A0A3Q0KU51_SCHMA Loading...

Carbamoyl phosphate synthase arginine-specific large chain

AlphaFold DB , UniProt , Accession A0A3Q0KU51, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 2,628 aa.

						>A0A3Q0KU51_SCHMA|A0A3Q0KU51
MVLGSGVYRIGSSVEFDWCAVGCVKELRRLGWKTVIINCNPETVSTDFDMCDRLYFDELSLERVLDIYEFESPIGVIVSMGGQTPNNIAMPMHRLGVPILGTSAESIDNAENRFKFSRLLDCIGLSQPRWKELTDIDSAKAFCEEVGYPCLVRPSYVLSGAAMNVANDHDQLITFLTAAKNISPEHPVVIKVYNCELDRLRGQFDTNYKPFRDFDALIAVLSNIRQLPVVGSGESSMPTGECAGALILEDGSVFNGFLYGAKTPQSGEVVFQTGMVGYVESLTDPSYHSQLLVLTYPSIGNYGVPSLADIDESGLPRWFESSQIYAKGLIVSELCEEFSHFSAVKSLSRWLYESGVTCISGIDTRSLTLKLRQHGTLLGKIIPLSLRPETFDWIDPSKSNLVSEVSRTDIKVFNPHGDVHIAALDCGMKFNQIRCFVRRGAKVTVLPWSSDLTKTETNYDALFISNGPGDPIQCKGIIDQIRGWMTTKKPLFGICLGHQLVALACGFKTYKMKYGNRGHNQPCVHLPTGRCFITSQNHGYAVDTKNITDGWYELFRNKNDRSNEGLAHYTHPWMTVQFHPEHMAGPSDLEFLFDIFLSYIRSSGGQSLSDCLTNHISYKQEEFERVLCSKDNKPRKVLLLGSGGLSIGQAGEFDYSGSQALKALREEGVQTLLINSNIATVQTTEGMADKIFLLPITPDSVARVIKAERPDGLLIAFGGQTSLSCGLALTKVGSSSLIPDLKGEDSKKSNVLDLYNCRILGTSISAVEITEDRELFATAMRSMGEKVAPANAATSVQDAVKVANDLGYPVLVRAAFALGGMGSGFAENATELERLAGKALAQTTQIFIDKSLKGWKEVEYEVIRDAYDNCITVCNMENVDPVGIHTGESIVVSPSQTLSNVEYYMLRSVAIKVARHLRIVGECNIQFALDPHSLNYYIIEVNARLSRSSALASKATGYPIAYIAAKLSLGKSLPELTNSVTGGLTTACFEPSLDYCVVKVPRWDLAKFSRVSRKIGSSMKSVGEVMAIARCFEEALQKSLRMTNESVSGFDGSLEAPDENDLSDPTDIRIYKLSAALRSGWSVEHLHALTSIDPWFLYRMRSIVNCAKELESLYEGALANAMKLLECIPTTVPDNSSFYTLVRHAEKVMIAKRLGFSDVQLARALRSTPVMVRWFRKHLNLNPLIRLVDTVAGEWPATTNYLYTTYADIPLGNIQHLLRSFHDCQTETLVPQEMIDLLLKCMTVTKIHDVLPEQKSSIMVLGSGVYRIGSSVEFDWCAVGCVKELRRLGWKTVIINCNPETVSTDFDMCDRLYFDELSLERVLDIYEFESPIGVIVSMGGQTPNNIAMPMHRLGVPILGTSAESIDNAENRFKFSRLLDCIGLSQPRWKELTDIDSAKAFCEEVGYPCLVRPSYVLSGAAMNVANDHDQLITFLTAAKNISPEHPVVISQFILDAKEIDVDAVAQSGRLVAMAVSEHVENAGVHSGDATLVTPPQDLNEETLKLIKELVRALADELEVSGPFNLQLLAKDNRLLIIEANLRVSRSFPFVSKTLKYDFIAAATRAILGAARDSIHPPFDTPNSKLEKLSLSKSFLEPSVNILENTIGYVGVKVPVFSFARLLGADVLLGVEMVSTGEVACFGVDRYEAYLLAQAAALCNTNGLLPKPGDNVFLSIGSYRHKLEMLPSVKQLHQLGYKLYGSCGTADFYQTQGISIIPVEWPYEESDICISDNKIQNNMDASSKDGTIQQYLKDKLFSLIVSLSLKKVGSRRLSAFVTRGYQTRRLAVDTNVPLLTDVKLAKLLIEALYRYFHGQSANKTLIKSEDNEYNVYKQSFLHRLLPLHSITSSQIIYLPGLIDIHVHTRDPGMEYKEDWTSVTKAALAGGIVTILAMPNTDPAIVDENTFNIMSRNAASKACCDYGLYVGASSENAFTVSSLSHKAVGLKMYLNETFTCLSLGNKLNIWRQHFENWPSDRPICCHAEGETIAAVILLAEITGRSVHICHVARRAEIELIRDAKQRGLKVTCEVCPHHLFLTADDLPQEGGWNEVRPRLGTADDINALWANISTIDCFATDHAPHTISEKSKVSGAPPGFPGLETMLSLLLTAMYNGRLTLTELIERLYINPYKIFGIPTAHTLYEAVNSVSRGIYGETWVEVDMSAEWRIPGAAWKTKSESEPSFFTRANWSPFAGRVVRGQVRRVMLRGHLAFVDGRVLVEPGFGKDVSSDISLSKNSYDPLTIDTSLKHIPVSAGSPTLRNRYSSTNERVQSQDEPGTPIPANTQSDEGPRSPIIVYQPSASGLIPTAQLPQTHQSLPSIWLEGISGKHILSSEDFSKDHLRRLYNLAHSFKVALNKNKPLDQICRGKVMGNLFFEPSTRTSNSFAVAMQRLGGTVVHFSESTSSQTKGETTLDTVRILAGYCDCLVIRHPGKGAIQALANSIVHKPIINAGDGIGEHPTQALLDVFTIREEIGTVNGLTITMVGDLANGRTVHSLARLLCLYKVKLRYVTHRDEFKMPPEVKSYVADRGIPQEEMTSLEEALPDTDVLYMTRVQTERMSDDGNARRDQFVVTPELMTLAKPRGMIVMHPLPRVGEISPKFDSDPRAAYFRQAEYGTHVRMALLAIVLANQK
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	23.9	Very low	24.5	Very low	233 Å²	233	145.5 Å²	145.5	100%	1.148	84%	0.839	S	S	*	*				0	134.4	0	-102	174.1	62	0	0	108.4
2	V	26.6	Very low	24.4	Very low	140 Å²	140	142.4 Å²	142.4	85%	0.848	83%	0.832	S	S	*	*			trans	-105.7	127.2	176.8	173.1	0	0	0	0	109.1
3	L	27.2	Very low	24.4	Very low	168 Å²	168	137.9 Å²	137.9	88%	0.88	81%	0.813	S	S	*	*			trans	-157	127.4	159	-75	174.2	0	0	0	104.6
4	G	25.4	Very low	24.6	Very low	62 Å²	62	134.9 Å²	134.9	64%	0.639	80%	0.796	S	S	*	*			cis	-179.8	144.6	-1.4	0	0	0	0	0	108.7
5	S	24	Very low	24.7	Very low	133 Å²	133	138.6 Å²	138.6	93%	0.93	80%	0.803	S	S	*	*			trans	44.2	115.5	149.7	61.7	0	0	0	0	121.4
6	G	24.4	Very low	24.9	Very low	70 Å²	70	140.2 Å²	140.2	72%	0.722	80%	0.798	S	S	*	*			trans	-173.8	92.9	156.9	0	0	0	0	0	113.1
7	V	24.7	Very low	25.2	Very low	145 Å²	145	136.9 Å²	136.9	88%	0.879	78%	0.777	S	S	*	*			trans	-78.2	117.8	171.1	174.9	0	0	0	0	109.1
8	Y	23.2	Very low	25.6	Very low	216 Å²	216	138.9 Å²	138.9	85%	0.847	77%	0.771	S	S	*	*			trans	-122.4	132.7	159.8	-83.4	-79.4	0	0	0	111.7
9	R	22.6	Very low	26.2	Very low	218 Å²	218	132.9 Å²	132.9	82%	0.823	74%	0.739	S	S	*	*			trans	-72.2	135.2	-179.8	-89.6	177.7	169	165.6	-4.2	112
10	I	25.1	Very low	26.9	Very low	137 Å²	137	127.4 Å²	127.4	70%	0.703	71%	0.711	S	S	*	*				52.5	107	125.3	-47.7	168.6	0	0	0	117.4
11	G	22	Very low	27.5	Very low	79 Å²	79	125 Å²	125	81%	0.814	70%	0.699	S	S	*	*			trans	-125.1	119	146.7	0	0	0	0	0	108.4
12	S	24	Very low	28.3	Very low	108 Å²	108	115.7 Å²	115.7	76%	0.755	66%	0.663	S	S	*	*			trans	-96.8	105.1	-170.8	46.7	0	0	0	0	111.2
13	S	23.9	Very low	29.1	Very low	84 Å²	84	110 Å²	110	59%	0.587	63%	0.63	S	S	*	*			trans	-179.1	75.9	158.9	48.9	0	0	0	0	111.2
14	V	27	Very low	29.9	Very low	95 Å²	95	104.9 Å²	104.9	58%	0.576	61%	0.605	S	S	*	*			trans	-129.1	101.9	161.5	-177.5	0	0	0	0	106.2	F16 L59	V14-F16 HydrophobicContact CG1-CD2 3.74Å; V14-F16 HydrophobicContact CG1-CE2 4.05Å; V14-F16 PolarHBondContact O-N 2.87Å; V14-L59 HydrophobicContact CG2-CD1 4.14Å
15	E	26.2	Very low	30.8	Very low	191 Å²	191	109.5 Å²	109.5	89%	0.893	61%	0.607	S	S	*	*			trans	-84.7	94.2	173	-76.3	-173.9	156.6	0	0	108.7
16	F	27.8	Very low	31.8	Very low	164 Å²	164	105.1 Å²	105.1	72%	0.719	57%	0.572	S	S	*	*			trans	-77.5	132.3	163.6	-103.9	-90.2	0	0	0	109.2	V14 W18	V14-F16 HydrophobicContact CG1-CD2 3.74Å; V14-F16 HydrophobicContact CG1-CE2 4.05Å; V14-F16 PolarHBondContact O-N 2.87Å; F16-W18 VanDerWaalsContact C-N 3.32Å; F16-W18 VanDerWaalsContact O-CD1 3.27Å; F16-W18 PolarHBondContact O-N 3.14Å
17	D	30.3	Very low	32.9	Very low	85 Å²	85	102.9 Å²	102.9	46%	0.455	54%	0.544	S	S	.	.			trans	-70.6	86.8	171.5	-172.3	-10.1	0	0	0	110	C19 A20	D17-C19 PolarHBondContact O-N 3.09Å; D17-C19 WeakPolarHBondContact OD1-CB 3.3Å; D17-C19 PolarHBondContact OD1-N 3.38Å; D17-A20 PolarHBondContact O-N 3.32Å
18	W	33.2	Very low	34	Very low	173 Å²	173	104.8 Å²	104.8	66%	0.655	54%	0.535	S	S	*	.	H	α-helix	trans	-59.3	-9.7	175.9	-79.3	89.9	0	0	0	113.3	F16 A20 V21 G22 L197	F16-W18 VanDerWaalsContact C-N 3.32Å; F16-W18 VanDerWaalsContact O-CD1 3.27Å; F16-W18 PolarHBondContact O-N 3.14Å; W18-A20 VanDerWaalsContact C-N 3.33Å; W18-V21 HydrophobicContact CE3-CB 4.45Å; W18-V21 PolarHBondContact O-N 2.88Å; W18-G22 PolarHBondContact O-N 3.14Å; W18-L197 HydrophobicContact CB-CD1 3.87Å; W18-L197 HydrophobicContact CB-CD2 3.59Å; W18-L197 HydrophobicContact CB-CG 4.39Å; W18-L197 HydrophobicContact CG-CD2 4.38Å
19	C	37.1	Very low	35.3	Very low	25 Å²	25	102.5 Å²	102.5	17%	0.169	53%	0.525	C	S	.	.	H	α-helix	trans	-72.5	-32.5	179.7	-133.3	0	0	0	0	110.7	D17 V21 G22 C23 C195 L197	D17-C19 PolarHBondContact O-N 3.09Å; D17-C19 WeakPolarHBondContact OD1-CB 3.3Å; D17-C19 PolarHBondContact OD1-N 3.38Å; C19-V21 VanDerWaalsContact C-N 3.33Å; C19-V21 PolarHBondContact O-N 2.7Å; C19-G22 PolarHBondContact O-N 3.05Å; C19-C23 WeakPolarHBondContact O-CB 3.49Å; C19-C23 PolarHBondContact O-N 3.04Å; C19-C195 HydrophobicContact CB-CB 3.9Å; C19-C195 VanDerWaalsContact SG-CB 3.52Å; C19-C195 PolarHBondContact SG-SG 3.4Å; C19-L197 VanDerWaalsContact CA-CD1 3.47Å; C19-L197 HydrophobicContact CB-CD1 3.38Å
20	A	38.9	Very low	36.7	Very low	21 Å²	21	93.4 Å²	93.4	17%	0.174	49%	0.493	C	S	.	.	H	α-helix	trans	-58.3	-46.2	171.2	0	0	0	0	0	111.1	D17 W18 C23 V24 I37	D17-A20 PolarHBondContact O-N 3.32Å; W18-A20 VanDerWaalsContact C-N 3.33Å; A20-C23 PolarHBondContact O-N 2.82Å; A20-V24 WeakPolarHBondContact O-CG2 3.3Å; A20-V24 PolarHBondContact O-N 3.18Å; A20-I37 HydrophobicContact CB-CD1 4Å; A20-I37 HydrophobicContact CB-CG2 3.98Å; A20-I37 WeakPolarHBondContact O-CD1 3.38Å
21	V	40.4	Very low	37.8	Very low	78 Å²	78	89.3 Å²	89.3	47%	0.473	48%	0.484	S	S	.	.	H	α-helix	trans	-66.1	-40.7	179.5	-177.8	0	0	0	0	111.4	W18 C19 V24 K25	W18-V21 HydrophobicContact CE3-CB 4.45Å; W18-V21 PolarHBondContact O-N 2.88Å; C19-V21 VanDerWaalsContact C-N 3.33Å; C19-V21 PolarHBondContact O-N 2.7Å; V21-V24 PolarHBondContact O-N 3.25Å; V21-K25 PolarHBondContact O-N 2.74Å
22	G	40.8	Very low	39	Very low	38 Å²	38	87.5 Å²	87.5	39%	0.392	45%	0.453	S	S	.	.	H	α-helix	trans	-62.9	-45.2	174.2	0	0	0	0	0	113	W18 C19 K25 E26	W18-G22 PolarHBondContact O-N 3.14Å; C19-G22 PolarHBondContact O-N 3.05Å; G22-K25 WeakPolarHBondContact O-CB 3.32Å; G22-K25 PolarHBondContact O-N 3.43Å; G22-E26 PolarHBondContact O-N 3.34Å
23	C	42.8	Very low	40.1	Very low	21 Å²	21	92.1 Å²	92.1	14%	0.142	46%	0.459	C	S	.	.	H	α-helix	trans	-62.6	-42.6	175.5	-81.4	0	0	0	0	112.1	C19 A20 K25 E26 L27	C19-C23 WeakPolarHBondContact O-CB 3.49Å; C19-C23 PolarHBondContact O-N 3.04Å; A20-C23 PolarHBondContact O-N 2.82Å; C23-K25 VanDerWaalsContact C-N 3.32Å; C23-K25 PolarHBondContact O-N 3.31Å; C23-E26 PolarHBondContact O-N 3.01Å; C23-L27 VanDerWaalsContact O-CB 3.23Å; C23-L27 WeakPolarHBondContact O-CB 3.32Å; C23-L27 WeakPolarHBondContact O-CD1 3.4Å; C23-L27 WeakPolarHBondContact O-CG 3.37Å; C23-L27 PolarHBondContact O-N 3.1Å
24	V	43.8	Very low	41.2	Very low	59 Å²	59	92.7 Å²	92.7	36%	0.358	46%	0.459	S	S	.	.	H	α-helix	trans	-60	-44.2	173.9	176.3	0	0	0	0	110.7	A20 V21 E26 R28 V35 I37	A20-V24 WeakPolarHBondContact O-CG2 3.3Å; A20-V24 PolarHBondContact O-N 3.18Å; V21-V24 PolarHBondContact O-N 3.25Å; V24-E26 VanDerWaalsContact C-N 3.33Å; V24-E26 PolarHBondContact O-N 3.37Å; V24-R28 VanDerWaalsContact O-CB 3.25Å; V24-R28 WeakPolarHBondContact O-CB 3.5Å; V24-R28 PolarHBondContact O-N 2.6Å; V24-V35 HydrophobicContact CG2-CG1 4.36Å; V24-I37 HydrophobicContact CG2-CD1 3.26Å; V24-I37 HydrophobicContact CG2-CG1 4.31Å
25	K	44.2	Very low	41.8	Very low	159 Å²	159	90 Å²	90	69%	0.691	44%	0.443	S	S	*	.	H	α-helix	trans	-58.6	-45.3	177.8	-117.1	179.7	178.4	176.9	0	111.5	V21 G22 C23 R28 R29	V21-K25 PolarHBondContact O-N 2.74Å; G22-K25 WeakPolarHBondContact O-CB 3.32Å; G22-K25 PolarHBondContact O-N 3.43Å; C23-K25 VanDerWaalsContact C-N 3.32Å; C23-K25 PolarHBondContact O-N 3.31Å; K25-R28 PolarHBondContact O-N 3.45Å; K25-R29 PolarHBondContact O-N 2.97Å
26	E	45.5	Very low	42.6	Very low	42 Å²	42	86.5 Å²	86.5	20%	0.196	43%	0.429	C	S	.	.	H	α-helix	trans	-78.2	-33.7	-176.4	-155.3	61.9	-177.5	0	0	113.2	G22 C23 V24 R28 R29 L30	G22-E26 PolarHBondContact O-N 3.34Å; C23-E26 PolarHBondContact O-N 3.01Å; V24-E26 VanDerWaalsContact C-N 3.33Å; V24-E26 PolarHBondContact O-N 3.37Å; E26-R28 VanDerWaalsContact C-N 3.34Å; E26-R29 CarbonylContact O-C 3.48Å; E26-R29 WeakPolarHBondContact O-CB 3.42Å; E26-R29 PolarHBondContact O-N 3.02Å; E26-R29 IonicContact OE1-CZ 3.56Å; E26-R29 IonicContact OE1-NE 3.9Å; E26-R29 PolarHBondContact OE1-NE 2.7Å; E26-R29 IonicContact OE1-NH2 2.92Å; E26-R29 PolarHBondContact OE1-NH2 3.21Å; E26-R29 WeakPolarHBondContact OE2-CD 3.39Å; E26-R29 IonicContact OE2-NE 3.98Å; E26-R29 PolarHBondContact OE2-NE 2.91Å; E26-R29 VanDerWaalsContact OE2-NE 3.08Å; E26-L30 WeakPolarHBondContact O-CB 3.47Å; E26-L30 WeakPolarHBondContact O-CG 3.29Å; E26-L30 PolarHBondContact O-N 3.18Å
27	L	48.3	Very low	43	Very low	22 Å²	22	81.4 Å²	81.4	12%	0.115	41%	0.409	C	S	.	.	H	α-helix	trans	-64.1	-38.8	169.3	-71.9	166.2	0	0	0	111.5	C23 L30 G31 W32 V35 L176	C23-L27 VanDerWaalsContact O-CB 3.23Å; C23-L27 WeakPolarHBondContact O-CB 3.32Å; C23-L27 WeakPolarHBondContact O-CD1 3.4Å; C23-L27 WeakPolarHBondContact O-CG 3.37Å; C23-L27 PolarHBondContact O-N 3.1Å; L27-L30 CarbonylContact O-C 3.56Å; L27-L30 PolarHBondContact O-N 2.96Å; L27-G31 PolarHBondContact O-N 3.14Å; L27-G31 VanDerWaalsContact O-N 3.15Å; L27-W32 HydrophobicContact CB-CB 4.45Å; L27-W32 HydrophobicContact CD2-CG 4.26Å; L27-W32 WeakPolarHBondContact O-CB 3.48Å; L27-W32 VanDerWaalsContact O-CD1 3.27Å; L27-W32 PolarHBondContact O-N 3.49Å; L27-V35 HydrophobicContact CB-CG2 3.9Å; L27-V35 HydrophobicContact CD1-CB 4.48Å; L27-V35 HydrophobicContact CD1-CG1 3.59Å; L27-V35 HydrophobicContact CD1-CG2 3.98Å; L27-L176 HydrophobicContact CD2-CD1 3.68Å; L27-L176 HydrophobicContact CD2-CD2 3.64Å; L27-L176 HydrophobicContact CD2-CG 4.21Å; L27-L176 HydrophobicContact CG-CD1 4.42Å
28	R	46.9	Very low	43.3	Very low	186 Å²	186	82 Å²	82	70%	0.702	41%	0.412	S	S	*	.	H	α-helix	trans	-66.8	-39.7	173	-157.1	177.9	-168.8	176.6	3.3	110.9	V24 K25 E26 L30 G31	V24-R28 VanDerWaalsContact O-CB 3.25Å; V24-R28 WeakPolarHBondContact O-CB 3.5Å; V24-R28 PolarHBondContact O-N 2.6Å; K25-R28 PolarHBondContact O-N 3.45Å; E26-R28 VanDerWaalsContact C-N 3.34Å; R28-L30 VanDerWaalsContact C-N 3.33Å; R28-L30 PolarHBondContact O-N 2.85Å; R28-G31 PolarHBondContact O-N 3.47Å; R28-G31 VanDerWaalsContact O-N 3.1Å
29	R	51.4	Low	43.3	Very low	167 Å²	167	78 Å²	78	63%	0.63	41%	0.409	S	S	*	.	H	α-helix	trans	-62.9	-37.1	172.6	-163.5	-176.4	74	84.5	-1.4	112.4	K25 E26 G31	K25-R29 PolarHBondContact O-N 2.97Å; E26-R29 CarbonylContact O-C 3.48Å; E26-R29 WeakPolarHBondContact O-CB 3.42Å; E26-R29 PolarHBondContact O-N 3.02Å; E26-R29 IonicContact OE1-CZ 3.56Å; E26-R29 IonicContact OE1-NE 3.9Å; E26-R29 PolarHBondContact OE1-NE 2.7Å; E26-R29 IonicContact OE1-NH2 2.92Å; E26-R29 PolarHBondContact OE1-NH2 3.21Å; E26-R29 WeakPolarHBondContact OE2-CD 3.39Å; E26-R29 IonicContact OE2-NE 3.98Å; E26-R29 PolarHBondContact OE2-NE 2.91Å; E26-R29 VanDerWaalsContact OE2-NE 3.08Å; R29-G31 PolarHBondContact O-N 3.37Å
30	L	50.9	Low	42.8	Very low	28 Å²	28	82.1 Å²	82.1	15%	0.147	43%	0.43	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-0.7	174.6	-70.7	171.3	0	0	0	113.4	E26 L27 R28 L176 K180	E26-L30 WeakPolarHBondContact O-CB 3.47Å; E26-L30 WeakPolarHBondContact O-CG 3.29Å; E26-L30 PolarHBondContact O-N 3.18Å; L27-L30 CarbonylContact O-C 3.56Å; L27-L30 PolarHBondContact O-N 2.96Å; R28-L30 VanDerWaalsContact C-N 3.33Å; R28-L30 PolarHBondContact O-N 2.85Å; L30-L176 HydrophobicContact CD1-CB 4.14Å; L30-L176 HydrophobicContact CD1-CD1 4.38Å; L30-K180 WeakPolarHBondContact O-CE 3.3Å; L30-K180 PolarHBondContact O-NZ 3.33Å
31	G	49.2	Very low	42.3	Very low	51 Å²	51	87.1 Å²	87.1	53%	0.526	46%	0.46	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.5	18.8	170.5	0	0	0	0	0	115.8	L27 R28 R29	L27-G31 PolarHBondContact O-N 3.14Å; L27-G31 VanDerWaalsContact O-N 3.15Å; R28-G31 PolarHBondContact O-N 3.47Å; R28-G31 VanDerWaalsContact O-N 3.1Å; R29-G31 PolarHBondContact O-N 3.37Å
32	W	46	Very low	41.6	Very low	40 Å²	40	90.4 Å²	90.4	15%	0.152	47%	0.47	C	S	.	.			trans	-75.7	131.8	176.4	-66.9	78	0	0	0	111.1	L27 V35 A179 K180 V188 I190	L27-W32 HydrophobicContact CB-CB 4.45Å; L27-W32 HydrophobicContact CD2-CG 4.26Å; L27-W32 WeakPolarHBondContact O-CB 3.48Å; L27-W32 VanDerWaalsContact O-CD1 3.27Å; L27-W32 PolarHBondContact O-N 3.49Å; W32-V35 HydrophobicContact CB-CG2 4.38Å; W32-A179 HydrophobicContact CH2-CB 4.24Å; W32-A179 HydrophobicContact CZ2-CB 4.31Å; W32-K180 HydrophobicContact CZ2-CB 4.14Å; W32-V188 HydrophobicContact CH2-CB 3.74Å; W32-V188 HydrophobicContact CH2-CG2 3.99Å; W32-V188 HydrophobicContact CZ3-CB 3.71Å; W32-V188 HydrophobicContact CZ3-CG2 4.17Å; W32-I190 HydrophobicContact CH2-CD1 4.41Å
33	K	48.4	Very low	40.9	Very low	206 Å²	206	95 Å²	95	90%	0.896	49%	0.491	S	S	*	.	S	Bend	trans	-86.1	-26.1	-177.4	-72.1	-174.4	178.2	177.7	0	114.4
34	T	45.6	Very low	40	Very low	95 Å²	95	101.2 Å²	101.2	58%	0.583	53%	0.528	S	S	*	.			trans	-138	128.2	-178	-49.6	0	0	0	0	109
35	V	39.4	Very low	39.1	Very low	39 Å²	39	103 Å²	103	24%	0.236	54%	0.544	C	S	.	.			trans	-130.5	129.6	178.4	-179.6	0	0	0	0	107.8	V24 L27 W32 I37	V24-V35 HydrophobicContact CG2-CG1 4.36Å; L27-V35 HydrophobicContact CB-CG2 3.9Å; L27-V35 HydrophobicContact CD1-CB 4.48Å; L27-V35 HydrophobicContact CD1-CG1 3.59Å; L27-V35 HydrophobicContact CD1-CG2 3.98Å; W32-V35 HydrophobicContact CB-CG2 4.38Å; V35-I37 HydrophobicContact CG1-CD1 4.32Å; V35-I37 HydrophobicContact CG1-CG1 3.96Å
36	I	42.8	Very low	38.2	Very low	117 Å²	117	101.8 Å²	101.8	60%	0.6	55%	0.549	S	S	*	.			trans	-116.3	115.6	177.3	-59.9	174	0	0	0	107.8
37	I	37.3	Very low	37.2	Very low	58 Å²	58	106.8 Å²	106.8	30%	0.297	58%	0.578	S	S	.	*			trans	-111.4	125.7	176.9	-57.1	-172.2	0	0	0	108.2	A20 V24 V35	A20-I37 HydrophobicContact CB-CD1 4Å; A20-I37 HydrophobicContact CB-CG2 3.98Å; A20-I37 WeakPolarHBondContact O-CD1 3.38Å; V24-I37 HydrophobicContact CG2-CD1 3.26Å; V24-I37 HydrophobicContact CG2-CG1 4.31Å; V35-I37 HydrophobicContact CG1-CD1 4.32Å; V35-I37 HydrophobicContact CG1-CG1 3.96Å
38	N	37	Very low	36.1	Very low	98 Å²	98	115 Å²	115	52%	0.524	61%	0.612	S	S	.	*			trans	-114.4	101.8	178.6	-169.5	5.7	0	0	0	109
39	C	31.7	Very low	35	Very low	87 Å²	87	113.3 Å²	113.3	59%	0.588	62%	0.617	S	S	*	*			trans	-86.1	117.9	178.8	-56.9	0	0	0	0	109	P41	C39-P41 WeakPolarHBondContact O-CD 3.32Å
40	N	28.5	Very low	33.6	Very low	113 Å²	113	113.9 Å²	113.9	60%	0.604	63%	0.63	S	S	*	*			trans	-100.8	109.8	177.4	-163	25.3	0	0	0	109.1	E42	N40-E42 PolarHBondContact ND2-OE1 3.41Å; N40-E42 PolarHBondContact O-N 3.07Å
41	P	27.6	Very low	32.3	Very low	125 Å²	125	118.2 Å²	118.2	81%	0.812	66%	0.661	S	S	*	*			trans	-79.7	87.7	176.4	29.4	-26.5	0	0	0	109	C39	C39-P41 WeakPolarHBondContact O-CD 3.32Å
42	E	25.4	Very low	31	Very low	147 Å²	147	123.5 Å²	123.5	69%	0.687	68%	0.677	S	S	*	*			trans	-88.6	149.1	167.9	-79.9	-175.5	178.5	0	0	110.8	N40	N40-E42 PolarHBondContact ND2-OE1 3.41Å; N40-E42 PolarHBondContact O-N 3.07Å
43	T	25.7	Very low	29.9	Very low	134 Å²	134	132.4 Å²	132.4	82%	0.822	71%	0.711	S	S	*	*			trans	89.1	74.1	168	68.1	0	0	0	0	118.5
44	V	24.4	Very low	28.6	Very low	152 Å²	152	129.2 Å²	129.2	92%	0.921	70%	0.703	S	S	*	*			trans	-120.9	117.6	136.1	-172.7	0	0	0	0	108.2
45	S	25.7	Very low	27.6	Very low	98 Å²	98	135.8 Å²	135.8	69%	0.685	72%	0.718	S	S	*	*			trans	-57.7	133.8	-170.8	177.3	0	0	0	0	113.8	D47	S45-D47 PolarHBondContact O-N 2.92Å
46	T	25.3	Very low	27	Very low	133 Å²	133	141.1 Å²	141.1	82%	0.816	74%	0.739	S	S	*	*			trans	-62.5	99.7	157.8	47.9	0	0	0	0	109.4
47	D	24.1	Very low	26.2	Very low	147 Å²	147	143.1 Å²	143.1	79%	0.786	75%	0.751	S	S	*	*			trans	-140	111	155.2	-126	-14.8	0	0	0	109.1	S45	S45-D47 PolarHBondContact O-N 2.92Å
48	F	23.9	Very low	25.8	Very low	193 Å²	193	149.4 Å²	149.4	85%	0.846	78%	0.779	S	S	*	*			trans	-78.1	138.3	169.9	-96.8	-101.2	0	0	0	107.1
49	D	24.9	Very low	25.5	Very low	151 Å²	151	149.8 Å²	149.8	81%	0.807	78%	0.78	S	S	*	*	S	Bend	trans	81	109.1	-179.3	-64.3	-23.6	0	0	0	116.1
50	M	22	Very low	25.8	Very low	180 Å²	180	148.9 Å²	148.9	89%	0.887	78%	0.775	S	S	*	*			trans	92.9	72.2	171.5	-54.2	-159.6	69.4	0	0	117.2
51	C	22.8	Very low	26.2	Very low	119 Å²	119	149.4 Å²	149.4	80%	0.804	78%	0.777	S	S	*	*			trans	-160.1	77.3	139.1	-95.8	0	0	0	0	110.1	R53	C51-R53 PolarHBondContact O-N 3.05Å
52	D	22.3	Very low	26.6	Very low	162 Å²	162	150.6 Å²	150.6	87%	0.866	77%	0.772	S	S	*	*			trans	-63.4	125	149.4	-84.4	-38.9	0	0	0	107.7
53	R	22.7	Very low	27.1	Very low	227 Å²	227	150.9 Å²	150.9	86%	0.857	77%	0.766	S	S	*	*			trans	87.8	88.6	175.5	-51.4	173.4	-174.9	-178.5	1.2	115.8	C51	C51-R53 PolarHBondContact O-N 3.05Å
54	L	22.1	Very low	27.7	Very low	139 Å²	139	147.8 Å²	147.8	73%	0.728	75%	0.747	S	S	*	*			trans	-171.6	68.4	141.1	-97.4	159.8	0	0	0	107.8	F56	L54-F56 HydrophobicContact CD2-CE2 4.48Å; L54-F56 PolarHBondContact O-N 3.46Å
55	Y	24.3	Very low	28.5	Very low	233 Å²	233	145 Å²	145	91%	0.914	73%	0.727	S	S	*	*			trans	-77.9	109.4	161.7	-86.3	-82.4	0	0	0	107
56	F	26.8	Very low	28.9	Very low	150 Å²	150	146.5 Å²	146.5	66%	0.658	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-63.7	131.6	161.8	-77	-91.8	0	0	0	108.4	L54 E58	L54-F56 HydrophobicContact CD2-CE2 4.48Å; L54-F56 PolarHBondContact O-N 3.46Å; F56-E58 PolarHBondContact O-N 3.27Å
57	D	25.1	Very low	29.3	Very low	160 Å²	160	146.2 Å²	146.2	86%	0.856	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-55	119.2	167.4	-74.3	-45.4	0	0	0	109.2	L59	D57-L59 PolarHBondContact O-N 3.41Å
58	E	29.5	Very low	29.8	Very low	189 Å²	189	146 Å²	146	88%	0.883	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-63.6	125.6	170.8	-81.4	-177.7	153.7	0	0	109.3	F56 S60	F56-E58 PolarHBondContact O-N 3.27Å; E58-S60 PolarHBondContact O-N 3.38Å; E58-S60 VanDerWaalsContact O-N 3.09Å
59	L	30.2	Very low	30.2	Very low	107 Å²	107	145.4 Å²	145.4	56%	0.56	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-55.4	116.2	164.9	-89.1	93.6	0	0	0	108.6	V14 D57 R63	V14-L59 HydrophobicContact CG2-CD1 4.14Å; D57-L59 PolarHBondContact O-N 3.41Å; L59-R63 HydrophobicContact CD2-CB 4.12Å; L59-R63 HydrophobicContact CD2-CG 4.04Å
60	S	37.7	Very low	30.5	Very low	67 Å²	67	146.7 Å²	146.7	47%	0.469	71%	0.707	S	S	.	*	P	Polyproline II helix	trans	-61.6	146.5	172.2	64.3	0	0	0	0	110.7	E58 E62 R63	E58-S60 PolarHBondContact O-N 3.38Å; E58-S60 VanDerWaalsContact O-N 3.09Å; S60-E62 PolarHBondContact O-N 3.05Å; S60-R63 WeakPolarHBondContact O-CB 3.31Å; S60-R63 PolarHBondContact O-N 3.32Å
61	L	37.4	Very low	31	Very low	124 Å²	124	146 Å²	146	65%	0.649	70%	0.701	S	S	*	*	H	α-helix	trans	-51.5	-25.3	177.3	-173.8	67.1	0	0	0	113.1	R63 V64 L65	L61-R63 VanDerWaalsContact C-N 3.32Å; L61-R63 PolarHBondContact O-N 2.92Å; L61-V64 HydrophobicContact CD1-CB 4.5Å; L61-V64 PolarHBondContact O-N 3.41Å; L61-L65 HydrophobicContact CD1-CG 4.45Å; L61-L65 HydrophobicContact CD2-CD1 4.33Å; L61-L65 HydrophobicContact CG-CD1 3.88Å; L61-L65 HydrophobicContact CG-CG 4.23Å; L61-L65 WeakPolarHBondContact O-CB 3.17Å; L61-L65 VanDerWaalsContact O-CG 3.29Å; L61-L65 WeakPolarHBondContact O-CG 3.41Å; L61-L65 PolarHBondContact O-N 3.49Å
62	E	37.4	Very low	31.2	Very low	150 Å²	150	145.3 Å²	145.3	70%	0.701	70%	0.698	S	S	*	*	H	α-helix	trans	-61	-38.8	171.5	-76	175.7	151.7	0	0	112.4	S60 V64 L65 D66	S60-E62 PolarHBondContact O-N 3.05Å; E62-V64 VanDerWaalsContact C-N 3.31Å; E62-V64 PolarHBondContact O-N 3.33Å; E62-L65 PolarHBondContact O-N 3.25Å; E62-D66 WeakPolarHBondContact O-CB 3.28Å; E62-D66 PolarHBondContact O-N 2.93Å
63	R	34.7	Very low	31.6	Very low	154 Å²	154	141.8 Å²	141.8	58%	0.581	68%	0.684	S	S	*	*	H	α-helix	trans	-71.5	-28.3	177.1	-144.6	94.9	172.8	-163.1	-0.9	112.4	L59 S60 L61 I67	L59-R63 HydrophobicContact CD2-CB 4.12Å; L59-R63 HydrophobicContact CD2-CG 4.04Å; S60-R63 WeakPolarHBondContact O-CB 3.31Å; S60-R63 PolarHBondContact O-N 3.32Å; L61-R63 VanDerWaalsContact C-N 3.32Å; L61-R63 PolarHBondContact O-N 2.92Å; R63-I67 WeakPolarHBondContact O-CG1 3.47Å
64	V	39.1	Very low	32.1	Very low	68 Å²	68	137.1 Å²	137.1	41%	0.412	67%	0.674	S	S	.	*	H	α-helix	trans	-76.4	-37.6	175.5	177.5	0	0	0	0	110.4	L61 E62 I67 Y68	L61-V64 HydrophobicContact CD1-CB 4.5Å; L61-V64 PolarHBondContact O-N 3.41Å; E62-V64 VanDerWaalsContact C-N 3.31Å; E62-V64 PolarHBondContact O-N 3.33Å; V64-I67 PolarHBondContact O-N 3.33Å; V64-Y68 PolarHBondContact O-N 3.38Å
65	L	40.5	Very low	32.4	Very low	94 Å²	94	133.4 Å²	133.4	49%	0.492	67%	0.67	S	S	.	*	H	α-helix	trans	-77.4	-31.3	179.2	-70.5	172.9	0	0	0	113.1	L61 E62 I67 Y68 E69	L61-L65 HydrophobicContact CD1-CG 4.45Å; L61-L65 HydrophobicContact CD2-CD1 4.33Å; L61-L65 HydrophobicContact CG-CD1 3.88Å; L61-L65 HydrophobicContact CG-CG 4.23Å; L61-L65 WeakPolarHBondContact O-CB 3.17Å; L61-L65 VanDerWaalsContact O-CG 3.29Å; L61-L65 WeakPolarHBondContact O-CG 3.41Å; L61-L65 PolarHBondContact O-N 3.49Å; E62-L65 PolarHBondContact O-N 3.25Å; L65-I67 PolarHBondContact O-N 3.31Å; L65-Y68 WeakPolarHBondContact O-CA 3.45Å; L65-Y68 WeakPolarHBondContact O-CB 3.08Å; L65-Y68 PolarHBondContact O-N 3.02Å; L65-E69 PolarHBondContact O-N 2.7Å
66	D	34.7	Very low	32.6	Very low	129 Å²	129	127.8 Å²	127.8	69%	0.69	66%	0.66	S	S	*	*	H	α-helix	trans	-62.6	-26.7	170.4	-84.8	-8.5	0	0	0	112.4	E62	E62-D66 WeakPolarHBondContact O-CB 3.28Å; E62-D66 PolarHBondContact O-N 2.93Å
67	I	33.3	Very low	32.7	Very low	127 Å²	127	127.6 Å²	127.6	65%	0.651	66%	0.664	S	S	*	*	H	α-helix	trans	-81.4	-22	173.2	-64.7	171.3	0	0	0	110.9	R63 V64 L65	R63-I67 WeakPolarHBondContact O-CG1 3.47Å; V64-I67 PolarHBondContact O-N 3.33Å; L65-I67 PolarHBondContact O-N 3.31Å
68	Y	34.9	Very low	32.9	Very low	143 Å²	143	125.9 Å²	125.9	56%	0.561	66%	0.659	S	S	*	*	H	α-helix	trans	-83.1	-12.6	-173.6	-135.5	-91	0	0	0	114	V64 L65 F70 P73	V64-Y68 PolarHBondContact O-N 3.38Å; L65-Y68 WeakPolarHBondContact O-CA 3.45Å; L65-Y68 WeakPolarHBondContact O-CB 3.08Å; L65-Y68 PolarHBondContact O-N 3.02Å; Y68-F70 PolarHBondContact O-N 3.23Å; Y68-P73 HydrophobicContact CE1-CG 3.8Å; Y68-P73 WeakPolarHBondContact OH-CG 3.33Å
69	E	32.2	Very low	32.7	Very low	180 Å²	180	121.2 Å²	121.2	84%	0.841	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.5	-2.8	177	-127.7	-177.2	-174.4	0	0	113.7	L65	L65-E69 PolarHBondContact O-N 2.7Å
70	F	31.8	Very low	32.6	Very low	178 Å²	178	125.3 Å²	125.3	78%	0.781	67%	0.666	S	S	*	*	S	Bend	trans	-101.1	104.1	168.7	-88.4	-89.8	0	0	0	111.6	Y68	Y68-F70 PolarHBondContact O-N 3.23Å
71	E	30.4	Very low	32.2	Very low	165 Å²	165	125.5 Å²	125.5	77%	0.771	68%	0.679	S	S	*	*	S	Bend	trans	67	98.5	154.6	-55.9	-169.9	172.7	0	0	118.6
72	S	29	Very low	32.3	Very low	105 Å²	105	122.2 Å²	122.2	73%	0.734	67%	0.674	S	S	*	*			trans	13.9	102.8	151.9	61.2	0	0	0	0	118.3	I74	S72-I74 PolarHBondContact O-N 3.35Å
73	P	29.5	Very low	32.4	Very low	88 Å²	88	122 Å²	122	57%	0.571	67%	0.674	S	S	*	*			trans	-79.4	117.9	178.5	15.8	-7.2	0	0	0	112.3	Y68 G75	Y68-P73 HydrophobicContact CE1-CG 3.8Å; Y68-P73 WeakPolarHBondContact OH-CG 3.33Å; P73-G75 PolarHBondContact O-N 3.42Å
74	I	33.1	Very low	32.5	Very low	129 Å²	129	119.5 Å²	119.5	66%	0.662	68%	0.675	S	S	*	*			trans	-80.4	94.2	165.5	-61.5	170	0	0	0	107	S72	S72-I74 PolarHBondContact O-N 3.35Å
75	G	28.4	Very low	32.5	Very low	61 Å²	61	120.1 Å²	120.1	63%	0.629	68%	0.681	S	S	*	*			trans	32.3	106.9	163.9	0	0	0	0	0	119.9	P73	P73-G75 PolarHBondContact O-N 3.42Å
76	V	28.4	Very low	32.6	Very low	116 Å²	116	118.1 Å²	118.1	70%	0.703	67%	0.671	S	S	*	*			trans	-112.9	125.2	163	178.4	0	0	0	0	108	V78	V76-V78 HydrophobicContact CG1-CG2 4.25Å
77	I	29.8	Very low	32.8	Very low	145 Å²	145	116.7 Å²	116.7	74%	0.744	66%	0.663	S	S	*	*			trans	-107.6	115.6	173.3	-63	177.9	0	0	0	108.4
78	V	28	Very low	33.2	Very low	124 Å²	124	114.9 Å²	114.9	75%	0.752	65%	0.654	S	S	*	*			trans	-95.6	117.6	173	-179	0	0	0	0	107.9	V76	V76-V78 HydrophobicContact CG1-CG2 4.25Å
79	S	26.3	Very low	33.7	Very low	91 Å²	91	108.5 Å²	108.5	64%	0.636	63%	0.63	S	S	*	*			trans	-105.6	107.7	-176.6	158.7	0	0	0	0	110.4	G81	S79-G81 PolarHBondContact O-N 3.46Å
80	M	28.6	Very low	34.3	Very low	193 Å²	193	104 Å²	104	95%	0.951	61%	0.611	S	S	*	*			trans	-80.8	103.8	168.3	-68	-129.1	-81.9	0	0	110.1
81	G	28.2	Very low	34.5	Very low	72 Å²	72	98.5 Å²	98.5	74%	0.742	59%	0.592	S	S	*	*			trans	-170.9	102.5	172.8	0	0	0	0	0	107.9	S79	S79-G81 PolarHBondContact O-N 3.46Å
82	G	41.1	Very low	34.9	Very low	54 Å²	54	94.7 Å²	94.7	56%	0.557	58%	0.576	S	S	*	*			trans	-153.6	177	-167.4	0	0	0	0	0	112.5	T84 P85	G82-T84 PolarHBondContact O-N 3.48Å; G82-P85 WeakPolarHBondContact O-CD 3.37Å
83	Q	37.6	Very low	35.6	Very low	147 Å²	147	95.5 Å²	95.5	69%	0.687	57%	0.568	S	S	*	*	S	Bend	trans	-52.7	-9.1	-159.5	-63.2	-163.6	-13.7	0	0	119.2	N86 N87	Q83-N86 PolarHBondContact O-N 3.06Å; Q83-N87 PolarHBondContact O-N 3.19Å; Q83-N87 VanDerWaalsContact O-N 3.13Å; Q83-N87 PolarHBondContact OE1-ND2 3.09Å; Q83-N87 VanDerWaalsContact OE1-ND2 3.12Å
84	T	38.6	Very low	36.5	Very low	100 Å²	100	100.9 Å²	100.9	61%	0.613	58%	0.577	S	S	*	*	H	α-helix	trans	-58.5	-40.4	-169.4	-24.3	0	0	0	0	113.9	G82 I88	G82-T84 PolarHBondContact O-N 3.48Å; T84-I88 HydrophobicContact CG2-CD1 3.8Å; T84-I88 WeakPolarHBondContact O-CB 3.32Å; T84-I88 WeakPolarHBondContact O-CD1 3.48Å; T84-I88 WeakPolarHBondContact O-CG1 3.4Å; T84-I88 PolarHBondContact O-N 3.17Å; T84-I88 VanDerWaalsContact O-N 3.11Å
85	P	38.5	Very low	37	Very low	82 Å²	82	101.3 Å²	101.3	53%	0.532	58%	0.579	S	S	.	*	H	α-helix	trans	-67.7	-39.1	179.9	-21.7	33.9	0	0	0	113.8	G82 A89	G82-P85 WeakPolarHBondContact O-CD 3.37Å; P85-A89 WeakPolarHBondContact O-CA 3.37Å; P85-A89 WeakPolarHBondContact O-CB 2.91Å; P85-A89 PolarHBondContact O-N 2.9Å
86	N	41.5	Very low	37.4	Very low	51 Å²	51	101.4 Å²	101.4	27%	0.273	58%	0.58	S	S	.	*	H	α-helix	trans	-79.3	-36.8	-177.3	-148.4	7.7	0	0	0	111.9	Q83 I88 A89 M90 I107	Q83-N86 PolarHBondContact O-N 3.06Å; N86-I88 PolarHBondContact O-N 3.3Å; N86-A89 PolarHBondContact O-N 3Å; N86-M90 PolarHBondContact O-N 3.05Å; N86-I107 HydrophobicContact CB-CG2 4.23Å
87	N	40.5	Very low	37.6	Very low	100 Å²	100	99 Å²	99	54%	0.535	57%	0.566	S	S	.	*	H	α-helix	trans	-69.5	-20.5	174.7	-72	-11.1	0	0	0	112.7	Q83 P91	Q83-N87 PolarHBondContact O-N 3.19Å; Q83-N87 VanDerWaalsContact O-N 3.13Å; Q83-N87 PolarHBondContact OE1-ND2 3.09Å; Q83-N87 VanDerWaalsContact OE1-ND2 3.12Å; N87-P91 WeakPolarHBondContact O-CD 3.45Å; N87-P91 WeakPolarHBondContact O-CG 3.45Å
88	I	41.2	Very low	37.8	Very low	88 Å²	88	97.4 Å²	97.4	45%	0.451	57%	0.565	S	S	.	*	H	α-helix	trans	-90	-42	169.7	-66.1	173	0	0	0	110.6	T84 N86 P91 M92	T84-I88 HydrophobicContact CG2-CD1 3.8Å; T84-I88 WeakPolarHBondContact O-CB 3.32Å; T84-I88 WeakPolarHBondContact O-CD1 3.48Å; T84-I88 WeakPolarHBondContact O-CG1 3.4Å; T84-I88 PolarHBondContact O-N 3.17Å; T84-I88 VanDerWaalsContact O-N 3.11Å; N86-I88 PolarHBondContact O-N 3.3Å; I88-P91 WeakPolarHBondContact O-CD 3.28Å; I88-M92 HydrophobicContact CG2-CE 3.96Å; I88-M92 HydrophobicContact CG2-CG 3.84Å; I88-M92 WeakPolarHBondContact O-CB 3.38Å; I88-M92 WeakPolarHBondContact O-CG 3.4Å; I88-M92 PolarHBondContact O-N 3.1Å
89	A	44.4	Very low	38.6	Very low	9 Å²	9	94.5 Å²	94.5	7%	0.074	55%	0.545	C	S	.	.	H	α-helix	trans	-68.6	-41	-175.1	0	0	0	0	0	113.4	P85 N86 H93 I99 A104 I107	P85-A89 WeakPolarHBondContact O-CA 3.37Å; P85-A89 WeakPolarHBondContact O-CB 2.91Å; P85-A89 PolarHBondContact O-N 2.9Å; N86-A89 PolarHBondContact O-N 3Å; A89-H93 WeakPolarHBondContact O-CB 3.27Å; A89-H93 PolarHBondContact O-N 3.21Å; A89-I99 HydrophobicContact CB-CD1 3.74Å; A89-I99 WeakPolarHBondContact O-CD1 3.24Å; A89-A104 HydrophobicContact CB-CB 4.39Å; A89-I107 HydrophobicContact CB-CD1 4.42Å
90	M	45.8	Very low	39.2	Very low	87 Å²	87	98.5 Å²	98.5	43%	0.429	56%	0.558	S	S	.	*	H	α-helix	trans	-65.3	-45.5	178.9	-102	-136.7	178.7	0	0	112.9	N86 R94 A104	N86-M90 PolarHBondContact O-N 3.05Å; M90-R94 WeakPolarHBondContact O-CB 3.43Å; M90-R94 WeakPolarHBondContact O-CG 3.44Å; M90-R94 PolarHBondContact O-N 2.93Å; M90-R94 PolarHBondContact SD-NH2 3.47Å; M90-A104 HydrophobicContact CG-CB 4.1Å
91	P	35	Very low	40.3	Very low	61 Å²	61	92.9 Å²	92.9	40%	0.396	55%	0.55	S	S	.	.	H	α-helix	trans	-66.4	-42.5	174	-25.1	36.7	0	0	0	113	N87 I88 H93 R94 L95	N87-P91 WeakPolarHBondContact O-CD 3.45Å; N87-P91 WeakPolarHBondContact O-CG 3.45Å; I88-P91 WeakPolarHBondContact O-CD 3.28Å; P91-H93 VanDerWaalsContact C-N 3.31Å; P91-H93 PolarHBondContact O-N 3.4Å; P91-R94 CarbonylContact O-C 3.54Å; P91-R94 PolarHBondContact O-N 3.15Å; P91-L95 VanDerWaalsContact O-CB 3.26Å; P91-L95 WeakPolarHBondContact O-CB 3.35Å; P91-L95 VanDerWaalsContact O-CG 3.23Å; P91-L95 WeakPolarHBondContact O-CG 3.3Å; P91-L95 PolarHBondContact O-N 2.88Å
92	M	39.1	Very low	41.2	Very low	85 Å²	85	93.6 Å²	93.6	42%	0.419	54%	0.539	S	S	.	.	H	α-helix	trans	-59.1	-42.9	176.2	-71.1	-104.3	179.5	0	0	111	I88 L95 G96 V97 I99	I88-M92 HydrophobicContact CG2-CE 3.96Å; I88-M92 HydrophobicContact CG2-CG 3.84Å; I88-M92 WeakPolarHBondContact O-CB 3.38Å; I88-M92 WeakPolarHBondContact O-CG 3.4Å; I88-M92 PolarHBondContact O-N 3.1Å; M92-L95 PolarHBondContact O-N 3.38Å; M92-G96 PolarHBondContact O-N 3.02Å; M92-V97 HydrophobicContact CB-CB 4.18Å; M92-V97 WeakPolarHBondContact O-CA 3.44Å; M92-V97 WeakPolarHBondContact O-CB 3.26Å; M92-V97 PolarHBondContact O-N 3.23Å; M92-V97 HydrophobicContact SD-CB 4.06Å; M92-V97 HydrophobicContact SD-CG1 3.75Å; M92-V97 HydrophobicContact SD-CG2 4.34Å; M92-I99 HydrophobicContact CB-CD1 3.97Å; M92-I99 HydrophobicContact CB-CG1 4.08Å
93	H	44.3	Very low	41.9	Very low	122 Å²	122	93.3 Å²	93.3	57%	0.565	53%	0.529	S	S	*	.	H	α-helix	trans	-66.5	-41.1	174.4	-171.3	-74.8	0	0	0	112.6	A89 P91 L95 G96 I99	A89-H93 WeakPolarHBondContact O-CB 3.27Å; A89-H93 PolarHBondContact O-N 3.21Å; P91-H93 VanDerWaalsContact C-N 3.31Å; P91-H93 PolarHBondContact O-N 3.4Å; H93-L95 VanDerWaalsContact C-N 3.32Å; H93-L95 PolarHBondContact O-N 2.92Å; H93-G96 PolarHBondContact O-N 3.39Å; H93-I99 HydrophobicContact CB-CD1 3.99Å
94	R	49.1	Very low	42.5	Very low	201 Å²	201	86.8 Å²	86.8	76%	0.758	50%	0.5	S	S	*	.	H	α-helix	trans	-69	-28.2	175.8	-75.3	-177.4	-161	175	7.1	113.2	M90 P91 G96	M90-R94 WeakPolarHBondContact O-CB 3.43Å; M90-R94 WeakPolarHBondContact O-CG 3.44Å; M90-R94 PolarHBondContact O-N 2.93Å; M90-R94 PolarHBondContact SD-NH2 3.47Å; P91-R94 CarbonylContact O-C 3.54Å; P91-R94 PolarHBondContact O-N 3.15Å; R94-G96 PolarHBondContact O-N 2.96Å
95	L	42.4	Very low	43.6	Very low	138 Å²	138	88.5 Å²	88.5	72%	0.723	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	5.2	175.6	-70.2	168.5	0	0	0	112.6	P91 M92 H93 V97	P91-L95 VanDerWaalsContact O-CB 3.26Å; P91-L95 WeakPolarHBondContact O-CB 3.35Å; P91-L95 VanDerWaalsContact O-CG 3.23Å; P91-L95 WeakPolarHBondContact O-CG 3.3Å; P91-L95 PolarHBondContact O-N 2.88Å; M92-L95 PolarHBondContact O-N 3.38Å; H93-L95 VanDerWaalsContact C-N 3.32Å; H93-L95 PolarHBondContact O-N 2.92Å; L95-V97 HydrophobicContact CB-CG2 4.23Å; L95-V97 PolarHBondContact O-N 3.35Å
96	G	36.6	Very low	44.6	Very low	63 Å²	63	87.3 Å²	87.3	65%	0.649	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	69	15	-180	0	0	0	0	0	113.8	M92 H93 R94 P98	M92-G96 PolarHBondContact O-N 3.02Å; H93-G96 PolarHBondContact O-N 3.39Å; R94-G96 PolarHBondContact O-N 2.96Å; G96-P98 WeakPolarHBondContact O-CD 3.3Å
97	V	33.8	Very low	45	Very low	65 Å²	65	86.6 Å²	86.6	39%	0.394	49%	0.491	S	S	.	.			trans	-76.3	117.9	173.7	-176.8	0	0	0	0	107.8	M92 L95 I99	M92-V97 HydrophobicContact CB-CB 4.18Å; M92-V97 WeakPolarHBondContact O-CA 3.44Å; M92-V97 WeakPolarHBondContact O-CB 3.26Å; M92-V97 PolarHBondContact O-N 3.23Å; M92-V97 HydrophobicContact SD-CB 4.06Å; M92-V97 HydrophobicContact SD-CG1 3.75Å; M92-V97 HydrophobicContact SD-CG2 4.34Å; L95-V97 HydrophobicContact CB-CG2 4.23Å; L95-V97 PolarHBondContact O-N 3.35Å; V97-I99 PolarHBondContact O-N 3.35Å
98	P	32.7	Very low	45.7	Very low	113 Å²	113	84.7 Å²	84.7	73%	0.734	48%	0.48	S	S	*	.			trans	-65.2	118.9	179.7	24.1	-30.7	0	0	0	110	G96 L100	G96-P98 WeakPolarHBondContact O-CD 3.3Å; P98-L100 PolarHBondContact O-N 3.34Å
99	I	45.6	Very low	46.6	Very low	62 Å²	62	82.4 Å²	82.4	32%	0.318	47%	0.469	S	S	.	.			trans	-87.3	108.7	176.8	-56.9	179.6	0	0	0	108	A89 M92 H93 V97 G101	A89-I99 HydrophobicContact CB-CD1 3.74Å; A89-I99 WeakPolarHBondContact O-CD1 3.24Å; M92-I99 HydrophobicContact CB-CD1 3.97Å; M92-I99 HydrophobicContact CB-CG1 4.08Å; H93-I99 HydrophobicContact CB-CD1 3.99Å; V97-I99 PolarHBondContact O-N 3.35Å; I99-G101 PolarHBondContact O-N 3Å
100	L	37.8	Very low	47	Very low	176 Å²	176	85 Å²	85	92%	0.921	49%	0.49	S	S	*	.	S	Bend	trans	-75	114.6	171.5	-71.9	162.1	0	0	0	108.8	P98	P98-L100 PolarHBondContact O-N 3.34Å
101	G	52.9	Low	47	Very low	75 Å²	75	85.4 Å²	85.4	77%	0.773	49%	0.491	S	S	*	.	S	Bend	trans	133.2	-99.2	176.9	0	0	0	0	0	112.8	I99	I99-G101 PolarHBondContact O-N 3Å
102	T	47.5	Very low	47.8	Very low	86 Å²	86	83.1 Å²	83.1	53%	0.528	48%	0.476	S	S	.	.			trans	-125.4	132.1	-169.7	-56.2	0	0	0	0	110.6	S106 I107	T102-S106 VanDerWaalsContact CG2-CB 3.44Å; T102-I107 HydrophobicContact CG2-CG1 4.36Å
103	S	55.3	Low	48.7	Very low	48 Å²	48	83.3 Å²	83.3	34%	0.336	47%	0.472	S	S	.	.			trans	-67.6	149.7	-179.6	79.7	0	0	0	0	111.6	E105 S106 I107	S103-E105 PolarHBondContact O-N 3.08Å; S103-E105 VanDerWaalsContact O-N 3.16Å; S103-S106 WeakPolarHBondContact O-CB 3.38Å; S103-S106 PolarHBondContact O-N 2.78Å; S103-S106 PolarHBondContact OG-N 2.79Å; S103-S106 PolarHBondContact OG-OG 2.86Å; S103-I107 PolarHBondContact O-N 3.44Å
104	A	50.8	Low	49.2	Very low	10 Å²	10	82.8 Å²	82.8	8%	0.083	47%	0.468	C	S	.	.	H	α-helix	trans	-57.2	-29.5	174.4	0	0	0	0	0	112.4	A89 M90 I107 D108	A89-A104 HydrophobicContact CB-CB 4.39Å; M90-A104 HydrophobicContact CG-CB 4.1Å; A104-I107 PolarHBondContact O-N 2.93Å; A104-D108 PolarHBondContact O-N 3.36Å
105	E	60	Low	49.7	Very low	137 Å²	137	76.9 Å²	76.9	64%	0.64	45%	0.448	S	S	*	.	H	α-helix	trans	-70.8	-35.7	175.1	-165.2	174.2	-164	0	0	112.2	S103 I107 D108 N109	S103-E105 PolarHBondContact O-N 3.08Å; S103-E105 VanDerWaalsContact O-N 3.16Å; E105-I107 VanDerWaalsContact C-N 3.3Å; E105-I107 PolarHBondContact O-N 2.75Å; E105-D108 PolarHBondContact O-N 3.16Å; E105-N109 WeakPolarHBondContact O-CB 3.33Å; E105-N109 VanDerWaalsContact O-CG 3.25Å; E105-N109 PolarHBondContact O-N 3.15Å; E105-N109 PolarHBondContact O-ND2 2.8Å
106	S	60	Low	50.7	Low	56 Å²	56	74.2 Å²	74.2	39%	0.392	43%	0.431	S	S	.	.	H	α-helix	trans	-65.3	-33.9	173.3	-55.9	0	0	0	0	112	T102 S103 A110	T102-S106 VanDerWaalsContact CG2-CB 3.44Å; S103-S106 WeakPolarHBondContact O-CB 3.38Å; S103-S106 PolarHBondContact O-N 2.78Å; S103-S106 PolarHBondContact OG-N 2.79Å; S103-S106 PolarHBondContact OG-OG 2.86Å; S106-A110 PolarHBondContact O-N 2.97Å
107	I	50.7	Low	51.9	Low	36 Å²	36	72 Å²	72	19%	0.185	41%	0.406	C	S	.	.	H	α-helix	trans	-65.6	-47.7	173.8	-60.8	174.3	0	0	0	110	N86 A89 T102 S103 A104 E105 A110 E111	N86-I107 HydrophobicContact CB-CG2 4.23Å; A89-I107 HydrophobicContact CB-CD1 4.42Å; T102-I107 HydrophobicContact CG2-CG1 4.36Å; S103-I107 PolarHBondContact O-N 3.44Å; A104-I107 PolarHBondContact O-N 2.93Å; E105-I107 VanDerWaalsContact C-N 3.3Å; E105-I107 PolarHBondContact O-N 2.75Å; I107-A110 PolarHBondContact O-N 2.92Å; I107-E111 HydrophobicContact CG2-CG 4.32Å; I107-E111 WeakPolarHBondContact O-CB 3.34Å; I107-E111 WeakPolarHBondContact O-CG 3.49Å; I107-E111 PolarHBondContact O-N 3.41Å; I107-E111 VanDerWaalsContact O-N 3.08Å
108	D	54.6	Low	53.2	Low	60 Å²	60	78.1 Å²	78.1	32%	0.321	42%	0.421	S	S	.	.	H	α-helix	trans	-66.7	-36.8	179	-178.5	37.9	0	0	0	113.4	A104 E105 A110 E111 N112 K115	A104-D108 PolarHBondContact O-N 3.36Å; E105-D108 PolarHBondContact O-N 3.16Å; D108-A110 VanDerWaalsContact C-N 3.3Å; D108-A110 PolarHBondContact O-N 3.12Å; D108-E111 PolarHBondContact O-N 2.92Å; D108-N112 WeakPolarHBondContact O-CB 3.32Å; D108-N112 PolarHBondContact O-N 2.92Å; D108-N112 VanDerWaalsContact O-N 3.08Å; D108-K115 IonicContact OD1-NZ 2.99Å; D108-K115 IonicContact OD2-NZ 2.83Å; D108-K115 PolarHBondContact OD2-NZ 2.9Å
109	N	60.2	Low	54.4	Low	40 Å²	40	76.2 Å²	76.2	21%	0.214	41%	0.405	C	S	.	.	H	α-helix	trans	-67	-28.9	175.2	-74.9	-28.2	0	0	0	113.2	E105 F116 L119	E105-N109 WeakPolarHBondContact O-CB 3.33Å; E105-N109 VanDerWaalsContact O-CG 3.25Å; E105-N109 PolarHBondContact O-N 3.15Å; E105-N109 PolarHBondContact O-ND2 2.8Å; N109-F116 WeakPolarHBondContact O-CA 3.49Å; N109-F116 WeakPolarHBondContact O-CB 3.45Å; N109-F116 PolarHBondContact O-N 2.89Å; N109-L119 HydrophobicContact CB-CD1 4.31Å
110	A	52.5	Low	54.9	Low	63 Å²	63	74.5 Å²	74.5	52%	0.521	40%	0.396	S	S	.	.	H	α-helix	trans	-79.4	-34	174.2	0	0	0	0	0	112.6	S106 I107 D108	S106-A110 PolarHBondContact O-N 2.97Å; I107-A110 PolarHBondContact O-N 2.92Å; D108-A110 VanDerWaalsContact C-N 3.3Å; D108-A110 PolarHBondContact O-N 3.12Å
111	E	45.6	Very low	55.9	Low	96 Å²	96	71.7 Å²	71.7	45%	0.449	38%	0.382	S	S	.	.	H	α-helix	trans	-82.6	-34.4	-173.4	-71.1	-101.1	150.2	0	0	113.7	I107 D108 R113	I107-E111 HydrophobicContact CG2-CG 4.32Å; I107-E111 WeakPolarHBondContact O-CB 3.34Å; I107-E111 WeakPolarHBondContact O-CG 3.49Å; I107-E111 PolarHBondContact O-N 3.41Å; I107-E111 VanDerWaalsContact O-N 3.08Å; D108-E111 PolarHBondContact O-N 2.92Å; E111-R113 PolarHBondContact O-N 2.78Å
112	N	52.4	Low	56.1	Low	14 Å²	14	73.4 Å²	73.4	8%	0.075	38%	0.381	C	S	.	.			trans	-87.2	107.2	-179.2	179.5	-36.9	0	0	0	110.1	D108 F114 K115 F116 Y156	D108-N112 WeakPolarHBondContact O-CB 3.32Å; D108-N112 PolarHBondContact O-N 2.92Å; D108-N112 VanDerWaalsContact O-N 3.08Å; N112-F114 PolarHBondContact O-N 3.44Å; N112-F114 VanDerWaalsContact O-N 3.13Å; N112-F114 WeakPolarHBondContact OD1-CA 3.46Å; N112-F114 WeakPolarHBondContact OD1-CB 3.47Å; N112-F114 PolarHBondContact OD1-N 2.83Å; N112-K115 HydrophobicContact CB-CB 3.88Å; N112-K115 HydrophobicContact CB-CD 3.91Å; N112-K115 HydrophobicContact CB-CG 3.86Å; N112-K115 CarbonylContact O-C 3.53Å; N112-K115 WeakPolarHBondContact O-CA 3.34Å; N112-K115 WeakPolarHBondContact O-CB 3.35Å; N112-K115 PolarHBondContact O-N 2.75Å; N112-K115 PolarHBondContact OD1-N 2.82Å; N112-F116 WeakPolarHBondContact O-CB 3.44Å; N112-F116 PolarHBondContact O-N 3.07Å; N112-Y156 PolarHBondContact ND2-OH 2.92Å
113	R	57.1	Low	56.2	Low	89 Å²	89	74.5 Å²	74.5	34%	0.336	38%	0.382	S	S	.	.	H	α-helix	trans	-57.5	-30.9	-176.5	-103.6	-169.5	-178.9	-161.1	-1.1	114.2	E111 S117	E111-R113 PolarHBondContact O-N 2.78Å; R113-S117 WeakPolarHBondContact O-CB 3.44Å; R113-S117 PolarHBondContact O-N 2.8Å
114	F	55.7	Low	55.7	Low	110 Å²	110	75.5 Å²	75.5	48%	0.482	40%	0.4	S	S	.	.	H	α-helix	trans	-68.8	-43	172.1	-101.6	-80.5	0	0	0	111.2	N112 R118 W130	N112-F114 PolarHBondContact O-N 3.44Å; N112-F114 VanDerWaalsContact O-N 3.13Å; N112-F114 WeakPolarHBondContact OD1-CA 3.46Å; N112-F114 WeakPolarHBondContact OD1-CB 3.47Å; N112-F114 PolarHBondContact OD1-N 2.83Å; F114-R118 WeakPolarHBondContact O-CB 3.48Å; F114-R118 PolarHBondContact O-N 2.88Å; F114-W130 HydrophobicContact CE2-CH2 4.06Å; F114-W130 HydrophobicContact CZ-CH2 4.02Å
115	K	60.3	Low	55	Low	78 Å²	78	79.5 Å²	79.5	34%	0.339	42%	0.42	S	S	.	.	H	α-helix	trans	-66.3	-42	174	-66.4	-176.1	-179.2	-174	0	111.6	D108 N112 R118 L119	D108-K115 IonicContact OD1-NZ 2.99Å; D108-K115 IonicContact OD2-NZ 2.83Å; D108-K115 PolarHBondContact OD2-NZ 2.9Å; N112-K115 HydrophobicContact CB-CB 3.88Å; N112-K115 HydrophobicContact CB-CD 3.91Å; N112-K115 HydrophobicContact CB-CG 3.86Å; N112-K115 CarbonylContact O-C 3.53Å; N112-K115 WeakPolarHBondContact O-CA 3.34Å; N112-K115 WeakPolarHBondContact O-CB 3.35Å; N112-K115 PolarHBondContact O-N 2.75Å; N112-K115 PolarHBondContact OD1-N 2.82Å; K115-R118 CarbonylContact O-C 3.48Å; K115-R118 PolarHBondContact O-N 3.02Å; K115-L119 VanDerWaalsContact O-CB 3.29Å; K115-L119 WeakPolarHBondContact O-CB 3.33Å; K115-L119 PolarHBondContact O-N 3.06Å
116	F	63.4	Low	54.4	Low	82 Å²	82	78.7 Å²	78.7	36%	0.36	43%	0.429	S	S	.	.	H	α-helix	trans	-65.5	-42.1	177	-169.6	-112.1	0	0	0	111.7	N109 N112 L119 L120	N109-F116 WeakPolarHBondContact O-CA 3.49Å; N109-F116 WeakPolarHBondContact O-CB 3.45Å; N109-F116 PolarHBondContact O-N 2.89Å; N112-F116 WeakPolarHBondContact O-CB 3.44Å; N112-F116 PolarHBondContact O-N 3.07Å; F116-L119 WeakPolarHBondContact O-CB 3.33Å; F116-L119 PolarHBondContact O-N 2.94Å; F116-L120 HydrophobicContact CD1-CD1 3.76Å; F116-L120 HydrophobicContact CD1-CG 4.37Å; F116-L120 HydrophobicContact CE1-CD1 3.57Å; F116-L120 HydrophobicContact CE1-CG 4.18Å; F116-L120 HydrophobicContact CZ-CD1 4.24Å; F116-L120 HydrophobicContact CZ-CD2 4.49Å; F116-L120 HydrophobicContact CZ-CG 4.41Å; F116-L120 WeakPolarHBondContact O-CB 3.06Å; F116-L120 VanDerWaalsContact O-CG 3.27Å; F116-L120 WeakPolarHBondContact O-CG 3.32Å; F116-L120 PolarHBondContact O-N 3.43Å
117	S	60.9	Low	54	Low	17 Å²	17	78.3 Å²	78.3	12%	0.119	42%	0.421	C	S	.	.	H	α-helix	trans	-64.1	-44	172.7	171.3	0	0	0	0	111.3	R113 L119 L120 D121 Q127	R113-S117 WeakPolarHBondContact O-CB 3.44Å; R113-S117 PolarHBondContact O-N 2.8Å; S117-L119 VanDerWaalsContact C-N 3.29Å; S117-L119 PolarHBondContact O-N 3.14Å; S117-L120 PolarHBondContact O-N 2.63Å; S117-D121 PolarHBondContact O-N 2.89Å; S117-Q127 PolarHBondContact OG-OE1 2.83Å
118	R	61.6	Low	54.3	Low	192 Å²	192	81.7 Å²	81.7	73%	0.725	45%	0.446	S	S	*	.	H	α-helix	trans	-61	-38.7	171.2	-115.9	-179.4	178	164.4	0	112	F114 K115 D121 C122	F114-R118 WeakPolarHBondContact O-CB 3.48Å; F114-R118 PolarHBondContact O-N 2.88Å; K115-R118 CarbonylContact O-C 3.48Å; K115-R118 PolarHBondContact O-N 3.02Å; R118-D121 PolarHBondContact O-N 3.21Å; R118-C122 VanDerWaalsContact O-CB 3.24Å; R118-C122 WeakPolarHBondContact O-CB 3.43Å; R118-C122 PolarHBondContact O-N 2.91Å; R118-C122 PolarHBondContact O-SG 2.81Å
119	L	57.8	Low	54.4	Low	74 Å²	74	87.9 Å²	87.9	39%	0.387	46%	0.464	S	S	.	.	H	α-helix	trans	-64.3	-45.5	178	-148.8	90.4	0	0	0	109.8	N109 K115 F116 S117 C122 I123	N109-L119 HydrophobicContact CB-CD1 4.31Å; K115-L119 VanDerWaalsContact O-CB 3.29Å; K115-L119 WeakPolarHBondContact O-CB 3.33Å; K115-L119 PolarHBondContact O-N 3.06Å; F116-L119 WeakPolarHBondContact O-CB 3.33Å; F116-L119 PolarHBondContact O-N 2.94Å; S117-L119 VanDerWaalsContact C-N 3.29Å; S117-L119 PolarHBondContact O-N 3.14Å; L119-C122 PolarHBondContact O-N 3.26Å; L119-I123 VanDerWaalsContact O-CG1 3.23Å; L119-I123 WeakPolarHBondContact O-CG1 3.41Å; L119-I123 PolarHBondContact O-N 2.75Å
120	L	55.2	Low	54.5	Low	26 Å²	26	90.6 Å²	90.6	14%	0.136	47%	0.472	C	S	.	.	H	α-helix	trans	-61.5	-45.6	175.2	-74.7	171.1	0	0	0	111.8	F116 S117 I123 G124 L125 Q127	F116-L120 HydrophobicContact CD1-CD1 3.76Å; F116-L120 HydrophobicContact CD1-CG 4.37Å; F116-L120 HydrophobicContact CE1-CD1 3.57Å; F116-L120 HydrophobicContact CE1-CG 4.18Å; F116-L120 HydrophobicContact CZ-CD1 4.24Å; F116-L120 HydrophobicContact CZ-CD2 4.49Å; F116-L120 HydrophobicContact CZ-CG 4.41Å; F116-L120 WeakPolarHBondContact O-CB 3.06Å; F116-L120 VanDerWaalsContact O-CG 3.27Å; F116-L120 WeakPolarHBondContact O-CG 3.32Å; F116-L120 PolarHBondContact O-N 3.43Å; S117-L120 PolarHBondContact O-N 2.63Å; L120-I123 HydrophobicContact CD2-CD1 4.44Å; L120-I123 CarbonylContact O-C 3.53Å; L120-I123 WeakPolarHBondContact O-CG1 3.46Å; L120-I123 PolarHBondContact O-N 3.19Å; L120-G124 PolarHBondContact O-N 3.09Å; L120-L125 CarbonylContact C-O 3.59Å; L120-L125 HydrophobicContact CB-CB 4.38Å; L120-L125 HydrophobicContact CD2-CB 3.69Å; L120-L125 HydrophobicContact CD2-CD1 3.8Å; L120-L125 HydrophobicContact CD2-CG 4.42Å; L120-L125 PolarHBondContact O-N 2.91Å; L120-Q127 HydrophobicContact CD1-CB 4.36Å; L120-Q127 HydrophobicContact CD1-CG 4.32Å
121	D	59.7	Low	54.6	Low	116 Å²	116	93 Å²	93	62%	0.62	47%	0.47	S	S	*	.	H	α-helix	trans	-63.4	-41.9	174.2	-86.6	-11.1	0	0	0	111.6	S117 R118 I123 G124	S117-D121 PolarHBondContact O-N 2.89Å; R118-D121 PolarHBondContact O-N 3.21Å; D121-I123 PolarHBondContact O-N 3.11Å; D121-G124 PolarHBondContact O-N 2.82Å; D121-G124 VanDerWaalsContact O-N 3.15Å
122	C	57.8	Low	55	Low	112 Å²	112	93.6 Å²	93.6	76%	0.757	47%	0.473	S	S	*	.	H	α-helix	trans	-63.5	-26.8	176.3	-78.6	0	0	0	0	113	R118 L119	R118-C122 VanDerWaalsContact O-CB 3.24Å; R118-C122 WeakPolarHBondContact O-CB 3.43Å; R118-C122 PolarHBondContact O-N 2.91Å; R118-C122 PolarHBondContact O-SG 2.81Å; L119-C122 PolarHBondContact O-N 3.26Å
