakPolarHBondContact O-CD 3.22Å
3195	L	34	Very low	49	Very low	120 Å²	120	115.5 Å²	115.5	63%	0.628	60%	0.596	S	S	*	*			trans	-103.2	95.3	173.8	-84.8	92.1	0	0	0	113	K3197	L3195-K3197 PolarHBondContact O-N 3.32Å; L3195-K3197 VanDerWaalsContact O-N 3.1Å
3196	P	31.8	Very low	47.9	Very low	127 Å²	127	117.1 Å²	117.1	83%	0.825	61%	0.613	S	S	*	*			trans	-77.1	92.7	170.8	31.6	-34.3	0	0	0	111.2	K3194	K3194-P3196 WeakPolarHBondContact O-CD 3.22Å
3197	K	35.3	Very low	47.3	Very low	180 Å²	180	123.3 Å²	123.3	78%	0.783	64%	0.641	S	S	*	*			trans	-105.2	100.8	171.1	-79.8	-170.8	175.4	-180	0	112.4	L3195	L3195-K3197 PolarHBondContact O-N 3.32Å; L3195-K3197 VanDerWaalsContact O-N 3.1Å
3198	Q	34.4	Very low	47.4	Very low	198 Å²	198	128 Å²	128	93%	0.925	67%	0.666	S	S	*	*	S	Bend	trans	65.1	159.2	166.3	-71.5	179.9	-28.5	0	0	117.8
3199	S	29.4	Very low	48.1	Very low	116 Å²	116	126.5 Å²	126.5	81%	0.811	66%	0.659	S	S	*	*			trans	-90.3	121.3	-163.8	53.9	0	0	0	0	113.3
3200	C	30.6	Very low	48.8	Very low	134 Å²	134	122.2 Å²	122.2	91%	0.905	64%	0.643	S	S	*	*			trans	-136.2	145.7	155.8	-93.5	0	0	0	0	111.4
3201	K	36.9	Very low	49.7	Very low	208 Å²	208	121.8 Å²	121.8	90%	0.904	64%	0.638	S	S	*	*			trans	-42	138.7	-168.8	-61.8	168.4	-179.8	178.6	0	115
3202	A	31.3	Very low	51.1	Low	104 Å²	104	120.8 Å²	120.8	86%	0.86	63%	0.631	S	S	*	*			trans	-67.6	143.7	174.3	0	0	0	0	0	112.7
3203	S	31.2	Very low	52.5	Low	121 Å²	121	115 Å²	115	85%	0.846	61%	0.606	S	S	*	*				-179.7	50.3	122.6	-172.1	0	0	0	0	113.5
3204	E	36.9	Very low	54	Low	187 Å²	187	109.8 Å²	109.8	87%	0.874	58%	0.582	S	S	*	*			trans	-143.7	111.8	165.8	-117	171.8	-150.1	0	0	110	S3206	E3204-S3206 PolarHBondContact O-N 2.65Å
3205	R	39.9	Very low	55.9	Low	254 Å²	254	103.5 Å²	103.5	96%	0.958	56%	0.555	S	S	*	*			trans	-86.5	79.2	171.9	-85.9	-173.9	171.7	175.4	-2.1	109	E3207	R3205-E3207 PolarHBondContact O-N 3.43Å
3206	S	51.9	Low	58.4	Low	108 Å²	108	102.4 Å²	102.4	76%	0.755	55%	0.55	S	S	*	.			trans	-67.8	111.8	169.1	56.2	0	0	0	0	110	E3204 I3208	E3204-S3206 PolarHBondContact O-N 2.65Å; S3206-I3208 PolarHBondContact O-N 2.7Å
3207	E	62.9	Low	60.9	Low	135 Å²	135	96.4 Å²	96.4	63%	0.631	51%	0.51	S	S	*	.			trans	-64.8	133.6	178.3	-64.9	-171	148.4	0	0	111.9	R3205 T3209	R3205-E3207 PolarHBondContact O-N 3.43Å; E3207-T3209 WeakPolarHBondContact O-CG2 3.3Å; E3207-T3209 PolarHBondContact O-N 3.32Å; E3207-T3209 PolarHBondContact O-OG1 3.27Å
3208	I	73.6	Confident	63.2	Low	102 Å²	102	89.1 Å²	89.1	52%	0.523	48%	0.482	S	S	.	.			trans	-64.4	122.4	177.8	-54.9	176.7	0	0	0	108.1	S3206 P3229 V3230	S3206-I3208 PolarHBondContact O-N 2.7Å; I3208-P3229 WeakPolarHBondContact O-CA 3.45Å; I3208-V3230 HydrophobicContact CB-CG1 4.37Å; I3208-V3230 HydrophobicContact CB-CG2 4.09Å; I3208-V3230 HydrophobicContact CG2-CG1 3.8Å; I3208-V3230 HydrophobicContact CG2-CG2 4.29Å; I3208-V3230 PolarHBondContact O-N 3.02Å
3209	T	83.9	Confident	65.2	Low	24 Å²	24	89.3 Å²	89.3	15%	0.147	48%	0.483	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	121.1	-165.4	34.7	0	0	0	0	112.2	E3207 R3227 V3228 P3229	E3207-T3209 WeakPolarHBondContact O-CG2 3.3Å; E3207-T3209 PolarHBondContact O-N 3.32Å; E3207-T3209 PolarHBondContact O-OG1 3.27Å; T3209-R3227 HydrophobicContact CG2-CG 4.42Å; T3209-R3227 PolarHBondContact OG1-NE 2.93Å; T3209-R3227 PolarHBondContact OG1-NH2 2.72Å; T3209-V3228 CarbonylContact C-O 3.59Å; T3209-V3228 WeakPolarHBondContact CA-O 3.44Å; T3209-P3229 HydrophobicContact CG2-CG 4.21Å
3210	F	86.7	Confident	67.6	Low	4 Å²	4	91.5 Å²	91.5	2%	0.018	49%	0.486	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	171.9	180	75.7	-74.3	0	0	0	112.6	T3186 V3212 R3227 V3228 P3229 V3230 I3237 V3304 F3305 Q3308	T3186-F3210 HydrophobicContact CG2-CB 3.63Å; F3210-V3212 HydrophobicContact CD2-CB 4.38Å; F3210-V3212 HydrophobicContact CE2-CB 3.8Å; F3210-V3212 HydrophobicContact CE2-CG2 4.46Å; F3210-V3212 HydrophobicContact CZ-CB 4.45Å; F3210-R3227 WeakPolarHBondContact O-CA 3.42Å; F3210-V3228 HydrophobicContact CD1-CB 4.37Å; F3210-V3228 HydrophobicContact CD1-CG2 3.72Å; F3210-V3228 WeakPolarHBondContact CD1-O 3.42Å; F3210-V3228 HydrophobicContact CD2-CG2 4.2Å; F3210-V3228 HydrophobicContact CE1-CB 3.99Å; F3210-V3228 HydrophobicContact CE1-CG2 3.43Å; F3210-V3228 VanDerWaalsContact CE1-CG2 3.43Å; F3210-V3228 HydrophobicContact CE2-CG2 3.99Å; F3210-V3228 HydrophobicContact CG-CG2 4.08Å; F3210-V3228 HydrophobicContact CZ-CB 4.46Å; F3210-V3228 HydrophobicContact CZ-CG2 3.59Å; F3210-V3228 PolarHBondContact N-O 2.93Å; F3210-V3228 PolarHBondContact O-N 3.19Å; F3210-P3229 WeakPolarHBondContact CE1-O 3.47Å; F3210-V3230 HydrophobicContact CB-CG1 4.38Å; F3210-V3230 HydrophobicContact CD1-CG1 4.13Å; F3210-I3237 HydrophobicContact CZ-CD1 4.48Å; F3210-V3304 HydrophobicContact CE2-CG1 4.3Å; F3210-V3304 HydrophobicContact CZ-CB 4.15Å; F3210-V3304 HydrophobicContact CZ-CG1 4.25Å; F3210-F3305 HydrophobicContact CB-CD2 3.73Å; F3210-F3305 HydrophobicContact CB-CE2 4.17Å; F3210-F3305 HydrophobicContact CD1-CB 3.87Å; F3210-F3305 HydrophobicContact CD1-CD2 4.05Å; F3210-F3305 HydrophobicContact CD1-CG 4.29Å; F3210-F3305 HydrophobicContact CD2-CB 4.28Å; F3210-F3305 HydrophobicContact CD2-CD2 4.02Å; F3210-F3305 HydrophobicContact CE1-CB 3.69Å; F3210-F3305 HydrophobicContact CE2-CB 4.08Å; F3210-F3305 HydrophobicContact CG-CB 4.18Å; F3210-F3305 AromaticContact CG-CD2 3.7Å; F3210-F3305 HydrophobicContact CG-CD2 3.7Å; F3210-F3305 HydrophobicContact CG-CG 4.35Å; F3210-F3305 HydrophobicContact CZ-CB 3.81Å; F3210-Q3308 VanDerWaalsContact CE2-OE1 3.31Å
3211	L	85.4	Confident	69.9	Low	25 Å²	25	87.9 Å²	87.9	13%	0.131	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	112.3	174.1	-68.8	171.2	0	0	0	110.1	A3182 N3185 T3186 I3225 L3226 R3227 Q3308	A3182-L3211 CarbonylContact C-O 3.59Å; A3182-L3211 HydrophobicContact CB-CB 4.15Å; A3182-L3211 WeakPolarHBondContact CB-O 3.22Å; N3185-L3211 HydrophobicContact CB-CD1 3.82Å; T3186-L3211 PolarHBondContact OG1-N 3.48Å; T3186-L3211 PolarHBondContact OG1-O 3.38Å; L3211-I3225 HydrophobicContact CD2-CG2 4.15Å; L3211-L3226 WeakPolarHBondContact CA-O 3.29Å; L3211-R3227 HydrophobicContact CD2-CB 4Å; L3211-R3227 HydrophobicContact CD2-CG 4.45Å; L3211-Q3308 PolarHBondContact O-NE2 2.75Å; L3211-Q3308 PolarHBondContact O-OE1 2.94Å
3212	V	88.8	Confident	72.1	Confident	0 Å²	0	84.2 Å²	84.2	0%	0	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	144.9	170.1	69.5	0	0	0	0	109.7	F3210 V3214 I3225 L3226 V3228 I3237 V3304 F3317	F3210-V3212 HydrophobicContact CD2-CB 4.38Å; F3210-V3212 HydrophobicContact CE2-CB 3.8Å; F3210-V3212 HydrophobicContact CE2-CG2 4.46Å; F3210-V3212 HydrophobicContact CZ-CB 4.45Å; V3212-V3214 HydrophobicContact CG2-CG2 4.22Å; V3212-I3225 WeakPolarHBondContact O-CA 3.47Å; V3212-L3226 HydrophobicContact CG1-CB 3.86Å; V3212-L3226 HydrophobicContact CG1-CD1 4.44Å; V3212-L3226 PolarHBondContact N-O 3.42Å; V3212-L3226 PolarHBondContact O-N 3.05Å; V3212-V3228 HydrophobicContact CB-CG2 4.26Å; V3212-V3228 HydrophobicContact CG1-CG2 3.7Å; V3212-I3237 HydrophobicContact CG1-CD1 4.07Å; V3212-I3237 HydrophobicContact CG1-CG2 4.23Å; V3212-V3304 HydrophobicContact CG2-CG1 3.9Å; V3212-F3317 HydrophobicContact CG2-CD2 3.47Å; V3212-F3317 VanDerWaalsContact CG2-CD2 3.47Å; V3212-F3317 HydrophobicContact CG2-CE2 3.68Å; V3212-F3317 HydrophobicContact CG2-CG 4.34Å
3213	C	90	Very high	74.8	Confident	1 Å²	1	84.2 Å²	84.2	1%	0.007	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	121	168.8	-174.4	0	0	0	0	110.1	P3178 A3182 A3224 I3225	P3178-C3213 VanDerWaalsContact CB-SG 3.54Å; A3182-C3213 HydrophobicContact CB-CB 3.94Å; C3213-A3224 WeakPolarHBondContact CA-O 3.37Å; C3213-I3225 HydrophobicContact CB-CG1 4Å
3214	V	89.6	Confident	77.5	Confident	0 Å²	0	78.5 Å²	78.5	0%	0	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	130.2	178.5	-175.1	0	0	0	0	108.8	V3212 V3217 Y3223 A3224 I3237 V3241 L3256 F3317 L3319	V3212-V3214 HydrophobicContact CG2-CG2 4.22Å; V3214-V3217 HydrophobicContact CG1-CG2 4.43Å; V3214-V3217 WeakPolarHBondContact O-CG2 3.19Å; V3214-Y3223 CarbonylContact O-C 3.52Å; V3214-Y3223 WeakPolarHBondContact O-CA 3.2Å; V3214-Y3223 WeakPolarHBondContact O-CB 3.27Å; V3214-A3224 PolarHBondContact N-O 2.85Å; V3214-A3224 PolarHBondContact O-N 3.33Å; V3214-I3237 HydrophobicContact CG2-CG2 3.68Å; V3214-V3241 HydrophobicContact CB-CG2 3.91Å; V3214-V3241 HydrophobicContact CG1-CG2 4.23Å; V3214-V3241 HydrophobicContact CG2-CG2 3.83Å; V3214-L3256 HydrophobicContact CB-CD1 4.42Å; V3214-L3256 HydrophobicContact CG1-CD1 3.62Å; V3214-L3256 HydrophobicContact CG2-CD1 3.88Å; V3214-F3317 WeakPolarHBondContact CA-O 3.24Å; V3214-F3317 HydrophobicContact CG2-CB 4.13Å; V3214-L3319 HydrophobicContact CG1-CB 3.94Å
3215	H	89.1	Confident	79.9	Confident	26 Å²	26	72.6 Å²	72.6	12%	0.12	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	167.1	179.3	-64.9	-125.9	0	0	0	110.5	S3179 D3222 F3317 L3318 L3319	S3179-H3215 PolarHBondContact OG-CD2 2.85Å; S3179-H3215 PolarHBondContact OG-NE2 2.89Å; H3215-D3222 CarbonylContact C-O 3.55Å; H3215-D3222 VanDerWaalsContact CA-O 3.3Å; H3215-D3222 WeakPolarHBondContact CA-O 3.35Å; H3215-F3317 PolarHBondContact CD2-O 3.12Å; H3215-F3317 PolarHBondContact N-O 3.18Å; H3215-L3318 HydrophobicContact CB-CD2 3.86Å; H3215-L3318 HydrophobicContact CB-CG 4.38Å; H3215-L3318 WeakPolarHBondContact O-CA 3.35Å; H3215-L3319 PolarHBondContact O-N 3.14Å
3216	N	86.8	Confident	82.2	Confident	97 Å²	97	61 Å²	61	52%	0.519	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	63.6	45.2	177.4	-162.6	60.2	0	0	0	113.4	D3222 L3318 L3319	N3216-D3222 PolarHBondContact N-O 2.93Å; N3216-L3318 HydrophobicContact CB-CD2 4.18Å; N3216-L3319 PolarHBondContact ND2-O 3.32Å
3217	V	85.1	Confident	83.9	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	-44.6	-168.6	173.8	0	0	0	0	113	V3214 Q3221 A3224 V3241 A3245 R3247	V3214-V3217 HydrophobicContact CG1-CG2 4.43Å; V3214-V3217 WeakPolarHBondContact O-CG2 3.19Å; V3217-Q3221 WeakPolarHBondContact CB-O 3.3Å; V3217-Q3221 PolarHBondContact N-O 2.91Å; V3217-A3224 HydrophobicContact CG1-CB 4.3Å; V3217-A3224 HydrophobicContact CG2-CB 3.92Å; V3217-V3241 HydrophobicContact CB-CG1 4.23Å; V3217-V3241 HydrophobicContact CG1-CG1 3.59Å; V3217-V3241 HydrophobicContact CG2-CG1 3.71Å; V3217-A3245 HydrophobicContact CG1-CB 3.5Å; V3217-A3245 VanDerWaalsContact CG1-CB 3.5Å; V3217-R3247 PolarHBondContact O-NH1 2.92Å
3218	S	82	Confident	85.1	Confident	27 Å²	27	56.1 Å²	56.1	19%	0.189	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	172.2	164.3	63.2	0	0	0	0	109.9	D3220 Q3221	S3218-D3220 PolarHBondContact O-N 3.23Å; S3218-Q3221 PolarHBondContact N-O 3.45Å; S3218-Q3221 VanDerWaalsContact N-O 3.09Å; S3218-Q3221 CarbonylContact O-C 3.46Å; S3218-Q3221 VanDerWaalsContact O-C 3.23Å; S3218-Q3221 PolarHBondContact O-N 3.41Å; S3218-Q3221 VanDerWaalsContact O-O 3.06Å; S3218-Q3221 WeakPolarHBondContact OG-CB 3.2Å; S3218-Q3221 PolarHBondContact OG-N 3.28Å
3219	E	77	Confident	85.8	Confident	203 Å²	203	52.7 Å²	52.7	95%	0.949	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-28.6	175.1	-68.5	168.6	-156.8	0	0	111.8
3220	D	80.4	Confident	85.9	Confident	161 Å²	161	53.5 Å²	53.5	86%	0.861	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.2	-9.9	171.6	-42.6	-80.1	0	0	0	114.1	S3218	S3218-D3220 PolarHBondContact O-N 3.23Å
3221	Q	79.3	Confident	85.9	Confident	59 Å²	59	58.7 Å²	58.7	28%	0.276	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	95	-171.5	-170.1	176.7	-4.2	0	0	112.3	V3217 S3218 Y3223	V3217-Q3221 WeakPolarHBondContact CB-O 3.3Å; V3217-Q3221 PolarHBondContact N-O 2.91Å; S3218-Q3221 PolarHBondContact N-O 3.45Å; S3218-Q3221 VanDerWaalsContact N-O 3.09Å; S3218-Q3221 CarbonylContact O-C 3.46Å; S3218-Q3221 VanDerWaalsContact O-C 3.23Å; S3218-Q3221 PolarHBondContact O-N 3.41Å; S3218-Q3221 VanDerWaalsContact O-O 3.06Å; S3218-Q3221 WeakPolarHBondContact OG-CB 3.2Å; S3218-Q3221 PolarHBondContact OG-N 3.28Å; Q3221-Y3223 VanDerWaalsContact CG-O 3.31Å; Q3221-Y3223 WeakPolarHBondContact CG-O 3.37Å; Q3221-Y3223 PolarHBondContact NE2-O 3.02Å; Q3221-Y3223 PolarHBondContact O-N 3.4Å; Q3221-Y3223 VanDerWaalsContact O-N 3.17Å
3222	D	82.5	Confident	86.1	Confident	131 Å²	131	57.8 Å²	57.8	70%	0.701	29%	0.287	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-49.7	-40.6	175.6	-72.3	-35.3	0	0	0	113.6	H3215 N3216	H3215-D3222 CarbonylContact C-O 3.55Å; H3215-D3222 VanDerWaalsContact CA-O 3.3Å; H3215-D3222 WeakPolarHBondContact CA-O 3.35Å; N3216-D3222 PolarHBondContact N-O 2.93Å
3223	Y	88.5	Confident	86.3	Confident	103 Å²	103	59.4 Å²	59.4	40%	0.404	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	152.8	-176.6	70.2	-87.5	0	0	0	114	P3178 V3214 Q3221 I3225	P3178-Y3223 HydrophobicContact CB-CD2 3.94Å; P3178-Y3223 HydrophobicContact CB-CE2 3.88Å; P3178-Y3223 HydrophobicContact CB-CG 4.37Å; P3178-Y3223 HydrophobicContact CG-CD1 4.13Å; P3178-Y3223 HydrophobicContact CG-CD2 4.18Å; P3178-Y3223 HydrophobicContact CG-CE1 3.9Å; P3178-Y3223 HydrophobicContact CG-CE2 3.95Å; P3178-Y3223 HydrophobicContact CG-CG 4.28Å; V3214-Y3223 CarbonylContact O-C 3.52Å; V3214-Y3223 WeakPolarHBondContact O-CA 3.2Å; V3214-Y3223 WeakPolarHBondContact O-CB 3.27Å; Q3221-Y3223 VanDerWaalsContact CG-O 3.31Å; Q3221-Y3223 WeakPolarHBondContact CG-O 3.37Å; Q3221-Y3223 PolarHBondContact NE2-O 3.02Å; Q3221-Y3223 PolarHBondContact O-N 3.4Å; Q3221-Y3223 VanDerWaalsContact O-N 3.17Å; Y3223-I3225 HydrophobicContact CD2-CG1 4.08Å; Y3223-I3225 HydrophobicContact CE2-CD1 4.07Å; Y3223-I3225 HydrophobicContact CE2-CG1 4.07Å
3224	A	86.5	Confident	86.3	Confident	1 Å²	1	59.5 Å²	59.5	1%	0.008	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	126.1	170	0	0	0	0	0	110.5	C3213 V3214 V3217	C3213-A3224 WeakPolarHBondContact CA-O 3.37Å; V3214-A3224 PolarHBondContact N-O 2.85Å; V3214-A3224 PolarHBondContact O-N 3.33Å; V3217-A3224 HydrophobicContact CG1-CB 4.3Å; V3217-A3224 HydrophobicContact CG2-CB 3.92Å
3225	I	87.9	Confident	86.4	Confident	63 Å²	63	61.9 Å²	61.9	32%	0.323	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	127	165.2	-58.4	174.4	0	0	0	108.1	L3211 V3212 C3213 Y3223 K3244	L3211-I3225 HydrophobicContact CD2-CG2 4.15Å; V3212-I3225 WeakPolarHBondContact O-CA 3.47Å; C3213-I3225 HydrophobicContact CB-CG1 4Å; Y3223-I3225 HydrophobicContact CD2-CG1 4.08Å; Y3223-I3225 HydrophobicContact CE2-CD1 4.07Å; Y3223-I3225 HydrophobicContact CE2-CG1 4.07Å; I3225-K3244 PolarHBondContact O-NZ 3.3Å
3226	L	87.6	Confident	86.5	Confident	11 Å²	11	63.9 Å²	63.9	6%	0.058	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	147.6	175.2	-66.1	173.6	0	0	0	110.5	L3211 V3212 V3228 I3237 Q3240 V3241 K3244	L3211-L3226 WeakPolarHBondContact CA-O 3.29Å; V3212-L3226 HydrophobicContact CG1-CB 3.86Å; V3212-L3226 HydrophobicContact CG1-CD1 4.44Å; V3212-L3226 PolarHBondContact N-O 3.42Å; V3212-L3226 PolarHBondContact O-N 3.05Å; L3226-V3228 HydrophobicContact CB-CG1 3.87Å; L3226-V3228 HydrophobicContact CD1-CG1 4.34Å; L3226-I3237 HydrophobicContact CD1-CG2 4.43Å; L3226-Q3240 HydrophobicContact CD1-CB 3.63Å; L3226-Q3240 HydrophobicContact CD2-CB 4.29Å; L3226-V3241 HydrophobicContact CD1-CG2 3.58Å; L3226-V3241 HydrophobicContact CG-CG2 4.38Å; L3226-K3244 HydrophobicContact CD2-CB 4.17Å; L3226-K3244 HydrophobicContact CD2-CD 3.54Å; L3226-K3244 HydrophobicContact CD2-CG 4.49Å
3227	R	88.5	Confident	86.7	Confident	141 Å²	141	59.3 Å²	59.3	53%	0.532	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	117	164.2	-177.6	178.5	-174.7	166.2	4.2	107.4	T3209 F3210 L3211	T3209-R3227 HydrophobicContact CG2-CG 4.42Å; T3209-R3227 PolarHBondContact OG1-NE 2.93Å; T3209-R3227 PolarHBondContact OG1-NH2 2.72Å; F3210-R3227 WeakPolarHBondContact O-CA 3.42Å; L3211-R3227 HydrophobicContact CD2-CB 4Å; L3211-R3227 HydrophobicContact CD2-CG 4.45Å
3228	V	88.1	Confident	87	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	138.7	-161.3	-87.5	0	0	0	0	111	T3209 F3210 V3212 L3226 I3237	T3209-V3228 CarbonylContact C-O 3.59Å; T3209-V3228 WeakPolarHBondContact CA-O 3.44Å; F3210-V3228 HydrophobicContact CD1-CB 4.37Å; F3210-V3228 HydrophobicContact CD1-CG2 3.72Å; F3210-V3228 WeakPolarHBondContact CD1-O 3.42Å; F3210-V3228 HydrophobicContact CD2-CG2 4.2Å; F3210-V3228 HydrophobicContact CE1-CB 3.99Å; F3210-V3228 HydrophobicContact CE1-CG2 3.43Å; F3210-V3228 VanDerWaalsContact CE1-CG2 3.43Å; F3210-V3228 HydrophobicContact CE2-CG2 3.99Å; F3210-V3228 HydrophobicContact CG-CG2 4.08Å; F3210-V3228 HydrophobicContact CZ-CB 4.46Å; F3210-V3228 HydrophobicContact CZ-CG2 3.59Å; F3210-V3228 PolarHBondContact N-O 2.93Å; F3210-V3228 PolarHBondContact O-N 3.19Å; V3212-V3228 HydrophobicContact CB-CG2 4.26Å; V3212-V3228 HydrophobicContact CG1-CG2 3.7Å; L3226-V3228 HydrophobicContact CB-CG1 3.87Å; L3226-V3228 HydrophobicContact CD1-CG1 4.34Å; V3228-I3237 HydrophobicContact CB-CD1 3.88Å; V3228-I3237 HydrophobicContact CG1-CD1 3.53Å; V3228-I3237 HydrophobicContact CG2-CD1 3.93Å
3229	P	87.8	Confident	87.4	Confident	29 Å²	29	59.7 Å²	59.7	19%	0.188	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.9	142.1	175	-29.4	38.7	0	0	0	112.4	I3208 T3209 F3210 N3231 S3232	I3208-P3229 WeakPolarHBondContact O-CA 3.45Å; T3209-P3229 HydrophobicContact CG2-CG 4.21Å; F3210-P3229 WeakPolarHBondContact CE1-O 3.47Å; P3229-N3231 WeakPolarHBondContact CB-OD1 3.11Å; P3229-N3231 PolarHBondContact O-N 3.44Å; P3229-S3232 VanDerWaalsContact O-CB 3.24Å; P3229-S3232 WeakPolarHBondContact O-CB 3.26Å; P3229-S3232 PolarHBondContact O-N 3.37Å; P3229-S3232 PolarHBondContact O-OG 3.44Å
3230	V	86	Confident	88	Confident	41 Å²	41	53.1 Å²	53.1	25%	0.248	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-14.6	-174.3	-69.4	0	0	0	0	115.3	I3208 F3210 N3303 F3305	I3208-V3230 HydrophobicContact CB-CG1 4.37Å; I3208-V3230 HydrophobicContact CB-CG2 4.09Å; I3208-V3230 HydrophobicContact CG2-CG1 3.8Å; I3208-V3230 HydrophobicContact CG2-CG2 4.29Å; I3208-V3230 PolarHBondContact O-N 3.02Å; F3210-V3230 HydrophobicContact CB-CG1 4.38Å; F3210-V3230 HydrophobicContact CD1-CG1 4.13Å; V3230-N3303 PolarHBondContact O-ND2 2.77Å; V3230-F3305 HydrophobicContact CB-CB 4.42Å; V3230-F3305 HydrophobicContact CB-CD1 3.92Å; V3230-F3305 HydrophobicContact CB-CE1 4.31Å; V3230-F3305 HydrophobicContact CB-CG 4.04Å; V3230-F3305 HydrophobicContact CG1-CD1 4.09Å; V3230-F3305 HydrophobicContact CG1-CD2 3.96Å; V3230-F3305 HydrophobicContact CG1-CE1 4.18Å; V3230-F3305 HydrophobicContact CG1-CE2 4.06Å; V3230-F3305 HydrophobicContact CG1-CG 3.97Å; V3230-F3305 HydrophobicContact CG1-CZ 4.17Å; V3230-F3305 WeakPolarHBondContact O-CB 3.49Å
3231	N	87	Confident	88.4	Confident	113 Å²	113	45.5 Å²	45.5	60%	0.604	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.5	-7.2	171.4	55.9	-22.2	0	0	0	114	P3229 T3233 N3303	P3229-N3231 WeakPolarHBondContact CB-OD1 3.11Å; P3229-N3231 PolarHBondContact O-N 3.44Å; N3231-T3233 PolarHBondContact O-N 2.88Å; N3231-N3303 WeakPolarHBondContact CA-ND2 3.49Å; N3231-N3303 PolarHBondContact O-ND2 3Å
3232	S	89.7	Confident	88.9	Confident	6 Å²	6	43 Å²	43	4%	0.042	22%	0.221	C	C	.	.			trans	-57.1	124.9	-175.6	-57.9	0	0	0	0	113.2	P3229 V3304	P3229-S3232 VanDerWaalsContact O-CB 3.24Å; P3229-S3232 WeakPolarHBondContact O-CB 3.26Å; P3229-S3232 PolarHBondContact O-N 3.37Å; P3229-S3232 PolarHBondContact O-OG 3.44Å; S3232-V3304 PolarHBondContact O-N 2.84Å; S3232-V3304 VanDerWaalsContact O-N 3.11Å
3233	T	92.2	Very high	89.1	Confident	35 Å²	35	43 Å²	43	22%	0.215	22%	0.22	C	C	.	.	B	Isolated β-bridge	trans	-82.5	167	174.6	70.4	0	0	0	0	111.5	N3231 S3235 D3236 I3237 N3300 T3302	N3231-T3233 PolarHBondContact O-N 2.88Å; T3233-S3235 PolarHBondContact O-N 3.47Å; T3233-S3235 PolarHBondContact OG1-N 2.95Å; T3233-D3236 WeakPolarHBondContact CB-OD2 3.28Å; T3233-D3236 PolarHBondContact N-OD2 2.99Å; T3233-D3236 WeakPolarHBondContact O-CB 3.36Å; T3233-D3236 PolarHBondContact O-N 3.41Å; T3233-D3236 VanDerWaalsContact OG1-CG 3.25Å; T3233-D3236 PolarHBondContact OG1-N 3Å; T3233-D3236 PolarHBondContact OG1-OD2 3.03Å; T3233-I3237 WeakPolarHBondContact O-CG1 3.44Å; T3233-I3237 PolarHBondContact O-N 3.42Å; T3233-N3300 VanDerWaalsContact CB-O 3.25Å; T3233-N3300 WeakPolarHBondContact CB-O 3.36Å; T3233-N3300 PolarHBondContact OG1-O 3.44Å; T3233-T3302 CarbonylContact C-O 3.54Å; T3233-T3302 WeakPolarHBondContact CA-O 3.25Å