123	I	48.4	Very low	54.8	Low	108 Å²	108	95.1 Å²	95.1	55%	0.554	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103	10.8	175.8	67.2	-165.7	0	0	0	113.3	L119 L120 D121 L125	L119-I123 VanDerWaalsContact O-CG1 3.23Å; L119-I123 WeakPolarHBondContact O-CG1 3.41Å; L119-I123 PolarHBondContact O-N 2.75Å; L120-I123 HydrophobicContact CD2-CD1 4.44Å; L120-I123 CarbonylContact O-C 3.53Å; L120-I123 WeakPolarHBondContact O-CG1 3.46Å; L120-I123 PolarHBondContact O-N 3.19Å; D121-I123 PolarHBondContact O-N 3.11Å; I123-L125 VanDerWaalsContact C-N 3.31Å; I123-L125 HydrophobicContact CD1-CD1 3.94Å; I123-L125 HydrophobicContact CG1-CB 4.37Å; I123-L125 HydrophobicContact CG1-CD1 4.04Å; I123-L125 HydrophobicContact CG1-CG 4.21Å; I123-L125 PolarHBondContact O-N 3.2Å
124	G	45.2	Very low	54.3	Low	69 Å²	69	96.8 Å²	96.8	71%	0.711	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.9	16.5	173.9	0	0	0	0	0	115.6	L120 D121	L120-G124 PolarHBondContact O-N 3.09Å; D121-G124 PolarHBondContact O-N 2.82Å; D121-G124 VanDerWaalsContact O-N 3.15Å
125	L	35.8	Very low	53.8	Low	95 Å²	95	95.4 Å²	95.4	50%	0.497	50%	0.499	S	S	.	.	P	Polyproline II helix	trans	-92.3	118.1	177.1	-74.8	173.3	0	0	0	110.8	L120 I123	L120-L125 CarbonylContact C-O 3.59Å; L120-L125 HydrophobicContact CB-CB 4.38Å; L120-L125 HydrophobicContact CD2-CB 3.69Å; L120-L125 HydrophobicContact CD2-CD1 3.8Å; L120-L125 HydrophobicContact CD2-CG 4.42Å; L120-L125 PolarHBondContact O-N 2.91Å; I123-L125 VanDerWaalsContact C-N 3.31Å; I123-L125 HydrophobicContact CD1-CD1 3.94Å; I123-L125 HydrophobicContact CG1-CB 4.37Å; I123-L125 HydrophobicContact CG1-CD1 4.04Å; I123-L125 HydrophobicContact CG1-CG 4.21Å; I123-L125 PolarHBondContact O-N 3.2Å
126	S	47.1	Very low	53	Low	119 Å²	119	97.7 Å²	97.7	83%	0.832	51%	0.513	S	S	*	.	P	Polyproline II helix	trans	-73.3	129.6	174.5	62	0	0	0	0	112
127	Q	52.2	Low	52.5	Low	49 Å²	49	99.8 Å²	99.8	23%	0.229	53%	0.529	C	S	.	.	P	Polyproline II helix	trans	-88.3	152	175.9	-166.5	176.1	28.9	0	0	110.8	S117 L120 W130	S117-Q127 PolarHBondContact OG-OE1 2.83Å; L120-Q127 HydrophobicContact CD1-CB 4.36Å; L120-Q127 HydrophobicContact CD1-CG 4.32Å; Q127-W130 VanDerWaalsContact OE1-CD1 3.3Å
128	P	56	Low	51.9	Low	107 Å²	107	100.1 Å²	100.1	70%	0.695	53%	0.531	S	S	*	.	P	Polyproline II helix	trans	-51.9	140.9	169.1	-25	30.6	0	0	0	112	W130	P128-W130 PolarHBondContact O-N 2.82Å
129	R	57.7	Low	51.2	Low	189 Å²	189	92 Å²	92	71%	0.713	50%	0.504	S	S	*	.			trans	-52.2	115.5	177	-75.1	-172.6	-175.9	-177.6	2.4	109.4	F142	R129-F142 HydrophobicContact CB-CZ 4.5Å
130	W	61.7	Low	51	Low	97 Å²	97	93.4 Å²	93.4	37%	0.367	51%	0.507	S	S	.	.			trans	-128.2	148.4	174.3	71.4	-85.7	0	0	0	108.3	F114 Q127 P128 E132	F114-W130 HydrophobicContact CE2-CH2 4.06Å; F114-W130 HydrophobicContact CZ-CH2 4.02Å; Q127-W130 VanDerWaalsContact OE1-CD1 3.3Å; P128-W130 PolarHBondContact O-N 2.82Å; W130-E132 HydrophobicContact CZ3-CB 4.47Å
131	K	55.9	Low	51.3	Low	113 Å²	113	94.7 Å²	94.7	49%	0.491	52%	0.522	S	S	.	.			trans	-136.2	138.1	176.4	-172.6	175.9	-178.9	-179.6	0	107.3	L133 F142	K131-L133 HydrophobicContact CB-CD2 4.2Å; K131-L133 HydrophobicContact CD-CD2 4.23Å; K131-L133 HydrophobicContact CG-CD2 4.22Å; K131-L133 PolarHBondContact O-N 3.02Å; K131-F142 HydrophobicContact CB-CD1 4.23Å; K131-F142 HydrophobicContact CB-CD2 3.74Å; K131-F142 HydrophobicContact CB-CE1 4.04Å; K131-F142 HydrophobicContact CB-CE2 3.52Å; K131-F142 HydrophobicContact CB-CG 4.09Å; K131-F142 HydrophobicContact CB-CZ 3.67Å; K131-F142 HydrophobicContact CD-CD2 3.79Å; K131-F142 HydrophobicContact CD-CE2 4.22Å; K131-F142 HydrophobicContact CD-CG 4.32Å; K131-F142 HydrophobicContact CG-CD2 4.43Å
132	E	52.7	Low	51.2	Low	109 Å²	109	90.5 Å²	90.5	51%	0.509	50%	0.498	S	S	.	.			trans	-71.6	117.3	167.1	-171.9	162.4	-137.8	0	0	107.7	W130 S155	W130-E132 HydrophobicContact CZ3-CB 4.47Å; E132-S155 PolarHBondContact OE1-OG 3.21Å
133	L	47.8	Very low	50.9	Low	47 Å²	47	85.6 Å²	85.6	25%	0.246	47%	0.465	C	S	.	.			trans	-100.5	114.7	-173.3	-59.9	169.1	0	0	0	108.1	K131 S138 A139 F142 V152	K131-L133 HydrophobicContact CB-CD2 4.2Å; K131-L133 HydrophobicContact CD-CD2 4.23Å; K131-L133 HydrophobicContact CG-CD2 4.22Å; K131-L133 PolarHBondContact O-N 3.02Å; L133-S138 WeakPolarHBondContact CD2-O 3.45Å; L133-A139 HydrophobicContact CB-CB 4.2Å; L133-A139 HydrophobicContact CD1-CB 3.74Å; L133-A139 HydrophobicContact CG-CB 4.35Å; L133-F142 HydrophobicContact CD1-CD1 4.29Å; L133-F142 HydrophobicContact CD2-CB 3.62Å; L133-F142 HydrophobicContact CD2-CD1 4.13Å; L133-F142 HydrophobicContact CD2-CG 3.98Å; L133-V152 HydrophobicContact CD1-CG1 4.31Å; L133-V152 HydrophobicContact CD1-CG2 4.24Å
134	T	47.3	Very low	51.5	Low	123 Å²	123	87.1 Å²	87.1	76%	0.755	47%	0.47	S	S	*	.			trans	-90.4	-15.2	-174.6	48	0	0	0	0	113.6
135	D	45.5	Very low	52.1	Low	81 Å²	81	89.8 Å²	89.8	43%	0.433	46%	0.464	S	S	.	.	S	Bend	trans	-156.3	163.8	-177.5	53.7	70.9	0	0	0	111.9	D137 S138 A139	D135-D137 VanDerWaalsContact C-N 3.3Å; D135-D137 PolarHBondContact O-N 2.75Å; D135-D137 PolarHBondContact OD1-N 2.9Å; D135-S138 PolarHBondContact N-OG 3.33Å; D135-S138 PolarHBondContact O-N 2.93Å; D135-S138 PolarHBondContact O-OG 3.1Å; D135-S138 WeakPolarHBondContact OD1-CB 3.47Å; D135-S138 PolarHBondContact OD1-N 3.41Å; D135-S138 PolarHBondContact OD1-OG 3.33Å; D135-S138 PolarHBondContact OD2-OG 2.67Å; D135-A139 PolarHBondContact O-N 3.29Å
136	I	43.6	Very low	53.3	Low	126 Å²	126	88.4 Å²	88.4	65%	0.646	46%	0.459	S	S	*	.	H	α-helix	trans	-63.1	-35.1	-176.3	-73.8	171.6	0	0	0	111.8	A139 K140	I136-A139 PolarHBondContact O-N 3Å; I136-K140 WeakPolarHBondContact O-CB 3.24Å; I136-K140 PolarHBondContact O-N 3.01Å
137	D	52.4	Low	53.1	Low	127 Å²	127	84.4 Å²	84.4	68%	0.679	44%	0.437	S	S	*	.	H	α-helix	trans	-71.4	-39.2	-179.2	-71.4	-36.5	0	0	0	111.7	D135 K140 A141	D135-D137 VanDerWaalsContact C-N 3.3Å; D135-D137 PolarHBondContact O-N 2.75Å; D135-D137 PolarHBondContact OD1-N 2.9Å; D137-K140 PolarHBondContact O-N 3.2Å; D137-A141 WeakPolarHBondContact O-CB 3.4Å; D137-A141 PolarHBondContact O-N 2.81Å
138	S	49.2	Very low	52.9	Low	24 Å²	24	87 Å²	87	17%	0.168	45%	0.445	C	S	.	.	H	α-helix	trans	-68.4	-33.3	172.6	54.2	0	0	0	0	112.5	L133 D135 F142	L133-S138 WeakPolarHBondContact CD2-O 3.45Å; D135-S138 PolarHBondContact N-OG 3.33Å; D135-S138 PolarHBondContact O-N 2.93Å; D135-S138 PolarHBondContact O-OG 3.1Å; D135-S138 WeakPolarHBondContact OD1-CB 3.47Å; D135-S138 PolarHBondContact OD1-N 3.41Å; D135-S138 PolarHBondContact OD1-OG 3.33Å; D135-S138 PolarHBondContact OD2-OG 2.67Å; S138-F142 WeakPolarHBondContact O-CB 3.3Å; S138-F142 PolarHBondContact O-N 2.85Å
139	A	46.9	Very low	52.2	Low	20 Å²	20	88.1 Å²	88.1	17%	0.165	45%	0.452	C	S	.	.	H	α-helix	trans	-66	-41.7	170.9	0	0	0	0	0	112.5	L133 D135 I136 F142 C143	L133-A139 HydrophobicContact CB-CB 4.2Å; L133-A139 HydrophobicContact CD1-CB 3.74Å; L133-A139 HydrophobicContact CG-CB 4.35Å; D135-A139 PolarHBondContact O-N 3.29Å; I136-A139 PolarHBondContact O-N 3Å; A139-F142 PolarHBondContact O-N 3.44Å; A139-C143 WeakPolarHBondContact O-CB 3.49Å; A139-C143 PolarHBondContact O-N 3.33Å
140	K	52.5	Low	51.5	Low	104 Å²	104	81.1 Å²	81.1	45%	0.452	43%	0.432	S	S	.	.	H	α-helix	trans	-62.9	-49.2	175.9	-142.4	-179.5	-174.4	-174.8	0	111.1	I136 D137 F142 C143 E144	I136-K140 WeakPolarHBondContact O-CB 3.24Å; I136-K140 PolarHBondContact O-N 3.01Å; D137-K140 PolarHBondContact O-N 3.2Å; K140-F142 VanDerWaalsContact C-N 3.34Å; K140-F142 PolarHBondContact O-N 3.03Å; K140-C143 PolarHBondContact O-N 3.26Å; K140-E144 WeakPolarHBondContact O-CG 3.42Å; K140-E144 PolarHBondContact O-N 3.47Å
141	A	61.4	Low	50.8	Low	54 Å²	54	81.7 Å²	81.7	45%	0.446	44%	0.442	S	S	.	.	H	α-helix	trans	-61.2	-39.8	176.9	0	0	0	0	0	112.3	D137 E145	D137-A141 WeakPolarHBondContact O-CB 3.4Å; D137-A141 PolarHBondContact O-N 2.81Å; A141-E145 VanDerWaalsContact O-CB 3.32Å; A141-E145 WeakPolarHBondContact O-CB 3.39Å; A141-E145 PolarHBondContact O-N 3.07Å
142	F	57.9	Low	50.2	Low	27 Å²	27	81 Å²	81	12%	0.118	45%	0.447	C	S	.	.	H	α-helix	trans	-70.8	-42.5	176.9	-171.5	-111.3	0	0	0	112.2	R129 K131 L133 S138 A139 K140 E144 E145 V146	R129-F142 HydrophobicContact CB-CZ 4.5Å; K131-F142 HydrophobicContact CB-CD1 4.23Å; K131-F142 HydrophobicContact CB-CD2 3.74Å; K131-F142 HydrophobicContact CB-CE1 4.04Å; K131-F142 HydrophobicContact CB-CE2 3.52Å; K131-F142 HydrophobicContact CB-CG 4.09Å; K131-F142 HydrophobicContact CB-CZ 3.67Å; K131-F142 HydrophobicContact CD-CD2 3.79Å; K131-F142 HydrophobicContact CD-CE2 4.22Å; K131-F142 HydrophobicContact CD-CG 4.32Å; K131-F142 HydrophobicContact CG-CD2 4.43Å; L133-F142 HydrophobicContact CD1-CD1 4.29Å; L133-F142 HydrophobicContact CD2-CB 3.62Å; L133-F142 HydrophobicContact CD2-CD1 4.13Å; L133-F142 HydrophobicContact CD2-CG 3.98Å; S138-F142 WeakPolarHBondContact O-CB 3.3Å; S138-F142 PolarHBondContact O-N 2.85Å; A139-F142 PolarHBondContact O-N 3.44Å; K140-F142 VanDerWaalsContact C-N 3.34Å; K140-F142 PolarHBondContact O-N 3.03Å; F142-E144 VanDerWaalsContact C-N 3.31Å; F142-E144 PolarHBondContact O-N 3.1Å; F142-E145 PolarHBondContact O-N 2.87Å; F142-E145 VanDerWaalsContact O-N 3.11Å; F142-V146 HydrophobicContact CD1-CG2 3.95Å; F142-V146 HydrophobicContact CD2-CG2 3.82Å; F142-V146 HydrophobicContact CE1-CG2 3.64Å; F142-V146 HydrophobicContact CE2-CG2 3.51Å; F142-V146 HydrophobicContact CG-CG2 4.04Å; F142-V146 HydrophobicContact CZ-CG2 3.42Å; F142-V146 VanDerWaalsContact CZ-CG2 3.42Å; F142-V146 WeakPolarHBondContact O-CG2 3.24Å; F142-V146 PolarHBondContact O-N 3.45Å
143	C	52.9	Low	49.8	Very low	9 Å²	9	83.2 Å²	83.2	6%	0.061	45%	0.451	C	S	.	.	H	α-helix	trans	-63.1	-35.8	174.6	-78	0	0	0	0	112.5	A139 K140 G147 Y148 C150	A139-C143 WeakPolarHBondContact O-CB 3.49Å; A139-C143 PolarHBondContact O-N 3.33Å; K140-C143 PolarHBondContact O-N 3.26Å; C143-G147 WeakPolarHBondContact O-CA 3.31Å; C143-G147 PolarHBondContact O-N 3.44Å; C143-Y148 HydrophobicContact CB-CE1 4Å; C143-C150 HydrophobicContact CB-CB 3.95Å; C143-C150 WeakPolarHBondContact CB-SG 3.34Å; C143-C150 WeakPolarHBondContact SG-CB 3.14Å; C143-C150 CovalentContact SG-SG 2.05Å; C143-C150 PolarHBondContact SG-SG 3.2Å
144	E	59.2	Low	49.4	Very low	140 Å²	140	84.9 Å²	84.9	65%	0.654	46%	0.464	S	S	*	.	H	α-helix	trans	-66.9	-35.7	170.6	-76.3	178.8	177.8	0	0	112.3	K140 F142	K140-E144 WeakPolarHBondContact O-CG 3.42Å; K140-E144 PolarHBondContact O-N 3.47Å; F142-E144 VanDerWaalsContact C-N 3.31Å; F142-E144 PolarHBondContact O-N 3.1Å
145	E	59	Low	49	Very low	125 Å²	125	81 Å²	81	58%	0.584	44%	0.442	S	S	*	.	H	α-helix	trans	-72.5	-38.9	178	-167.5	-174.3	175	0	0	113.3	A141 F142	A141-E145 VanDerWaalsContact O-CB 3.32Å; A141-E145 WeakPolarHBondContact O-CB 3.39Å; A141-E145 PolarHBondContact O-N 3.07Å; F142-E145 PolarHBondContact O-N 2.87Å; F142-E145 VanDerWaalsContact O-N 3.11Å
146	V	59.9	Low	48.3	Very low	66 Å²	66	82.9 Å²	82.9	40%	0.4	44%	0.444	S	S	.	.	H	α-helix	trans	-91.1	-20.6	-176.5	-163.3	0	0	0	0	112.5	F142	F142-V146 HydrophobicContact CD1-CG2 3.95Å; F142-V146 HydrophobicContact CD2-CG2 3.82Å; F142-V146 HydrophobicContact CE1-CG2 3.64Å; F142-V146 HydrophobicContact CE2-CG2 3.51Å; F142-V146 HydrophobicContact CG-CG2 4.04Å; F142-V146 HydrophobicContact CZ-CG2 3.42Å; F142-V146 VanDerWaalsContact CZ-CG2 3.42Å; F142-V146 WeakPolarHBondContact O-CG2 3.24Å; F142-V146 PolarHBondContact O-N 3.45Å
147	G	44.5	Very low	48.3	Very low	35 Å²	35	81.5 Å²	81.5	36%	0.361	44%	0.441	S	S	.	.			trans	80.6	153.3	-175.1	0	0	0	0	0	113.1	C143	C143-G147 WeakPolarHBondContact O-CA 3.31Å; C143-G147 PolarHBondContact O-N 3.44Å
148	Y	47.6	Very low	47.7	Very low	104 Å²	104	81.8 Å²	81.8	41%	0.408	44%	0.442	S	S	.	.	S	Bend	trans	-81.9	143.5	177.9	-64.6	-80.5	0	0	0	111.3	C143 I182	C143-Y148 HydrophobicContact CB-CE1 4Å; Y148-I182 HydrophobicContact CE1-CG2 3.86Å; Y148-I182 HydrophobicContact CE2-CG2 4.45Å; Y148-I182 WeakPolarHBondContact OH-CG2 3.07Å
149	P	40.9	Very low	46.7	Very low	130 Å²	130	84 Å²	84	84%	0.844	46%	0.457	S	S	*	.	S	Bend	cis	-81.1	130.8	4.7	30.8	-33.1	0	0	0	113.6
150	C	42.9	Very low	45.7	Very low	43 Å²	43	87.2 Å²	87.2	29%	0.291	49%	0.493	S	S	.	.			trans	-105.1	145.8	172	65.3	0	0	0	0	110.8	C143	C143-C150 HydrophobicContact CB-CB 3.95Å; C143-C150 WeakPolarHBondContact CB-SG 3.34Å; C143-C150 WeakPolarHBondContact SG-CB 3.14Å; C143-C150 CovalentContact SG-SG 2.05Å; C143-C150 PolarHBondContact SG-SG 3.2Å
151	L	46.5	Very low	44.4	Very low	108 Å²	108	86.5 Å²	86.5	57%	0.565	51%	0.506	S	S	*	.			trans	-120.8	103.7	-172.2	-169.9	81.7	0	0	0	110.4	R153	L151-R153 VanDerWaalsContact CD2-CZ 3.47Å; L151-R153 VanDerWaalsContact CD2-NE 3.34Å; L151-R153 HydrophobicContact CG-CG 4.23Å
152	V	44.7	Very low	42.6	Very low	100 Å²	100	86.5 Å²	86.5	61%	0.606	51%	0.506	S	S	*	.			trans	-92.7	119	-179	-175.1	0	0	0	0	109.6	L133	L133-V152 HydrophobicContact CD1-CG1 4.31Å; L133-V152 HydrophobicContact CD1-CG2 4.24Å
153	R	44.4	Very low	41.1	Very low	155 Å²	155	93.1 Å²	93.1	59%	0.585	54%	0.54	S	S	*	.			trans	-143.8	149.5	-178	-63.8	-175	-178.6	179.4	2.4	111.2	L151	L151-R153 VanDerWaalsContact CD2-CZ 3.47Å; L151-R153 VanDerWaalsContact CD2-NE 3.34Å; L151-R153 HydrophobicContact CG-CG 4.23Å
154	P	38.9	Very low	39.9	Very low	82 Å²	82	99.8 Å²	99.8	53%	0.532	58%	0.575	S	S	.	*			trans	-61.7	150.9	173.8	-21.4	32.8	0	0	0	114.1	Y156 A162	P154-Y156 VanDerWaalsContact C-N 3.31Å; P154-Y156 PolarHBondContact O-N 3.45Å; P154-A162 HydrophobicContact CB-CB 4.49Å; P154-A162 HydrophobicContact CG-CB 4.03Å
155	S	39	Very low	38.6	Very low	40 Å²	40	97.6 Å²	97.6	28%	0.28	57%	0.57	S	S	.	*	S	Bend	trans	-67.1	-20.5	-171	-36.2	0	0	0	0	115	E132	E132-S155 PolarHBondContact OE1-OG 3.21Å
156	Y	30.2	Very low	37.2	Very low	122 Å²	122	93 Å²	93	48%	0.478	55%	0.554	S	S	.	*	S	Bend	trans	-117.8	129	173.1	-88.8	-99.3	0	0	0	109.4	N112 P154 L158 S159	N112-Y156 PolarHBondContact ND2-OH 2.92Å; P154-Y156 VanDerWaalsContact C-N 3.31Å; P154-Y156 PolarHBondContact O-N 3.45Å; Y156-L158 VanDerWaalsContact C-N 3.29Å; Y156-L158 PolarHBondContact O-N 3.22Å; Y156-S159 WeakPolarHBondContact CB-OG 3.37Å
157	V	43.9	Very low	35.8	Very low	97 Å²	97	96.4 Å²	96.4	59%	0.588	57%	0.57	S	S	*	*	S	Bend	trans	-70.6	-23.7	-169.5	-179.2	0	0	0	0	112.8
158	L	38.7	Very low	35.5	Very low	132 Å²	132	98.5 Å²	98.5	69%	0.691	57%	0.573	S	S	*	*	S	Bend	trans	-138.3	17.9	-171	-83.4	162.2	0	0	0	115.9	Y156	Y156-L158 VanDerWaalsContact C-N 3.29Å; Y156-L158 PolarHBondContact O-N 3.22Å
159	S	28.1	Very low	35.1	Very low	70 Å²	70	98.7 Å²	98.7	49%	0.49	58%	0.577	S	S	.	*			trans	-89	108.7	168.7	61.4	0	0	0	0	110.2	Y156 A161	Y156-S159 WeakPolarHBondContact CB-OG 3.37Å; S159-A161 PolarHBondContact O-N 3.11Å
160	G	26.2	Very low	35.1	Very low	89 Å²	89	97.7 Å²	97.7	92%	0.918	57%	0.565	S	S	*	*	S	Bend	trans	-65.1	37.7	179.8	0	0	0	0	0	116.3
161	A	25.9	Very low	34.9	Very low	89 Å²	89	100.7 Å²	100.7	74%	0.736	58%	0.575	S	S	*	*			trans	-125.2	45.8	-177.4	0	0	0	0	0	112	S159	S159-A161 PolarHBondContact O-N 3.11Å
162	A	24.3	Very low	34.7	Very low	53 Å²	53	96.7 Å²	96.7	44%	0.438	55%	0.554	S	S	.	*			trans	-104.6	94	172.9	0	0	0	0	0	111	P154	P154-A162 HydrophobicContact CB-CB 4.49Å; P154-A162 HydrophobicContact CG-CB 4.03Å
163	M	26.2	Very low	35	Very low	167 Å²	167	93.6 Å²	93.6	82%	0.823	53%	0.533	S	S	*	.			trans	45.7	105.3	153.4	-70.1	-177	80.7	0	0	119.5	V165	M163-V165 HydrophobicContact CB-CG2 4.25Å; M163-V165 HydrophobicContact CE-CG2 4.11Å; M163-V165 PolarHBondContact O-N 3.21Å
164	N	26.9	Very low	35.2	Very low	149 Å²	149	90.6 Å²	90.6	80%	0.797	53%	0.532	S	S	*	.			trans	-57	59.7	163.2	-77	-24.7	0	0	0	114.5
165	V	31.7	Very low	35.5	Very low	93 Å²	93	91.8 Å²	91.8	56%	0.564	53%	0.529	S	S	*	.			trans	-117.1	70.6	176.3	-168.8	0	0	0	0	110	M163	M163-V165 HydrophobicContact CB-CG2 4.25Å; M163-V165 HydrophobicContact CE-CG2 4.11Å; M163-V165 PolarHBondContact O-N 3.21Å
166	A	29.6	Very low	36	Very low	29 Å²	29	90.4 Å²	90.4	24%	0.24	52%	0.519	C	S	.	.			trans	179.4	55.8	148	0	0	0	0	0	111.1	D168 L172	A166-D168 PolarHBondContact O-N 2.94Å; A166-L172 HydrophobicContact CB-CB 4.2Å; A166-L172 HydrophobicContact CB-CD1 4.33Å
167	N	31.3	Very low	37.1	Very low	138 Å²	138	87.3 Å²	87.3	74%	0.738	51%	0.513	S	S	*	.	S	Bend	trans	-73.4	8.1	161	-80.3	-5.7	0	0	0	112.2
168	D	38.1	Very low	37.3	Very low	79 Å²	79	85 Å²	85	42%	0.422	50%	0.504	S	S	.	.	S	Bend	trans	-134	116.7	-177.1	-164.1	-12.4	0	0	0	110.2	A166 D170 Q171 L172	A166-D168 PolarHBondContact O-N 2.94Å; D168-D170 PolarHBondContact O-N 3.25Å; D168-D170 PolarHBondContact OD1-N 3.21Å; D168-Q171 HydrophobicContact CB-CB 4.38Å; D168-Q171 HydrophobicContact CB-CG 4.36Å; D168-Q171 PolarHBondContact O-N 2.66Å; D168-Q171 VanDerWaalsContact O-N 3.08Å; D168-L172 PolarHBondContact O-N 2.8Å
169	H	38.2	Very low	37.8	Very low	107 Å²	107	79.2 Å²	79.2	50%	0.495	48%	0.475	S	S	.	.	H	α-helix	trans	-57	-32.4	-179.9	-162.4	68.7	0	0	0	111.1	L172 I173	H169-L172 PolarHBondContact O-N 3.19Å; H169-I173 WeakPolarHBondContact O-CB 3.35Å; H169-I173 VanDerWaalsContact O-CG1 3.23Å; H169-I173 WeakPolarHBondContact O-CG1 3.4Å; H169-I173 PolarHBondContact O-N 3.23Å
170	D	41.9	Very low	38.7	Very low	110 Å²	110	80 Å²	80	59%	0.588	47%	0.47	S	S	*	.	H	α-helix	trans	-71.2	-32.7	178.8	-77.7	-19.1	0	0	0	112.6	D168 T174	D168-D170 PolarHBondContact O-N 3.25Å; D168-D170 PolarHBondContact OD1-N 3.21Å; D170-T174 WeakPolarHBondContact O-CB 3.39Å; D170-T174 PolarHBondContact O-N 2.99Å; D170-T174 PolarHBondContact O-OG1 3.11Å
171	Q	39.3	Very low	40	Very low	106 Å²	106	82 Å²	82	50%	0.495	46%	0.459	S	S	.	.	H	α-helix	trans	-73.4	-39.2	175.1	-76.8	-171.1	-0.6	0	0	112.1	D168 T174 F175	D168-Q171 HydrophobicContact CB-CB 4.38Å; D168-Q171 HydrophobicContact CB-CG 4.36Å; D168-Q171 PolarHBondContact O-N 2.66Å; D168-Q171 VanDerWaalsContact O-N 3.08Å; Q171-T174 PolarHBondContact O-N 3.27Å; Q171-F175 PolarHBondContact O-N 3.42Å
172	L	42.3	Very low	41.2	Very low	24 Å²	24	81.4 Å²	81.4	13%	0.126	44%	0.443	C	S	.	.	H	α-helix	trans	-61.9	-46.3	172.8	-173.5	70.7	0	0	0	110.2	A166 D168 H169 T174 F175 L176	A166-L172 HydrophobicContact CB-CB 4.2Å; A166-L172 HydrophobicContact CB-CD1 4.33Å; D168-L172 PolarHBondContact O-N 2.8Å; H169-L172 PolarHBondContact O-N 3.19Å; L172-T174 VanDerWaalsContact C-N 3.31Å; L172-T174 PolarHBondContact O-N 3.41Å; L172-F175 PolarHBondContact O-N 3.48Å; L172-L176 HydrophobicContact CD1-CD1 4.45Å; L172-L176 HydrophobicContact CD2-CD1 4.39Å; L172-L176 HydrophobicContact CG-CD1 3.87Å; L172-L176 HydrophobicContact CG-CG 4.36Å; L172-L176 VanDerWaalsContact O-CB 3.32Å; L172-L176 WeakPolarHBondContact O-CB 3.33Å; L172-L176 WeakPolarHBondContact O-CG 3.48Å; L172-L176 PolarHBondContact O-N 3.37Å
173	I	49.6	Very low	42.2	Very low	35 Å²	35	80.5 Å²	80.5	18%	0.179	43%	0.433	C	S	.	.	H	α-helix	trans	-59.8	-41.6	174.4	-71.1	170.3	0	0	0	110.8	H169 L176 T177	H169-I173 WeakPolarHBondContact O-CB 3.35Å; H169-I173 VanDerWaalsContact O-CG1 3.23Å; H169-I173 WeakPolarHBondContact O-CG1 3.4Å; H169-I173 PolarHBondContact O-N 3.23Å; I173-L176 PolarHBondContact O-N 3.27Å; I173-T177 WeakPolarHBondContact O-CB 3.09Å; I173-T177 PolarHBondContact O-N 3.15Å; I173-T177 PolarHBondContact O-OG1 2.64Å
174	T	48.8	Very low	43.3	Very low	92 Å²	92	78 Å²	78	56%	0.564	43%	0.43	S	S	*	.	H	α-helix	trans	-64.2	-43.6	178.7	-58	0	0	0	0	111.8	D170 Q171 L172 T177 A178	D170-T174 WeakPolarHBondContact O-CB 3.39Å; D170-T174 PolarHBondContact O-N 2.99Å; D170-T174 PolarHBondContact O-OG1 3.11Å; Q171-T174 PolarHBondContact O-N 3.27Å; L172-T174 VanDerWaalsContact C-N 3.31Å; L172-T174 PolarHBondContact O-N 3.41Å; T174-T177 PolarHBondContact O-N 2.79Å; T174-A178 WeakPolarHBondContact O-CB 3.35Å; T174-A178 PolarHBondContact O-N 3.46Å
175	F	46.4	Very low	44.2	Very low	107 Å²	107	79 Å²	79	47%	0.469	43%	0.43	S	S	.	.	H	α-helix	trans	-64.6	-45.1	175.1	-177.1	-94.7	0	0	0	111.9	Q171 L172 T177 A178 A179 I190	Q171-F175 PolarHBondContact O-N 3.42Å; L172-F175 PolarHBondContact O-N 3.48Å; F175-T177 VanDerWaalsContact C-N 3.32Å; F175-T177 PolarHBondContact O-N 2.91Å; F175-A178 PolarHBondContact O-N 3.06Å; F175-A179 WeakPolarHBondContact O-CB 3.45Å; F175-A179 PolarHBondContact O-N 3Å; F175-I190 HydrophobicContact CE1-CD1 4.33Å; F175-I190 HydrophobicContact CE1-CG2 4.5Å
176	L	47.6	Very low	44.9	Very low	11 Å²	11	80 Å²	80	6%	0.058	43%	0.428	C	S	.	.	H	α-helix	trans	-64.4	-35.8	177	-69.1	173.9	0	0	0	112.2	L27 L30 L172 I173 K180 I190	L27-L176 HydrophobicContact CD2-CD1 3.68Å; L27-L176 HydrophobicContact CD2-CD2 3.64Å; L27-L176 HydrophobicContact CD2-CG 4.21Å; L27-L176 HydrophobicContact CG-CD1 4.42Å; L30-L176 HydrophobicContact CD1-CB 4.14Å; L30-L176 HydrophobicContact CD1-CD1 4.38Å; L172-L176 HydrophobicContact CD1-CD1 4.45Å; L172-L176 HydrophobicContact CD2-CD1 4.39Å; L172-L176 HydrophobicContact CG-CD1 3.87Å; L172-L176 HydrophobicContact CG-CG 4.36Å; L172-L176 VanDerWaalsContact O-CB 3.32Å; L172-L176 WeakPolarHBondContact O-CB 3.33Å; L172-L176 WeakPolarHBondContact O-CG 3.48Å; L172-L176 PolarHBondContact O-N 3.37Å; I173-L176 PolarHBondContact O-N 3.27Å; L176-K180 PolarHBondContact O-N 2.98Å; L176-K180 VanDerWaalsContact O-N 3.08Å; L176-I190 HydrophobicContact CD2-CD1 3.35Å
177	T	53.6	Low	45.6	Very low	57 Å²	57	84 Å²	84	35%	0.35	45%	0.451	S	S	.	.	H	α-helix	trans	-71.1	-41.5	175.4	-55.9	0	0	0	0	111	I173 T174 F175 K180 N181	I173-T177 WeakPolarHBondContact O-CB 3.09Å; I173-T177 PolarHBondContact O-N 3.15Å; I173-T177 PolarHBondContact O-OG1 2.64Å; T174-T177 PolarHBondContact O-N 2.79Å; F175-T177 VanDerWaalsContact C-N 3.32Å; F175-T177 PolarHBondContact O-N 2.91Å; T177-K180 PolarHBondContact O-N 2.65Å; T177-N181 PolarHBondContact O-N 3.49Å; T177-N181 VanDerWaalsContact O-N 3.13Å
178	A	49.7	Very low	46.1	Very low	49 Å²	49	80.4 Å²	80.4	41%	0.405	43%	0.434	S	S	.	.	H	α-helix	trans	-63.7	-43.2	174.2	0	0	0	0	0	111.7	T174 F175 K180 N181 I182	T174-A178 WeakPolarHBondContact O-CB 3.35Å; T174-A178 PolarHBondContact O-N 3.46Å; F175-A178 PolarHBondContact O-N 3.06Å; A178-K180 VanDerWaalsContact C-N 3.33Å; A178-K180 PolarHBondContact O-N 2.96Å; A178-N181 PolarHBondContact O-N 3.26Å; A178-I182 WeakPolarHBondContact O-CG1 3.32Å; A178-I182 PolarHBondContact O-N 3.39Å
179	A	47.6	Very low	46.3	Very low	10 Å²	10	81.7 Å²	81.7	8%	0.083	44%	0.444	C	S	.	.	H	α-helix	trans	-61.6	-39.3	176.1	0	0	0	0	0	112.3	W32 F175 I182	W32-A179 HydrophobicContact CH2-CB 4.24Å; W32-A179 HydrophobicContact CZ2-CB 4.31Å; F175-A179 WeakPolarHBondContact O-CB 3.45Å; F175-A179 PolarHBondContact O-N 3Å; A179-I182 PolarHBondContact O-N 2.84Å
180	K	47.7	Very low	46.4	Very low	86 Å²	86	78.6 Å²	78.6	37%	0.374	43%	0.431	S	S	.	.	H	α-helix	trans	-65	-37.1	175	-171.8	179.9	178.1	-177.5	0	112.8	L30 W32 L176 T177 A178 I182	L30-K180 WeakPolarHBondContact O-CE 3.3Å; L30-K180 PolarHBondContact O-NZ 3.33Å; W32-K180 HydrophobicContact CZ2-CB 4.14Å; L176-K180 PolarHBondContact O-N 2.98Å; L176-K180 VanDerWaalsContact O-N 3.08Å; T177-K180 PolarHBondContact O-N 2.65Å; A178-K180 VanDerWaalsContact C-N 3.33Å; A178-K180 PolarHBondContact O-N 2.96Å; K180-I182 VanDerWaalsContact C-N 3.25Å; K180-I182 PolarHBondContact O-N 2.9Å
181	N	53.7	Low	46.2	Very low	132 Å²	132	80 Å²	80	71%	0.706	43%	0.432	S	S	*	.	H	α-helix	trans	-71.3	-18.1	177.9	-74.9	-18.1	0	0	0	113.4	T177 A178	T177-N181 PolarHBondContact O-N 3.49Å; T177-N181 VanDerWaalsContact O-N 3.13Å; A178-N181 PolarHBondContact O-N 3.26Å
182	I	51.7	Low	46	Very low	76 Å²	76	78.8 Å²	78.8	39%	0.39	43%	0.432	S	S	.	.	H	α-helix	trans	-75.3	-35.3	-179.8	-71.1	167.3	0	0	0	111.8	Y148 A178 A179 K180	Y148-I182 HydrophobicContact CE1-CG2 3.86Å; Y148-I182 HydrophobicContact CE2-CG2 4.45Å; Y148-I182 WeakPolarHBondContact OH-CG2 3.07Å; A178-I182 WeakPolarHBondContact O-CG1 3.32Å; A178-I182 PolarHBondContact O-N 3.39Å; A179-I182 PolarHBondContact O-N 2.84Å; K180-I182 VanDerWaalsContact C-N 3.25Å; K180-I182 PolarHBondContact O-N 2.9Å
183	S	44.9	Very low	45.6	Very low	33 Å²	33	85.2 Å²	85.2	23%	0.231	46%	0.455	C	S	.	.			trans	-166	116.4	166.2	-179	0	0	0	0	111.4	E185	S183-E185 PolarHBondContact O-N 3.13Å
184	P	48.5	Very low	44.9	Very low	115 Å²	115	90.6 Å²	90.6	75%	0.747	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-20	178.3	-20.1	31.5	0	0	0	114.8
185	E	47.1	Very low	44.1	Very low	171 Å²	171	88.4 Å²	88.4	80%	0.799	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.2	-2.9	-168.5	-61.5	-154.1	163.3	0	0	114.5	S183	S183-E185 PolarHBondContact O-N 3.13Å
186	H	46.2	Very low	43.4	Very low	114 Å²	114	91.8 Å²	91.8	53%	0.528	49%	0.49	S	S	.	.	S	Bend	trans	-120.7	134.7	-176.3	-66.5	-27.9	0	0	0	113.2	V188	H186-V188 PolarHBondContact O-N 3.07Å
187	P	43.3	Very low	42.4	Very low	113 Å²	113	94 Å²	94	73%	0.734	50%	0.501	S	S	*	.	P	Polyproline II helix	trans	-67.5	118.7	-176.9	25.5	-31.9	0	0	0	111.2
188	V	41.5	Very low	41.2	Very low	61 Å²	61	98 Å²	98	37%	0.37	52%	0.52	S	S	.	.	P	Polyproline II helix	trans	-94.7	127.9	169.6	-174	0	0	0	0	108.7	W32 H186 I190	W32-V188 HydrophobicContact CH2-CB 3.74Å; W32-V188 HydrophobicContact CH2-CG2 3.99Å; W32-V188 HydrophobicContact CZ3-CB 3.71Å; W32-V188 HydrophobicContact CZ3-CG2 4.17Å; H186-V188 PolarHBondContact O-N 3.07Å; V188-I190 HydrophobicContact CG1-CD1 4.36Å; V188-I190 HydrophobicContact CG1-CG1 4.01Å
189	V	43.8	Very low	40.2	Very low	106 Å²	106	107.4 Å²	107.4	64%	0.642	55%	0.545	S	S	*	.	P	Polyproline II helix	trans	-94.9	119.1	178	-179.8	0	0	0	0	109.2
190	I	39.2	Very low	39.2	Very low	43 Å²	43	112.3 Å²	112.3	22%	0.221	57%	0.57	C	S	.	*			trans	-120.7	126.3	-176.6	-56	-180	0	0	0	108.9	W32 F175 L176 V188 V192	W32-I190 HydrophobicContact CH2-CD1 4.41Å; F175-I190 HydrophobicContact CE1-CD1 4.33Å; F175-I190 HydrophobicContact CE1-CG2 4.5Å; L176-I190 HydrophobicContact CD2-CD1 3.35Å; V188-I190 HydrophobicContact CG1-CD1 4.36Å; V188-I190 HydrophobicContact CG1-CG1 4.01Å; I190-V192 HydrophobicContact CG2-CG2 4.28Å
191	K	38.6	Very low	38.1	Very low	139 Å²	139	118.6 Å²	118.6	60%	0.604	59%	0.591	S	S	*	*			trans	-103.6	124.2	174.2	-83.7	-174.6	170.4	-169.5	0	109.4	Y193	K191-Y193 HydrophobicContact CB-CE2 4.21Å
192	V	35.2	Very low	36.9	Very low	80 Å²	80	115.7 Å²	115.7	49%	0.485	59%	0.592	S	S	.	*			trans	-111.6	132.2	179.4	-176.3	0	0	0	0	108.9	I190	I190-V192 HydrophobicContact CG2-CG2 4.28Å
193	Y	33.6	Very low	35.7	Very low	159 Å²	159	119.6 Å²	119.6	62%	0.624	61%	0.609	S	S	*	*			trans	-120.8	145.4	178.2	-68.7	-85.1	0	0	0	110.1	K191	K191-Y193 HydrophobicContact CB-CE2 4.21Å
194	N	34.2	Very low	34.7	Very low	149 Å²	149	127.8 Å²	127.8	80%	0.797	64%	0.64	S	S	*	*			trans	51.6	76.4	164.3	-97.2	5.1	0	0	0	117.3
195	C	31.3	Very low	33.6	Very low	45 Å²	45	128.5 Å²	128.5	30%	0.304	64%	0.638	S	S	.	*			trans	-111.6	104.3	173.2	-145.1	0	0	0	0	110.8	C19 L197	C19-C195 HydrophobicContact CB-CB 3.9Å; C19-C195 VanDerWaalsContact SG-CB 3.52Å; C19-C195 PolarHBondContact SG-SG 3.4Å; C195-L197 PolarHBondContact O-N 2.85Å
196	E	31.5	Very low	32.6	Very low	179 Å²	179	126 Å²	126	84%	0.836	63%	0.634	S	S	*	*			trans	-69.6	120.3	-179.2	-74.4	-179.4	160.8	0	0	111.8	D198	E196-D198 PolarHBondContact O-N 3.37Å
197	L	27.6	Very low	31.6	Very low	57 Å²	57	127.5 Å²	127.5	30%	0.298	65%	0.646	S	S	.	*			trans	-92.7	10.1	-166.8	-146.2	110.1	0	0	0	115.8	W18 C19 C195 R199 L200	W18-L197 HydrophobicContact CB-CD1 3.87Å; W18-L197 HydrophobicContact CB-CD2 3.59Å; W18-L197 HydrophobicContact CB-CG 4.39Å; W18-L197 HydrophobicContact CG-CD2 4.38Å; C19-L197 VanDerWaalsContact CA-CD1 3.47Å; C19-L197 HydrophobicContact CB-CD1 3.38Å; C195-L197 PolarHBondContact O-N 2.85Å; L197-R199 PolarHBondContact O-N 3.41Å; L197-L200 PolarHBondContact O-N 3.07Å
198	D	28.4	Very low	30.6	Very low	141 Å²	141	133.2 Å²	133.2	75%	0.754	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.1	-7.2	-168.6	-103.5	-21.9	0	0	0	114.6	E196	E196-D198 PolarHBondContact O-N 3.37Å
199	R	29.7	Very low	29.8	Very low	246 Å²	246	140 Å²	140	93%	0.928	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.5	-7.1	-177.3	-84.3	-175.8	172.8	169.9	0	117.3	L197	L197-R199 PolarHBondContact O-N 3.41Å
200	L	26.5	Very low	29	Very low	114 Å²	114	139.1 Å²	139.1	60%	0.597	68%	0.676	S	S	*	*	S	Bend	trans	-98.3	-0.8	-177.2	-79	164.4	0	0	0	115	L197 G202	L197-L200 PolarHBondContact O-N 3.07Å; L200-G202 PolarHBondContact O-N 3.35Å
201	R	24.7	Very low	28.3	Very low	218 Å²	218	145.9 Å²	145.9	82%	0.823	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65	-3.2	177.3	-91.5	-177.5	169.3	165.7	0.4	115.3
202	G	27.3	Very low	27.6	Very low	70 Å²	70	151 Å²	151	72%	0.722	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.8	-3.7	-169.9	0	0	0	0	0	117.9	L200	L200-G202 PolarHBondContact O-N 3.35Å
203	Q	26.9	Very low	27.4	Very low	159 Å²	159	152.2 Å²	152.2	74%	0.743	72%	0.724	S	S	*	*			trans	-130.2	5.8	-161.9	-81.4	-167.2	-7.6	0	0	119.4
204	F	23.9	Very low	27.2	Very low	204 Å²	204	152.4 Å²	152.4	90%	0.895	73%	0.728	S	S	*	*			trans	-107.6	82.3	170.5	-71.1	-74.4	0	0	0	110.8
205	D	25.7	Very low	27	Very low	130 Å²	130	150.8 Å²	150.8	70%	0.695	72%	0.72	S	S	*	*			trans	-57.1	127	177.2	-166.4	-3.4	0	0	0	111.3	N207	D205-N207 PolarHBondContact O-N 2.84Å
206	T	25.3	Very low	27.1	Very low	118 Å²	118	151.5 Å²	151.5	72%	0.724	73%	0.728	S	S	*	*	S	Bend	trans	-37	94.3	155.1	41.2	0	0	0	0	112.8
207	N	25.1	Very low	27	Very low	146 Å²	146	148.3 Å²	148.3	78%	0.781	72%	0.716	S	S	*	*			trans	-179.1	73.7	151.9	-88.9	-33.7	0	0	0	112.7	D205	D205-N207 PolarHBondContact O-N 2.84Å
208	Y	22	Very low	27.1	Very low	234 Å²	234	149.9 Å²	149.9	92%	0.918	72%	0.724	S	S	*	*			trans	-137.4	83.4	160.4	-114.7	-94.5	0	0	0	110.3
209	K	25.4	Very low	27.3	Very low	202 Å²	202	145.2 Å²	145.2	88%	0.878	71%	0.705	S	S	*	*			trans	-99.4	124.9	153.5	-70	172.2	175.5	172.1	0	104.1
210	P	27	Very low	27.3	Very low	89 Å²	89	137.7 Å²	137.7	58%	0.578	69%	0.687	S	S	*	*				-145.6	166.6	74.5	22.1	4.4	0	0	0	110.2
211	F	24.2	Very low	27.4	Very low	184 Å²	184	137.4 Å²	137.4	81%	0.807	69%	0.685	S	S	*	*				-161	110.1	68.4	-87.7	-89.6	0	0	0	108.2	D213	F211-D213 PolarHBondContact O-N 2.87Å
212	R	25	Very low	27.6	Very low	247 Å²	247	129.5 Å²	129.5	93%	0.932	66%	0.663	S	S	*	*			trans	-68.3	109.1	147.4	-80.4	175.4	165.3	177.9	-5.8	105.9
213	D	30.4	Very low	27.6	Very low	106 Å²	106	131.6 Å²	131.6	57%	0.567	66%	0.658	S	S	*	*			trans	-150.1	76.2	144.9	-134.2	-17.6	0	0	0	109	F211 D215 A216	F211-D213 PolarHBondContact O-N 2.87Å; D213-D215 PolarHBondContact O-N 2.94Å; D213-D215 VanDerWaalsContact O-N 3.14Å; D213-A216 PolarHBondContact O-N 3.42Å; D213-A216 VanDerWaalsContact O-N 3.12Å
214	F	29	Very low	27.6	Very low	163 Å²	163	129.6 Å²	129.6	72%	0.715	65%	0.651	S	S	*	*	H	α-helix	trans	-62	-14	176.8	-152.4	-103.3	0	0	0	111.2	I218	F214-I218 WeakPolarHBondContact O-CG1 3.31Å; F214-I218 PolarHBondContact O-N 3.22Å
215	D	30.9	Very low	27.7	Very low	115 Å²	115	130.4 Å²	130.4	62%	0.615	65%	0.648	S	S	*	*	H	α-helix	trans	-81.6	-21.8	176.1	-66.6	-32.4	0	0	0	113.2	D213 I218 A219	D213-D215 PolarHBondContact O-N 2.94Å; D213-D215 VanDerWaalsContact O-N 3.14Å; D215-I218 PolarHBondContact O-N 3.09Å; D215-A219 WeakPolarHBondContact O-CB 3.34Å; D215-A219 PolarHBondContact O-N 3.28Å
216	A	33.1	Very low	27.8	Very low	59 Å²	59	131.9 Å²	131.9	49%	0.488	65%	0.651	S	S	.	*	H	α-helix	trans	-71.9	-35.5	174	0	0	0	0	0	111.9	D213 A219 V220	D213-A216 PolarHBondContact O-N 3.42Å; D213-A216 VanDerWaalsContact O-N 3.12Å; A216-A219 PolarHBondContact O-N 3.13Å; A216-V220 WeakPolarHBondContact O-CG2 3.44Å; A216-V220 PolarHBondContact O-N 3.36Å; A216-V220 VanDerWaalsContact O-N 3.17Å
217	L	28.8	Very low	27.6	Very low	112 Å²	112	132.6 Å²	132.6	59%	0.586	65%	0.65	S	S	*	*	H	α-helix	trans	-73.7	-34.5	175.5	-160.6	73.9	0	0	0	111.4	V220 L221	L217-V220 PolarHBondContact O-N 3.28Å; L217-L221 WeakPolarHBondContact O-CG 3.16Å; L217-L221 PolarHBondContact O-N 2.9Å
218	I	30.7	Very low	27.6	Very low	91 Å²	91	130.3 Å²	130.3	47%	0.467	64%	0.642	S	S	.	*	H	α-helix	trans	-70.5	-30.2	171.3	-64.8	-132.7	0	0	0	111.3	F214 D215 L221 S222	F214-I218 WeakPolarHBondContact O-CG1 3.31Å; F214-I218 PolarHBondContact O-N 3.22Å; D215-I218 PolarHBondContact O-N 3.09Å; I218-L221 PolarHBondContact O-N 3.12Å; I218-S222 WeakPolarHBondContact O-CA 3.5Å; I218-S222 WeakPolarHBondContact O-CB 3.28Å; I218-S222 PolarHBondContact O-N 3.15Å; I218-S222 PolarHBondContact O-OG 3.25Å
219	A	31.3	Very low	27.7	Very low	43 Å²	43	126 Å²	126	36%	0.355	64%	0.64	S	S	.	*	H	α-helix	trans	-67.4	-37.5	173.4	0	0	0	0	0	112.3	D215 A216 S222 N223	D215-A219 WeakPolarHBondContact O-CB 3.34Å; D215-A219 PolarHBondContact O-N 3.28Å; A216-A219 PolarHBondContact O-N 3.13Å; A219-S222 WeakPolarHBondContact CA-OG 3.36Å; A219-S222 PolarHBondContact O-OG 2.94Å; A219-N223 WeakPolarHBondContact O-CB 3.35Å; A219-N223 PolarHBondContact O-N 3.27Å; A219-N223 PolarHBondContact O-ND2 2.93Å
220	V	30	Very low	27.7	Very low	88 Å²	88	121.5 Å²	121.5	53%	0.533	63%	0.63	S	S	.	*	H	α-helix	trans	-71.1	-39.7	175.2	176.8	0	0	0	0	111.1	A216 L217 I224	A216-V220 WeakPolarHBondContact O-CG2 3.44Å; A216-V220 PolarHBondContact O-N 3.36Å; A216-V220 VanDerWaalsContact O-N 3.17Å; L217-V220 PolarHBondContact O-N 3.28Å; V220-I224 WeakPolarHBondContact O-CG1 3.29Å; V220-I224 PolarHBondContact O-N 2.86Å
221	L	27.9	Very low	27.6	Very low	107 Å²	107	120.8 Å²	120.8	56%	0.56	64%	0.638	S	S	*	*	H	α-helix	trans	-75.5	-24.8	176.5	-69.8	170.7	0	0	0	113.7	L217 I218 R225	L217-L221 WeakPolarHBondContact O-CG 3.16Å; L217-L221 PolarHBondContact O-N 2.9Å; I218-L221 PolarHBondContact O-N 3.12Å; L221-R225 PolarHBondContact O-N 3.01Å
222	S	29.9	Very low	27.7	Very low	53 Å²	53	116 Å²	116	37%	0.371	63%	0.628	S	S	.	*	H	α-helix	trans	-83.7	-27	175.7	55.4	0	0	0	0	112.7	I218 A219 R225	I218-S222 WeakPolarHBondContact O-CA 3.5Å; I218-S222 WeakPolarHBondContact O-CB 3.28Å; I218-S222 PolarHBondContact O-N 3.15Å; I218-S222 PolarHBondContact O-OG 3.25Å; A219-S222 WeakPolarHBondContact CA-OG 3.36Å; A219-S222 PolarHBondContact O-OG 2.94Å; S222-R225 PolarHBondContact O-N 3.41Å
223	N	27.2	Very low	27.7	Very low	113 Å²	113	108.2 Å²	108.2	60%	0.604	62%	0.624	S	S	*	*	H	α-helix	trans	-76	-23.3	170.6	-76.7	-27.1	0	0	0	113.6	A219 R225 Q226	A219-N223 WeakPolarHBondContact O-CB 3.35Å; A219-N223 PolarHBondContact O-N 3.27Å; A219-N223 PolarHBondContact O-ND2 2.93Å; N223-R225 VanDerWaalsContact C-N 3.27Å; N223-Q226 PolarHBondContact O-N 3.45Å
224	I	27.2	Very low	27.5	Very low	117 Å²	117	110.6 Å²	110.6	60%	0.6	63%	0.632	S	S	*	*	H	α-helix	trans	-75.7	-19.4	169.2	-64.7	171.4	0	0	0	111.4	V220 Q226	V220-I224 WeakPolarHBondContact O-CG1 3.29Å; V220-I224 PolarHBondContact O-N 2.86Å; I224-Q226 VanDerWaalsContact C-N 3.34Å
225	R	25.6	Very low	27.6	Very low	222 Å²	222	107 Å²	107	84%	0.838	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.9	1.7	173.7	-82.8	-173.3	172.1	-176.9	-0.9	114.9	L221 S222 N223	L221-R225 PolarHBondContact O-N 3.01Å; S222-R225 PolarHBondContact O-N 3.41Å; N223-R225 VanDerWaalsContact C-N 3.27Å
226	Q	26.8	Very low	27.7	Very low	161 Å²	161	107 Å²	107	75%	0.752	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.1	15.9	175.6	-70.2	-167.5	-2.2	0	0	114.1	N223 I224	N223-Q226 PolarHBondContact O-N 3.45Å; I224-Q226 VanDerWaalsContact C-N 3.34Å
227	L	22.7	Very low	27.9	Very low	133 Å²	133	106.7 Å²	106.7	70%	0.696	63%	0.625	S	S	*	*	S	Bend	trans	-70.5	121.8	151.4	-83.6	159.7	0	0	0	106.7	V229	L227-V229 PolarHBondContact O-N 3.44Å
228	P	23.6	Very low	28.4	Very low	97 Å²	97	104.9 Å²	104.9	63%	0.63	62%	0.62	S	S	*	*			trans	-52.9	128.8	-170.4	19.7	-30.3	0	0	0	108.7	V230	P228-V230 HydrophobicContact CG-CG2 4.5Å; P228-V230 PolarHBondContact O-N 3.16Å
229	V	24.2	Very low	29	Very low	143 Å²	143	106.8 Å²	106.8	87%	0.867	64%	0.636	S	S	*	*			trans	-55.6	89	153.3	179.5	0	0	0	0	104.2	L227 G231	L227-V229 PolarHBondContact O-N 3.44Å; V229-G231 PolarHBondContact O-N 3.33Å
230	V	26.1	Very low	29.9	Very low	109 Å²	109	107.2 Å²	107.2	66%	0.661	64%	0.644	S	S	*	*			trans	-62.8	95.2	162.1	178.2	0	0	0	0	102.4	P228 S232	P228-V230 HydrophobicContact CG-CG2 4.5Å; P228-V230 PolarHBondContact O-N 3.16Å; V230-S232 PolarHBondContact O-N 3.35Å
231	G	24.3	Very low	31.4	Very low	73 Å²	73	106.8 Å²	106.8	75%	0.753	64%	0.636	S	S	*	*			trans	-60.6	87.7	163.6	0	0	0	0	0	106.6	V229	V229-G231 PolarHBondContact O-N 3.33Å
232	S	26.9	Very low	33.6	Very low	85 Å²	85	103.5 Å²	103.5	59%	0.594	62%	0.622	S	S	*	*			trans	-118.5	101.1	152	52.7	0	0	0	0	104.4	V230 E234	V230-S232 PolarHBondContact O-N 3.35Å; S232-E234 VanDerWaalsContact C-N 3.26Å; S232-E234 PolarHBondContact O-N 2.98Å
233	G	25	Very low	36	Very low	83 Å²	83	101.7 Å²	101.7	86%	0.856	61%	0.61	S	S	*	*			trans	-59.3	94.6	169.1	0	0	0	0	0	108.9
234	E	26.6	Very low	38.9	Very low	156 Å²	156	96.3 Å²	96.3	73%	0.729	58%	0.581	S	S	*	*			trans	-114.7	102.8	153.6	-73.1	-168.1	164.2	0	0	105.2	S232 S236	S232-E234 VanDerWaalsContact C-N 3.26Å; S232-E234 PolarHBondContact O-N 2.98Å; E234-S236 PolarHBondContact O-N 3.29Å
235	S	30.2	Very low	42	Very low	86 Å²	86	90.9 Å²	90.9	60%	0.601	55%	0.554	S	S	*	*			trans	-42.3	117.4	166.9	53.8	0	0	0	0	108.4	M237	S235-M237 PolarHBondContact O-N 3.04Å
236	S	33.2	Very low	45.2	Very low	115 Å²	115	80.3 Å²	80.3	80%	0.804	51%	0.514	S	S	*	.			trans	-50.2	112.7	170	51.6	0	0	0	0	107.3	E234	E234-S236 PolarHBondContact O-N 3.29Å
237	M	37.8	Very low	48.4	Very low	53 Å²	53	73.7 Å²	73.7	26%	0.261	48%	0.484	S	S	.	.			trans	-46.8	139.1	172.7	-78.3	-91	-86.2	0	0	108.2	S235 T239 R349 Y352	S235-M237 PolarHBondContact O-N 3.04Å; M237-T239 HydrophobicContact CB-CG2 3.94Å; M237-T239 PolarHBondContact O-N 3.18Å; M237-R349 PolarHBondContact SD-NH1 2.71Å; M237-Y352 HydrophobicContact CE-CD1 4.27Å; M237-Y352 HydrophobicContact CE-CG 4.13Å; M237-Y352 HydrophobicContact SD-CD1 3.35Å; M237-Y352 WeakPolarHBondContact SD-CD1 3.5Å; M237-Y352 HydrophobicContact SD-CD2 3.99Å; M237-Y352 HydrophobicContact SD-CE1 3.49Å; M237-Y352 WeakPolarHBondContact SD-CE1 3.16Å; M237-Y352 HydrophobicContact SD-CE2 4.11Å; M237-Y352 HydrophobicContact SD-CG 3.61Å
238	P	40	Very low	51.8	Low	75 Å²	75	67.4 Å²	67.4	49%	0.487	45%	0.451	S	S	.	.			trans	-65.8	84.4	161.6	26.6	-29.3	0	0	0	107.1	G240 K262	P238-G240 PolarHBondContact O-N 3.13Å; P238-K262 PolarHBondContact O-NZ 3.19Å
239	T	42.3	Very low	55.1	Low	131 Å²	131	67.2 Å²	67.2	80%	0.804	44%	0.442	S	S	*	.			trans	-71.9	-7.8	179	48.4	0	0	0	0	112.3	M237 E241	M237-T239 HydrophobicContact CB-CG2 3.94Å; M237-T239 PolarHBondContact O-N 3.18Å; T239-E241 PolarHBondContact O-N 2.69Å
240	G	49.6	Very low	58.2	Low	51 Å²	51	63.7 Å²	63.7	53%	0.526	42%	0.418	S	S	.	.	S	Bend	trans	-66.4	118.3	169.9	0	0	0	0	0	110.7	P238 C242 K262	P238-G240 PolarHBondContact O-N 3.13Å; G240-C242 PolarHBondContact O-N 3.03Å; G240-K262 PolarHBondContact O-NZ 3.33Å
241	E	61.3	Low	61.1	Low	79 Å²	79	61.1 Å²	61.1	37%	0.369	41%	0.414	S	S	.	.			trans	-43.4	129.3	159	-71.4	171.6	174.6	0	0	109.2	T239 F257 Y259 R1219	T239-E241 PolarHBondContact O-N 2.69Å; E241-F257 HydrophobicContact CB-CD1 4.36Å; E241-Y259 HydrophobicContact CG-CE1 4.5Å; E241-R1219 VanDerWaalsContact CB-NH2 3.31Å; E241-R1219 PolarHBondContact O-NH1 2.69Å; E241-R1219 PolarHBondContact O-NH2 3.25Å; E241-R1219 IonicContact OE2-NH2 3.31Å; E241-R1219 PolarHBondContact OE2-NH2 3.44Å
242	C	75.2	Confident	64.2	Low	39 Å²	39	59 Å²	59	26%	0.264	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	125.9	177.8	179.7	0	0	0	0	108.2	G240 G244 L258 K262	G240-C242 PolarHBondContact O-N 3.03Å; C242-G244 PolarHBondContact O-N 2.89Å; C242-L258 HydrophobicContact CB-CB 4.26Å; C242-L258 WeakPolarHBondContact O-CB 3.31Å; C242-L258 PolarHBondContact O-N 2.94Å; C242-K262 HydrophobicContact CB-CD 3.98Å
243	A	80.7	Confident	67	Low	14 Å²	14	58.9 Å²	58.9	12%	0.116	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	134.2	179.5	0	0	0	0	0	110.5	L384	A243-L384 HydrophobicContact CB-CD1 3.72Å; A243-L384 HydrophobicContact CB-CG 4.3Å; A243-L384 PolarHBondContact O-N 3.36Å
244	G	88.6	Confident	70.1	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	172.9	-179.5	0	0	0	0	0	113	C242 G256 I382	C242-G244 PolarHBondContact O-N 2.89Å; G244-G256 PolarHBondContact N-O 3.09Å; G244-G256 PolarHBondContact O-N 2.99Å; G244-G256 VanDerWaalsContact O-O 3.07Å; G244-I382 CarbonylContact C-O 3.47Å; G244-I382 VanDerWaalsContact CA-O 3.23Å; G244-I382 WeakPolarHBondContact CA-O 3.5Å
245	A	90.3	Very high	72.9	Confident	3 Å²	3	51.1 Å²	51.1	3%	0.025	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	141.2	178.5	0	0	0	0	0	111.3	I247 V253 F254 I381 I382 L384	A245-I247 HydrophobicContact CB-CG1 4.44Å; A245-V253 HydrophobicContact CB-CG1 3.94Å; A245-F254 WeakPolarHBondContact CA-O 3.35Å; A245-I381 WeakPolarHBondContact O-CA 3.42Å; A245-I382 PolarHBondContact N-O 3.27Å; A245-I382 PolarHBondContact O-N 2.82Å; A245-L384 HydrophobicContact CB-CD2 3.79Å
246	L	94	Very high	75.7	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	119.7	162.1	171.1	69.5	0	0	0	108.3	L248 V253 F254 V269 L291 I330 I359 I362 L367 K380 I381	L246-L248 HydrophobicContact CD1-CD2 4.46Å; L246-L248 HydrophobicContact CD2-CD2 4.44Å; L246-L248 HydrophobicContact CG-CD2 4.33Å; L246-V253 CarbonylContact O-C 3.52Å; L246-V253 WeakPolarHBondContact O-CA 3.3Å; L246-F254 HydrophobicContact CB-CB 4.27Å; L246-F254 HydrophobicContact CD2-CD2 4.49Å; L246-F254 PolarHBondContact N-O 2.83Å; L246-F254 PolarHBondContact O-N 3.45Å; L246-V269 HydrophobicContact CD1-CG2 4.49Å; L246-L291 HydrophobicContact CD1-CD1 4.5Å; L246-I330 HydrophobicContact CD1-CD1 4.04Å; L246-I330 HydrophobicContact CD2-CD1 3.85Å; L246-I330 HydrophobicContact CD2-CG2 4.34Å; L246-I359 HydrophobicContact CB-CD1 4.31Å; L246-I362 HydrophobicContact CD2-CD1 4.31Å; L246-L367 HydrophobicContact CD2-CD1 4.35Å; L246-L367 HydrophobicContact CD2-CD2 3.69Å; L246-K380 CarbonylContact C-O 3.57Å; L246-K380 WeakPolarHBondContact CA-O 3.27Å; L246-I381 HydrophobicContact CD1-CG1 3.94Å
247	I	94.1	Very high	78.3	Confident	23 Å²	23	42.3 Å²	42.3	12%	0.118	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	122.8	178.4	-54.7	178.8	0	0	0	108.5	A245 S252 V253 G379 K380 I382 P388 W393	A245-I247 HydrophobicContact CB-CG1 4.44Å; I247-S252 WeakPolarHBondContact CA-O 3.36Å; I247-V253 HydrophobicContact CG1-CG1 4.35Å; I247-V253 HydrophobicContact CG1-CG2 4.29Å; I247-V253 HydrophobicContact CG2-CG2 4.47Å; I247-G379 CarbonylContact O-C 3.51Å; I247-G379 VanDerWaalsContact O-CA 3.27Å; I247-G379 WeakPolarHBondContact O-CA 3.33Å; I247-K380 PolarHBondContact N-O 2.74Å; I247-K380 PolarHBondContact O-N 3.41Å; I247-I382 HydrophobicContact CD1-CD1 3.51Å; I247-I382 HydrophobicContact CD1-CG1 4.12Å; I247-P388 HydrophobicContact CD1-CB 3.72Å; I247-P388 HydrophobicContact CD1-CG 3.75Å; I247-W393 HydrophobicContact CG2-CH2 4.25Å
248	L	94.5	Very high	80.8	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	154.2	174.2	-57.9	-176.7	0	0	0	110.9	L246 D250 G251 S252 F254 V269 L367 K370 L377 L378	L246-L248 HydrophobicContact CD1-CD2 4.46Å; L246-L248 HydrophobicContact CD2-CD2 4.44Å; L246-L248 HydrophobicContact CG-CD2 4.33Å; L248-D250 PolarHBondContact O-N 3.26Å; L248-D250 VanDerWaalsContact O-N 3.14Å; L248-G251 PolarHBondContact O-N 3.27Å; L248-S252 PolarHBondContact N-O 3.21Å; L248-F254 HydrophobicContact CD1-CE2 3.98Å; L248-F254 HydrophobicContact CG-CE2 4.49Å; L248-V269 HydrophobicContact CD2-CB 4.45Å; L248-V269 HydrophobicContact CD2-CG2 3.82Å; L248-L367 HydrophobicContact CD1-CD1 3.87Å; L248-L367 HydrophobicContact CD2-CD1 4.42Å; L248-K370 HydrophobicContact CD1-CD 4.46Å; L248-L377 HydrophobicContact CD1-CD1 4.12Å; L248-L378 WeakPolarHBondContact CA-O 3.47Å
249	E	91.3	Very high	83.3	Confident	94 Å²	94	38.3 Å²	38.3	44%	0.439	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-21.6	-177.5	70.1	-174.1	152	0	0	114.5	G251 L377 L378 W393	E249-G251 PolarHBondContact O-N 2.75Å; E249-L377 HydrophobicContact CG-CB 4.29Å; E249-L377 HydrophobicContact CG-CD2 4.08Å; E249-L377 VanDerWaalsContact OE1-CA 3.31Å; E249-L377 WeakPolarHBondContact OE1-CA 3.35Å; E249-L377 VanDerWaalsContact OE1-CD2 3.29Å; E249-L377 WeakPolarHBondContact OE1-CD2 3.43Å; E249-L378 HydrophobicContact CB-CB 4.16Å; E249-L378 HydrophobicContact CG-CB 4.41Å; E249-L378 PolarHBondContact N-O 3.28Å; E249-L378 PolarHBondContact OE1-N 3.34Å; E249-W393 HydrophobicContact CB-CE3 4.45Å; E249-W393 HydrophobicContact CB-CH2 4.18Å; E249-W393 HydrophobicContact CB-CZ2 4.49Å; E249-W393 HydrophobicContact CB-CZ3 4.14Å
250	D	90.2	Very high	85.6	Confident	68 Å²	68	32.4 Å²	32.4	36%	0.364	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.9	2.7	173.9	69.3	16.3	0	0	0	114.1	L248 S252 K370	L248-D250 PolarHBondContact O-N 3.26Å; L248-D250 VanDerWaalsContact O-N 3.14Å; D250-S252 VanDerWaalsContact OD1-CB 3.24Å; D250-S252 WeakPolarHBondContact OD1-CB 3.44Å; D250-S252 PolarHBondContact OD1-N 2.95Å; D250-S252 PolarHBondContact OD1-OG 2.96Å; D250-K370 IonicContact OD1-NZ 3.37Å; D250-K370 PolarHBondContact OD1-NZ 3.41Å; D250-K370 VanDerWaalsContact OD1-NZ 3.14Å; D250-K370 IonicContact OD2-NZ 3.18Å; D250-K370 PolarHBondContact OD2-NZ 3.42Å
251	G	87	Confident	87.4	Confident	56 Å²	56	31.1 Å²	31.1	58%	0.577	18%	0.184	S	C	*	.	S	Bend	trans	92.5	1.4	178.2	0	0	0	0	0	114.9	L248 E249	L248-G251 PolarHBondContact O-N 3.27Å; E249-G251 PolarHBondContact O-N 2.75Å
252	S	88.6	Confident	88.7	Confident	29 Å²	29	29.3 Å²	29.3	20%	0.203	18%	0.175	C	C	.	.			trans	-74.4	140.6	178.6	-54.5	0	0	0	0	112.2	I247 L248 D250 K370	I247-S252 WeakPolarHBondContact CA-O 3.36Å; L248-S252 PolarHBondContact N-O 3.21Å; D250-S252 VanDerWaalsContact OD1-CB 3.24Å; D250-S252 WeakPolarHBondContact OD1-CB 3.44Å; D250-S252 PolarHBondContact OD1-N 2.95Å; D250-S252 PolarHBondContact OD1-OG 2.96Å; S252-K370 WeakPolarHBondContact OG-CE 3.3Å; S252-K370 PolarHBondContact OG-NZ 3.47Å
253	V	87.4	Confident	89.4	Confident	82 Å²	82	30.6 Å²	30.6	50%	0.497	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	128.5	-175.4	-174	0	0	0	0	110.5	A245 L246 I247 N255	A245-V253 HydrophobicContact CB-CG1 3.94Å; L246-V253 CarbonylContact O-C 3.52Å; L246-V253 WeakPolarHBondContact O-CA 3.3Å; I247-V253 HydrophobicContact CG1-CG1 4.35Å; I247-V253 HydrophobicContact CG1-CG2 4.29Å; I247-V253 HydrophobicContact CG2-CG2 4.47Å; V253-N255 WeakPolarHBondContact CG1-OD1 3.26Å
254	F	88.2	Confident	89.9	Confident	34 Å²	34	31.6 Å²	31.6	15%	0.149	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	110.7	174.5	-64.4	-100.8	0	0	0	109.2	A245 L246 L248 I362 L367	A245-F254 WeakPolarHBondContact CA-O 3.35Å; L246-F254 HydrophobicContact CB-CB 4.27Å; L246-F254 HydrophobicContact CD2-CD2 4.49Å; L246-F254 PolarHBondContact N-O 2.83Å; L246-F254 PolarHBondContact O-N 3.45Å; L248-F254 HydrophobicContact CD1-CE2 3.98Å; L248-F254 HydrophobicContact CG-CE2 4.49Å; F254-I362 HydrophobicContact CB-CB 4.45Å; F254-I362 HydrophobicContact CB-CG2 4.3Å; F254-L367 HydrophobicContact CD2-CD1 4.45Å; F254-L367 HydrophobicContact CE1-CB 4.12Å; F254-L367 HydrophobicContact CE2-CD1 3.9Å; F254-L367 HydrophobicContact CZ-CB 4.13Å; F254-L367 HydrophobicContact CZ-CD1 4.07Å