3234	A	91.5	Very high	88.9	Confident	3 Å²	3	43.4 Å²	43.4	3%	0.025	22%	0.224	C	C	.	.	H	α-helix	trans	-57.9	-33.2	175.2	0	0	0	0	0	112.2	I3237 V3238 L3256 L3298 S3299 N3300 T3302 V3304	A3234-I3237 PolarHBondContact O-N 3.37Å; A3234-V3238 WeakPolarHBondContact O-CB 3.32Å; A3234-V3238 VanDerWaalsContact O-CG2 3.27Å; A3234-V3238 WeakPolarHBondContact O-CG2 3.17Å; A3234-V3238 PolarHBondContact O-N 3.06Å; A3234-L3256 HydrophobicContact CB-CB 4.14Å; A3234-L3256 HydrophobicContact CB-CD2 4.35Å; A3234-L3298 HydrophobicContact CB-CB 4.26Å; A3234-S3299 WeakPolarHBondContact CB-O 3.44Å; A3234-N3300 PolarHBondContact N-O 2.88Å; A3234-N3300 VanDerWaalsContact N-O 3.15Å; A3234-T3302 PolarHBondContact N-O 2.97Å; A3234-V3304 HydrophobicContact CB-CG2 4.1Å
3235	S	90.6	Very high	88.7	Confident	49 Å²	49	44.2 Å²	44.2	34%	0.343	23%	0.231	S	C	.	.	H	α-helix	trans	-63.6	-41.4	173.5	-168.5	0	0	0	0	112.8	T3233 S3239 N3300	T3233-S3235 PolarHBondContact O-N 3.47Å; T3233-S3235 PolarHBondContact OG1-N 2.95Å; S3235-S3239 WeakPolarHBondContact O-CB 3.47Å; S3235-S3239 PolarHBondContact O-N 2.87Å; S3235-S3239 PolarHBondContact O-OG 2.8Å; S3235-N3300 PolarHBondContact N-O 3.22Å
3236	D	91.5	Very high	88.5	Confident	69 Å²	69	52 Å²	52	37%	0.369	26%	0.256	S	S	.	.	H	α-helix	trans	-67.5	-42.8	177.4	-56.3	-52.1	0	0	0	110.9	T3233 S3239 Q3240	T3233-D3236 WeakPolarHBondContact CB-OD2 3.28Å; T3233-D3236 PolarHBondContact N-OD2 2.99Å; T3233-D3236 WeakPolarHBondContact O-CB 3.36Å; T3233-D3236 PolarHBondContact O-N 3.41Å; T3233-D3236 VanDerWaalsContact OG1-CG 3.25Å; T3233-D3236 PolarHBondContact OG1-N 3Å; T3233-D3236 PolarHBondContact OG1-OD2 3.03Å; D3236-S3239 PolarHBondContact O-N 3.29Å; D3236-Q3240 WeakPolarHBondContact O-CB 3.35Å; D3236-Q3240 WeakPolarHBondContact O-CG 3.4Å; D3236-Q3240 PolarHBondContact O-N 2.76Å
3237	I	92.2	Very high	88.1	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-62	-48.8	175.9	-60.4	-46	0	0	0	110.7	F3210 V3212 V3214 L3226 V3228 T3233 A3234 S3239 Q3240 V3241 L3256 V3304	F3210-I3237 HydrophobicContact CZ-CD1 4.48Å; V3212-I3237 HydrophobicContact CG1-CD1 4.07Å; V3212-I3237 HydrophobicContact CG1-CG2 4.23Å; V3214-I3237 HydrophobicContact CG2-CG2 3.68Å; L3226-I3237 HydrophobicContact CD1-CG2 4.43Å; V3228-I3237 HydrophobicContact CB-CD1 3.88Å; V3228-I3237 HydrophobicContact CG1-CD1 3.53Å; V3228-I3237 HydrophobicContact CG2-CD1 3.93Å; T3233-I3237 WeakPolarHBondContact O-CG1 3.44Å; T3233-I3237 PolarHBondContact O-N 3.42Å; A3234-I3237 PolarHBondContact O-N 3.37Å; I3237-S3239 VanDerWaalsContact C-N 3.32Å; I3237-S3239 PolarHBondContact O-N 2.85Å; I3237-Q3240 PolarHBondContact O-N 3.02Å; I3237-V3241 HydrophobicContact CG2-CG2 4.28Å; I3237-V3241 WeakPolarHBondContact O-CB 3.24Å; I3237-V3241 VanDerWaalsContact O-CG2 3.27Å; I3237-V3241 WeakPolarHBondContact O-CG2 3.19Å; I3237-V3241 PolarHBondContact O-N 2.68Å; I3237-L3256 HydrophobicContact CB-CD2 4.22Å; I3237-L3256 HydrophobicContact CG2-CD1 4.24Å; I3237-L3256 HydrophobicContact CG2-CD2 3.93Å; I3237-V3304 HydrophobicContact CB-CG2 4.45Å; I3237-V3304 HydrophobicContact CG1-CB 3.91Å; I3237-V3304 HydrophobicContact CG1-CG1 4.13Å; I3237-V3304 HydrophobicContact CG1-CG2 3.68Å
3238	V	90.7	Very high	87.5	Confident	4 Å²	4	55.2 Å²	55.2	2%	0.024	28%	0.284	C	S	.	.	H	α-helix	trans	-56.1	-47.5	175.8	165.4	0	0	0	0	110.8	A3234 Q3240 V3241 L3242 F3254 L3256 L3319	A3234-V3238 WeakPolarHBondContact O-CB 3.32Å; A3234-V3238 VanDerWaalsContact O-CG2 3.27Å; A3234-V3238 WeakPolarHBondContact O-CG2 3.17Å; A3234-V3238 PolarHBondContact O-N 3.06Å; V3238-Q3240 PolarHBondContact O-N 3.06Å; V3238-V3241 PolarHBondContact O-N 3.02Å; V3238-L3242 HydrophobicContact CG1-CD1 3.98Å; V3238-L3242 WeakPolarHBondContact O-CG 3.35Å; V3238-L3242 PolarHBondContact O-N 3.15Å; V3238-F3254 HydrophobicContact CG1-CB 3.77Å; V3238-L3256 HydrophobicContact CG2-CB 4.15Å; V3238-L3319 HydrophobicContact CB-CD1 4.45Å; V3238-L3319 HydrophobicContact CG1-CD1 4.18Å; V3238-L3319 HydrophobicContact CG2-CD1 3.93Å
3239	S	89.5	Confident	87.2	Confident	32 Å²	32	58.4 Å²	58.4	22%	0.224	30%	0.299	C	S	.	.	H	α-helix	trans	-63.2	-44.2	-179.3	-58	0	0	0	0	112	S3235 D3236 I3237 L3242 I3243 S3251	S3235-S3239 WeakPolarHBondContact O-CB 3.47Å; S3235-S3239 PolarHBondContact O-N 2.87Å; S3235-S3239 PolarHBondContact O-OG 2.8Å; D3236-S3239 PolarHBondContact O-N 3.29Å; I3237-S3239 VanDerWaalsContact C-N 3.32Å; I3237-S3239 PolarHBondContact O-N 2.85Å; S3239-L3242 PolarHBondContact O-N 2.94Å; S3239-I3243 WeakPolarHBondContact O-CD1 3.36Å; S3239-I3243 VanDerWaalsContact O-CG1 3.26Å; S3239-I3243 WeakPolarHBondContact O-CG1 3.34Å; S3239-I3243 PolarHBondContact O-N 2.8Å; S3239-S3251 VanDerWaalsContact OG-CB 3.3Å; S3239-S3251 WeakPolarHBondContact OG-CB 3.46Å; S3239-S3251 PolarHBondContact OG-OG 2.9Å
3240	Q	89.8	Confident	86.8	Confident	65 Å²	65	64 Å²	64	30%	0.304	32%	0.323	S	S	.	.	H	α-helix	trans	-68.7	-33.7	176.4	-71.9	-172.4	40	0	0	113.4	L3226 D3236 I3237 V3238 K3244	L3226-Q3240 HydrophobicContact CD1-CB 3.63Å; L3226-Q3240 HydrophobicContact CD2-CB 4.29Å; D3236-Q3240 WeakPolarHBondContact O-CB 3.35Å; D3236-Q3240 WeakPolarHBondContact O-CG 3.4Å; D3236-Q3240 PolarHBondContact O-N 2.76Å; I3237-Q3240 PolarHBondContact O-N 3.02Å; V3238-Q3240 PolarHBondContact O-N 3.06Å; Q3240-K3244 VanDerWaalsContact O-CB 3.28Å; Q3240-K3244 WeakPolarHBondContact O-CB 3.35Å; Q3240-K3244 PolarHBondContact O-N 3.24Å
3241	V	90.1	Very high	86.5	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-63.5	-47.6	173.8	169.3	0	0	0	0	110.1	V3214 V3217 L3226 I3237 V3238 K3244 A3245 L3319	V3214-V3241 HydrophobicContact CB-CG2 3.91Å; V3214-V3241 HydrophobicContact CG1-CG2 4.23Å; V3214-V3241 HydrophobicContact CG2-CG2 3.83Å; V3217-V3241 HydrophobicContact CB-CG1 4.23Å; V3217-V3241 HydrophobicContact CG1-CG1 3.59Å; V3217-V3241 HydrophobicContact CG2-CG1 3.71Å; L3226-V3241 HydrophobicContact CD1-CG2 3.58Å; L3226-V3241 HydrophobicContact CG-CG2 4.38Å; I3237-V3241 HydrophobicContact CG2-CG2 4.28Å; I3237-V3241 WeakPolarHBondContact O-CB 3.24Å; I3237-V3241 VanDerWaalsContact O-CG2 3.27Å; I3237-V3241 WeakPolarHBondContact O-CG2 3.19Å; I3237-V3241 PolarHBondContact O-N 2.68Å; V3238-V3241 PolarHBondContact O-N 3.02Å; V3241-K3244 PolarHBondContact O-N 2.67Å; V3241-A3245 VanDerWaalsContact O-CB 3.23Å; V3241-A3245 WeakPolarHBondContact O-CB 3.4Å; V3241-A3245 PolarHBondContact O-N 3.28Å; V3241-L3319 HydrophobicContact CG1-CD2 3.92Å
3242	L	88	Confident	86.3	Confident	6 Å²	6	61.7 Å²	61.7	3%	0.031	32%	0.317	C	S	.	.	H	α-helix	trans	-63.8	-43.2	-179.8	-66.5	170.9	0	0	0	112.2	V3238 S3239 A3245 R3246 R3247 F3254 L3319	V3238-L3242 HydrophobicContact CG1-CD1 3.98Å; V3238-L3242 WeakPolarHBondContact O-CG 3.35Å; V3238-L3242 PolarHBondContact O-N 3.15Å; S3239-L3242 PolarHBondContact O-N 2.94Å; L3242-A3245 CarbonylContact O-C 3.58Å; L3242-A3245 PolarHBondContact O-N 2.94Å; L3242-R3246 PolarHBondContact O-N 3.07Å; L3242-R3247 HydrophobicContact CB-CB 4.49Å; L3242-R3247 HydrophobicContact CD2-CB 3.93Å; L3242-R3247 HydrophobicContact CD2-CG 4.43Å; L3242-R3247 PolarHBondContact O-N 3.27Å; L3242-F3254 HydrophobicContact CD1-CD2 3.72Å; L3242-F3254 HydrophobicContact CD1-CE2 4.03Å; L3242-F3254 HydrophobicContact CD1-CG 4.42Å; L3242-F3254 HydrophobicContact CD2-CD2 3.97Å; L3242-F3254 HydrophobicContact CD2-CE1 4.3Å; L3242-F3254 HydrophobicContact CD2-CE2 3.64Å; L3242-F3254 HydrophobicContact CD2-CG 4.44Å; L3242-F3254 HydrophobicContact CD2-CZ 3.8Å; L3242-F3254 HydrophobicContact CG-CD2 4.44Å; L3242-L3319 HydrophobicContact CD2-CD2 4.13Å
3243	I	86.7	Confident	86.1	Confident	133 Å²	133	63 Å²	63	68%	0.682	33%	0.329	S	S	*	.	H	α-helix	trans	-59	-47.9	173.6	-69.5	164.7	0	0	0	110.6	S3239 A3245 R3246	S3239-I3243 WeakPolarHBondContact O-CD1 3.36Å; S3239-I3243 VanDerWaalsContact O-CG1 3.26Å; S3239-I3243 WeakPolarHBondContact O-CG1 3.34Å; S3239-I3243 PolarHBondContact O-N 2.8Å; I3243-A3245 VanDerWaalsContact C-N 3.33Å; I3243-A3245 PolarHBondContact O-N 2.94Å; I3243-R3246 PolarHBondContact O-N 3.3Å; I3243-R3246 VanDerWaalsContact O-N 3.12Å
3244	K	85.4	Confident	86	Confident	110 Å²	110	61.6 Å²	61.6	48%	0.478	32%	0.32	S	S	.	.	H	α-helix	trans	-65.2	-36.1	179.7	-177.1	164.6	-178.4	166.3	0	112.7	I3225 L3226 Q3240 V3241 R3246	I3225-K3244 PolarHBondContact O-NZ 3.3Å; L3226-K3244 HydrophobicContact CD2-CB 4.17Å; L3226-K3244 HydrophobicContact CD2-CD 3.54Å; L3226-K3244 HydrophobicContact CD2-CG 4.49Å; Q3240-K3244 VanDerWaalsContact O-CB 3.28Å; Q3240-K3244 WeakPolarHBondContact O-CB 3.35Å; Q3240-K3244 PolarHBondContact O-N 3.24Å; V3241-K3244 PolarHBondContact O-N 2.67Å; K3244-R3246 PolarHBondContact O-N 3.21Å
3245	A	82.4	Confident	85.9	Confident	19 Å²	19	62.2 Å²	62.2	16%	0.157	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.8	1.7	175.7	0	0	0	0	0	113.8	V3217 V3241 L3242 I3243 R3247	V3217-A3245 HydrophobicContact CG1-CB 3.5Å; V3217-A3245 VanDerWaalsContact CG1-CB 3.5Å; V3241-A3245 VanDerWaalsContact O-CB 3.23Å; V3241-A3245 WeakPolarHBondContact O-CB 3.4Å; V3241-A3245 PolarHBondContact O-N 3.28Å; L3242-A3245 CarbonylContact O-C 3.58Å; L3242-A3245 PolarHBondContact O-N 2.94Å; I3243-A3245 VanDerWaalsContact C-N 3.33Å; I3243-A3245 PolarHBondContact O-N 2.94Å; A3245-R3247 HydrophobicContact CB-CG 3.99Å; A3245-R3247 PolarHBondContact O-N 3.13Å; A3245-R3247 VanDerWaalsContact O-N 3.15Å