255	N	85.7	Confident	90.1	Very high	42 Å²	42	32.7 Å²	32.7	23%	0.225	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	138.9	179.8	-66.7	-18.2	0	0	0	110.9	V253 N1213	V253-N255 WeakPolarHBondContact CG1-OD1 3.26Å; N255-N1213 PolarHBondContact ND2-OD1 3.39Å
256	G	88.7	Confident	90.3	Very high	2 Å²	2	32.7 Å²	32.7	2%	0.021	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.5	-157.7	-179.3	0	0	0	0	0	112.5	G244 S360	G244-G256 PolarHBondContact N-O 3.09Å; G244-G256 PolarHBondContact O-N 2.99Å; G244-G256 VanDerWaalsContact O-O 3.07Å; G256-S360 CarbonylContact C-O 3.59Å; G256-S360 VanDerWaalsContact CA-O 3.25Å; G256-S360 WeakPolarHBondContact CA-O 3.43Å
257	F	88.6	Confident	90.3	Very high	14 Å²	14	32.7 Å²	32.7	6%	0.061	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	131.1	-176.7	-56.3	-78	0	0	0	110.8	E241 Y259 I359 S360 L1211 Q1215	E241-F257 HydrophobicContact CB-CD1 4.36Å; F257-Y259 HydrophobicContact CB-CD2 4.4Å; F257-Y259 HydrophobicContact CB-CE2 3.67Å; F257-Y259 WeakPolarHBondContact O-CD2 3.35Å; F257-I359 CarbonylContact O-C 3.58Å; F257-I359 WeakPolarHBondContact O-CA 3.42Å; F257-S360 PolarHBondContact N-O 2.91Å; F257-S360 PolarHBondContact O-N 3.25Å; F257-L1211 HydrophobicContact CE2-CB 4.42Å; F257-L1211 HydrophobicContact CZ-CB 4.39Å; F257-Q1215 HydrophobicContact CE1-CB 4.46Å; F257-Q1215 VanDerWaalsContact CE1-OE1 3.26Å; F257-Q1215 HydrophobicContact CZ-CB 4.45Å
258	L	91.3	Very high	90.2	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	130.6	178.3	-57	-179	0	0	0	111.1	C242 K262 T357 C358 I359 I381 P383	C242-L258 HydrophobicContact CB-CB 4.26Å; C242-L258 WeakPolarHBondContact O-CB 3.31Å; C242-L258 PolarHBondContact O-N 2.94Å; L258-K262 HydrophobicContact CB-CB 4.32Å; L258-K262 HydrophobicContact CB-CG 3.94Å; L258-K262 VanDerWaalsContact O-CE 3.27Å; L258-K262 WeakPolarHBondContact O-CE 3.38Å; L258-T357 HydrophobicContact CD2-CG2 4.12Å; L258-C358 CarbonylContact C-O 3.52Å; L258-C358 VanDerWaalsContact CA-O 3.26Å; L258-C358 WeakPolarHBondContact CA-O 3.26Å; L258-I359 HydrophobicContact CD2-CB 4.02Å; L258-I359 HydrophobicContact CD2-CD1 4.32Å; L258-I359 HydrophobicContact CD2-CG1 4.13Å; L258-I381 HydrophobicContact CD2-CG2 3.46Å; L258-I381 VanDerWaalsContact CD2-CG2 3.46Å; L258-P383 HydrophobicContact CD1-CB 3.96Å; L258-P383 HydrophobicContact CD1-CG 3.71Å
259	Y	90.7	Very high	90.3	Very high	44 Å²	44	32.3 Å²	32.3	17%	0.173	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	171.8	171.5	-63.8	-95.4	0	0	0	109.7	E241 F257 L334 C358	E241-Y259 HydrophobicContact CG-CE1 4.5Å; F257-Y259 HydrophobicContact CB-CD2 4.4Å; F257-Y259 HydrophobicContact CB-CE2 3.67Å; F257-Y259 WeakPolarHBondContact O-CD2 3.35Å; Y259-L334 HydrophobicContact CD1-CD2 3.92Å; Y259-L334 HydrophobicContact CD2-CD2 3.92Å; Y259-L334 HydrophobicContact CG-CD2 3.59Å; Y259-C358 PolarHBondContact N-O 3.42Å; Y259-C358 PolarHBondContact O-N 3.14Å
260	G	91.1	Very high	90.5	Very high	7 Å²	7	27.9 Å²	27.9	7%	0.072	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	70.6	-135.9	-174.7	0	0	0	0	0	112	K262 Y352 V356	G260-K262 VanDerWaalsContact C-N 3.28Å; G260-K262 PolarHBondContact O-N 3.38Å; G260-Y352 WeakPolarHBondContact O-CD2 3.46Å; G260-V356 WeakPolarHBondContact CA-O 3.35Å
261	A	88.7	Confident	90.7	Very high	24 Å²	24	25.2 Å²	25.2	20%	0.198	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-21.9	-174.6	0	0	0	0	0	115.1	T263 G355 V356	A261-T263 PolarHBondContact O-N 3.31Å; A261-T263 VanDerWaalsContact O-N 3.07Å; A261-G355 VanDerWaalsContact CB-C 3.4Å; A261-V356 PolarHBondContact N-O 3.08Å
262	K	87.9	Confident	91	Very high	40 Å²	40	22.6 Å²	22.6	17%	0.174	13%	0.127	C	C	.	.			trans	55.6	22.2	179.1	-57.2	171	-175.5	-177.6	0	114.5	P238 G240 C242 L258 G260 P383	P238-K262 PolarHBondContact O-NZ 3.19Å; G240-K262 PolarHBondContact O-NZ 3.33Å; C242-K262 HydrophobicContact CB-CD 3.98Å; L258-K262 HydrophobicContact CB-CB 4.32Å; L258-K262 HydrophobicContact CB-CG 3.94Å; L258-K262 VanDerWaalsContact O-CE 3.27Å; L258-K262 WeakPolarHBondContact O-CE 3.38Å; G260-K262 VanDerWaalsContact C-N 3.28Å; G260-K262 PolarHBondContact O-N 3.38Å; K262-P383 WeakPolarHBondContact O-CG 3.44Å
263	T	89.4	Confident	91.1	Very high	67 Å²	67	21.3 Å²	21.3	41%	0.411	12%	0.118	S	C	.	.			trans	-96.6	153.3	174.9	57.3	0	0	0	0	111.3	A261 Q265 T357	A261-T263 PolarHBondContact O-N 3.31Å; A261-T263 VanDerWaalsContact O-N 3.07Å; T263-Q265 PolarHBondContact O-N 3.14Å; T263-Q265 PolarHBondContact OG1-NE2 3.27Å; T263-T357 PolarHBondContact N-OG1 3.43Å; T263-T357 WeakPolarHBondContact O-CB 3.5Å; T263-T357 PolarHBondContact O-OG1 3.46Å
264	P	91.7	Very high	91.3	Very high	34 Å²	34	17.7 Å²	17.7	22%	0.221	10%	0.097	C	C	.	.			trans	-54.4	135.8	173.5	-28.5	36.8	0	0	0	113.4	I381 I382 L386 F391	P264-I381 CarbonylContact C-O 3.45Å; P264-I381 VanDerWaalsContact CA-O 3.26Å; P264-I381 WeakPolarHBondContact CA-O 3.43Å; P264-I382 HydrophobicContact CB-CG2 4.24Å; P264-L386 HydrophobicContact CG-CD1 3.78Å; P264-F391 HydrophobicContact CB-CD1 4.06Å; P264-F391 HydrophobicContact CB-CD2 3.81Å; P264-F391 HydrophobicContact CB-CE1 4.07Å; P264-F391 HydrophobicContact CB-CE2 3.84Å; P264-F391 HydrophobicContact CB-CG 3.92Å; P264-F391 HydrophobicContact CB-CZ 3.98Å
265	Q	93.2	Very high	91.4	Very high	23 Å²	23	17 Å²	17	11%	0.107	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	142.4	176.3	-62.3	-62	-16.1	0	0	110.8	T263 L291 K380 I381 F391	T263-Q265 PolarHBondContact O-N 3.14Å; T263-Q265 PolarHBondContact OG1-NE2 3.27Å; Q265-L291 HydrophobicContact CB-CD2 4.26Å; Q265-K380 CarbonylContact O-C 3.54Å; Q265-K380 VanDerWaalsContact O-CA 3.22Å; Q265-K380 WeakPolarHBondContact O-CA 3.37Å; Q265-I381 PolarHBondContact N-O 2.97Å; Q265-I381 PolarHBondContact O-N 3.44Å; Q265-F391 VanDerWaalsContact C-CE1 3.42Å
266	S	94	Very high	91.8	Very high	3 Å²	3	15.4 Å²	15.4	2%	0.021	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	144.4	175.9	-175.3	0	0	0	0	109.2	G379 I394	S266-G379 WeakPolarHBondContact CA-O 3.46Å; S266-G379 PolarHBondContact OG-O 3.46Å; S266-I394 PolarHBondContact OG-N 3.47Å
267	G	93.2	Very high	92	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-179.3	-174	172.7	0	0	0	0	0	112	G379	G267-G379 PolarHBondContact N-O 2.66Å; G267-G379 PolarHBondContact O-N 3.49Å
268	E	93.8	Very high	92.3	Very high	16 Å²	16	14.8 Å²	14.8	8%	0.075	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	126.5	170.6	-178.2	-179	-139.3	0	0	109.6	V270 Q290 L291 T376 L378 P396 K511	E268-V270 HydrophobicContact CG-CG1 3.94Å; E268-Q290 HydrophobicContact CB-CG 4.38Å; E268-Q290 CarbonylContact O-C 3.49Å; E268-Q290 WeakPolarHBondContact O-CA 3.33Å; E268-Q290 PolarHBondContact OE2-NE2 3.23Å; E268-L291 PolarHBondContact O-N 3.06Å; E268-T376 HydrophobicContact CG-CG2 4.48Å; E268-T376 WeakPolarHBondContact OE1-CB 3.29Å; E268-T376 PolarHBondContact OE1-OG1 3.34Å; E268-L378 HydrophobicContact CB-CD2 4.37Å; E268-P396 HydrophobicContact CB-CG 4.21Å; E268-K511 WeakPolarHBondContact OE1-CE 3.26Å; E268-K511 IonicContact OE1-NZ 3.74Å; E268-K511 PolarHBondContact OE1-NZ 2.88Å
269	V	95.7	Very high	92.6	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	123.9	177.3	-171.5	0	0	0	0	109.5	L246 L248 L291 V293 I330 L371 L377 G379	L246-V269 HydrophobicContact CD1-CG2 4.49Å; L248-V269 HydrophobicContact CD2-CB 4.45Å; L248-V269 HydrophobicContact CD2-CG2 3.82Å; V269-L291 WeakPolarHBondContact CA-O 3.47Å; V269-L291 HydrophobicContact CG2-CB 4.25Å; V269-L291 HydrophobicContact CG2-CD1 4.05Å; V269-V293 HydrophobicContact CG1-CG2 3.68Å; V269-I330 HydrophobicContact CG1-CD1 4.04Å; V269-L371 HydrophobicContact CB-CD2 4.23Å; V269-L371 HydrophobicContact CG1-CD1 3.8Å; V269-L371 HydrophobicContact CG1-CD2 4.27Å; V269-L377 PolarHBondContact N-O 2.86Å; V269-G379 VanDerWaalsContact CG2-CA 3.49Å
270	V	94.7	Very high	92.8	Very high	1 Å²	1	13.4 Å²	13.4	1%	0.006	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	148.7	-177.3	-54.7	0	0	0	0	109.4	E268 Y287 Q290 L291 L292 V293 T376	E268-V270 HydrophobicContact CG-CG1 3.94Å; V270-Y287 HydrophobicContact CG2-CD1 4.17Å; V270-Y287 HydrophobicContact CG2-CE1 4.2Å; V270-Q290 HydrophobicContact CG1-CG 4.37Å; V270-Q290 HydrophobicContact CG2-CB 4.07Å; V270-L291 PolarHBondContact N-O 2.64Å; V270-L292 HydrophobicContact CG2-CD1 4.03Å; V270-V293 WeakPolarHBondContact O-CB 3.17Å; V270-V293 WeakPolarHBondContact O-CG2 3.17Å; V270-V293 PolarHBondContact O-N 3.3Å; V270-T376 HydrophobicContact CG1-CG2 3.99Å
271	F	94.7	Very high	92.9	Very high	12 Å²	12	13 Å²	13	5%	0.053	8%	0.075	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	154.4	178.6	66.1	-94.4	0	0	0	111.9	T273 V293 T295 T368 L371 Y514 R517 E1194	F271-T273 HydrophobicContact CD2-CG2 4.1Å; F271-T273 HydrophobicContact CE2-CG2 4.16Å; F271-V293 CarbonylContact C-O 3.22Å; F271-V293 VanDerWaalsContact CA-O 3.31Å; F271-V293 WeakPolarHBondContact CA-O 3.27Å; F271-V293 HydrophobicContact CB-CB 3.97Å; F271-V293 HydrophobicContact CB-CG1 4.48Å; F271-T295 HydrophobicContact CB-CG2 4.27Å; F271-T295 HydrophobicContact CD2-CG2 4.3Å; F271-T368 HydrophobicContact CD1-CG2 4.19Å; F271-T368 HydrophobicContact CD2-CG2 3.85Å; F271-T368 HydrophobicContact CE1-CG2 4.35Å; F271-T368 HydrophobicContact CE2-CG2 4.02Å; F271-T368 HydrophobicContact CG-CG2 3.94Å; F271-T368 HydrophobicContact CZ-CG2 4.27Å; F271-L371 HydrophobicContact CB-CD1 4.46Å; F271-L371 HydrophobicContact CD1-CB 3.87Å; F271-L371 HydrophobicContact CD1-CD1 3.98Å; F271-L371 HydrophobicContact CE1-CB 4.05Å; F271-Y514 HydrophobicContact CE1-CD2 4.34Å; F271-Y514 HydrophobicContact CE1-CG 4.48Å; F271-Y514 AromaticContact CZ-CD2 3.87Å; F271-Y514 HydrophobicContact CZ-CD2 3.87Å; F271-Y514 HydrophobicContact CZ-CE2 4.49Å; F271-Y514 HydrophobicContact CZ-CG 4.38Å; F271-R517 WeakPolarHBondContact O-CB 3.18Å; F271-E1194 HydrophobicContact CE2-CB 4.32Å; F271-E1194 HydrophobicContact CE2-CG 4.14Å; F271-E1194 HydrophobicContact CZ-CG 4.48Å
272	Q	93.2	Very high	93.3	Very high	1 Å²	1	11.9 Å²	11.9	1%	0.005	7%	0.065	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	138.3	176.2	177.2	-79.4	-2.4	0	0	111.6	G274 L292 V293 L294 T295 R517 H519	Q272-G274 PolarHBondContact OE1-O 3.29Å; Q272-L292 HydrophobicContact CB-CD1 3.92Å; Q272-V293 PolarHBondContact N-O 2.94Å; Q272-L294 HydrophobicContact CB-CD2 4.3Å; Q272-L294 VanDerWaalsContact OE1-CD2 3.26Å; Q272-T295 WeakPolarHBondContact O-CG2 3.23Å; Q272-T295 PolarHBondContact O-N 2.94Å; Q272-T295 VanDerWaalsContact O-N 3.09Å; Q272-T295 PolarHBondContact O-OG1 2.77Å; Q272-R517 WeakPolarHBondContact CA-O 3.28Å; Q272-R517 WeakPolarHBondContact CB-O 3.42Å; Q272-R517 VanDerWaalsContact CG-O 3.3Å; Q272-R517 WeakPolarHBondContact CG-O 3.27Å; Q272-H519 PolarHBondContact NE2-CE1 2.88Å; Q272-H519 PolarHBondContact NE2-NE2 3.01Å
273	T	92	Very high	93.7	Very high	2 Å²	2	10 Å²	10	1%	0.012	6%	0.057	C	C	.	.			trans	-104.8	6.2	-168.5	52.8	0	0	0	0	115.4	F271 T295 R517 G518 S992 A1192 E1194	F271-T273 HydrophobicContact CD2-CG2 4.1Å; F271-T273 HydrophobicContact CE2-CG2 4.16Å; T273-T295 WeakPolarHBondContact CA-OG1 3.37Å; T273-T295 HydrophobicContact CG2-CG2 4.24Å; T273-R517 PolarHBondContact N-O 3.09Å; T273-G518 WeakPolarHBondContact OG1-CA 3.31Å; T273-S992 WeakPolarHBondContact O-CB 3.4Å; T273-S992 PolarHBondContact O-OG 3.43Å; T273-A1192 HydrophobicContact CG2-CB 4.12Å; T273-E1194 HydrophobicContact CG2-CB 4.16Å; T273-E1194 PolarHBondContact OG1-OE2 3.01Å; T273-E1194 VanDerWaalsContact OG1-OE2 3.11Å
274	G	90.2	Very high	94	Very high	5 Å²	5	6.8 Å²	6.8	5%	0.052	4%	0.037	C	C	.	.			trans	-76.9	137.7	174.8	0	0	0	0	0	111.5	Q272 V276	Q272-G274 PolarHBondContact OE1-O 3.29Å; G274-V276 VanDerWaalsContact C-N 3.33Å
275	M	91.3	Very high	94.2	Very high	20 Å²	20	5.3 Å²	5.3	10%	0.099	3%	0.027	C	C	.	.	S	Bend	trans	-80.2	-17.9	-179	-59	178.9	-67.2	0	0	112.9	Y296 P894 Y903 L993	M275-Y296 HydrophobicContact CB-CD2 4.5Å; M275-Y296 HydrophobicContact CG-CD2 4.37Å; M275-P894 HydrophobicContact CB-CB 4.48Å; M275-P894 HydrophobicContact CB-CG 4.27Å; M275-P894 HydrophobicContact CE-CB 4.08Å; M275-P894 HydrophobicContact CG-CG 4.36Å; M275-P894 HydrophobicContact SD-CB 3.59Å; M275-P894 VanDerWaalsContact SD-CB 3.59Å; M275-P894 HydrophobicContact SD-CG 3.68Å; M275-Y903 WeakPolarHBondContact CE-OH 3.45Å; M275-L993 HydrophobicContact SD-CB 3.82Å; M275-L993 HydrophobicContact SD-CD1 4.42Å; M275-L993 HydrophobicContact SD-CG 3.85Å; M275-L993 PolarHBondContact SD-N 3.1Å; M275-L993 VanDerWaalsContact SD-N 3.38Å
276	V	93.7	Very high	94.2	Very high	8 Å²	8	4.5 Å²	4.5	5%	0.048	3%	0.025	C	C	.	.	S	Bend	trans	-133.1	166.4	176.4	-61.9	0	0	0	0	109.5	G274 H519 N900 Y903 Y904	G274-V276 VanDerWaalsContact C-N 3.33Å; V276-H519 PolarHBondContact O-CE1 3.2Å; V276-N900 HydrophobicContact CB-CB 4.48Å; V276-N900 HydrophobicContact CG2-CB 4.2Å; V276-Y903 HydrophobicContact CG1-CD2 4.08Å; V276-Y903 HydrophobicContact CG1-CG 4.49Å; V276-Y903 HydrophobicContact CG2-CD1 4.25Å; V276-Y903 HydrophobicContact CG2-CD2 4.23Å; V276-Y903 HydrophobicContact CG2-CG 3.93Å; V276-Y904 HydrophobicContact CG2-CE2 4.13Å
277	G	93.4	Very high	94.2	Very high	0 Å²	0	4.4 Å²	4.4	0%	0	2%	0.024	C	C	.	.			trans	104.8	19.3	170.5	0	0	0	0	0	116.8	V279 E280 S281 Y302	G277-V279 PolarHBondContact O-N 2.7Å; G277-E280 VanDerWaalsContact C-OE2 3.31Å; G277-E280 VanDerWaalsContact CA-OE2 3.28Å; G277-E280 WeakPolarHBondContact CA-OE2 3.48Å; G277-E280 PolarHBondContact O-N 3.44Å; G277-S281 PolarHBondContact O-N 3.26Å; G277-S281 PolarHBondContact O-OG 2.85Å; G277-Y302 WeakPolarHBondContact CA-OH 3.24Å; G277-Y302 PolarHBondContact N-OH 3.1Å
278	Y	95.6	Very high	94.3	Very high	4 Å²	4	5.8 Å²	5.8	2%	0.016	3%	0.03	C	C	.	.	H	α-helix	trans	-63.3	-29.1	-175.4	58.2	-106.7	0	0	0	113.2	L282 I299 Y302 G303 L347	Y278-L282 VanDerWaalsContact O-CB 3.23Å; Y278-L282 WeakPolarHBondContact O-CB 3.31Å; Y278-L282 WeakPolarHBondContact O-CD1 3.44Å; Y278-L282 WeakPolarHBondContact O-CG 3.43Å; Y278-L282 PolarHBondContact O-N 2.86Å; Y278-I299 HydrophobicContact CD1-CG2 3.88Å; Y278-I299 HydrophobicContact CE1-CG2 4.47Å; Y278-I299 HydrophobicContact CG-CG2 4.05Å; Y278-Y302 AromaticContact CD1-CE1 3.91Å; Y278-Y302 HydrophobicContact CD1-CE1 3.91Å; Y278-Y302 HydrophobicContact CD1-CE2 4.31Å; Y278-Y302 AromaticContact CD1-CZ 3.6Å; Y278-Y302 WeakPolarHBondContact CD1-OH 3.39Å; Y278-Y302 AromaticContact CE1-CD1 3.86Å; Y278-Y302 HydrophobicContact CE1-CD1 3.86Å; Y278-Y302 HydrophobicContact CE1-CD2 4.13Å; Y278-Y302 AromaticContact CE1-CE1 3.29Å; Y278-Y302 HydrophobicContact CE1-CE1 3.29Å; Y278-Y302 AromaticContact CE1-CE2 3.59Å; Y278-Y302 HydrophobicContact CE1-CE2 3.59Å; Y278-Y302 HydrophobicContact CE1-CG 4.24Å; Y278-Y302 AromaticContact CE1-CZ 3.13Å; Y278-Y302 WeakPolarHBondContact CE1-OH 3.35Å; Y278-Y302 AromaticContact CE2-CE2 3.93Å; Y278-Y302 HydrophobicContact CE2-CE2 3.93Å; Y278-Y302 AromaticContact CZ-CD2 3.72Å; Y278-Y302 AromaticContact CZ-CE1 3.92Å; Y278-Y302 AromaticContact CZ-CE2 3.34Å; Y278-Y302 AromaticContact CZ-CZ 3.45Å; Y278-Y302 VanDerWaalsContact CZ-CZ 3.45Å; Y278-Y302 PolarHBondContact N-OH 3.43Å; Y278-Y302 WeakPolarHBondContact OH-CD2 3.28Å; Y278-Y302 VanDerWaalsContact OH-CE2 3.32Å; Y278-Y302 WeakPolarHBondContact OH-CE2 3.33Å; Y278-Y302 PolarHBondContact OH-N 3.49Å; Y278-G303 WeakPolarHBondContact CE2-O 3.42Å; Y278-G303 PolarHBondContact OH-N 3.29Å; Y278-G303 PolarHBondContact OH-O 2.96Å; Y278-L347 HydrophobicContact CD2-CD1 4.24Å; Y278-L347 HydrophobicContact CD2-CD2 4.05Å; Y278-L347 HydrophobicContact CE2-CD1 4.41Å; Y278-L347 HydrophobicContact CE2-CD2 4.23Å; Y278-L347 HydrophobicContact CG-CD2 4.49Å
279	V	96	Very high	94.1	Very high	2 Å²	2	5.9 Å²	5.9	1%	0.012	3%	0.032	C	C	.	.	H	α-helix	trans	-66.8	-46.5	177.4	175.6	0	0	0	0	109.9	G277 T283 Y302 V304 F319 W350	G277-V279 PolarHBondContact O-N 2.7Å; V279-T283 PolarHBondContact O-N 3.1Å; V279-T283 VanDerWaalsContact O-N 3.16Å; V279-T283 PolarHBondContact O-OG1 3.49Å; V279-Y302 HydrophobicContact CG2-CE2 4.37Å; V279-V304 HydrophobicContact CG2-CG1 4.42Å; V279-V304 HydrophobicContact CG2-CG2 4.49Å; V279-F319 HydrophobicContact CG1-CD1 3.52Å; V279-F319 HydrophobicContact CG1-CE1 3.43Å; V279-F319 VanDerWaalsContact CG1-CE1 3.43Å; V279-F319 HydrophobicContact CG1-CG 4.4Å; V279-F319 HydrophobicContact CG1-CZ 4.22Å; V279-W350 HydrophobicContact CG1-CH2 4.15Å; V279-W350 HydrophobicContact CG1-CZ3 4.44Å
280	E	95	Very high	94	Very high	12 Å²	12	6.8 Å²	6.8	6%	0.056	4%	0.037	C	C	.	.	H	α-helix	trans	-70.5	-45	-178.6	-60.5	90.3	153.2	0	0	111.5	G277 L282 T283 D284 E320 M583 A584 N900	G277-E280 VanDerWaalsContact C-OE2 3.31Å; G277-E280 VanDerWaalsContact CA-OE2 3.28Å; G277-E280 WeakPolarHBondContact CA-OE2 3.48Å; G277-E280 PolarHBondContact O-N 3.44Å; E280-L282 VanDerWaalsContact C-N 3.33Å; E280-L282 PolarHBondContact O-N 3.4Å; E280-T283 CarbonylContact O-C 3.47Å; E280-T283 PolarHBondContact O-N 3.33Å; E280-T283 PolarHBondContact O-OG1 3.08Å; E280-D284 WeakPolarHBondContact O-CB 3.27Å; E280-D284 PolarHBondContact O-N 3.5Å; E280-E320 HydrophobicContact CB-CG 4.21Å; E280-M583 VanDerWaalsContact CB-C 3.43Å; E280-M583 WeakPolarHBondContact CB-O 3.07Å; E280-M583 HydrophobicContact CG-CB 4.15Å; E280-A584 HydrophobicContact CB-CB 4.37Å; E280-N900 VanDerWaalsContact OE1-CB 3.28Å; E280-N900 WeakPolarHBondContact OE1-CB 2.91Å; E280-N900 PolarHBondContact OE1-ND2 3.45Å
281	S	94.7	Very high	94.1	Very high	0 Å²	0	6.7 Å²	6.7	0%	0	4%	0.036	C	C	.	.	H	α-helix	trans	-60.9	-39.7	175.6	-59.4	0	0	0	0	112.6	G277 T283 D284 Y287	G277-S281 PolarHBondContact O-N 3.26Å; G277-S281 PolarHBondContact O-OG 2.85Å; S281-T283 VanDerWaalsContact C-N 3.31Å; S281-T283 PolarHBondContact O-N 2.83Å; S281-D284 PolarHBondContact O-N 3.37Å; S281-Y287 WeakPolarHBondContact O-CD2 3.29Å
282	L	96.5	Very high	94.2	Very high	0 Å²	0	6.1 Å²	6.1	0%	0	3%	0.034	C	C	.	.	H	α-helix	trans	-67	-32.7	177.4	-77	171.6	0	0	0	112.5	Y278 E280 I324 Y325 A326 L329 L347 W350 L351	Y278-L282 VanDerWaalsContact O-CB 3.23Å; Y278-L282 WeakPolarHBondContact O-CB 3.31Å; Y278-L282 WeakPolarHBondContact O-CD1 3.44Å; Y278-L282 WeakPolarHBondContact O-CG 3.43Å; Y278-L282 PolarHBondContact O-N 2.86Å; E280-L282 VanDerWaalsContact C-N 3.33Å; E280-L282 PolarHBondContact O-N 3.4Å; L282-I324 HydrophobicContact CB-CG1 4.46Å; L282-I324 HydrophobicContact CB-CG2 4.09Å; L282-I324 HydrophobicContact CD2-CG2 4.16Å; L282-I324 CarbonylContact O-C 3.58Å; L282-I324 WeakPolarHBondContact O-CA 3.26Å; L282-I324 WeakPolarHBondContact O-CG2 3.31Å; L282-Y325 PolarHBondContact O-N 2.93Å; L282-A326 HydrophobicContact CD2-CB 3.77Å; L282-L329 HydrophobicContact CD1-CD2 4.37Å; L282-L329 HydrophobicContact CD2-CB 4.44Å; L282-L329 HydrophobicContact CD2-CD1 4.23Å; L282-L347 HydrophobicContact CD1-CD1 3.89Å; L282-W350 HydrophobicContact CB-CH2 4.09Å; L282-W350 HydrophobicContact CB-CZ3 4.17Å; L282-W350 HydrophobicContact CD1-CE3 4.43Å; L282-W350 HydrophobicContact CD1-CH2 4.45Å; L282-W350 HydrophobicContact CD1-CZ3 3.71Å; L282-L351 HydrophobicContact CD1-CD2 4.3Å
283	T	96.1	Very high	94.3	Very high	0 Å²	0	6.1 Å²	6.1	0%	0	3%	0.034	C	C	.	.	H	α-helix	trans	-92.1	1.4	179.6	55.5	0	0	0	0	114.5	V279 E280 S281 P285 F319 E320 S321 Q323 W350	V279-T283 PolarHBondContact O-N 3.1Å; V279-T283 VanDerWaalsContact O-N 3.16Å; V279-T283 PolarHBondContact O-OG1 3.49Å; E280-T283 CarbonylContact O-C 3.47Å; E280-T283 PolarHBondContact O-N 3.33Å; E280-T283 PolarHBondContact O-OG1 3.08Å; S281-T283 VanDerWaalsContact C-N 3.31Å; S281-T283 PolarHBondContact O-N 2.83Å; T283-P285 WeakPolarHBondContact O-CD 3.37Å; T283-F319 HydrophobicContact CG2-CB 4.33Å; T283-F319 HydrophobicContact CG2-CD1 3.68Å; T283-F319 HydrophobicContact CG2-CG 4.49Å; T283-E320 PolarHBondContact OG1-N 3.46Å; T283-E320 VanDerWaalsContact OG1-N 3.09Å; T283-S321 WeakPolarHBondContact O-CB 3.31Å; T283-S321 PolarHBondContact O-N 3.25Å; T283-S321 PolarHBondContact O-OG 3.26Å; T283-Q323 WeakPolarHBondContact CA-O 3.48Å; T283-Q323 WeakPolarHBondContact CB-O 3.26Å; T283-Q323 WeakPolarHBondContact CG2-O 3.31Å; T283-W350 HydrophobicContact CG2-CH2 3.7Å; T283-W350 HydrophobicContact CG2-CZ2 3.72Å
284	D	95.4	Very high	94.5	Very high	0 Å²	0	6.2 Å²	6.2	0%	0	3%	0.034	C	C	.	.			trans	-78	119.9	177.3	-176.8	-21.8	0	0	0	111.3	E280 S281 S286 Y287 K429 N537 H582	E280-D284 WeakPolarHBondContact O-CB 3.27Å; E280-D284 PolarHBondContact O-N 3.5Å; S281-D284 PolarHBondContact O-N 3.37Å; D284-S286 PolarHBondContact O-N 3.45Å; D284-S286 VanDerWaalsContact O-N 3.09Å; D284-S286 VanDerWaalsContact OD1-CB 3.28Å; D284-S286 WeakPolarHBondContact OD1-CB 3.24Å; D284-S286 PolarHBondContact OD1-N 3.23Å; D284-S286 PolarHBondContact OD1-OG 3.35Å; D284-Y287 HydrophobicContact CB-CD2 3.99Å; D284-Y287 HydrophobicContact CB-CE2 4.43Å; D284-Y287 PolarHBondContact O-N 3.19Å; D284-Y287 VanDerWaalsContact O-N 3.15Å; D284-K429 VanDerWaalsContact CG-CE 3.42Å; D284-K429 VanDerWaalsContact OD1-CE 3.23Å; D284-K429 WeakPolarHBondContact OD1-CE 3.1Å; D284-K429 IonicContact OD1-NZ 3.73Å; D284-K429 WeakPolarHBondContact OD2-CE 3.35Å; D284-K429 IonicContact OD2-NZ 2.74Å; D284-K429 PolarHBondContact OD2-NZ 2.97Å; D284-N537 PolarHBondContact OD2-ND2 3.15Å; D284-H582 IonicContact OD2-CE1 2.72Å; D284-H582 IonicContact OD2-NE2 2.84Å; D284-H582 PolarHBondContact OD2-NE2 2.97Å; D284-H582 VanDerWaalsContact OD2-NE2 3.15Å
285	P	95.5	Very high	94.7	Very high	2 Å²	2	6 Å²	6	1%	0.013	3%	0.032	C	C	.	.	G	3₁₀ helix	trans	-58	-23.1	179.8	-21.7	31.4	0	0	0	115	T283 Y287 H288 Y325 V405 G427	T283-P285 WeakPolarHBondContact O-CD 3.37Å; P285-Y287 PolarHBondContact O-N 2.89Å; P285-H288 VanDerWaalsContact O-CB 3.31Å; P285-H288 WeakPolarHBondContact O-CB 3.42Å; P285-H288 PolarHBondContact O-N 2.64Å; P285-H288 VanDerWaalsContact O-N 3.13Å; P285-Y325 HydrophobicContact CB-CD2 4.01Å; P285-Y325 HydrophobicContact CB-CE2 3.95Å; P285-Y325 HydrophobicContact CB-CG 4.41Å; P285-Y325 HydrophobicContact CG-CD2 3.92Å; P285-Y325 HydrophobicContact CG-CE2 3.64Å; P285-V405 HydrophobicContact CB-CB 4.31Å; P285-G427 WeakPolarHBondContact CB-O 3.12Å
286	S	94	Very high	94.9	Very high	7 Å²	7	5.2 Å²	5.2	5%	0.049	3%	0.028	C	C	.	.	G	3₁₀ helix	trans	-62.1	-25.4	178.1	-71.4	0	0	0	0	113	D284 H288 N466 N537	D284-S286 PolarHBondContact O-N 3.45Å; D284-S286 VanDerWaalsContact O-N 3.09Å; D284-S286 VanDerWaalsContact OD1-CB 3.28Å; D284-S286 WeakPolarHBondContact OD1-CB 3.24Å; D284-S286 PolarHBondContact OD1-N 3.23Å; D284-S286 PolarHBondContact OD1-OG 3.35Å; S286-H288 VanDerWaalsContact C-N 3.29Å; S286-H288 PolarHBondContact O-N 3.12Å; S286-N466 PolarHBondContact OG-ND2 2.84Å; S286-N466 VanDerWaalsContact OG-ND2 3.09Å; S286-N537 VanDerWaalsContact CB-OD1 3.28Å; S286-N537 WeakPolarHBondContact CB-OD1 3.4Å; S286-N537 PolarHBondContact OG-OD1 3.26Å
287	Y	94.2	Very high	94.7	Very high	1 Å²	1	4.9 Å²	4.9	0%	0.004	3%	0.026	C	C	.	.	G	3₁₀ helix	trans	-87.1	8	177.9	-70.4	-72.2	0	0	0	113.8	V270 S281 D284 P285 S289 Q290 L292 R517 N537	V270-Y287 HydrophobicContact CG2-CD1 4.17Å; V270-Y287 HydrophobicContact CG2-CE1 4.2Å; S281-Y287 WeakPolarHBondContact O-CD2 3.29Å; D284-Y287 HydrophobicContact CB-CD2 3.99Å; D284-Y287 HydrophobicContact CB-CE2 4.43Å; D284-Y287 PolarHBondContact O-N 3.19Å; D284-Y287 VanDerWaalsContact O-N 3.15Å; P285-Y287 PolarHBondContact O-N 2.89Å; Y287-S289 PolarHBondContact O-N 3.45Å; Y287-Q290 WeakPolarHBondContact O-CB 3.37Å; Y287-Q290 PolarHBondContact O-N 3.22Å; Y287-L292 HydrophobicContact CD1-CD1 3.94Å; Y287-L292 HydrophobicContact CE1-CD1 3.57Å; Y287-R517 HydrophobicContact CE1-CG 4.25Å; Y287-N537 HydrophobicContact CE2-CB 4.14Å
288	H	94.1	Very high	94.6	Very high	28 Å²	28	4.9 Å²	4.9	13%	0.13	3%	0.026	C	C	.	.	B	Isolated β-bridge	trans	-52.8	132.7	-179.1	-176.9	55.7	0	0	0	112.2	P285 S286 Q290 Y325 E404 V405 P468	P285-H288 VanDerWaalsContact O-CB 3.31Å; P285-H288 WeakPolarHBondContact O-CB 3.42Å; P285-H288 PolarHBondContact O-N 2.64Å; P285-H288 VanDerWaalsContact O-N 3.13Å; S286-H288 VanDerWaalsContact C-N 3.29Å; S286-H288 PolarHBondContact O-N 3.12Å; H288-Q290 PolarHBondContact O-N 3.22Å; H288-Y325 WeakPolarHBondContact CA-O 3.34Å; H288-Y325 HydrophobicContact CB-CD1 4.24Å; H288-Y325 AromaticContact ND1-CD1 3.82Å; H288-E404 IonicContact CD2-OE2 3.13Å; H288-E404 IonicContact CE1-OE2 3.69Å; H288-E404 IonicContact NE2-OE2 3.2Å; H288-E404 PolarHBondContact NE2-OE2 2.85Å; H288-V405 HydrophobicContact CB-CG1 3.64Å; H288-P468 HydrophobicContact CB-CB 4.1Å; H288-P468 HydrophobicContact CB-CG 4.03Å
289	S	90	Very high	94.6	Very high	18 Å²	18	5 Å²	5	13%	0.126	3%	0.027	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.4	11.3	-177.9	-61.4	0	0	0	0	116.1	Y287 P396	Y287-S289 PolarHBondContact O-N 3.45Å; S289-P396 VanDerWaalsContact O-CG 3.24Å; S289-P396 WeakPolarHBondContact O-CG 3.24Å
290	Q	94	Very high	94.5	Very high	19 Å²	19	4.9 Å²	4.9	9%	0.089	3%	0.026	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	153.6	173.4	-64.6	178.9	-23	0	0	112	E268 V270 Y287 H288 K327	E268-Q290 HydrophobicContact CB-CG 4.38Å; E268-Q290 CarbonylContact O-C 3.49Å; E268-Q290 WeakPolarHBondContact O-CA 3.33Å; E268-Q290 PolarHBondContact OE2-NE2 3.23Å; V270-Q290 HydrophobicContact CG1-CG 4.37Å; V270-Q290 HydrophobicContact CG2-CB 4.07Å; Y287-Q290 WeakPolarHBondContact O-CB 3.37Å; Y287-Q290 PolarHBondContact O-N 3.22Å; H288-Q290 PolarHBondContact O-N 3.22Å; Q290-K327 WeakPolarHBondContact O-CB 3.18Å; Q290-K327 PolarHBondContact O-N 3.26Å
291	L	96.1	Very high	94.6	Very high	0 Å²	0	4.5 Å²	4.5	0%	0	2%	0.024	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	110.6	169.2	-59.1	179.2	0	0	0	108.2	L246 Q265 E268 V269 V270 K327 I330 G379 I381	L246-L291 HydrophobicContact CD1-CD1 4.5Å; Q265-L291 HydrophobicContact CB-CD2 4.26Å; E268-L291 PolarHBondContact O-N 3.06Å; V269-L291 WeakPolarHBondContact CA-O 3.47Å; V269-L291 HydrophobicContact CG2-CB 4.25Å; V269-L291 HydrophobicContact CG2-CD1 4.05Å; V270-L291 PolarHBondContact N-O 2.64Å; L291-K327 HydrophobicContact CD2-CB 4.25Å; L291-I330 HydrophobicContact CB-CD1 4.01Å; L291-G379 VanDerWaalsContact CD1-O 3.26Å; L291-G379 WeakPolarHBondContact CD1-O 3.32Å; L291-I381 HydrophobicContact CD1-CG1 4.42Å; L291-I381 HydrophobicContact CD2-CD1 4.26Å
292	L	96.2	Very high	94.6	Very high	0 Å²	0	4.9 Å²	4.9	0%	0	3%	0.026	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	121.3	-170.9	-177.5	59.8	0	0	0	111.2	V270 Q272 Y287 L294 A326 G328 I330	V270-L292 HydrophobicContact CG2-CD1 4.03Å; Q272-L292 HydrophobicContact CB-CD1 3.92Å; Y287-L292 HydrophobicContact CD1-CD1 3.94Å; Y287-L292 HydrophobicContact CE1-CD1 3.57Å; L292-L294 HydrophobicContact CD2-CD2 4.05Å; L292-L294 HydrophobicContact CG-CD2 4.1Å; L292-A326 HydrophobicContact CB-CB 4.32Å; L292-G328 PolarHBondContact N-O 3.43Å; L292-I330 PolarHBondContact O-N 3.07Å
293	V	96.7	Very high	94.6	Very high	0 Å²	0	4.9 Å²	4.9	0%	0	3%	0.026	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	122.1	169.9	-172.5	0	0	0	0	108.8	V269 V270 F271 Q272 I330 T364 L367 L371	V269-V293 HydrophobicContact CG1-CG2 3.68Å; V270-V293 WeakPolarHBondContact O-CB 3.17Å; V270-V293 WeakPolarHBondContact O-CG2 3.17Å; V270-V293 PolarHBondContact O-N 3.3Å; F271-V293 CarbonylContact C-O 3.22Å; F271-V293 VanDerWaalsContact CA-O 3.31Å; F271-V293 WeakPolarHBondContact CA-O 3.27Å; F271-V293 HydrophobicContact CB-CB 3.97Å; F271-V293 HydrophobicContact CB-CG1 4.48Å; Q272-V293 PolarHBondContact N-O 2.94Å; V293-I330 WeakPolarHBondContact CA-O 3.5Å; V293-I330 HydrophobicContact CB-CB 4.34Å; V293-I330 HydrophobicContact CG1-CG2 4.29Å; V293-I330 HydrophobicContact CG2-CB 3.92Å; V293-I330 HydrophobicContact CG2-CD1 3.74Å; V293-I330 HydrophobicContact CG2-CG1 4.42Å; V293-I330 HydrophobicContact CG2-CG2 4.07Å; V293-T364 HydrophobicContact CG1-CG2 4.08Å; V293-L367 HydrophobicContact CG1-CD2 4.09Å; V293-L367 HydrophobicContact CG2-CD2 3.6Å; V293-L367 HydrophobicContact CG2-CG 4.36Å; V293-L371 HydrophobicContact CG2-CD1 4.43Å
294	L	96.2	Very high	94.6	Very high	4 Å²	4	5 Å²	5	2%	0.021	3%	0.026	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	123.6	168.2	-58.4	177.7	0	0	0	108.2	Q272 L292 I299 L329 I330 V331	Q272-L294 HydrophobicContact CB-CD2 4.3Å; Q272-L294 VanDerWaalsContact OE1-CD2 3.26Å; L292-L294 HydrophobicContact CD2-CD2 4.05Å; L292-L294 HydrophobicContact CG-CD2 4.1Å; L294-I299 HydrophobicContact CB-CD1 3.97Å; L294-I299 HydrophobicContact CB-CG1 4.07Å; L294-I299 HydrophobicContact CD1-CD1 3.92Å; L294-I299 HydrophobicContact CD1-CG1 4.05Å; L294-I299 HydrophobicContact CD1-CG2 3.78Å; L294-L329 HydrophobicContact CD1-CD1 3.77Å; L294-L329 HydrophobicContact CG-CD1 3.89Å; L294-I330 PolarHBondContact N-O 3.11Å; L294-V331 HydrophobicContact CB-CG1 4.34Å; L294-V331 HydrophobicContact CD1-CG1 4.36Å
295	T	94.4	Very high	94.7	Very high	2 Å²	2	5.6 Å²	5.6	1%	0.012	3%	0.03	C	C	.	.			trans	-76.8	-32.3	-172.9	53.6	0	0	0	0	113.3	F271 Q272 T273 T368	F271-T295 HydrophobicContact CB-CG2 4.27Å; F271-T295 HydrophobicContact CD2-CG2 4.3Å; Q272-T295 WeakPolarHBondContact O-CG2 3.23Å; Q272-T295 PolarHBondContact O-N 2.94Å; Q272-T295 VanDerWaalsContact O-N 3.09Å; Q272-T295 PolarHBondContact O-OG1 2.77Å; T273-T295 WeakPolarHBondContact CA-OG1 3.37Å; T273-T295 HydrophobicContact CG2-CG2 4.24Å; T295-T368 HydrophobicContact CG2-CG2 4.1Å; T295-T368 WeakPolarHBondContact CG2-OG1 3.25Å
296	Y	94.7	Very high	94.6	Very high	2 Å²	2	7.4 Å²	7.4	1%	0.008	4%	0.043	C	C	.	.	S	Bend	trans	-63	133	176.6	-173.1	-108	0	0	0	110.4	M275 S298 I299 P894 Q896 L993	M275-Y296 HydrophobicContact CB-CD2 4.5Å; M275-Y296 HydrophobicContact CG-CD2 4.37Å; Y296-S298 WeakPolarHBondContact CD1-O 3.39Å; Y296-S298 WeakPolarHBondContact CE1-O 3.45Å; Y296-I299 HydrophobicContact CD1-CD1 4.36Å; Y296-P894 HydrophobicContact CD2-CG 4.11Å; Y296-P894 HydrophobicContact CE2-CG 3.41Å; Y296-P894 VanDerWaalsContact CE2-CG 3.41Å; Y296-Q896 PolarHBondContact OH-NE2 3.21Å; Y296-Q896 PolarHBondContact OH-OE1 3.08Å; Y296-L993 WeakPolarHBondContact CD2-O 3.41Å
297	P	90.4	Very high	94.4	Very high	1 Å²	1	10.3 Å²	10.3	1%	0.006	6%	0.058	C	C	.	.	S	Bend	trans	-65.2	-44.4	-168.6	-26.7	35.5	0	0	0	115.1	E333 D994 R1030	P297-E333 WeakPolarHBondContact O-CA 3.12Å; P297-E333 VanDerWaalsContact O-CB 3.27Å; P297-E333 WeakPolarHBondContact O-CB 3.44Å; P297-E333 PolarHBondContact O-N 3.09Å; P297-D994 WeakPolarHBondContact CG-O 3.48Å; P297-R1030 WeakPolarHBondContact CB-O 3.39Å; P297-R1030 HydrophobicContact CG-CB 4.41Å; P297-R1030 WeakPolarHBondContact CG-O 3.4Å
298	S	91	Very high	94.3	Very high	1 Å²	1	14 Å²	14	1%	0.007	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	103.8	-171.4	-55.7	0	0	0	0	111.1	Y296 E333	Y296-S298 WeakPolarHBondContact CD1-O 3.39Å; Y296-S298 WeakPolarHBondContact CE1-O 3.45Å; S298-E333 PolarHBondContact OG-OE2 3.37Å
299	I	95.2	Very high	94.2	Very high	5 Å²	5	15.1 Å²	15.1	3%	0.026	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	137.8	-176.4	-59.3	-59.9	0	0	0	110.9	Y278 L294 Y296 V331 E333 L334 C335 L347	Y278-I299 HydrophobicContact CD1-CG2 3.88Å; Y278-I299 HydrophobicContact CE1-CG2 4.47Å; Y278-I299 HydrophobicContact CG-CG2 4.05Å; L294-I299 HydrophobicContact CB-CD1 3.97Å; L294-I299 HydrophobicContact CB-CG1 4.07Å; L294-I299 HydrophobicContact CD1-CD1 3.92Å; L294-I299 HydrophobicContact CD1-CG1 4.05Å; L294-I299 HydrophobicContact CD1-CG2 3.78Å; Y296-I299 HydrophobicContact CD1-CD1 4.36Å; I299-V331 HydrophobicContact CB-CB 4.35Å; I299-V331 HydrophobicContact CB-CG1 3.88Å; I299-V331 HydrophobicContact CG1-CB 4.21Å; I299-V331 HydrophobicContact CG1-CG1 3.77Å; I299-V331 HydrophobicContact CG2-CG1 4.02Å; I299-E333 PolarHBondContact N-O 2.89Å; I299-E333 VanDerWaalsContact N-O 3.1Å; I299-L334 WeakPolarHBondContact O-CA 3.23Å; I299-C335 PolarHBondContact O-N 3.49Å; I299-L347 HydrophobicContact CG2-CD2 3.58Å
300	G	95.1	Very high	94.3	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	11%	0.108	C	C	.	.	S	Bend	trans	101.7	-2.9	179.9	0	0	0	0	0	114.5	Y302 G303 F338	G300-Y302 VanDerWaalsContact C-N 3.32Å; G300-Y302 PolarHBondContact O-N 2.87Å; G300-G303 PolarHBondContact O-N 3.44Å; G300-F338 WeakPolarHBondContact O-CB 3.37Å
301	N	95.6	Very high	94.2	Very high	4 Å²	4	17.5 Å²	17.5	2%	0.021	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	-48.5	-37.3	178.4	48.2	-22.8	0	0	0	116	F338 S339 Q896 W1095	N301-F338 VanDerWaalsContact O-CA 3.24Å; N301-F338 WeakPolarHBondContact O-CA 3.43Å; N301-F338 WeakPolarHBondContact O-CB 3.16Å; N301-S339 PolarHBondContact O-N 3.43Å; N301-Q896 WeakPolarHBondContact CB-O 3.43Å; N301-Q896 VanDerWaalsContact CG-O 3.31Å; N301-Q896 PolarHBondContact ND2-O 3.08Å; N301-W1095 HydrophobicContact CB-CZ2 4.25Å
302	Y	95.6	Very high	93.8	Very high	9 Å²	9	25 Å²	25	4%	0.035	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.8	11.4	177.5	59.2	-103.2	0	0	0	113.7	G277 Y278 V279 G300 H340 A343 L898	G277-Y302 WeakPolarHBondContact CA-OH 3.24Å; G277-Y302 PolarHBondContact N-OH 3.1Å; Y278-Y302 AromaticContact CD1-CE1 3.91Å; Y278-Y302 HydrophobicContact CD1-CE1 3.91Å; Y278-Y302 HydrophobicContact CD1-CE2 4.31Å; Y278-Y302 AromaticContact CD1-CZ 3.6Å; Y278-Y302 WeakPolarHBondContact CD1-OH 3.39Å; Y278-Y302 AromaticContact CE1-CD1 3.86Å; Y278-Y302 HydrophobicContact CE1-CD1 3.86Å; Y278-Y302 HydrophobicContact CE1-CD2 4.13Å; Y278-Y302 AromaticContact CE1-CE1 3.29Å; Y278-Y302 HydrophobicContact CE1-CE1 3.29Å; Y278-Y302 AromaticContact CE1-CE2 3.59Å; Y278-Y302 HydrophobicContact CE1-CE2 3.59Å; Y278-Y302 HydrophobicContact CE1-CG 4.24Å; Y278-Y302 AromaticContact CE1-CZ 3.13Å; Y278-Y302 WeakPolarHBondContact CE1-OH 3.35Å; Y278-Y302 AromaticContact CE2-CE2 3.93Å; Y278-Y302 HydrophobicContact CE2-CE2 3.93Å; Y278-Y302 AromaticContact CZ-CD2 3.72Å; Y278-Y302 AromaticContact CZ-CE1 3.92Å; Y278-Y302 AromaticContact CZ-CE2 3.34Å; Y278-Y302 AromaticContact CZ-CZ 3.45Å; Y278-Y302 VanDerWaalsContact CZ-CZ 3.45Å; Y278-Y302 PolarHBondContact N-OH 3.43Å; Y278-Y302 WeakPolarHBondContact OH-CD2 3.28Å; Y278-Y302 VanDerWaalsContact OH-CE2 3.32Å; Y278-Y302 WeakPolarHBondContact OH-CE2 3.33Å; Y278-Y302 PolarHBondContact OH-N 3.49Å; V279-Y302 HydrophobicContact CG2-CE2 4.37Å; G300-Y302 VanDerWaalsContact C-N 3.32Å; G300-Y302 PolarHBondContact O-N 2.87Å; Y302-H340 VanDerWaalsContact O-CB 3.23Å; Y302-H340 WeakPolarHBondContact O-CB 3.33Å; Y302-A343 WeakPolarHBondContact O-CB 3.4Å; Y302-L898 VanDerWaalsContact CD1-O 3.31Å; Y302-L898 WeakPolarHBondContact CD1-O 3.39Å
303	G	95.8	Very high	93.3	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	15%	0.15	C	C	.	.			trans	67.3	-163.6	174.1	0	0	0	0	0	114.3	Y278 G300 F338	Y278-G303 WeakPolarHBondContact CE2-O 3.42Å; Y278-G303 PolarHBondContact OH-N 3.29Å; Y278-G303 PolarHBondContact OH-O 2.96Å; G300-G303 PolarHBondContact O-N 3.44Å; G303-F338 VanDerWaalsContact N-CB 3.32Å
304	V	97.2	Very high	92.9	Very high	1 Å²	1	28.7 Å²	28.7	1%	0.006	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	127.7	-179.5	-174.2	0	0	0	0	110.1	V279 F319 A343 V344 K345 L347 W350	V279-V304 HydrophobicContact CG2-CG1 4.42Å; V279-V304 HydrophobicContact CG2-CG2 4.49Å; V304-F319 HydrophobicContact CG1-CE1 4.25Å; V304-F319 HydrophobicContact CG1-CZ 4.28Å; V304-A343 WeakPolarHBondContact O-CA 3.46Å; V304-V344 PolarHBondContact O-N 3.02Å; V304-K345 HydrophobicContact CB-CG 4.19Å; V304-K345 PolarHBondContact N-O 2.95Å; V304-L347 HydrophobicContact CG2-CB 4.28Å; V304-L347 HydrophobicContact CG2-CD1 4.24Å; V304-W350 HydrophobicContact CB-CB 4.4Å; V304-W350 HydrophobicContact CB-CD2 4.47Å; V304-W350 HydrophobicContact CB-CE3 4.39Å; V304-W350 HydrophobicContact CG1-CB 4.31Å; V304-W350 HydrophobicContact CG1-CD2 3.63Å; V304-W350 HydrophobicContact CG1-CE3 3.74Å; V304-W350 HydrophobicContact CG1-CG 3.89Å; V304-W350 HydrophobicContact CG1-CZ3 4.3Å; V304-W350 HydrophobicContact CG2-CB 4.01Å; V304-W350 HydrophobicContact CG2-CD2 4.13Å; V304-W350 HydrophobicContact CG2-CE3 3.67Å; V304-W350 HydrophobicContact CG2-CG 4.31Å; V304-W350 HydrophobicContact CG2-CZ3 4.46Å
305	P	95.8	Very high	92.8	Very high	13 Å²	13	29.1 Å²	29.1	8%	0.084	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	172	176.9	29.9	-33.6	0	0	0	112.6	W318 F319 S342	P305-W318 HydrophobicContact CB-CB 4.17Å; P305-W318 HydrophobicContact CB-CG 3.91Å; P305-W318 HydrophobicContact CG-CB 3.52Å; P305-W318 HydrophobicContact CG-CG 3.8Å; P305-F319 HydrophobicContact CG-CE2 4.1Å; P305-F319 HydrophobicContact CG-CZ 3.94Å; P305-F319 WeakPolarHBondContact O-CZ 3.47Å; P305-S342 VanDerWaalsContact CA-O 3.32Å; P305-S342 WeakPolarHBondContact CA-O 3.27Å
306	S	93.9	Very high	92.8	Very high	40 Å²	40	29.8 Å²	29.8	28%	0.28	18%	0.183	S	C	.	.			trans	-79.6	129.8	179.4	-173.3	0	0	0	0	112.1	A308 D309	S306-A308 PolarHBondContact O-N 3.35Å; S306-A308 WeakPolarHBondContact OG-CB 3.16Å; S306-A308 PolarHBondContact OG-N 3.18Å; S306-D309 PolarHBondContact O-N 2.77Å; S306-D309 VanDerWaalsContact O-N 3.13Å
307	L	90.7	Very high	92.6	Very high	68 Å²	68	34.1 Å²	34.1	36%	0.356	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-20	167.7	-81.1	167.8	0	0	0	112.9	D309 P316 F319	L307-D309 VanDerWaalsContact C-N 3.28Å; L307-P316 HydrophobicContact CD2-CB 4.02Å; L307-P316 HydrophobicContact CD2-CG 4.31Å; L307-F319 HydrophobicContact CB-CE2 4.44Å; L307-F319 HydrophobicContact CD2-CB 4.41Å; L307-F319 HydrophobicContact CD2-CD1 3.89Å; L307-F319 HydrophobicContact CD2-CD2 3.59Å; L307-F319 HydrophobicContact CD2-CE1 3.95Å; L307-F319 HydrophobicContact CD2-CE2 3.68Å; L307-F319 HydrophobicContact CD2-CG 3.69Å; L307-F319 HydrophobicContact CD2-CZ 3.85Å; L307-F319 HydrophobicContact CG-CD2 4.35Å; L307-F319 HydrophobicContact CG-CE1 4.17Å; L307-F319 HydrophobicContact CG-CE2 3.93Å; L307-F319 HydrophobicContact CG-CZ 3.82Å
308	A	91.2	Very high	92.7	Very high	80 Å²	80	36.1 Å²	36.1	66%	0.661	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-9.4	176.6	0	0	0	0	0	113.2	S306 I310	S306-A308 PolarHBondContact O-N 3.35Å; S306-A308 WeakPolarHBondContact OG-CB 3.16Å; S306-A308 PolarHBondContact OG-N 3.18Å; A308-I310 PolarHBondContact O-N 2.88Å
309	D	91.7	Very high	92.9	Very high	50 Å²	50	36.1 Å²	36.1	27%	0.267	21%	0.206	S	C	.	.			trans	-77.5	103.2	169.4	-171.3	21.1	0	0	0	108.7	S306 L307 R317 W318	S306-D309 PolarHBondContact O-N 2.77Å; S306-D309 VanDerWaalsContact O-N 3.13Å; L307-D309 VanDerWaalsContact C-N 3.28Å; D309-R317 VanDerWaalsContact CG-NH1 3.33Å; D309-R317 WeakPolarHBondContact O-CB 3.33Å; D309-R317 PolarHBondContact O-N 3.39Å; D309-R317 IonicContact OD1-CZ 2.71Å; D309-R317 IonicContact OD1-NH1 3.64Å; D309-R317 PolarHBondContact OD1-NH1 2.88Å; D309-R317 IonicContact OD2-CZ 3.78Å; D309-R317 IonicContact OD2-NH1 2.77Å; D309-R317 PolarHBondContact OD2-NH1 2.99Å; D309-W318 PolarHBondContact OD2-NE1 2.87Å
310	I	92.7	Very high	92.9	Very high	75 Å²	75	35.9 Å²	35.9	39%	0.385	21%	0.205	S	C	.	.	B	Isolated β-bridge	trans	-104.8	137.1	-173.9	-57.5	-64.8	0	0	0	109.2	A308 L315 P316	A308-I310 PolarHBondContact O-N 2.88Å; I310-L315 CarbonylContact C-O 3.27Å; I310-L315 WeakPolarHBondContact CA-O 3.09Å; I310-P316 HydrophobicContact CD1-CB 4.49Å; I310-P316 HydrophobicContact CD1-CG 4.08Å
311	D	91.7	Very high	92.9	Very high	12 Å²	12	36 Å²	36	6%	0.064	21%	0.206	C	C	.	.			trans	-81.2	-179.2	175.8	66.8	30.9	0	0	0	113.4	S313 G314 L315 R317 R434	D311-S313 PolarHBondContact O-N 3.47Å; D311-S313 VanDerWaalsContact O-N 3.13Å; D311-S313 WeakPolarHBondContact OD1-CA 3.35Å; D311-S313 VanDerWaalsContact OD1-CB 3.3Å; D311-S313 WeakPolarHBondContact OD1-CB 3.31Å; D311-S313 PolarHBondContact OD1-N 3.33Å; D311-G314 PolarHBondContact O-N 3.36Å; D311-G314 PolarHBondContact OD1-N 3.05Å; D311-L315 PolarHBondContact N-O 3.47Å; D311-L315 PolarHBondContact OD1-N 2.91Å; D311-R317 HydrophobicContact CB-CB 4.31Å; D311-R434 IonicContact OD2-CZ 3.19Å; D311-R434 VanDerWaalsContact OD2-CZ 3.26Å; D311-R434 IonicContact OD2-NE 3.93Å; D311-R434 PolarHBondContact OD2-NE 2.9Å; D311-R434 IonicContact OD2-NH2 3.81Å; D311-R434 PolarHBondContact OD2-NH2 2.94Å
312	E	87.5	Confident	92.6	Very high	158 Å²	158	39.3 Å²	39.3	74%	0.738	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-16.2	-177.5	-52.4	75.3	-160.9	0	0	113.1	R317	E312-R317 IonicContact OE1-NH2 3.78Å
313	S	85.8	Confident	92.5	Very high	25 Å²	25	43.6 Å²	43.6	18%	0.175	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.6	-1	176.4	-56.7	0	0	0	0	112.7	D311 V437	D311-S313 PolarHBondContact O-N 3.47Å; D311-S313 VanDerWaalsContact O-N 3.13Å; D311-S313 WeakPolarHBondContact OD1-CA 3.35Å; D311-S313 VanDerWaalsContact OD1-CB 3.3Å; D311-S313 WeakPolarHBondContact OD1-CB 3.31Å; D311-S313 PolarHBondContact OD1-N 3.33Å; S313-V437 WeakPolarHBondContact OG-CG1 3.11Å
314	G	88.9	Confident	92.5	Very high	53 Å²	53	44.5 Å²	44.5	55%	0.546	25%	0.254	S	S	.	.	S	Bend	trans	79.1	19.2	-176.5	0	0	0	0	0	113.5	D311	D311-G314 PolarHBondContact O-N 3.36Å; D311-G314 PolarHBondContact OD1-N 3.05Å
315	L	93.4	Very high	92.4	Very high	12 Å²	12	45.8 Å²	45.8	6%	0.063	26%	0.259	C	S	.	.	S	Bend	trans	-110.2	147.9	-179.1	-60.6	173	0	0	0	111.6	I310 D311 R317 F413 F430 I433	I310-L315 CarbonylContact C-O 3.27Å; I310-L315 WeakPolarHBondContact CA-O 3.09Å; D311-L315 PolarHBondContact N-O 3.47Å; D311-L315 PolarHBondContact OD1-N 2.91Å; L315-R317 PolarHBondContact O-N 3Å; L315-R317 VanDerWaalsContact O-N 3.11Å; L315-F413 HydrophobicContact CD1-CE1 4.35Å; L315-F413 HydrophobicContact CD2-CE1 3.9Å; L315-F413 HydrophobicContact CD2-CZ 4.1Å; L315-F413 HydrophobicContact CG-CE1 4.18Å; L315-F430 HydrophobicContact CB-CD2 4.28Å; L315-F430 HydrophobicContact CB-CG 4.45Å; L315-F430 HydrophobicContact CD1-CB 4.11Å; L315-F430 HydrophobicContact CD1-CD1 4.36Å; L315-F430 HydrophobicContact CD1-CG 4.21Å; L315-F430 HydrophobicContact CD2-CD1 4.1Å; L315-F430 HydrophobicContact CD2-CD2 4.45Å; L315-F430 HydrophobicContact CD2-CE1 4.08Å; L315-F430 HydrophobicContact CD2-CE2 4.43Å; L315-F430 HydrophobicContact CD2-CG 4.29Å; L315-F430 HydrophobicContact CD2-CZ 4.24Å; L315-I433 HydrophobicContact CD1-CB 4.05Å; L315-I433 HydrophobicContact CD1-CD1 4.09Å; L315-I433 HydrophobicContact CD1-CG2 4.06Å
316	P	94.1	Very high	92.4	Very high	16 Å²	16	45.3 Å²	45.3	10%	0.104	26%	0.256	C	S	.	.	B	Isolated β-bridge	trans	-54.1	113.8	173.2	-26.4	34	0	0	0	112.7	L307 I310 W318 F319 F430 R434	L307-P316 HydrophobicContact CD2-CB 4.02Å; L307-P316 HydrophobicContact CD2-CG 4.31Å; I310-P316 HydrophobicContact CD1-CB 4.49Å; I310-P316 HydrophobicContact CD1-CG 4.08Å; P316-W318 VanDerWaalsContact C-N 3.33Å; P316-W318 PolarHBondContact O-N 2.58Å; P316-F319 HydrophobicContact CB-CB 4.32Å; P316-F319 HydrophobicContact CB-CD2 3.87Å; P316-F319 HydrophobicContact CB-CG 4.46Å; P316-F319 PolarHBondContact O-N 2.92Å; P316-F430 HydrophobicContact CG-CE2 4.05Å; P316-R434 PolarHBondContact O-NH2 3.34Å
317	R	92.3	Very high	92.4	Very high	94 Å²	94	47.6 Å²	47.6	36%	0.355	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-41	-163.7	177.9	175.5	-77.6	149.1	-6	114.3	D309 D311 E312 L315	D309-R317 VanDerWaalsContact CG-NH1 3.33Å; D309-R317 WeakPolarHBondContact O-CB 3.33Å; D309-R317 PolarHBondContact O-N 3.39Å; D309-R317 IonicContact OD1-CZ 2.71Å; D309-R317 IonicContact OD1-NH1 3.64Å; D309-R317 PolarHBondContact OD1-NH1 2.88Å; D309-R317 IonicContact OD2-CZ 3.78Å; D309-R317 IonicContact OD2-NH1 2.77Å; D309-R317 PolarHBondContact OD2-NH1 2.99Å; D311-R317 HydrophobicContact CB-CB 4.31Å; E312-R317 IonicContact OE1-NH2 3.78Å; L315-R317 PolarHBondContact O-N 3Å; L315-R317 VanDerWaalsContact O-N 3.11Å
318	W	91.8	Very high	92.6	Very high	42 Å²	42	44.4 Å²	44.4	16%	0.159	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.3	7.8	-168.2	-48.5	102.9	0	0	0	114.6	P305 D309 P316 V901 L934	P305-W318 HydrophobicContact CB-CB 4.17Å; P305-W318 HydrophobicContact CB-CG 3.91Å; P305-W318 HydrophobicContact CG-CB 3.52Å; P305-W318 HydrophobicContact CG-CG 3.8Å; D309-W318 PolarHBondContact OD2-NE1 2.87Å; P316-W318 VanDerWaalsContact C-N 3.33Å; P316-W318 PolarHBondContact O-N 2.58Å; W318-V901 HydrophobicContact CE3-CG2 3.91Å; W318-V901 HydrophobicContact CZ3-CB 4.21Å; W318-V901 HydrophobicContact CZ3-CG1 4.16Å; W318-V901 HydrophobicContact CZ3-CG2 3.85Å; W318-L934 HydrophobicContact CH2-CD1 4.18Å
319	F	95.2	Very high	92.9	Very high	1 Å²	1	40.6 Å²	40.6	0%	0.004	21%	0.213	C	C	.	.			trans	-124	150.3	-171.1	-56.5	-96.3	0	0	0	110.9	V279 T283 V304 P305 L307 P316 S321 W350 R434	V279-F319 HydrophobicContact CG1-CD1 3.52Å; V279-F319 HydrophobicContact CG1-CE1 3.43Å; V279-F319 VanDerWaalsContact CG1-CE1 3.43Å; V279-F319 HydrophobicContact CG1-CG 4.4Å; V279-F319 HydrophobicContact CG1-CZ 4.22Å; T283-F319 HydrophobicContact CG2-CB 4.33Å; T283-F319 HydrophobicContact CG2-CD1 3.68Å; T283-F319 HydrophobicContact CG2-CG 4.49Å; V304-F319 HydrophobicContact CG1-CE1 4.25Å; V304-F319 HydrophobicContact CG1-CZ 4.28Å; P305-F319 HydrophobicContact CG-CE2 4.1Å; P305-F319 HydrophobicContact CG-CZ 3.94Å; P305-F319 WeakPolarHBondContact O-CZ 3.47Å; L307-F319 HydrophobicContact CB-CE2 4.44Å; L307-F319 HydrophobicContact CD2-CB 4.41Å; L307-F319 HydrophobicContact CD2-CD1 3.89Å; L307-F319 HydrophobicContact CD2-CD2 3.59Å; L307-F319 HydrophobicContact CD2-CE1 3.95Å; L307-F319 HydrophobicContact CD2-CE2 3.68Å; L307-F319 HydrophobicContact CD2-CG 3.69Å; L307-F319 HydrophobicContact CD2-CZ 3.85Å; L307-F319 HydrophobicContact CG-CD2 4.35Å; L307-F319 HydrophobicContact CG-CE1 4.17Å; L307-F319 HydrophobicContact CG-CE2 3.93Å; L307-F319 HydrophobicContact CG-CZ 3.82Å; P316-F319 HydrophobicContact CB-CB 4.32Å; P316-F319 HydrophobicContact CB-CD2 3.87Å; P316-F319 HydrophobicContact CB-CG 4.46Å; P316-F319 PolarHBondContact O-N 2.92Å; F319-S321 VanDerWaalsContact C-N 3.35Å; F319-S321 VanDerWaalsContact CB-O 3.26Å; F319-S321 WeakPolarHBondContact CB-O 3.32Å; F319-W350 HydrophobicContact CD1-CH2 4.43Å; F319-W350 HydrophobicContact CD1-CZ2 4.13Å; F319-W350 HydrophobicContact CE1-CH2 4.16Å; F319-W350 AromaticContact CE1-CZ2 3.72Å; F319-W350 HydrophobicContact CE1-CZ2 3.72Å; F319-R434 PolarHBondContact O-NH1 2.67Å; F319-R434 VanDerWaalsContact O-NH1 3.1Å
320	E	94.9	Very high	93.2	Very high	1 Å²	1	38.2 Å²	38.2	1%	0.005	20%	0.2	C	C	.	.	S	Bend	trans	-85.2	-12.8	175.4	-72.4	-65.5	-172.1	0	0	112.9	E280 T283 K429 F430 N431 M583	E280-E320 HydrophobicContact CB-CG 4.21Å; T283-E320 PolarHBondContact OG1-N 3.46Å; T283-E320 VanDerWaalsContact OG1-N 3.09Å; E320-K429 HydrophobicContact CB-CG 4.36Å; E320-K429 HydrophobicContact CG-CD 4.4Å; E320-K429 WeakPolarHBondContact OE2-CB 3.47Å; E320-F430 PolarHBondContact O-N 3.05Å; E320-N431 WeakPolarHBondContact OE2-CB 3.46Å; E320-N431 PolarHBondContact OE2-N 3.31Å; E320-N431 VanDerWaalsContact OE2-N 3.11Å; E320-M583 WeakPolarHBondContact CG-O 3.09Å; E320-M583 WeakPolarHBondContact OE1-CA 3.48Å; E320-M583 WeakPolarHBondContact OE1-CB 3.28Å; E320-M583 PolarHBondContact OE1-N 3.46Å