3246	R	82.4	Confident	86	Confident	227 Å²	227	60 Å²	60	86%	0.857	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	56	25.4	-177	-54.7	-179.7	176.6	-175.6	-1.9	114.2	L3242 I3243 K3244	L3242-R3246 PolarHBondContact O-N 3.07Å; I3243-R3246 PolarHBondContact O-N 3.3Å; I3243-R3246 VanDerWaalsContact O-N 3.12Å; K3244-R3246 PolarHBondContact O-N 3.21Å
3247	R	79.8	Confident	85.9	Confident	70 Å²	70	56.8 Å²	56.8	26%	0.264	29%	0.29	S	S	.	.			trans	-80.8	126.7	178.6	-63.8	-177.1	74.9	140.2	10.9	109.5	V3217 L3242 A3245 E3249	V3217-R3247 PolarHBondContact O-NH1 2.92Å; L3242-R3247 HydrophobicContact CB-CB 4.49Å; L3242-R3247 HydrophobicContact CD2-CB 3.93Å; L3242-R3247 HydrophobicContact CD2-CG 4.43Å; L3242-R3247 PolarHBondContact O-N 3.27Å; A3245-R3247 HydrophobicContact CB-CG 3.99Å; A3245-R3247 PolarHBondContact O-N 3.13Å; A3245-R3247 VanDerWaalsContact O-N 3.15Å; R3247-E3249 VanDerWaalsContact C-N 3.27Å; R3247-E3249 IonicContact CZ-OE1 3.31Å; R3247-E3249 IonicContact NE-OE1 3.87Å; R3247-E3249 PolarHBondContact NE-OE1 2.67Å; R3247-E3249 IonicContact NH2-OE1 3.25Å; R3247-E3249 PolarHBondContact NH2-OE1 3.13Å; R3247-E3249 PolarHBondContact O-N 3.2Å
3248	T	76.1	Confident	85.9	Confident	149 Å²	149	57.5 Å²	57.5	91%	0.914	29%	0.293	S	S	*	.			trans	-84.8	2.1	178.1	50.3	0	0	0	0	113.8
3249	E	81.8	Confident	85.8	Confident	67 Å²	67	57.8 Å²	57.8	31%	0.313	29%	0.294	S	S	.	.	S	Bend	trans	-70.7	144.2	176.9	-60.1	-170.5	-122.7	0	0	111.5	R3247 F3254 K3321	R3247-E3249 VanDerWaalsContact C-N 3.27Å; R3247-E3249 IonicContact CZ-OE1 3.31Å; R3247-E3249 IonicContact NE-OE1 3.87Å; R3247-E3249 PolarHBondContact NE-OE1 2.67Å; R3247-E3249 IonicContact NH2-OE1 3.25Å; R3247-E3249 PolarHBondContact NH2-OE1 3.13Å; R3247-E3249 PolarHBondContact O-N 3.2Å; E3249-F3254 HydrophobicContact CB-CE2 3.76Å; E3249-F3254 HydrophobicContact CB-CZ 4.37Å; E3249-K3321 IonicContact OE1-NZ 2.86Å; E3249-K3321 PolarHBondContact OE1-NZ 3.17Å; E3249-K3321 VanDerWaalsContact OE2-CE 3.23Å; E3249-K3321 WeakPolarHBondContact OE2-CE 3.24Å; E3249-K3321 IonicContact OE2-NZ 2.9Å; E3249-K3321 PolarHBondContact OE2-NZ 2.75Å
3250	Q	79.5	Confident	85.5	Confident	146 Å²	146	57.5 Å²	57.5	68%	0.682	29%	0.291	S	S	*	.			trans	-64	137.9	178.2	-60.3	-176.7	-3.1	0	0	111.2	S3252 A3253	Q3250-S3252 WeakPolarHBondContact CB-OG 3.04Å; Q3250-S3252 PolarHBondContact O-N 3.19Å; Q3250-S3252 VanDerWaalsContact O-N 3.16Å; Q3250-S3252 PolarHBondContact OE1-OG 2.76Å; Q3250-A3253 VanDerWaalsContact O-CB 3.28Å; Q3250-A3253 WeakPolarHBondContact O-CB 3.41Å; Q3250-A3253 PolarHBondContact O-N 2.81Å
3251	S	80.2	Confident	84.7	Confident	48 Å²	48	56.2 Å²	56.2	34%	0.336	29%	0.286	S	S	.	.	G	3₁₀ helix	trans	-62.1	-22.6	175.3	45.6	0	0	0	0	113.5	S3239 A3253 F3254	S3239-S3251 VanDerWaalsContact OG-CB 3.3Å; S3239-S3251 WeakPolarHBondContact OG-CB 3.46Å; S3239-S3251 PolarHBondContact OG-OG 2.9Å; S3251-A3253 PolarHBondContact O-N 2.76Å; S3251-F3254 PolarHBondContact O-N 2.86Å
3252	S	83.1	Confident	83.3	Confident	57 Å²	57	61.8 Å²	61.8	40%	0.399	31%	0.312	S	S	.	.	G	3₁₀ helix	trans	-61.3	-16.8	168.9	59.8	0	0	0	0	114.7	Q3250 R3322	Q3250-S3252 WeakPolarHBondContact CB-OG 3.04Å; Q3250-S3252 PolarHBondContact O-N 3.19Å; Q3250-S3252 VanDerWaalsContact O-N 3.16Å; Q3250-S3252 PolarHBondContact OE1-OG 2.76Å; S3252-R3322 WeakPolarHBondContact O-CD 3.07Å; S3252-R3322 PolarHBondContact O-NE 3.03Å; S3252-R3322 VanDerWaalsContact O-NE 3.11Å; S3252-R3322 PolarHBondContact O-NH1 2.95Å
3253	A	85.6	Confident	81.6	Confident	35 Å²	35	66.7 Å²	66.7	29%	0.289	34%	0.344	S	S	.	.	G	3₁₀ helix	trans	-84.2	-10.5	178.2	0	0	0	0	0	113.6	Q3250 S3251 K3321 R3322	Q3250-A3253 VanDerWaalsContact O-CB 3.28Å; Q3250-A3253 WeakPolarHBondContact O-CB 3.41Å; Q3250-A3253 PolarHBondContact O-N 2.81Å; S3251-A3253 PolarHBondContact O-N 2.76Å; A3253-K3321 WeakPolarHBondContact O-CA 3.29Å; A3253-R3322 PolarHBondContact O-N 3.17Å
3254	F	89.1	Confident	79.6	Confident	5 Å²	5	66.1 Å²	66.1	2%	0.022	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	165.9	-173.4	-65.1	-96.8	0	0	0	112.7	V3238 L3242 E3249 S3251 L3319 E3320 K3321 R3322	V3238-F3254 HydrophobicContact CG1-CB 3.77Å; L3242-F3254 HydrophobicContact CD1-CD2 3.72Å; L3242-F3254 HydrophobicContact CD1-CE2 4.03Å; L3242-F3254 HydrophobicContact CD1-CG 4.42Å; L3242-F3254 HydrophobicContact CD2-CD2 3.97Å; L3242-F3254 HydrophobicContact CD2-CE1 4.3Å; L3242-F3254 HydrophobicContact CD2-CE2 3.64Å; L3242-F3254 HydrophobicContact CD2-CG 4.44Å; L3242-F3254 HydrophobicContact CD2-CZ 3.8Å; L3242-F3254 HydrophobicContact CG-CD2 4.44Å; E3249-F3254 HydrophobicContact CB-CE2 3.76Å; E3249-F3254 HydrophobicContact CB-CZ 4.37Å; S3251-F3254 PolarHBondContact O-N 2.86Å; F3254-L3319 HydrophobicContact CB-CD1 3.86Å; F3254-L3319 HydrophobicContact CD1-CD1 3.92Å; F3254-L3319 HydrophobicContact CD1-CD2 3.91Å; F3254-L3319 HydrophobicContact CD1-CG 3.68Å; F3254-L3319 HydrophobicContact CE1-CD2 4.01Å; F3254-L3319 HydrophobicContact CE1-CG 4.23Å; F3254-L3319 HydrophobicContact CG-CD1 4.14Å; F3254-L3319 HydrophobicContact CG-CG 4.39Å; F3254-E3320 CarbonylContact C-O 3.59Å; F3254-E3320 VanDerWaalsContact CA-O 3.3Å; F3254-E3320 WeakPolarHBondContact CA-O 3.28Å; F3254-K3321 HydrophobicContact CD1-CG 3.8Å; F3254-K3321 HydrophobicContact CE1-CD 4.27Å; F3254-K3321 HydrophobicContact CE1-CG 3.45Å; F3254-K3321 VanDerWaalsContact CE1-CG 3.45Å; F3254-K3321 HydrophobicContact CZ-CD 4.33Å; F3254-K3321 HydrophobicContact CZ-CG 3.93Å; F3254-R3322 PolarHBondContact O-NE 3.02Å; F3254-R3322 PolarHBondContact O-NH2 3.43Å
3255	V	90.4	Very high	77.6	Confident	16 Å²	16	64.5 Å²	64.5	10%	0.097	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	161.1	164.8	-70.3	0	0	0	0	110.1	V3257 I3297 E3320 R3322 I3325	V3255-V3257 HydrophobicContact CG2-CG2 4.21Å; V3255-I3297 HydrophobicContact CB-CG2 4.19Å; V3255-I3297 HydrophobicContact CG1-CG2 4.37Å; V3255-I3297 HydrophobicContact CG2-CG2 3.99Å; V3255-E3320 PolarHBondContact N-O 3.02Å; V3255-E3320 PolarHBondContact O-N 2.85Å; V3255-E3320 VanDerWaalsContact O-N 3.1Å; V3255-R3322 HydrophobicContact CG1-CG 3.91Å; V3255-I3325 HydrophobicContact CG2-CD1 3.25Å
3256	L	91.6	Very high	75.3	Confident	1 Å²	1	68.6 Å²	68.6	1%	0.005	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	130	169.5	-156.5	68.1	0	0	0	109	V3214 A3234 I3237 V3238 L3298 V3304 F3317 L3318	V3214-L3256 HydrophobicContact CB-CD1 4.42Å; V3214-L3256 HydrophobicContact CG1-CD1 3.62Å; V3214-L3256 HydrophobicContact CG2-CD1 3.88Å; A3234-L3256 HydrophobicContact CB-CB 4.14Å; A3234-L3256 HydrophobicContact CB-CD2 4.35Å; I3237-L3256 HydrophobicContact CB-CD2 4.22Å; I3237-L3256 HydrophobicContact CG2-CD1 4.24Å; I3237-L3256 HydrophobicContact CG2-CD2 3.93Å; V3238-L3256 HydrophobicContact CG2-CB 4.15Å; L3256-L3298 HydrophobicContact CB-CD1 4.24Å; L3256-L3298 HydrophobicContact CD2-CD1 4.08Å; L3256-L3298 HydrophobicContact CG-CD1 4.23Å; L3256-L3298 WeakPolarHBondContact O-CB 3.45Å; L3256-L3298 WeakPolarHBondContact O-CG 3.34Å; L3256-L3298 PolarHBondContact O-N 3.28Å; L3256-V3304 HydrophobicContact CD2-CG1 4.25Å; L3256-V3304 HydrophobicContact CD2-CG2 3.86Å; L3256-F3317 HydrophobicContact CD1-CB 4.05Å; L3256-F3317 HydrophobicContact CD2-CB 4.36Å; L3256-F3317 HydrophobicContact CD2-CD1 3.7Å; L3256-F3317 HydrophobicContact CD2-CE1 4.26Å; L3256-F3317 HydrophobicContact CD2-CG 4.16Å; L3256-F3317 HydrophobicContact CG-CB 4.15Å; L3256-F3317 HydrophobicContact CG-CD1 3.97Å; L3256-F3317 HydrophobicContact CG-CG 4.39Å; L3256-L3318 WeakPolarHBondContact CA-O 3.3Å
3257	V	90.6	Very high	73	Confident	2 Å²	2	66.4 Å²	66.4	1%	0.012	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	125.3	178.5	-179.4	0	0	0	0	108.9	V3255 R3295 R3296 I3297 F3317 L3318 E3320 I3325	V3255-V3257 HydrophobicContact CG2-CG2 4.21Å; V3257-R3295 HydrophobicContact CG1-CB 4.22Å; V3257-R3296 CarbonylContact C-O 3.52Å; V3257-R3296 WeakPolarHBondContact CA-O 3.45Å; V3257-I3297 HydrophobicContact CG2-CG1 4.21Å; V3257-F3317 CarbonylContact O-C 3.48Å; V3257-F3317 WeakPolarHBondContact O-CA 3.32Å; V3257-L3318 HydrophobicContact CB-CB 4.33Å; V3257-L3318 PolarHBondContact N-O 3.12Å; V3257-L3318 PolarHBondContact O-N 3.38Å; V3257-E3320 HydrophobicContact CG2-CB 4.25Å; V3257-E3320 HydrophobicContact CG2-CG 4.26Å; V3257-I3325 HydrophobicContact CG2-CD1 4.42Å
3258	E	91.6	Very high	70.8	Confident	15 Å²	15	70 Å²	70	7%	0.07	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	125.5	168.2	162.8	171.7	-113.2	0	0	108.8	T3260 R3295 R3296 L3298 L3307 W3311	E3258-T3260 HydrophobicContact CG-CG2 3.68Å; E3258-R3295 CarbonylContact O-C 3.59Å; E3258-R3295 WeakPolarHBondContact O-CA 3.43Å; E3258-R3296 HydrophobicContact CB-CB 4.34Å; E3258-R3296 PolarHBondContact N-O 3.22Å; E3258-R3296 PolarHBondContact O-N 3.27Å; E3258-R3296 VanDerWaalsContact OE2-CD 3.24Å; E3258-R3296 WeakPolarHBondContact OE2-CD 3.49Å; E3258-R3296 IonicContact OE2-NH1 2.65Å; E3258-R3296 PolarHBondContact OE2-NH1 3.24Å; E3258-L3298 HydrophobicContact CB-CD1 4.36Å; E3258-L3298 HydrophobicContact CB-CD2 3.92Å; E3258-L3298 HydrophobicContact CB-CG 4.34Å; E3258-L3307 HydrophobicContact CB-CD2 4.15Å; E3258-L3307 VanDerWaalsContact CD-CD2 3.5Å; E3258-L3307 HydrophobicContact CG-CD2 4.35Å; E3258-L3307 VanDerWaalsContact OE1-CD2 3.27Å; E3258-L3307 WeakPolarHBondContact OE1-CD2 3.41Å; E3258-L3307 WeakPolarHBondContact OE1-CG 3.43Å; E3258-W3311 PolarHBondContact OE1-NE1 3.03Å
3259	E	88.5	Confident	68.9	Low	10 Å²	10	69.6 Å²	69.6	5%	0.047	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	119.7	168.5	-178.5	-178.5	107.6	0	0	109	K3293 T3294 R3295 S3315 R3316 L3318	E3259-K3293 HydrophobicContact CG-CB 4.35Å; E3259-K3293 IonicContact OE1-NZ 3.74Å; E3259-K3293 PolarHBondContact OE1-NZ 2.9Å; E3259-T3294 WeakPolarHBondContact CA-O 3.31Å; E3259-R3295 HydrophobicContact CB-CG 4.09Å; E3259-R3295 HydrophobicContact CG-CG 3.95Å; E3259-R3295 IonicContact OE2-CZ 3.33Å; E3259-R3295 IonicContact OE2-NE 3.03Å; E3259-R3295 PolarHBondContact OE2-NE 2.84Å; E3259-R3295 IonicContact OE2-NH2 3.76Å; E3259-S3315 CarbonylContact O-C 3.46Å; E3259-S3315 VanDerWaalsContact O-CA 3.26Å; E3259-S3315 WeakPolarHBondContact O-CA 3.43Å; E3259-R3316 HydrophobicContact CB-CG 4.17Å; E3259-R3316 PolarHBondContact N-O 3.46Å; E3259-R3316 PolarHBondContact O-N 3.02Å; E3259-R3316 IonicContact OE1-CZ 2.58Å; E3259-R3316 VanDerWaalsContact OE1-CZ 3.27Å; E3259-R3316 IonicContact OE1-NE 2.91Å; E3259-R3316 PolarHBondContact OE1-NE 2.91Å; E3259-R3316 IonicContact OE1-NH2 2.59Å; E3259-R3316 PolarHBondContact OE1-NH2 3.22Å; E3259-R3316 IonicContact OE2-NH2 2.72Å; E3259-R3316 PolarHBondContact OE2-NH2 2.89Å; E3259-L3318 HydrophobicContact CB-CD1 3.49Å; E3259-L3318 VanDerWaalsContact CB-CD1 3.49Å; E3259-L3318 HydrophobicContact CG-CD1 4.33Å
3260	T	81.8	Confident	66.6	Low	26 Å²	26	71.8 Å²	71.8	16%	0.16	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	148	178.5	68.4	0	0	0	0	110.4	E3258 T3294 S3315	E3258-T3260 HydrophobicContact CG-CG2 3.68Å; T3260-T3294 PolarHBondContact N-O 2.88Å; T3260-T3294 PolarHBondContact O-N 2.94Å; T3260-T3294 PolarHBondContact O-OG1 3.4Å; T3260-T3294 PolarHBondContact OG1-OG1 2.93Å; T3260-S3315 VanDerWaalsContact CG2-OG 3.31Å; T3260-S3315 WeakPolarHBondContact CG2-OG 3.36Å
3261	E	73.3	Confident	64.5	Low	39 Å²	39	70.5 Å²	70.5	18%	0.182	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	123.8	168.7	-60.4	-167.3	166.8	0	0	109.8	R3291 K3293 T3313 P3314	E3261-R3291 WeakPolarHBondContact OE2-CD 3.07Å; E3261-R3291 IonicContact OE2-CZ 2.7Å; E3261-R3291 IonicContact OE2-NE 2.97Å; E3261-R3291 IonicContact OE2-NH1 3.88Å; E3261-R3291 PolarHBondContact OE2-NH1 3.19Å; E3261-K3293 HydrophobicContact CG-CG 4.23Å; E3261-K3293 WeakPolarHBondContact OE1-CE 3.24Å; E3261-K3293 IonicContact OE1-NZ 3.3Å; E3261-K3293 PolarHBondContact OE1-NZ 3.36Å; E3261-T3313 WeakPolarHBondContact O-CB 3.46Å; E3261-T3313 WeakPolarHBondContact O-CG2 3.4Å; E3261-T3313 PolarHBondContact O-OG1 3.16Å; E3261-P3314 PolarHBondContact N-O 2.85Å; E3261-P3314 VanDerWaalsContact N-O 3.16Å
3262	E	60.7	Low	62.3	Low	117 Å²	117	72.2 Å²	72.2	55%	0.547	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	139.9	172.7	-68.1	-152.5	136.8	0	0	112	V3264 K3292	E3262-V3264 PolarHBondContact O-N 3.19Å; E3262-K3292 PolarHBondContact N-O 2.95Å
3263	P	52.9	Low	59.8	Low	109 Å²	109	73.6 Å²	73.6	71%	0.708	50%	0.496	S	S	*	.	P	Polyproline II helix	trans	-72.6	124.9	173.1	30.4	-33.1	0	0	0	110.3	G3265	P3263-G3265 PolarHBondContact O-N 3.36Å
3264	V	45.1	Very low	57.1	Low	120 Å²	120	75.7 Å²	75.7	73%	0.727	52%	0.521	S	S	*	.	S	Bend	trans	-87.1	100.5	178.1	-177.9	0	0	0	0	109.3	E3262 K3292	E3262-V3264 PolarHBondContact O-N 3.19Å; V3264-K3292 HydrophobicContact CG2-CB 4.19Å
3265	G	42.7	Very low	54.6	Low	76 Å²	76	85.3 Å²	85.3	78%	0.784	56%	0.563	S	S	*	*			trans	136.9	69.6	166.2	0	0	0	0	0	116.6	P3263	P3263-G3265 PolarHBondContact O-N 3.36Å
3266	A	33.4	Very low	51.6	Low	106 Å²	106	89.9 Å²	89.9	88%	0.876	59%	0.591	S	S	*	*			trans	-154.3	103.9	157	0	0	0	0	0	108.5
3267	M	35.8	Very low	48.8	Very low	180 Å²	180	98.4 Å²	98.4	89%	0.887	63%	0.629	S	S	*	*			trans	-132.6	135.4	172.2	-169.6	171.9	-176.5	0	0	108.9
3268	D	33.3	Very low	46.1	Very low	145 Å²	145	105.2 Å²	105.2	78%	0.775	66%	0.663	S	S	*	*			trans	-60.9	133.4	-154.1	-48.7	-71.9	0	0	0	116.2
3269	T	34.8	Very low	43.2	Very low	142 Å²	142	108.8 Å²	108.8	87%	0.871	70%	0.696	S	S	*	*			trans	-139.2	88	156.9	56.4	0	0	0	0	111
3270	S	34.2	Very low	40.6	Very low	112 Å²	112	113.3 Å²	113.3	78%	0.783	73%	0.729	S	S	*	*			trans	-101.3	92.5	176.3	45	0	0	0	0	111.7
3271	S	36.7	Very low	38.3	Very low	120 Å²	120	117.2 Å²	117.2	84%	0.839	76%	0.757	S	S	*	*			trans	-171.5	110.5	159.4	23.5	0	0	0	0	114.9
3272	G	33	Very low	36.4	Very low	84 Å²	84	121.5 Å²	121.5	87%	0.866	79%	0.791	S	S	*	*			trans	79.1	140	139.5	0	0	0	0	0	120.3
3273	G	31.2	Very low	35.1	Very low	85 Å²	85	119.6 Å²	119.6	88%	0.876	80%	0.803	S	S	*	*			trans	88.1	93.9	156.7	0	0	0	0	0	115.9
3274	G	28.6	Very low	34	Very low	79 Å²	79	118.9 Å²	118.9	81%	0.814	81%	0.806	S	S	*	*			trans	-81.6	154.3	173.9	0	0	0	0	0	114
3275	K	35.6	Very low	33.5	Very low	207 Å²	207	120.3 Å²	120.3	90%	0.9	82%	0.816	S	S	*	*			trans	-158.1	151.8	151.7	-112.6	166.5	-173.7	177.3	0	110.5
3276	T	28.5	Very low	33	Very low	112 Å²	112	122.5 Å²	122.5	69%	0.687	82%	0.819	S	S	*	*			trans	-66.1	158.2	173.5	44.4	0	0	0	0	112
3277	F	32	Very low	33.1	Very low	180 Å²	180	122.8 Å²	122.8	79%	0.789	82%	0.815	S	S	*	*				176.5	110.8	122	-94.1	-63.6	0	0	0	114.4
3278	I	33.9	Very low	33.2	Very low	145 Å²	145	124.4 Å²	124.4	74%	0.744	82%	0.817	S	S	*	*				42.7	104.3	127.7	-58.3	-176.9	0	0	0	120.3
3279	A	31.2	Very low	33.5	Very low	91 Å²	91	121.9 Å²	121.9	75%	0.752	82%	0.816	S	S	*	*				72.6	169.7	126.3	0	0	0	0	0	124.7
3280	S	34.4	Very low	33.9	Very low	105 Å²	105	119.8 Å²	119.8	73%	0.734	81%	0.813	S	S	*	*			trans	85.7	78.3	159.9	66	0	0	0	0	121.3
3281	S	32.8	Very low	34.9	Very low	107 Å²	107	122.2 Å²	122.2	75%	0.748	81%	0.805	S	S	*	*				44.8	137.8	116.8	63.4	0	0	0	0	123.4
3282	S	34.3	Very low	36.3	Very low	129 Å²	129	123.7 Å²	123.7	90%	0.902	80%	0.796	S	S	*	*			trans	84.6	155.3	151.9	84.5	0	0	0	0	118.7
3283	G	32.1	Very low	38.3	Very low	78 Å²	78	124.2 Å²	124.2	80%	0.804	77%	0.774	S	S	*	*			trans	119.5	90	175.6	0	0	0	0	0	114.1
3284	A	30.3	Very low	40.7	Very low	93 Å²	93	122.7 Å²	122.7	77%	0.769	75%	0.749	S	S	*	*			trans	-85.4	145.2	175.4	0	0	0	0	0	112.3
3285	T	34.9	Very low	43.4	Very low	151 Å²	151	125 Å²	125	93%	0.926	73%	0.732	S	S	*	*				172.8	162.6	122.6	32.7	0	0	0	0	111.6
3286	S	31.5	Very low	45.9	Very low	122 Å²	122	121.7 Å²	121.7	85%	0.853	71%	0.714	S	S	*	*			trans	-93	128.4	-170.7	59	0	0	0	0	114.3
3287	S	36.1	Very low	48.7	Very low	112 Å²	112	120.2 Å²	120.2	78%	0.783	70%	0.702	S	S	*	*			trans	-127.7	125.3	158.5	61.1	0	0	0	0	110.3	A3289	S3287-A3289 PolarHBondContact O-N 3.47Å
3288	K	37.3	Very low	51.5	Low	214 Å²	214	112 Å²	112	93%	0.93	67%	0.666	S	S	*	*			trans	-70.2	97.1	176.6	-73.6	-179.5	178	176.1	0	110.3	A3290	K3288-A3290 PolarHBondContact O-N 2.66Å
3289	A	39.8	Very low	54	Low	92 Å²	92	108.1 Å²	108.1	76%	0.76	65%	0.652	S	S	*	*			trans	-60.6	122.8	167.3	0	0	0	0	0	109.7	S3287 R3291	S3287-A3289 PolarHBondContact O-N 3.47Å; A3289-R3291 PolarHBondContact O-N 2.88Å; A3289-R3291 VanDerWaalsContact O-N 3.17Å
3290	A	43.3	Very low	56.7	Low	98 Å²	98	107.2 Å²	107.2	81%	0.81	63%	0.634	S	S	*	*			trans	-73.6	107.5	-175.8	0	0	0	0	0	110.7	K3288 K3292	K3288-A3290 PolarHBondContact O-N 2.66Å; A3290-K3292 PolarHBondContact O-N 3.38Å
3291	R	55.2	Low	59.4	Low	163 Å²	163	108.2 Å²	108.2	62%	0.615	63%	0.631	S	S	*	*	P	Polyproline II helix	trans	-64.3	130.8	173.5	-68.9	-177	176.5	178.6	-1.9	110.3	E3261 A3289 K3293	E3261-R3291 WeakPolarHBondContact OE2-CD 3.07Å; E3261-R3291 IonicContact OE2-CZ 2.7Å; E3261-R3291 IonicContact OE2-NE 2.97Å; E3261-R3291 IonicContact OE2-NH1 3.88Å; E3261-R3291 PolarHBondContact OE2-NH1 3.19Å; A3289-R3291 PolarHBondContact O-N 2.88Å; A3289-R3291 VanDerWaalsContact O-N 3.17Å; R3291-K3293 PolarHBondContact O-N 3.28Å
3292	K	66.6	Low	62.1	Low	150 Å²	150	104.3 Å²	104.3	65%	0.652	60%	0.603	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-75.2	119.1	175.3	-167.7	177.8	-179.1	-175.3	0	108.9	E3262 V3264 A3290	E3262-K3292 PolarHBondContact N-O 2.95Å; V3264-K3292 HydrophobicContact CG2-CB 4.19Å; A3290-K3292 PolarHBondContact O-N 3.38Å
3293	K	74.5	Confident	64.7	Low	95 Å²	95	100.6 Å²	100.6	41%	0.413	57%	0.573	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-92	123.8	176	-72.8	177	172.5	-95.8	0	109.8	E3259 E3261 R3291	E3259-K3293 HydrophobicContact CG-CB 4.35Å; E3259-K3293 IonicContact OE1-NZ 3.74Å; E3259-K3293 PolarHBondContact OE1-NZ 2.9Å; E3261-K3293 HydrophobicContact CG-CG 4.23Å; E3261-K3293 WeakPolarHBondContact OE1-CE 3.24Å; E3261-K3293 IonicContact OE1-NZ 3.3Å; E3261-K3293 PolarHBondContact OE1-NZ 3.36Å; R3291-K3293 PolarHBondContact O-N 3.28Å
3294	T	81.3	Confident	67.5	Low	54 Å²	54	96.9 Å²	96.9	33%	0.331	54%	0.535	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	126.8	174.4	24.1	0	0	0	0	109.1	E3259 T3260	E3259-T3294 WeakPolarHBondContact CA-O 3.31Å; T3260-T3294 PolarHBondContact N-O 2.88Å; T3260-T3294 PolarHBondContact O-N 2.94Å; T3260-T3294 PolarHBondContact O-OG1 3.4Å; T3260-T3294 PolarHBondContact OG1-OG1 2.93Å
3295	R	86.4	Confident	70.2	Confident	126 Å²	126	95 Å²	95	48%	0.475	51%	0.509	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	130.6	-178	-75.9	171.3	132.7	-118.7	-0	110.1	V3257 E3258 E3259 E3320	V3257-R3295 HydrophobicContact CG1-CB 4.22Å; E3258-R3295 CarbonylContact O-C 3.59Å; E3258-R3295 WeakPolarHBondContact O-CA 3.43Å; E3259-R3295 HydrophobicContact CB-CG 4.09Å; E3259-R3295 HydrophobicContact CG-CG 3.95Å; E3259-R3295 IonicContact OE2-CZ 3.33Å; E3259-R3295 IonicContact OE2-NE 3.03Å; E3259-R3295 PolarHBondContact OE2-NE 2.84Å; E3259-R3295 IonicContact OE2-NH2 3.76Å; R3295-E3320 IonicContact CZ-OE1 2.82Å; R3295-E3320 IonicContact NH1-OE1 2.74Å; R3295-E3320 PolarHBondContact NH1-OE1 3.11Å; R3295-E3320 IonicContact NH1-OE2 3.43Å; R3295-E3320 PolarHBondContact NH1-OE2 3.08Å; R3295-E3320 IonicContact NH2-OE1 2.7Å; R3295-E3320 PolarHBondContact NH2-OE1 3.21Å
3296	R	87.6	Confident	72.6	Confident	138 Å²	138	90.6 Å²	90.6	52%	0.521	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	118.1	-176.8	-178	-167.1	-178.2	-170.9	1	110	V3257 E3258 L3298	V3257-R3296 CarbonylContact C-O 3.52Å; V3257-R3296 WeakPolarHBondContact CA-O 3.45Å; E3258-R3296 HydrophobicContact CB-CB 4.34Å; E3258-R3296 PolarHBondContact N-O 3.22Å; E3258-R3296 PolarHBondContact O-N 3.27Å; E3258-R3296 VanDerWaalsContact OE2-CD 3.24Å; E3258-R3296 WeakPolarHBondContact OE2-CD 3.49Å; E3258-R3296 IonicContact OE2-NH1 2.65Å; E3258-R3296 PolarHBondContact OE2-NH1 3.24Å; R3296-L3298 HydrophobicContact CG-CD2 4.4Å