321	S	94.6	Very high	93.3	Very high	3 Å²	3	34.6 Å²	34.6	2%	0.021	18%	0.182	C	C	.	.	S	Bend	trans	-157.4	-178.7	169	76.8	0	0	0	0	111.4	T283 F319 Q323 Y325 F430	T283-S321 WeakPolarHBondContact O-CB 3.31Å; T283-S321 PolarHBondContact O-N 3.25Å; T283-S321 PolarHBondContact O-OG 3.26Å; F319-S321 VanDerWaalsContact C-N 3.35Å; F319-S321 VanDerWaalsContact CB-O 3.26Å; F319-S321 WeakPolarHBondContact CB-O 3.32Å; S321-Q323 VanDerWaalsContact C-N 3.28Å; S321-Q323 PolarHBondContact O-N 3.43Å; S321-Q323 PolarHBondContact OG-N 3.37Å; S321-Q323 PolarHBondContact OG-O 3.2Å; S321-Y325 WeakPolarHBondContact OG-CD2 3.41Å; S321-Y325 WeakPolarHBondContact OG-CE2 3.36Å; S321-F430 VanDerWaalsContact CA-CD2 3.49Å
322	S	90.7	Very high	93.3	Very high	72 Å²	72	34.4 Å²	34.4	50%	0.503	18%	0.181	S	C	.	.	S	Bend	trans	-79.7	-3.6	-179.6	55.2	0	0	0	0	114.6	F430	S322-F430 VanDerWaalsContact N-CE2 3.29Å
323	Q	93.6	Very high	93.5	Very high	100 Å²	100	28.8 Å²	28.8	47%	0.467	16%	0.155	S	C	.	.	S	Bend	trans	-152.8	168.3	-174.9	66.3	-175.4	-1.4	0	0	112.4	T283 S321 Y325	T283-Q323 WeakPolarHBondContact CA-O 3.48Å; T283-Q323 WeakPolarHBondContact CB-O 3.26Å; T283-Q323 WeakPolarHBondContact CG2-O 3.31Å; S321-Q323 VanDerWaalsContact C-N 3.28Å; S321-Q323 PolarHBondContact O-N 3.43Å; S321-Q323 PolarHBondContact OG-N 3.37Å; S321-Q323 PolarHBondContact OG-O 3.2Å; Q323-Y325 HydrophobicContact CG-CD2 4.41Å; Q323-Y325 HydrophobicContact CG-CE1 4.3Å; Q323-Y325 HydrophobicContact CG-CE2 4Å; Q323-Y325 VanDerWaalsContact NE2-CE1 3.32Å; Q323-Y325 PolarHBondContact NE2-OH 2.78Å
324	I	95.7	Very high	93.8	Very high	19 Å²	19	28.4 Å²	28.4	10%	0.097	15%	0.151	C	C	.	.			trans	-79.8	129.9	171.1	-59.1	-180	0	0	0	109.1	L282 A326 W350 L351 V356	L282-I324 HydrophobicContact CB-CG1 4.46Å; L282-I324 HydrophobicContact CB-CG2 4.09Å; L282-I324 HydrophobicContact CD2-CG2 4.16Å; L282-I324 CarbonylContact O-C 3.58Å; L282-I324 WeakPolarHBondContact O-CA 3.26Å; L282-I324 WeakPolarHBondContact O-CG2 3.31Å; I324-A326 HydrophobicContact CG2-CB 4.37Å; I324-W350 HydrophobicContact CD1-CD2 3.82Å; I324-W350 HydrophobicContact CD1-CE3 3.92Å; I324-W350 HydrophobicContact CD1-CH2 3.79Å; I324-W350 HydrophobicContact CD1-CZ2 3.68Å; I324-W350 HydrophobicContact CD1-CZ3 3.91Å; I324-W350 HydrophobicContact CG1-CD2 4.47Å; I324-W350 HydrophobicContact CG1-CH2 3.63Å; I324-W350 HydrophobicContact CG1-CZ2 3.4Å; I324-W350 HydrophobicContact CG1-CZ3 4.26Å; I324-L351 HydrophobicContact CD1-CD2 3.92Å; I324-V356 HydrophobicContact CB-CG2 4.07Å; I324-V356 HydrophobicContact CD1-CG2 4.3Å; I324-V356 HydrophobicContact CG2-CG2 3.79Å
325	Y	95	Very high	94	Very high	28 Å²	28	25.9 Å²	25.9	11%	0.11	13%	0.125	C	C	.	.			trans	-102.8	-27.9	177.3	-79.1	-73.8	0	0	0	113.3	L282 P285 H288 S321 Q323 K327 V405	L282-Y325 PolarHBondContact O-N 2.93Å; P285-Y325 HydrophobicContact CB-CD2 4.01Å; P285-Y325 HydrophobicContact CB-CE2 3.95Å; P285-Y325 HydrophobicContact CB-CG 4.41Å; P285-Y325 HydrophobicContact CG-CD2 3.92Å; P285-Y325 HydrophobicContact CG-CE2 3.64Å; H288-Y325 WeakPolarHBondContact CA-O 3.34Å; H288-Y325 HydrophobicContact CB-CD1 4.24Å; H288-Y325 AromaticContact ND1-CD1 3.82Å; S321-Y325 WeakPolarHBondContact OG-CD2 3.41Å; S321-Y325 WeakPolarHBondContact OG-CE2 3.36Å; Q323-Y325 HydrophobicContact CG-CD2 4.41Å; Q323-Y325 HydrophobicContact CG-CE1 4.3Å; Q323-Y325 HydrophobicContact CG-CE2 4Å; Q323-Y325 VanDerWaalsContact NE2-CE1 3.32Å; Q323-Y325 PolarHBondContact NE2-OH 2.78Å; Y325-K327 PolarHBondContact O-N 2.82Å; Y325-V405 HydrophobicContact CD1-CG1 3.89Å; Y325-V405 HydrophobicContact CE1-CB 4.08Å; Y325-V405 HydrophobicContact CE1-CG1 3.69Å
326	A	94.6	Very high	93.7	Very high	2 Å²	2	28.6 Å²	28.6	2%	0.017	14%	0.137	C	C	.	.	B	Isolated β-bridge	trans	-58.9	130.3	172.2	0	0	0	0	0	110	L282 L292 I324 G328	L282-A326 HydrophobicContact CD2-CB 3.77Å; L292-A326 HydrophobicContact CB-CB 4.32Å; I324-A326 HydrophobicContact CG2-CB 4.37Å; A326-G328 VanDerWaalsContact C-N 3.32Å; A326-G328 PolarHBondContact O-N 2.96Å
327	K	93.6	Very high	93.7	Very high	89 Å²	89	31.4 Å²	31.4	39%	0.387	15%	0.149	S	C	.	.	S	Bend	trans	-75.3	-26.7	-174.4	-163.4	65.4	172.1	-176	0	112.6	Q290 L291 Y325	Q290-K327 WeakPolarHBondContact O-CB 3.18Å; Q290-K327 PolarHBondContact O-N 3.26Å; L291-K327 HydrophobicContact CD2-CB 4.25Å; Y325-K327 PolarHBondContact O-N 2.82Å
328	G	96.2	Very high	93.7	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.6	156.8	175	0	0	0	0	0	111	L292 A326 T357	L292-G328 PolarHBondContact N-O 3.43Å; A326-G328 VanDerWaalsContact C-N 3.32Å; A326-G328 PolarHBondContact O-N 2.96Å; G328-T357 CarbonylContact C-O 3.47Å; G328-T357 WeakPolarHBondContact CA-O 3.3Å
329	L	97.3	Very high	93.9	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	140.2	-179.8	178.7	65.8	0	0	0	110.2	L282 L294 V331 L347 L351 T357 C358 I359	L282-L329 HydrophobicContact CD1-CD2 4.37Å; L282-L329 HydrophobicContact CD2-CB 4.44Å; L282-L329 HydrophobicContact CD2-CD1 4.23Å; L294-L329 HydrophobicContact CD1-CD1 3.77Å; L294-L329 HydrophobicContact CG-CD1 3.89Å; L329-V331 HydrophobicContact CD1-CG1 4Å; L329-V331 HydrophobicContact CD2-CG1 4.05Å; L329-V331 HydrophobicContact CG-CG1 3.86Å; L329-L347 HydrophobicContact CD2-CD2 4.09Å; L329-L351 HydrophobicContact CD2-CD1 3.93Å; L329-T357 PolarHBondContact N-O 3.25Å; L329-C358 HydrophobicContact CB-CB 4.09Å; L329-C358 CarbonylContact O-C 3.48Å; L329-C358 WeakPolarHBondContact O-CA 3.38Å; L329-I359 PolarHBondContact O-N 2.99Å
330	I	96.9	Very high	93.9	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	117.9	-178.1	-57.7	166.6	0	0	0	107.7	L246 V269 L291 L292 V293 L294 I359 I362 L367 I381	L246-I330 HydrophobicContact CD1-CD1 4.04Å; L246-I330 HydrophobicContact CD2-CD1 3.85Å; L246-I330 HydrophobicContact CD2-CG2 4.34Å; V269-I330 HydrophobicContact CG1-CD1 4.04Å; L291-I330 HydrophobicContact CB-CD1 4.01Å; L292-I330 PolarHBondContact O-N 3.07Å; V293-I330 WeakPolarHBondContact CA-O 3.5Å; V293-I330 HydrophobicContact CB-CB 4.34Å; V293-I330 HydrophobicContact CG1-CG2 4.29Å; V293-I330 HydrophobicContact CG2-CB 3.92Å; V293-I330 HydrophobicContact CG2-CD1 3.74Å; V293-I330 HydrophobicContact CG2-CG1 4.42Å; V293-I330 HydrophobicContact CG2-CG2 4.07Å; L294-I330 PolarHBondContact N-O 3.11Å; I330-I359 HydrophobicContact CB-CG2 4.23Å; I330-I359 HydrophobicContact CG1-CG2 3.9Å; I330-I359 HydrophobicContact CG2-CG2 4.02Å; I330-I362 HydrophobicContact CG2-CD1 3.09Å; I330-I362 HydrophobicContact CG2-CG1 3.96Å; I330-L367 HydrophobicContact CG2-CD2 3.99Å; I330-I381 HydrophobicContact CG1-CD1 3.98Å
331	V	95.4	Very high	93.8	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	16%	0.164	C	C	.	.			trans	-136.3	158.8	-176.2	-61.7	0	0	0	0	111.3	L294 I299 L329 L334 I359 S360	L294-V331 HydrophobicContact CB-CG1 4.34Å; L294-V331 HydrophobicContact CD1-CG1 4.36Å; I299-V331 HydrophobicContact CB-CB 4.35Å; I299-V331 HydrophobicContact CB-CG1 3.88Å; I299-V331 HydrophobicContact CG1-CB 4.21Å; I299-V331 HydrophobicContact CG1-CG1 3.77Å; I299-V331 HydrophobicContact CG2-CG1 4.02Å; L329-V331 HydrophobicContact CD1-CG1 4Å; L329-V331 HydrophobicContact CD2-CG1 4.05Å; L329-V331 HydrophobicContact CG-CG1 3.86Å; V331-L334 HydrophobicContact CG2-CB 4.17Å; V331-L334 HydrophobicContact CG2-CD1 4.48Å; V331-I359 PolarHBondContact N-O 3.22Å; V331-S360 WeakPolarHBondContact O-CA 3.36Å
332	S	92.6	Very high	93.7	Very high	8 Å²	8	34.4 Å²	34.4	6%	0.056	17%	0.171	C	C	.	.	S	Bend	trans	-77	-49	174	-163.6	0	0	0	0	110.8	S360 G361 I362 T364	S332-S360 PolarHBondContact O-OG 3.14Å; S332-G361 VanDerWaalsContact O-CA 3.23Å; S332-G361 WeakPolarHBondContact O-CA 3.35Å; S332-G361 PolarHBondContact O-N 3.09Å; S332-I362 WeakPolarHBondContact CA-O 3.49Å; S332-I362 PolarHBondContact OG-O 3.18Å; S332-I362 VanDerWaalsContact OG-O 3.08Å; S332-T364 VanDerWaalsContact N-CG2 3.35Å
333	E	91	Very high	93.8	Very high	39 Å²	39	31.8 Å²	31.8	18%	0.182	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	135.7	178.9	-168.1	-161.6	162.4	0	0	110	P297 S298 I299 R1099	P297-E333 WeakPolarHBondContact O-CA 3.12Å; P297-E333 VanDerWaalsContact O-CB 3.27Å; P297-E333 WeakPolarHBondContact O-CB 3.44Å; P297-E333 PolarHBondContact O-N 3.09Å; S298-E333 PolarHBondContact OG-OE2 3.37Å; I299-E333 PolarHBondContact N-O 2.89Å; I299-E333 VanDerWaalsContact N-O 3.1Å; E333-R1099 IonicContact OE1-CZ 3.13Å; E333-R1099 IonicContact OE1-NH1 3.2Å; E333-R1099 PolarHBondContact OE1-NH1 3.17Å; E333-R1099 IonicContact OE1-NH2 3.69Å; E333-R1099 PolarHBondContact OE1-NH2 2.98Å
334	L	92.2	Very high	93.9	Very high	17 Å²	17	31.1 Å²	31.1	9%	0.089	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	117.2	174.6	-173.1	68.5	0	0	0	109.4	Y259 I299 V331 L347 S360	Y259-L334 HydrophobicContact CD1-CD2 3.92Å; Y259-L334 HydrophobicContact CD2-CD2 3.92Å; Y259-L334 HydrophobicContact CG-CD2 3.59Å; I299-L334 WeakPolarHBondContact O-CA 3.23Å; V331-L334 HydrophobicContact CG2-CB 4.17Å; V331-L334 HydrophobicContact CG2-CD1 4.48Å; L334-L347 HydrophobicContact CD1-CB 4.34Å; L334-L347 HydrophobicContact CD1-CD2 3.72Å; L334-L347 HydrophobicContact CD1-CG 4.08Å; L334-S360 PolarHBondContact N-OG 3.22Å; L334-S360 VanDerWaalsContact N-OG 3.15Å
335	C	92.2	Very high	93.9	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.165	C	C	.	.			trans	-82.3	123.2	176.8	-62.9	0	0	0	0	110.5	I299	I299-C335 PolarHBondContact O-N 3.49Å
336	E	88.7	Confident	93.9	Very high	70 Å²	70	32.5 Å²	32.5	33%	0.327	16%	0.164	S	C	.	.	S	Bend	trans	-88.7	-43.1	173.5	-74.2	-66.3	169.2	0	0	111.8	F338 S346 S348	E336-F338 WeakPolarHBondContact O-CD1 3.47Å; E336-F338 PolarHBondContact O-N 2.87Å; E336-S346 PolarHBondContact OE2-OG 3.13Å; E336-S348 WeakPolarHBondContact OE1-CB 3.49Å; E336-S348 PolarHBondContact OE1-OG 2.79Å; E336-S348 PolarHBondContact OE2-OG 3.25Å
337	E	92.6	Very high	93.9	Very high	74 Å²	74	32.4 Å²	32.4	35%	0.346	16%	0.164	S	C	.	.	S	Bend	trans	-77.7	113.8	171.3	-58.7	84.3	174.7	0	0	110	W1095 Y1098	E337-W1095 VanDerWaalsContact O-CD1 3.23Å; E337-Y1098 HydrophobicContact CB-CD2 3.8Å; E337-Y1098 HydrophobicContact CB-CE2 4.4Å; E337-Y1098 HydrophobicContact CB-CG 3.89Å; E337-Y1098 HydrophobicContact CG-CD1 4.14Å; E337-Y1098 HydrophobicContact CG-CD2 4.24Å; E337-Y1098 HydrophobicContact CG-CG 3.98Å
338	F	93.9	Very high	93.9	Very high	61 Å²	61	28.6 Å²	28.6	27%	0.268	15%	0.148	S	C	.	.			trans	-115	157.3	178.5	60.2	-88.6	0	0	0	111.6	G300 N301 G303 E336 A343 K345	G300-F338 WeakPolarHBondContact O-CB 3.37Å; N301-F338 VanDerWaalsContact O-CA 3.24Å; N301-F338 WeakPolarHBondContact O-CA 3.43Å; N301-F338 WeakPolarHBondContact O-CB 3.16Å; G303-F338 VanDerWaalsContact N-CB 3.32Å; E336-F338 WeakPolarHBondContact O-CD1 3.47Å; E336-F338 PolarHBondContact O-N 2.87Å; F338-A343 HydrophobicContact CD2-CB 3.53Å; F338-A343 HydrophobicContact CE2-CB 3.5Å; F338-K345 VanDerWaalsContact CZ-C 3.44Å
339	S	94.2	Very high	93.8	Very high	17 Å²	17	31.9 Å²	31.9	12%	0.119	16%	0.16	C	C	.	.			trans	-142.1	103.5	176.3	-174.7	0	0	0	0	111	N301 D1093	N301-S339 PolarHBondContact O-N 3.43Å; S339-D1093 WeakPolarHBondContact CB-OD1 3.48Å; S339-D1093 PolarHBondContact OG-OD1 3.02Å; S339-D1093 PolarHBondContact OG-OD2 3.05Å
340	H	95.6	Very high	93.7	Very high	21 Å²	21	32.3 Å²	32.3	10%	0.097	16%	0.162	C	C	.	.			trans	-163.1	138.5	171.2	-172.9	-92.4	0	0	0	109.4	Y302 S342 A343 S899 E902	Y302-H340 VanDerWaalsContact O-CB 3.23Å; Y302-H340 WeakPolarHBondContact O-CB 3.33Å; H340-S342 VanDerWaalsContact C-N 3.25Å; H340-S342 PolarHBondContact CE1-OG 2.94Å; H340-S342 PolarHBondContact ND1-N 3.28Å; H340-S342 PolarHBondContact ND1-OG 2.66Å; H340-S342 PolarHBondContact O-N 3.09Å; H340-A343 HydrophobicContact CB-CB 4.24Å; H340-A343 WeakPolarHBondContact O-CB 3.33Å; H340-A343 PolarHBondContact O-N 3.29Å; H340-A343 VanDerWaalsContact O-N 3.11Å; H340-S899 WeakPolarHBondContact NE2-CB 3.24Å; H340-S899 PolarHBondContact NE2-OG 3.11Å; H340-E902 IonicContact CD2-OE1 3.33Å; H340-E902 IonicContact CD2-OE2 3.3Å; H340-E902 PolarHBondContact CD2-OE2 3.25Å; H340-E902 VanDerWaalsContact NE2-CD 3.29Å; H340-E902 IonicContact NE2-OE1 2.64Å; H340-E902 PolarHBondContact NE2-OE1 2.96Å; H340-E902 IonicContact NE2-OE2 3.15Å; H340-E902 PolarHBondContact NE2-OE2 2.94Å
341	F	92.8	Very high	93.6	Very high	81 Å²	81	32.3 Å²	32.3	36%	0.355	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-27.1	-171.8	74.1	-90.2	0	0	0	114.1	L934	F341-L934 HydrophobicContact CE1-CD2 4.27Å; F341-L934 HydrophobicContact CZ-CD2 4.09Å; F341-L934 HydrophobicContact CZ-CG 4.25Å
342	S	92.1	Very high	93.6	Very high	24 Å²	24	35.9 Å²	35.9	17%	0.168	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-12.7	179	76.9	0	0	0	0	113.8	P305 H340	P305-S342 VanDerWaalsContact CA-O 3.32Å; P305-S342 WeakPolarHBondContact CA-O 3.27Å; H340-S342 VanDerWaalsContact C-N 3.25Å; H340-S342 PolarHBondContact CE1-OG 2.94Å; H340-S342 PolarHBondContact ND1-N 3.28Å; H340-S342 PolarHBondContact ND1-OG 2.66Å; H340-S342 PolarHBondContact O-N 3.09Å
343	A	94.2	Very high	93.6	Very high	18 Å²	18	39.9 Å²	39.9	15%	0.149	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	135	-174.2	0	0	0	0	0	111.6	Y302 V304 F338 H340	Y302-A343 WeakPolarHBondContact O-CB 3.4Å; V304-A343 WeakPolarHBondContact O-CA 3.46Å; F338-A343 HydrophobicContact CD2-CB 3.53Å; F338-A343 HydrophobicContact CE2-CB 3.5Å; H340-A343 HydrophobicContact CB-CB 4.24Å; H340-A343 WeakPolarHBondContact O-CB 3.33Å; H340-A343 PolarHBondContact O-N 3.29Å; H340-A343 VanDerWaalsContact O-N 3.11Å
344	V	95.5	Very high	93.7	Very high	86 Å²	86	40.4 Å²	40.4	52%	0.521	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	-12.2	-179.5	-61.4	0	0	0	0	113.4	V304	V304-V344 PolarHBondContact O-N 3.02Å
345	K	94.9	Very high	93.7	Very high	61 Å²	61	41.6 Å²	41.6	27%	0.265	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-159	163.7	178.9	65.3	-174.3	75.1	-164	0	111.6	V304 F338 R349 W350 E353	V304-K345 HydrophobicContact CB-CG 4.19Å; V304-K345 PolarHBondContact N-O 2.95Å; F338-K345 VanDerWaalsContact CZ-C 3.44Å; K345-R349 HydrophobicContact CB-CG 4.4Å; K345-R349 HydrophobicContact CD-CG 4.41Å; K345-W350 HydrophobicContact CD-CB 4.06Å; K345-W350 HydrophobicContact CG-CB 4.39Å; K345-E353 VanDerWaalsContact NZ-CD 3.3Å; K345-E353 IonicContact NZ-OE1 2.83Å; K345-E353 PolarHBondContact NZ-OE1 3.43Å; K345-E353 IonicContact NZ-OE2 2.98Å; K345-E353 PolarHBondContact NZ-OE2 3.29Å
346	S	94.9	Very high	93.9	Very high	15 Å²	15	42 Å²	42	11%	0.105	22%	0.221	C	C	.	.			trans	-74.8	159.1	174.1	70.1	0	0	0	0	111.6	E336 S348 R349 W350	E336-S346 PolarHBondContact OE2-OG 3.13Å; S346-S348 VanDerWaalsContact C-N 3.32Å; S346-S348 PolarHBondContact O-N 3.05Å; S346-S348 PolarHBondContact OG-OG 2.92Å; S346-R349 PolarHBondContact O-N 3Å; S346-R349 PolarHBondContact OG-N 2.83Å; S346-W350 PolarHBondContact O-N 2.89Å; S346-W350 VanDerWaalsContact O-N 3.13Å
347	L	96	Very high	94.2	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-61	-41.1	176.4	176.8	56.1	0	0	0	111.7	Y278 L282 I299 V304 L329 L334 R349 W350 L351	Y278-L347 HydrophobicContact CD2-CD1 4.24Å; Y278-L347 HydrophobicContact CD2-CD2 4.05Å; Y278-L347 HydrophobicContact CE2-CD1 4.41Å; Y278-L347 HydrophobicContact CE2-CD2 4.23Å; Y278-L347 HydrophobicContact CG-CD2 4.49Å; L282-L347 HydrophobicContact CD1-CD1 3.89Å; I299-L347 HydrophobicContact CG2-CD2 3.58Å; V304-L347 HydrophobicContact CG2-CB 4.28Å; V304-L347 HydrophobicContact CG2-CD1 4.24Å; L329-L347 HydrophobicContact CD2-CD2 4.09Å; L334-L347 HydrophobicContact CD1-CB 4.34Å; L334-L347 HydrophobicContact CD1-CD2 3.72Å; L334-L347 HydrophobicContact CD1-CG 4.08Å; L347-R349 VanDerWaalsContact C-N 3.31Å; L347-R349 PolarHBondContact O-N 2.99Å; L347-W350 HydrophobicContact CD1-CE3 3.73Å; L347-W350 HydrophobicContact CD1-CZ3 4.17Å; L347-W350 PolarHBondContact O-N 3.28Å; L347-L351 HydrophobicContact CD1-CD1 3.98Å; L347-L351 HydrophobicContact CD1-CG 4.01Å; L347-L351 HydrophobicContact CG-CD1 3.88Å; L347-L351 HydrophobicContact CG-CG 4.41Å; L347-L351 VanDerWaalsContact O-CG 3.25Å; L347-L351 WeakPolarHBondContact O-CG 3.39Å; L347-L351 PolarHBondContact O-N 2.89Å
348	S	92.1	Very high	94.3	Very high	8 Å²	8	35.2 Å²	35.2	6%	0.056	19%	0.189	C	C	.	.	H	α-helix	trans	-60	-41.6	178.5	69.3	0	0	0	0	112.3	E336 S346 L351 Y352	E336-S348 WeakPolarHBondContact OE1-CB 3.49Å; E336-S348 PolarHBondContact OE1-OG 2.79Å; E336-S348 PolarHBondContact OE2-OG 3.25Å; S346-S348 VanDerWaalsContact C-N 3.32Å; S346-S348 PolarHBondContact O-N 3.05Å; S346-S348 PolarHBondContact OG-OG 2.92Å; S348-L351 PolarHBondContact O-N 3.48Å; S348-Y352 PolarHBondContact O-N 2.94Å
349	R	93.5	Very high	94.4	Very high	70 Å²	70	32.3 Å²	32.3	26%	0.264	18%	0.176	S	C	.	.	H	α-helix	trans	-65.9	-43	177.7	179.2	58.8	-174.3	-160.2	-7.9	111.4	M237 K345 S346 L347 Y352 E353	M237-R349 PolarHBondContact SD-NH1 2.71Å; K345-R349 HydrophobicContact CB-CG 4.4Å; K345-R349 HydrophobicContact CD-CG 4.41Å; S346-R349 PolarHBondContact O-N 3Å; S346-R349 PolarHBondContact OG-N 2.83Å; L347-R349 VanDerWaalsContact C-N 3.31Å; L347-R349 PolarHBondContact O-N 2.99Å; R349-Y352 PolarHBondContact O-N 3.46Å; R349-E353 IonicContact CZ-OE1 2.7Å; R349-E353 IonicContact NE-OE1 3.21Å; R349-E353 PolarHBondContact NE-OE1 3.19Å; R349-E353 IonicContact NH2-OE1 3.8Å; R349-E353 PolarHBondContact NH2-OE1 3.18Å; R349-E353 WeakPolarHBondContact O-CG 3.42Å; R349-E353 PolarHBondContact O-N 3.12Å
350	W	95.9	Very high	94.3	Very high	9 Å²	9	31.9 Å²	31.9	3%	0.034	17%	0.173	C	C	.	.	H	α-helix	trans	-64.1	-40.5	178.1	-177.8	43.5	0	0	0	112.7	V279 L282 T283 V304 F319 I324 K345 S346 L347 E353 S354	V279-W350 HydrophobicContact CG1-CH2 4.15Å; V279-W350 HydrophobicContact CG1-CZ3 4.44Å; L282-W350 HydrophobicContact CB-CH2 4.09Å; L282-W350 HydrophobicContact CB-CZ3 4.17Å; L282-W350 HydrophobicContact CD1-CE3 4.43Å; L282-W350 HydrophobicContact CD1-CH2 4.45Å; L282-W350 HydrophobicContact CD1-CZ3 3.71Å; T283-W350 HydrophobicContact CG2-CH2 3.7Å; T283-W350 HydrophobicContact CG2-CZ2 3.72Å; V304-W350 HydrophobicContact CB-CB 4.4Å; V304-W350 HydrophobicContact CB-CD2 4.47Å; V304-W350 HydrophobicContact CB-CE3 4.39Å; V304-W350 HydrophobicContact CG1-CB 4.31Å; V304-W350 HydrophobicContact CG1-CD2 3.63Å; V304-W350 HydrophobicContact CG1-CE3 3.74Å; V304-W350 HydrophobicContact CG1-CG 3.89Å; V304-W350 HydrophobicContact CG1-CZ3 4.3Å; V304-W350 HydrophobicContact CG2-CB 4.01Å; V304-W350 HydrophobicContact CG2-CD2 4.13Å; V304-W350 HydrophobicContact CG2-CE3 3.67Å; V304-W350 HydrophobicContact CG2-CG 4.31Å; V304-W350 HydrophobicContact CG2-CZ3 4.46Å; F319-W350 HydrophobicContact CD1-CH2 4.43Å; F319-W350 HydrophobicContact CD1-CZ2 4.13Å; F319-W350 HydrophobicContact CE1-CH2 4.16Å; F319-W350 AromaticContact CE1-CZ2 3.72Å; F319-W350 HydrophobicContact CE1-CZ2 3.72Å; I324-W350 HydrophobicContact CD1-CD2 3.82Å; I324-W350 HydrophobicContact CD1-CE3 3.92Å; I324-W350 HydrophobicContact CD1-CH2 3.79Å; I324-W350 HydrophobicContact CD1-CZ2 3.68Å; I324-W350 HydrophobicContact CD1-CZ3 3.91Å; I324-W350 HydrophobicContact CG1-CD2 4.47Å; I324-W350 HydrophobicContact CG1-CH2 3.63Å; I324-W350 HydrophobicContact CG1-CZ2 3.4Å; I324-W350 HydrophobicContact CG1-CZ3 4.26Å; K345-W350 HydrophobicContact CD-CB 4.06Å; K345-W350 HydrophobicContact CG-CB 4.39Å; S346-W350 PolarHBondContact O-N 2.89Å; S346-W350 VanDerWaalsContact O-N 3.13Å; L347-W350 HydrophobicContact CD1-CE3 3.73Å; L347-W350 HydrophobicContact CD1-CZ3 4.17Å; L347-W350 PolarHBondContact O-N 3.28Å; W350-E353 PolarHBondContact O-N 3.45Å; W350-S354 VanDerWaalsContact O-CB 3.29Å; W350-S354 WeakPolarHBondContact O-CB 3.46Å; W350-S354 PolarHBondContact O-N 3.29Å; W350-S354 PolarHBondContact O-OG 2.86Å
351	L	96.1	Very high	93.8	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-64.6	-40.2	175.7	-68.8	165	0	0	0	112.1	L282 I324 L329 L347 S348 S354 G355 V356 C358	L282-L351 HydrophobicContact CD1-CD2 4.3Å; I324-L351 HydrophobicContact CD1-CD2 3.92Å; L329-L351 HydrophobicContact CD2-CD1 3.93Å; L347-L351 HydrophobicContact CD1-CD1 3.98Å; L347-L351 HydrophobicContact CD1-CG 4.01Å; L347-L351 HydrophobicContact CG-CD1 3.88Å; L347-L351 HydrophobicContact CG-CG 4.41Å; L347-L351 VanDerWaalsContact O-CG 3.25Å; L347-L351 WeakPolarHBondContact O-CG 3.39Å; L347-L351 PolarHBondContact O-N 2.89Å; S348-L351 PolarHBondContact O-N 3.48Å; L351-S354 PolarHBondContact O-N 3.31Å; L351-G355 PolarHBondContact O-N 3.35Å; L351-G355 VanDerWaalsContact O-N 3.12Å; L351-V356 HydrophobicContact CD2-CB 3.86Å; L351-V356 HydrophobicContact CD2-CG1 3.76Å; L351-V356 PolarHBondContact O-N 3.13Å; L351-C358 HydrophobicContact CD1-CB 3.76Å
352	Y	93.6	Very high	93.5	Very high	75 Å²	75	27.8 Å²	27.8	29%	0.294	16%	0.158	S	C	.	.	H	α-helix	trans	-61.2	-50.2	174.9	174.5	-95.6	0	0	0	111.6	M237 G260 S348 R349 S354 G355	M237-Y352 HydrophobicContact CE-CD1 4.27Å; M237-Y352 HydrophobicContact CE-CG 4.13Å; M237-Y352 HydrophobicContact SD-CD1 3.35Å; M237-Y352 WeakPolarHBondContact SD-CD1 3.5Å; M237-Y352 HydrophobicContact SD-CD2 3.99Å; M237-Y352 HydrophobicContact SD-CE1 3.49Å; M237-Y352 WeakPolarHBondContact SD-CE1 3.16Å; M237-Y352 HydrophobicContact SD-CE2 4.11Å; M237-Y352 HydrophobicContact SD-CG 3.61Å; G260-Y352 WeakPolarHBondContact O-CD2 3.46Å; S348-Y352 PolarHBondContact O-N 2.94Å; R349-Y352 PolarHBondContact O-N 3.46Å; Y352-S354 PolarHBondContact O-N 2.78Å; Y352-G355 PolarHBondContact O-N 3.36Å; Y352-G355 VanDerWaalsContact O-N 3.16Å
353	E	93.5	Very high	93.4	Very high	91 Å²	91	27.7 Å²	27.7	43%	0.425	16%	0.156	S	C	.	.	H	α-helix	trans	-62.1	-30.4	178.9	-70.9	172	-178.4	0	0	112.5	K345 R349 W350	K345-E353 VanDerWaalsContact NZ-CD 3.3Å; K345-E353 IonicContact NZ-OE1 2.83Å; K345-E353 PolarHBondContact NZ-OE1 3.43Å; K345-E353 IonicContact NZ-OE2 2.98Å; K345-E353 PolarHBondContact NZ-OE2 3.29Å; R349-E353 IonicContact CZ-OE1 2.7Å; R349-E353 IonicContact NE-OE1 3.21Å; R349-E353 PolarHBondContact NE-OE1 3.19Å; R349-E353 IonicContact NH2-OE1 3.8Å; R349-E353 PolarHBondContact NH2-OE1 3.18Å; R349-E353 WeakPolarHBondContact O-CG 3.42Å; R349-E353 PolarHBondContact O-N 3.12Å; W350-E353 PolarHBondContact O-N 3.45Å
354	S	93.3	Very high	93.3	Very high	51 Å²	51	26.9 Å²	26.9	36%	0.357	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.9	-0.1	-179.4	-55.4	0	0	0	0	113.5	W350 L351 Y352 V356	W350-S354 VanDerWaalsContact O-CB 3.29Å; W350-S354 WeakPolarHBondContact O-CB 3.46Å; W350-S354 PolarHBondContact O-N 3.29Å; W350-S354 PolarHBondContact O-OG 2.86Å; L351-S354 PolarHBondContact O-N 3.31Å; Y352-S354 PolarHBondContact O-N 2.78Å; S354-V356 VanDerWaalsContact C-N 3.32Å; S354-V356 PolarHBondContact O-N 2.89Å
355	G	93.1	Very high	93	Very high	42 Å²	42	23 Å²	23	43%	0.433	13%	0.125	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.1	23.5	179.9	0	0	0	0	0	114.8	A261 L351 Y352	A261-G355 VanDerWaalsContact CB-C 3.4Å; L351-G355 PolarHBondContact O-N 3.35Å; L351-G355 VanDerWaalsContact O-N 3.12Å; Y352-G355 PolarHBondContact O-N 3.36Å; Y352-G355 VanDerWaalsContact O-N 3.16Å
356	V	95.3	Very high	92.7	Very high	9 Å²	9	20.7 Å²	20.7	6%	0.055	12%	0.117	C	C	.	.			trans	-103.2	133.2	-176.8	-178.5	0	0	0	0	110.4	G260 A261 I324 L351 S354	G260-V356 WeakPolarHBondContact CA-O 3.35Å; A261-V356 PolarHBondContact N-O 3.08Å; I324-V356 HydrophobicContact CB-CG2 4.07Å; I324-V356 HydrophobicContact CD1-CG2 4.3Å; I324-V356 HydrophobicContact CG2-CG2 3.79Å; L351-V356 HydrophobicContact CD2-CB 3.86Å; L351-V356 HydrophobicContact CD2-CG1 3.76Å; L351-V356 PolarHBondContact O-N 3.13Å; S354-V356 VanDerWaalsContact C-N 3.32Å; S354-V356 PolarHBondContact O-N 2.89Å
357	T	95.2	Very high	92.6	Very high	0 Å²	0	20 Å²	20	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	131.7	178	-59.6	0	0	0	0	110.1	L258 T263 G328 L329 I381	L258-T357 HydrophobicContact CD2-CG2 4.12Å; T263-T357 PolarHBondContact N-OG1 3.43Å; T263-T357 WeakPolarHBondContact O-CB 3.5Å; T263-T357 PolarHBondContact O-OG1 3.46Å; G328-T357 CarbonylContact C-O 3.47Å; G328-T357 WeakPolarHBondContact CA-O 3.3Å; L329-T357 PolarHBondContact N-O 3.25Å; T357-I381 HydrophobicContact CG2-CG2 3.82Å
358	C	95.3	Very high	92.4	Very high	0 Å²	0	20 Å²	20	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	141.5	171.9	175.1	0	0	0	0	110.4	L258 Y259 L329 L351	L258-C358 CarbonylContact C-O 3.52Å; L258-C358 VanDerWaalsContact CA-O 3.26Å; L258-C358 WeakPolarHBondContact CA-O 3.26Å; Y259-C358 PolarHBondContact N-O 3.42Å; Y259-C358 PolarHBondContact O-N 3.14Å; L329-C358 HydrophobicContact CB-CB 4.09Å; L329-C358 CarbonylContact O-C 3.48Å; L329-C358 WeakPolarHBondContact O-CA 3.38Å; L351-C358 HydrophobicContact CD1-CB 3.76Å
359	I	94.6	Very high	92.3	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	127.6	166.7	-168.7	171.1	0	0	0	109.8	L246 F257 L258 L329 I330 V331 I362 I381	L246-I359 HydrophobicContact CB-CD1 4.31Å; F257-I359 CarbonylContact O-C 3.58Å; F257-I359 WeakPolarHBondContact O-CA 3.42Å; L258-I359 HydrophobicContact CD2-CB 4.02Å; L258-I359 HydrophobicContact CD2-CD1 4.32Å; L258-I359 HydrophobicContact CD2-CG1 4.13Å; L329-I359 PolarHBondContact O-N 2.99Å; I330-I359 HydrophobicContact CB-CG2 4.23Å; I330-I359 HydrophobicContact CG1-CG2 3.9Å; I330-I359 HydrophobicContact CG2-CG2 4.02Å; V331-I359 PolarHBondContact N-O 3.22Å; I359-I362 HydrophobicContact CD1-CG2 4.15Å; I359-I362 HydrophobicContact CG1-CG2 4.09Å; I359-I381 HydrophobicContact CB-CG2 4.15Å; I359-I381 HydrophobicContact CG2-CD1 4.05Å; I359-I381 HydrophobicContact CG2-CG1 4.31Å; I359-I381 HydrophobicContact CG2-CG2 4.46Å
360	S	92.3	Very high	92.1	Very high	8 Å²	8	20 Å²	20	6%	0.056	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	168.7	178.4	-171.9	0	0	0	0	111	G256 F257 V331 S332 L334	G256-S360 CarbonylContact C-O 3.59Å; G256-S360 VanDerWaalsContact CA-O 3.25Å; G256-S360 WeakPolarHBondContact CA-O 3.43Å; F257-S360 PolarHBondContact N-O 2.91Å; F257-S360 PolarHBondContact O-N 3.25Å; V331-S360 WeakPolarHBondContact O-CA 3.36Å; S332-S360 PolarHBondContact O-OG 3.14Å; L334-S360 PolarHBondContact N-OG 3.22Å; L334-S360 VanDerWaalsContact N-OG 3.15Å
361	G	85.8	Confident	91.9	Very high	11 Å²	11	19.7 Å²	19.7	11%	0.113	11%	0.113	C	C	.	.	S	Bend	trans	79.2	19.1	179.9	0	0	0	0	0	113.8	S332	S332-G361 VanDerWaalsContact O-CA 3.23Å; S332-G361 WeakPolarHBondContact O-CA 3.35Å; S332-G361 PolarHBondContact O-N 3.09Å
362	I	87.2	Confident	91.6	Very high	5 Å²	5	21.3 Å²	21.3	3%	0.026	12%	0.119	C	C	.	.	S	Bend	trans	-103.7	153.4	178.7	73.6	154.8	0	0	0	112.1	L246 F254 I330 S332 I359 T364 L367	L246-I362 HydrophobicContact CD2-CD1 4.31Å; F254-I362 HydrophobicContact CB-CB 4.45Å; F254-I362 HydrophobicContact CB-CG2 4.3Å; I330-I362 HydrophobicContact CG2-CD1 3.09Å; I330-I362 HydrophobicContact CG2-CG1 3.96Å; S332-I362 WeakPolarHBondContact CA-O 3.49Å; S332-I362 PolarHBondContact OG-O 3.18Å; S332-I362 VanDerWaalsContact OG-O 3.08Å; I359-I362 HydrophobicContact CD1-CG2 4.15Å; I359-I362 HydrophobicContact CG1-CG2 4.09Å; I362-T364 HydrophobicContact CD1-CG2 4.47Å; I362-T364 HydrophobicContact CG1-CG2 4.12Å; I362-T364 PolarHBondContact O-N 3.03Å; I362-L367 HydrophobicContact CD1-CD2 3.87Å
363	D	88.3	Confident	91.3	Very high	23 Å²	23	23.2 Å²	23.2	12%	0.123	13%	0.131	C	C	.	.			trans	-76.6	89.3	173.2	-177.4	-10.3	0	0	0	110.1	R365 S366 L367 R1186 D1208	D363-R365 PolarHBondContact O-N 3.44Å; D363-R365 VanDerWaalsContact OD1-CB 3.3Å; D363-R365 WeakPolarHBondContact OD1-CB 3.48Å; D363-R365 PolarHBondContact OD1-N 2.88Å; D363-R365 VanDerWaalsContact OD1-N 3.1Å; D363-S366 VanDerWaalsContact CG-OG 3.24Å; D363-S366 PolarHBondContact O-N 2.92Å; D363-S366 PolarHBondContact OD1-N 3.05Å; D363-S366 WeakPolarHBondContact OD2-CB 3.45Å; D363-S366 PolarHBondContact OD2-OG 2.98Å; D363-L367 PolarHBondContact O-N 3.4Å; D363-L367 VanDerWaalsContact O-N 3.17Å; D363-R1186 IonicContact OD1-NH2 2.89Å; D363-R1186 IonicContact OD2-CZ 3.94Å; D363-R1186 IonicContact OD2-NH2 3.73Å; D363-R1186 PolarHBondContact OD2-NH2 2.72Å; D363-D1208 HydrophobicContact CB-CB 4.38Å
364	T	92	Very high	91	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-65.4	-26.8	178	56.5	0	0	0	0	112.5	V293 S332 I362 L367 T368 R1030	V293-T364 HydrophobicContact CG1-CG2 4.08Å; S332-T364 VanDerWaalsContact N-CG2 3.35Å; I362-T364 HydrophobicContact CD1-CG2 4.47Å; I362-T364 HydrophobicContact CG1-CG2 4.12Å; I362-T364 PolarHBondContact O-N 3.03Å; T364-L367 PolarHBondContact O-N 2.81Å; T364-T368 WeakPolarHBondContact O-CB 3.35Å; T364-T368 PolarHBondContact O-N 3.41Å; T364-T368 PolarHBondContact O-OG1 2.87Å; T364-R1030 PolarHBondContact OG1-NH2 2.83Å
365	R	90.7	Very high	90.8	Very high	5 Å²	5	22.1 Å²	22.1	2%	0.019	12%	0.12	C	C	.	.	H	α-helix	trans	-63.1	-54.2	175.7	174.7	78	-177.8	156.3	2.6	110.1	D363 L367 T368 L369 D994 D1189 D1249	D363-R365 PolarHBondContact O-N 3.44Å; D363-R365 VanDerWaalsContact OD1-CB 3.3Å; D363-R365 WeakPolarHBondContact OD1-CB 3.48Å; D363-R365 PolarHBondContact OD1-N 2.88Å; D363-R365 VanDerWaalsContact OD1-N 3.1Å; R365-L367 VanDerWaalsContact C-N 3.28Å; R365-L367 PolarHBondContact O-N 3Å; R365-T368 PolarHBondContact O-N 3.48Å; R365-L369 HydrophobicContact CG-CD1 4.33Å; R365-L369 WeakPolarHBondContact O-CG 3.47Å; R365-L369 PolarHBondContact O-N 2.84Å; R365-D994 WeakPolarHBondContact CD-OD2 3.17Å; R365-D994 IonicContact CZ-OD2 3.29Å; R365-D994 IonicContact NE-OD2 3.55Å; R365-D994 IonicContact NH1-OD2 3.45Å; R365-D994 PolarHBondContact NH1-OD2 3.42Å; R365-D1189 IonicContact CZ-OD2 2.92Å; R365-D1189 IonicContact NH1-OD2 3.45Å; R365-D1189 PolarHBondContact NH1-OD2 3.31Å; R365-D1189 IonicContact NH2-OD2 3.49Å; R365-D1189 PolarHBondContact NH2-OD2 2.95Å; R365-D1249 IonicContact CZ-OD2 3.14Å; R365-D1249 IonicContact NE-OD2 2.59Å; R365-D1249 PolarHBondContact NE-OD2 3.36Å; R365-D1249 IonicContact NH2-OD2 3.47Å; R365-D1249 PolarHBondContact NH2-OD2 3.11Å
366	S	88.6	Confident	90.5	Very high	13 Å²	13	21 Å²	21	9%	0.091	11%	0.106	C	C	.	.	H	α-helix	trans	-60.6	-38.7	178.3	-70.2	0	0	0	0	112	D363 K370	D363-S366 VanDerWaalsContact CG-OG 3.24Å; D363-S366 PolarHBondContact O-N 2.92Å; D363-S366 PolarHBondContact OD1-N 3.05Å; D363-S366 WeakPolarHBondContact OD2-CB 3.45Å; D363-S366 PolarHBondContact OD2-OG 2.98Å; S366-K370 WeakPolarHBondContact O-CB 3.4Å; S366-K370 PolarHBondContact O-N 2.85Å; S366-K370 VanDerWaalsContact O-N 3.17Å
367	L	91.5	Very high	90.5	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-64.3	-47.9	176.1	179.6	58.1	0	0	0	112.2	L246 L248 F254 V293 I330 I362 D363 T364 R365 L369 K370 L371	L246-L367 HydrophobicContact CD2-CD1 4.35Å; L246-L367 HydrophobicContact CD2-CD2 3.69Å; L248-L367 HydrophobicContact CD1-CD1 3.87Å; L248-L367 HydrophobicContact CD2-CD1 4.42Å; F254-L367 HydrophobicContact CD2-CD1 4.45Å; F254-L367 HydrophobicContact CE1-CB 4.12Å; F254-L367 HydrophobicContact CE2-CD1 3.9Å; F254-L367 HydrophobicContact CZ-CB 4.13Å; F254-L367 HydrophobicContact CZ-CD1 4.07Å; V293-L367 HydrophobicContact CG1-CD2 4.09Å; V293-L367 HydrophobicContact CG2-CD2 3.6Å; V293-L367 HydrophobicContact CG2-CG 4.36Å; I330-L367 HydrophobicContact CG2-CD2 3.99Å; I362-L367 HydrophobicContact CD1-CD2 3.87Å; D363-L367 PolarHBondContact O-N 3.4Å; D363-L367 VanDerWaalsContact O-N 3.17Å; T364-L367 PolarHBondContact O-N 2.81Å; R365-L367 VanDerWaalsContact C-N 3.28Å; R365-L367 PolarHBondContact O-N 3Å; L367-L369 PolarHBondContact O-N 3.3Å; L367-K370 WeakPolarHBondContact O-CB 3.35Å; L367-K370 PolarHBondContact O-N 3.47Å; L367-L371 HydrophobicContact CD1-CD1 4.19Å; L367-L371 HydrophobicContact CD1-CG 4.26Å; L367-L371 HydrophobicContact CG-CD1 4.11Å; L367-L371 WeakPolarHBondContact O-CG 3.49Å; L367-L371 PolarHBondContact O-N 3.1Å
368	T	92.3	Very high	90.4	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-61.5	-45.4	178.4	-62.8	0	0	0	0	111.6	F271 T295 T364 R365 K370 L371 R372	F271-T368 HydrophobicContact CD1-CG2 4.19Å; F271-T368 HydrophobicContact CD2-CG2 3.85Å; F271-T368 HydrophobicContact CE1-CG2 4.35Å; F271-T368 HydrophobicContact CE2-CG2 4.02Å; F271-T368 HydrophobicContact CG-CG2 3.94Å; F271-T368 HydrophobicContact CZ-CG2 4.27Å; T295-T368 HydrophobicContact CG2-CG2 4.1Å; T295-T368 WeakPolarHBondContact CG2-OG1 3.25Å; T364-T368 WeakPolarHBondContact O-CB 3.35Å; T364-T368 PolarHBondContact O-N 3.41Å; T364-T368 PolarHBondContact O-OG1 2.87Å; R365-T368 PolarHBondContact O-N 3.48Å; T368-K370 PolarHBondContact O-N 2.86Å; T368-L371 PolarHBondContact O-N 3.02Å; T368-R372 WeakPolarHBondContact O-CB 3.33Å; T368-R372 PolarHBondContact O-N 3.4Å
369	L	90	Very high	90.4	Very high	33 Å²	33	22.6 Å²	22.6	17%	0.173	11%	0.113	C	C	.	.	H	α-helix	trans	-58.5	-37.2	177.1	-70.3	177.3	0	0	0	112	R365 L367 Q373	R365-L369 HydrophobicContact CG-CD1 4.33Å; R365-L369 WeakPolarHBondContact O-CG 3.47Å; R365-L369 PolarHBondContact O-N 2.84Å; L367-L369 PolarHBondContact O-N 3.3Å; L369-Q373 WeakPolarHBondContact O-CB 3.29Å; L369-Q373 VanDerWaalsContact O-CG 3.27Å; L369-Q373 WeakPolarHBondContact O-CG 3.33Å; L369-Q373 PolarHBondContact O-N 3.04Å
370	K	90.2	Very high	90.4	Very high	46 Å²	46	23.1 Å²	23.1	20%	0.2	12%	0.116	C	C	.	.	H	α-helix	trans	-69.1	-47.8	177.9	-162.6	160.7	-155.1	-83.2	0	112.4	L248 D250 S252 S366 L367 T368 R372 Q373 H374	L248-K370 HydrophobicContact CD1-CD 4.46Å; D250-K370 IonicContact OD1-NZ 3.37Å; D250-K370 PolarHBondContact OD1-NZ 3.41Å; D250-K370 VanDerWaalsContact OD1-NZ 3.14Å; D250-K370 IonicContact OD2-NZ 3.18Å; D250-K370 PolarHBondContact OD2-NZ 3.42Å; S252-K370 WeakPolarHBondContact OG-CE 3.3Å; S252-K370 PolarHBondContact OG-NZ 3.47Å; S366-K370 WeakPolarHBondContact O-CB 3.4Å; S366-K370 PolarHBondContact O-N 2.85Å; S366-K370 VanDerWaalsContact O-N 3.17Å; L367-K370 WeakPolarHBondContact O-CB 3.35Å; L367-K370 PolarHBondContact O-N 3.47Å; T368-K370 PolarHBondContact O-N 2.86Å; K370-R372 VanDerWaalsContact C-N 3.33Å; K370-R372 PolarHBondContact O-N 3.34Å; K370-Q373 PolarHBondContact O-N 3.4Å; K370-Q373 VanDerWaalsContact O-N 3.14Å; K370-H374 PolarHBondContact O-CD2 3.23Å; K370-H374 PolarHBondContact O-N 3.5Å
371	L	91.7	Very high	90.5	Very high	1 Å²	1	22.8 Å²	22.8	1%	0.005	11%	0.113	C	C	.	.	H	α-helix	trans	-61.6	-40	175.4	-66.8	170.5	0	0	0	111.5	V269 F271 V293 L367 T368 Q373 G375 L377	V269-L371 HydrophobicContact CB-CD2 4.23Å; V269-L371 HydrophobicContact CG1-CD1 3.8Å; V269-L371 HydrophobicContact CG1-CD2 4.27Å; F271-L371 HydrophobicContact CB-CD1 4.46Å; F271-L371 HydrophobicContact CD1-CB 3.87Å; F271-L371 HydrophobicContact CD1-CD1 3.98Å; F271-L371 HydrophobicContact CE1-CB 4.05Å; V293-L371 HydrophobicContact CG2-CD1 4.43Å; L367-L371 HydrophobicContact CD1-CD1 4.19Å; L367-L371 HydrophobicContact CD1-CG 4.26Å; L367-L371 HydrophobicContact CG-CD1 4.11Å; L367-L371 WeakPolarHBondContact O-CG 3.49Å; L367-L371 PolarHBondContact O-N 3.1Å; T368-L371 PolarHBondContact O-N 3.02Å; L371-Q373 VanDerWaalsContact C-N 3.35Å; L371-Q373 PolarHBondContact O-N 3.31Å; L371-G375 CarbonylContact O-C 3.58Å; L371-G375 WeakPolarHBondContact O-CA 3.44Å; L371-G375 PolarHBondContact O-N 3.08Å; L371-L377 HydrophobicContact CD2-CB 4.19Å; L371-L377 HydrophobicContact CD2-CD1 4.42Å; L371-L377 HydrophobicContact CD2-CG 4.35Å
372	R	89	Confident	90.8	Very high	35 Å²	35	22.6 Å²	22.6	13%	0.132	11%	0.109	C	C	.	.	H	α-helix	trans	-62	-41	173.3	179.1	-157	58.3	140.5	-0.9	112.2	T368 K370 K513 G1193 E1194 P1196	T368-R372 WeakPolarHBondContact O-CB 3.33Å; T368-R372 PolarHBondContact O-N 3.4Å; K370-R372 VanDerWaalsContact C-N 3.33Å; K370-R372 PolarHBondContact O-N 3.34Å; R372-K513 WeakPolarHBondContact O-CE 3.47Å; R372-K513 PolarHBondContact O-NZ 3.2Å; R372-G1193 WeakPolarHBondContact CD-O 3.41Å; R372-E1194 WeakPolarHBondContact CD-O 3.45Å; R372-E1194 VanDerWaalsContact CG-O 3.31Å; R372-E1194 WeakPolarHBondContact CG-O 3.37Å; R372-P1196 VanDerWaalsContact NH1-CB 3.26Å; R372-P1196 VanDerWaalsContact NH1-N 3.15Å
373	Q	87.5	Confident	90.8	Very high	115 Å²	115	22.7 Å²	22.7	54%	0.537	11%	0.11	S	C	.	.	H	α-helix	trans	-69.9	-47.5	-179	-78.6	174.3	0.9	0	0	112.6	L369 K370 L371 K513	L369-Q373 WeakPolarHBondContact O-CB 3.29Å; L369-Q373 VanDerWaalsContact O-CG 3.27Å; L369-Q373 WeakPolarHBondContact O-CG 3.33Å; L369-Q373 PolarHBondContact O-N 3.04Å; K370-Q373 PolarHBondContact O-N 3.4Å; K370-Q373 VanDerWaalsContact O-N 3.14Å; L371-Q373 VanDerWaalsContact C-N 3.35Å; L371-Q373 PolarHBondContact O-N 3.31Å; Q373-K513 WeakPolarHBondContact O-CE 3.25Å; Q373-K513 PolarHBondContact O-NZ 2.78Å
374	H	88.2	Confident	90.4	Very high	115 Å²	115	24.7 Å²	24.7	53%	0.532	12%	0.121	S	C	.	.	H	α-helix	trans	-91.9	-17.7	-174.8	-68.7	-81.9	0	0	0	114.2	K370 L377	K370-H374 PolarHBondContact O-CD2 3.23Å; K370-H374 PolarHBondContact O-N 3.5Å; H374-L377 HydrophobicContact CB-CD1 4.29Å; H374-L377 HydrophobicContact CB-CD2 4.35Å; H374-L377 HydrophobicContact CB-CG 4.49Å
375	G	87.2	Confident	89.6	Confident	3 Å²	3	30 Å²	30	3%	0.031	16%	0.157	C	C	.	.			trans	91.8	-179.1	-163.6	0	0	0	0	0	111.6	L371 K513	L371-G375 CarbonylContact O-C 3.58Å; L371-G375 WeakPolarHBondContact O-CA 3.44Å; L371-G375 PolarHBondContact O-N 3.08Å; G375-K513 CarbonylContact C-O 3.58Å; G375-K513 WeakPolarHBondContact CA-O 3.08Å
376	T	88.7	Confident	89	Confident	20 Å²	20	33 Å²	33	12%	0.123	17%	0.174	C	C	.	.	S	Bend	trans	-61.7	141.9	172.6	55	0	0	0	0	110.3	E268 V270 K513 Y514	E268-T376 HydrophobicContact CG-CG2 4.48Å; E268-T376 WeakPolarHBondContact OE1-CB 3.29Å; E268-T376 PolarHBondContact OE1-OG1 3.34Å; V270-T376 HydrophobicContact CG1-CG2 3.99Å; T376-K513 PolarHBondContact N-O 3.03Å; T376-K513 VanDerWaalsContact N-O 3.15Å; T376-Y514 WeakPolarHBondContact CG2-O 3.43Å
377	L	93.5	Very high	88.5	Confident	18 Å²	18	41.7 Å²	41.7	9%	0.094	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	153	-178.9	-66.9	172.8	0	0	0	109.7	L248 E249 V269 L371 H374	L248-L377 HydrophobicContact CD1-CD1 4.12Å; E249-L377 HydrophobicContact CG-CB 4.29Å; E249-L377 HydrophobicContact CG-CD2 4.08Å; E249-L377 VanDerWaalsContact OE1-CA 3.31Å; E249-L377 WeakPolarHBondContact OE1-CA 3.35Å; E249-L377 VanDerWaalsContact OE1-CD2 3.29Å; E249-L377 WeakPolarHBondContact OE1-CD2 3.43Å; V269-L377 PolarHBondContact N-O 2.86Å; L371-L377 HydrophobicContact CD2-CB 4.19Å; L371-L377 HydrophobicContact CD2-CD1 4.42Å; L371-L377 HydrophobicContact CD2-CG 4.35Å; H374-L377 HydrophobicContact CB-CD1 4.29Å; H374-L377 HydrophobicContact CB-CD2 4.35Å; H374-L377 HydrophobicContact CB-CG 4.49Å
378	L	94.1	Very high	87.5	Confident	23 Å²	23	44.4 Å²	44.4	12%	0.12	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	141.7	166.7	-58.2	179.4	0	0	0	110.4	L248 E249 E268 W393 D395	L248-L378 WeakPolarHBondContact CA-O 3.47Å; E249-L378 HydrophobicContact CB-CB 4.16Å; E249-L378 HydrophobicContact CG-CB 4.41Å; E249-L378 PolarHBondContact N-O 3.28Å; E249-L378 PolarHBondContact OE1-N 3.34Å; E268-L378 HydrophobicContact CB-CD2 4.37Å; L378-W393 HydrophobicContact CB-CE3 3.85Å; L378-W393 HydrophobicContact CB-CZ3 4.24Å; L378-D395 HydrophobicContact CD1-CB 4.09Å; L378-D395 HydrophobicContact CD2-CB 4.26Å
379	G	95	Very high	86.8	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	155.8	-179.3	0	0	0	0	0	112.9	I247 S266 G267 V269 L291	I247-G379 CarbonylContact O-C 3.51Å; I247-G379 VanDerWaalsContact O-CA 3.27Å; I247-G379 WeakPolarHBondContact O-CA 3.33Å; S266-G379 WeakPolarHBondContact CA-O 3.46Å; S266-G379 PolarHBondContact OG-O 3.46Å; G267-G379 PolarHBondContact N-O 2.66Å; G267-G379 PolarHBondContact O-N 3.49Å; V269-G379 VanDerWaalsContact CG2-CA 3.49Å; L291-G379 VanDerWaalsContact CD1-O 3.26Å; L291-G379 WeakPolarHBondContact CD1-O 3.32Å
380	K	94.5	Very high	86.2	Confident	12 Å²	12	54.5 Å²	54.5	5%	0.052	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	129	173.9	-71.4	169.9	179	169.3	0	111	L246 I247 Q265 I382 F391 D392 W393	L246-K380 CarbonylContact C-O 3.57Å; L246-K380 WeakPolarHBondContact CA-O 3.27Å; I247-K380 PolarHBondContact N-O 2.74Å; I247-K380 PolarHBondContact O-N 3.41Å; Q265-K380 CarbonylContact O-C 3.54Å; Q265-K380 VanDerWaalsContact O-CA 3.22Å; Q265-K380 WeakPolarHBondContact O-CA 3.37Å; K380-I382 HydrophobicContact CB-CG2 4.34Å; K380-F391 HydrophobicContact CD-CD1 4.16Å; K380-F391 VanDerWaalsContact CE-O 3.25Å; K380-F391 WeakPolarHBondContact CE-O 3.28Å; K380-F391 HydrophobicContact CG-CD1 4.2Å; K380-F391 PolarHBondContact NZ-O 2.74Å; K380-D392 WeakPolarHBondContact CE-O 3.35Å; K380-W393 HydrophobicContact CB-CZ3 4.43Å; K380-W393 HydrophobicContact CD-CD2 3.97Å; K380-W393 HydrophobicContact CD-CE3 3.89Å; K380-W393 HydrophobicContact CD-CH2 4.07Å; K380-W393 HydrophobicContact CD-CZ2 4.16Å; K380-W393 HydrophobicContact CD-CZ3 3.95Å; K380-W393 VanDerWaalsContact CE-CA 3.44Å; K380-W393 VanDerWaalsContact CE-CE3 3.49Å; K380-W393 VanDerWaalsContact CE-CG 3.46Å; K380-W393 VanDerWaalsContact CE-N 3.29Å; K380-W393 HydrophobicContact CG-CD2 4.45Å; K380-W393 HydrophobicContact CG-CE3 3.88Å; K380-W393 HydrophobicContact CG-CH2 4.3Å; K380-W393 HydrophobicContact CG-CZ3 3.8Å; K380-W393 VanDerWaalsContact NZ-CD2 3.25Å; K380-W393 VanDerWaalsContact NZ-CE2 3.25Å; K380-W393 VanDerWaalsContact NZ-N 3.16Å; K380-W393 VanDerWaalsContact NZ-NE1 3.19Å
381	I	94.5	Very high	85.9	Confident	0 Å²	0	55 Å²	55	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	119.9	168.9	-57.1	172.2	0	0	0	107.2	A245 L246 L258 P264 Q265 L291 I330 T357 I359	A245-I381 WeakPolarHBondContact O-CA 3.42Å; L246-I381 HydrophobicContact CD1-CG1 3.94Å; L258-I381 HydrophobicContact CD2-CG2 3.46Å; L258-I381 VanDerWaalsContact CD2-CG2 3.46Å; P264-I381 CarbonylContact C-O 3.45Å; P264-I381 VanDerWaalsContact CA-O 3.26Å; P264-I381 WeakPolarHBondContact CA-O 3.43Å; Q265-I381 PolarHBondContact N-O 2.97Å; Q265-I381 PolarHBondContact O-N 3.44Å; L291-I381 HydrophobicContact CD1-CG1 4.42Å; L291-I381 HydrophobicContact CD2-CD1 4.26Å; I330-I381 HydrophobicContact CG1-CD1 3.98Å; T357-I381 HydrophobicContact CG2-CG2 3.82Å; I359-I381 HydrophobicContact CB-CG2 4.15Å; I359-I381 HydrophobicContact CG2-CD1 4.05Å; I359-I381 HydrophobicContact CG2-CG1 4.31Å; I359-I381 HydrophobicContact CG2-CG2 4.46Å
382	I	92.1	Very high	85.6	Confident	7 Å²	7	61.2 Å²	61.2	4%	0.036	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	145.3	-178.8	64.2	172.4	0	0	0	111.8	G244 A245 I247 P264 K380 P388	G244-I382 CarbonylContact C-O 3.47Å; G244-I382 VanDerWaalsContact CA-O 3.23Å; G244-I382 WeakPolarHBondContact CA-O 3.5Å; A245-I382 PolarHBondContact N-O 3.27Å; A245-I382 PolarHBondContact O-N 2.82Å; I247-I382 HydrophobicContact CD1-CD1 3.51Å; I247-I382 HydrophobicContact CD1-CG1 4.12Å; P264-I382 HydrophobicContact CB-CG2 4.24Å; K380-I382 HydrophobicContact CB-CG2 4.34Å; I382-P388 HydrophobicContact CD1-CB 3.91Å; I382-P388 HydrophobicContact CD1-CG 3.81Å
383	P	87.8	Confident	85.6	Confident	7 Å²	7	64.8 Å²	64.8	5%	0.045	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	141.5	165.6	-20.6	33	0	0	0	111.1	L258 K262 S385 L386	L258-P383 HydrophobicContact CD1-CB 3.96Å; L258-P383 HydrophobicContact CD1-CG 3.71Å; K262-P383 WeakPolarHBondContact O-CG 3.44Å; P383-S385 PolarHBondContact O-N 3.03Å; P383-S385 VanDerWaalsContact O-N 3.1Å; P383-L386 HydrophobicContact CB-CD1 4.21Å; P383-L386 HydrophobicContact CG-CD1 3.85Å; P383-L386 PolarHBondContact O-N 2.99Å
384	L	79.6	Confident	85.6	Confident	66 Å²	66	63.5 Å²	63.5	35%	0.346	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-17.2	179.1	-70.7	-177.7	0	0	0	113.5	A243 A245 L386	A243-L384 HydrophobicContact CB-CD1 3.72Å; A243-L384 HydrophobicContact CB-CG 4.3Å; A243-L384 PolarHBondContact O-N 3.36Å; A245-L384 HydrophobicContact CB-CD2 3.79Å; L384-L386 VanDerWaalsContact C-N 3.26Å; L384-L386 PolarHBondContact O-N 3.3Å
385	S	74	Confident	85.5	Confident	110 Å²	110	60 Å²	60	77%	0.769	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-14.1	174.2	59.2	0	0	0	0	113.9	P383	P383-S385 PolarHBondContact O-N 3.03Å; P383-S385 VanDerWaalsContact O-N 3.1Å
386	L	79.7	Confident	85.4	Confident	70 Å²	70	60 Å²	60	37%	0.366	31%	0.305	S	S	.	.	S	Bend	trans	-101.8	139.9	179.5	-85.8	144.4	0	0	0	110.6	P264 P383 L384	P264-L386 HydrophobicContact CG-CD1 3.78Å; P383-L386 HydrophobicContact CB-CD1 4.21Å; P383-L386 HydrophobicContact CG-CD1 3.85Å; P383-L386 PolarHBondContact O-N 2.99Å; L384-L386 VanDerWaalsContact C-N 3.26Å; L384-L386 PolarHBondContact O-N 3.3Å
387	R	76.8	Confident	85.1	Confident	194 Å²	194	60.4 Å²	60.4	73%	0.732	31%	0.309	S	S	*	.			trans	-74.5	129.4	175	-72.1	-170.7	-173.4	172.7	2.1	110.4	E389 T390	R387-E389 WeakPolarHBondContact CB-OE2 3.47Å; R387-E389 PolarHBondContact O-N 2.77Å; R387-E389 VanDerWaalsContact O-N 3.08Å; R387-T390 HydrophobicContact CB-CG2 4.07Å; R387-T390 WeakPolarHBondContact O-CB 3.21Å; R387-T390 PolarHBondContact O-N 3.45Å; R387-T390 PolarHBondContact O-OG1 3.39Å
388	P	71.4	Confident	84.6	Confident	58 Å²	58	67 Å²	67	38%	0.377	34%	0.337	S	S	.	.	G	3₁₀ helix	trans	-54	-31.9	-176.5	-25.2	31.6	0	0	0	114.8	I247 I382 T390	I247-P388 HydrophobicContact CD1-CB 3.72Å; I247-P388 HydrophobicContact CD1-CG 3.75Å; I382-P388 HydrophobicContact CD1-CB 3.91Å; I382-P388 HydrophobicContact CD1-CG 3.81Å; P388-T390 PolarHBondContact O-N 3.09Å
389	E	76.5	Confident	84.1	Confident	149 Å²	149	68.1 Å²	68.1	70%	0.696	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	-72.6	-11.4	-176.6	-49.5	78.8	-162.7	0	0	113.3	R387 F391	R387-E389 WeakPolarHBondContact CB-OE2 3.47Å; R387-E389 PolarHBondContact O-N 2.77Å; R387-E389 VanDerWaalsContact O-N 3.08Å; E389-F391 VanDerWaalsContact C-N 3.32Å; E389-F391 PolarHBondContact O-N 2.98Å
390	T	78.6	Confident	83.8	Confident	95 Å²	95	69.8 Å²	69.8	58%	0.583	36%	0.355	S	S	*	.	G	3₁₀ helix	trans	-82.4	-6.6	-177	60.1	0	0	0	0	114.3	R387 P388	R387-T390 HydrophobicContact CB-CG2 4.07Å; R387-T390 WeakPolarHBondContact O-CB 3.21Å; R387-T390 PolarHBondContact O-N 3.45Å; R387-T390 PolarHBondContact O-OG1 3.39Å; P388-T390 PolarHBondContact O-N 3.09Å
391	F	82.6	Confident	83.6	Confident	56 Å²	56	69.5 Å²	69.5	25%	0.246	35%	0.354	C	S	.	.	S	Bend	trans	-129.5	126.9	-175.5	-169.9	-109	0	0	0	110.5	P264 Q265 K380 E389	P264-F391 HydrophobicContact CB-CD1 4.06Å; P264-F391 HydrophobicContact CB-CD2 3.81Å; P264-F391 HydrophobicContact CB-CE1 4.07Å; P264-F391 HydrophobicContact CB-CE2 3.84Å; P264-F391 HydrophobicContact CB-CG 3.92Å; P264-F391 HydrophobicContact CB-CZ 3.98Å; Q265-F391 VanDerWaalsContact C-CE1 3.42Å; K380-F391 HydrophobicContact CD-CD1 4.16Å; K380-F391 VanDerWaalsContact CE-O 3.25Å; K380-F391 WeakPolarHBondContact CE-O 3.28Å; K380-F391 HydrophobicContact CG-CD1 4.2Å; K380-F391 PolarHBondContact NZ-O 2.74Å; E389-F391 VanDerWaalsContact C-N 3.32Å; E389-F391 PolarHBondContact O-N 2.98Å
392	D	87.2	Confident	83.6	Confident	133 Å²	133	69.5 Å²	69.5	71%	0.711	35%	0.354	S	S	*	.			trans	-81.2	154.8	-170.7	-74.5	-40.1	0	0	0	114.4	K380	K380-D392 WeakPolarHBondContact CE-O 3.35Å