3297	I	88.4	Confident	75.2	Confident	82 Å²	82	86.1 Å²	86.1	42%	0.421	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	131.5	171.1	-56.9	158.9	0	0	0	108.1	V3255 V3257 I3325	V3255-I3297 HydrophobicContact CB-CG2 4.19Å; V3255-I3297 HydrophobicContact CG1-CG2 4.37Å; V3255-I3297 HydrophobicContact CG2-CG2 3.99Å; V3257-I3297 HydrophobicContact CG2-CG1 4.21Å; I3297-I3325 HydrophobicContact CD1-CD1 4.29Å; I3297-I3325 HydrophobicContact CD1-CG2 3.59Å; I3297-I3325 HydrophobicContact CG1-CD1 4.33Å
3298	L	89.1	Confident	77.6	Confident	7 Å²	7	80.9 Å²	80.9	4%	0.037	42%	0.418	C	S	.	.	P	Polyproline II helix	trans	-90.8	144.3	179.6	-53.8	179	0	0	0	110.2	A3234 L3256 E3258 R3296 T3302 L3307 F3317	A3234-L3298 HydrophobicContact CB-CB 4.26Å; L3256-L3298 HydrophobicContact CB-CD1 4.24Å; L3256-L3298 HydrophobicContact CD2-CD1 4.08Å; L3256-L3298 HydrophobicContact CG-CD1 4.23Å; L3256-L3298 WeakPolarHBondContact O-CB 3.45Å; L3256-L3298 WeakPolarHBondContact O-CG 3.34Å; L3256-L3298 PolarHBondContact O-N 3.28Å; E3258-L3298 HydrophobicContact CB-CD1 4.36Å; E3258-L3298 HydrophobicContact CB-CD2 3.92Å; E3258-L3298 HydrophobicContact CB-CG 4.34Å; R3296-L3298 HydrophobicContact CG-CD2 4.4Å; L3298-T3302 HydrophobicContact CB-CG2 4.33Å; L3298-T3302 HydrophobicContact CD2-CG2 4.37Å; L3298-L3307 HydrophobicContact CD1-CD2 3.71Å; L3298-L3307 HydrophobicContact CD2-CD2 3.57Å; L3298-L3307 HydrophobicContact CG-CD2 4.31Å; L3298-F3317 HydrophobicContact CD1-CD1 3.94Å; L3298-F3317 HydrophobicContact CD1-CE1 3.77Å
3299	S	88	Confident	79.5	Confident	64 Å²	64	72.8 Å²	72.8	45%	0.448	38%	0.384	S	S	.	.	P	Polyproline II helix	trans	-67.9	152.6	169.9	68.3	0	0	0	0	109.6	A3234 D3301 T3302	A3234-S3299 WeakPolarHBondContact CB-O 3.44Å; S3299-D3301 PolarHBondContact O-N 2.87Å; S3299-D3301 VanDerWaalsContact O-N 3.08Å; S3299-T3302 PolarHBondContact N-OG1 3.36Å; S3299-T3302 VanDerWaalsContact O-CB 3.3Å; S3299-T3302 WeakPolarHBondContact O-CB 3.4Å; S3299-T3302 PolarHBondContact O-N 3.26Å; S3299-T3302 PolarHBondContact O-OG1 3.35Å; S3299-T3302 PolarHBondContact OG-N 3.43Å; S3299-T3302 PolarHBondContact OG-OG1 2.72Å
3300	N	88	Confident	81.3	Confident	71 Å²	71	70.9 Å²	70.9	38%	0.38	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.7	-38.8	178.9	-59.8	-37.7	0	0	0	111.5	T3233 A3234 S3235 R3322	T3233-N3300 VanDerWaalsContact CB-O 3.25Å; T3233-N3300 WeakPolarHBondContact CB-O 3.36Å; T3233-N3300 PolarHBondContact OG1-O 3.44Å; A3234-N3300 PolarHBondContact N-O 2.88Å; A3234-N3300 VanDerWaalsContact N-O 3.15Å; S3235-N3300 PolarHBondContact N-O 3.22Å; N3300-R3322 PolarHBondContact OD1-NH2 3.28Å
3301	D	89.5	Confident	82.9	Confident	126 Å²	126	67 Å²	67	67%	0.674	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.2	-1.8	-174.5	-31.4	-86.6	0	0	0	113.6	S3299 N3303	S3299-D3301 PolarHBondContact O-N 2.87Å; S3299-D3301 VanDerWaalsContact O-N 3.08Å; D3301-N3303 PolarHBondContact O-N 2.97Å; D3301-N3303 VanDerWaalsContact O-N 3.14Å
3302	T	90	Very high	83.6	Confident	26 Å²	26	67.4 Å²	67.4	16%	0.16	34%	0.343	C	S	.	.			trans	-62.7	117.3	178.2	-69.1	0	0	0	0	109.5	T3233 A3234 L3298 S3299 V3304	T3233-T3302 CarbonylContact C-O 3.54Å; T3233-T3302 WeakPolarHBondContact CA-O 3.25Å; A3234-T3302 PolarHBondContact N-O 2.97Å; L3298-T3302 HydrophobicContact CB-CG2 4.33Å; L3298-T3302 HydrophobicContact CD2-CG2 4.37Å; S3299-T3302 PolarHBondContact N-OG1 3.36Å; S3299-T3302 VanDerWaalsContact O-CB 3.3Å; S3299-T3302 WeakPolarHBondContact O-CB 3.4Å; S3299-T3302 PolarHBondContact O-N 3.26Å; S3299-T3302 PolarHBondContact O-OG1 3.35Å; S3299-T3302 PolarHBondContact OG-N 3.43Å; S3299-T3302 PolarHBondContact OG-OG1 2.72Å; T3302-V3304 PolarHBondContact O-N 2.7Å
3303	N	90.1	Very high	83.7	Confident	50 Å²	50	62.5 Å²	62.5	27%	0.267	33%	0.326	S	S	.	.	B	Isolated β-bridge	trans	-66.1	117	173.4	-179.5	-81.4	0	0	0	110.2	V3230 N3231 D3301 F3305 A3306 L3307	V3230-N3303 PolarHBondContact O-ND2 2.77Å; N3231-N3303 WeakPolarHBondContact CA-ND2 3.49Å; N3231-N3303 PolarHBondContact O-ND2 3Å; D3301-N3303 PolarHBondContact O-N 2.97Å; D3301-N3303 VanDerWaalsContact O-N 3.14Å; N3303-F3305 WeakPolarHBondContact OD1-CB 3.34Å; N3303-F3305 PolarHBondContact OD1-N 3.23Å; N3303-A3306 HydrophobicContact CB-CB 4.33Å; N3303-A3306 WeakPolarHBondContact OD1-CB 3.29Å; N3303-A3306 PolarHBondContact OD1-N 3.27Å; N3303-L3307 PolarHBondContact O-N 2.95Å
3304	V	89.8	Confident	83.5	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-77.7	-29.2	-170	179.2	0	0	0	0	111.9	F3210 V3212 S3232 A3234 I3237 L3256 T3302 L3307 Q3308 F3317	F3210-V3304 HydrophobicContact CE2-CG1 4.3Å; F3210-V3304 HydrophobicContact CZ-CB 4.15Å; F3210-V3304 HydrophobicContact CZ-CG1 4.25Å; V3212-V3304 HydrophobicContact CG2-CG1 3.9Å; S3232-V3304 PolarHBondContact O-N 2.84Å; S3232-V3304 VanDerWaalsContact O-N 3.11Å; A3234-V3304 HydrophobicContact CB-CG2 4.1Å; I3237-V3304 HydrophobicContact CB-CG2 4.45Å; I3237-V3304 HydrophobicContact CG1-CB 3.91Å; I3237-V3304 HydrophobicContact CG1-CG1 4.13Å; I3237-V3304 HydrophobicContact CG1-CG2 3.68Å; L3256-V3304 HydrophobicContact CD2-CG1 4.25Å; L3256-V3304 HydrophobicContact CD2-CG2 3.86Å; T3302-V3304 PolarHBondContact O-N 2.7Å; V3304-L3307 PolarHBondContact O-N 3.3Å; V3304-Q3308 VanDerWaalsContact O-CB 3.29Å; V3304-Q3308 WeakPolarHBondContact O-CB 3.38Å; V3304-Q3308 PolarHBondContact O-N 2.97Å; V3304-F3317 HydrophobicContact CG1-CD1 4.45Å; V3304-F3317 HydrophobicContact CG1-CD2 4.42Å; V3304-F3317 HydrophobicContact CG1-CE1 3.81Å; V3304-F3317 HydrophobicContact CG1-CE2 3.79Å; V3304-F3317 HydrophobicContact CG1-CZ 3.46Å; V3304-F3317 VanDerWaalsContact CG1-CZ 3.46Å
3305	F	87.3	Confident	83.5	Confident	53 Å²	53	59.1 Å²	59.1	23%	0.232	32%	0.315	C	S	.	.	H	α-helix	trans	-62.9	-50.9	174.3	173	-111.1	0	0	0	111.7	T3186 F3210 V3230 N3303 L3307 Q3308 M3309	T3186-F3305 HydrophobicContact CG2-CD2 4.38Å; T3186-F3305 HydrophobicContact CG2-CE2 3.93Å; F3210-F3305 HydrophobicContact CB-CD2 3.73Å; F3210-F3305 HydrophobicContact CB-CE2 4.17Å; F3210-F3305 HydrophobicContact CD1-CB 3.87Å; F3210-F3305 HydrophobicContact CD1-CD2 4.05Å; F3210-F3305 HydrophobicContact CD1-CG 4.29Å; F3210-F3305 HydrophobicContact CD2-CB 4.28Å; F3210-F3305 HydrophobicContact CD2-CD2 4.02Å; F3210-F3305 HydrophobicContact CE1-CB 3.69Å; F3210-F3305 HydrophobicContact CE2-CB 4.08Å; F3210-F3305 HydrophobicContact CG-CB 4.18Å; F3210-F3305 AromaticContact CG-CD2 3.7Å; F3210-F3305 HydrophobicContact CG-CD2 3.7Å; F3210-F3305 HydrophobicContact CG-CG 4.35Å; F3210-F3305 HydrophobicContact CZ-CB 3.81Å; V3230-F3305 HydrophobicContact CB-CB 4.42Å; V3230-F3305 HydrophobicContact CB-CD1 3.92Å; V3230-F3305 HydrophobicContact CB-CE1 4.31Å; V3230-F3305 HydrophobicContact CB-CG 4.04Å; V3230-F3305 HydrophobicContact CG1-CD1 4.09Å; V3230-F3305 HydrophobicContact CG1-CD2 3.96Å; V3230-F3305 HydrophobicContact CG1-CE1 4.18Å; V3230-F3305 HydrophobicContact CG1-CE2 4.06Å; V3230-F3305 HydrophobicContact CG1-CG 3.97Å; V3230-F3305 HydrophobicContact CG1-CZ 4.17Å; V3230-F3305 WeakPolarHBondContact O-CB 3.49Å; N3303-F3305 WeakPolarHBondContact OD1-CB 3.34Å; N3303-F3305 PolarHBondContact OD1-N 3.23Å; F3305-L3307 VanDerWaalsContact C-N 3.29Å; F3305-L3307 PolarHBondContact O-N 3.35Å; F3305-Q3308 PolarHBondContact O-N 3.27Å; F3305-M3309 HydrophobicContact CD2-CG 3.96Å; F3305-M3309 HydrophobicContact CE1-CG 4.32Å; F3305-M3309 HydrophobicContact CE2-CG 3.6Å; F3305-M3309 HydrophobicContact CE2-SD 3.99Å; F3305-M3309 HydrophobicContact CG-CG 4.46Å; F3305-M3309 HydrophobicContact CZ-CG 3.81Å; F3305-M3309 HydrophobicContact CZ-SD 4.38Å; F3305-M3309 WeakPolarHBondContact O-CB 3.47Å; F3305-M3309 VanDerWaalsContact O-CG 3.27Å; F3305-M3309 WeakPolarHBondContact O-CG 3.33Å; F3305-M3309 PolarHBondContact O-N 2.85Å
3306	A	84.7	Confident	83.6	Confident	59 Å²	59	56.8 Å²	56.8	49%	0.488	31%	0.306	S	S	.	.	H	α-helix	trans	-58.8	-41.3	178.6	0	0	0	0	0	111.8	N3303 G3310	N3303-A3306 HydrophobicContact CB-CB 4.33Å; N3303-A3306 WeakPolarHBondContact OD1-CB 3.29Å; N3303-A3306 PolarHBondContact OD1-N 3.27Å; A3306-G3310 PolarHBondContact O-N 3.45Å; A3306-G3310 VanDerWaalsContact O-N 3.1Å
3307	L	86.5	Confident	83.8	Confident	28 Å²	28	50.2 Å²	50.2	15%	0.147	28%	0.281	C	S	.	.	H	α-helix	trans	-65.3	-49.3	176.4	-159.4	82.8	0	0	0	112	E3258 L3298 N3303 V3304 F3305 M3309 G3310 W3311 F3317	E3258-L3307 HydrophobicContact CB-CD2 4.15Å; E3258-L3307 VanDerWaalsContact CD-CD2 3.5Å; E3258-L3307 HydrophobicContact CG-CD2 4.35Å; E3258-L3307 VanDerWaalsContact OE1-CD2 3.27Å; E3258-L3307 WeakPolarHBondContact OE1-CD2 3.41Å; E3258-L3307 WeakPolarHBondContact OE1-CG 3.43Å; L3298-L3307 HydrophobicContact CD1-CD2 3.71Å; L3298-L3307 HydrophobicContact CD2-CD2 3.57Å; L3298-L3307 HydrophobicContact CG-CD2 4.31Å; N3303-L3307 PolarHBondContact O-N 2.95Å; V3304-L3307 PolarHBondContact O-N 3.3Å; F3305-L3307 VanDerWaalsContact C-N 3.29Å; F3305-L3307 PolarHBondContact O-N 3.35Å; L3307-M3309 VanDerWaalsContact C-N 3.29Å; L3307-M3309 PolarHBondContact O-N 2.97Å; L3307-G3310 PolarHBondContact O-N 2.96Å; L3307-W3311 VanDerWaalsContact O-CD1 3.32Å; L3307-W3311 PolarHBondContact O-N 2.9Å; L3307-F3317 HydrophobicContact CD2-CE1 3.73Å; L3307-F3317 HydrophobicContact CD2-CZ 4.23Å
3308	Q	85.6	Confident	83.9	Confident	3 Å²	3	46.7 Å²	46.7	1%	0.014	26%	0.263	C	S	.	.	H	α-helix	trans	-62.3	-35.7	-179.9	-163.4	-176.4	-24.3	0	0	111.8	W3183 F3210 L3211 V3304 F3305 W3311 F3317	W3183-Q3308 PolarHBondContact NE1-O 3.45Å; F3210-Q3308 VanDerWaalsContact CE2-OE1 3.31Å; L3211-Q3308 PolarHBondContact O-NE2 2.75Å; L3211-Q3308 PolarHBondContact O-OE1 2.94Å; V3304-Q3308 VanDerWaalsContact O-CB 3.29Å; V3304-Q3308 WeakPolarHBondContact O-CB 3.38Å; V3304-Q3308 PolarHBondContact O-N 2.97Å; F3305-Q3308 PolarHBondContact O-N 3.27Å; Q3308-W3311 HydrophobicContact CG-CD2 4.3Å; Q3308-W3311 HydrophobicContact CG-CE3 3.84Å; Q3308-W3311 HydrophobicContact CG-CH2 3.98Å; Q3308-W3311 HydrophobicContact CG-CZ2 4.4Å; Q3308-W3311 HydrophobicContact CG-CZ3 3.68Å; Q3308-F3317 HydrophobicContact CB-CE2 3.96Å; Q3308-F3317 HydrophobicContact CB-CZ 4.03Å; Q3308-F3317 HydrophobicContact CG-CE2 3.91Å; Q3308-F3317 HydrophobicContact CG-CZ 4.45Å
3309	M	78.5	Confident	84	Confident	44 Å²	44	46.5 Å²	46.5	22%	0.217	26%	0.262	C	S	.	.	H	α-helix	trans	-70.8	-29.8	174.8	-69.5	-62.1	-66.8	0	0	113	R3146 T3186 I3187 F3305 L3307 W3311	R3146-M3309 PolarHBondContact NH1-O 2.91Å; T3186-M3309 HydrophobicContact CG2-SD 4.23Å; I3187-M3309 HydrophobicContact CG1-CE 4.14Å; I3187-M3309 HydrophobicContact CG1-SD 4.11Å; F3305-M3309 HydrophobicContact CD2-CG 3.96Å; F3305-M3309 HydrophobicContact CE1-CG 4.32Å; F3305-M3309 HydrophobicContact CE2-CG 3.6Å; F3305-M3309 HydrophobicContact CE2-SD 3.99Å; F3305-M3309 HydrophobicContact CG-CG 4.46Å; F3305-M3309 HydrophobicContact CZ-CG 3.81Å; F3305-M3309 HydrophobicContact CZ-SD 4.38Å; F3305-M3309 WeakPolarHBondContact O-CB 3.47Å; F3305-M3309 VanDerWaalsContact O-CG 3.27Å; F3305-M3309 WeakPolarHBondContact O-CG 3.33Å; F3305-M3309 PolarHBondContact O-N 2.85Å; L3307-M3309 VanDerWaalsContact C-N 3.29Å; L3307-M3309 PolarHBondContact O-N 2.97Å; M3309-W3311 VanDerWaalsContact C-N 3.27Å; M3309-W3311 PolarHBondContact O-N 2.85Å
3310	G	76.8	Confident	84	Confident	51 Å²	51	45.1 Å²	45.1	53%	0.526	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-9	177.8	0	0	0	0	0	115.4	A3306 L3307	A3306-G3310 PolarHBondContact O-N 3.45Å; A3306-G3310 VanDerWaalsContact O-N 3.1Å; L3307-G3310 PolarHBondContact O-N 2.96Å
3311	W	77.4	Confident	83.9	Confident	16 Å²	16	44.8 Å²	44.8	6%	0.061	24%	0.244	C	C	.	.			trans	-59	138.6	-179.6	-69.1	-14	0	0	0	113	R3146 E3258 L3307 Q3308 M3309 S3315 F3317	R3146-W3311 PolarHBondContact NH1-O 3.33Å; E3258-W3311 PolarHBondContact OE1-NE1 3.03Å; L3307-W3311 VanDerWaalsContact O-CD1 3.32Å; L3307-W3311 PolarHBondContact O-N 2.9Å; Q3308-W3311 HydrophobicContact CG-CD2 4.3Å; Q3308-W3311 HydrophobicContact CG-CE3 3.84Å; Q3308-W3311 HydrophobicContact CG-CH2 3.98Å; Q3308-W3311 HydrophobicContact CG-CZ2 4.4Å; Q3308-W3311 HydrophobicContact CG-CZ3 3.68Å; M3309-W3311 VanDerWaalsContact C-N 3.27Å; M3309-W3311 PolarHBondContact O-N 2.85Å; W3311-S3315 VanDerWaalsContact CD2-CB 3.43Å; W3311-S3315 VanDerWaalsContact CE2-CB 3.41Å; W3311-S3315 WeakPolarHBondContact CH2-O 3.42Å; W3311-S3315 VanDerWaalsContact CZ3-O 3.27Å; W3311-S3315 WeakPolarHBondContact CZ3-O 3.4Å; W3311-F3317 AromaticContact CH2-CD2 3.65Å; W3311-F3317 HydrophobicContact CH2-CD2 3.65Å; W3311-F3317 AromaticContact CH2-CE2 3.37Å; W3311-F3317 HydrophobicContact CH2-CE2 3.37Å; W3311-F3317 HydrophobicContact CH2-CG 4.46Å; W3311-F3317 AromaticContact CH2-CZ 3.99Å; W3311-F3317 HydrophobicContact CH2-CZ 3.99Å; W3311-F3317 HydrophobicContact CZ2-CD1 4.46Å; W3311-F3317 AromaticContact CZ2-CD2 3.86Å; W3311-F3317 HydrophobicContact CZ2-CD2 3.86Å; W3311-F3317 HydrophobicContact CZ2-CE1 4.05Å; W3311-F3317 AromaticContact CZ2-CE2 3.37Å; W3311-F3317 HydrophobicContact CZ2-CE2 3.37Å; W3311-F3317 HydrophobicContact CZ2-CG 4.37Å; W3311-F3317 AromaticContact CZ2-CZ 3.46Å; W3311-F3317 HydrophobicContact CZ2-CZ 3.46Å; W3311-F3317 VanDerWaalsContact CZ2-CZ 3.46Å; W3311-F3317 HydrophobicContact CZ3-CE2 4.41Å
3312	K	68.7	Low	83.6	Confident	172 Å²	172	42.9 Å²	42.9	75%	0.748	23%	0.227	S	C	*	.			trans	-115.4	-27.9	178.1	-66.2	-177.8	179.7	178.5	0	112.9
3313	T	68.8	Low	82.9	Confident	47 Å²	47	45.6 Å²	45.6	29%	0.288	24%	0.244	S	C	.	.	S	Bend	trans	-123.6	171.2	180	57	0	0	0	0	110	E3261 S3315	E3261-T3313 WeakPolarHBondContact O-CB 3.46Å; E3261-T3313 WeakPolarHBondContact O-CG2 3.4Å; E3261-T3313 PolarHBondContact O-OG1 3.16Å; T3313-S3315 PolarHBondContact O-N 3.26Å; T3313-S3315 PolarHBondContact O-OG 3.05Å
3314	P	71.5	Confident	82	Confident	69 Å²	69	47.7 Å²	47.7	45%	0.448	26%	0.255	S	S	.	.			trans	-59.6	124.8	173.4	-24	35.8	0	0	0	111.3	E3261	E3261-P3314 PolarHBondContact N-O 2.85Å; E3261-P3314 VanDerWaalsContact N-O 3.16Å
3315	S	81.7	Confident	80.9	Confident	9 Å²	9	48.7 Å²	48.7	6%	0.063	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	154.3	-171.9	-63.4	0	0	0	0	110.7	E3259 T3260 W3311 T3313	E3259-S3315 CarbonylContact O-C 3.46Å; E3259-S3315 VanDerWaalsContact O-CA 3.26Å; E3259-S3315 WeakPolarHBondContact O-CA 3.43Å; T3260-S3315 VanDerWaalsContact CG2-OG 3.31Å; T3260-S3315 WeakPolarHBondContact CG2-OG 3.36Å; W3311-S3315 VanDerWaalsContact CD2-CB 3.43Å; W3311-S3315 VanDerWaalsContact CE2-CB 3.41Å; W3311-S3315 WeakPolarHBondContact CH2-O 3.42Å; W3311-S3315 VanDerWaalsContact CZ3-O 3.27Å; W3311-S3315 WeakPolarHBondContact CZ3-O 3.4Å; T3313-S3315 PolarHBondContact O-N 3.26Å; T3313-S3315 PolarHBondContact O-OG 3.05Å
3316	R	88.3	Confident	79.4	Confident	77 Å²	77	51 Å²	51	29%	0.291	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	152.9	179.8	61.2	-178.1	-178.7	149	3.5	112.4	E3259	E3259-R3316 HydrophobicContact CB-CG 4.17Å; E3259-R3316 PolarHBondContact N-O 3.46Å; E3259-R3316 PolarHBondContact O-N 3.02Å; E3259-R3316 IonicContact OE1-CZ 2.58Å; E3259-R3316 VanDerWaalsContact OE1-CZ 3.27Å; E3259-R3316 IonicContact OE1-NE 2.91Å; E3259-R3316 PolarHBondContact OE1-NE 2.91Å; E3259-R3316 IonicContact OE1-NH2 2.59Å; E3259-R3316 PolarHBondContact OE1-NH2 3.22Å; E3259-R3316 IonicContact OE2-NH2 2.72Å; E3259-R3316 PolarHBondContact OE2-NH2 2.89Å
3317	F	92.1	Very high	77.9	Confident	1 Å²	1	54.4 Å²	54.4	0%	0.004	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	141.5	168	-61.5	-75.9	0	0	0	110.1	V3212 V3214 H3215 L3256 V3257 L3298 V3304 L3307 Q3308 W3311	V3212-F3317 HydrophobicContact CG2-CD2 3.47Å; V3212-F3317 VanDerWaalsContact CG2-CD2 3.47Å; V3212-F3317 HydrophobicContact CG2-CE2 3.68Å; V3212-F3317 HydrophobicContact CG2-CG 4.34Å; V3214-F3317 WeakPolarHBondContact CA-O 3.24Å; V3214-F3317 HydrophobicContact CG2-CB 4.13Å; H3215-F3317 PolarHBondContact CD2-O 3.12Å; H3215-F3317 PolarHBondContact N-O 3.18Å; L3256-F3317 HydrophobicContact CD1-CB 4.05Å; L3256-F3317 HydrophobicContact CD2-CB 4.36Å; L3256-F3317 HydrophobicContact CD2-CD1 3.7Å; L3256-F3317 HydrophobicContact CD2-CE1 4.26Å; L3256-F3317 HydrophobicContact CD2-CG 4.16Å; L3256-F3317 HydrophobicContact CG-CB 4.15Å; L3256-F3317 HydrophobicContact CG-CD1 3.97Å; L3256-F3317 HydrophobicContact CG-CG 4.39Å; V3257-F3317 CarbonylContact O-C 3.48Å; V3257-F3317 WeakPolarHBondContact O-CA 3.32Å; L3298-F3317 HydrophobicContact CD1-CD1 3.94Å; L3298-F3317 HydrophobicContact CD1-CE1 3.77Å; V3304-F3317 HydrophobicContact CG1-CD1 4.45Å; V3304-F3317 HydrophobicContact CG1-CD2 4.42Å; V3304-F3317 HydrophobicContact CG1-CE1 3.81Å; V3304-F3317 HydrophobicContact CG1-CE2 3.79Å; V3304-F3317 HydrophobicContact CG1-CZ 3.46Å; V3304-F3317 VanDerWaalsContact CG1-CZ 3.46Å; L3307-F3317 HydrophobicContact CD2-CE1 3.73Å; L3307-F3317 HydrophobicContact CD2-CZ 4.23Å; Q3308-F3317 HydrophobicContact CB-CE2 3.96Å; Q3308-F3317 HydrophobicContact CB-CZ 4.03Å; Q3308-F3317 HydrophobicContact CG-CE2 3.91Å; Q3308-F3317 HydrophobicContact CG-CZ 4.45Å; W3311-F3317 AromaticContact CH2-CD2 3.65Å; W3311-F3317 HydrophobicContact CH2-CD2 3.65Å; W3311-F3317 AromaticContact CH2-CE2 3.37Å; W3311-F3317 HydrophobicContact CH2-CE2 3.37Å; W3311-F3317 HydrophobicContact CH2-CG 4.46Å; W3311-F3317 AromaticContact CH2-CZ 3.99Å; W3311-F3317 HydrophobicContact CH2-CZ 3.99Å; W3311-F3317 HydrophobicContact CZ2-CD1 4.46Å; W3311-F3317 AromaticContact CZ2-CD2 3.86Å; W3311-F3317 HydrophobicContact CZ2-CD2 3.86Å; W3311-F3317 HydrophobicContact CZ2-CE1 4.05Å; W3311-F3317 AromaticContact CZ2-CE2 3.37Å; W3311-F3317 HydrophobicContact CZ2-CE2 3.37Å; W3311-F3317 HydrophobicContact CZ2-CG 4.37Å; W3311-F3317 AromaticContact CZ2-CZ 3.46Å; W3311-F3317 HydrophobicContact CZ2-CZ 3.46Å; W3311-F3317 VanDerWaalsContact CZ2-CZ 3.46Å; W3311-F3317 HydrophobicContact CZ3-CE2 4.41Å
3318	L	90.5	Very high	76.3	Confident	8 Å²	8	56.3 Å²	56.3	4%	0.042	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	140.4	176.8	-69	140.2	0	0	0	109.2	H3215 N3216 L3256 V3257 E3259	H3215-L3318 HydrophobicContact CB-CD2 3.86Å; H3215-L3318 HydrophobicContact CB-CG 4.38Å; H3215-L3318 WeakPolarHBondContact O-CA 3.35Å; N3216-L3318 HydrophobicContact CB-CD2 4.18Å; L3256-L3318 WeakPolarHBondContact CA-O 3.3Å; V3257-L3318 HydrophobicContact CB-CB 4.33Å; V3257-L3318 PolarHBondContact N-O 3.12Å; V3257-L3318 PolarHBondContact O-N 3.38Å; E3259-L3318 HydrophobicContact CB-CD1 3.49Å; E3259-L3318 VanDerWaalsContact CB-CD1 3.49Å; E3259-L3318 HydrophobicContact CG-CD1 4.33Å
3319	L	90.6	Very high	74.6	Confident	2 Å²	2	63.2 Å²	63.2	1%	0.01	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	124	169.3	-175	73.1	0	0	0	109.1	V3214 H3215 N3216 V3238 V3241 L3242 F3254	V3214-L3319 HydrophobicContact CG1-CB 3.94Å; H3215-L3319 PolarHBondContact O-N 3.14Å; N3216-L3319 PolarHBondContact ND2-O 3.32Å; V3238-L3319 HydrophobicContact CB-CD1 4.45Å; V3238-L3319 HydrophobicContact CG1-CD1 4.18Å; V3238-L3319 HydrophobicContact CG2-CD1 3.93Å; V3241-L3319 HydrophobicContact CG1-CD2 3.92Å; L3242-L3319 HydrophobicContact CD2-CD2 4.13Å; F3254-L3319 HydrophobicContact CB-CD1 3.86Å; F3254-L3319 HydrophobicContact CD1-CD1 3.92Å; F3254-L3319 HydrophobicContact CD1-CD2 3.91Å; F3254-L3319 HydrophobicContact CD1-CG 3.68Å; F3254-L3319 HydrophobicContact CE1-CD2 4.01Å; F3254-L3319 HydrophobicContact CE1-CG 4.23Å; F3254-L3319 HydrophobicContact CG-CD1 4.14Å; F3254-L3319 HydrophobicContact CG-CG 4.39Å
3320	E	88.4	Confident	72.8	Confident	36 Å²	36	70 Å²	70	17%	0.168	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	145.3	176.9	-66.9	-167.3	158.9	0	0	111.8	F3254 V3255 V3257 R3295 I3325	F3254-E3320 CarbonylContact C-O 3.59Å; F3254-E3320 VanDerWaalsContact CA-O 3.3Å; F3254-E3320 WeakPolarHBondContact CA-O 3.28Å; V3255-E3320 PolarHBondContact N-O 3.02Å; V3255-E3320 PolarHBondContact O-N 2.85Å; V3255-E3320 VanDerWaalsContact O-N 3.1Å; V3257-E3320 HydrophobicContact CG2-CB 4.25Å; V3257-E3320 HydrophobicContact CG2-CG 4.26Å; R3295-E3320 IonicContact CZ-OE1 2.82Å; R3295-E3320 IonicContact NH1-OE1 2.74Å; R3295-E3320 PolarHBondContact NH1-OE1 3.11Å; R3295-E3320 IonicContact NH1-OE2 3.43Å; R3295-E3320 PolarHBondContact NH1-OE2 3.08Å; R3295-E3320 IonicContact NH2-OE1 2.7Å; R3295-E3320 PolarHBondContact NH2-OE1 3.21Å; E3320-I3325 HydrophobicContact CB-CD1 4.1Å; E3320-I3325 HydrophobicContact CB-CG1 4.49Å