393	W	88.6	Confident	83.4	Confident	110 Å²	110	72 Å²	72	42%	0.417	37%	0.372	S	S	.	.			trans	-78.6	125.9	175.2	-62.8	100.6	0	0	0	110.1	I247 E249 L378 K380	I247-W393 HydrophobicContact CG2-CH2 4.25Å; E249-W393 HydrophobicContact CB-CE3 4.45Å; E249-W393 HydrophobicContact CB-CH2 4.18Å; E249-W393 HydrophobicContact CB-CZ2 4.49Å; E249-W393 HydrophobicContact CB-CZ3 4.14Å; L378-W393 HydrophobicContact CB-CE3 3.85Å; L378-W393 HydrophobicContact CB-CZ3 4.24Å; K380-W393 HydrophobicContact CB-CZ3 4.43Å; K380-W393 HydrophobicContact CD-CD2 3.97Å; K380-W393 HydrophobicContact CD-CE3 3.89Å; K380-W393 HydrophobicContact CD-CH2 4.07Å; K380-W393 HydrophobicContact CD-CZ2 4.16Å; K380-W393 HydrophobicContact CD-CZ3 3.95Å; K380-W393 VanDerWaalsContact CE-CA 3.44Å; K380-W393 VanDerWaalsContact CE-CE3 3.49Å; K380-W393 VanDerWaalsContact CE-CG 3.46Å; K380-W393 VanDerWaalsContact CE-N 3.29Å; K380-W393 HydrophobicContact CG-CD2 4.45Å; K380-W393 HydrophobicContact CG-CE3 3.88Å; K380-W393 HydrophobicContact CG-CH2 4.3Å; K380-W393 HydrophobicContact CG-CZ3 3.8Å; K380-W393 VanDerWaalsContact NZ-CD2 3.25Å; K380-W393 VanDerWaalsContact NZ-CE2 3.25Å; K380-W393 VanDerWaalsContact NZ-N 3.16Å; K380-W393 VanDerWaalsContact NZ-NE1 3.19Å
394	I	86.1	Confident	83.6	Confident	87 Å²	87	76.6 Å²	76.6	45%	0.446	39%	0.393	S	S	.	.			trans	-107.7	122	176.3	-58.1	174.8	0	0	0	108.5	S266 P396	S266-I394 PolarHBondContact OG-N 3.47Å; I394-P396 WeakPolarHBondContact O-CD 3.37Å
395	D	87.4	Confident	84.3	Confident	41 Å²	41	73.9 Å²	73.9	22%	0.219	38%	0.379	C	S	.	.			trans	-103.5	104.4	175.3	178.4	-2.1	0	0	0	109.7	L378 S397 K398	L378-D395 HydrophobicContact CD1-CB 4.09Å; L378-D395 HydrophobicContact CD2-CB 4.26Å; D395-S397 VanDerWaalsContact CG-OG 3.27Å; D395-S397 PolarHBondContact O-N 2.72Å; D395-S397 VanDerWaalsContact O-N 3.17Å; D395-S397 WeakPolarHBondContact OD1-CB 3.07Å; D395-S397 PolarHBondContact OD1-N 2.65Å; D395-S397 PolarHBondContact OD1-OG 3.2Å; D395-S397 PolarHBondContact OD2-OG 3.1Å; D395-K398 HydrophobicContact CB-CD 4.15Å; D395-K398 HydrophobicContact CB-CG 4.43Å; D395-K398 PolarHBondContact O-N 3.32Å; D395-K398 WeakPolarHBondContact OD2-CE 3.31Å; D395-K398 IonicContact OD2-NZ 3.36Å; D395-K398 PolarHBondContact OD2-NZ 2.89Å
396	P	84.9	Confident	85.3	Confident	5 Å²	5	69.2 Å²	69.2	3%	0.032	35%	0.347	C	S	.	.	G	3₁₀ helix	trans	-63.2	-19.2	-177.6	-21.2	33.3	0	0	0	114.1	E268 S289 I394 K398 L401	E268-P396 HydrophobicContact CB-CG 4.21Å; S289-P396 VanDerWaalsContact O-CG 3.24Å; S289-P396 WeakPolarHBondContact O-CG 3.24Å; I394-P396 WeakPolarHBondContact O-CD 3.37Å; P396-K398 PolarHBondContact O-N 3.23Å; P396-L401 HydrophobicContact CB-CD1 3.9Å
397	S	81.7	Confident	85.8	Confident	28 Å²	28	69 Å²	69	20%	0.196	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-72.4	-12.9	-176.6	70.2	0	0	0	0	114.1	D395	D395-S397 VanDerWaalsContact CG-OG 3.27Å; D395-S397 PolarHBondContact O-N 2.72Å; D395-S397 VanDerWaalsContact O-N 3.17Å; D395-S397 WeakPolarHBondContact OD1-CB 3.07Å; D395-S397 PolarHBondContact OD1-N 2.65Å; D395-S397 PolarHBondContact OD1-OG 3.2Å; D395-S397 PolarHBondContact OD2-OG 3.1Å
398	K	83.6	Confident	86.3	Confident	157 Å²	157	66.2 Å²	66.2	68%	0.683	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	-89.4	-12.8	-176	-67.1	177.7	-179.1	156.7	0	114.4	D395 P396	D395-K398 HydrophobicContact CB-CD 4.15Å; D395-K398 HydrophobicContact CB-CG 4.43Å; D395-K398 PolarHBondContact O-N 3.32Å; D395-K398 WeakPolarHBondContact OD2-CE 3.31Å; D395-K398 IonicContact OD2-NZ 3.36Å; D395-K398 PolarHBondContact OD2-NZ 2.89Å; P396-K398 PolarHBondContact O-N 3.23Å
399	S	82.9	Confident	87.2	Confident	45 Å²	45	67.1 Å²	67.1	32%	0.315	35%	0.347	S	S	.	.	S	Bend	trans	-112.4	159.4	-179	55	0	0	0	0	112.4	L401	S399-L401 VanDerWaalsContact C-N 3.34Å; S399-L401 PolarHBondContact O-N 3.04Å; S399-L401 VanDerWaalsContact O-N 3.11Å; S399-L401 VanDerWaalsContact OG-CD2 3.25Å; S399-L401 WeakPolarHBondContact OG-CD2 3.34Å
400	N	88.5	Confident	87.9	Confident	35 Å²	35	64.9 Å²	64.9	19%	0.187	34%	0.339	C	S	.	.			trans	-81.7	81.9	172	-179.2	9.6	0	0	0	109.7	V402 S403 W448	N400-V402 PolarHBondContact O-N 3.48Å; N400-V402 WeakPolarHBondContact OD1-CB 3.2Å; N400-V402 PolarHBondContact OD1-N 3.36Å; N400-S403 WeakPolarHBondContact O-CB 3.4Å; N400-S403 PolarHBondContact O-N 3.49Å; N400-S403 VanDerWaalsContact O-N 3.09Å; N400-S403 PolarHBondContact O-OG 3.26Å; N400-W448 WeakPolarHBondContact ND2-CH2 3.43Å
401	L	92	Very high	88.5	Confident	6 Å²	6	64.9 Å²	64.9	3%	0.031	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-27.1	-177.4	-62.2	-177.3	0	0	0	113.4	P396 S399 S403 E404 V405 P468	P396-L401 HydrophobicContact CB-CD1 3.9Å; S399-L401 VanDerWaalsContact C-N 3.34Å; S399-L401 PolarHBondContact O-N 3.04Å; S399-L401 VanDerWaalsContact O-N 3.11Å; S399-L401 VanDerWaalsContact OG-CD2 3.25Å; S399-L401 WeakPolarHBondContact OG-CD2 3.34Å; L401-S403 PolarHBondContact O-N 3.21Å; L401-E404 WeakPolarHBondContact O-CB 3.19Å; L401-E404 PolarHBondContact O-N 2.86Å; L401-V405 PolarHBondContact O-N 3.29Å; L401-P468 HydrophobicContact CB-CB 4.04Å; L401-P468 HydrophobicContact CB-CG 3.69Å; L401-P468 HydrophobicContact CD1-CB 4.04Å
402	V	92.7	Very high	89	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-56.6	-38.2	175.2	173.2	0	0	0	0	111.6	N400 E404 V405 S406 C426 W448 I477 L496	N400-V402 PolarHBondContact O-N 3.48Å; N400-V402 WeakPolarHBondContact OD1-CB 3.2Å; N400-V402 PolarHBondContact OD1-N 3.36Å; V402-E404 PolarHBondContact O-N 2.9Å; V402-V405 PolarHBondContact O-N 3.44Å; V402-S406 VanDerWaalsContact O-CB 3.3Å; V402-S406 WeakPolarHBondContact O-CB 3.16Å; V402-S406 PolarHBondContact O-N 2.9Å; V402-C426 HydrophobicContact CG1-CB 3.83Å; V402-C426 HydrophobicContact CG2-CB 4.28Å; V402-W448 HydrophobicContact CG1-CB 3.6Å; V402-W448 HydrophobicContact CG1-CD2 4.22Å; V402-W448 HydrophobicContact CG1-CG 3.81Å; V402-I477 HydrophobicContact CG1-CD1 4.17Å; V402-L496 HydrophobicContact CG2-CD2 3.38Å
403	S	89.9	Confident	89.4	Confident	60 Å²	60	59.7 Å²	59.7	42%	0.42	31%	0.307	S	S	.	.	H	α-helix	trans	-66.9	-16.8	179.5	71.5	0	0	0	0	114.1	N400 L401	N400-S403 WeakPolarHBondContact O-CB 3.4Å; N400-S403 PolarHBondContact O-N 3.49Å; N400-S403 VanDerWaalsContact O-N 3.09Å; N400-S403 PolarHBondContact O-OG 3.26Å; L401-S403 PolarHBondContact O-N 3.21Å
404	E	91.7	Very high	89.7	Confident	103 Å²	103	56.9 Å²	56.9	48%	0.481	30%	0.3	S	S	.	.	H	α-helix	trans	-95.3	-26.8	-179.7	-59.1	176.8	-150.6	0	0	112.6	H288 L401 V402	H288-E404 IonicContact CD2-OE2 3.13Å; H288-E404 IonicContact CE1-OE2 3.69Å; H288-E404 IonicContact NE2-OE2 3.2Å; H288-E404 PolarHBondContact NE2-OE2 2.85Å; L401-E404 WeakPolarHBondContact O-CB 3.19Å; L401-E404 PolarHBondContact O-N 2.86Å; V402-E404 PolarHBondContact O-N 2.9Å
405	V	93.9	Very high	89.9	Confident	9 Å²	9	56.4 Å²	56.4	6%	0.055	30%	0.303	C	S	.	.	H	α-helix	trans	-102.5	-23	-176.4	-59.3	0	0	0	0	114.3	P285 H288 Y325 L401 V402 G427 P468	P285-V405 HydrophobicContact CB-CB 4.31Å; H288-V405 HydrophobicContact CB-CG1 3.64Å; Y325-V405 HydrophobicContact CD1-CG1 3.89Å; Y325-V405 HydrophobicContact CE1-CB 4.08Å; Y325-V405 HydrophobicContact CE1-CG1 3.69Å; L401-V405 PolarHBondContact O-N 3.29Å; V402-V405 PolarHBondContact O-N 3.44Å; V405-G427 VanDerWaalsContact CG2-CA 3.45Å; V405-P468 HydrophobicContact CG1-CG 4.02Å; V405-P468 HydrophobicContact CG2-CG 3.77Å
406	S	93.9	Very high	90.1	Very high	13 Å²	13	62.8 Å²	62.8	9%	0.091	33%	0.331	C	S	.	.	S	Bend	trans	-67.3	143.8	177.3	168.6	0	0	0	0	111	V402 D425 W448	V402-S406 VanDerWaalsContact O-CB 3.3Å; V402-S406 WeakPolarHBondContact O-CB 3.16Å; V402-S406 PolarHBondContact O-N 2.9Å; S406-D425 VanDerWaalsContact CB-O 3.27Å; S406-D425 WeakPolarHBondContact CB-O 3.46Å; S406-D425 PolarHBondContact OG-O 3.24Å; S406-W448 VanDerWaalsContact CB-CD1 3.47Å; S406-W448 PolarHBondContact OG-N 3.37Å; S406-W448 VanDerWaalsContact OG-N 3.09Å
407	R	90.8	Very high	90.4	Very high	65 Å²	65	63.4 Å²	63.4	25%	0.245	34%	0.338	C	S	.	.			trans	-61.7	156.3	167.1	74.3	-172.5	-53.4	132	16.6	112.4	D409 D425 V445 P447	R407-D409 VanDerWaalsContact CD-O 3.27Å; R407-D409 WeakPolarHBondContact CD-O 3.17Å; R407-D409 WeakPolarHBondContact CG-O 3.31Å; R407-D409 IonicContact CZ-OD1 3.48Å; R407-D409 PolarHBondContact NE-O 3.05Å; R407-D409 IonicContact NE-OD1 2.72Å; R407-D409 PolarHBondContact NE-OD1 2.76Å; R407-D409 IonicContact NH2-OD1 3.91Å; R407-D409 PolarHBondContact NH2-OD1 3.49Å; R407-D409 VanDerWaalsContact NH2-OD1 3.13Å; R407-D409 IonicContact NH2-OD2 3.35Å; R407-D409 PolarHBondContact NH2-OD2 3.13Å; R407-D425 WeakPolarHBondContact CB-OD2 3.45Å; R407-D425 HydrophobicContact CG-CB 4.32Å; R407-D425 VanDerWaalsContact CG-OD2 3.24Å; R407-D425 WeakPolarHBondContact CG-OD2 3.25Å; R407-D425 PolarHBondContact N-OD2 2.9Å; R407-V445 VanDerWaalsContact CD-CG1 3.46Å; R407-V445 HydrophobicContact CG-CG1 4.49Å; R407-P447 VanDerWaalsContact O-CB 3.31Å; R407-P447 WeakPolarHBondContact O-CB 3.35Å
408	T	88.6	Confident	90.9	Very high	135 Å²	135	67 Å²	67	83%	0.828	36%	0.355	S	S	*	.	S	Bend	trans	-97.2	-25.1	178.2	54.6	0	0	0	0	113.7	P447	T408-P447 WeakPolarHBondContact O-CG 3.32Å
409	D	90.2	Very high	91.3	Very high	77 Å²	77	59.7 Å²	59.7	41%	0.412	32%	0.324	S	S	.	.	S	Bend	trans	-102.8	147.9	-177.5	66.8	-50.5	0	0	0	111.8	R407	R407-D409 VanDerWaalsContact CD-O 3.27Å; R407-D409 WeakPolarHBondContact CD-O 3.17Å; R407-D409 WeakPolarHBondContact CG-O 3.31Å; R407-D409 IonicContact CZ-OD1 3.48Å; R407-D409 PolarHBondContact NE-O 3.05Å; R407-D409 IonicContact NE-OD1 2.72Å; R407-D409 PolarHBondContact NE-OD1 2.76Å; R407-D409 IonicContact NH2-OD1 3.91Å; R407-D409 PolarHBondContact NH2-OD1 3.49Å; R407-D409 VanDerWaalsContact NH2-OD1 3.13Å; R407-D409 IonicContact NH2-OD2 3.35Å; R407-D409 PolarHBondContact NH2-OD2 3.13Å
410	I	89.9	Confident	91.9	Very high	102 Å²	102	58.7 Å²	58.7	52%	0.523	31%	0.314	S	S	.	.			trans	-77.8	127.4	170.9	-63.9	173.4	0	0	0	108.9	T444 V445 L446 P447	I410-T444 HydrophobicContact CG2-CG2 3.46Å; I410-T444 VanDerWaalsContact CG2-CG2 3.46Å; I410-V445 WeakPolarHBondContact CA-O 3.46Å; I410-L446 HydrophobicContact CD1-CD2 3.83Å; I410-L446 HydrophobicContact CG1-CD2 3.86Å; I410-L446 HydrophobicContact CG2-CD2 3.92Å; I410-P447 HydrophobicContact CG1-CG 4.45Å
411	K	92	Very high	92.2	Very high	96 Å²	96	57 Å²	57	42%	0.417	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	134.5	179.4	-175.2	70.8	179.5	-172.9	0	111.4	F413 T444 V445	K411-F413 HydrophobicContact CB-CE2 4.06Å; K411-F413 HydrophobicContact CG-CD2 4.11Å; K411-F413 HydrophobicContact CG-CE1 4.49Å; K411-F413 HydrophobicContact CG-CE2 3.47Å; K411-F413 VanDerWaalsContact CG-CE2 3.47Å; K411-F413 HydrophobicContact CG-CZ 3.7Å; K411-T444 CarbonylContact O-C 3.57Å; K411-T444 WeakPolarHBondContact O-CA 3.36Å; K411-V445 PolarHBondContact N-O 2.76Å; K411-V445 VanDerWaalsContact N-O 3.08Å; K411-V445 PolarHBondContact O-N 2.91Å
412	V	92.8	Very high	92.3	Very high	61 Å²	61	56.8 Å²	56.8	37%	0.37	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	127.1	175.7	-172	0	0	0	0	109.7	P415 K442 V443 T444	V412-P415 HydrophobicContact CG1-CB 4.24Å; V412-K442 HydrophobicContact CG1-CG 4.03Å; V412-V443 CarbonylContact C-O 3.54Å; V412-V443 WeakPolarHBondContact CA-O 3.19Å; V412-T444 HydrophobicContact CG2-CG2 4.28Å
413	F	94.9	Very high	92.5	Very high	19 Å²	19	56.8 Å²	56.8	8%	0.083	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	143.4	171.3	-64.3	-91.5	0	0	0	109.7	L315 K411 I433 V437 V443 V445	L315-F413 HydrophobicContact CD1-CE1 4.35Å; L315-F413 HydrophobicContact CD2-CE1 3.9Å; L315-F413 HydrophobicContact CD2-CZ 4.1Å; L315-F413 HydrophobicContact CG-CE1 4.18Å; K411-F413 HydrophobicContact CB-CE2 4.06Å; K411-F413 HydrophobicContact CG-CD2 4.11Å; K411-F413 HydrophobicContact CG-CE1 4.49Å; K411-F413 HydrophobicContact CG-CE2 3.47Å; K411-F413 VanDerWaalsContact CG-CE2 3.47Å; K411-F413 HydrophobicContact CG-CZ 3.7Å; F413-I433 HydrophobicContact CB-CG2 4.06Å; F413-I433 HydrophobicContact CD1-CG2 4.04Å; F413-I433 HydrophobicContact CD2-CD1 4.4Å; F413-I433 HydrophobicContact CD2-CG2 3.97Å; F413-I433 HydrophobicContact CE1-CG2 4.48Å; F413-I433 HydrophobicContact CE2-CD1 3.91Å; F413-I433 HydrophobicContact CE2-CG2 4.43Å; F413-I433 HydrophobicContact CG-CG2 3.76Å; F413-I433 HydrophobicContact CZ-CD1 4.09Å; F413-V437 HydrophobicContact CB-CG2 3.93Å; F413-V443 HydrophobicContact CB-CB 4.47Å; F413-V443 PolarHBondContact N-O 3.48Å; F413-V443 PolarHBondContact O-N 2.92Å; F413-V445 HydrophobicContact CD2-CG2 3.82Å; F413-V445 HydrophobicContact CE2-CG2 3.75Å
414	N	94.9	Very high	92.7	Very high	51 Å²	51	53.9 Å²	53.9	27%	0.273	28%	0.284	S	S	.	.	S	Bend	trans	47.4	64.1	-175.5	-173.8	27.7	0	0	0	113	H416 G417 V437 G440 A441 K442	N414-H416 PolarHBondContact O-N 2.86Å; N414-G417 PolarHBondContact O-N 2.68Å; N414-V437 HydrophobicContact CB-CG1 4.03Å; N414-V437 HydrophobicContact CB-CG2 4.08Å; N414-G440 VanDerWaalsContact ND2-C 3.33Å; N414-G440 PolarHBondContact ND2-O 3.02Å; N414-A441 WeakPolarHBondContact CB-O 3.2Å; N414-A441 PolarHBondContact ND2-O 2.88Å; N414-K442 VanDerWaalsContact O-CA 3.25Å; N414-K442 WeakPolarHBondContact O-CA 3.42Å; N414-K442 VanDerWaalsContact O-CB 3.24Å; N414-K442 WeakPolarHBondContact O-CB 3.32Å; N414-K442 WeakPolarHBondContact O-CG 3.32Å
415	P	91.1	Very high	92.9	Very high	76 Å²	76	49.5 Å²	49.5	49%	0.494	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-15.8	-171.8	25.8	-35.7	0	0	0	114.8	V412 K442	V412-P415 HydrophobicContact CG1-CB 4.24Å; P415-K442 WeakPolarHBondContact O-CD 3.48Å
416	H	91.5	Very high	93	Very high	176 Å²	176	49.1 Å²	49.1	82%	0.815	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.1	6.9	178.6	-55.4	-60.3	0	0	0	113.6	N414	N414-H416 PolarHBondContact O-N 2.86Å
417	G	91.9	Very high	93	Very high	18 Å²	18	48.5 Å²	48.5	19%	0.186	26%	0.257	C	S	.	.			trans	-61.6	150.9	177.8	0	0	0	0	0	113.2	N414 G440	N414-G417 PolarHBondContact O-N 2.68Å; G417-G440 CarbonylContact C-O 3.13Å; G417-G440 WeakPolarHBondContact CA-O 3.35Å
418	D	92	Very high	93.2	Very high	102 Å²	102	45.9 Å²	45.9	55%	0.545	25%	0.248	S	C	.	.	S	Bend	trans	-78.8	-25.8	-171.5	66.7	-35.7	0	0	0	113.7	G440 R601	D418-G440 PolarHBondContact N-O 3.08Å; D418-G440 VanDerWaalsContact OD1-O 3.07Å; D418-R601 IonicContact OD1-CZ 2.77Å; D418-R601 IonicContact OD1-NE 3.73Å; D418-R601 IonicContact OD1-NH2 3.59Å; D418-R601 PolarHBondContact OD1-NH2 2.92Å; D418-R601 IonicContact OD2-CZ 3.73Å; D418-R601 IonicContact OD2-NE 2.77Å; D418-R601 PolarHBondContact OD2-NE 2.58Å; D418-R601 IonicContact OD2-NH2 3.47Å; D418-R601 PolarHBondContact OD2-NH2 2.85Å
419	V	92.3	Very high	93.6	Very high	5 Å²	5	39.5 Å²	39.5	3%	0.03	21%	0.208	C	C	.	.	S	Bend	trans	-117.4	129	175.9	177.9	0	0	0	0	109.5	I421 K442 D460 L597 I600 R601	V419-I421 HydrophobicContact CG1-CD1 3.66Å; V419-I421 HydrophobicContact CG1-CG1 4.26Å; V419-K442 PolarHBondContact O-N 2.73Å; V419-D460 HydrophobicContact CG1-CB 4.17Å; V419-L597 HydrophobicContact CB-CD2 4.45Å; V419-L597 HydrophobicContact CG1-CD2 4.26Å; V419-I600 HydrophobicContact CG1-CB 4.16Å; V419-I600 HydrophobicContact CG1-CD1 4Å; V419-I600 HydrophobicContact CG1-CG2 3.52Å; V419-I600 HydrophobicContact CG2-CG2 4.19Å; V419-R601 HydrophobicContact CG2-CG 3.69Å
420	H	94.4	Very high	93.8	Very high	24 Å²	24	37.3 Å²	37.3	11%	0.111	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	102.4	-178.6	-164.5	-179.4	0	0	0	112.1	K442 T444 Y459 D460	H420-K442 CarbonylContact C-O 3.17Å; H420-K442 WeakPolarHBondContact CA-O 3.49Å; H420-K442 HydrophobicContact CB-CD 4.29Å; H420-K442 PolarHBondContact CE1-NZ 3.27Å; H420-K442 VanDerWaalsContact CE1-NZ 3.28Å; H420-K442 PolarHBondContact ND1-NZ 2.69Å; H420-T444 PolarHBondContact NE2-OG1 2.99Å; H420-Y459 AromaticContact CD2-CD1 3.78Å; H420-Y459 AromaticContact CE1-CD1 3.66Å; H420-Y459 AromaticContact CE1-CE1 3.5Å; H420-Y459 AromaticContact NE2-CD1 3.56Å; H420-Y459 AromaticContact NE2-CE1 3.36Å; H420-Y459 WeakPolarHBondContact NE2-CE1 3.13Å; H420-D460 PolarHBondContact N-OD2 2.87Å; H420-D460 PolarHBondContact O-N 2.9Å
421	I	95	Very high	94.1	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	129.8	178.7	-52.2	-61.6	0	0	0	110.4	V419 F436 A441 K442 T444 A461 F463 F596 L597 I600	V419-I421 HydrophobicContact CG1-CD1 3.66Å; V419-I421 HydrophobicContact CG1-CG1 4.26Å; I421-F436 HydrophobicContact CG1-CD1 4.49Å; I421-A441 HydrophobicContact CG1-CB 4.22Å; I421-K442 PolarHBondContact N-O 3.09Å; I421-T444 PolarHBondContact O-N 3.03Å; I421-A461 HydrophobicContact CD1-CB 3.79Å; I421-F463 HydrophobicContact CG2-CB 3.8Å; I421-F596 HydrophobicContact CD1-CE1 4.25Å; I421-L597 HydrophobicContact CD1-CD2 4.15Å; I421-L597 HydrophobicContact CG1-CD2 4.31Å; I421-I600 HydrophobicContact CD1-CD1 3.66Å
422	A	94.4	Very high	94.3	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	119.2	159.9	0	0	0	0	0	108.9	L446 Y459 A461 L462 F463	A422-L446 HydrophobicContact CB-CD1 3.89Å; A422-Y459 HydrophobicContact CB-CD1 3.77Å; A422-Y459 HydrophobicContact CB-CD2 3.62Å; A422-Y459 HydrophobicContact CB-CE1 4.05Å; A422-Y459 HydrophobicContact CB-CE2 3.89Å; A422-Y459 HydrophobicContact CB-CG 3.55Å; A422-A461 PolarHBondContact N-O 3.26Å; A422-L462 HydrophobicContact CB-CD1 4.18Å; A422-L462 CarbonylContact O-C 3.56Å; A422-L462 WeakPolarHBondContact O-CA 3.25Å; A422-F463 PolarHBondContact O-N 2.94Å
423	A	95.8	Very high	94.4	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	111.2	175.7	0	0	0	0	0	109.3	D425 M428 V443 T444 V445 L446 F463	A423-D425 PolarHBondContact O-N 3.46Å; A423-M428 HydrophobicContact CB-CE 3.83Å; A423-M428 HydrophobicContact CB-SD 4.15Å; A423-V443 HydrophobicContact CB-CG1 3.74Å; A423-T444 PolarHBondContact N-O 3.41Å; A423-V445 HydrophobicContact CB-CG2 4.43Å; A423-V445 CarbonylContact O-C 3.58Å; A423-V445 WeakPolarHBondContact O-CA 3.43Å; A423-L446 PolarHBondContact O-N 2.89Å; A423-F463 CarbonylContact C-O 3.52Å; A423-F463 WeakPolarHBondContact CA-O 3.42Å; A423-F463 HydrophobicContact CB-CB 4.41Å; A423-F463 HydrophobicContact CB-CD1 4Å
424	L	95	Very high	94.4	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	115.2	174.4	-169	68.7	0	0	0	109.2	C426 L446 P447 F463 I464 S465 I477	L424-C426 PolarHBondContact O-N 2.88Å; L424-L446 HydrophobicContact CD1-CB 4.37Å; L424-P447 WeakPolarHBondContact CD1-O 3.43Å; L424-F463 PolarHBondContact N-O 2.87Å; L424-I464 HydrophobicContact CB-CG1 4.49Å; L424-I464 HydrophobicContact CD2-CG2 4.44Å; L424-S465 PolarHBondContact O-N 2.87Å; L424-S465 VanDerWaalsContact O-N 3.15Å; L424-S465 PolarHBondContact O-OG 2.99Å; L424-I477 HydrophobicContact CD2-CG2 3.67Å
425	D	96.3	Very high	94.4	Very high	11 Å²	11	22.2 Å²	22.2	6%	0.059	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	105.4	-179.3	179.4	8	0	0	0	110.4	S406 R407 A423 G427 M428 V445 L446 W448	S406-D425 VanDerWaalsContact CB-O 3.27Å; S406-D425 WeakPolarHBondContact CB-O 3.46Å; S406-D425 PolarHBondContact OG-O 3.24Å; R407-D425 WeakPolarHBondContact CB-OD2 3.45Å; R407-D425 HydrophobicContact CG-CB 4.32Å; R407-D425 VanDerWaalsContact CG-OD2 3.24Å; R407-D425 WeakPolarHBondContact CG-OD2 3.25Å; R407-D425 PolarHBondContact N-OD2 2.9Å; A423-D425 PolarHBondContact O-N 3.46Å; D425-G427 PolarHBondContact OD1-N 2.87Å; D425-M428 HydrophobicContact CB-CB 4.22Å; D425-M428 VanDerWaalsContact OD1-CB 3.24Å; D425-M428 WeakPolarHBondContact OD1-CB 3.37Å; D425-M428 PolarHBondContact OD1-N 3.16Å; D425-V445 HydrophobicContact CB-CG1 3.71Å; D425-L446 WeakPolarHBondContact CB-O 3.31Å; D425-L446 PolarHBondContact N-O 3.17Å; D425-W448 WeakPolarHBondContact O-CA 3.18Å; D425-W448 VanDerWaalsContact O-CB 3.29Å; D425-W448 WeakPolarHBondContact O-CB 3.36Å; D425-W448 PolarHBondContact O-N 2.78Å
426	C	95.3	Very high	94.7	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	10%	0.095	C	C	.	.	S	Bend	trans	-103.9	13.4	172.8	-63.8	0	0	0	0	113	V402 L424 S465 N466 G467 L496	V402-C426 HydrophobicContact CG1-CB 3.83Å; V402-C426 HydrophobicContact CG2-CB 4.28Å; L424-C426 PolarHBondContact O-N 2.88Å; C426-S465 PolarHBondContact N-OG 2.95Å; C426-N466 CarbonylContact C-O 3.59Å; C426-N466 WeakPolarHBondContact CB-O 3.05Å; C426-G467 WeakPolarHBondContact O-CA 3.31Å; C426-L496 HydrophobicContact CB-CD2 4.04Å
427	G	94.2	Very high	94.9	Very high	0 Å²	0	11.5 Å²	11.5	0%	0	6%	0.064	C	C	.	.	S	Bend	trans	117.6	44.8	-159.3	0	0	0	0	0	110.9	P285 V405 D425 N466	P285-G427 WeakPolarHBondContact CB-O 3.12Å; V405-G427 VanDerWaalsContact CG2-CA 3.45Å; D425-G427 PolarHBondContact OD1-N 2.87Å; G427-N466 CarbonylContact C-O 3.49Å; G427-N466 PolarHBondContact O-ND2 3.2Å; G427-N466 PolarHBondContact O-OD1 3.46Å
428	M	95.6	Very high	94.9	Very high	11 Å²	11	17.7 Å²	17.7	5%	0.054	8%	0.082	C	C	.	.			trans	-68.7	127.8	-171.5	-167.7	177.9	-170.1	0	0	111.6	A423 D425 Q432 I433 V445 F463	A423-M428 HydrophobicContact CB-CE 3.83Å; A423-M428 HydrophobicContact CB-SD 4.15Å; D425-M428 HydrophobicContact CB-CB 4.22Å; D425-M428 VanDerWaalsContact OD1-CB 3.24Å; D425-M428 WeakPolarHBondContact OD1-CB 3.37Å; D425-M428 PolarHBondContact OD1-N 3.16Å; M428-Q432 HydrophobicContact CE-CB 3.77Å; M428-Q432 HydrophobicContact CG-CB 4.43Å; M428-Q432 VanDerWaalsContact CG-OE1 3.24Å; M428-I433 HydrophobicContact CE-CG1 3.54Å; M428-I433 HydrophobicContact SD-CD1 4.22Å; M428-I433 HydrophobicContact SD-CG1 3.86Å; M428-V445 HydrophobicContact SD-CG1 3.84Å; M428-V445 HydrophobicContact SD-CG2 4.01Å; M428-F463 HydrophobicContact CE-CD1 4.14Å; M428-F463 HydrophobicContact CE-CE1 3.93Å
429	K	95.8	Very high	95	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	6%	0.063	C	C	.	.			trans	-73.9	139.6	170.5	-71	-174.8	-144	-166.4	0	111.5	D284 E320 N431 Q432 N466 N537 H579 H582	D284-K429 VanDerWaalsContact CG-CE 3.42Å; D284-K429 VanDerWaalsContact OD1-CE 3.23Å; D284-K429 WeakPolarHBondContact OD1-CE 3.1Å; D284-K429 IonicContact OD1-NZ 3.73Å; D284-K429 WeakPolarHBondContact OD2-CE 3.35Å; D284-K429 IonicContact OD2-NZ 2.74Å; D284-K429 PolarHBondContact OD2-NZ 2.97Å; E320-K429 HydrophobicContact CB-CG 4.36Å; E320-K429 HydrophobicContact CG-CD 4.4Å; E320-K429 WeakPolarHBondContact OE2-CB 3.47Å; K429-N431 PolarHBondContact O-N 3.45Å; K429-Q432 HydrophobicContact CB-CG 4.21Å; K429-Q432 WeakPolarHBondContact O-CB 3.2Å; K429-Q432 PolarHBondContact O-N 3Å; K429-Q432 VanDerWaalsContact O-N 3.09Å; K429-N466 WeakPolarHBondContact CE-ND2 3.32Å; K429-N466 PolarHBondContact N-OD1 2.9Å; K429-N537 PolarHBondContact NZ-ND2 3.47Å; K429-H579 PolarHBondContact NZ-CE1 3.33Å; K429-H579 VanDerWaalsContact NZ-CE1 3.33Å; K429-H579 PolarHBondContact NZ-ND1 3.47Å; K429-H579 VanDerWaalsContact NZ-ND1 3.15Å; K429-H582 PolarHBondContact NZ-CD2 2.58Å; K429-H582 PolarHBondContact NZ-NE2 2.77Å
430	F	95.8	Very high	95.1	Very high	32 Å²	32	15.9 Å²	15.9	14%	0.14	8%	0.075	C	C	.	.	H	α-helix	trans	-59.2	-33.2	177	-72.5	-12.2	0	0	0	112.3	L315 P316 E320 S321 S322 Q432 I433 R434	L315-F430 HydrophobicContact CB-CD2 4.28Å; L315-F430 HydrophobicContact CB-CG 4.45Å; L315-F430 HydrophobicContact CD1-CB 4.11Å; L315-F430 HydrophobicContact CD1-CD1 4.36Å; L315-F430 HydrophobicContact CD1-CG 4.21Å; L315-F430 HydrophobicContact CD2-CD1 4.1Å; L315-F430 HydrophobicContact CD2-CD2 4.45Å; L315-F430 HydrophobicContact CD2-CE1 4.08Å; L315-F430 HydrophobicContact CD2-CE2 4.43Å; L315-F430 HydrophobicContact CD2-CG 4.29Å; L315-F430 HydrophobicContact CD2-CZ 4.24Å; P316-F430 HydrophobicContact CG-CE2 4.05Å; E320-F430 PolarHBondContact O-N 3.05Å; S321-F430 VanDerWaalsContact CA-CD2 3.49Å; S322-F430 VanDerWaalsContact N-CE2 3.29Å; F430-Q432 VanDerWaalsContact C-N 3.26Å; F430-Q432 PolarHBondContact O-N 2.71Å; F430-I433 HydrophobicContact CD1-CD1 4.46Å; F430-I433 WeakPolarHBondContact O-CB 3.36Å; F430-I433 PolarHBondContact O-N 3.02Å; F430-I433 VanDerWaalsContact O-N 3.11Å; F430-R434 PolarHBondContact O-N 3.23Å; F430-R434 VanDerWaalsContact O-N 3.12Å
431	N	94.8	Very high	95.2	Very high	2 Å²	2	14.8 Å²	14.8	1%	0.011	7%	0.07	C	C	.	.	H	α-helix	trans	-66.9	-24.2	178.3	-154.3	45.1	0	0	0	113.9	E320 K429 I433 R434 C435 E581	E320-N431 WeakPolarHBondContact OE2-CB 3.46Å; E320-N431 PolarHBondContact OE2-N 3.31Å; E320-N431 VanDerWaalsContact OE2-N 3.11Å; K429-N431 PolarHBondContact O-N 3.45Å; N431-I433 VanDerWaalsContact C-N 3.31Å; N431-I433 PolarHBondContact O-N 3.36Å; N431-R434 WeakPolarHBondContact O-CB 3.35Å; N431-R434 PolarHBondContact O-N 3.32Å; N431-R434 WeakPolarHBondContact OD1-CD 3.48Å; N431-C435 PolarHBondContact O-N 3.19Å; N431-C435 PolarHBondContact O-SG 2.86Å; N431-E581 PolarHBondContact ND2-O 2.85Å
432	Q	95.9	Very high	95.3	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-63.1	-40.4	171.9	-61.1	175.7	-14.8	0	0	111.3	M428 K429 F430 C435 F436 F463 N466 E581	M428-Q432 HydrophobicContact CE-CB 3.77Å; M428-Q432 HydrophobicContact CG-CB 4.43Å; M428-Q432 VanDerWaalsContact CG-OE1 3.24Å; K429-Q432 HydrophobicContact CB-CG 4.21Å; K429-Q432 WeakPolarHBondContact O-CB 3.2Å; K429-Q432 PolarHBondContact O-N 3Å; K429-Q432 VanDerWaalsContact O-N 3.09Å; F430-Q432 VanDerWaalsContact C-N 3.26Å; F430-Q432 PolarHBondContact O-N 2.71Å; Q432-C435 PolarHBondContact O-N 3.22Å; Q432-F436 VanDerWaalsContact O-CD2 3.25Å; Q432-F436 WeakPolarHBondContact O-CD2 3.4Å; Q432-F436 PolarHBondContact O-N 3.22Å; Q432-F463 HydrophobicContact CB-CE1 4.18Å; Q432-F463 HydrophobicContact CB-CZ 4.23Å; Q432-F463 HydrophobicContact CG-CE1 4.45Å; Q432-F463 HydrophobicContact CG-CZ 4.2Å; Q432-N466 PolarHBondContact NE2-OD1 2.78Å; Q432-N466 PolarHBondContact OE1-OD1 2.63Å; Q432-E581 HydrophobicContact CG-CB 3.99Å; Q432-E581 HydrophobicContact CG-CG 3.46Å; Q432-E581 VanDerWaalsContact CG-CG 3.46Å; Q432-E581 PolarHBondContact NE2-OE1 2.92Å
433	I	96.3	Very high	95.4	Very high	4 Å²	4	17.2 Å²	17.2	2%	0.021	8%	0.081	C	C	.	.	H	α-helix	trans	-64	-45.9	175.2	-56.1	173.3	0	0	0	109.3	L315 F413 M428 F430 N431 C435 F436 V437 V445	L315-I433 HydrophobicContact CD1-CB 4.05Å; L315-I433 HydrophobicContact CD1-CD1 4.09Å; L315-I433 HydrophobicContact CD1-CG2 4.06Å; F413-I433 HydrophobicContact CB-CG2 4.06Å; F413-I433 HydrophobicContact CD1-CG2 4.04Å; F413-I433 HydrophobicContact CD2-CD1 4.4Å; F413-I433 HydrophobicContact CD2-CG2 3.97Å; F413-I433 HydrophobicContact CE1-CG2 4.48Å; F413-I433 HydrophobicContact CE2-CD1 3.91Å; F413-I433 HydrophobicContact CE2-CG2 4.43Å; F413-I433 HydrophobicContact CG-CG2 3.76Å; F413-I433 HydrophobicContact CZ-CD1 4.09Å; M428-I433 HydrophobicContact CE-CG1 3.54Å; M428-I433 HydrophobicContact SD-CD1 4.22Å; M428-I433 HydrophobicContact SD-CG1 3.86Å; F430-I433 HydrophobicContact CD1-CD1 4.46Å; F430-I433 WeakPolarHBondContact O-CB 3.36Å; F430-I433 PolarHBondContact O-N 3.02Å; F430-I433 VanDerWaalsContact O-N 3.11Å; N431-I433 VanDerWaalsContact C-N 3.31Å; N431-I433 PolarHBondContact O-N 3.36Å; I433-C435 PolarHBondContact O-N 3.25Å; I433-F436 PolarHBondContact O-N 3.19Å; I433-V437 HydrophobicContact CG2-CG2 3.95Å; I433-V437 WeakPolarHBondContact O-CB 3.49Å; I433-V437 VanDerWaalsContact O-CG2 3.31Å; I433-V437 WeakPolarHBondContact O-CG2 3.43Å; I433-V437 PolarHBondContact O-N 2.83Å; I433-V445 HydrophobicContact CD1-CG2 4.2Å; I433-V445 HydrophobicContact CG1-CG2 4.44Å
434	R	94.5	Very high	95.3	Very high	5 Å²	5	17.4 Å²	17.4	2%	0.019	8%	0.082	C	C	.	.	H	α-helix	trans	-58.2	-45.4	177.3	-64.8	172.8	179.8	117.5	10.1	111.9	D311 P316 F319 F430 N431 F436 V437 R438	D311-R434 IonicContact OD2-CZ 3.19Å; D311-R434 VanDerWaalsContact OD2-CZ 3.26Å; D311-R434 IonicContact OD2-NE 3.93Å; D311-R434 PolarHBondContact OD2-NE 2.9Å; D311-R434 IonicContact OD2-NH2 3.81Å; D311-R434 PolarHBondContact OD2-NH2 2.94Å; P316-R434 PolarHBondContact O-NH2 3.34Å; F319-R434 PolarHBondContact O-NH1 2.67Å; F319-R434 VanDerWaalsContact O-NH1 3.1Å; F430-R434 PolarHBondContact O-N 3.23Å; F430-R434 VanDerWaalsContact O-N 3.12Å; N431-R434 WeakPolarHBondContact O-CB 3.35Å; N431-R434 PolarHBondContact O-N 3.32Å; N431-R434 WeakPolarHBondContact OD1-CD 3.48Å; R434-F436 VanDerWaalsContact C-N 3.3Å; R434-F436 PolarHBondContact O-N 3.2Å; R434-V437 PolarHBondContact O-N 2.73Å; R434-R438 VanDerWaalsContact O-CB 3.27Å; R434-R438 WeakPolarHBondContact O-CB 3.36Å; R434-R438 VanDerWaalsContact O-CG 3.26Å; R434-R438 WeakPolarHBondContact O-CG 2.9Å; R434-R438 PolarHBondContact O-N 3.44Å
435	C	95.1	Very high	95.4	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-57	-43.2	179.9	-72.2	0	0	0	0	111.7	N431 Q432 I433 R439 F593	N431-C435 PolarHBondContact O-N 3.19Å; N431-C435 PolarHBondContact O-SG 2.86Å; Q432-C435 PolarHBondContact O-N 3.22Å; I433-C435 PolarHBondContact O-N 3.25Å; C435-R439 WeakPolarHBondContact O-CD 3.4Å; C435-R439 VanDerWaalsContact O-CG 3.29Å; C435-R439 WeakPolarHBondContact O-CG 3.46Å; C435-R439 PolarHBondContact O-NH1 3.44Å; C435-F593 HydrophobicContact CB-CB 4.45Å; C435-F593 HydrophobicContact CB-CD1 3.85Å; C435-F593 HydrophobicContact CB-CD2 3.79Å; C435-F593 HydrophobicContact CB-CE1 3.97Å; C435-F593 HydrophobicContact CB-CE2 3.91Å; C435-F593 HydrophobicContact CB-CG 3.77Å; C435-F593 HydrophobicContact CB-CZ 4Å
436	F	96.9	Very high	95.2	Very high	0 Å²	0	17 Å²	17	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-74.4	-45.6	176.7	-76	-61.4	0	0	0	113.6	I421 Q432 I433 R434 R439 G440 A441 V443 F463 F593 F596 L597	I421-F436 HydrophobicContact CG1-CD1 4.49Å; Q432-F436 VanDerWaalsContact O-CD2 3.25Å; Q432-F436 WeakPolarHBondContact O-CD2 3.4Å; Q432-F436 PolarHBondContact O-N 3.22Å; I433-F436 PolarHBondContact O-N 3.19Å; R434-F436 VanDerWaalsContact C-N 3.3Å; R434-F436 PolarHBondContact O-N 3.2Å; F436-R439 CarbonylContact O-C 3.49Å; F436-R439 PolarHBondContact O-N 3.1Å; F436-R439 VanDerWaalsContact O-N 3.15Å; F436-G440 PolarHBondContact O-N 3.1Å; F436-A441 HydrophobicContact CB-CB 4.15Å; F436-A441 HydrophobicContact CD1-CB 4.46Å; F436-A441 WeakPolarHBondContact O-CB 3.27Å; F436-A441 PolarHBondContact O-N 3.18Å; F436-A441 VanDerWaalsContact O-N 3.1Å; F436-V443 HydrophobicContact CB-CG2 3.48Å; F436-V443 VanDerWaalsContact CB-CG2 3.48Å; F436-V443 HydrophobicContact CD2-CG2 4.49Å; F436-V443 HydrophobicContact CG-CG2 4.17Å; F436-F463 HydrophobicContact CE2-CB 4.15Å; F436-F463 AromaticContact CE2-CD1 3.91Å; F436-F463 HydrophobicContact CE2-CD1 3.91Å; F436-F463 AromaticContact CE2-CD2 3.6Å; F436-F463 HydrophobicContact CE2-CD2 3.6Å; F436-F463 HydrophobicContact CE2-CE1 4.18Å; F436-F463 AromaticContact CE2-CE2 3.88Å; F436-F463 HydrophobicContact CE2-CE2 3.88Å; F436-F463 AromaticContact CE2-CG 3.59Å; F436-F463 HydrophobicContact CE2-CG 3.59Å; F436-F463 HydrophobicContact CE2-CZ 4.16Å; F436-F463 HydrophobicContact CZ-CB 4.17Å; F436-F463 AromaticContact CZ-CD2 3.56Å; F436-F463 HydrophobicContact CZ-CD2 3.56Å; F436-F463 HydrophobicContact CZ-CE2 4.06Å; F436-F463 AromaticContact CZ-CG 3.86Å; F436-F463 HydrophobicContact CZ-CG 3.86Å; F436-F593 HydrophobicContact CD1-CD1 4.11Å; F436-F593 HydrophobicContact CD2-CD1 4.21Å; F436-F593 HydrophobicContact CD2-CE1 4.12Å; F436-F593 AromaticContact CE1-CD1 3.72Å; F436-F593 HydrophobicContact CE1-CD1 3.72Å; F436-F593 HydrophobicContact CE1-CE1 4.32Å; F436-F593 AromaticContact CE2-CD1 3.84Å; F436-F593 HydrophobicContact CE2-CD1 3.84Å; F436-F593 AromaticContact CE2-CE1 3.59Å; F436-F593 HydrophobicContact CE2-CE1 3.59Å; F436-F593 HydrophobicContact CG-CD1 4.33Å; F436-F593 AromaticContact CZ-CD1 3.57Å; F436-F593 HydrophobicContact CZ-CD1 3.57Å; F436-F593 AromaticContact CZ-CE1 3.71Å; F436-F593 HydrophobicContact CZ-CE1 3.71Å; F436-F596 HydrophobicContact CE1-CD1 4.04Å; F436-F596 HydrophobicContact CE1-CE1 4.46Å; F436-F596 HydrophobicContact CZ-CD1 4.42Å; F436-L597 HydrophobicContact CD1-CD1 4.09Å; F436-L597 HydrophobicContact CD1-CD2 3.99Å; F436-L597 HydrophobicContact CD1-CG 4.16Å; F436-L597 HydrophobicContact CE1-CD2 4.23Å; F436-L597 HydrophobicContact CE1-CG 4.36Å
437	V	95.3	Very high	95.2	Very high	27 Å²	27	17.5 Å²	17.5	16%	0.164	8%	0.083	C	C	.	.	H	α-helix	trans	-65.3	-43.8	-176.2	168.6	0	0	0	0	111.4	S313 F413 N414 I433 R434 R439 G440 V443	S313-V437 WeakPolarHBondContact OG-CG1 3.11Å; F413-V437 HydrophobicContact CB-CG2 3.93Å; N414-V437 HydrophobicContact CB-CG1 4.03Å; N414-V437 HydrophobicContact CB-CG2 4.08Å; I433-V437 HydrophobicContact CG2-CG2 3.95Å; I433-V437 WeakPolarHBondContact O-CB 3.49Å; I433-V437 VanDerWaalsContact O-CG2 3.31Å; I433-V437 WeakPolarHBondContact O-CG2 3.43Å; I433-V437 PolarHBondContact O-N 2.83Å; R434-V437 PolarHBondContact O-N 2.73Å; V437-R439 PolarHBondContact O-N 3.13Å; V437-R439 VanDerWaalsContact O-N 3.12Å; V437-G440 PolarHBondContact O-N 3.01Å; V437-V443 HydrophobicContact CG2-CG2 4.38Å
438	R	92.8	Very high	94.9	Very high	148 Å²	148	20.3 Å²	20.3	56%	0.558	9%	0.094	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-24.3	175.9	-73	177.1	-179.8	162	2	112.7	R434	R434-R438 VanDerWaalsContact O-CB 3.27Å; R434-R438 WeakPolarHBondContact O-CB 3.36Å; R434-R438 VanDerWaalsContact O-CG 3.26Å; R434-R438 WeakPolarHBondContact O-CG 2.9Å; R434-R438 PolarHBondContact O-N 3.44Å
439	R	94.2	Very high	94.6	Very high	43 Å²	43	23.3 Å²	23.3	16%	0.162	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.4	11.4	178	-65.6	171	174.1	75.5	2.8	113	C435 F436 V437 E590 D594 L597 R601	C435-R439 WeakPolarHBondContact O-CD 3.4Å; C435-R439 VanDerWaalsContact O-CG 3.29Å; C435-R439 WeakPolarHBondContact O-CG 3.46Å; C435-R439 PolarHBondContact O-NH1 3.44Å; F436-R439 CarbonylContact O-C 3.49Å; F436-R439 PolarHBondContact O-N 3.1Å; F436-R439 VanDerWaalsContact O-N 3.15Å; V437-R439 PolarHBondContact O-N 3.13Å; V437-R439 VanDerWaalsContact O-N 3.12Å; R439-E590 IonicContact CZ-OE1 2.68Å; R439-E590 VanDerWaalsContact CZ-OE1 3.27Å; R439-E590 IonicContact NH1-OE1 3.69Å; R439-E590 PolarHBondContact NH1-OE1 2.8Å; R439-E590 IonicContact NH2-OE1 2.63Å; R439-E590 PolarHBondContact NH2-OE1 2.98Å; R439-D594 WeakPolarHBondContact CD-OD1 3.28Å; R439-D594 IonicContact CZ-OD1 3.81Å; R439-D594 IonicContact CZ-OD2 3.99Å; R439-D594 IonicContact NE-OD1 3.96Å; R439-D594 PolarHBondContact NE-OD1 2.83Å; R439-D594 IonicContact NE-OD2 3.67Å; R439-D594 PolarHBondContact NE-OD2 3.4Å; R439-D594 IonicContact NH2-OD1 2.73Å; R439-D594 IonicContact NH2-OD2 2.88Å; R439-D594 PolarHBondContact NH2-OD2 3.25Å; R439-L597 HydrophobicContact CB-CD1 3.35Å; R439-L597 HydrophobicContact CG-CD1 4.26Å; R439-R601 PolarHBondContact O-NH2 3.04Å
440	G	94.3	Very high	94.2	Very high	27 Å²	27	24.2 Å²	24.2	28%	0.278	12%	0.122	S	C	.	.	T	Hydrogen-bonded Turn	trans	84.9	4.4	173.5	0	0	0	0	0	115.6	N414 G417 D418 F436 V437	N414-G440 VanDerWaalsContact ND2-C 3.33Å; N414-G440 PolarHBondContact ND2-O 3.02Å; G417-G440 CarbonylContact C-O 3.13Å; G417-G440 WeakPolarHBondContact CA-O 3.35Å; D418-G440 PolarHBondContact N-O 3.08Å; D418-G440 VanDerWaalsContact OD1-O 3.07Å; F436-G440 PolarHBondContact O-N 3.1Å; V437-G440 PolarHBondContact O-N 3.01Å
441	A	96.5	Very high	93.7	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.128	C	C	.	.			trans	-77	144.1	-178.5	0	0	0	0	0	111.7	N414 I421 F436 V443 L597	N414-A441 WeakPolarHBondContact CB-O 3.2Å; N414-A441 PolarHBondContact ND2-O 2.88Å; I421-A441 HydrophobicContact CG1-CB 4.22Å; F436-A441 HydrophobicContact CB-CB 4.15Å; F436-A441 HydrophobicContact CD1-CB 4.46Å; F436-A441 WeakPolarHBondContact O-CB 3.27Å; F436-A441 PolarHBondContact O-N 3.18Å; F436-A441 VanDerWaalsContact O-N 3.1Å; A441-V443 HydrophobicContact CB-CG2 4.44Å; A441-L597 HydrophobicContact CB-CD1 4.2Å; A441-L597 HydrophobicContact CB-CD2 3.78Å
442	K	96.2	Very high	93.1	Very high	52 Å²	52	25.5 Å²	25.5	23%	0.226	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	121.1	165.6	174.5	-175.5	177.7	-165.7	0	108.4	V412 N414 P415 V419 H420 I421	V412-K442 HydrophobicContact CG1-CG 4.03Å; N414-K442 VanDerWaalsContact O-CA 3.25Å; N414-K442 WeakPolarHBondContact O-CA 3.42Å; N414-K442 VanDerWaalsContact O-CB 3.24Å; N414-K442 WeakPolarHBondContact O-CB 3.32Å; N414-K442 WeakPolarHBondContact O-CG 3.32Å; P415-K442 WeakPolarHBondContact O-CD 3.48Å; V419-K442 PolarHBondContact O-N 2.73Å; H420-K442 CarbonylContact C-O 3.17Å; H420-K442 WeakPolarHBondContact CA-O 3.49Å; H420-K442 HydrophobicContact CB-CD 4.29Å; H420-K442 PolarHBondContact CE1-NZ 3.27Å; H420-K442 VanDerWaalsContact CE1-NZ 3.28Å; H420-K442 PolarHBondContact ND1-NZ 2.69Å; I421-K442 PolarHBondContact N-O 3.09Å
443	V	96.4	Very high	91.9	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	113.7	-175.2	-173	0	0	0	0	109.6	V412 F413 A423 F436 V437 A441 V445	V412-V443 CarbonylContact C-O 3.54Å; V412-V443 WeakPolarHBondContact CA-O 3.19Å; F413-V443 HydrophobicContact CB-CB 4.47Å; F413-V443 PolarHBondContact N-O 3.48Å; F413-V443 PolarHBondContact O-N 2.92Å; A423-V443 HydrophobicContact CB-CG1 3.74Å; F436-V443 HydrophobicContact CB-CG2 3.48Å; F436-V443 VanDerWaalsContact CB-CG2 3.48Å; F436-V443 HydrophobicContact CD2-CG2 4.49Å; F436-V443 HydrophobicContact CG-CG2 4.17Å; V437-V443 HydrophobicContact CG2-CG2 4.38Å; A441-V443 HydrophobicContact CB-CG2 4.44Å; V443-V445 HydrophobicContact CG1-CG2 4.1Å
444	T	95.1	Very high	90.3	Very high	4 Å²	4	37.8 Å²	37.8	3%	0.025	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	108	167.4	-65.9	0	0	0	0	108.7	I410 K411 V412 H420 I421 A423 L446 Y459	I410-T444 HydrophobicContact CG2-CG2 3.46Å; I410-T444 VanDerWaalsContact CG2-CG2 3.46Å; K411-T444 CarbonylContact O-C 3.57Å; K411-T444 WeakPolarHBondContact O-CA 3.36Å; V412-T444 HydrophobicContact CG2-CG2 4.28Å; H420-T444 PolarHBondContact NE2-OG1 2.99Å; I421-T444 PolarHBondContact O-N 3.03Å; A423-T444 PolarHBondContact N-O 3.41Å; T444-L446 HydrophobicContact CG2-CD2 3.76Å; T444-L446 HydrophobicContact CG2-CG 4.29Å; T444-Y459 HydrophobicContact CG2-CE1 4.18Å
445	V	95.5	Very high	88.5	Confident	1 Å²	1	39.6 Å²	39.6	1%	0.006	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	119.3	174.4	-171.1	0	0	0	0	108.6	R407 I410 K411 F413 A423 D425 M428 I433 V443	R407-V445 VanDerWaalsContact CD-CG1 3.46Å; R407-V445 HydrophobicContact CG-CG1 4.49Å; I410-V445 WeakPolarHBondContact CA-O 3.46Å; K411-V445 PolarHBondContact N-O 2.76Å; K411-V445 VanDerWaalsContact N-O 3.08Å; K411-V445 PolarHBondContact O-N 2.91Å; F413-V445 HydrophobicContact CD2-CG2 3.82Å; F413-V445 HydrophobicContact CE2-CG2 3.75Å; A423-V445 HydrophobicContact CB-CG2 4.43Å; A423-V445 CarbonylContact O-C 3.58Å; A423-V445 WeakPolarHBondContact O-CA 3.43Å; D425-V445 HydrophobicContact CB-CG1 3.71Å; M428-V445 HydrophobicContact SD-CG1 3.84Å; M428-V445 HydrophobicContact SD-CG2 4.01Å; I433-V445 HydrophobicContact CD1-CG2 4.2Å; I433-V445 HydrophobicContact CG1-CG2 4.44Å; V443-V445 HydrophobicContact CG1-CG2 4.1Å
446	L	94	Very high	86.2	Confident	1 Å²	1	49.2 Å²	49.2	1%	0.005	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	135.8	-177.2	-62.9	177.1	0	0	0	109.7	I410 A422 A423 L424 D425 T444 L452 Y459	I410-L446 HydrophobicContact CD1-CD2 3.83Å; I410-L446 HydrophobicContact CG1-CD2 3.86Å; I410-L446 HydrophobicContact CG2-CD2 3.92Å; A422-L446 HydrophobicContact CB-CD1 3.89Å; A423-L446 PolarHBondContact O-N 2.89Å; L424-L446 HydrophobicContact CD1-CB 4.37Å; D425-L446 WeakPolarHBondContact CB-O 3.31Å; D425-L446 PolarHBondContact N-O 3.17Å; T444-L446 HydrophobicContact CG2-CD2 3.76Å; T444-L446 HydrophobicContact CG2-CG 4.29Å; L446-L452 HydrophobicContact CD1-CD2 4.09Å; L446-Y459 HydrophobicContact CD1-CE2 4.31Å
447	P	93.4	Very high	84.3	Confident	11 Å²	11	52 Å²	52	7%	0.071	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-51.9	145.8	167.7	-27.8	34.4	0	0	0	112.2	R407 T408 I410 L424 S449 S450	R407-P447 VanDerWaalsContact O-CB 3.31Å; R407-P447 WeakPolarHBondContact O-CB 3.35Å; T408-P447 WeakPolarHBondContact O-CG 3.32Å; I410-P447 HydrophobicContact CG1-CG 4.45Å; L424-P447 WeakPolarHBondContact CD1-O 3.43Å; P447-S449 PolarHBondContact O-N 3.01Å; P447-S450 VanDerWaalsContact CD-OG 3.28Å; P447-S450 WeakPolarHBondContact CD-OG 3.25Å; P447-S450 VanDerWaalsContact O-CB 3.22Å; P447-S450 WeakPolarHBondContact O-CB 3.5Å; P447-S450 PolarHBondContact O-N 3.41Å; P447-S450 PolarHBondContact O-OG 3.01Å
448	W	89.5	Confident	83.3	Confident	59 Å²	59	57.6 Å²	57.6	22%	0.223	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.5	-29.4	-178.1	75.2	-83.2	0	0	0	115.3	N400 V402 S406 D425 I477	N400-W448 WeakPolarHBondContact ND2-CH2 3.43Å; V402-W448 HydrophobicContact CG1-CB 3.6Å; V402-W448 HydrophobicContact CG1-CD2 4.22Å; V402-W448 HydrophobicContact CG1-CG 3.81Å; S406-W448 VanDerWaalsContact CB-CD1 3.47Å; S406-W448 PolarHBondContact OG-N 3.37Å; S406-W448 VanDerWaalsContact OG-N 3.09Å; D425-W448 WeakPolarHBondContact O-CA 3.18Å; D425-W448 VanDerWaalsContact O-CB 3.29Å; D425-W448 WeakPolarHBondContact O-CB 3.36Å; D425-W448 PolarHBondContact O-N 2.78Å; W448-I477 HydrophobicContact CB-CD1 4.2Å; W448-I477 HydrophobicContact CD2-CD1 4.35Å; W448-I477 HydrophobicContact CE3-CD1 3.51Å; W448-I477 HydrophobicContact CE3-CG1 3.5Å; W448-I477 VanDerWaalsContact CE3-CG1 3.5Å; W448-I477 HydrophobicContact CZ3-CD1 4.23Å; W448-I477 HydrophobicContact CZ3-CG1 3.94Å
449	S	87.8	Confident	83.2	Confident	73 Å²	73	51 Å²	51	51%	0.51	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.3	3.7	-177.4	63.1	0	0	0	0	114.2	P447 D451	P447-S449 PolarHBondContact O-N 3.01Å; S449-D451 PolarHBondContact O-N 2.68Å
450	S	87.7	Confident	83.1	Confident	19 Å²	19	52.3 Å²	52.3	13%	0.133	28%	0.28	C	S	.	.			trans	-65	129.8	-174.2	-61.3	0	0	0	0	112.2	P447 L452 Q480	P447-S450 VanDerWaalsContact CD-OG 3.28Å; P447-S450 WeakPolarHBondContact CD-OG 3.25Å; P447-S450 VanDerWaalsContact O-CB 3.22Å; P447-S450 WeakPolarHBondContact O-CB 3.5Å; P447-S450 PolarHBondContact O-N 3.41Å; P447-S450 PolarHBondContact O-OG 3.01Å; S450-L452 PolarHBondContact O-N 3.2Å; S450-Q480 VanDerWaalsContact O-CD 3.23Å; S450-Q480 PolarHBondContact O-NE2 3.42Å; S450-Q480 PolarHBondContact O-OE1 3.29Å
451	D	85.1	Confident	83	Confident	53 Å²	53	51 Å²	51	28%	0.283	27%	0.266	S	S	.	.			trans	-69.2	96.1	179.7	-172.4	-12.3	0	0	0	112.2	S449 T453 K454 T455	S449-D451 PolarHBondContact O-N 2.68Å; D451-T453 PolarHBondContact O-N 3.4Å; D451-T453 WeakPolarHBondContact OD1-CA 3.38Å; D451-T453 WeakPolarHBondContact OD1-CB 3.3Å; D451-T453 PolarHBondContact OD1-N 3.41Å; D451-T453 PolarHBondContact OD1-OG1 2.74Å; D451-K454 HydrophobicContact CB-CB 4.16Å; D451-K454 PolarHBondContact O-N 2.69Å; D451-K454 VanDerWaalsContact O-N 3.08Å; D451-K454 PolarHBondContact OD1-N 2.85Å; D451-K454 WeakPolarHBondContact OD2-CD 3.37Å; D451-K454 WeakPolarHBondContact OD2-CE 3.33Å; D451-K454 WeakPolarHBondContact OD2-CG 3.26Å; D451-K454 IonicContact OD2-NZ 3.67Å; D451-T455 WeakPolarHBondContact O-CG2 3.37Å
452	L	81.8	Confident	83	Confident	9 Å²	9	51 Å²	51	5%	0.047	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-11.5	177.8	-61.8	-179.1	0	0	0	114	L446 S450 L462 Q480 W484	L446-L452 HydrophobicContact CD1-CD2 4.09Å; S450-L452 PolarHBondContact O-N 3.2Å; L452-L462 HydrophobicContact CD1-CD1 4.3Å; L452-L462 HydrophobicContact CD1-CD2 3.87Å; L452-L462 HydrophobicContact CD2-CD1 4.03Å; L452-Q480 HydrophobicContact CB-CB 4.41Å; L452-Q480 HydrophobicContact CD1-CB 4.03Å; L452-Q480 HydrophobicContact CG-CB 4.23Å; L452-W484 HydrophobicContact CD1-CB 4.43Å
453	T	70.9	Confident	83	Confident	99 Å²	99	48.5 Å²	48.5	61%	0.607	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93	-21.5	176.6	72.1	0	0	0	0	113.6	D451	D451-T453 PolarHBondContact O-N 3.4Å; D451-T453 WeakPolarHBondContact OD1-CA 3.38Å; D451-T453 WeakPolarHBondContact OD1-CB 3.3Å; D451-T453 PolarHBondContact OD1-N 3.41Å; D451-T453 PolarHBondContact OD1-OG1 2.74Å
454	K	63.4	Low	83.1	Confident	163 Å²	163	48.5 Å²	48.5	71%	0.709	26%	0.256	S	S	*	.	S	Bend	trans	-103.9	8.8	-175.3	-74.9	-174.4	-167.6	165.8	0	114.7	D451 E456	D451-K454 HydrophobicContact CB-CB 4.16Å; D451-K454 PolarHBondContact O-N 2.69Å; D451-K454 VanDerWaalsContact O-N 3.08Å; D451-K454 PolarHBondContact OD1-N 2.85Å; D451-K454 WeakPolarHBondContact OD2-CD 3.37Å; D451-K454 WeakPolarHBondContact OD2-CE 3.33Å; D451-K454 WeakPolarHBondContact OD2-CG 3.26Å; D451-K454 IonicContact OD2-NZ 3.67Å; K454-E456 PolarHBondContact O-N 3.21Å; K454-E456 VanDerWaalsContact O-N 3.07Å
455	T	56	Low	83.2	Confident	43 Å²	43	48.3 Å²	48.3	26%	0.264	25%	0.254	S	S	.	.			trans	-70.3	111.8	-175.6	53.4	0	0	0	0	109.9	D451 T457 Y459	D451-T455 WeakPolarHBondContact O-CG2 3.37Å; T455-T457 PolarHBondContact O-N 3.37Å; T455-Y459 HydrophobicContact CG2-CE2 3.78Å
456	E	47.4	Very low	83.2	Confident	201 Å²	201	48.3 Å²	48.3	94%	0.939	25%	0.254	S	S	*	.	S	Bend	trans	-58.8	12.2	174.6	-64.2	-177.8	150.3	0	0	114.2	K454	K454-E456 PolarHBondContact O-N 3.21Å; K454-E456 VanDerWaalsContact O-N 3.07Å
457	T	56.5	Low	83.2	Confident	60 Å²	60	48.6 Å²	48.6	37%	0.368	26%	0.257	S	S	.	.	S	Bend	trans	-128.9	123.7	-167.6	24.9	0	0	0	0	109.4	T455 Y459	T455-T457 PolarHBondContact O-N 3.37Å; T457-Y459 VanDerWaalsContact C-N 3.28Å; T457-Y459 PolarHBondContact O-N 3.38Å; T457-Y459 WeakPolarHBondContact OG1-CE2 3.29Å; T457-Y459 PolarHBondContact OG1-OH 2.73Å
458	N	74.8	Confident	83.3	Confident	143 Å²	143	48.3 Å²	48.3	77%	0.765	26%	0.256	S	S	*	.			trans	-70.3	84.3	169	-97	-19	0	0	0	108.9
459	Y	89.9	Confident	83.3	Confident	11 Å²	11	46.6 Å²	46.6	4%	0.043	26%	0.256	C	S	.	.			trans	-71.5	140.8	166	-58	-64.6	0	0	0	110	H420 A422 T444 L446 T455 T457 K489	H420-Y459 AromaticContact CD2-CD1 3.78Å; H420-Y459 AromaticContact CE1-CD1 3.66Å; H420-Y459 AromaticContact CE1-CE1 3.5Å; H420-Y459 AromaticContact NE2-CD1 3.56Å; H420-Y459 AromaticContact NE2-CE1 3.36Å; H420-Y459 WeakPolarHBondContact NE2-CE1 3.13Å; A422-Y459 HydrophobicContact CB-CD1 3.77Å; A422-Y459 HydrophobicContact CB-CD2 3.62Å; A422-Y459 HydrophobicContact CB-CE1 4.05Å; A422-Y459 HydrophobicContact CB-CE2 3.89Å; A422-Y459 HydrophobicContact CB-CG 3.55Å; T444-Y459 HydrophobicContact CG2-CE1 4.18Å; L446-Y459 HydrophobicContact CD1-CE2 4.31Å; T455-Y459 HydrophobicContact CG2-CE2 3.78Å; T457-Y459 VanDerWaalsContact C-N 3.28Å; T457-Y459 PolarHBondContact O-N 3.38Å; T457-Y459 WeakPolarHBondContact OG1-CE2 3.29Å; T457-Y459 PolarHBondContact OG1-OH 2.73Å; Y459-K489 WeakPolarHBondContact O-CD 3.43Å; Y459-K489 PolarHBondContact O-NZ 3.22Å
460	D	92.3	Very high	83.5	Confident	69 Å²	69	44.5 Å²	44.5	37%	0.369	24%	0.24	S	C	.	.	S	Bend	trans	-79.3	-32.7	179.5	-60.6	-50.4	0	0	0	111.5	V419 H420 P490 I600	V419-D460 HydrophobicContact CG1-CB 4.17Å; H420-D460 PolarHBondContact N-OD2 2.87Å; H420-D460 PolarHBondContact O-N 2.9Å; D460-P490 WeakPolarHBondContact O-CD 3.4Å; D460-I600 HydrophobicContact CB-CG2 3.9Å
461	A	93.8	Very high	83.8	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	161.9	-179.7	0	0	0	0	0	112.4	I421 A422 P490 F596 I600	I421-A461 HydrophobicContact CD1-CB 3.79Å; A422-A461 PolarHBondContact N-O 3.26Å; A461-P490 WeakPolarHBondContact CA-O 3.41Å; A461-P490 HydrophobicContact CB-CB 3.85Å; A461-P490 HydrophobicContact CB-CG 4.46Å; A461-P490 WeakPolarHBondContact CB-O 3.5Å; A461-F596 HydrophobicContact CB-CE1 4.03Å; A461-F596 HydrophobicContact CB-CZ 3.75Å; A461-I600 HydrophobicContact CB-CD1 3.52Å; A461-I600 HydrophobicContact CB-CG1 4.19Å