3321	K	84.7	Confident	71.2	Confident	64 Å²	64	73.2 Å²	73.2	28%	0.278	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	136.9	174.4	-69.8	-168.8	-179	-161	0	110.4	E3249 A3253 F3254 T3323 N3324 I3325	E3249-K3321 IonicContact OE1-NZ 2.86Å; E3249-K3321 PolarHBondContact OE1-NZ 3.17Å; E3249-K3321 VanDerWaalsContact OE2-CE 3.23Å; E3249-K3321 WeakPolarHBondContact OE2-CE 3.24Å; E3249-K3321 IonicContact OE2-NZ 2.9Å; E3249-K3321 PolarHBondContact OE2-NZ 2.75Å; A3253-K3321 WeakPolarHBondContact O-CA 3.29Å; F3254-K3321 HydrophobicContact CD1-CG 3.8Å; F3254-K3321 HydrophobicContact CE1-CD 4.27Å; F3254-K3321 HydrophobicContact CE1-CG 3.45Å; F3254-K3321 VanDerWaalsContact CE1-CG 3.45Å; F3254-K3321 HydrophobicContact CZ-CD 4.33Å; F3254-K3321 HydrophobicContact CZ-CG 3.93Å; K3321-T3323 WeakPolarHBondContact CB-OG1 3.16Å; K3321-T3323 PolarHBondContact O-N 3.31Å; K3321-N3324 PolarHBondContact O-N 3.48Å; K3321-N3324 VanDerWaalsContact O-N 3.13Å; K3321-I3325 PolarHBondContact O-N 3.12Å
3322	R	82.9	Confident	69.2	Low	86 Å²	86	80.9 Å²	80.9	33%	0.325	41%	0.407	S	S	.	.	H	α-helix	trans	-60.7	-27.5	179.1	-67.9	-179.6	-171.8	-171.8	-7.9	112.9	S3252 A3253 F3254 V3255 N3300 N3326	S3252-R3322 WeakPolarHBondContact O-CD 3.07Å; S3252-R3322 PolarHBondContact O-NE 3.03Å; S3252-R3322 VanDerWaalsContact O-NE 3.11Å; S3252-R3322 PolarHBondContact O-NH1 2.95Å; A3253-R3322 PolarHBondContact O-N 3.17Å; F3254-R3322 PolarHBondContact O-NE 3.02Å; F3254-R3322 PolarHBondContact O-NH2 3.43Å; V3255-R3322 HydrophobicContact CG1-CG 3.91Å; N3300-R3322 PolarHBondContact OD1-NH2 3.28Å; R3322-N3326 VanDerWaalsContact O-CG 3.28Å; R3322-N3326 PolarHBondContact O-N 2.9Å; R3322-N3326 VanDerWaalsContact O-N 3.16Å; R3322-N3326 PolarHBondContact O-ND2 3.44Å
3323	T	76	Confident	67.4	Low	82 Å²	82	82.3 Å²	82.3	50%	0.503	41%	0.413	S	S	.	.	H	α-helix	trans	-56.9	-53.3	172.1	44	0	0	0	0	111.7	K3321 I3325 N3326 E3327	K3321-T3323 WeakPolarHBondContact CB-OG1 3.16Å; K3321-T3323 PolarHBondContact O-N 3.31Å; T3323-I3325 VanDerWaalsContact C-N 3.27Å; T3323-I3325 PolarHBondContact O-N 2.75Å; T3323-N3326 PolarHBondContact O-N 2.89Å; T3323-N3326 VanDerWaalsContact O-N 3.13Å; T3323-E3327 PolarHBondContact O-N 3.06Å
3324	N	72.1	Confident	65.5	Low	94 Å²	94	85.3 Å²	85.3	50%	0.503	43%	0.433	S	S	.	.	H	α-helix	trans	-66	-33.7	-173	-56.3	32.6	0	0	0	111.2	K3321 E3327 A3328	K3321-N3324 PolarHBondContact O-N 3.48Å; K3321-N3324 VanDerWaalsContact O-N 3.13Å; N3324-E3327 PolarHBondContact O-N 3.13Å; N3324-A3328 WeakPolarHBondContact O-CB 3.44Å; N3324-A3328 PolarHBondContact O-N 3.07Å
3325	I	65	Low	63.7	Low	22 Å²	22	91.6 Å²	91.6	11%	0.113	45%	0.454	C	S	.	.	H	α-helix	trans	-69.1	-42.4	175.8	-65.7	171.3	0	0	0	111.2	V3255 V3257 I3297 E3320 K3321 T3323 E3327 A3328 Q3329	V3255-I3325 HydrophobicContact CG2-CD1 3.25Å; V3257-I3325 HydrophobicContact CG2-CD1 4.42Å; I3297-I3325 HydrophobicContact CD1-CD1 4.29Å; I3297-I3325 HydrophobicContact CD1-CG2 3.59Å; I3297-I3325 HydrophobicContact CG1-CD1 4.33Å; E3320-I3325 HydrophobicContact CB-CD1 4.1Å; E3320-I3325 HydrophobicContact CB-CG1 4.49Å; K3321-I3325 PolarHBondContact O-N 3.12Å; T3323-I3325 VanDerWaalsContact C-N 3.27Å; T3323-I3325 PolarHBondContact O-N 2.75Å; I3325-E3327 VanDerWaalsContact C-N 3.28Å; I3325-E3327 PolarHBondContact O-N 2.72Å; I3325-A3328 PolarHBondContact O-N 2.75Å; I3325-Q3329 PolarHBondContact O-N 3.01Å
3326	N	56.1	Low	61.2	Low	101 Å²	101	96.6 Å²	96.6	54%	0.54	49%	0.488	S	S	.	.	H	α-helix	trans	-67.3	-29.6	176.9	-72	-15.8	0	0	0	112.5	R3322 T3323 K3330	R3322-N3326 VanDerWaalsContact O-CG 3.28Å; R3322-N3326 PolarHBondContact O-N 2.9Å; R3322-N3326 VanDerWaalsContact O-N 3.16Å; R3322-N3326 PolarHBondContact O-ND2 3.44Å; T3323-N3326 PolarHBondContact O-N 2.89Å; T3323-N3326 VanDerWaalsContact O-N 3.13Å; N3326-K3330 PolarHBondContact O-N 3.49Å
3327	E	52.8	Low	58.5	Low	131 Å²	131	101 Å²	101	61%	0.612	52%	0.518	S	S	*	.	H	α-helix	trans	-74.2	-44.1	172.7	-70.9	178.6	156.6	0	0	111.5	T3323 N3324 I3325 Q3329 K3330	T3323-E3327 PolarHBondContact O-N 3.06Å; N3324-E3327 PolarHBondContact O-N 3.13Å; I3325-E3327 VanDerWaalsContact C-N 3.28Å; I3325-E3327 PolarHBondContact O-N 2.72Å; E3327-Q3329 VanDerWaalsContact C-N 3.26Å; E3327-Q3329 PolarHBondContact O-N 2.67Å; E3327-K3330 PolarHBondContact O-N 3.14Å
3328	A	53.8	Low	55.9	Low	67 Å²	67	106.7 Å²	106.7	55%	0.554	56%	0.557	S	S	*	*	H	α-helix	trans	-56.3	-39.2	173.4	0	0	0	0	0	112.5	N3324 I3325 K3330	N3324-A3328 WeakPolarHBondContact O-CB 3.44Å; N3324-A3328 PolarHBondContact O-N 3.07Å; I3325-A3328 PolarHBondContact O-N 2.75Å; A3328-K3330 VanDerWaalsContact C-N 3.28Å; A3328-K3330 PolarHBondContact O-N 3.41Å
3329	Q	49.9	Very low	53.2	Low	149 Å²	149	113.6 Å²	113.6	70%	0.696	59%	0.594	S	S	*	*	H	α-helix	trans	-73.4	-11.2	175.7	-72.8	-169	-11.8	0	0	114.9	I3325 E3327	I3325-Q3329 PolarHBondContact O-N 3.01Å; E3327-Q3329 VanDerWaalsContact C-N 3.26Å; E3327-Q3329 PolarHBondContact O-N 2.67Å
3330	K	41.6	Very low	50.5	Low	187 Å²	187	118.7 Å²	118.7	81%	0.813	62%	0.621	S	S	*	*	H	α-helix	trans	-97.1	-13.9	-175.5	-107.2	-179.1	175.9	179.6	0	115.3	N3326 E3327 A3328	N3326-K3330 PolarHBondContact O-N 3.49Å; E3327-K3330 PolarHBondContact O-N 3.14Å; A3328-K3330 VanDerWaalsContact C-N 3.28Å; A3328-K3330 PolarHBondContact O-N 3.41Å
3331	V	42	Very low	48	Very low	118 Å²	118	123.5 Å²	123.5	72%	0.715	65%	0.653	S	S	*	*	H	α-helix	trans	-94.2	-26.1	-171.3	177.7	0	0	0	0	113.2	K3333	V3331-K3333 PolarHBondContact O-N 3.44Å; V3331-K3333 VanDerWaalsContact O-N 3.08Å
3332	E	36.7	Very low	45.8	Very low	177 Å²	177	128.5 Å²	128.5	83%	0.827	68%	0.681	S	S	*	*			trans	-87.6	55.2	-172.4	-64.6	-157.7	139.3	0	0	116
3333	K	29.8	Very low	43.3	Very low	202 Å²	202	134.7 Å²	134.7	88%	0.878	71%	0.705	S	S	*	*			trans	-146.3	104.4	155.4	-75.5	-163.5	-179.7	176.3	0	112.8	V3331	V3331-K3333 PolarHBondContact O-N 3.44Å; V3331-K3333 VanDerWaalsContact O-N 3.08Å
3334	P	30.2	Very low	41.3	Very low	110 Å²	110	135.5 Å²	135.5	71%	0.714	71%	0.714	S	S	*	*			trans	-142.8	156.1	130.5	36.8	-23.3	0	0	0	115.4
3335	K	32.1	Very low	39.6	Very low	201 Å²	201	138.3 Å²	138.3	87%	0.874	73%	0.728	S	S	*	*			trans	66.4	90.3	156.3	-66.4	164.1	-176.4	176.4	0	118.1
3336	S	29.1	Very low	38.1	Very low	114 Å²	114	143.1 Å²	143.1	80%	0.797	75%	0.754	S	S	*	*			trans	-61	125.9	150.8	51.4	0	0	0	0	111.9
3337	N	31.6	Very low	37.1	Very low	169 Å²	169	144.8 Å²	144.8	90%	0.904	76%	0.762	S	S	*	*			trans	-170	88.5	156.5	-105.5	-11.5	0	0	0	111.9
3338	S	37.9	Very low	36	Very low	120 Å²	120	149.4 Å²	149.4	84%	0.839	77%	0.774	S	S	*	*			trans	-155.6	115.1	165.2	58.9	0	0	0	0	109.7
3339	L	34.3	Very low	35	Very low	154 Å²	154	155.8 Å²	155.8	81%	0.806	79%	0.789	S	S	*	*			trans	-141.8	148.4	-176	-104.6	174.8	0	0	0	111.5
3340	N	33.9	Very low	34.1	Very low	109 Å²	109	158.1 Å²	158.1	58%	0.583	80%	0.797	S	S	*	*			trans	64.3	86.5	161.1	-57.1	-41.6	0	0	0	118.2
3341	V	36.3	Very low	33.9	Very low	137 Å²	137	154.8 Å²	154.8	83%	0.83	79%	0.794	S	S	*	*	S	Bend	trans	-120.3	140.4	134.5	172.2	0	0	0	0	107.5
3342	L	38.1	Very low	33.9	Very low	168 Å²	168	154.8 Å²	154.8	88%	0.88	80%	0.797	S	S	*	*			trans	58.4	95.4	175.8	-69.8	165.2	0	0	0	118
3343	R	29.7	Very low	33.9	Very low	216 Å²	216	152.2 Å²	152.2	82%	0.815	80%	0.796	S	S	*	*			trans	-97.4	140	153.3	-64.6	167.5	168.8	166.9	-7.2	109.2
3344	S	34.8	Very low	34.2	Very low	100 Å²	100	147 Å²	147	70%	0.699	79%	0.79	S	S	*	*			trans	-175.7	116.3	140.1	54.1	0	0	0	0	113.3
3345	L	35.5	Very low	34.9	Very low	153 Å²	153	147.3 Å²	147.3	80%	0.801	79%	0.792	S	S	*	*			trans	65.3	143.4	150.4	-49.2	168.5	0	0	0	117.4
3346	N	33.9	Very low	35.1	Very low	123 Å²	123	144 Å²	144	66%	0.658	79%	0.789	S	S	*	*			cis	-157.1	149.7	-13.6	-125.1	-7.5	0	0	0	113.4
3347	L	35.4	Very low	35.8	Very low	135 Å²	135	143.4 Å²	143.4	71%	0.707	79%	0.791	S	S	*	*			trans	35.8	117.1	143.6	-66.2	165.3	0	0	0	122.5
3348	R	29.9	Very low	36	Very low	229 Å²	229	144.4 Å²	144.4	86%	0.864	79%	0.79	S	S	*	*				6.4	124.7	122.6	-67.1	171.6	164.1	178.4	-6.1	117.4
3349	K	32.2	Very low	36	Very low	200 Å²	200	147.8 Å²	147.8	87%	0.87	81%	0.814	S	S	*	*				176	127.7	119.5	-100	166.2	-177.8	177.5	0	115.2
3350	K	32.3	Very low	36.1	Very low	198 Å²	198	147.5 Å²	147.5	86%	0.861	82%	0.815	S	S	*	*			trans	58.7	152.6	147.5	-71.7	-167.4	171.5	-168.9	0	121
3351	P	37.5	Very low	36.2	Very low	117 Å²	117	149.5 Å²	149.5	76%	0.76	83%	0.827	S	S	*	*			trans	-97.8	166	176.8	39.6	-35.9	0	0	0	113.6
3352	P	41.5	Very low	36.2	Very low	119 Å²	119	150.2 Å²	150.2	77%	0.773	83%	0.827	S	S	*	*			trans	-110.2	155.5	137.5	35.7	-28.7	0	0	0	111.5
3353	P	36.2	Very low	36.1	Very low	123 Å²	123	149.2 Å²	149.2	80%	0.799	82%	0.823	S	S	*	*			trans	-88.2	170.8	-177.8	36.8	-36.5	0	0	0	113.4
3354	A	36.6	Very low	36.5	Very low	92 Å²	92	145 Å²	145	76%	0.76	82%	0.824	S	S	*	*			trans	-69.5	161.6	165.6	0	0	0	0	0	112.2
3355	P	45.1	Very low	36.6	Very low	117 Å²	117	148 Å²	148	76%	0.76	83%	0.832	S	S	*	*			trans	-114.7	123.7	134.8	33.2	-28.9	0	0	0	111.9
3356	T	36.4	Very low	36.7	Very low	131 Å²	131	147.6 Å²	147.6	80%	0.804	83%	0.834	S	S	*	*			trans	-1.8	130.6	148	-1.3	0	0	0	0	119
3357	A	43.2	Very low	36.9	Very low	102 Å²	102	149.5 Å²	149.5	84%	0.843	85%	0.848	S	S	*	*			trans	-136.1	111.2	142.6	0	0	0	0	0	108.6
3358	Q	35.4	Very low	37	Very low	189 Å²	189	150.8 Å²	150.8	88%	0.883	86%	0.86	S	S	*	*			trans	-128.6	110	165.7	-105.1	-168.9	-24.6	0	0	107.4
3359	S	37.9	Very low	37.7	Very low	192 Å²	192	143.6 Å²	143.6	100%	1.343	86%	0.859	S	S	*	*			trans	-161.3	0	165.7	60.9	0	0	0	0	107.7

Retrieved 3,359 of 3,359 residues in 5077.5 ms (Link to these results)

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