462	L	95.3	Very high	84.1	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	130.5	174.3	179	68.6	0	0	0	110.3	A422 L452 I464 W484 P490 L491 F492	A422-L462 HydrophobicContact CB-CD1 4.18Å; A422-L462 CarbonylContact O-C 3.56Å; A422-L462 WeakPolarHBondContact O-CA 3.25Å; L452-L462 HydrophobicContact CD1-CD1 4.3Å; L452-L462 HydrophobicContact CD1-CD2 3.87Å; L452-L462 HydrophobicContact CD2-CD1 4.03Å; L462-I464 HydrophobicContact CD2-CD1 4.12Å; L462-I464 HydrophobicContact CD2-CG1 4.12Å; L462-I464 HydrophobicContact CG-CG1 4.07Å; L462-W484 HydrophobicContact CB-CD2 3.76Å; L462-W484 HydrophobicContact CB-CE3 4.32Å; L462-W484 HydrophobicContact CB-CG 4.2Å; L462-W484 HydrophobicContact CB-CH2 4.12Å; L462-W484 HydrophobicContact CB-CZ2 3.55Å; L462-W484 HydrophobicContact CB-CZ3 4.47Å; L462-W484 HydrophobicContact CD2-CB 3.97Å; L462-W484 HydrophobicContact CD2-CD2 3.84Å; L462-W484 HydrophobicContact CD2-CE3 4.44Å; L462-W484 HydrophobicContact CD2-CG 3.56Å; L462-W484 HydrophobicContact CG-CD2 4.34Å; L462-P490 PolarHBondContact N-O 3.3Å; L462-L491 HydrophobicContact CD2-CD1 4.07Å; L462-L491 VanDerWaalsContact O-CA 3.3Å; L462-L491 WeakPolarHBondContact O-CA 3.48Å; L462-F492 PolarHBondContact O-N 2.83Å
463	F	97.4	Very high	84.4	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	137.5	167.3	177.3	-99.9	0	0	0	109.2	I421 A422 A423 L424 M428 Q432 F436 F492 I494 F593	I421-F463 HydrophobicContact CG2-CB 3.8Å; A422-F463 PolarHBondContact O-N 2.94Å; A423-F463 CarbonylContact C-O 3.52Å; A423-F463 WeakPolarHBondContact CA-O 3.42Å; A423-F463 HydrophobicContact CB-CB 4.41Å; A423-F463 HydrophobicContact CB-CD1 4Å; L424-F463 PolarHBondContact N-O 2.87Å; M428-F463 HydrophobicContact CE-CD1 4.14Å; M428-F463 HydrophobicContact CE-CE1 3.93Å; Q432-F463 HydrophobicContact CB-CE1 4.18Å; Q432-F463 HydrophobicContact CB-CZ 4.23Å; Q432-F463 HydrophobicContact CG-CE1 4.45Å; Q432-F463 HydrophobicContact CG-CZ 4.2Å; F436-F463 HydrophobicContact CE2-CB 4.15Å; F436-F463 AromaticContact CE2-CD1 3.91Å; F436-F463 HydrophobicContact CE2-CD1 3.91Å; F436-F463 AromaticContact CE2-CD2 3.6Å; F436-F463 HydrophobicContact CE2-CD2 3.6Å; F436-F463 HydrophobicContact CE2-CE1 4.18Å; F436-F463 AromaticContact CE2-CE2 3.88Å; F436-F463 HydrophobicContact CE2-CE2 3.88Å; F436-F463 AromaticContact CE2-CG 3.59Å; F436-F463 HydrophobicContact CE2-CG 3.59Å; F436-F463 HydrophobicContact CE2-CZ 4.16Å; F436-F463 HydrophobicContact CZ-CB 4.17Å; F436-F463 AromaticContact CZ-CD2 3.56Å; F436-F463 HydrophobicContact CZ-CD2 3.56Å; F436-F463 HydrophobicContact CZ-CE2 4.06Å; F436-F463 AromaticContact CZ-CG 3.86Å; F436-F463 HydrophobicContact CZ-CG 3.86Å; F463-F492 CarbonylContact C-O 3.24Å; F463-F492 VanDerWaalsContact CA-O 3.28Å; F463-F492 WeakPolarHBondContact CA-O 3.1Å; F463-F492 HydrophobicContact CD2-CB 4.17Å; F463-F492 AromaticContact CD2-CD1 3.86Å; F463-F492 HydrophobicContact CD2-CD1 3.86Å; F463-F492 HydrophobicContact CD2-CG 4.23Å; F463-F492 WeakPolarHBondContact CD2-O 3.41Å; F463-F492 AromaticContact CE2-CD1 3.84Å; F463-F492 HydrophobicContact CE2-CD1 3.84Å; F463-F492 HydrophobicContact CE2-CE1 4.21Å; F463-F492 HydrophobicContact CE2-CG 4.39Å; F463-I494 HydrophobicContact CE2-CD1 3.65Å; F463-I494 HydrophobicContact CE2-CG1 3.93Å; F463-I494 HydrophobicContact CZ-CD1 3.72Å; F463-I494 HydrophobicContact CZ-CG1 4.15Å; F463-F593 HydrophobicContact CE2-CE1 4.13Å; F463-F593 HydrophobicContact CZ-CE1 4.43Å
464	I	97.7	Very high	85.2	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	117.4	176.9	-53.2	167	0	0	0	107.5	L424 L462 I481 L491 F492 G493 I494 G497 V501	L424-I464 HydrophobicContact CB-CG1 4.49Å; L424-I464 HydrophobicContact CD2-CG2 4.44Å; L462-I464 HydrophobicContact CD2-CD1 4.12Å; L462-I464 HydrophobicContact CD2-CG1 4.12Å; L462-I464 HydrophobicContact CG-CG1 4.07Å; I464-I481 HydrophobicContact CD1-CD1 3.67Å; I464-I481 HydrophobicContact CD1-CG1 3.75Å; I464-I481 HydrophobicContact CD1-CG2 4.4Å; I464-L491 HydrophobicContact CD1-CD1 4.29Å; I464-L491 HydrophobicContact CD1-CD2 4.49Å; I464-F492 PolarHBondContact N-O 3.27Å; I464-G493 WeakPolarHBondContact O-CA 3.07Å; I464-I494 PolarHBondContact O-N 3.18Å; I464-I494 VanDerWaalsContact O-N 3.11Å; I464-G497 VanDerWaalsContact CG2-CA 3.48Å; I464-V501 HydrophobicContact CD1-CG2 3.62Å
465	S	97.3	Very high	86.2	Confident	0 Å²	0	43 Å²	43	0%	0	22%	0.224	C	C	.	.			trans	-69.7	174.9	-174.4	73.6	0	0	0	0	113	L424 C426 I494 G497	L424-S465 PolarHBondContact O-N 2.87Å; L424-S465 VanDerWaalsContact O-N 3.15Å; L424-S465 PolarHBondContact O-OG 2.99Å; C426-S465 PolarHBondContact N-OG 2.95Å; S465-I494 CarbonylContact C-O 3.54Å; S465-G497 PolarHBondContact O-N 3.34Å; S465-G497 VanDerWaalsContact O-N 3.09Å
466	N	95.7	Very high	87.5	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.234	C	C	.	.			trans	-65	175.7	160.7	68.8	-66.9	0	0	0	111.8	S286 C426 G427 K429 Q432 I494 C495 H579	S286-N466 PolarHBondContact OG-ND2 2.84Å; S286-N466 VanDerWaalsContact OG-ND2 3.09Å; C426-N466 CarbonylContact C-O 3.59Å; C426-N466 WeakPolarHBondContact CB-O 3.05Å; G427-N466 CarbonylContact C-O 3.49Å; G427-N466 PolarHBondContact O-ND2 3.2Å; G427-N466 PolarHBondContact O-OD1 3.46Å; K429-N466 WeakPolarHBondContact CE-ND2 3.32Å; K429-N466 PolarHBondContact N-OD1 2.9Å; Q432-N466 PolarHBondContact NE2-OD1 2.78Å; Q432-N466 PolarHBondContact OE1-OD1 2.63Å; N466-I494 WeakPolarHBondContact CA-O 3.4Å; N466-I494 PolarHBondContact N-O 3.01Å; N466-C495 HydrophobicContact CB-CB 3.82Å; N466-H579 VanDerWaalsContact CB-CE1 3.45Å; N466-H579 WeakPolarHBondContact CB-CE1 3.39Å
467	G	94	Very high	89.5	Confident	7 Å²	7	33.6 Å²	33.6	7%	0.072	19%	0.189	C	C	.	.			trans	177.9	166.6	174.9	0	0	0	0	0	112.8	C426	C426-G467 WeakPolarHBondContact O-CA 3.31Å
468	P	94.4	Very high	91.1	Very high	6 Å²	6	31.3 Å²	31.3	4%	0.039	17%	0.174	C	C	.	.			trans	-84.8	167	178.4	34.8	-36.2	0	0	0	112.8	H288 L401 V405	H288-P468 HydrophobicContact CB-CB 4.1Å; H288-P468 HydrophobicContact CB-CG 4.03Å; L401-P468 HydrophobicContact CB-CB 4.04Å; L401-P468 HydrophobicContact CB-CG 3.69Å; L401-P468 HydrophobicContact CD1-CB 4.04Å; V405-P468 HydrophobicContact CG1-CG 4.02Å; V405-P468 HydrophobicContact CG2-CG 3.77Å
469	G	90.1	Very high	91.7	Very high	23 Å²	23	29.2 Å²	29.2	24%	0.237	16%	0.163	C	C	.	.	S	Bend	trans	89	-176.8	167	0	0	0	0	0	115.4
470	D	92.9	Very high	91.6	Very high	29 Å²	29	30.3 Å²	30.3	16%	0.155	17%	0.169	C	C	.	.			trans	-81.1	122.5	178.6	-171	-36.7	0	0	0	110.2	I472 Q473 Y540	D470-I472 PolarHBondContact O-N 3.49Å; D470-I472 VanDerWaalsContact O-N 3.07Å; D470-I472 WeakPolarHBondContact OD1-CB 3.42Å; D470-I472 PolarHBondContact OD1-N 3.35Å; D470-Q473 HydrophobicContact CB-CG 4.09Å; D470-Q473 WeakPolarHBondContact O-CB 3.28Å; D470-Q473 PolarHBondContact O-N 3.34Å; D470-Y540 HydrophobicContact CB-CE1 4.04Å; D470-Y540 HydrophobicContact CB-CE2 4.16Å; D470-Y540 WeakPolarHBondContact CB-OH 3.37Å; D470-Y540 VanDerWaalsContact CG-CE1 3.48Å; D470-Y540 VanDerWaalsContact OD2-CE1 3.28Å; D470-Y540 WeakPolarHBondContact OD2-CE1 3.28Å; D470-Y540 PolarHBondContact OD2-OH 2.88Å
471	P	93.1	Very high	91.6	Very high	0 Å²	0	27 Å²	27	0%	0	15%	0.151	C	C	.	.	G	3₁₀ helix	trans	-58.9	-24.1	-178.3	24.7	-36	0	0	0	113.8	Q473 C474 L496 Q499 L500 L503 T509	P471-Q473 PolarHBondContact O-N 3.35Å; P471-C474 WeakPolarHBondContact O-CB 3.36Å; P471-C474 PolarHBondContact O-N 3.29Å; P471-L496 HydrophobicContact CB-CD1 3.72Å; P471-Q499 HydrophobicContact CB-CB 3.88Å; P471-Q499 HydrophobicContact CG-CB 4.05Å; P471-L500 HydrophobicContact CB-CD2 4.18Å; P471-L503 HydrophobicContact CB-CD1 3.76Å; P471-L503 HydrophobicContact CG-CD1 4.28Å; P471-T509 HydrophobicContact CG-CG2 3.89Å
472	I	91.1	Very high	91.4	Very high	79 Å²	79	32.1 Å²	32.1	41%	0.405	17%	0.17	S	C	.	.	G	3₁₀ helix	trans	-70.2	-22.2	180	-62.2	171.1	0	0	0	111.9	D470 C474 K475 L503	D470-I472 PolarHBondContact O-N 3.49Å; D470-I472 VanDerWaalsContact O-N 3.07Å; D470-I472 WeakPolarHBondContact OD1-CB 3.42Å; D470-I472 PolarHBondContact OD1-N 3.35Å; I472-C474 PolarHBondContact O-N 2.96Å; I472-K475 WeakPolarHBondContact O-CG 3.07Å; I472-L503 HydrophobicContact CG1-CD1 4.25Å
473	Q	88.5	Confident	91.1	Very high	84 Å²	84	33.1 Å²	33.1	39%	0.393	18%	0.18	S	C	.	.	G	3₁₀ helix	trans	-70.1	-20.2	175.7	-59.6	-61.8	-22.2	0	0	112.1	D470 P471 K475	D470-Q473 HydrophobicContact CB-CG 4.09Å; D470-Q473 WeakPolarHBondContact O-CB 3.28Å; D470-Q473 PolarHBondContact O-N 3.34Å; P471-Q473 PolarHBondContact O-N 3.35Å; Q473-K475 VanDerWaalsContact C-N 3.31Å; Q473-K475 PolarHBondContact O-N 3.05Å; Q473-K475 VanDerWaalsContact O-N 3.17Å
474	C	88.7	Confident	90.7	Very high	3 Å²	3	33.6 Å²	33.6	2%	0.02	18%	0.182	C	C	.	.			trans	-88.9	40	-175.5	-64.1	0	0	0	0	113.9	P471 I472 G476 I477 I478 L500	P471-C474 WeakPolarHBondContact O-CB 3.36Å; P471-C474 PolarHBondContact O-N 3.29Å; I472-C474 PolarHBondContact O-N 2.96Å; C474-G476 VanDerWaalsContact C-N 3.32Å; C474-G476 PolarHBondContact O-N 2.97Å; C474-I477 HydrophobicContact CB-CB 4.36Å; C474-I477 HydrophobicContact CB-CD1 3.84Å; C474-I477 HydrophobicContact CB-CG1 4.2Å; C474-I477 WeakPolarHBondContact O-CB 3.38Å; C474-I477 PolarHBondContact O-N 3.17Å; C474-I478 PolarHBondContact O-N 3.33Å; C474-L500 HydrophobicContact CB-CD2 3.56Å
475	K	84.1	Confident	90.3	Very high	146 Å²	146	34.5 Å²	34.5	64%	0.635	19%	0.187	S	C	*	.	H	α-helix	trans	-53	-42.7	-171.8	-64.9	-176	-177.9	173.8	0	114.4	I472 Q473 I477 I478 D479	I472-K475 WeakPolarHBondContact O-CG 3.07Å; Q473-K475 VanDerWaalsContact C-N 3.31Å; Q473-K475 PolarHBondContact O-N 3.05Å; Q473-K475 VanDerWaalsContact O-N 3.17Å; K475-I477 VanDerWaalsContact C-N 3.31Å; K475-I477 PolarHBondContact O-N 3.28Å; K475-I478 WeakPolarHBondContact O-CB 3.24Å; K475-I478 PolarHBondContact O-N 3.21Å; K475-D479 PolarHBondContact O-N 3.43Å
476	G	83.7	Confident	89.9	Confident	45 Å²	45	39.9 Å²	39.9	46%	0.464	22%	0.22	S	C	.	.	H	α-helix	trans	-63.1	-35.2	-179.9	0	0	0	0	0	113.4	C474 D479 Q480	C474-G476 VanDerWaalsContact C-N 3.32Å; C474-G476 PolarHBondContact O-N 2.97Å; G476-D479 PolarHBondContact O-N 3.48Å; G476-Q480 PolarHBondContact O-N 3.05Å
477	I	88.4	Confident	89.4	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-67	-42	177.8	-53.5	-178.7	0	0	0	110.3	V402 L424 W448 C474 K475 D479 Q480 I481 L500	V402-I477 HydrophobicContact CG1-CD1 4.17Å; L424-I477 HydrophobicContact CD2-CG2 3.67Å; W448-I477 HydrophobicContact CB-CD1 4.2Å; W448-I477 HydrophobicContact CD2-CD1 4.35Å; W448-I477 HydrophobicContact CE3-CD1 3.51Å; W448-I477 HydrophobicContact CE3-CG1 3.5Å; W448-I477 VanDerWaalsContact CE3-CG1 3.5Å; W448-I477 HydrophobicContact CZ3-CD1 4.23Å; W448-I477 HydrophobicContact CZ3-CG1 3.94Å; C474-I477 HydrophobicContact CB-CB 4.36Å; C474-I477 HydrophobicContact CB-CD1 3.84Å; C474-I477 HydrophobicContact CB-CG1 4.2Å; C474-I477 WeakPolarHBondContact O-CB 3.38Å; C474-I477 PolarHBondContact O-N 3.17Å; K475-I477 VanDerWaalsContact C-N 3.31Å; K475-I477 PolarHBondContact O-N 3.28Å; I477-D479 VanDerWaalsContact C-N 3.27Å; I477-D479 PolarHBondContact O-N 2.95Å; I477-Q480 PolarHBondContact O-N 3.38Å; I477-Q480 VanDerWaalsContact O-N 3.09Å; I477-I481 HydrophobicContact CG2-CD1 3.82Å; I477-I481 HydrophobicContact CG2-CG1 4.21Å; I477-I481 WeakPolarHBondContact O-CG1 3.4Å; I477-I481 PolarHBondContact O-N 3.46Å; I477-L500 HydrophobicContact CD1-CD1 4.37Å; I477-L500 HydrophobicContact CG2-CD1 4.04Å
478	I	89.7	Confident	89.1	Confident	13 Å²	13	49.1 Å²	49.1	7%	0.067	26%	0.264	C	S	.	.	H	α-helix	trans	-58.3	-41.7	-178.7	-61.2	170.4	0	0	0	110.7	C474 K475 I481 R482 L500 L503 A504	C474-I478 PolarHBondContact O-N 3.33Å; K475-I478 WeakPolarHBondContact O-CB 3.24Å; K475-I478 PolarHBondContact O-N 3.21Å; I478-I481 PolarHBondContact O-N 2.76Å; I478-R482 WeakPolarHBondContact O-CG 3.37Å; I478-R482 PolarHBondContact O-N 3.13Å; I478-R482 VanDerWaalsContact O-N 3.1Å; I478-L500 HydrophobicContact CD1-CD2 4.48Å; I478-L500 HydrophobicContact CG1-CD2 4.03Å; I478-L503 HydrophobicContact CD1-CB 3.91Å; I478-L503 HydrophobicContact CD1-CD1 3.76Å; I478-L503 HydrophobicContact CD1-CG 4.49Å; I478-L503 HydrophobicContact CG1-CB 4.36Å; I478-L503 HydrophobicContact CG2-CB 4.41Å; I478-A504 HydrophobicContact CG2-CB 3.98Å
479	D	87.6	Confident	88.8	Confident	98 Å²	98	51.8 Å²	51.8	52%	0.524	28%	0.275	S	S	.	.	H	α-helix	trans	-67.5	-37.2	177.3	-70.1	-30.1	0	0	0	112.6	K475 G476 I477 R482 G483	K475-D479 PolarHBondContact O-N 3.43Å; G476-D479 PolarHBondContact O-N 3.48Å; I477-D479 VanDerWaalsContact C-N 3.27Å; I477-D479 PolarHBondContact O-N 2.95Å; D479-R482 PolarHBondContact O-N 3.36Å; D479-R482 IonicContact OD1-CZ 2.71Å; D479-R482 IonicContact OD1-NH1 2.72Å; D479-R482 PolarHBondContact OD1-NH1 2.78Å; D479-G483 PolarHBondContact O-N 2.97Å
480	Q	88.9	Confident	89	Confident	34 Å²	34	51.4 Å²	51.4	16%	0.159	27%	0.268	C	S	.	.	H	α-helix	trans	-67.3	-39.1	175.1	-69.3	-174.3	-14.3	0	0	112.5	S450 L452 G476 I477 G483 W484	S450-Q480 VanDerWaalsContact O-CD 3.23Å; S450-Q480 PolarHBondContact O-NE2 3.42Å; S450-Q480 PolarHBondContact O-OE1 3.29Å; L452-Q480 HydrophobicContact CB-CB 4.41Å; L452-Q480 HydrophobicContact CD1-CB 4.03Å; L452-Q480 HydrophobicContact CG-CB 4.23Å; G476-Q480 PolarHBondContact O-N 3.05Å; I477-Q480 PolarHBondContact O-N 3.38Å; I477-Q480 VanDerWaalsContact O-N 3.09Å; Q480-G483 WeakPolarHBondContact O-CA 3.27Å; Q480-G483 PolarHBondContact O-N 3.19Å; Q480-G483 VanDerWaalsContact O-N 3.14Å; Q480-W484 PolarHBondContact O-N 3.3Å
481	I	91.9	Very high	89.1	Confident	0 Å²	0	50 Å²	50	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-61.8	-44.5	175.1	-66.1	166.9	0	0	0	110.4	I464 I477 I478 G483 W484 M485 L491 L500 V501 A504	I464-I481 HydrophobicContact CD1-CD1 3.67Å; I464-I481 HydrophobicContact CD1-CG1 3.75Å; I464-I481 HydrophobicContact CD1-CG2 4.4Å; I477-I481 HydrophobicContact CG2-CD1 3.82Å; I477-I481 HydrophobicContact CG2-CG1 4.21Å; I477-I481 WeakPolarHBondContact O-CG1 3.4Å; I477-I481 PolarHBondContact O-N 3.46Å; I478-I481 PolarHBondContact O-N 2.76Å; I481-G483 PolarHBondContact O-N 2.99Å; I481-W484 PolarHBondContact O-N 3.24Å; I481-W484 VanDerWaalsContact O-N 3.17Å; I481-M485 HydrophobicContact CG2-CE 3.67Å; I481-M485 HydrophobicContact CG2-SD 4.28Å; I481-M485 WeakPolarHBondContact O-CG 3.42Å; I481-M485 PolarHBondContact O-N 3.29Å; I481-L491 HydrophobicContact CG2-CD1 4.33Å; I481-L500 HydrophobicContact CD1-CB 3.66Å; I481-V501 HydrophobicContact CG2-CG2 4.21Å; I481-A504 HydrophobicContact CB-CB 4.05Å; I481-A504 HydrophobicContact CG2-CB 3.69Å
482	R	89.9	Confident	89.3	Confident	108 Å²	108	50 Å²	50	41%	0.408	26%	0.261	S	S	.	.	H	α-helix	trans	-57.4	-41	173.6	-70.8	178	-171.2	132	3.2	111.6	I478 D479 M485 T486 L503 A504	I478-R482 WeakPolarHBondContact O-CG 3.37Å; I478-R482 PolarHBondContact O-N 3.13Å; I478-R482 VanDerWaalsContact O-N 3.1Å; D479-R482 PolarHBondContact O-N 3.36Å; D479-R482 IonicContact OD1-CZ 2.71Å; D479-R482 IonicContact OD1-NH1 2.72Å; D479-R482 PolarHBondContact OD1-NH1 2.78Å; R482-M485 PolarHBondContact O-N 3.23Å; R482-T486 WeakPolarHBondContact O-CG2 3.29Å; R482-L503 PolarHBondContact NH2-O 2.87Å; R482-A504 HydrophobicContact CG-CB 3.85Å; R482-A504 WeakPolarHBondContact CG-O 3.48Å; R482-A504 PolarHBondContact NE-O 3.33Å
483	G	88.4	Confident	89.6	Confident	20 Å²	20	46.2 Å²	46.2	21%	0.206	24%	0.241	C	C	.	.	H	α-helix	trans	-57.2	-51.8	173.1	0	0	0	0	0	112.4	D479 Q480 I481 M485 T486	D479-G483 PolarHBondContact O-N 2.97Å; Q480-G483 WeakPolarHBondContact O-CA 3.27Å; Q480-G483 PolarHBondContact O-N 3.19Å; Q480-G483 VanDerWaalsContact O-N 3.14Å; I481-G483 PolarHBondContact O-N 2.99Å; G483-M485 VanDerWaalsContact C-N 3.34Å; G483-M485 PolarHBondContact O-N 3.4Å; G483-T486 WeakPolarHBondContact O-CB 3.23Å; G483-T486 PolarHBondContact O-N 3.1Å; G483-T486 PolarHBondContact O-OG1 2.97Å
484	W	89.1	Confident	90	Very high	10 Å²	10	42.2 Å²	42.2	4%	0.038	22%	0.223	C	C	.	.	H	α-helix	trans	-58.8	-43	177.6	178	-87.4	0	0	0	112.6	L452 L462 Q480 I481 T486 T487 K489	L452-W484 HydrophobicContact CD1-CB 4.43Å; L462-W484 HydrophobicContact CB-CD2 3.76Å; L462-W484 HydrophobicContact CB-CE3 4.32Å; L462-W484 HydrophobicContact CB-CG 4.2Å; L462-W484 HydrophobicContact CB-CH2 4.12Å; L462-W484 HydrophobicContact CB-CZ2 3.55Å; L462-W484 HydrophobicContact CB-CZ3 4.47Å; L462-W484 HydrophobicContact CD2-CB 3.97Å; L462-W484 HydrophobicContact CD2-CD2 3.84Å; L462-W484 HydrophobicContact CD2-CE3 4.44Å; L462-W484 HydrophobicContact CD2-CG 3.56Å; L462-W484 HydrophobicContact CG-CD2 4.34Å; Q480-W484 PolarHBondContact O-N 3.3Å; I481-W484 PolarHBondContact O-N 3.24Å; I481-W484 VanDerWaalsContact O-N 3.17Å; W484-T486 PolarHBondContact O-N 3.42Å; W484-T486 VanDerWaalsContact O-N 3.07Å; W484-T487 VanDerWaalsContact O-CB 3.28Å; W484-T487 WeakPolarHBondContact O-CB 3.17Å; W484-T487 WeakPolarHBondContact O-CG2 3.38Å; W484-T487 PolarHBondContact O-N 3.45Å; W484-T487 PolarHBondContact O-OG1 2.91Å; W484-K489 HydrophobicContact CH2-CD 4.01Å; W484-K489 HydrophobicContact CZ2-CB 3.65Å; W484-K489 HydrophobicContact CZ2-CD 3.89Å; W484-K489 HydrophobicContact CZ2-CG 4.41Å
485	M	89.3	Confident	90.4	Very high	20 Å²	20	42.2 Å²	42.2	10%	0.099	22%	0.223	C	C	.	.	H	α-helix	trans	-58.5	-24.9	-178.8	-73.9	175.6	174.6	0	0	113.2	I481 R482 G483 T487 K488 L491 V501 C505 W573	I481-M485 HydrophobicContact CG2-CE 3.67Å; I481-M485 HydrophobicContact CG2-SD 4.28Å; I481-M485 WeakPolarHBondContact O-CG 3.42Å; I481-M485 PolarHBondContact O-N 3.29Å; R482-M485 PolarHBondContact O-N 3.23Å; G483-M485 VanDerWaalsContact C-N 3.34Å; G483-M485 PolarHBondContact O-N 3.4Å; M485-T487 PolarHBondContact O-N 2.89Å; M485-K488 PolarHBondContact O-N 3.41Å; M485-K488 VanDerWaalsContact O-N 3.14Å; M485-L491 HydrophobicContact CE-CD1 4.12Å; M485-L491 HydrophobicContact CG-CD1 4.43Å; M485-V501 HydrophobicContact CE-CB 4.42Å; M485-V501 HydrophobicContact CE-CG1 3.64Å; M485-C505 WeakPolarHBondContact CE-SG 3.27Å; M485-C505 VanDerWaalsContact SD-SG 3.63Å; M485-W573 HydrophobicContact CB-CH2 4.21Å; M485-W573 HydrophobicContact CB-CZ2 4.03Å; M485-W573 HydrophobicContact CG-CZ2 4.3Å; M485-W573 VanDerWaalsContact O-CZ2 3.32Å; M485-W573 WeakPolarHBondContact O-CZ2 3.29Å
486	T	87.9	Confident	91	Very high	113 Å²	113	35.3 Å²	35.3	69%	0.693	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-23.3	173.7	71.5	0	0	0	0	113.5	R482 G483 W484 K488	R482-T486 WeakPolarHBondContact O-CG2 3.29Å; G483-T486 WeakPolarHBondContact O-CB 3.23Å; G483-T486 PolarHBondContact O-N 3.1Å; G483-T486 PolarHBondContact O-OG1 2.97Å; W484-T486 PolarHBondContact O-N 3.42Å; W484-T486 VanDerWaalsContact O-N 3.07Å; T486-K488 VanDerWaalsContact C-N 3.3Å; T486-K488 PolarHBondContact O-N 3.04Å
487	T	86.9	Confident	91.6	Very high	70 Å²	70	33.2 Å²	33.2	43%	0.429	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-17.4	177.4	71.9	0	0	0	0	113.5	W484 M485 K489	W484-T487 VanDerWaalsContact O-CB 3.28Å; W484-T487 WeakPolarHBondContact O-CB 3.17Å; W484-T487 WeakPolarHBondContact O-CG2 3.38Å; W484-T487 PolarHBondContact O-N 3.45Å; W484-T487 PolarHBondContact O-OG1 2.91Å; M485-T487 PolarHBondContact O-N 2.89Å; T487-K489 PolarHBondContact O-N 2.8Å; T487-K489 VanDerWaalsContact O-N 3.11Å; T487-K489 PolarHBondContact OG1-N 3.29Å
488	K	85.9	Confident	92	Very high	130 Å²	130	33.2 Å²	33.2	57%	0.565	17%	0.17	S	C	*	.			trans	56.7	15.7	-173	-57.6	-179.7	177.4	179.9	0	115.1	M485 T486 P572	M485-K488 PolarHBondContact O-N 3.41Å; M485-K488 VanDerWaalsContact O-N 3.14Å; T486-K488 VanDerWaalsContact C-N 3.3Å; T486-K488 PolarHBondContact O-N 3.04Å; K488-P572 WeakPolarHBondContact O-CG 3.49Å
489	K	89.2	Confident	92.3	Very high	62 Å²	62	32.8 Å²	32.8	27%	0.27	17%	0.168	S	C	.	.			trans	-70.6	157.6	173.5	-70.6	-176.1	176.1	-176.5	0	111.6	Y459 W484 T487 W573	Y459-K489 WeakPolarHBondContact O-CD 3.43Å; Y459-K489 PolarHBondContact O-NZ 3.22Å; W484-K489 HydrophobicContact CH2-CD 4.01Å; W484-K489 HydrophobicContact CZ2-CB 3.65Å; W484-K489 HydrophobicContact CZ2-CD 3.89Å; W484-K489 HydrophobicContact CZ2-CG 4.41Å; T487-K489 PolarHBondContact O-N 2.8Å; T487-K489 VanDerWaalsContact O-N 3.11Å; T487-K489 PolarHBondContact OG1-N 3.29Å; K489-W573 PolarHBondContact O-NE1 3.47Å
490	P	93.2	Very high	92.8	Very high	15 Å²	15	28.1 Å²	28.1	10%	0.097	14%	0.143	C	C	.	.			trans	-55.9	140.5	177.4	-25.5	35.5	0	0	0	113.3	D460 A461 L462 P572 F596 Y599 I600	D460-P490 WeakPolarHBondContact O-CD 3.4Å; A461-P490 WeakPolarHBondContact CA-O 3.41Å; A461-P490 HydrophobicContact CB-CB 3.85Å; A461-P490 HydrophobicContact CB-CG 4.46Å; A461-P490 WeakPolarHBondContact CB-O 3.5Å; L462-P490 PolarHBondContact N-O 3.3Å; P490-P572 VanDerWaalsContact CA-O 3.27Å; P490-P572 WeakPolarHBondContact CA-O 3.38Å; P490-P572 HydrophobicContact CB-CB 4.11Å; P490-P572 HydrophobicContact CB-CG 4.31Å; P490-P572 HydrophobicContact CG-CB 4.02Å; P490-P572 HydrophobicContact CG-CG 4.01Å; P490-F596 HydrophobicContact CB-CE2 3.73Å; P490-F596 HydrophobicContact CB-CZ 4Å; P490-Y599 HydrophobicContact CG-CD1 4.09Å; P490-Y599 HydrophobicContact CG-CE1 3.96Å; P490-I600 HydrophobicContact CB-CG1 4.18Å; P490-I600 HydrophobicContact CG-CG1 4.06Å
491	L	95.4	Very high	93	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	131.4	179.8	-174.2	153.6	0	0	0	109.9	L462 I464 I481 M485 V501 P572 W573 M574 T575	L462-L491 HydrophobicContact CD2-CD1 4.07Å; L462-L491 VanDerWaalsContact O-CA 3.3Å; L462-L491 WeakPolarHBondContact O-CA 3.48Å; I464-L491 HydrophobicContact CD1-CD1 4.29Å; I464-L491 HydrophobicContact CD1-CD2 4.49Å; I481-L491 HydrophobicContact CG2-CD1 4.33Å; M485-L491 HydrophobicContact CE-CD1 4.12Å; M485-L491 HydrophobicContact CG-CD1 4.43Å; L491-V501 HydrophobicContact CD1-CG2 4.35Å; L491-V501 HydrophobicContact CD2-CG1 4.19Å; L491-V501 HydrophobicContact CD2-CG2 3.57Å; L491-P572 PolarHBondContact N-O 3.21Å; L491-W573 HydrophobicContact CB-CB 4.45Å; L491-W573 HydrophobicContact CB-CG 4.2Å; L491-M574 PolarHBondContact O-N 3.33Å; L491-M574 VanDerWaalsContact O-N 3.1Å; L491-T575 HydrophobicContact CD2-CG2 4.31Å
492	F	97.3	Very high	93.2	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	123.7	171.7	-175.5	-150.9	0	0	0	111.6	L462 F463 I464 I494 M574 V576 P580 L592 F593 F596	L462-F492 PolarHBondContact O-N 2.83Å; F463-F492 CarbonylContact C-O 3.24Å; F463-F492 VanDerWaalsContact CA-O 3.28Å; F463-F492 WeakPolarHBondContact CA-O 3.1Å; F463-F492 HydrophobicContact CD2-CB 4.17Å; F463-F492 AromaticContact CD2-CD1 3.86Å; F463-F492 HydrophobicContact CD2-CD1 3.86Å; F463-F492 HydrophobicContact CD2-CG 4.23Å; F463-F492 WeakPolarHBondContact CD2-O 3.41Å; F463-F492 AromaticContact CE2-CD1 3.84Å; F463-F492 HydrophobicContact CE2-CD1 3.84Å; F463-F492 HydrophobicContact CE2-CE1 4.21Å; F463-F492 HydrophobicContact CE2-CG 4.39Å; I464-F492 PolarHBondContact N-O 3.27Å; F492-I494 HydrophobicContact CE1-CD1 4.05Å; F492-I494 HydrophobicContact CE1-CG1 4.31Å; F492-I494 HydrophobicContact CE2-CG1 4.19Å; F492-I494 HydrophobicContact CZ-CD1 3.99Å; F492-I494 HydrophobicContact CZ-CG1 3.95Å; F492-M574 WeakPolarHBondContact CA-O 3.46Å; F492-M574 HydrophobicContact CD1-CE 4.22Å; F492-M574 HydrophobicContact CD2-CE 3.8Å; F492-M574 HydrophobicContact CD2-CG 3.81Å; F492-M574 HydrophobicContact CE1-CE 4.34Å; F492-M574 HydrophobicContact CE2-CE 3.93Å; F492-M574 HydrophobicContact CE2-CG 4.31Å; F492-M574 HydrophobicContact CG-CE 3.97Å; F492-M574 HydrophobicContact CZ-CE 4.21Å; F492-V576 HydrophobicContact CE2-CG2 3.91Å; F492-V576 HydrophobicContact CZ-CG2 4.12Å; F492-P580 HydrophobicContact CZ-CG 4.34Å; F492-L592 HydrophobicContact CZ-CB 4.15Å; F492-L592 HydrophobicContact CZ-CD1 4.49Å; F492-F593 HydrophobicContact CE1-CD1 4.32Å; F492-F593 HydrophobicContact CE1-CE1 4.18Å; F492-F593 HydrophobicContact CE1-CZ 4.41Å; F492-F596 HydrophobicContact CB-CD1 4.25Å; F492-F596 HydrophobicContact CB-CD2 3.89Å; F492-F596 HydrophobicContact CB-CE1 4.01Å; F492-F596 HydrophobicContact CB-CE2 3.64Å; F492-F596 HydrophobicContact CB-CG 4.17Å; F492-F596 HydrophobicContact CB-CZ 3.68Å; F492-F596 HydrophobicContact CD1-CD1 4.48Å; F492-F596 HydrophobicContact CD1-CG 4.4Å
493	G	97.5	Very high	93.4	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	138.8	179.9	0	0	0	0	0	112.9	I464 M574 T575 V576	I464-G493 WeakPolarHBondContact O-CA 3.07Å; G493-M574 PolarHBondContact N-O 2.68Å; G493-T575 CarbonylContact O-C 3.58Å; G493-T575 WeakPolarHBondContact O-CA 3.34Å; G493-T575 WeakPolarHBondContact O-CB 3.4Å; G493-V576 PolarHBondContact O-N 3.36Å
494	I	97.7	Very high	93.6	Very high	0 Å²	0	22 Å²	22	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	135	-178.1	-63.5	-177.8	0	0	0	110.9	F463 I464 S465 N466 F492 L496 G497 V576 P580 E581 F593	F463-I494 HydrophobicContact CE2-CD1 3.65Å; F463-I494 HydrophobicContact CE2-CG1 3.93Å; F463-I494 HydrophobicContact CZ-CD1 3.72Å; F463-I494 HydrophobicContact CZ-CG1 4.15Å; I464-I494 PolarHBondContact O-N 3.18Å; I464-I494 VanDerWaalsContact O-N 3.11Å; S465-I494 CarbonylContact C-O 3.54Å; N466-I494 WeakPolarHBondContact CA-O 3.4Å; N466-I494 PolarHBondContact N-O 3.01Å; F492-I494 HydrophobicContact CE1-CD1 4.05Å; F492-I494 HydrophobicContact CE1-CG1 4.31Å; F492-I494 HydrophobicContact CE2-CG1 4.19Å; F492-I494 HydrophobicContact CZ-CD1 3.99Å; F492-I494 HydrophobicContact CZ-CG1 3.95Å; I494-L496 PolarHBondContact O-N 3.15Å; I494-G497 WeakPolarHBondContact O-CA 3.39Å; I494-G497 PolarHBondContact O-N 2.91Å; I494-V576 CarbonylContact C-O 3.18Å; I494-V576 WeakPolarHBondContact CA-O 3.47Å; I494-V576 HydrophobicContact CG1-CG2 4.07Å; I494-P580 HydrophobicContact CD1-CG 3.69Å; I494-P580 HydrophobicContact CG1-CG 4.43Å; I494-E581 WeakPolarHBondContact CD1-OE2 3.44Å; I494-F593 HydrophobicContact CD1-CE1 4.45Å; I494-F593 HydrophobicContact CD1-CZ 3.78Å
495	C	96.5	Very high	93.7	Very high	3 Å²	3	22.7 Å²	22.7	2%	0.02	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.2	-102.4	176.9	-179.3	0	0	0	0	113.1	N466 G497 H498 Q499 V576 Q577 H579	N466-C495 HydrophobicContact CB-CB 3.82Å; C495-G497 VanDerWaalsContact C-N 3.3Å; C495-G497 PolarHBondContact O-N 2.97Å; C495-H498 WeakPolarHBondContact O-CB 3.39Å; C495-H498 PolarHBondContact O-N 3.42Å; C495-H498 VanDerWaalsContact O-N 3.17Å; C495-Q499 WeakPolarHBondContact O-CG 3.36Å; C495-Q499 PolarHBondContact O-N 2.76Å; C495-Q499 VanDerWaalsContact O-N 3.11Å; C495-V576 PolarHBondContact N-O 2.87Å; C495-Q577 VanDerWaalsContact CA-O 3.32Å; C495-Q577 WeakPolarHBondContact CA-O 3.18Å; C495-Q577 WeakPolarHBondContact CB-O 3.28Å; C495-H579 VanDerWaalsContact CB-CE1 3.44Å; C495-H579 WeakPolarHBondContact CB-CE1 3.27Å; C495-H579 WeakPolarHBondContact CB-NE2 3.38Å
496	L	96.4	Very high	93.7	Very high	1 Å²	1	24.5 Å²	24.5	1%	0.005	15%	0.146	C	C	.	.	H	α-helix	trans	-63.2	-38.8	174.8	-176.3	65.1	0	0	0	110.9	V402 C426 P471 I494 H498 Q499 L500	V402-L496 HydrophobicContact CG2-CD2 3.38Å; C426-L496 HydrophobicContact CB-CD2 4.04Å; P471-L496 HydrophobicContact CB-CD1 3.72Å; I494-L496 PolarHBondContact O-N 3.15Å; L496-H498 VanDerWaalsContact C-N 3.27Å; L496-H498 PolarHBondContact O-N 2.99Å; L496-Q499 WeakPolarHBondContact O-CB 3.39Å; L496-Q499 PolarHBondContact O-N 3.43Å; L496-Q499 VanDerWaalsContact O-N 3.09Å; L496-L500 HydrophobicContact CD1-CG 4.26Å; L496-L500 HydrophobicContact CD2-CD1 4.35Å; L496-L500 HydrophobicContact CG-CD1 3.93Å; L496-L500 HydrophobicContact CG-CG 4.1Å; L496-L500 WeakPolarHBondContact O-CB 3.37Å; L496-L500 VanDerWaalsContact O-CG 3.25Å; L496-L500 WeakPolarHBondContact O-CG 3.17Å; L496-L500 PolarHBondContact O-N 3.4Å
497	G	96.7	Very high	94	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-58.4	-38.5	173.4	0	0	0	0	0	112.8	I464 S465 I494 C495 V501	I464-G497 VanDerWaalsContact CG2-CA 3.48Å; S465-G497 PolarHBondContact O-N 3.34Å; S465-G497 VanDerWaalsContact O-N 3.09Å; I494-G497 WeakPolarHBondContact O-CA 3.39Å; I494-G497 PolarHBondContact O-N 2.91Å; C495-G497 VanDerWaalsContact C-N 3.3Å; C495-G497 PolarHBondContact O-N 2.97Å; G497-V501 WeakPolarHBondContact O-CB 3.43Å; G497-V501 WeakPolarHBondContact O-CG2 3.4Å; G497-V501 PolarHBondContact O-N 2.94Å; G497-V501 VanDerWaalsContact O-N 3.08Å
498	H	96.9	Very high	94.3	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-61.4	-47	172.1	161.3	76.2	0	0	0	111.8	C495 L496 V501 A502 V542 N563 T575 V576 Q577	C495-H498 WeakPolarHBondContact O-CB 3.39Å; C495-H498 PolarHBondContact O-N 3.42Å; C495-H498 VanDerWaalsContact O-N 3.17Å; L496-H498 VanDerWaalsContact C-N 3.27Å; L496-H498 PolarHBondContact O-N 2.99Å; H498-V501 PolarHBondContact O-N 2.68Å; H498-A502 WeakPolarHBondContact O-CB 3.34Å; H498-A502 PolarHBondContact O-N 2.8Å; H498-V542 WeakPolarHBondContact NE2-CG2 3.42Å; H498-N563 PolarHBondContact CE1-OD1 3.04Å; H498-N563 PolarHBondContact NE2-OD1 3.47Å; H498-T575 WeakPolarHBondContact ND1-CB 3.32Å; H498-T575 PolarHBondContact ND1-OG1 2.93Å; H498-V576 WeakPolarHBondContact CB-O 3.44Å; H498-Q577 PolarHBondContact CD2-OE1 3.47Å; H498-Q577 VanDerWaalsContact CD2-OE1 3.26Å
499	Q	96.5	Very high	94.8	Very high	5 Å²	5	18.4 Å²	18.4	2%	0.023	11%	0.106	C	C	.	.	H	α-helix	trans	-64.9	-42.6	-180	-65.2	164.3	9.8	0	0	112.4	P471 C495 L496 A502 L503 T509 Y540 V542 Q577	P471-Q499 HydrophobicContact CB-CB 3.88Å; P471-Q499 HydrophobicContact CG-CB 4.05Å; C495-Q499 WeakPolarHBondContact O-CG 3.36Å; C495-Q499 PolarHBondContact O-N 2.76Å; C495-Q499 VanDerWaalsContact O-N 3.11Å; L496-Q499 WeakPolarHBondContact O-CB 3.39Å; L496-Q499 PolarHBondContact O-N 3.43Å; L496-Q499 VanDerWaalsContact O-N 3.09Å; Q499-A502 PolarHBondContact O-N 2.85Å; Q499-L503 WeakPolarHBondContact O-CG 3.42Å; Q499-L503 PolarHBondContact O-N 3.47Å; Q499-T509 HydrophobicContact CB-CG2 4.07Å; Q499-T509 HydrophobicContact CG-CG2 4.35Å; Q499-Y540 PolarHBondContact NE2-O 3.42Å; Q499-V542 HydrophobicContact CG-CG2 4.28Å; Q499-Q577 VanDerWaalsContact NE2-NE2 3.14Å
500	L	96.6	Very high	95	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-65.9	-40.4	179.2	-67.4	173.4	0	0	0	112	P471 C474 I477 I478 I481 L496 L503 A504	P471-L500 HydrophobicContact CB-CD2 4.18Å; C474-L500 HydrophobicContact CB-CD2 3.56Å; I477-L500 HydrophobicContact CD1-CD1 4.37Å; I477-L500 HydrophobicContact CG2-CD1 4.04Å; I478-L500 HydrophobicContact CD1-CD2 4.48Å; I478-L500 HydrophobicContact CG1-CD2 4.03Å; I481-L500 HydrophobicContact CD1-CB 3.66Å; L496-L500 HydrophobicContact CD1-CG 4.26Å; L496-L500 HydrophobicContact CD2-CD1 4.35Å; L496-L500 HydrophobicContact CG-CD1 3.93Å; L496-L500 HydrophobicContact CG-CG 4.1Å; L496-L500 WeakPolarHBondContact O-CB 3.37Å; L496-L500 VanDerWaalsContact O-CG 3.25Å; L496-L500 WeakPolarHBondContact O-CG 3.17Å; L496-L500 PolarHBondContact O-N 3.4Å; L500-L503 PolarHBondContact O-N 3Å; L500-A504 WeakPolarHBondContact O-CB 3.43Å; L500-A504 PolarHBondContact O-N 3.44Å
501	V	95.1	Very high	95	Very high	1 Å²	1	24 Å²	24	1%	0.006	13%	0.126	C	C	.	.	H	α-helix	trans	-63.5	-44.9	173.9	167.1	0	0	0	0	110.7	I464 I481 M485 L491 G497 H498 L503 A504 C505 W551 T575	I464-V501 HydrophobicContact CD1-CG2 3.62Å; I481-V501 HydrophobicContact CG2-CG2 4.21Å; M485-V501 HydrophobicContact CE-CB 4.42Å; M485-V501 HydrophobicContact CE-CG1 3.64Å; L491-V501 HydrophobicContact CD1-CG2 4.35Å; L491-V501 HydrophobicContact CD2-CG1 4.19Å; L491-V501 HydrophobicContact CD2-CG2 3.57Å; G497-V501 WeakPolarHBondContact O-CB 3.43Å; G497-V501 WeakPolarHBondContact O-CG2 3.4Å; G497-V501 PolarHBondContact O-N 2.94Å; G497-V501 VanDerWaalsContact O-N 3.08Å; H498-V501 PolarHBondContact O-N 2.68Å; V501-L503 PolarHBondContact O-N 3.08Å; V501-A504 WeakPolarHBondContact O-CB 3.43Å; V501-A504 PolarHBondContact O-N 2.91Å; V501-A504 VanDerWaalsContact O-N 3.16Å; V501-C505 PolarHBondContact O-N 3.33Å; V501-C505 PolarHBondContact O-SG 3.18Å; V501-C505 VanDerWaalsContact O-SG 3.39Å; V501-W551 HydrophobicContact CG1-CH2 4.13Å; V501-T575 HydrophobicContact CB-CG2 3.83Å; V501-T575 HydrophobicContact CG1-CG2 3.59Å; V501-T575 HydrophobicContact CG2-CG2 4.05Å
502	A	95	Very high	94.8	Very high	1 Å²	1	24.8 Å²	24.8	1%	0.008	13%	0.13	C	C	.	.	H	α-helix	trans	-60	-46.5	176.5	0	0	0	0	0	111.4	H498 Q499 A504 C505 G506 F507 V542 L566	H498-A502 WeakPolarHBondContact O-CB 3.34Å; H498-A502 PolarHBondContact O-N 2.8Å; Q499-A502 PolarHBondContact O-N 2.85Å; A502-A504 VanDerWaalsContact C-N 3.31Å; A502-A504 PolarHBondContact O-N 3.11Å; A502-C505 CarbonylContact O-C 3.56Å; A502-C505 PolarHBondContact O-N 3.02Å; A502-C505 VanDerWaalsContact O-N 3.14Å; A502-G506 PolarHBondContact O-N 3.23Å; A502-G506 VanDerWaalsContact O-N 3.16Å; A502-F507 HydrophobicContact CB-CB 3.9Å; A502-F507 HydrophobicContact CB-CD2 4.19Å; A502-F507 HydrophobicContact CB-CG 4.23Å; A502-F507 WeakPolarHBondContact O-CB 3.48Å; A502-F507 WeakPolarHBondContact O-CD2 3.44Å; A502-F507 PolarHBondContact O-N 2.97Å; A502-V542 HydrophobicContact CB-CB 4.33Å; A502-V542 HydrophobicContact CB-CG1 3.78Å; A502-V542 HydrophobicContact CB-CG2 3.52Å; A502-L566 HydrophobicContact CB-CD1 4.02Å
503	L	94.5	Very high	94.3	Very high	22 Å²	22	30.6 Å²	30.6	12%	0.115	16%	0.156	C	C	.	.	H	α-helix	trans	-62	-36.8	174.6	-69.8	175	0	0	0	112.6	P471 I472 I478 R482 Q499 L500 V501 C505 G506 T509	P471-L503 HydrophobicContact CB-CD1 3.76Å; P471-L503 HydrophobicContact CG-CD1 4.28Å; I472-L503 HydrophobicContact CG1-CD1 4.25Å; I478-L503 HydrophobicContact CD1-CB 3.91Å; I478-L503 HydrophobicContact CD1-CD1 3.76Å; I478-L503 HydrophobicContact CD1-CG 4.49Å; I478-L503 HydrophobicContact CG1-CB 4.36Å; I478-L503 HydrophobicContact CG2-CB 4.41Å; R482-L503 PolarHBondContact NH2-O 2.87Å; Q499-L503 WeakPolarHBondContact O-CG 3.42Å; Q499-L503 PolarHBondContact O-N 3.47Å; L500-L503 PolarHBondContact O-N 3Å; V501-L503 PolarHBondContact O-N 3.08Å; L503-C505 VanDerWaalsContact C-N 3.28Å; L503-C505 PolarHBondContact O-N 3.39Å; L503-G506 PolarHBondContact O-N 3.33Å; L503-T509 HydrophobicContact CD1-CG2 4.28Å; L503-T509 HydrophobicContact CD2-CG2 4.02Å; L503-T509 HydrophobicContact CG-CG2 3.99Å
504	A	92.5	Very high	93.8	Very high	10 Å²	10	32 Å²	32	8%	0.083	16%	0.161	C	C	.	.	H	α-helix	trans	-62.4	-37.5	175	0	0	0	0	0	111.6	I478 I481 R482 L500 V501 A502 G506	I478-A504 HydrophobicContact CG2-CB 3.98Å; I481-A504 HydrophobicContact CB-CB 4.05Å; I481-A504 HydrophobicContact CG2-CB 3.69Å; R482-A504 HydrophobicContact CG-CB 3.85Å; R482-A504 WeakPolarHBondContact CG-O 3.48Å; R482-A504 PolarHBondContact NE-O 3.33Å; L500-A504 WeakPolarHBondContact O-CB 3.43Å; L500-A504 PolarHBondContact O-N 3.44Å; V501-A504 WeakPolarHBondContact O-CB 3.43Å; V501-A504 PolarHBondContact O-N 2.91Å; V501-A504 VanDerWaalsContact O-N 3.16Å; A502-A504 VanDerWaalsContact C-N 3.31Å; A502-A504 PolarHBondContact O-N 3.11Å; A504-G506 VanDerWaalsContact C-N 3.33Å
505	C	90.9	Very high	93.2	Very high	24 Å²	24	32.2 Å²	32.2	16%	0.162	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.7	4.9	177.4	-63.8	0	0	0	0	115.1	M485 V501 A502 L503 F507 T548 W551	M485-C505 WeakPolarHBondContact CE-SG 3.27Å; M485-C505 VanDerWaalsContact SD-SG 3.63Å; V501-C505 PolarHBondContact O-N 3.33Å; V501-C505 PolarHBondContact O-SG 3.18Å; V501-C505 VanDerWaalsContact O-SG 3.39Å; A502-C505 CarbonylContact O-C 3.56Å; A502-C505 PolarHBondContact O-N 3.02Å; A502-C505 VanDerWaalsContact O-N 3.14Å; L503-C505 VanDerWaalsContact C-N 3.28Å; L503-C505 PolarHBondContact O-N 3.39Å; C505-F507 HydrophobicContact CB-CD2 4Å; C505-F507 HydrophobicContact CB-CE2 4.11Å; C505-T548 PolarHBondContact O-OG1 2.73Å; C505-W551 HydrophobicContact CB-CZ2 4.45Å; C505-W551 WeakPolarHBondContact SG-CZ2 3.23Å
506	G	89.6	Confident	92.6	Very high	58 Å²	58	32.1 Å²	32.1	60%	0.598	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	90.5	5.6	174.7	0	0	0	0	0	115.9	A502 L503 A504	A502-G506 PolarHBondContact O-N 3.23Å; A502-G506 VanDerWaalsContact O-N 3.16Å; L503-G506 PolarHBondContact O-N 3.33Å; A504-G506 VanDerWaalsContact C-N 3.33Å
507	F	94.1	Very high	92.1	Very high	11 Å²	11	32.5 Å²	32.5	5%	0.048	16%	0.164	C	C	.	.			trans	-69.4	169.8	168.4	-65.2	-95.4	0	0	0	110.9	A502 C505 V542 I547 W551 L566	A502-F507 HydrophobicContact CB-CB 3.9Å; A502-F507 HydrophobicContact CB-CD2 4.19Å; A502-F507 HydrophobicContact CB-CG 4.23Å; A502-F507 WeakPolarHBondContact O-CB 3.48Å; A502-F507 WeakPolarHBondContact O-CD2 3.44Å; A502-F507 PolarHBondContact O-N 2.97Å; C505-F507 HydrophobicContact CB-CD2 4Å; C505-F507 HydrophobicContact CB-CE2 4.11Å; F507-V542 HydrophobicContact CB-CG1 3.87Å; F507-V542 HydrophobicContact CD1-CG1 4.1Å; F507-V542 HydrophobicContact CG-CG1 4.16Å; F507-I547 HydrophobicContact CE1-CB 4.42Å; F507-I547 HydrophobicContact CE1-CG1 3.88Å; F507-I547 HydrophobicContact CZ-CG1 4.33Å; F507-W551 HydrophobicContact CE2-CB 4.35Å; F507-W551 HydrophobicContact CE2-CD2 4.45Å; F507-W551 HydrophobicContact CE2-CG 4.09Å; F507-W551 HydrophobicContact CZ-CB 3.92Å; F507-W551 HydrophobicContact CZ-CG 4.16Å; F507-L566 HydrophobicContact CD2-CD1 4.28Å; F507-L566 HydrophobicContact CE1-CD1 4.3Å; F507-L566 HydrophobicContact CE1-CD2 4.39Å; F507-L566 HydrophobicContact CE2-CD1 4.06Å; F507-L566 HydrophobicContact CZ-CD1 4.08Å; F507-L566 HydrophobicContact CZ-CD2 4.28Å
508	K	93.9	Very high	91.6	Very high	155 Å²	155	32.5 Å²	32.5	67%	0.674	16%	0.164	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-113	155.1	172.5	-65.5	-179.1	-179.3	178.1	0	110	D543	K508-D543 HydrophobicContact CB-CB 4.48Å; K508-D543 PolarHBondContact O-N 2.78Å
509	T	94.6	Very high	91.2	Very high	18 Å²	18	32.6 Å²	32.6	11%	0.11	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	156.6	169.8	53.9	0	0	0	0	109.8	P471 Q499 L503 A541 V542	P471-T509 HydrophobicContact CG-CG2 3.89Å; Q499-T509 HydrophobicContact CB-CG2 4.07Å; Q499-T509 HydrophobicContact CG-CG2 4.35Å; L503-T509 HydrophobicContact CD1-CG2 4.28Å; L503-T509 HydrophobicContact CD2-CG2 4.02Å; L503-T509 HydrophobicContact CG-CG2 3.99Å; T509-A541 CarbonylContact C-O 3.56Å; T509-A541 VanDerWaalsContact CA-O 3.26Å; T509-A541 WeakPolarHBondContact CA-O 3.3Å; T509-V542 HydrophobicContact CG2-CG2 4.16Å
510	Y	94.3	Very high	90.8	Very high	102 Å²	102	33 Å²	33	40%	0.4	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	152	174.3	63.5	-83.8	0	0	0	110.3	M512 Y540 A541 D543	Y510-M512 HydrophobicContact CE2-CG 4.29Å; Y510-Y540 VanDerWaalsContact O-CA 3.29Å; Y510-Y540 WeakPolarHBondContact O-CA 3.49Å; Y510-A541 WeakPolarHBondContact CD1-O 3.45Å; Y510-A541 HydrophobicContact CE1-CB 4.01Å; Y510-A541 HydrophobicContact CE2-CB 4.33Å; Y510-A541 PolarHBondContact N-O 3.3Å; Y510-A541 PolarHBondContact O-N 2.79Å; Y510-D543 HydrophobicContact CD1-CB 4.06Å; Y510-D543 HydrophobicContact CE1-CB 4.27Å
511	K	92.5	Very high	90.6	Very high	92 Å²	92	33.3 Å²	33.3	40%	0.4	17%	0.168	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	127.9	173.2	-170.6	171	-177.4	174.1	0	109.2	E268 Y540	E268-K511 WeakPolarHBondContact OE1-CE 3.26Å; E268-K511 IonicContact OE1-NZ 3.74Å; E268-K511 PolarHBondContact OE1-NZ 2.88Å; K511-Y540 HydrophobicContact CB-CD1 4Å; K511-Y540 HydrophobicContact CB-CE1 3.67Å; K511-Y540 HydrophobicContact CG-CE1 4.1Å
512	M	92.2	Very high	90.6	Very high	17 Å²	17	33.3 Å²	33.3	8%	0.084	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	150	174	-61	176.7	74.7	0	0	109.6	Y510 Y514 N516 G539 A541 D560	Y510-M512 HydrophobicContact CE2-CG 4.29Å; M512-Y514 PolarHBondContact O-N 3.32Å; M512-N516 WeakPolarHBondContact CE-ND2 3.33Å; M512-G539 PolarHBondContact N-O 3.5Å; M512-A541 HydrophobicContact CG-CB 3.98Å; M512-A541 HydrophobicContact SD-CB 3.88Å; M512-D560 WeakPolarHBondContact CE-OD2 3.39Å
513	K	86.7	Confident	90.7	Very high	123 Å²	123	33.2 Å²	33.2	54%	0.535	17%	0.168	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-53.5	-57.2	-174.4	-176.6	-173.9	-179.6	-162.8	0	112.7	R372 Q373 G375 T376	R372-K513 WeakPolarHBondContact O-CE 3.47Å; R372-K513 PolarHBondContact O-NZ 3.2Å; Q373-K513 WeakPolarHBondContact O-CE 3.25Å; Q373-K513 PolarHBondContact O-NZ 2.78Å; G375-K513 CarbonylContact C-O 3.58Å; G375-K513 WeakPolarHBondContact CA-O 3.08Å; T376-K513 PolarHBondContact N-O 3.03Å; T376-K513 VanDerWaalsContact N-O 3.15Å
514	Y	86.2	Confident	90.8	Very high	30 Å²	30	33.2 Å²	33.2	12%	0.118	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	-16.9	172.9	51.8	-90.8	0	0	0	112.1	F271 T376 M512 R517 E1194	F271-Y514 HydrophobicContact CE1-CD2 4.34Å; F271-Y514 HydrophobicContact CE1-CG 4.48Å; F271-Y514 AromaticContact CZ-CD2 3.87Å; F271-Y514 HydrophobicContact CZ-CD2 3.87Å; F271-Y514 HydrophobicContact CZ-CE2 4.49Å; F271-Y514 HydrophobicContact CZ-CG 4.38Å; T376-Y514 WeakPolarHBondContact CG2-O 3.43Å; M512-Y514 PolarHBondContact O-N 3.32Å; Y514-R517 PolarHBondContact O-NH1 2.83Å; Y514-E1194 HydrophobicContact CE2-CG 4.32Å
515	G	84.9	Confident	91	Very high	4 Å²	4	32.7 Å²	32.7	4%	0.041	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	74.9	160	-178.1	0	0	0	0	0	113.4	H538	G515-H538 WeakPolarHBondContact CA-O 3.3Å
516	N	84.3	Confident	91.1	Very high	1 Å²	1	34.8 Å²	34.8	1%	0.005	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	114.7	-177.9	-65.8	-18.3	0	0	0	109.4	M512 Q536 N537 H538 D560	M512-N516 WeakPolarHBondContact CE-ND2 3.33Å; N516-Q536 HydrophobicContact CB-CB 3.85Å; N516-Q536 PolarHBondContact ND2-OE1 2.89Å; N516-Q536 CarbonylContact O-C 3.46Å; N516-N537 CarbonylContact O-C 3.32Å; N516-N537 VanDerWaalsContact O-C 3.24Å; N516-N537 WeakPolarHBondContact O-CA 3.31Å; N516-N537 PolarHBondContact O-N 3.42Å; N516-N537 VanDerWaalsContact O-N 3.13Å; N516-H538 PolarHBondContact N-O 2.94Å; N516-H538 PolarHBondContact O-N 3.18Å; N516-D560 PolarHBondContact ND2-OD2 2.85Å; N516-D560 PolarHBondContact OD1-OD2 3.06Å
517	R	86.2	Confident	91.2	Very high	9 Å²	9	35 Å²	35	3%	0.034	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	54.5	-177.1	-74.8	173.2	-174.4	85.9	-12.2	110.3	F271 Q272 T273 Y287 Y514 Q536 N537	F271-R517 WeakPolarHBondContact O-CB 3.18Å; Q272-R517 WeakPolarHBondContact CA-O 3.28Å; Q272-R517 WeakPolarHBondContact CB-O 3.42Å; Q272-R517 VanDerWaalsContact CG-O 3.3Å; Q272-R517 WeakPolarHBondContact CG-O 3.27Å; T273-R517 PolarHBondContact N-O 3.09Å; Y287-R517 HydrophobicContact CE1-CG 4.25Å; Y514-R517 PolarHBondContact O-NH1 2.83Å; R517-Q536 CarbonylContact C-O 3.35Å; R517-Q536 WeakPolarHBondContact CA-O 3.14Å; R517-N537 HydrophobicContact CG-CB 4.43Å
518	G	86.6	Confident	91.1	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	163.2	-175.3	0	0	0	0	0	111.7	T273 S535 Q536	T273-G518 WeakPolarHBondContact OG1-CA 3.31Å; G518-S535 WeakPolarHBondContact O-CA 3.26Å; G518-Q536 PolarHBondContact N-O 2.88Å; G518-Q536 PolarHBondContact O-N 3.28Å
519	H	87.9	Confident	91	Very high	2 Å²	2	31 Å²	31	1%	0.009	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	-5.4	-179.3	-55.6	166.7	0	0	0	113.6	Q272 V276 T534 S535 A584 P586 Y904	Q272-H519 PolarHBondContact NE2-CE1 2.88Å; Q272-H519 PolarHBondContact NE2-NE2 3.01Å; V276-H519 PolarHBondContact O-CE1 3.2Å; H519-T534 CarbonylContact C-O 3.51Å; H519-T534 CarbonylContact O-C 3.58Å; H519-S535 WeakPolarHBondContact CA-OG 3.36Å; H519-A584 PolarHBondContact CD2-O 3Å; H519-A584 WeakPolarHBondContact CE1-CB 3.45Å; H519-P586 WeakPolarHBondContact O-CD 3.19Å; H519-Y904 VanDerWaalsContact CB-OH 3.25Å; H519-Y904 WeakPolarHBondContact CB-OH 3.05Å
520	N	89.2	Confident	91	Very high	14 Å²	14	31.3 Å²	31.3	8%	0.075	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	40.5	-166.9	-62.9	-18.8	0	0	0	112.9	I533 E990 S992	N520-I533 HydrophobicContact CB-CG2 4.29Å; N520-E990 HydrophobicContact CB-CB 4.1Å; N520-E990 VanDerWaalsContact CB-O 3.29Å; N520-E990 WeakPolarHBondContact CB-O 3.42Å; N520-E990 PolarHBondContact ND2-O 3.24Å; N520-S992 PolarHBondContact ND2-OG 3Å
521	Q	91.4	Very high	91	Very high	5 Å²	5	26.6 Å²	26.6	2%	0.023	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	122.1	-173.8	-63.1	-63.4	-28.4	0	0	112.5	C523 T534 Q536 N557 E1194	Q521-C523 PolarHBondContact O-N 3.08Å; Q521-T534 WeakPolarHBondContact CB-O 3.3Å; Q521-T534 PolarHBondContact N-O 3.34Å; Q521-T534 PolarHBondContact O-N 3.19Å; Q521-T534 PolarHBondContact O-OG1 3.46Å; Q521-Q536 VanDerWaalsContact CB-CD 3.48Å; Q521-Q536 HydrophobicContact CB-CG 4Å; Q521-Q536 HydrophobicContact CG-CB 4.14Å; Q521-Q536 HydrophobicContact CG-CG 3.99Å; Q521-N557 PolarHBondContact OE1-ND2 3.03Å; Q521-E1194 PolarHBondContact NE2-OE1 2.83Å; Q521-E1194 PolarHBondContact NE2-OE2 2.84Å
522	P	95.1	Very high	91.1	Very high	1 Å²	1	22.8 Å²	22.8	1%	0.006	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	114	-175.4	31.6	-34	0	0	0	113.2	F532 I533 N557 K558 N559 T986 C988	P522-F532 WeakPolarHBondContact CA-O 3.27Å; P522-I533 HydrophobicContact CB-CD1 4.24Å; P522-N557 WeakPolarHBondContact O-CA 3.42Å; P522-K558 HydrophobicContact CB-CB 4.34Å; P522-K558 HydrophobicContact CG-CB 4.22Å; P522-K558 PolarHBondContact O-N 3.01Å; P522-N559 WeakPolarHBondContact CG-ND2 3.45Å; P522-T986 HydrophobicContact CB-CG2 4.12Å; P522-T986 HydrophobicContact CG-CG2 3.81Å; P522-C988 WeakPolarHBondContact CB-O 3.47Å
523	C	96.6	Very high	91.3	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	124.1	-179.7	-68.4	0	0	0	0	110.6	Q521 C531 F532 T534 Q536 F555 F578	Q521-C523 PolarHBondContact O-N 3.08Å; C523-C531 WeakPolarHBondContact O-CA 3.28Å; C523-F532 PolarHBondContact N-O 2.9Å; C523-F532 PolarHBondContact O-N 3.01Å; C523-T534 HydrophobicContact CB-CG2 3.93Å; C523-T534 PolarHBondContact SG-OG1 3.09Å; C523-Q536 PolarHBondContact SG-NE2 2.94Å; C523-F555 HydrophobicContact CB-CD1 4.31Å; C523-F578 HydrophobicContact CB-CD1 4.44Å; C523-F578 HydrophobicContact CB-CE1 4.47Å
524	V	96.7	Very high	91.6	Very high	21 Å²	21	16.5 Å²	16.5	13%	0.127	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	125.1	177.4	179.5	0	0	0	0	109.7	L526 R530 C531 F555 R556 K558	V524-L526 HydrophobicContact CG1-CD2 4.47Å; V524-L526 PolarHBondContact O-N 3.09Å; V524-R530 CarbonylContact C-O 3.52Å; V524-R530 WeakPolarHBondContact CA-O 3.37Å; V524-C531 HydrophobicContact CG2-CB 4.08Å; V524-F555 WeakPolarHBondContact O-CA 3.43Å; V524-R556 PolarHBondContact N-O 3.25Å; V524-R556 PolarHBondContact O-N 2.87Å; V524-K558 HydrophobicContact CG2-CB 4.17Å; V524-K558 HydrophobicContact CG2-CD 4.15Å; V524-K558 HydrophobicContact CG2-CG 4.44Å
525	H	96.1	Very high	92	Very high	0 Å²	0	15 Å²	15	0%	0	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	105.1	167.8	-177.6	-120.1	0	0	0	109.3	T528 G529 R530 F532 L554 F555 I616	H525-T528 WeakPolarHBondContact ND1-CG2 3.43Å; H525-T528 PolarHBondContact ND1-OG1 3.19Å; H525-T528 PolarHBondContact O-N 3.44Å; H525-T528 PolarHBondContact O-OG1 3.34Å; H525-G529 PolarHBondContact O-N 3.11Å; H525-R530 PolarHBondContact N-O 3.46Å; H525-F532 HydrophobicContact CB-CE2 4.44Å; H525-L554 PolarHBondContact CD2-O 3.31Å; H525-F555 HydrophobicContact CB-CD1 3.95Å; H525-F555 HydrophobicContact CB-CE1 3.53Å; H525-F555 HydrophobicContact CB-CZ 4.12Å; H525-F555 AromaticContact CD2-CZ 3.75Å; H525-I616 HydrophobicContact CB-CD1 4.34Å; H525-I616 HydrophobicContact CB-CG2 4.47Å
526	L	94	Very high	92.3	Very high	68 Å²	68	14.9 Å²	14.9	36%	0.356	9%	0.092	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-40.7	-167.7	-63.4	-172.9	0	0	0	114.4	V524 T528 E553 L554 R556	V524-L526 HydrophobicContact CG1-CD2 4.47Å; V524-L526 PolarHBondContact O-N 3.09Å; L526-T528 VanDerWaalsContact C-N 3.29Å; L526-T528 PolarHBondContact O-N 2.93Å; L526-E553 HydrophobicContact CD1-CB 3.62Å; L526-E553 WeakPolarHBondContact CD1-O 3.42Å; L526-L554 PolarHBondContact N-O 3.36Å; L526-L554 VanDerWaalsContact N-O 3.08Å; L526-R556 HydrophobicContact CD1-CB 4.43Å; L526-R556 HydrophobicContact CD2-CB 4Å; L526-R556 HydrophobicContact CG-CB 4.39Å
527	P	91.9	Very high	92.6	Very high	62 Å²	62	15 Å²	15	40%	0.403	9%	0.093	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-32.1	178.6	-26.2	35.4	0	0	0	114.6	Y552 T613	P527-Y552 HydrophobicContact CG-CE2 4.01Å; P527-T613 HydrophobicContact CB-CG2 4.07Å
528	T	92	Very high	92.9	Very high	43 Å²	43	15 Å²	15	26%	0.264	9%	0.093	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.9	-18.6	-173.7	61.3	0	0	0	0	114.3	H525 L526 R530 T613 I616	H525-T528 WeakPolarHBondContact ND1-CG2 3.43Å; H525-T528 PolarHBondContact ND1-OG1 3.19Å; H525-T528 PolarHBondContact O-N 3.44Å; H525-T528 PolarHBondContact O-OG1 3.34Å; L526-T528 VanDerWaalsContact C-N 3.29Å; L526-T528 PolarHBondContact O-N 2.93Å; T528-R530 PolarHBondContact O-N 3.43Å; T528-R530 PolarHBondContact OG1-N 3.29Å; T528-T613 HydrophobicContact CG2-CG2 4Å; T528-I616 HydrophobicContact CG2-CB 4.39Å; T528-I616 HydrophobicContact CG2-CG2 4Å; T528-I616 WeakPolarHBondContact OG1-CG2 3.25Å
529	G	91	Very high	93.1	Very high	40 Å²	40	15.6 Å²	15.6	41%	0.412	10%	0.099	S	C	.	.			trans	75.9	-5.9	-171.8	0	0	0	0	0	115.6	H525	H525-G529 PolarHBondContact O-N 3.11Å
530	R	94.3	Very high	93.4	Very high	23 Å²	23	16.6 Å²	16.6	9%	0.087	10%	0.103	C	C	.	.			trans	-61.6	138.2	175	-74.5	-74.5	-64.4	-109.6	6.5	111.5	V524 H525 T528 F532 I616 Y618 Y867 D868	V524-R530 CarbonylContact C-O 3.52Å; V524-R530 WeakPolarHBondContact CA-O 3.37Å; H525-R530 PolarHBondContact N-O 3.46Å; T528-R530 PolarHBondContact O-N 3.43Å; T528-R530 PolarHBondContact OG1-N 3.29Å; R530-F532 HydrophobicContact CB-CE2 3.79Å; R530-F532 HydrophobicContact CB-CZ 4.26Å; R530-I616 HydrophobicContact CB-CG2 3.87Å; R530-I616 HydrophobicContact CG-CG2 3.94Å; R530-Y618 VanDerWaalsContact NH1-CB 3.34Å; R530-Y867 WeakPolarHBondContact CD-O 3.09Å; R530-D868 VanDerWaalsContact CZ-O 3.27Å; R530-D868 IonicContact CZ-OD2 3.99Å; R530-D868 VanDerWaalsContact NH1-CB 3.3Å; R530-D868 IonicContact NH1-OD2 3.6Å; R530-D868 PolarHBondContact NH1-OD2 2.97Å; R530-D868 PolarHBondContact NH2-O 3.29Å; R530-D868 IonicContact NH2-OD2 3.15Å; R530-D868 PolarHBondContact NH2-OD2 2.83Å
531	C	95.3	Very high	93.6	Very high	4 Å²	4	15.9 Å²	15.9	3%	0.027	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	139.9	176.3	-166.1	0	0	0	0	110.9	C523 V524 N869 P974	C523-C531 WeakPolarHBondContact O-CA 3.28Å; V524-C531 HydrophobicContact CG2-CB 4.08Å; C531-N869 PolarHBondContact N-OD1 3.1Å; C531-P974 HydrophobicContact CB-CB 4.3Å; C531-P974 HydrophobicContact CB-CG 3.46Å; C531-P974 VanDerWaalsContact CB-CG 3.46Å
532	F	95.2	Very high	93.9	Very high	11 Å²	11	15.8 Å²	15.8	5%	0.048	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	148.1	179.5	-63.5	-90	0	0	0	109.9	P522 C523 H525 R530 F555 D588 L589 F591 I616	P522-F532 WeakPolarHBondContact CA-O 3.27Å; C523-F532 PolarHBondContact N-O 2.9Å; C523-F532 PolarHBondContact O-N 3.01Å; H525-F532 HydrophobicContact CB-CE2 4.44Å; R530-F532 HydrophobicContact CB-CE2 3.79Å; R530-F532 HydrophobicContact CB-CZ 4.26Å; F532-F555 HydrophobicContact CD2-CE1 4.17Å; F532-D588 HydrophobicContact CD1-CB 4.4Å; F532-L589 HydrophobicContact CB-CD1 3.98Å; F532-L589 HydrophobicContact CB-CD2 4.16Å; F532-L589 HydrophobicContact CB-CG 4.03Å; F532-L589 HydrophobicContact CD1-CD2 3.82Å; F532-L589 HydrophobicContact CD1-CG 4.32Å; F532-L589 HydrophobicContact CD2-CD2 3.93Å; F532-L589 HydrophobicContact CE1-CD2 4.15Å; F532-L589 HydrophobicContact CE2-CD2 4.25Å; F532-L589 HydrophobicContact CG-CD1 4.37Å; F532-L589 HydrophobicContact CG-CD2 3.7Å; F532-L589 HydrophobicContact CG-CG 4.11Å; F532-L589 HydrophobicContact CZ-CD2 4.35Å; F532-F591 HydrophobicContact CE1-CE1 4.28Å; F532-F591 HydrophobicContact CZ-CZ 4.46Å; F532-I616 HydrophobicContact CE2-CD1 4.32Å; F532-I616 HydrophobicContact CE2-CG2 3.92Å; F532-I616 HydrophobicContact CZ-CG1 4.35Å; F532-I616 HydrophobicContact CZ-CG2 3.94Å
533	I	94.8	Very high	93.8	Very high	3 Å²	3	18.2 Å²	18.2	2%	0.015	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	131.6	174.5	-53.9	-55.3	0	0	0	108.2	N520 P522 P586 I871 E990	N520-I533 HydrophobicContact CB-CG2 4.29Å; P522-I533 HydrophobicContact CB-CD1 4.24Å; I533-P586 HydrophobicContact CG2-CG 4.23Å; I533-P586 VanDerWaalsContact O-CG 3.25Å; I533-P586 WeakPolarHBondContact O-CG 3.47Å; I533-I871 HydrophobicContact CD1-CG2 3.83Å; I533-I871 HydrophobicContact CG1-CG2 3.75Å; I533-E990 HydrophobicContact CG1-CG 4.18Å; I533-E990 HydrophobicContact CG2-CG 4.24Å
534	T	94.7	Very high	93.5	Very high	5 Å²	5	19.3 Å²	19.3	3%	0.031	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	151.1	-170.1	66.6	0	0	0	0	112.3	H519 Q521 C523 Q536 F578 L589	H519-T534 CarbonylContact C-O 3.51Å; H519-T534 CarbonylContact O-C 3.58Å; Q521-T534 WeakPolarHBondContact CB-O 3.3Å; Q521-T534 PolarHBondContact N-O 3.34Å; Q521-T534 PolarHBondContact O-N 3.19Å; Q521-T534 PolarHBondContact O-OG1 3.46Å; C523-T534 HydrophobicContact CB-CG2 3.93Å; C523-T534 PolarHBondContact SG-OG1 3.09Å; T534-Q536 PolarHBondContact OG1-NE2 3.25Å; T534-F578 HydrophobicContact CG2-CB 4.3Å; T534-F578 HydrophobicContact CG2-CD1 4.2Å; T534-F578 HydrophobicContact CG2-CD2 3.97Å; T534-F578 HydrophobicContact CG2-CE2 4.4Å; T534-F578 HydrophobicContact CG2-CG 3.88Å; T534-L589 HydrophobicContact CG2-CD1 3.58Å
535	S	93.1	Very high	93	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	135.9	168.1	-82.5	0	0	0	0	111.9	G518 H519 H579 A584 G585 P586	G518-S535 WeakPolarHBondContact O-CA 3.26Å; H519-S535 WeakPolarHBondContact CA-OG 3.36Å; S535-H579 PolarHBondContact O-N 3.4Å; S535-A584 PolarHBondContact OG-O 3.01Å; S535-G585 WeakPolarHBondContact OG-CA 3.49Å; S535-P586 WeakPolarHBondContact OG-CD 3.48Å
536	Q	91.8	Very high	92.3	Very high	1 Å²	1	33.6 Å²	33.6	1%	0.005	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	140.1	-177.5	-62.4	-177.8	12.7	0	0	109.6	N516 R517 G518 Q521 C523 T534 H538 E564 F578	N516-Q536 HydrophobicContact CB-CB 3.85Å; N516-Q536 PolarHBondContact ND2-OE1 2.89Å; N516-Q536 CarbonylContact O-C 3.46Å; R517-Q536 CarbonylContact C-O 3.35Å; R517-Q536 WeakPolarHBondContact CA-O 3.14Å; G518-Q536 PolarHBondContact N-O 2.88Å; G518-Q536 PolarHBondContact O-N 3.28Å; Q521-Q536 VanDerWaalsContact CB-CD 3.48Å; Q521-Q536 HydrophobicContact CB-CG 4Å; Q521-Q536 HydrophobicContact CG-CB 4.14Å; Q521-Q536 HydrophobicContact CG-CG 3.99Å; C523-Q536 PolarHBondContact SG-NE2 2.94Å; T534-Q536 PolarHBondContact OG1-NE2 3.25Å; Q536-H538 PolarHBondContact OE1-NE2 2.89Å; Q536-E564 PolarHBondContact NE2-OE2 2.76Å; Q536-F578 HydrophobicContact CG-CB 3.81Å
537	N	91.3	Very high	91.7	Very high	4 Å²	4	33.7 Å²	33.7	2%	0.021	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	21.9	175.1	71.2	20.8	0	0	0	115.1	D284 S286 Y287 K429 N516 R517 H579 H582	D284-N537 PolarHBondContact OD2-ND2 3.15Å; S286-N537 VanDerWaalsContact CB-OD1 3.28Å; S286-N537 WeakPolarHBondContact CB-OD1 3.4Å; S286-N537 PolarHBondContact OG-OD1 3.26Å; Y287-N537 HydrophobicContact CE2-CB 4.14Å; K429-N537 PolarHBondContact NZ-ND2 3.47Å; N516-N537 CarbonylContact O-C 3.32Å; N516-N537 VanDerWaalsContact O-C 3.24Å; N516-N537 WeakPolarHBondContact O-CA 3.31Å; N516-N537 PolarHBondContact O-N 3.42Å; N516-N537 VanDerWaalsContact O-N 3.13Å; R517-N537 HydrophobicContact CG-CB 4.43Å; N537-H579 PolarHBondContact OD1-NE2 3.22Å; N537-H582 PolarHBondContact ND2-NE2 3.14Å
538	H	91	Very high	91.2	Very high	7 Å²	7	33.2 Å²	33.2	3%	0.032	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	145	-172.5	53	88.9	0	0	0	113.5	G515 N516 Q536 Y540 E564 Q577	G515-H538 WeakPolarHBondContact CA-O 3.3Å; N516-H538 PolarHBondContact N-O 2.94Å; N516-H538 PolarHBondContact O-N 3.18Å; Q536-H538 PolarHBondContact OE1-NE2 2.89Å; H538-Y540 PolarHBondContact ND1-O 3.08Å; H538-Y540 VanDerWaalsContact ND1-O 3.09Å; H538-E564 IonicContact CE1-OE1 3.39Å; H538-Q577 PolarHBondContact CD2-NE2 2.77Å; H538-Q577 VanDerWaalsContact CE1-CG 3.48Å; H538-Q577 WeakPolarHBondContact CE1-CG 3.14Å; H538-Q577 WeakPolarHBondContact NE2-CG 3.39Å
539	G	90.9	Very high	90.7	Very high	13 Å²	13	38.6 Å²	38.6	13%	0.134	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	-4.7	173.3	0	0	0	0	0	114.6	M512	M512-G539 PolarHBondContact N-O 3.5Å
540	Y	94.3	Very high	90.5	Very high	23 Å²	23	38 Å²	38	9%	0.09	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	153.1	-175.4	-66	-97.3	0	0	0	110	D470 Q499 Y510 K511 H538 Q577	D470-Y540 HydrophobicContact CB-CE1 4.04Å; D470-Y540 HydrophobicContact CB-CE2 4.16Å; D470-Y540 WeakPolarHBondContact CB-OH 3.37Å; D470-Y540 VanDerWaalsContact CG-CE1 3.48Å; D470-Y540 VanDerWaalsContact OD2-CE1 3.28Å; D470-Y540 WeakPolarHBondContact OD2-CE1 3.28Å; D470-Y540 PolarHBondContact OD2-OH 2.88Å; Q499-Y540 PolarHBondContact NE2-O 3.42Å; Y510-Y540 VanDerWaalsContact O-CA 3.29Å; Y510-Y540 WeakPolarHBondContact O-CA 3.49Å; K511-Y540 HydrophobicContact CB-CD1 4Å; K511-Y540 HydrophobicContact CB-CE1 3.67Å; K511-Y540 HydrophobicContact CG-CE1 4.1Å; H538-Y540 PolarHBondContact ND1-O 3.08Å; H538-Y540 VanDerWaalsContact ND1-O 3.09Å; Y540-Q577 PolarHBondContact O-OE1 3.04Å
541	A	94.9	Very high	90.5	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	160	175.6	0	0	0	0	0	110.9	T509 Y510 M512	T509-A541 CarbonylContact C-O 3.56Å; T509-A541 VanDerWaalsContact CA-O 3.26Å; T509-A541 WeakPolarHBondContact CA-O 3.3Å; Y510-A541 WeakPolarHBondContact CD1-O 3.45Å; Y510-A541 HydrophobicContact CE1-CB 4.01Å; Y510-A541 HydrophobicContact CE2-CB 4.33Å; Y510-A541 PolarHBondContact N-O 3.3Å; Y510-A541 PolarHBondContact O-N 2.79Å; M512-A541 HydrophobicContact CG-CB 3.98Å; M512-A541 HydrophobicContact SD-CB 3.88Å
542	V	96.5	Very high	90.4	Very high	2 Å²	2	38.5 Å²	38.5	1%	0.012	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	136.1	177.2	176.4	0	0	0	0	110.6	H498 Q499 A502 F507 T509 T544 L566	H498-V542 WeakPolarHBondContact NE2-CG2 3.42Å; Q499-V542 HydrophobicContact CG-CG2 4.28Å; A502-V542 HydrophobicContact CB-CB 4.33Å; A502-V542 HydrophobicContact CB-CG1 3.78Å; A502-V542 HydrophobicContact CB-CG2 3.52Å; F507-V542 HydrophobicContact CB-CG1 3.87Å; F507-V542 HydrophobicContact CD1-CG1 4.1Å; F507-V542 HydrophobicContact CG-CG1 4.16Å; T509-V542 HydrophobicContact CG2-CG2 4.16Å; V542-T544 HydrophobicContact CG1-CG2 4.19Å; V542-L566 HydrophobicContact CG1-CD1 4.24Å
543	D	94.4	Very high	90.3	Very high	53 Å²	53	38.8 Å²	38.8	28%	0.283	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	112.4	172.1	-174.7	0	0	0	0	110.4	K508 Y510 K545	K508-D543 HydrophobicContact CB-CB 4.48Å; K508-D543 PolarHBondContact O-N 2.78Å; Y510-D543 HydrophobicContact CD1-CB 4.06Å; Y510-D543 HydrophobicContact CE1-CB 4.27Å; D543-K545 WeakPolarHBondContact OD1-CB 2.9Å; D543-K545 VanDerWaalsContact OD1-CG 3.25Å; D543-K545 WeakPolarHBondContact OD1-CG 3.39Å; D543-K545 PolarHBondContact OD1-N 3.29Å
544	T	90.3	Very high	90.3	Very high	23 Å²	23	38.7 Å²	38.7	14%	0.141	21%	0.205	C	C	.	.			trans	-102.1	9	-177.4	56.2	0	0	0	0	113.9	V542 N546 I547 E553 N563 L566	V542-T544 HydrophobicContact CG1-CG2 4.19Å; T544-N546 PolarHBondContact O-N 2.81Å; T544-N546 VanDerWaalsContact O-N 3.1Å; T544-I547 PolarHBondContact O-N 2.79Å; T544-E553 VanDerWaalsContact CB-OE1 3.28Å; T544-E553 WeakPolarHBondContact CB-OE1 3.42Å; T544-E553 HydrophobicContact CG2-CG 3.98Å; T544-E553 VanDerWaalsContact OG1-CD 3.26Å; T544-E553 PolarHBondContact OG1-OE1 2.88Å; T544-N563 HydrophobicContact CG2-CB 3.57Å; T544-L566 HydrophobicContact CG2-CD2 4.1Å
545	K	86.1	Confident	90.4	Very high	175 Å²	175	38.4 Å²	38.4	76%	0.761	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-32.2	179.3	-74.1	171.7	-175.2	169.8	0	113.4	D543	D543-K545 WeakPolarHBondContact OD1-CB 2.9Å; D543-K545 VanDerWaalsContact OD1-CG 3.25Å; D543-K545 WeakPolarHBondContact OD1-CG 3.39Å; D543-K545 PolarHBondContact OD1-N 3.29Å
546	N	81.1	Confident	90.6	Very high	146 Å²	146	41.4 Å²	41.4	78%	0.781	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-122	79.2	175.4	-63.7	-39.4	0	0	0	109.5	T544 T548	T544-N546 PolarHBondContact O-N 2.81Å; T544-N546 VanDerWaalsContact O-N 3.1Å; N546-T548 PolarHBondContact O-N 3.43Å
547	I	81.8	Confident	90.7	Very high	69 Å²	69	41.4 Å²	41.4	35%	0.354	22%	0.215	S	C	.	.	P	Polyproline II helix	trans	-61.2	131.8	177	-93	163.7	0	0	0	111.1	F507 T544 W551 E553	F507-I547 HydrophobicContact CE1-CB 4.42Å; F507-I547 HydrophobicContact CE1-CG1 3.88Å; F507-I547 HydrophobicContact CZ-CG1 4.33Å; T544-I547 PolarHBondContact O-N 2.79Å; I547-W551 HydrophobicContact CG2-CB 4.4Å; I547-W551 WeakPolarHBondContact CG2-O 3.4Å; I547-E553 HydrophobicContact CD1-CG 3.91Å
548	T	81.3	Confident	90.9	Very high	52 Å²	52	44.5 Å²	44.5	32%	0.319	23%	0.229	S	C	.	.	P	Polyproline II helix	trans	-68.1	142.8	171.7	-49.9	0	0	0	0	111	C505 N546 G550 W551	C505-T548 PolarHBondContact O-OG1 2.73Å; N546-T548 PolarHBondContact O-N 3.43Å; T548-G550 PolarHBondContact O-N 3.23Å; T548-W551 PolarHBondContact O-N 3.34Å; T548-W551 VanDerWaalsContact O-N 3.15Å
549	D	81	Confident	90.9	Very high	156 Å²	156	45.2 Å²	45.2	83%	0.834	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-49.5	133.6	178.8	-79.4	-15.5	0	0	0	112.5	W551	D549-W551 VanDerWaalsContact C-N 3.33Å
550	G	87.4	Confident	90.9	Very high	28 Å²	28	46.8 Å²	46.8	29%	0.289	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	87.9	-12.2	179.2	0	0	0	0	0	115.5	T548 H568 Y569	T548-G550 PolarHBondContact O-N 3.23Å; G550-H568 WeakPolarHBondContact O-CA 3.31Å; G550-H568 PolarHBondContact O-CD2 3.46Å; G550-Y569 WeakPolarHBondContact O-CD2 3.47Å; G550-Y569 PolarHBondContact O-N 2.97Å
551	W	92.9	Very high	90.9	Very high	14 Å²	14	52.9 Å²	52.9	5%	0.053	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	156.5	175.6	-69.8	88.7	0	0	0	112.5	V501 C505 F507 I547 T548 D549 L566 A567 H568 W573	V501-W551 HydrophobicContact CG1-CH2 4.13Å; C505-W551 HydrophobicContact CB-CZ2 4.45Å; C505-W551 WeakPolarHBondContact SG-CZ2 3.23Å; F507-W551 HydrophobicContact CE2-CB 4.35Å; F507-W551 HydrophobicContact CE2-CD2 4.45Å; F507-W551 HydrophobicContact CE2-CG 4.09Å; F507-W551 HydrophobicContact CZ-CB 3.92Å; F507-W551 HydrophobicContact CZ-CG 4.16Å; I547-W551 HydrophobicContact CG2-CB 4.4Å; I547-W551 WeakPolarHBondContact CG2-O 3.4Å; T548-W551 PolarHBondContact O-N 3.34Å; T548-W551 VanDerWaalsContact O-N 3.15Å; D549-W551 VanDerWaalsContact C-N 3.33Å; W551-L566 HydrophobicContact CE3-CB 3.75Å; W551-L566 HydrophobicContact CZ3-CB 3.91Å; W551-A567 WeakPolarHBondContact CA-O 3.39Å; W551-A567 VanDerWaalsContact CE3-C 3.45Å; W551-H568 AromaticContact CD1-CD2 3.89Å; W551-H568 HydrophobicContact CD2-CB 4.24Å; W551-H568 AromaticContact CE2-CD2 3.88Å; W551-H568 HydrophobicContact CE3-CB 4.21Å; W551-H568 HydrophobicContact CH2-CB 4.4Å; W551-H568 HydrophobicContact CZ2-CB 4.39Å; W551-H568 HydrophobicContact CZ3-CB 4.3Å; W551-H568 AromaticContact NE1-CD2 3.68Å; W551-W573 HydrophobicContact CH2-CB 3.77Å; W551-W573 HydrophobicContact CH2-CE3 4.38Å; W551-W573 HydrophobicContact CZ2-CB 4.37Å; W551-W573 AromaticContact CZ2-CE3 3.82Å; W551-W573 HydrophobicContact CZ2-CE3 3.82Å; W551-W573 HydrophobicContact CZ3-CB 4.49Å
552	Y	93.1	Very high	90.8	Very high	23 Å²	23	52.9 Å²	52.9	9%	0.09	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	162.1	168.5	74.9	-82.7	0	0	0	111.1	P527 L554 L566 A567 Y569 S609	P527-Y552 HydrophobicContact CG-CE2 4.01Å; Y552-L554 HydrophobicContact CE2-CD1 4.13Å; Y552-L554 PolarHBondContact O-N 3.22Å; Y552-L554 WeakPolarHBondContact OH-CD1 3.36Å; Y552-L566 WeakPolarHBondContact O-CA 3.5Å; Y552-L566 WeakPolarHBondContact O-CD2 3.15Å; Y552-A567 HydrophobicContact CD1-CB 4.34Å; Y552-A567 WeakPolarHBondContact CD1-O 3.38Å; Y552-A567 HydrophobicContact CE1-CB 3.61Å; Y552-A567 PolarHBondContact N-O 2.85Å; Y552-A567 PolarHBondContact O-N 3Å; Y552-A567 VanDerWaalsContact O-N 3.07Å; Y552-Y569 VanDerWaalsContact CB-OH 3.28Å; Y552-Y569 WeakPolarHBondContact CB-OH 3.48Å; Y552-Y569 AromaticContact CD1-CD1 3.77Å; Y552-Y569 HydrophobicContact CD1-CD1 3.77Å; Y552-Y569 HydrophobicContact CD1-CD2 4.18Å; Y552-Y569 AromaticContact CD1-CE1 3.46Å; Y552-Y569 HydrophobicContact CD1-CE1 3.46Å; Y552-Y569 VanDerWaalsContact CD1-CE1 3.46Å; Y552-Y569 AromaticContact CD1-CE2 3.88Å; Y552-Y569 HydrophobicContact CD1-CE2 3.88Å; Y552-Y569 HydrophobicContact CD1-CG 4.13Å; Y552-Y569 AromaticContact CD1-CZ 3.53Å; Y552-Y569 AromaticContact CE1-CD1 3.97Å; Y552-Y569 HydrophobicContact CE1-CD1 3.97Å; Y552-Y569 AromaticContact CE1-CE1 3.92Å; Y552-Y569 HydrophobicContact CE1-CE1 3.92Å; Y552-Y569 AromaticContact CG-CE1 3.93Å; Y552-Y569 HydrophobicContact CG-CE1 3.93Å; Y552-Y569 HydrophobicContact CG-CE2 4.23Å; Y552-Y569 AromaticContact CG-CZ 3.69Å; Y552-S609 PolarHBondContact OH-OG 3.03Å
553	E	94.3	Very high	90.8	Very high	18 Å²	18	53 Å²	53	8%	0.084	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	121	174.7	-63.5	-168.2	-136.6	0	0	110.8	L526 T544 I547 R556 N563 L566	L526-E553 HydrophobicContact CD1-CB 3.62Å; L526-E553 WeakPolarHBondContact CD1-O 3.42Å; T544-E553 VanDerWaalsContact CB-OE1 3.28Å; T544-E553 WeakPolarHBondContact CB-OE1 3.42Å; T544-E553 HydrophobicContact CG2-CG 3.98Å; T544-E553 VanDerWaalsContact OG1-CD 3.26Å; T544-E553 PolarHBondContact OG1-OE1 2.88Å; I547-E553 HydrophobicContact CD1-CG 3.91Å; E553-R556 IonicContact OE1-CZ 2.78Å; E553-R556 IonicContact OE1-NE 2.73Å; E553-R556 IonicContact OE1-NH2 3.75Å; E553-R556 PolarHBondContact OE1-NH2 2.91Å; E553-R556 IonicContact OE2-CZ 2.97Å; E553-R556 VanDerWaalsContact OE2-CZ 3.31Å; E553-R556 IonicContact OE2-NE 3.12Å; E553-R556 PolarHBondContact OE2-NE 3.38Å; E553-R556 IonicContact OE2-NH2 3.65Å; E553-R556 PolarHBondContact OE2-NH2 3.39Å; E553-N563 VanDerWaalsContact CG-ND2 3.31Å; E553-N563 WeakPolarHBondContact CG-ND2 3.36Å; E553-N563 PolarHBondContact OE2-ND2 3.38Å; E553-L566 HydrophobicContact CG-CD2 4.42Å
554	L	94.6	Very high	90.9	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	-49.8	-179.2	-177.3	65.1	0	0	0	111.3	H525 L526 Y552 G565 A567 L612	H525-L554 PolarHBondContact CD2-O 3.31Å; L526-L554 PolarHBondContact N-O 3.36Å; L526-L554 VanDerWaalsContact N-O 3.08Å; Y552-L554 HydrophobicContact CE2-CD1 4.13Å; Y552-L554 PolarHBondContact O-N 3.22Å; Y552-L554 WeakPolarHBondContact OH-CD1 3.36Å; L554-G565 PolarHBondContact N-O 2.94Å; L554-A567 HydrophobicContact CB-CB 4.18Å; L554-A567 HydrophobicContact CD1-CB 4.16Å; L554-A567 HydrophobicContact CD2-CB 4.29Å; L554-A567 HydrophobicContact CG-CB 4.44Å; L554-L612 HydrophobicContact CD1-CD2 3.56Å; L554-L612 HydrophobicContact CD2-CD2 3.6Å; L554-L612 HydrophobicContact CG-CD2 4.02Å
555	F	96.7	Very high	91.2	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	150.8	176.4	-70.2	-90.6	0	0	0	110.3	C523 V524 H525 F532 E564 G565 V576 F578 L589 I616	C523-F555 HydrophobicContact CB-CD1 4.31Å; V524-F555 WeakPolarHBondContact O-CA 3.43Å; H525-F555 HydrophobicContact CB-CD1 3.95Å; H525-F555 HydrophobicContact CB-CE1 3.53Å; H525-F555 HydrophobicContact CB-CZ 4.12Å; H525-F555 AromaticContact CD2-CZ 3.75Å; F532-F555 HydrophobicContact CD2-CE1 4.17Å; F555-E564 HydrophobicContact CB-CB 3.73Å; F555-E564 PolarHBondContact O-N 3.37Å; F555-G565 PolarHBondContact O-N 3.38Å; F555-V576 HydrophobicContact CD2-CG1 4.2Å; F555-V576 HydrophobicContact CE2-CG1 4.39Å; F555-F578 HydrophobicContact CB-CE1 3.88Å; F555-F578 HydrophobicContact CD1-CE1 4.21Å; F555-F578 HydrophobicContact CD1-CZ 4.43Å; F555-F578 AromaticContact CD2-CE1 3.86Å; F555-F578 HydrophobicContact CD2-CE1 3.86Å; F555-F578 AromaticContact CD2-CZ 3.88Å; F555-F578 HydrophobicContact CD2-CZ 3.88Å; F555-F578 HydrophobicContact CE2-CE1 4.46Å; F555-F578 HydrophobicContact CE2-CZ 4.04Å; F555-F578 AromaticContact CG-CE1 3.74Å; F555-F578 HydrophobicContact CG-CE1 3.74Å; F555-F578 HydrophobicContact CG-CZ 4.12Å; F555-F578 HydrophobicContact CZ-CZ 4.38Å; F555-L589 HydrophobicContact CE1-CD1 4.2Å; F555-L589 HydrophobicContact CE1-CD2 4.38Å; F555-L589 HydrophobicContact CZ-CD1 4.36Å; F555-L589 HydrophobicContact CZ-CD2 4.21Å; F555-I616 HydrophobicContact CZ-CD1 4.07Å
556	R	96.4	Very high	91.6	Very high	63 Å²	63	41 Å²	41	24%	0.238	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	135	172.4	-172.5	177.4	-71	163.2	-11.9	110.2	V524 L526 E553 K558 S562	V524-R556 PolarHBondContact N-O 3.25Å; V524-R556 PolarHBondContact O-N 2.87Å; L526-R556 HydrophobicContact CD1-CB 4.43Å; L526-R556 HydrophobicContact CD2-CB 4Å; L526-R556 HydrophobicContact CG-CB 4.39Å; E553-R556 IonicContact OE1-CZ 2.78Å; E553-R556 IonicContact OE1-NE 2.73Å; E553-R556 IonicContact OE1-NH2 3.75Å; E553-R556 PolarHBondContact OE1-NH2 2.91Å; E553-R556 IonicContact OE2-CZ 2.97Å; E553-R556 VanDerWaalsContact OE2-CZ 3.31Å; E553-R556 IonicContact OE2-NE 3.12Å; E553-R556 PolarHBondContact OE2-NE 3.38Å; E553-R556 IonicContact OE2-NH2 3.65Å; E553-R556 PolarHBondContact OE2-NH2 3.39Å; R556-K558 PolarHBondContact O-N 2.05Å; R556-S562 WeakPolarHBondContact CG-O 3.5Å
557	N	95	Very high	92.2	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	131.8	172.9	-174.8	-42.3	0	0	0	109	Q521 P522 N559 D560 R561 S562 E564	Q521-N557 PolarHBondContact OE1-ND2 3.03Å; P522-N557 WeakPolarHBondContact O-CA 3.42Å; N557-N559 VanDerWaalsContact C-N 3.34Å; N557-N559 PolarHBondContact OD1-N 2.89Å; N557-D560 WeakPolarHBondContact CB-OD1 3.21Å; N557-D560 PolarHBondContact OD1-N 2.8Å; N557-D560 PolarHBondContact OD1-OD1 3.02Å; N557-R561 WeakPolarHBondContact O-CA 3.36Å; N557-R561 PolarHBondContact O-N 3.29Å; N557-S562 VanDerWaalsContact CB-OG 3.22Å; N557-S562 WeakPolarHBondContact CB-OG 3.47Å; N557-S562 PolarHBondContact N-O 3.01Å; N557-S562 VanDerWaalsContact N-O 3.14Å; N557-E564 HydrophobicContact CB-CG 3.67Å; N557-E564 VanDerWaalsContact N-CG 3.29Å
558	K	94.2	Very high	92.8	Very high	70 Å²	70	31.8 Å²	31.8	30%	0.304	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-27.4	-174.8	-173.8	56.4	173.9	-172.6	0	112.8	P522 V524 R556 P974 T986	P522-K558 HydrophobicContact CB-CB 4.34Å; P522-K558 HydrophobicContact CG-CB 4.22Å; P522-K558 PolarHBondContact O-N 3.01Å; V524-K558 HydrophobicContact CG2-CB 4.17Å; V524-K558 HydrophobicContact CG2-CD 4.15Å; V524-K558 HydrophobicContact CG2-CG 4.44Å; R556-K558 PolarHBondContact O-N 2.05Å; K558-P974 WeakPolarHBondContact CE-O 3.33Å; K558-P974 PolarHBondContact NZ-O 3.31Å; K558-T986 HydrophobicContact CB-CG2 4.03Å; K558-T986 HydrophobicContact CG-CG2 3.64Å
559	N	92.2	Very high	93.2	Very high	22 Å²	22	35.6 Å²	35.6	12%	0.118	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.5	-61.1	-173.7	-66.1	-23.9	0	0	0	112.2	P522 N557 T985 T986 W1195	P522-N559 WeakPolarHBondContact CG-ND2 3.45Å; N557-N559 VanDerWaalsContact C-N 3.34Å; N557-N559 PolarHBondContact OD1-N 2.89Å; N559-T985 HydrophobicContact CB-CG2 4.22Å; N559-T985 WeakPolarHBondContact OD1-CA 3.48Å; N559-T985 VanDerWaalsContact OD1-CB 3.28Å; N559-T985 WeakPolarHBondContact OD1-CB 3.24Å; N559-T986 PolarHBondContact OD1-N 3.22Å; N559-W1195 HydrophobicContact CB-CH2 4.38Å; N559-W1195 HydrophobicContact CB-CZ2 3.91Å
560	D	91.3	Very high	93.4	Very high	46 Å²	46	32.9 Å²	32.9	25%	0.246	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.5	-7.6	-174.5	68.3	1.3	0	0	0	114	M512 N516 N557 S562 W1195	M512-D560 WeakPolarHBondContact CE-OD2 3.39Å; N516-D560 PolarHBondContact ND2-OD2 2.85Å; N516-D560 PolarHBondContact OD1-OD2 3.06Å; N557-D560 WeakPolarHBondContact CB-OD1 3.21Å; N557-D560 PolarHBondContact OD1-N 2.8Å; N557-D560 PolarHBondContact OD1-OD1 3.02Å; D560-S562 PolarHBondContact O-N 2.97Å; D560-S562 WeakPolarHBondContact OD1-CB 3.46Å; D560-S562 PolarHBondContact OD1-N 3.19Å; D560-S562 PolarHBondContact OD1-OG 3.34Å; D560-W1195 HydrophobicContact CB-CH2 3.89Å; D560-W1195 HydrophobicContact CB-CZ2 4.08Å
561	R	92.7	Very high	93.6	Very high	150 Å²	150	33.9 Å²	33.9	57%	0.566	15%	0.151	S	C	*	.			trans	66.5	16.7	-179.9	-47.8	-70.5	-70.6	-173.3	-6.1	114.2	N557	N557-R561 WeakPolarHBondContact O-CA 3.36Å; N557-R561 PolarHBondContact O-N 3.29Å
562	S	94.2	Very high	93.5	Very high	1 Å²	1	33.7 Å²	33.7	1%	0.007	15%	0.152	C	C	.	.			trans	-58.4	148.4	172.1	60.9	0	0	0	0	111	R556 N557 D560 E564	R556-S562 WeakPolarHBondContact CG-O 3.5Å; N557-S562 VanDerWaalsContact CB-OG 3.22Å; N557-S562 WeakPolarHBondContact CB-OG 3.47Å; N557-S562 PolarHBondContact N-O 3.01Å; N557-S562 VanDerWaalsContact N-O 3.14Å; D560-S562 PolarHBondContact O-N 2.97Å; D560-S562 WeakPolarHBondContact OD1-CB 3.46Å; D560-S562 PolarHBondContact OD1-N 3.19Å; D560-S562 PolarHBondContact OD1-OG 3.34Å; S562-E564 PolarHBondContact O-N 3.31Å; S562-E564 PolarHBondContact OG-OE1 3.37Å
563	N	96.2	Very high	93.5	Very high	3 Å²	3	33.7 Å²	33.7	2%	0.016	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71	126.7	167.6	177.6	-111.6	0	0	0	109.1	H498 T544 E553 G565	H498-N563 PolarHBondContact CE1-OD1 3.04Å; H498-N563 PolarHBondContact NE2-OD1 3.47Å; T544-N563 HydrophobicContact CG2-CB 3.57Å; E553-N563 VanDerWaalsContact CG-ND2 3.31Å; E553-N563 WeakPolarHBondContact CG-ND2 3.36Å; E553-N563 PolarHBondContact OE2-ND2 3.38Å; N563-G565 PolarHBondContact ND2-O 3.11Å; N563-G565 PolarHBondContact OD1-O 3.47Å
564	E	96.6	Very high	93.5	Very high	0 Å²	0	33 Å²	33	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	3.7	-175.9	-71	-62.3	148.7	0	0	112.9	Q536 H538 F555 N557 S562 V576 Q577 F578	Q536-E564 PolarHBondContact NE2-OE2 2.76Å; H538-E564 IonicContact CE1-OE1 3.39Å; F555-E564 HydrophobicContact CB-CB 3.73Å; F555-E564 PolarHBondContact O-N 3.37Å; N557-E564 HydrophobicContact CB-CG 3.67Å; N557-E564 VanDerWaalsContact N-CG 3.29Å; S562-E564 PolarHBondContact O-N 3.31Å; S562-E564 PolarHBondContact OG-OE1 3.37Å; E564-V576 WeakPolarHBondContact O-CA 3.48Å; E564-Q577 PolarHBondContact O-N 2.88Å; E564-Q577 WeakPolarHBondContact OE2-CB 3.41Å; E564-F578 HydrophobicContact CB-CD1 4.02Å; E564-F578 HydrophobicContact CB-CE1 4.29Å; E564-F578 WeakPolarHBondContact O-CE1 3.44Å; E564-F578 PolarHBondContact OE2-N 3.06Å
565	G	95.8	Very high	93.6	Very high	0 Å²	0	33 Å²	33	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	171.3	155.6	174.8	0	0	0	0	0	113	L554 F555 N563 T575	L554-G565 PolarHBondContact N-O 2.94Å; F555-G565 PolarHBondContact O-N 3.38Å; N563-G565 PolarHBondContact ND2-O 3.11Å; N563-G565 PolarHBondContact OD1-O 3.47Å; G565-T575 CarbonylContact C-O 3.59Å; G565-T575 WeakPolarHBondContact CA-O 3.45Å
566	L	95.5	Very high	93.7	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	140.1	177.6	-71.4	169.8	0	0	0	109.4	A502 F507 V542 T544 W551 Y552 E553 M574 T575	A502-L566 HydrophobicContact CB-CD1 4.02Å; F507-L566 HydrophobicContact CD2-CD1 4.28Å; F507-L566 HydrophobicContact CE1-CD1 4.3Å; F507-L566 HydrophobicContact CE1-CD2 4.39Å; F507-L566 HydrophobicContact CE2-CD1 4.06Å; F507-L566 HydrophobicContact CZ-CD1 4.08Å; F507-L566 HydrophobicContact CZ-CD2 4.28Å; V542-L566 HydrophobicContact CG1-CD1 4.24Å; T544-L566 HydrophobicContact CG2-CD2 4.1Å; W551-L566 HydrophobicContact CE3-CB 3.75Å; W551-L566 HydrophobicContact CZ3-CB 3.91Å; Y552-L566 WeakPolarHBondContact O-CA 3.5Å; Y552-L566 WeakPolarHBondContact O-CD2 3.15Å; E553-L566 HydrophobicContact CG-CD2 4.42Å; L566-M574 CarbonylContact O-C 3.4Å; L566-M574 WeakPolarHBondContact O-CA 3.2Å; L566-T575 PolarHBondContact N-O 2.69Å; L566-T575 PolarHBondContact N-OG1 2.8Å; L566-T575 PolarHBondContact O-N 3.26Å; L566-T575 PolarHBondContact O-OG1 3.15Å
567	A	94.2	Very high	93.7	Very high	2 Å²	2	30.1 Å²	30.1	2%	0.017	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	149.4	171.7	0	0	0	0	0	110.4	W551 Y552 L554 M574	W551-A567 WeakPolarHBondContact CA-O 3.39Å; W551-A567 VanDerWaalsContact CE3-C 3.45Å; Y552-A567 HydrophobicContact CD1-CB 4.34Å; Y552-A567 WeakPolarHBondContact CD1-O 3.38Å; Y552-A567 HydrophobicContact CE1-CB 3.61Å; Y552-A567 PolarHBondContact N-O 2.85Å; Y552-A567 PolarHBondContact O-N 3Å; Y552-A567 VanDerWaalsContact O-N 3.07Å; L554-A567 HydrophobicContact CB-CB 4.18Å; L554-A567 HydrophobicContact CD1-CB 4.16Å; L554-A567 HydrophobicContact CD2-CB 4.29Å; L554-A567 HydrophobicContact CG-CB 4.44Å; A567-M574 HydrophobicContact CB-CB 4.39Å
568	H	93.8	Very high	93.8	Very high	20 Å²	20	30.1 Å²	30.1	9%	0.093	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	139.4	173.9	-167.7	-72.3	0	0	0	110	G550 W551 T570 H571 W573	G550-H568 WeakPolarHBondContact O-CA 3.31Å; G550-H568 PolarHBondContact O-CD2 3.46Å; W551-H568 AromaticContact CD1-CD2 3.89Å; W551-H568 HydrophobicContact CD2-CB 4.24Å; W551-H568 AromaticContact CE2-CD2 3.88Å; W551-H568 HydrophobicContact CE3-CB 4.21Å; W551-H568 HydrophobicContact CH2-CB 4.4Å; W551-H568 HydrophobicContact CZ2-CB 4.39Å; W551-H568 HydrophobicContact CZ3-CB 4.3Å; W551-H568 AromaticContact NE1-CD2 3.68Å; H568-T570 PolarHBondContact CE1-OG1 2.93Å; H568-T570 PolarHBondContact ND1-N 3.3Å; H568-T570 VanDerWaalsContact ND1-N 3.17Å; H568-T570 PolarHBondContact ND1-OG1 3.3Å; H568-T570 PolarHBondContact O-N 3.48Å; H568-H571 HydrophobicContact CB-CB 4.37Å; H568-H571 AromaticContact CE1-CD2 3.42Å; H568-H571 PolarHBondContact CE1-CD2 3.38Å; H568-H571 VanDerWaalsContact CE1-CD2 3.42Å; H568-H571 AromaticContact CE1-CG 3.99Å; H568-H571 AromaticContact ND1-CD2 3.87Å; H568-H571 PolarHBondContact ND1-N 3.44Å; H568-H571 AromaticContact NE2-CD2 3.7Å; H568-W573 HydrophobicContact CB-CB 4.37Å; H568-W573 HydrophobicContact CB-CE3 4.22Å; H568-W573 PolarHBondContact N-O 3.02Å
569	Y	88.5	Confident	93.8	Very high	132 Å²	132	26.9 Å²	26.9	52%	0.518	12%	0.124	S	C	.	.	S	Bend	trans	-65.3	-39.8	-175.2	-71.8	-71.5	0	0	0	113.6	G550 Y552 S607	G550-Y569 WeakPolarHBondContact O-CD2 3.47Å; G550-Y569 PolarHBondContact O-N 2.97Å; Y552-Y569 VanDerWaalsContact CB-OH 3.28Å; Y552-Y569 WeakPolarHBondContact CB-OH 3.48Å; Y552-Y569 AromaticContact CD1-CD1 3.77Å; Y552-Y569 HydrophobicContact CD1-CD1 3.77Å; Y552-Y569 HydrophobicContact CD1-CD2 4.18Å; Y552-Y569 AromaticContact CD1-CE1 3.46Å; Y552-Y569 HydrophobicContact CD1-CE1 3.46Å; Y552-Y569 VanDerWaalsContact CD1-CE1 3.46Å; Y552-Y569 AromaticContact CD1-CE2 3.88Å; Y552-Y569 HydrophobicContact CD1-CE2 3.88Å; Y552-Y569 HydrophobicContact CD1-CG 4.13Å; Y552-Y569 AromaticContact CD1-CZ 3.53Å; Y552-Y569 AromaticContact CE1-CD1 3.97Å; Y552-Y569 HydrophobicContact CE1-CD1 3.97Å; Y552-Y569 AromaticContact CE1-CE1 3.92Å; Y552-Y569 HydrophobicContact CE1-CE1 3.92Å; Y552-Y569 AromaticContact CG-CE1 3.93Å; Y552-Y569 HydrophobicContact CG-CE1 3.93Å; Y552-Y569 HydrophobicContact CG-CE2 4.23Å; Y552-Y569 AromaticContact CG-CZ 3.69Å; Y569-S607 WeakPolarHBondContact O-CB 3.39Å
570	T	86.9	Confident	93.9	Very high	98 Å²	98	26 Å²	26	60%	0.601	12%	0.119	S	C	*	.	S	Bend	trans	-110.9	-44	-175.5	56.1	0	0	0	0	114.6	H568	H568-T570 PolarHBondContact CE1-OG1 2.93Å; H568-T570 PolarHBondContact ND1-N 3.3Å; H568-T570 VanDerWaalsContact ND1-N 3.17Å; H568-T570 PolarHBondContact ND1-OG1 3.3Å; H568-T570 PolarHBondContact O-N 3.48Å
571	H	90.6	Very high	93.9	Very high	49 Å²	49	23.9 Å²	23.9	23%	0.227	11%	0.108	C	C	.	.	S	Bend	trans	-74.8	146.4	176.9	-64.3	-46.4	0	0	0	112.4	H568 W573	H568-H571 HydrophobicContact CB-CB 4.37Å; H568-H571 AromaticContact CE1-CD2 3.42Å; H568-H571 PolarHBondContact CE1-CD2 3.38Å; H568-H571 VanDerWaalsContact CE1-CD2 3.42Å; H568-H571 AromaticContact CE1-CG 3.99Å; H568-H571 AromaticContact ND1-CD2 3.87Å; H568-H571 PolarHBondContact ND1-N 3.44Å; H568-H571 AromaticContact NE2-CD2 3.7Å; H571-W573 HydrophobicContact CB-CD2 3.58Å; H571-W573 HydrophobicContact CB-CE3 3.55Å; H571-W573 HydrophobicContact CB-CG 4.23Å; H571-W573 HydrophobicContact CB-CH2 3.88Å; H571-W573 HydrophobicContact CB-CZ2 3.9Å; H571-W573 HydrophobicContact CB-CZ3 3.71Å; H571-W573 AromaticContact CD2-CH2 3.53Å; H571-W573 AromaticContact CD2-CZ3 3.53Å; H571-W573 AromaticContact CG-CH2 3.71Å; H571-W573 AromaticContact CG-CZ2 3.99Å; H571-W573 AromaticContact CG-CZ3 3.82Å; H571-W573 PolarHBondContact O-N 3.45Å
572	P	91.4	Very high	93.3	Very high	11 Å²	11	17 Å²	17	7%	0.071	8%	0.082	C	C	.	.	S	Bend	trans	-78.3	50.9	-175.4	33.5	-37.6	0	0	0	112.9	K488 P490 L491 Y599	K488-P572 WeakPolarHBondContact O-CG 3.49Å; P490-P572 VanDerWaalsContact CA-O 3.27Å; P490-P572 WeakPolarHBondContact CA-O 3.38Å; P490-P572 HydrophobicContact CB-CB 4.11Å; P490-P572 HydrophobicContact CB-CG 4.31Å; P490-P572 HydrophobicContact CG-CB 4.02Å; P490-P572 HydrophobicContact CG-CG 4.01Å; L491-P572 PolarHBondContact N-O 3.21Å; P572-Y599 HydrophobicContact CB-CD1 4.25Å; P572-Y599 HydrophobicContact CB-CE1 3.39Å; P572-Y599 HydrophobicContact CG-CE1 4.28Å
573	W	93.4	Very high	92.7	Very high	22 Å²	22	19.8 Å²	19.8	8%	0.083	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	123.5	-177.4	-51	-32.5	0	0	0	109.7	M485 K489 L491 W551 H568 H571	M485-W573 HydrophobicContact CB-CH2 4.21Å; M485-W573 HydrophobicContact CB-CZ2 4.03Å; M485-W573 HydrophobicContact CG-CZ2 4.3Å; M485-W573 VanDerWaalsContact O-CZ2 3.32Å; M485-W573 WeakPolarHBondContact O-CZ2 3.29Å; K489-W573 PolarHBondContact O-NE1 3.47Å; L491-W573 HydrophobicContact CB-CB 4.45Å; L491-W573 HydrophobicContact CB-CG 4.2Å; W551-W573 HydrophobicContact CH2-CB 3.77Å; W551-W573 HydrophobicContact CH2-CE3 4.38Å; W551-W573 HydrophobicContact CZ2-CB 4.37Å; W551-W573 AromaticContact CZ2-CE3 3.82Å; W551-W573 HydrophobicContact CZ2-CE3 3.82Å; W551-W573 HydrophobicContact CZ3-CB 4.49Å; H568-W573 HydrophobicContact CB-CB 4.37Å; H568-W573 HydrophobicContact CB-CE3 4.22Å; H568-W573 PolarHBondContact N-O 3.02Å; H571-W573 HydrophobicContact CB-CD2 3.58Å; H571-W573 HydrophobicContact CB-CE3 3.55Å; H571-W573 HydrophobicContact CB-CG 4.23Å; H571-W573 HydrophobicContact CB-CH2 3.88Å; H571-W573 HydrophobicContact CB-CZ2 3.9Å; H571-W573 HydrophobicContact CB-CZ3 3.71Å; H571-W573 AromaticContact CD2-CH2 3.53Å; H571-W573 AromaticContact CD2-CZ3 3.53Å; H571-W573 AromaticContact CG-CH2 3.71Å; H571-W573 AromaticContact CG-CZ2 3.99Å; H571-W573 AromaticContact CG-CZ3 3.82Å; H571-W573 PolarHBondContact O-N 3.45Å
574	M	94.3	Very high	92.1	Very high	4 Å²	4	19.7 Å²	19.7	2%	0.02	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	154.2	172.3	71.9	179.9	-174.6	0	0	110.1	L491 F492 G493 L566 A567 F596 L608	L491-M574 PolarHBondContact O-N 3.33Å; L491-M574 VanDerWaalsContact O-N 3.1Å; F492-M574 WeakPolarHBondContact CA-O 3.46Å; F492-M574 HydrophobicContact CD1-CE 4.22Å; F492-M574 HydrophobicContact CD2-CE 3.8Å; F492-M574 HydrophobicContact CD2-CG 3.81Å; F492-M574 HydrophobicContact CE1-CE 4.34Å; F492-M574 HydrophobicContact CE2-CE 3.93Å; F492-M574 HydrophobicContact CE2-CG 4.31Å; F492-M574 HydrophobicContact CG-CE 3.97Å; F492-M574 HydrophobicContact CZ-CE 4.21Å; G493-M574 PolarHBondContact N-O 2.68Å; L566-M574 CarbonylContact O-C 3.4Å; L566-M574 WeakPolarHBondContact O-CA 3.2Å; A567-M574 HydrophobicContact CB-CB 4.39Å; M574-F596 HydrophobicContact CE-CB 3.82Å; M574-F596 HydrophobicContact CE-CD2 4.02Å; M574-F596 HydrophobicContact CE-CG 4.27Å; M574-L608 HydrophobicContact CB-CD2 4.18Å; M574-L608 HydrophobicContact CE-CD2 4.32Å; M574-L608 HydrophobicContact CG-CD2 3.72Å; M574-L608 HydrophobicContact CG-CG 4.48Å; M574-L608 HydrophobicContact SD-CD1 4.3Å; M574-L608 HydrophobicContact SD-CD2 3.72Å; M574-L608 HydrophobicContact SD-CG 3.91Å
575	T	96.8	Very high	91.7	Very high	1 Å²	1	19.9 Å²	19.9	1%	0.006	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	152.2	178.4	58.3	0	0	0	0	110	L491 G493 H498 V501 G565 L566	L491-T575 HydrophobicContact CD2-CG2 4.31Å; G493-T575 CarbonylContact O-C 3.58Å; G493-T575 WeakPolarHBondContact O-CA 3.34Å; G493-T575 WeakPolarHBondContact O-CB 3.4Å; H498-T575 WeakPolarHBondContact ND1-CB 3.32Å; H498-T575 PolarHBondContact ND1-OG1 2.93Å; V501-T575 HydrophobicContact CB-CG2 3.83Å; V501-T575 HydrophobicContact CG1-CG2 3.59Å; V501-T575 HydrophobicContact CG2-CG2 4.05Å; G565-T575 CarbonylContact C-O 3.59Å; G565-T575 WeakPolarHBondContact CA-O 3.45Å; L566-T575 PolarHBondContact N-O 2.69Å; L566-T575 PolarHBondContact N-OG1 2.8Å; L566-T575 PolarHBondContact O-N 3.26Å; L566-T575 PolarHBondContact O-OG1 3.15Å
576	V	97.4	Very high	91.5	Very high	1 Å²	1	20 Å²	20	1%	0.006	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	142.9	176.4	-64.9	0	0	0	0	110.5	F492 G493 I494 C495 H498 F555 E564 F578 P580 L592	F492-V576 HydrophobicContact CE2-CG2 3.91Å; F492-V576 HydrophobicContact CZ-CG2 4.12Å; G493-V576 PolarHBondContact O-N 3.36Å; I494-V576 CarbonylContact C-O 3.18Å; I494-V576 WeakPolarHBondContact CA-O 3.47Å; I494-V576 HydrophobicContact CG1-CG2 4.07Å; C495-V576 PolarHBondContact N-O 2.87Å; H498-V576 WeakPolarHBondContact CB-O 3.44Å; F555-V576 HydrophobicContact CD2-CG1 4.2Å; F555-V576 HydrophobicContact CE2-CG1 4.39Å; E564-V576 WeakPolarHBondContact O-CA 3.48Å; V576-F578 HydrophobicContact CB-CD1 4.33Å; V576-F578 HydrophobicContact CB-CD2 4.35Å; V576-F578 HydrophobicContact CB-CE1 3.89Å; V576-F578 HydrophobicContact CB-CE2 3.89Å; V576-F578 HydrophobicContact CB-CZ 3.64Å; V576-F578 HydrophobicContact CG1-CE1 4Å; V576-F578 HydrophobicContact CG1-CE2 4.09Å; V576-F578 HydrophobicContact CG1-CZ 3.53Å; V576-F578 HydrophobicContact CG2-CD2 4.4Å; V576-F578 HydrophobicContact CG2-CE2 4.03Å; V576-F578 HydrophobicContact CG2-CZ 4.28Å; V576-P580 HydrophobicContact CG2-CG 4.08Å; V576-L592 HydrophobicContact CG1-CD1 3.95Å; V576-L592 HydrophobicContact CG2-CD1 4.42Å
577	Q	96.9	Very high	91.1	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.115	C	C	.	.	S	Bend	trans	-85.4	-39.5	-178.1	179.4	60	83.5	0	0	111.3	C495 H498 Q499 H538 Y540 E564	C495-Q577 VanDerWaalsContact CA-O 3.32Å; C495-Q577 WeakPolarHBondContact CA-O 3.18Å; C495-Q577 WeakPolarHBondContact CB-O 3.28Å; H498-Q577 PolarHBondContact CD2-OE1 3.47Å; H498-Q577 VanDerWaalsContact CD2-OE1 3.26Å; Q499-Q577 VanDerWaalsContact NE2-NE2 3.14Å; H538-Q577 PolarHBondContact CD2-NE2 2.77Å; H538-Q577 VanDerWaalsContact CE1-CG 3.48Å; H538-Q577 WeakPolarHBondContact CE1-CG 3.14Å; H538-Q577 WeakPolarHBondContact NE2-CG 3.39Å; Y540-Q577 PolarHBondContact O-OE1 3.04Å; E564-Q577 PolarHBondContact O-N 2.88Å; E564-Q577 WeakPolarHBondContact OE2-CB 3.41Å
578	F	96.1	Very high	90.9	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.119	C	C	.	.	S	Bend	trans	-67.3	169.4	168.4	60.9	-97.3	0	0	0	112.3	C523 T534 Q536 F555 E564 V576 P580 L589 L592	C523-F578 HydrophobicContact CB-CD1 4.44Å; C523-F578 HydrophobicContact CB-CE1 4.47Å; T534-F578 HydrophobicContact CG2-CB 4.3Å; T534-F578 HydrophobicContact CG2-CD1 4.2Å; T534-F578 HydrophobicContact CG2-CD2 3.97Å; T534-F578 HydrophobicContact CG2-CE2 4.4Å; T534-F578 HydrophobicContact CG2-CG 3.88Å; Q536-F578 HydrophobicContact CG-CB 3.81Å; F555-F578 HydrophobicContact CB-CE1 3.88Å; F555-F578 HydrophobicContact CD1-CE1 4.21Å; F555-F578 HydrophobicContact CD1-CZ 4.43Å; F555-F578 AromaticContact CD2-CE1 3.86Å; F555-F578 HydrophobicContact CD2-CE1 3.86Å; F555-F578 AromaticContact CD2-CZ 3.88Å; F555-F578 HydrophobicContact CD2-CZ 3.88Å; F555-F578 HydrophobicContact CE2-CE1 4.46Å; F555-F578 HydrophobicContact CE2-CZ 4.04Å; F555-F578 AromaticContact CG-CE1 3.74Å; F555-F578 HydrophobicContact CG-CE1 3.74Å; F555-F578 HydrophobicContact CG-CZ 4.12Å; F555-F578 HydrophobicContact CZ-CZ 4.38Å; E564-F578 HydrophobicContact CB-CD1 4.02Å; E564-F578 HydrophobicContact CB-CE1 4.29Å; E564-F578 WeakPolarHBondContact O-CE1 3.44Å; E564-F578 PolarHBondContact OE2-N 3.06Å; V576-F578 HydrophobicContact CB-CD1 4.33Å; V576-F578 HydrophobicContact CB-CD2 4.35Å; V576-F578 HydrophobicContact CB-CE1 3.89Å; V576-F578 HydrophobicContact CB-CE2 3.89Å; V576-F578 HydrophobicContact CB-CZ 3.64Å; V576-F578 HydrophobicContact CG1-CE1 4Å; V576-F578 HydrophobicContact CG1-CE2 4.09Å; V576-F578 HydrophobicContact CG1-CZ 3.53Å; V576-F578 HydrophobicContact CG2-CD2 4.4Å; V576-F578 HydrophobicContact CG2-CE2 4.03Å; V576-F578 HydrophobicContact CG2-CZ 4.28Å; F578-P580 HydrophobicContact CE2-CB 4.35Å; F578-P580 WeakPolarHBondContact O-CD 3.37Å; F578-L589 HydrophobicContact CD2-CD1 4.03Å; F578-L589 HydrophobicContact CE1-CD1 4.14Å; F578-L589 HydrophobicContact CE2-CB 4.06Å; F578-L589 HydrophobicContact CE2-CD1 3.24Å; F578-L589 HydrophobicContact CE2-CG 4.28Å; F578-L589 HydrophobicContact CZ-CD1 3.31Å; F578-L592 HydrophobicContact CE2-CD1 4.04Å; F578-L592 HydrophobicContact CZ-CD1 4.21Å
579	H	94.9	Very high	90.9	Very high	2 Å²	2	22.4 Å²	22.4	1%	0.009	12%	0.116	C	C	.	.	B	Isolated β-bridge	trans	-106.7	95.3	-176.5	-67.7	-98.2	0	0	0	111.3	K429 N466 C495 S535 N537 E581 H582	K429-H579 PolarHBondContact NZ-CE1 3.33Å; K429-H579 VanDerWaalsContact NZ-CE1 3.33Å; K429-H579 PolarHBondContact NZ-ND1 3.47Å; K429-H579 VanDerWaalsContact NZ-ND1 3.15Å; N466-H579 VanDerWaalsContact CB-CE1 3.45Å; N466-H579 WeakPolarHBondContact CB-CE1 3.39Å; C495-H579 VanDerWaalsContact CB-CE1 3.44Å; C495-H579 WeakPolarHBondContact CB-CE1 3.27Å; C495-H579 WeakPolarHBondContact CB-NE2 3.38Å; S535-H579 PolarHBondContact O-N 3.4Å; N537-H579 PolarHBondContact OD1-NE2 3.22Å; H579-E581 WeakPolarHBondContact CA-OE2 3.16Å; H579-E581 IonicContact CE1-OE1 3.7Å; H579-E581 IonicContact CG-OE1 2.77Å; H579-E581 IonicContact ND1-OE1 2.94Å; H579-E581 PolarHBondContact ND1-OE1 3.18Å; H579-E581 PolarHBondContact O-N 3.21Å; H579-H582 HydrophobicContact CB-CB 3.58Å; H579-H582 AromaticContact CD2-CD2 3.96Å; H579-H582 AromaticContact CG-CD2 3.66Å; H579-H582 WeakPolarHBondContact O-CB 3.43Å; H579-H582 PolarHBondContact O-N 3.14Å
580	P	94	Very high	91.2	Very high	3 Å²	3	17.9 Å²	17.9	2%	0.019	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-19.7	175.7	26.9	-35.8	0	0	0	113.6	F492 I494 V576 F578 L589 L592 F593	F492-P580 HydrophobicContact CZ-CG 4.34Å; I494-P580 HydrophobicContact CD1-CG 3.69Å; I494-P580 HydrophobicContact CG1-CG 4.43Å; V576-P580 HydrophobicContact CG2-CG 4.08Å; F578-P580 HydrophobicContact CE2-CB 4.35Å; F578-P580 WeakPolarHBondContact O-CD 3.37Å; P580-L589 HydrophobicContact CB-CB 4.12Å; P580-L589 VanDerWaalsContact CB-O 3.25Å; P580-L589 WeakPolarHBondContact CB-O 3.32Å; P580-L592 HydrophobicContact CB-CD1 4.12Å; P580-L592 HydrophobicContact CG-CD1 4.3Å; P580-F593 HydrophobicContact CB-CE2 4.26Å; P580-F593 HydrophobicContact CG-CE2 3.99Å; P580-F593 HydrophobicContact CG-CZ 4.5Å
581	E	92.5	Very high	91.5	Very high	3 Å²	3	14.9 Å²	14.9	1%	0.014	8%	0.078	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-11	176.6	78.2	-81.5	-168.3	0	0	114	N431 Q432 I494 H579 M583 F593	N431-E581 PolarHBondContact ND2-O 2.85Å; Q432-E581 HydrophobicContact CG-CB 3.99Å; Q432-E581 HydrophobicContact CG-CG 3.46Å; Q432-E581 VanDerWaalsContact CG-CG 3.46Å; Q432-E581 PolarHBondContact NE2-OE1 2.92Å; I494-E581 WeakPolarHBondContact CD1-OE2 3.44Å; H579-E581 WeakPolarHBondContact CA-OE2 3.16Å; H579-E581 IonicContact CE1-OE1 3.7Å; H579-E581 IonicContact CG-OE1 2.77Å; H579-E581 IonicContact ND1-OE1 2.94Å; H579-E581 PolarHBondContact ND1-OE1 3.18Å; H579-E581 PolarHBondContact O-N 3.21Å; E581-M583 PolarHBondContact O-N 3.22Å; E581-F593 HydrophobicContact CB-CE2 4Å; E581-F593 HydrophobicContact CB-CZ 4.03Å
582	H	78.8	Confident	91.8	Very high	5 Å²	5	12.5 Å²	12.5	2%	0.023	7%	0.067	C	C	.	.			trans	-63.7	129.9	-154.4	-150.9	-62.5	0	0	0	112.9	D284 K429 N537 H579 A584	D284-H582 IonicContact OD2-CE1 2.72Å; D284-H582 IonicContact OD2-NE2 2.84Å; D284-H582 PolarHBondContact OD2-NE2 2.97Å; D284-H582 VanDerWaalsContact OD2-NE2 3.15Å; K429-H582 PolarHBondContact NZ-CD2 2.58Å; K429-H582 PolarHBondContact NZ-NE2 2.77Å; N537-H582 PolarHBondContact ND2-NE2 3.14Å; H579-H582 HydrophobicContact CB-CB 3.58Å; H579-H582 AromaticContact CD2-CD2 3.96Å; H579-H582 AromaticContact CG-CD2 3.66Å; H579-H582 WeakPolarHBondContact O-CB 3.43Å; H579-H582 PolarHBondContact O-N 3.14Å; H582-A584 PolarHBondContact ND1-N 3.36Å; H582-A584 PolarHBondContact ND1-O 3.2Å
583	M	82.3	Confident	92	Very high	60 Å²	60	12 Å²	12	30%	0.296	6%	0.063	S	C	.	.	S	Bend	trans	-115.5	123.9	152.5	-61.2	-174.8	172.9	0	0	105.9	E280 E320 E581	E280-M583 VanDerWaalsContact CB-C 3.43Å; E280-M583 WeakPolarHBondContact CB-O 3.07Å; E280-M583 HydrophobicContact CG-CB 4.15Å; E320-M583 WeakPolarHBondContact CG-O 3.09Å; E320-M583 WeakPolarHBondContact OE1-CA 3.48Å; E320-M583 WeakPolarHBondContact OE1-CB 3.28Å; E320-M583 PolarHBondContact OE1-N 3.46Å; E581-M583 PolarHBondContact O-N 3.22Å
584	A	83.7	Confident	92.1	Very high	0 Å²	0	13.9 Å²	13.9	0%	0	8%	0.075	C	C	.	.	S	Bend	cis	-79.7	142.9	2.8	0	0	0	0	0	114.8	E280 H519 S535 H582 N900	E280-A584 HydrophobicContact CB-CB 4.37Å; H519-A584 PolarHBondContact CD2-O 3Å; H519-A584 WeakPolarHBondContact CE1-CB 3.45Å; S535-A584 PolarHBondContact OG-O 3.01Å; H582-A584 PolarHBondContact ND1-N 3.36Å; H582-A584 PolarHBondContact ND1-O 3.2Å; A584-N900 WeakPolarHBondContact CA-OD1 3.4Å; A584-N900 HydrophobicContact CB-CB 4.09Å; A584-N900 WeakPolarHBondContact CB-OD1 3.35Å
585	G	87.9	Confident	92	Very high	5 Å²	5	14.3 Å²	14.3	5%	0.052	8%	0.077	C	C	.	.	S	Bend	trans	150.9	167.7	-174	0	0	0	0	0	115.9	S535 N900 Y904	S535-G585 WeakPolarHBondContact OG-CA 3.49Å; G585-N900 PolarHBondContact N-OD1 3.01Å; G585-Y904 VanDerWaalsContact C-CD1 3.43Å; G585-Y904 VanDerWaalsContact C-CZ 3.47Å; G585-Y904 VanDerWaalsContact O-CD1 3.27Å; G585-Y904 WeakPolarHBondContact O-CD1 3.27Å; G585-Y904 VanDerWaalsContact O-CG 3.25Å
586	P	91.1	Very high	91.9	Very high	3 Å²	3	14.2 Å²	14.2	2%	0.019	8%	0.077	C	C	.	.			trans	-70.8	141.7	173.9	31.1	-35.3	0	0	0	111.3	H519 I533 S535 D588 Y904	H519-P586 WeakPolarHBondContact O-CD 3.19Å; I533-P586 HydrophobicContact CG2-CG 4.23Å; I533-P586 VanDerWaalsContact O-CG 3.25Å; I533-P586 WeakPolarHBondContact O-CG 3.47Å; S535-P586 WeakPolarHBondContact OG-CD 3.48Å; P586-D588 VanDerWaalsContact C-N 3.26Å; P586-D588 HydrophobicContact CB-CB 4.49Å; P586-D588 PolarHBondContact O-N 2.88Å; P586-Y904 HydrophobicContact CB-CD1 4.22Å; P586-Y904 HydrophobicContact CB-CE1 3.99Å; P586-Y904 HydrophobicContact CG-CE1 4.45Å
587	S	87.4	Confident	91.8	Very high	48 Å²	48	14.2 Å²	14.2	34%	0.336	8%	0.077	S	C	.	.			trans	-89.5	14	173.8	55.7	0	0	0	0	113.1	L589 E590	S587-L589 PolarHBondContact O-N 3.17Å; S587-E590 WeakPolarHBondContact O-CB 3.37Å; S587-E590 PolarHBondContact O-N 3.05Å
588	D	90.1	Very high	91.5	Very high	20 Å²	20	17.2 Å²	17.2	11%	0.107	10%	0.098	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.7	-27.7	-171	-70.5	19.9	0	0	0	113.8	F532 P586 F591 R907	F532-D588 HydrophobicContact CD1-CB 4.4Å; P586-D588 VanDerWaalsContact C-N 3.26Å; P586-D588 HydrophobicContact CB-CB 4.49Å; P586-D588 PolarHBondContact O-N 2.88Å; D588-F591 WeakPolarHBondContact O-CD1 3.48Å; D588-F591 WeakPolarHBondContact O-CE1 3.24Å; D588-R907 IonicContact OD1-CZ 2.66Å; D588-R907 IonicContact OD1-NH1 3.78Å; D588-R907 PolarHBondContact OD1-NH1 3.35Å; D588-R907 IonicContact OD1-NH2 3.91Å; D588-R907 IonicContact OD2-NH1 3.97Å; D588-R907 IonicContact OD2-NH2 3.94Å; D588-R907 PolarHBondContact OD2-NH2 2.71Å
589	L	94.5	Very high	91.3	Very high	4 Å²	4	18.6 Å²	18.6	2%	0.021	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.6	15.5	-179.6	-67.7	175.4	0	0	0	113.6	F532 T534 F555 F578 P580 S587 F591 L592	F532-L589 HydrophobicContact CB-CD1 3.98Å; F532-L589 HydrophobicContact CB-CD2 4.16Å; F532-L589 HydrophobicContact CB-CG 4.03Å; F532-L589 HydrophobicContact CD1-CD2 3.82Å; F532-L589 HydrophobicContact CD1-CG 4.32Å; F532-L589 HydrophobicContact CD2-CD2 3.93Å; F532-L589 HydrophobicContact CE1-CD2 4.15Å; F532-L589 HydrophobicContact CE2-CD2 4.25Å; F532-L589 HydrophobicContact CG-CD1 4.37Å; F532-L589 HydrophobicContact CG-CD2 3.7Å; F532-L589 HydrophobicContact CG-CG 4.11Å; F532-L589 HydrophobicContact CZ-CD2 4.35Å; T534-L589 HydrophobicContact CG2-CD1 3.58Å; F555-L589 HydrophobicContact CE1-CD1 4.2Å; F555-L589 HydrophobicContact CE1-CD2 4.38Å; F555-L589 HydrophobicContact CZ-CD1 4.36Å; F555-L589 HydrophobicContact CZ-CD2 4.21Å; F578-L589 HydrophobicContact CD2-CD1 4.03Å; F578-L589 HydrophobicContact CE1-CD1 4.14Å; F578-L589 HydrophobicContact CE2-CB 4.06Å; F578-L589 HydrophobicContact CE2-CD1 3.24Å; F578-L589 HydrophobicContact CE2-CG 4.28Å; F578-L589 HydrophobicContact CZ-CD1 3.31Å; P580-L589 HydrophobicContact CB-CB 4.12Å; P580-L589 VanDerWaalsContact CB-O 3.25Å; P580-L589 WeakPolarHBondContact CB-O 3.32Å; S587-L589 PolarHBondContact O-N 3.17Å; L589-F591 HydrophobicContact CD2-CE1 3.65Å; L589-F591 HydrophobicContact CD2-CE2 4.5Å; L589-F591 HydrophobicContact CD2-CZ 3.51Å; L589-F591 PolarHBondContact O-N 3.42Å; L589-F591 VanDerWaalsContact O-N 3.15Å; L589-L592 HydrophobicContact CB-CD1 4.22Å; L589-L592 HydrophobicContact CB-CG 4.4Å; L589-L592 WeakPolarHBondContact O-CB 3.09Å; L589-L592 VanDerWaalsContact O-CG 3.25Å; L589-L592 WeakPolarHBondContact O-CG 3.44Å; L589-L592 PolarHBondContact O-N 2.8Å; L589-L592 VanDerWaalsContact O-N 3.1Å
590	E	94.4	Very high	91.1	Very high	37 Å²	37	19.8 Å²	19.8	17%	0.173	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-24.8	175.9	-160.9	-166.9	129	0	0	111.8	R439 S587 L592 F593	R439-E590 IonicContact CZ-OE1 2.68Å; R439-E590 VanDerWaalsContact CZ-OE1 3.27Å; R439-E590 IonicContact NH1-OE1 3.69Å; R439-E590 PolarHBondContact NH1-OE1 2.8Å; R439-E590 IonicContact NH2-OE1 2.63Å; R439-E590 PolarHBondContact NH2-OE1 2.98Å; S587-E590 WeakPolarHBondContact O-CB 3.37Å; S587-E590 PolarHBondContact O-N 3.05Å; E590-L592 PolarHBondContact O-N 2.75Å; E590-F593 HydrophobicContact CG-CD2 4.22Å; E590-F593 WeakPolarHBondContact O-CD2 3.39Å; E590-F593 PolarHBondContact O-N 3.36Å
591	F	94.1	Very high	91	Very high	34 Å²	34	24.4 Å²	24.4	15%	0.149	13%	0.126	C	C	.	.	H	α-helix	trans	-62	-12.5	176.3	70.1	-103.4	0	0	0	113.8	F532 D588 L589 F593 D594 I595 L612 H615 I616	F532-F591 HydrophobicContact CE1-CE1 4.28Å; F532-F591 HydrophobicContact CZ-CZ 4.46Å; D588-F591 WeakPolarHBondContact O-CD1 3.48Å; D588-F591 WeakPolarHBondContact O-CE1 3.24Å; L589-F591 HydrophobicContact CD2-CE1 3.65Å; L589-F591 HydrophobicContact CD2-CE2 4.5Å; L589-F591 HydrophobicContact CD2-CZ 3.51Å; L589-F591 PolarHBondContact O-N 3.42Å; L589-F591 VanDerWaalsContact O-N 3.15Å; F591-F593 PolarHBondContact O-N 3.3Å; F591-D594 WeakPolarHBondContact CA-OD2 3.42Å; F591-D594 WeakPolarHBondContact O-CA 3.4Å; F591-D594 VanDerWaalsContact O-CB 3.31Å; F591-D594 WeakPolarHBondContact O-CB 3.37Å; F591-D594 PolarHBondContact O-N 3.2Å; F591-I595 HydrophobicContact CD2-CD1 3.46Å; F591-I595 VanDerWaalsContact CD2-CD1 3.46Å; F591-I595 HydrophobicContact CD2-CG1 4.34Å; F591-I595 HydrophobicContact CE2-CD1 3.69Å; F591-I595 WeakPolarHBondContact O-CG1 3.43Å; F591-I595 PolarHBondContact O-N 2.7Å; F591-L612 HydrophobicContact CE2-CD1 4.02Å; F591-H615 AromaticContact CD2-CD2 3.43Å; F591-H615 VanDerWaalsContact CD2-CD2 3.43Å; F591-H615 WeakPolarHBondContact CD2-CD2 3.22Å; F591-H615 AromaticContact CD2-NE2 3.64Å; F591-H615 AromaticContact CE2-CD2 3.63Å; F591-H615 AromaticContact CG-CD2 3.98Å; F591-H615 AromaticContact CG-NE2 3.72Å; F591-I616 HydrophobicContact CE2-CD1 4.21Å; F591-I616 HydrophobicContact CE2-CG1 3.9Å; F591-I616 HydrophobicContact CZ-CD1 4.04Å; F591-I616 HydrophobicContact CZ-CG1 3.75Å
592	L	95.7	Very high	90.6	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-58.6	-33	171.2	-67.1	-178.8	0	0	0	111.9	F492 V576 F578 P580 L589 E590 I595 F596 L612	F492-L592 HydrophobicContact CZ-CB 4.15Å; F492-L592 HydrophobicContact CZ-CD1 4.49Å; V576-L592 HydrophobicContact CG1-CD1 3.95Å; V576-L592 HydrophobicContact CG2-CD1 4.42Å; F578-L592 HydrophobicContact CE2-CD1 4.04Å; F578-L592 HydrophobicContact CZ-CD1 4.21Å; P580-L592 HydrophobicContact CB-CD1 4.12Å; P580-L592 HydrophobicContact CG-CD1 4.3Å; L589-L592 HydrophobicContact CB-CD1 4.22Å; L589-L592 HydrophobicContact CB-CG 4.4Å; L589-L592 WeakPolarHBondContact O-CB 3.09Å; L589-L592 VanDerWaalsContact O-CG 3.25Å; L589-L592 WeakPolarHBondContact O-CG 3.44Å; L589-L592 PolarHBondContact O-N 2.8Å; L589-L592 VanDerWaalsContact O-N 3.1Å; E590-L592 PolarHBondContact O-N 2.75Å; L592-I595 HydrophobicContact CD2-CD1 4.49Å; L592-F596 WeakPolarHBondContact O-CB 3.44Å; L592-F596 PolarHBondContact O-N 2.96Å; L592-F596 VanDerWaalsContact O-N 3.08Å; L592-L612 HydrophobicContact CD2-CD1 3.33Å; L592-L612 HydrophobicContact CD2-CD2 4.3Å; L592-L612 HydrophobicContact CD2-CG 4.48Å
593	F	96.6	Very high	90	Very high	0 Å²	0	33 Å²	33	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-67.1	-37.7	172.6	-67.8	-85.7	0	0	0	111.8	C435 F436 F463 F492 I494 P580 E581 E590 F591 F596 L597	C435-F593 HydrophobicContact CB-CB 4.45Å; C435-F593 HydrophobicContact CB-CD1 3.85Å; C435-F593 HydrophobicContact CB-CD2 3.79Å; C435-F593 HydrophobicContact CB-CE1 3.97Å; C435-F593 HydrophobicContact CB-CE2 3.91Å; C435-F593 HydrophobicContact CB-CG 3.77Å; C435-F593 HydrophobicContact CB-CZ 4Å; F436-F593 HydrophobicContact CD1-CD1 4.11Å; F436-F593 HydrophobicContact CD2-CD1 4.21Å; F436-F593 HydrophobicContact CD2-CE1 4.12Å; F436-F593 AromaticContact CE1-CD1 3.72Å; F436-F593 HydrophobicContact CE1-CD1 3.72Å; F436-F593 HydrophobicContact CE1-CE1 4.32Å; F436-F593 AromaticContact CE2-CD1 3.84Å; F436-F593 HydrophobicContact CE2-CD1 3.84Å; F436-F593 AromaticContact CE2-CE1 3.59Å; F436-F593 HydrophobicContact CE2-CE1 3.59Å; F436-F593 HydrophobicContact CG-CD1 4.33Å; F436-F593 AromaticContact CZ-CD1 3.57Å; F436-F593 HydrophobicContact CZ-CD1 3.57Å; F436-F593 AromaticContact CZ-CE1 3.71Å; F436-F593 HydrophobicContact CZ-CE1 3.71Å; F463-F593 HydrophobicContact CE2-CE1 4.13Å; F463-F593 HydrophobicContact CZ-CE1 4.43Å; F492-F593 HydrophobicContact CE1-CD1 4.32Å; F492-F593 HydrophobicContact CE1-CE1 4.18Å; F492-F593 HydrophobicContact CE1-CZ 4.41Å; I494-F593 HydrophobicContact CD1-CE1 4.45Å; I494-F593 HydrophobicContact CD1-CZ 3.78Å; P580-F593 HydrophobicContact CB-CE2 4.26Å; P580-F593 HydrophobicContact CG-CE2 3.99Å; P580-F593 HydrophobicContact CG-CZ 4.5Å; E581-F593 HydrophobicContact CB-CE2 4Å; E581-F593 HydrophobicContact CB-CZ 4.03Å; E590-F593 HydrophobicContact CG-CD2 4.22Å; E590-F593 WeakPolarHBondContact O-CD2 3.39Å; E590-F593 PolarHBondContact O-N 3.36Å; F591-F593 PolarHBondContact O-N 3.3Å; F593-F596 PolarHBondContact O-N 3.44Å; F593-L597 WeakPolarHBondContact O-CG 3.48Å; F593-L597 PolarHBondContact O-N 2.92Å
594	D	94	Very high	89	Confident	62 Å²	62	32 Å²	32	33%	0.332	19%	0.192	S	C	.	.	H	α-helix	trans	-63.5	-45.3	176.4	-66.7	-57	0	0	0	111.6	R439 F591 S598	R439-D594 WeakPolarHBondContact CD-OD1 3.28Å; R439-D594 IonicContact CZ-OD1 3.81Å; R439-D594 IonicContact CZ-OD2 3.99Å; R439-D594 IonicContact NE-OD1 3.96Å; R439-D594 PolarHBondContact NE-OD1 2.83Å; R439-D594 IonicContact NE-OD2 3.67Å; R439-D594 PolarHBondContact NE-OD2 3.4Å; R439-D594 IonicContact NH2-OD1 2.73Å; R439-D594 IonicContact NH2-OD2 2.88Å; R439-D594 PolarHBondContact NH2-OD2 3.25Å; F591-D594 WeakPolarHBondContact CA-OD2 3.42Å; F591-D594 WeakPolarHBondContact O-CA 3.4Å; F591-D594 VanDerWaalsContact O-CB 3.31Å; F591-D594 WeakPolarHBondContact O-CB 3.37Å; F591-D594 PolarHBondContact O-N 3.2Å; D594-S598 WeakPolarHBondContact O-CB 3.28Å; D594-S598 PolarHBondContact O-N 3.44Å; D594-S598 PolarHBondContact O-OG 2.93Å
595	I	92.9	Very high	88.3	Confident	12 Å²	12	35.7 Å²	35.7	6%	0.062	23%	0.231	C	C	.	.	H	α-helix	trans	-64	-45.7	179.1	-65.8	163.3	0	0	0	110.5	F591 L592 S598 Y599 L608 C611 L612 H615	F591-I595 HydrophobicContact CD2-CD1 3.46Å; F591-I595 VanDerWaalsContact CD2-CD1 3.46Å; F591-I595 HydrophobicContact CD2-CG1 4.34Å; F591-I595 HydrophobicContact CE2-CD1 3.69Å; F591-I595 WeakPolarHBondContact O-CG1 3.43Å; F591-I595 PolarHBondContact O-N 2.7Å; L592-I595 HydrophobicContact CD2-CD1 4.49Å; I595-S598 PolarHBondContact O-N 3.37Å; I595-Y599 WeakPolarHBondContact O-CB 3.4Å; I595-Y599 PolarHBondContact O-N 3.08Å; I595-L608 HydrophobicContact CG2-CD1 3.9Å; I595-C611 HydrophobicContact CG2-CB 4.08Å; I595-L612 HydrophobicContact CD1-CB 4.3Å; I595-L612 HydrophobicContact CD1-CD1 3.37Å; I595-L612 HydrophobicContact CD1-CG 4.44Å; I595-L612 HydrophobicContact CG2-CB 4.34Å; I595-H615 HydrophobicContact CD1-CB 3.94Å; I595-H615 HydrophobicContact CG1-CB 4.38Å
596	F	94.5	Very high	87.9	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-61.7	-47.2	-179.8	-172.7	-114.2	0	0	0	112.3	I421 F436 A461 P490 F492 M574 L592 F593 Y599 I600 L608	I421-F596 HydrophobicContact CD1-CE1 4.25Å; F436-F596 HydrophobicContact CE1-CD1 4.04Å; F436-F596 HydrophobicContact CE1-CE1 4.46Å; F436-F596 HydrophobicContact CZ-CD1 4.42Å; A461-F596 HydrophobicContact CB-CE1 4.03Å; A461-F596 HydrophobicContact CB-CZ 3.75Å; P490-F596 HydrophobicContact CB-CE2 3.73Å; P490-F596 HydrophobicContact CB-CZ 4Å; F492-F596 HydrophobicContact CB-CD1 4.25Å; F492-F596 HydrophobicContact CB-CD2 3.89Å; F492-F596 HydrophobicContact CB-CE1 4.01Å; F492-F596 HydrophobicContact CB-CE2 3.64Å; F492-F596 HydrophobicContact CB-CG 4.17Å; F492-F596 HydrophobicContact CB-CZ 3.68Å; F492-F596 HydrophobicContact CD1-CD1 4.48Å; F492-F596 HydrophobicContact CD1-CG 4.4Å; M574-F596 HydrophobicContact CE-CB 3.82Å; M574-F596 HydrophobicContact CE-CD2 4.02Å; M574-F596 HydrophobicContact CE-CG 4.27Å; L592-F596 WeakPolarHBondContact O-CB 3.44Å; L592-F596 PolarHBondContact O-N 2.96Å; L592-F596 VanDerWaalsContact O-N 3.08Å; F593-F596 PolarHBondContact O-N 3.44Å; F596-Y599 WeakPolarHBondContact O-CB 3.45Å; F596-Y599 PolarHBondContact O-N 2.89Å; F596-I600 HydrophobicContact CD1-CD1 3.93Å; F596-I600 HydrophobicContact CE1-CD1 3.75Å; F596-I600 HydrophobicContact CG-CD1 4.49Å; F596-I600 HydrophobicContact CZ-CD1 4.14Å; F596-I600 WeakPolarHBondContact O-CG1 3.27Å; F596-I600 PolarHBondContact O-N 2.79Å; F596-L608 HydrophobicContact CD2-CD2 4.08Å; F596-L608 HydrophobicContact CE2-CD2 4.47Å
597	L	94.5	Very high	87.6	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-68.7	-39.5	178.5	-70	176.1	0	0	0	112.4	V419 I421 F436 R439 A441 F593 Y599 I600 R601	V419-L597 HydrophobicContact CB-CD2 4.45Å; V419-L597 HydrophobicContact CG1-CD2 4.26Å; I421-L597 HydrophobicContact CD1-CD2 4.15Å; I421-L597 HydrophobicContact CG1-CD2 4.31Å; F436-L597 HydrophobicContact CD1-CD1 4.09Å; F436-L597 HydrophobicContact CD1-CD2 3.99Å; F436-L597 HydrophobicContact CD1-CG 4.16Å; F436-L597 HydrophobicContact CE1-CD2 4.23Å; F436-L597 HydrophobicContact CE1-CG 4.36Å; R439-L597 HydrophobicContact CB-CD1 3.35Å; R439-L597 HydrophobicContact CG-CD1 4.26Å; A441-L597 HydrophobicContact CB-CD1 4.2Å; A441-L597 HydrophobicContact CB-CD2 3.78Å; F593-L597 WeakPolarHBondContact O-CG 3.48Å; F593-L597 PolarHBondContact O-N 2.92Å; L597-Y599 VanDerWaalsContact C-N 3.3Å; L597-Y599 PolarHBondContact O-N 2.86Å; L597-I600 HydrophobicContact CD2-CD1 4.42Å; L597-I600 PolarHBondContact O-N 3.46Å; L597-R601 WeakPolarHBondContact O-CG 3.45Å; L597-R601 PolarHBondContact O-N 3.17Å
598	S	91.3	Very high	87.6	Confident	64 Å²	64	39 Å²	39	45%	0.448	24%	0.241	S	C	.	.	H	α-helix	trans	-62.6	-39.1	176.5	-60.9	0	0	0	0	111.5	D594 I595 R601 S602	D594-S598 WeakPolarHBondContact O-CB 3.28Å; D594-S598 PolarHBondContact O-N 3.44Å; D594-S598 PolarHBondContact O-OG 2.93Å; I595-S598 PolarHBondContact O-N 3.37Å; S598-R601 PolarHBondContact O-N 2.85Å; S598-S602 VanDerWaalsContact O-CB 3.3Å; S598-S602 WeakPolarHBondContact O-CB 3.31Å; S598-S602 PolarHBondContact O-N 3.45Å; S598-S602 PolarHBondContact O-OG 2.77Å
599	Y	91.7	Very high	87.3	Confident	29 Å²	29	38.6 Å²	38.6	11%	0.114	24%	0.24	C	C	.	.	H	α-helix	trans	-58.4	-49.6	174.6	-178.8	-89.5	0	0	0	111.6	P490 P572 I595 F596 L597 R601 S602 Q606 L608	P490-Y599 HydrophobicContact CG-CD1 4.09Å; P490-Y599 HydrophobicContact CG-CE1 3.96Å; P572-Y599 HydrophobicContact CB-CD1 4.25Å; P572-Y599 HydrophobicContact CB-CE1 3.39Å; P572-Y599 HydrophobicContact CG-CE1 4.28Å; I595-Y599 WeakPolarHBondContact O-CB 3.4Å; I595-Y599 PolarHBondContact O-N 3.08Å; F596-Y599 WeakPolarHBondContact O-CB 3.45Å; F596-Y599 PolarHBondContact O-N 2.89Å; L597-Y599 VanDerWaalsContact C-N 3.3Å; L597-Y599 PolarHBondContact O-N 2.86Å; Y599-R601 VanDerWaalsContact C-N 3.32Å; Y599-R601 PolarHBondContact O-N 3.08Å; Y599-S602 PolarHBondContact O-N 3.48Å; Y599-S602 PolarHBondContact O-OG 3.42Å; Y599-Q606 VanDerWaalsContact CE2-O 3.23Å; Y599-Q606 WeakPolarHBondContact CE2-O 3.44Å; Y599-L608 HydrophobicContact CD2-CB 3.9Å; Y599-L608 HydrophobicContact CD2-CD1 4.02Å; Y599-L608 HydrophobicContact CE2-CB 3.96Å; Y599-L608 HydrophobicContact CG-CB 4.28Å; Y599-L608 HydrophobicContact CG-CD1 3.82Å
600	I	91.9	Very high	86.9	Confident	27 Å²	27	42.1 Å²	42.1	14%	0.138	26%	0.259	C	S	.	.	H	α-helix	trans	-59.4	-44.1	179.5	-61.7	160.8	0	0	0	110.9	V419 I421 D460 A461 P490 F596 L597 S602	V419-I600 HydrophobicContact CG1-CB 4.16Å; V419-I600 HydrophobicContact CG1-CD1 4Å; V419-I600 HydrophobicContact CG1-CG2 3.52Å; V419-I600 HydrophobicContact CG2-CG2 4.19Å; I421-I600 HydrophobicContact CD1-CD1 3.66Å; D460-I600 HydrophobicContact CB-CG2 3.9Å; A461-I600 HydrophobicContact CB-CD1 3.52Å; A461-I600 HydrophobicContact CB-CG1 4.19Å; P490-I600 HydrophobicContact CB-CG1 4.18Å; P490-I600 HydrophobicContact CG-CG1 4.06Å; F596-I600 HydrophobicContact CD1-CD1 3.93Å; F596-I600 HydrophobicContact CE1-CD1 3.75Å; F596-I600 HydrophobicContact CG-CD1 4.49Å; F596-I600 HydrophobicContact CZ-CD1 4.14Å; F596-I600 WeakPolarHBondContact O-CG1 3.27Å; F596-I600 PolarHBondContact O-N 2.79Å; L597-I600 HydrophobicContact CD2-CD1 4.42Å; L597-I600 PolarHBondContact O-N 3.46Å; I600-S602 PolarHBondContact O-N 3.25Å
601	R	91.4	Very high	86.7	Confident	99 Å²	99	41.9 Å²	41.9	37%	0.374	26%	0.261	S	S	.	.	H	α-helix	trans	-64.9	-37.4	177.6	-69.2	169.9	176.7	135.3	4.4	113.3	D418 V419 R439 L597 S598 Y599 S603	D418-R601 IonicContact OD1-CZ 2.77Å; D418-R601 IonicContact OD1-NE 3.73Å; D418-R601 IonicContact OD1-NH2 3.59Å; D418-R601 PolarHBondContact OD1-NH2 2.92Å; D418-R601 IonicContact OD2-CZ 3.73Å; D418-R601 IonicContact OD2-NE 2.77Å; D418-R601 PolarHBondContact OD2-NE 2.58Å; D418-R601 IonicContact OD2-NH2 3.47Å; D418-R601 PolarHBondContact OD2-NH2 2.85Å; V419-R601 HydrophobicContact CG2-CG 3.69Å; R439-R601 PolarHBondContact O-NH2 3.04Å; L597-R601 WeakPolarHBondContact O-CG 3.45Å; L597-R601 PolarHBondContact O-N 3.17Å; S598-R601 PolarHBondContact O-N 2.85Å; Y599-R601 VanDerWaalsContact C-N 3.32Å; Y599-R601 PolarHBondContact O-N 3.08Å; R601-S603 VanDerWaalsContact C-N 3.29Å; R601-S603 PolarHBondContact O-N 3.34Å
602	S	83.1	Confident	86.5	Confident	73 Å²	73	40.4 Å²	40.4	51%	0.51	26%	0.255	S	S	.	.	H	α-helix	trans	-78.2	-3.8	-172.8	70.6	0	0	0	0	115.5	S598 Y599 I600 G604	S598-S602 VanDerWaalsContact O-CB 3.3Å; S598-S602 WeakPolarHBondContact O-CB 3.31Å; S598-S602 PolarHBondContact O-N 3.45Å; S598-S602 PolarHBondContact O-OG 2.77Å; Y599-S602 PolarHBondContact O-N 3.48Å; Y599-S602 PolarHBondContact O-OG 3.42Å; I600-S602 PolarHBondContact O-N 3.25Å; S602-G604 PolarHBondContact O-N 3.38Å
603	S	66.1	Low	86.2	Confident	116 Å²	116	41.7 Å²	41.7	81%	0.811	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.1	23.8	177.6	-56.5	0	0	0	0	116.1	R601	R601-S603 VanDerWaalsContact C-N 3.29Å; R601-S603 PolarHBondContact O-N 3.34Å
604	G	61.8	Low	85.9	Confident	38 Å²	38	46 Å²	46	39%	0.392	29%	0.286	S	S	.	.	S	Bend	trans	91.5	37.1	155.2	0	0	0	0	0	118.7	S602	S602-G604 PolarHBondContact O-N 3.38Å
605	G	69.8	Low	85.7	Confident	78 Å²	78	48.3 Å²	48.3	80%	0.804	29%	0.294	S	S	*	.	S	Bend	trans	-70.8	-38.7	178.2	0	0	0	0	0	115.8
606	Q	79.6	Confident	85.7	Confident	105 Å²	105	48.1 Å²	48.1	49%	0.491	29%	0.293	S	S	.	.	S	Bend	trans	-114.2	165.4	175.8	-70.6	-178.8	-10.2	0	0	109.3	Y599 D610 N614	Y599-Q606 VanDerWaalsContact CE2-O 3.23Å; Y599-Q606 WeakPolarHBondContact CE2-O 3.44Å; Q606-D610 HydrophobicContact CB-CB 4.24Å; Q606-N614 PolarHBondContact OE1-ND2 3.5Å
607	S	84.4	Confident	85.4	Confident	17 Å²	17	51.2 Å²	51.2	12%	0.119	32%	0.315	C	S	.	.			trans	-70.1	153.1	169.6	76.9	0	0	0	0	110.1	Y569 S609 D610 C611	Y569-S607 WeakPolarHBondContact O-CB 3.39Å; S607-S609 PolarHBondContact O-N 2.78Å; S607-D610 WeakPolarHBondContact CB-OD2 3.18Å; S607-D610 PolarHBondContact N-OD2 3.19Å; S607-D610 PolarHBondContact O-N 2.9Å; S607-D610 PolarHBondContact OG-N 2.97Å; S607-D610 PolarHBondContact OG-OD1 3.39Å; S607-D610 PolarHBondContact OG-OD2 2.8Å; S607-C611 PolarHBondContact O-N 3.28Å; S607-C611 PolarHBondContact O-SG 3.28Å; S607-C611 VanDerWaalsContact O-SG 3.4Å
608	L	87.2	Confident	85	Confident	3 Å²	3	53.8 Å²	53.8	2%	0.016	33%	0.325	C	S	.	.	H	α-helix	trans	-57.5	-36.6	175.8	178.1	61.4	0	0	0	111.4	M574 I595 F596 Y599 C611 L612	M574-L608 HydrophobicContact CB-CD2 4.18Å; M574-L608 HydrophobicContact CE-CD2 4.32Å; M574-L608 HydrophobicContact CG-CD2 3.72Å; M574-L608 HydrophobicContact CG-CG 4.48Å; M574-L608 HydrophobicContact SD-CD1 4.3Å; M574-L608 HydrophobicContact SD-CD2 3.72Å; M574-L608 HydrophobicContact SD-CG 3.91Å; I595-L608 HydrophobicContact CG2-CD1 3.9Å; F596-L608 HydrophobicContact CD2-CD2 4.08Å; F596-L608 HydrophobicContact CE2-CD2 4.47Å; Y599-L608 HydrophobicContact CD2-CB 3.9Å; Y599-L608 HydrophobicContact CD2-CD1 4.02Å; Y599-L608 HydrophobicContact CE2-CB 3.96Å; Y599-L608 HydrophobicContact CG-CB 4.28Å; Y599-L608 HydrophobicContact CG-CD1 3.82Å; L608-C611 PolarHBondContact O-N 3.08Å; L608-L612 PolarHBondContact O-N 2.82Å; L608-L612 VanDerWaalsContact O-N 3.09Å
609	S	84.1	Confident	84.7	Confident	13 Å²	13	59 Å²	59	9%	0.091	34%	0.34	C	S	.	.	H	α-helix	trans	-59.4	-43.8	173.5	170.2	0	0	0	0	112.7	Y552 S607 L612 T613	Y552-S609 PolarHBondContact OH-OG 3.03Å; S607-S609 PolarHBondContact O-N 2.78Å; S609-L612 PolarHBondContact O-N 3.41Å; S609-T613 WeakPolarHBondContact O-CB 3.42Å; S609-T613 PolarHBondContact O-N 3.28Å; S609-T613 PolarHBondContact O-OG1 3.3Å
610	D	86.4	Confident	84.4	Confident	77 Å²	77	59.8 Å²	59.8	41%	0.412	34%	0.344	S	S	.	.	H	α-helix	trans	-67.9	-41.5	178.2	-60.3	-37.8	0	0	0	110.9	Q606 S607 L612 T613 N614	Q606-D610 HydrophobicContact CB-CB 4.24Å; S607-D610 WeakPolarHBondContact CB-OD2 3.18Å; S607-D610 PolarHBondContact N-OD2 3.19Å; S607-D610 PolarHBondContact O-N 2.9Å; S607-D610 PolarHBondContact OG-N 2.97Å; S607-D610 PolarHBondContact OG-OD1 3.39Å; S607-D610 PolarHBondContact OG-OD2 2.8Å; D610-L612 VanDerWaalsContact C-N 3.28Å; D610-L612 PolarHBondContact O-N 2.91Å; D610-T613 PolarHBondContact O-N 3.38Å; D610-N614 VanDerWaalsContact O-CB 3.25Å; D610-N614 WeakPolarHBondContact O-CB 3.35Å; D610-N614 PolarHBondContact O-N 3Å; D610-N614 PolarHBondContact O-ND2 3.21Å; D610-N614 VanDerWaalsContact O-ND2 3.13Å
611	C	89.2	Confident	83.9	Confident	33 Å²	33	62.8 Å²	62.8	22%	0.223	36%	0.358	C	S	.	.	H	α-helix	trans	-57.2	-43.5	175.6	-63.3	0	0	0	0	111.5	I595 S607 L608 H615	I595-C611 HydrophobicContact CG2-CB 4.08Å; S607-C611 PolarHBondContact O-N 3.28Å; S607-C611 PolarHBondContact O-SG 3.28Å; S607-C611 VanDerWaalsContact O-SG 3.4Å; L608-C611 PolarHBondContact O-N 3.08Å; C611-H615 PolarHBondContact O-N 3.11Å; C611-H615 VanDerWaalsContact O-N 3.1Å
612	L	90.5	Very high	83.5	Confident	2 Å²	2	64.7 Å²	64.7	1%	0.01	37%	0.371	C	S	.	.	H	α-helix	trans	-65.3	-48.8	176.4	174.9	65.2	0	0	0	112.7	L554 F591 L592 I595 L608 S609 D610 N614 H615 I616	L554-L612 HydrophobicContact CD1-CD2 3.56Å; L554-L612 HydrophobicContact CD2-CD2 3.6Å; L554-L612 HydrophobicContact CG-CD2 4.02Å; F591-L612 HydrophobicContact CE2-CD1 4.02Å; L592-L612 HydrophobicContact CD2-CD1 3.33Å; L592-L612 HydrophobicContact CD2-CD2 4.3Å; L592-L612 HydrophobicContact CD2-CG 4.48Å; I595-L612 HydrophobicContact CD1-CB 4.3Å; I595-L612 HydrophobicContact CD1-CD1 3.37Å; I595-L612 HydrophobicContact CD1-CG 4.44Å; I595-L612 HydrophobicContact CG2-CB 4.34Å; L608-L612 PolarHBondContact O-N 2.82Å; L608-L612 VanDerWaalsContact O-N 3.09Å; S609-L612 PolarHBondContact O-N 3.41Å; D610-L612 VanDerWaalsContact C-N 3.28Å; D610-L612 PolarHBondContact O-N 2.91Å; L612-N614 VanDerWaalsContact C-N 3.29Å; L612-N614 PolarHBondContact O-N 3Å; L612-H615 PolarHBondContact O-N 3.1Å; L612-H615 VanDerWaalsContact O-N 3.13Å; L612-I616 HydrophobicContact CD1-CD1 3.56Å; L612-I616 HydrophobicContact CD1-CG1 4.14Å; L612-I616 HydrophobicContact CG-CD1 4Å; L612-I616 PolarHBondContact O-N 3.29Å
613	T	89.4	Confident	83.5	Confident	28 Å²	28	64.2 Å²	64.2	17%	0.172	36%	0.36	C	S	.	.	H	α-helix	trans	-61.2	-41.1	179.9	-59.5	0	0	0	0	111	P527 T528 S609 D610 H615 I616 S617	P527-T613 HydrophobicContact CB-CG2 4.07Å; T528-T613 HydrophobicContact CG2-CG2 4Å; S609-T613 WeakPolarHBondContact O-CB 3.42Å; S609-T613 PolarHBondContact O-N 3.28Å; S609-T613 PolarHBondContact O-OG1 3.3Å; D610-T613 PolarHBondContact O-N 3.38Å; T613-H615 VanDerWaalsContact C-N 3.33Å; T613-H615 PolarHBondContact O-N 3.38Å; T613-I616 PolarHBondContact O-N 2.85Å; T613-S617 WeakPolarHBondContact O-CB 3.44Å; T613-S617 PolarHBondContact O-N 2.97Å; T613-S617 PolarHBondContact O-OG 3.19Å
614	N	89.6	Confident	84.6	Confident	91 Å²	91	58.7 Å²	58.7	49%	0.487	32%	0.321	S	S	.	.	H	α-helix	trans	-64.4	-36	176.1	-70.6	-25.2	0	0	0	112.3	Q606 D610 L612	Q606-N614 PolarHBondContact OE1-ND2 3.5Å; D610-N614 VanDerWaalsContact O-CB 3.25Å; D610-N614 WeakPolarHBondContact O-CB 3.35Å; D610-N614 PolarHBondContact O-N 3Å; D610-N614 PolarHBondContact O-ND2 3.21Å; D610-N614 VanDerWaalsContact O-ND2 3.13Å; L612-N614 VanDerWaalsContact C-N 3.29Å; L612-N614 PolarHBondContact O-N 3Å
615	H	90.3	Very high	85.7	Confident	110 Å²	110	62.3 Å²	62.3	51%	0.509	32%	0.323	S	S	.	.	H	α-helix	trans	-71.5	-41.4	177.5	-171.1	91.2	0	0	0	112.8	F591 I595 C611 L612 T613 S617	F591-H615 AromaticContact CD2-CD2 3.43Å; F591-H615 VanDerWaalsContact CD2-CD2 3.43Å; F591-H615 WeakPolarHBondContact CD2-CD2 3.22Å; F591-H615 AromaticContact CD2-NE2 3.64Å; F591-H615 AromaticContact CE2-CD2 3.63Å; F591-H615 AromaticContact CG-CD2 3.98Å; F591-H615 AromaticContact CG-NE2 3.72Å; I595-H615 HydrophobicContact CD1-CB 3.94Å; I595-H615 HydrophobicContact CG1-CB 4.38Å; C611-H615 PolarHBondContact O-N 3.11Å; C611-H615 VanDerWaalsContact O-N 3.1Å; L612-H615 PolarHBondContact O-N 3.1Å; L612-H615 VanDerWaalsContact O-N 3.13Å; T613-H615 VanDerWaalsContact C-N 3.33Å; T613-H615 PolarHBondContact O-N 3.38Å; H615-S617 VanDerWaalsContact C-N 3.33Å
616	I	91.9	Very high	86.2	Confident	7 Å²	7	60.9 Å²	60.9	4%	0.036	30%	0.299	C	S	.	.	H	α-helix	trans	-75.5	-24.6	-179.9	-67.8	175.8	0	0	0	111.9	H525 T528 R530 F532 F555 F591 L612 T613 Y618	H525-I616 HydrophobicContact CB-CD1 4.34Å; H525-I616 HydrophobicContact CB-CG2 4.47Å; T528-I616 HydrophobicContact CG2-CB 4.39Å; T528-I616 HydrophobicContact CG2-CG2 4Å; T528-I616 WeakPolarHBondContact OG1-CG2 3.25Å; R530-I616 HydrophobicContact CB-CG2 3.87Å; R530-I616 HydrophobicContact CG-CG2 3.94Å; F532-I616 HydrophobicContact CE2-CD1 4.32Å; F532-I616 HydrophobicContact CE2-CG2 3.92Å; F532-I616 HydrophobicContact CZ-CG1 4.35Å; F532-I616 HydrophobicContact CZ-CG2 3.94Å; F555-I616 HydrophobicContact CZ-CD1 4.07Å; F591-I616 HydrophobicContact CE2-CD1 4.21Å; F591-I616 HydrophobicContact CE2-CG1 3.9Å; F591-I616 HydrophobicContact CZ-CD1 4.04Å; F591-I616 HydrophobicContact CZ-CG1 3.75Å; L612-I616 HydrophobicContact CD1-CD1 3.56Å; L612-I616 HydrophobicContact CD1-CG1 4.14Å; L612-I616 HydrophobicContact CG-CD1 4Å; L612-I616 PolarHBondContact O-N 3.29Å; T613-I616 PolarHBondContact O-N 2.85Å; I616-Y618 PolarHBondContact O-N 2.72Å
617	S	89.7	Confident	86.3	Confident	66 Å²	66	56.5 Å²	56.5	46%	0.462	28%	0.278	S	S	.	.			trans	-59.6	124.3	-178.4	-71	0	0	0	0	111.9	T613 H615	T613-S617 WeakPolarHBondContact O-CB 3.44Å; T613-S617 PolarHBondContact O-N 2.97Å; T613-S617 PolarHBondContact O-OG 3.19Å; H615-S617 VanDerWaalsContact C-N 3.33Å
618	Y	85	Confident	86.2	Confident	53 Å²	53	57.2 Å²	57.2	21%	0.208	28%	0.283	C	S	.	.			trans	-103.7	131.2	179.8	171.7	-116.2	0	0	0	111.6	R530 I616 Q620 E624 R864 D868	R530-Y618 VanDerWaalsContact NH1-CB 3.34Å; I616-Y618 PolarHBondContact O-N 2.72Å; Y618-Q620 HydrophobicContact CD1-CG 3.79Å; Y618-Q620 HydrophobicContact CE1-CB 4.18Å; Y618-Q620 HydrophobicContact CE1-CG 3.57Å; Y618-E624 VanDerWaalsContact OH-CD 3.25Å; Y618-E624 PolarHBondContact OH-OE1 3.29Å; Y618-E624 VanDerWaalsContact OH-OE1 3.14Å; Y618-E624 PolarHBondContact OH-OE2 2.73Å; Y618-R864 PolarHBondContact OH-NH2 3.2Å; Y618-R864 VanDerWaalsContact OH-NH2 3.13Å; Y618-D868 HydrophobicContact CD1-CB 3.64Å; Y618-D868 HydrophobicContact CD2-CB 3.96Å; Y618-D868 HydrophobicContact CE1-CB 3.74Å; Y618-D868 HydrophobicContact CE2-CB 4.08Å; Y618-D868 HydrophobicContact CG-CB 3.76Å
619	K	86	Confident	85.7	Confident	175 Å²	175	59.2 Å²	59.2	76%	0.761	30%	0.298	S	S	*	.			trans	-91.4	104.5	171.7	-171.8	-178.2	179.9	-174.1	0	109.2
620	Q	84.6	Confident	85	Confident	44 Å²	44	68.1 Å²	68.1	21%	0.206	34%	0.335	C	S	.	.			trans	-59.5	152.1	174.6	-72	-179.9	-37.4	0	0	112	Y618 E624 R625 A866	Y618-Q620 HydrophobicContact CD1-CG 3.79Å; Y618-Q620 HydrophobicContact CE1-CB 4.18Å; Y618-Q620 HydrophobicContact CE1-CG 3.57Å; Q620-E624 WeakPolarHBondContact CA-OE2 3.45Å; Q620-E624 HydrophobicContact CB-CB 4.3Å; Q620-R625 HydrophobicContact CB-CG 3.87Å; Q620-R625 PolarHBondContact O-NH1 3.16Å; Q620-A866 PolarHBondContact NE2-O 2.93Å
621	E	82.7	Confident	84	Confident	91 Å²	91	72.5 Å²	72.5	43%	0.425	36%	0.358	S	S	.	.			trans	-81.1	168.2	170.4	-74.4	-60.7	157.3	0	0	112.1	F623 E624 R625	E621-F623 HydrophobicContact CB-CD1 3.74Å; E621-F623 HydrophobicContact CB-CE1 3.79Å; E621-F623 HydrophobicContact CG-CE1 4.36Å; E621-F623 PolarHBondContact O-N 2.56Å; E621-E624 PolarHBondContact N-OE2 3.34Å; E621-E624 PolarHBondContact O-N 3.04Å; E621-R625 WeakPolarHBondContact O-CG 3.28Å; E621-R625 PolarHBondContact O-N 3.13Å
622	E	82.3	Confident	83.1	Confident	139 Å²	139	73.9 Å²	73.9	65%	0.65	36%	0.363	S	S	*	.	H	α-helix	trans	-59.6	-45.7	178.7	-172.1	177.4	177.5	0	0	112.1	E624 R625 V626	E622-E624 PolarHBondContact O-N 3.22Å; E622-R625 VanDerWaalsContact CA-NH2 3.35Å; E622-R625 PolarHBondContact O-N 3.43Å; E622-V626 HydrophobicContact CG-CG2 4.45Å; E622-V626 WeakPolarHBondContact O-CB 3.36Å; E622-V626 VanDerWaalsContact O-CG2 3.22Å; E622-V626 WeakPolarHBondContact O-CG2 3.42Å; E622-V626 PolarHBondContact O-N 3.05Å
623	F	83.5	Confident	82.6	Confident	62 Å²	62	78.9 Å²	78.9	27%	0.272	39%	0.385	S	S	.	.	H	α-helix	trans	-64.7	-38.4	179.9	84.7	-85.5	0	0	0	112.3	E621 V626 L627 R918 V920	E621-F623 HydrophobicContact CB-CD1 3.74Å; E621-F623 HydrophobicContact CB-CE1 3.79Å; E621-F623 HydrophobicContact CG-CE1 4.36Å; E621-F623 PolarHBondContact O-N 2.56Å; F623-V626 PolarHBondContact O-N 3.07Å; F623-L627 HydrophobicContact CD2-CD1 4.06Å; F623-L627 HydrophobicContact CE2-CD1 4.4Å; F623-L627 VanDerWaalsContact O-CG 3.3Å; F623-L627 WeakPolarHBondContact O-CG 3.38Å; F623-L627 PolarHBondContact O-N 3.19Å; F623-R918 HydrophobicContact CE1-CB 4.37Å; F623-R918 HydrophobicContact CZ-CB 4.16Å; F623-V920 HydrophobicContact CE2-CG2 4.04Å; F623-V920 HydrophobicContact CZ-CG2 4.36Å
624	E	87.8	Confident	82.5	Confident	0 Å²	0	77.8 Å²	77.8	0%	0	38%	0.378	C	S	.	.	H	α-helix	trans	-64.3	-45.7	174.8	-69.1	175.9	149.7	0	0	111	Y618 Q620 E621 E622 V626 L627 C628 R864 A866 V920	Y618-E624 VanDerWaalsContact OH-CD 3.25Å; Y618-E624 PolarHBondContact OH-OE1 3.29Å; Y618-E624 VanDerWaalsContact OH-OE1 3.14Å; Y618-E624 PolarHBondContact OH-OE2 2.73Å; Q620-E624 WeakPolarHBondContact CA-OE2 3.45Å; Q620-E624 HydrophobicContact CB-CB 4.3Å; E621-E624 PolarHBondContact N-OE2 3.34Å; E621-E624 PolarHBondContact O-N 3.04Å; E622-E624 PolarHBondContact O-N 3.22Å; E624-V626 VanDerWaalsContact C-N 3.3Å; E624-V626 PolarHBondContact O-N 3.47Å; E624-L627 WeakPolarHBondContact O-CB 3.43Å; E624-L627 PolarHBondContact O-N 3.37Å; E624-C628 PolarHBondContact O-N 3.38Å; E624-C628 PolarHBondContact O-SG 2.99Å; E624-R864 IonicContact OE1-CZ 3.82Å; E624-R864 IonicContact OE1-NH1 3.34Å; E624-R864 PolarHBondContact OE1-NH1 3.45Å; E624-R864 IonicContact OE1-NH2 2.77Å; E624-R864 PolarHBondContact OE1-NH2 3.35Å; E624-A866 HydrophobicContact CB-CB 4.13Å; E624-A866 HydrophobicContact CG-CB 4.19Å; E624-V920 HydrophobicContact CG-CG2 4.38Å
625	R	85.4	Confident	82.4	Confident	114 Å²	114	82.8 Å²	82.8	43%	0.43	39%	0.39	S	S	.	.	H	α-helix	trans	-60.9	-39.4	175.7	-75.4	-169.2	-64.9	-86.4	-5.6	112.6	Q620 E621 E622 L627 C628 S629	Q620-R625 HydrophobicContact CB-CG 3.87Å; Q620-R625 PolarHBondContact O-NH1 3.16Å; E621-R625 WeakPolarHBondContact O-CG 3.28Å; E621-R625 PolarHBondContact O-N 3.13Å; E622-R625 VanDerWaalsContact CA-NH2 3.35Å; E622-R625 PolarHBondContact O-N 3.43Å; R625-L627 VanDerWaalsContact C-N 3.34Å; R625-C628 PolarHBondContact O-N 3.47Å; R625-S629 PolarHBondContact O-N 3.07Å; R625-S629 VanDerWaalsContact O-N 3.13Å
626	V	81.4	Confident	82.5	Confident	49 Å²	49	78.1 Å²	78.1	30%	0.297	37%	0.368	S	S	.	.	H	α-helix	trans	-64.8	-39.3	177.2	166.6	0	0	0	0	111	E622 F623 E624 S629 N632	E622-V626 HydrophobicContact CG-CG2 4.45Å; E622-V626 WeakPolarHBondContact O-CB 3.36Å; E622-V626 VanDerWaalsContact O-CG2 3.22Å; E622-V626 WeakPolarHBondContact O-CG2 3.42Å; E622-V626 PolarHBondContact O-N 3.05Å; F623-V626 PolarHBondContact O-N 3.07Å; E624-V626 VanDerWaalsContact C-N 3.3Å; E624-V626 PolarHBondContact O-N 3.47Å; V626-S629 PolarHBondContact O-OG 3.4Å; V626-N632 WeakPolarHBondContact CG1-ND2 3.36Å
627	L	81.3	Confident	82.7	Confident	12 Å²	12	77.8 Å²	77.8	6%	0.063	37%	0.367	C	S	.	.	H	α-helix	trans	-64.9	-38.3	174.3	-71.6	168.1	0	0	0	112.1	F623 E624 R625 L760	F623-L627 HydrophobicContact CD2-CD1 4.06Å; F623-L627 HydrophobicContact CE2-CD1 4.4Å; F623-L627 VanDerWaalsContact O-CG 3.3Å; F623-L627 WeakPolarHBondContact O-CG 3.38Å; F623-L627 PolarHBondContact O-N 3.19Å; E624-L627 WeakPolarHBondContact O-CB 3.43Å; E624-L627 PolarHBondContact O-N 3.37Å; R625-L627 VanDerWaalsContact C-N 3.34Å; L627-L760 HydrophobicContact CD2-CD2 3.72Å
628	C	81.7	Confident	83	Confident	32 Å²	32	74.6 Å²	74.6	22%	0.216	35%	0.345	C	S	.	.	H	α-helix	trans	-86.6	-5	-175.5	-60.6	0	0	0	0	115	E624 R625 Y867	E624-C628 PolarHBondContact O-N 3.38Å; E624-C628 PolarHBondContact O-SG 2.99Å; R625-C628 PolarHBondContact O-N 3.47Å; C628-Y867 HydrophobicContact CB-CE1 4.49Å; C628-Y867 WeakPolarHBondContact CB-OH 3.48Å; C628-Y867 PolarHBondContact SG-OH 2.99Å; C628-Y867 VanDerWaalsContact SG-OH 3.34Å
629	S	77.8	Confident	83.6	Confident	46 Å²	46	72.1 Å²	72.1	32%	0.322	34%	0.335	S	S	.	.			trans	-78.6	133	-174.6	68.5	0	0	0	0	112.4	R625 V626 D631 N632	R625-S629 PolarHBondContact O-N 3.07Å; R625-S629 VanDerWaalsContact O-N 3.13Å; V626-S629 PolarHBondContact O-OG 3.4Å; S629-D631 VanDerWaalsContact C-N 3.3Å; S629-D631 PolarHBondContact O-N 3.48Å; S629-N632 PolarHBondContact O-N 2.95Å; S629-N632 VanDerWaalsContact O-N 3.1Å; S629-N632 WeakPolarHBondContact OG-CB 3.38Å
630	K	68.6	Low	84	Confident	200 Å²	200	63.8 Å²	63.8	87%	0.87	30%	0.299	S	S	*	.	G	3₁₀ helix	trans	-60.2	-38.6	-175.9	-72.6	-174.2	177.7	180	0	113	N632	K630-N632 PolarHBondContact O-N 2.86Å
631	D	66.3	Low	84.3	Confident	168 Å²	168	61.7 Å²	61.7	90%	0.898	29%	0.289	S	S	*	.	G	3₁₀ helix	trans	-72.7	-9	-178.2	-57.7	-37.3	0	0	0	112.8	S629	S629-D631 VanDerWaalsContact C-N 3.3Å; S629-D631 PolarHBondContact O-N 3.48Å
632	N	69	Low	84.5	Confident	63 Å²	63	57.6 Å²	57.6	34%	0.337	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	-120.9	17.6	-170	-146.8	-0	0	0	0	113.6	V626 S629 K630 R758	V626-N632 WeakPolarHBondContact CG1-ND2 3.36Å; S629-N632 PolarHBondContact O-N 2.95Å; S629-N632 VanDerWaalsContact O-N 3.1Å; S629-N632 WeakPolarHBondContact OG-CB 3.38Å; K630-N632 PolarHBondContact O-N 2.86Å; N632-R758 PolarHBondContact ND2-NH1 3.49Å; N632-R758 PolarHBondContact O-NH2 2.9Å; N632-R758 PolarHBondContact OD1-NH1 3.24Å
633	K	80.4	Confident	84.7	Confident	106 Å²	106	51 Å²	51	46%	0.461	24%	0.239	S	C	.	.			trans	-61.2	123	174.4	-174.3	178.9	174.9	-176.3	0	109.5	R635 E667	K633-R635 PolarHBondContact O-N 3.32Å; K633-E667 PolarHBondContact NZ-O 2.95Å; K633-E667 IonicContact NZ-OE2 2.86Å
634	P	87.7	Confident	84.8	Confident	5 Å²	5	48.1 Å²	48.1	3%	0.032	23%	0.227	C	C	.	.			trans	-65.3	132	-179.2	28.4	-34.5	0	0	0	109.8	V637 D711 L760 L969	P634-V637 HydrophobicContact CB-CG2 3.81Å; P634-V637 HydrophobicContact CG-CG2 4.04Å; P634-D711 HydrophobicContact CB-CB 3.99Å; P634-L760 HydrophobicContact CG-CD1 4.12Å; P634-L969 HydrophobicContact CG-CD2 3.62Å
635	R	87.1	Confident	84.7	Confident	196 Å²	196	48.5 Å²	48.5	74%	0.74	23%	0.229	S	C	*	.	S	Bend	trans	-91.6	-30.6	177.3	-63.1	-175.7	-179.5	-163.1	0.4	111.1	K633 Q670 D711	K633-R635 PolarHBondContact O-N 3.32Å; R635-Q670 PolarHBondContact O-N 2.95Å; R635-D711 WeakPolarHBondContact CA-OD2 3.41Å; R635-D711 PolarHBondContact N-OD2 2.66Å
636	K	91.9	Very high	84.5	Confident	12 Å²	12	43.6 Å²	43.6	5%	0.052	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	127.7	177.3	-167.8	-175	-51	-174.6	0	111.4	Q670 L672 E708 P710 D711 G712 D2210	K636-Q670 CarbonylContact C-O 3.43Å; K636-Q670 VanDerWaalsContact CA-O 3.28Å; K636-Q670 WeakPolarHBondContact CA-O 2.97Å; K636-Q670 HydrophobicContact CB-CB 4.35Å; K636-Q670 HydrophobicContact CG-CB 4.16Å; K636-Q670 HydrophobicContact CG-CG 4.32Å; K636-L672 HydrophobicContact CD-CD1 3.77Å; K636-L672 HydrophobicContact CD-CD2 4.32Å; K636-L672 HydrophobicContact CD-CG 4.1Å; K636-L672 HydrophobicContact CG-CD1 4.15Å; K636-L672 HydrophobicContact CG-CG 4.13Å; K636-E708 PolarHBondContact NZ-O 2.98Å; K636-P710 HydrophobicContact CG-CB 4.42Å; K636-D711 PolarHBondContact N-OD2 2.91Å; K636-D711 PolarHBondContact O-N 3.13Å; K636-G712 PolarHBondContact O-N 3.34Å; K636-D2210 IonicContact NZ-OD2 3.19Å; K636-D2210 PolarHBondContact NZ-OD2 3.09Å
637	V	96.5	Very high	84.3	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	134.1	-178.9	173.5	0	0	0	0	110.6	P634 L664 V669 Q670 L672 G712 L714 L760	P634-V637 HydrophobicContact CB-CG2 3.81Å; P634-V637 HydrophobicContact CG-CG2 4.04Å; V637-L664 HydrophobicContact CB-CD1 4.25Å; V637-L664 HydrophobicContact CG1-CD1 3.98Å; V637-V669 HydrophobicContact CB-CG1 3.88Å; V637-V669 HydrophobicContact CG2-CG1 3.57Å; V637-Q670 PolarHBondContact N-O 3.07Å; V637-L672 PolarHBondContact O-N 3.25Å; V637-G712 CarbonylContact C-O 3.54Å; V637-G712 WeakPolarHBondContact CA-O 3.19Å; V637-L714 HydrophobicContact CG1-CD1 3.84Å; V637-L714 HydrophobicContact CG1-CG 3.92Å; V637-L760 HydrophobicContact CG1-CD1 4.09Å; V637-L760 HydrophobicContact CG2-CD1 3.68Å
638	L	97.2	Very high	83.6	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	127.6	171.7	175.6	60	0	0	0	110.2	L640 L672 I674 V701 V704 I705 P710 G712 L713 L714	L638-L640 HydrophobicContact CD2-CD2 4.43Å; L638-L640 HydrophobicContact CG-CD2 4.31Å; L638-L672 CarbonylContact C-O 3.58Å; L638-L672 WeakPolarHBondContact CA-O 3.35Å; L638-L672 HydrophobicContact CB-CB 4.37Å; L638-L672 HydrophobicContact CD1-CB 3.7Å; L638-I674 HydrophobicContact CD1-CD1 3.9Å; L638-I674 HydrophobicContact CD1-CG1 3.92Å; L638-I674 HydrophobicContact CD2-CD1 4.06Å; L638-V701 HydrophobicContact CD2-CG1 4.16Å; L638-V704 HydrophobicContact CD1-CG1 4.31Å; L638-V704 HydrophobicContact CD2-CG1 4.26Å; L638-I705 HydrophobicContact CD2-CD1 4.41Å; L638-I705 HydrophobicContact CD2-CG1 3.79Å; L638-P710 HydrophobicContact CB-CB 3.97Å; L638-P710 HydrophobicContact CB-CG 3.92Å; L638-P710 HydrophobicContact CD2-CG 4.36Å; L638-G712 PolarHBondContact N-O 2.86Å; L638-L713 HydrophobicContact CB-CD1 4.05Å; L638-L713 HydrophobicContact CD2-CD1 3.94Å; L638-L713 HydrophobicContact CG-CD1 3.77Å; L638-L713 CarbonylContact O-C 3.58Å; L638-L713 VanDerWaalsContact O-CA 3.32Å; L638-L713 WeakPolarHBondContact O-CA 3.37Å; L638-L713 WeakPolarHBondContact O-CD1 3.49Å; L638-L714 PolarHBondContact O-N 3.34Å
639	L	96.7	Very high	83	Confident	0 Å²	0	40 Å²	40	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	133.7	172.8	-175	72.5	0	0	0	109.4	G657 A660 L661 L672 L673 I674 L714 F717	L639-G657 WeakPolarHBondContact CD2-O 3.37Å; L639-A660 HydrophobicContact CD1-CB 4.39Å; L639-A660 HydrophobicContact CD2-CB 4.43Å; L639-L661 HydrophobicContact CB-CD2 4.4Å; L639-L661 HydrophobicContact CD2-CD1 4.2Å; L639-L661 HydrophobicContact CD2-CD2 3.87Å; L639-L661 HydrophobicContact CD2-CG 3.69Å; L639-L672 PolarHBondContact N-O 3.33Å; L639-L673 HydrophobicContact CB-CD1 4.29Å; L639-L673 HydrophobicContact CD2-CD1 4.09Å; L639-L673 HydrophobicContact CG-CD1 4.27Å; L639-L673 WeakPolarHBondContact O-CA 3.36Å; L639-I674 PolarHBondContact O-N 3.18Å; L639-L714 HydrophobicContact CD1-CB 3.58Å; L639-L714 HydrophobicContact CD1-CD1 4.17Å; L639-F717 HydrophobicContact CD1-CB 4.01Å; L639-F717 HydrophobicContact CD1-CD2 4.19Å; L639-F717 HydrophobicContact CD1-CG 4.32Å
640	L	94.5	Very high	82.2	Confident	1 Å²	1	38 Å²	38	1%	0.005	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	128.9	169.5	-54.5	-175.3	0	0	0	109.5	L638 I674 I696 V701 L713 L714 I715 G718 S722 C725	L638-L640 HydrophobicContact CD2-CD2 4.43Å; L638-L640 HydrophobicContact CG-CD2 4.31Å; L640-I674 HydrophobicContact CD2-CB 4.12Å; L640-I674 HydrophobicContact CD2-CD1 3.94Å; L640-I674 HydrophobicContact CD2-CG1 4.5Å; L640-I696 HydrophobicContact CB-CG2 4.33Å; L640-I696 HydrophobicContact CD1-CG2 4.29Å; L640-V701 HydrophobicContact CD1-CG1 4.47Å; L640-V701 HydrophobicContact CD1-CG2 4.26Å; L640-V701 HydrophobicContact CD2-CG1 4.01Å; L640-V701 HydrophobicContact CD2-CG2 3.71Å; L640-L713 HydrophobicContact CD1-CD1 4.19Å; L640-L713 HydrophobicContact CD2-CD1 4.12Å; L640-L713 HydrophobicContact CG-CD1 3.82Å; L640-L714 PolarHBondContact N-O 3.44Å; L640-I715 HydrophobicContact CD1-CG2 4.14Å; L640-G718 WeakPolarHBondContact O-CA 3.37Å; L640-S722 WeakPolarHBondContact CB-OG 3.27Å; L640-C725 HydrophobicContact CD1-CB 4.37Å
641	G	91.3	Very high	82.6	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	14%	0.137	C	C	.	.			trans	-79	-166.9	175	0	0	0	0	0	113.3	I674 I696 G718	G641-I674 PolarHBondContact N-O 2.8Å; G641-I696 WeakPolarHBondContact O-CD1 3.48Å; G641-G718 WeakPolarHBondContact O-CA 3.42Å
642	S	86.4	Confident	83.3	Confident	4 Å²	4	20.7 Å²	20.7	3%	0.028	10%	0.095	C	C	.	.			trans	-92.7	-17.2	177.9	42.4	0	0	0	0	114.5	D654 G718 T721	S642-D654 PolarHBondContact OG-OD1 3.46Å; S642-G718 WeakPolarHBondContact CA-O 3.26Å; S642-T721 WeakPolarHBondContact O-CB 3.4Å; S642-T721 PolarHBondContact O-OG1 3.13Å
643	G	87.2	Confident	84.3	Confident	0 Å²	0	18 Å²	18	0%	0	8%	0.08	C	C	.	.			trans	76.2	-168.2	-164.4	0	0	0	0	0	111.1	N675 N677	G643-N675 VanDerWaalsContact CA-OD1 3.31Å; G643-N675 WeakPolarHBondContact CA-OD1 3.41Å; G643-N675 PolarHBondContact N-OD1 2.92Å; G643-N677 WeakPolarHBondContact O-CB 3.33Å
644	G	85.2	Confident	84.5	Confident	2 Å²	2	13 Å²	13	2%	0.021	6%	0.058	C	C	.	.	S	Bend	trans	-63.1	152.9	-178.8	0	0	0	0	0	113.5	E1636 N1658	G644-E1636 WeakPolarHBondContact CA-O 3.49Å; G644-N1658 VanDerWaalsContact C-ND2 3.32Å; G644-N1658 VanDerWaalsContact CA-ND2 3.28Å; G644-N1658 WeakPolarHBondContact CA-ND2 3.43Å; G644-N1658 PolarHBondContact N-ND2 3.13Å; G644-N1658 PolarHBondContact O-ND2 2.97Å
645	L	84.8	Confident	84.6	Confident	8 Å²	8	12.9 Å²	12.9	4%	0.042	6%	0.057	C	C	.	.			trans	-64.6	142.5	-178.3	-64.5	142.8	0	0	0	112.1	A650 G651 S1271 V1272 V1614 T1634 G1635	L645-A650 HydrophobicContact CD2-CB 4.36Å; L645-G651 VanDerWaalsContact CD2-N 3.28Å; L645-S1271 WeakPolarHBondContact CD1-OG 3.39Å; L645-V1272 HydrophobicContact CD1-CB 4.28Å; L645-V1272 HydrophobicContact CD1-CG1 3.87Å; L645-V1272 HydrophobicContact CD1-CG2 3.56Å; L645-V1272 HydrophobicContact CD2-CG1 4.11Å; L645-V1614 WeakPolarHBondContact O-CG1 3.44Å; L645-T1634 PolarHBondContact O-OG1 3.41Å; L645-G1635 PolarHBondContact O-N 2.85Å
646	S	81.8	Confident	84.8	Confident	12 Å²	12	3.6 Å²	3.6	8%	0.084	2%	0.023	C	C	.	.	B	Isolated β-bridge	trans	-145.8	162.2	172.4	70.4	0	0	0	0	111.1	G648 Q649	S646-G648 PolarHBondContact O-N 3.05Å; S646-Q649 PolarHBondContact N-O 2.96Å; S646-Q649 CarbonylContact O-C 3.58Å; S646-Q649 PolarHBondContact O-N 3.2Å
647	I	77.3	Confident	84.8	Confident	3 Å²	3	3.1 Å²	3.1	2%	0.015	2%	0.021	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	126.6	173.4	-69.3	170.8	0	0	0	108.6	V1022 S1616 R1619 L1620 T1634	I647-V1022 HydrophobicContact CD1-CG1 4.07Å; I647-V1022 HydrophobicContact CG1-CG1 3.99Å; I647-S1616 PolarHBondContact N-OG 3.4Å; I647-R1619 WeakPolarHBondContact O-CD 3.27Å; I647-R1619 PolarHBondContact O-NE 3.43Å; I647-L1620 HydrophobicContact CD1-CD1 4.26Å; I647-L1620 HydrophobicContact CD1-CD2 4.06Å; I647-L1620 HydrophobicContact CD1-CG 4.23Å; I647-T1634 HydrophobicContact CD1-CG2 4.16Å; I647-T1634 HydrophobicContact CG1-CG2 3.89Å
648	G	66.8	Low	84.6	Confident	8 Å²	8	3.1 Å²	3.1	8%	0.082	2%	0.021	C	C	.	.	T	Hydrogen-bonded Turn	trans	85.7	-2	-174.2	0	0	0	0	0	115.7	S646	S646-G648 PolarHBondContact O-N 3.05Å
649	Q	68.6	Low	84.3	Confident	6 Å²	6	3.1 Å²	3.1	3%	0.028	2%	0.021	C	C	.	.	B	Isolated β-bridge	trans	-141	91.1	167.7	-85.3	176.7	-2.3	0	0	108.3	S646 F653 T721 L818	S646-Q649 PolarHBondContact N-O 2.96Å; S646-Q649 CarbonylContact O-C 3.58Å; S646-Q649 PolarHBondContact O-N 3.2Å; Q649-F653 HydrophobicContact CB-CE2 4.48Å; Q649-F653 HydrophobicContact CG-CD2 4.47Å; Q649-F653 HydrophobicContact CG-CE2 4.1Å; Q649-T721 PolarHBondContact NE2-OG1 2.88Å; Q649-T721 PolarHBondContact OE1-OG1 3.09Å; Q649-L818 HydrophobicContact CG-CD1 3.83Å; Q649-L818 HydrophobicContact CG-CD2 3.63Å; Q649-L818 HydrophobicContact CG-CG 4.32Å
650	A	62	Low	84.2	Confident	5 Å²	5	3.1 Å²	3.1	4%	0.041	2%	0.021	C	C	.	.			trans	-104	-155.7	-176.4	0	0	0	0	0	111.8	L645 E652 E1300	L645-A650 HydrophobicContact CD2-CB 4.36Å; A650-E652 WeakPolarHBondContact CA-OE2 3.44Å; A650-E652 WeakPolarHBondContact CB-OE2 3.45Å; A650-E652 PolarHBondContact N-OE1 3.49Å; A650-E652 VanDerWaalsContact N-OE1 3.11Å; A650-E652 PolarHBondContact N-OE2 2.86Å; A650-E652 PolarHBondContact O-N 2.87Å; A650-E1300 WeakPolarHBondContact CB-OE1 3.18Å
651	G	76.5	Confident	84.2	Confident	1 Å²	1	3.1 Å²	3.1	1%	0.01	2%	0.021	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-8	-174.2	0	0	0	0	0	114.3	L645 F653 D654 Y655 E1300	L645-G651 VanDerWaalsContact CD2-N 3.28Å; G651-F653 VanDerWaalsContact C-N 3.27Å; G651-F653 PolarHBondContact O-N 3.3Å; G651-D654 WeakPolarHBondContact O-CB 3.36Å; G651-D654 PolarHBondContact O-N 2.87Å; G651-Y655 PolarHBondContact O-N 3.05Å; G651-E1300 CarbonylContact C-O 3.58Å
652	E	81.6	Confident	84.2	Confident	3 Å²	3	4.1 Å²	4.1	1%	0.014	3%	0.025	C	C	.	.	H	α-helix	trans	-58.2	-36.4	-178	68.1	-84.1	-167.4	0	0	113.3	A650 S656 R947 A950	A650-E652 WeakPolarHBondContact CA-OE2 3.44Å; A650-E652 WeakPolarHBondContact CB-OE2 3.45Å; A650-E652 PolarHBondContact N-OE1 3.49Å; A650-E652 VanDerWaalsContact N-OE1 3.11Å; A650-E652 PolarHBondContact N-OE2 2.86Å; A650-E652 PolarHBondContact O-N 2.87Å; E652-S656 VanDerWaalsContact O-CB 3.32Å; E652-S656 WeakPolarHBondContact O-CB 3.35Å; E652-S656 PolarHBondContact O-N 3.35Å; E652-S656 PolarHBondContact O-OG 2.81Å; E652-R947 HydrophobicContact CG-CB 4.1Å; E652-R947 HydrophobicContact CG-CG 4.38Å; E652-R947 IonicContact OE1-NE 3.94Å; E652-R947 IonicContact OE2-NE 3.25Å; E652-A950 HydrophobicContact CB-CB 4.03Å
653	F	88	Confident	84.4	Confident	5 Å²	5	3.9 Å²	3.9	2%	0.022	2%	0.024	C	C	.	.	H	α-helix	trans	-81.1	-30.9	-178.4	-61.3	-56	0	0	0	112	Q649 G651 S656 G657 L945	Q649-F653 HydrophobicContact CB-CE2 4.48Å; Q649-F653 HydrophobicContact CG-CD2 4.47Å; Q649-F653 HydrophobicContact CG-CE2 4.1Å; G651-F653 VanDerWaalsContact C-N 3.27Å; G651-F653 PolarHBondContact O-N 3.3Å; F653-S656 PolarHBondContact O-N 3.1Å; F653-G657 PolarHBondContact O-N 3.13Å; F653-L945 WeakPolarHBondContact CE1-O 2.98Å
654	D	86.4	Confident	84.8	Confident	2 Å²	2	4 Å²	4	1%	0.011	2%	0.024	C	C	.	.	H	α-helix	trans	-67.1	-40.6	171.1	-79.3	-26.3	0	0	0	111	S642 G651 S658 N675 N677 T680	S642-D654 PolarHBondContact OG-OD1 3.46Å; G651-D654 WeakPolarHBondContact O-CB 3.36Å; G651-D654 PolarHBondContact O-N 2.87Å; D654-S658 VanDerWaalsContact O-CB 3.31Å; D654-S658 WeakPolarHBondContact O-CB 3.36Å; D654-S658 PolarHBondContact O-N 2.94Å; D654-S658 PolarHBondContact O-OG 2.79Å; D654-N675 PolarHBondContact OD1-ND2 2.92Å; D654-N675 VanDerWaalsContact OD1-ND2 3.12Å; D654-N677 PolarHBondContact OD2-ND2 2.95Å; D654-T680 VanDerWaalsContact CB-OG1 3.28Å; D654-T680 WeakPolarHBondContact CB-OG1 3.43Å; D654-T680 WeakPolarHBondContact OD2-CB 3.43Å
655	Y	88.7	Confident	85	Confident	3 Å²	3	10 Å²	10	1%	0.012	5%	0.046	C	C	.	.	H	α-helix	trans	-61.6	-53.3	170.2	164.1	-104.2	0	0	0	111.3	G651 G657 S658 Q659 A950 K954 V1302 D1305	G651-Y655 PolarHBondContact O-N 3.05Å; Y655-G657 VanDerWaalsContact C-N 3.33Å; Y655-G657 PolarHBondContact O-N 3.27Å; Y655-S658 WeakPolarHBondContact O-CA 3.22Å; Y655-S658 WeakPolarHBondContact O-CB 3.44Å; Y655-S658 PolarHBondContact O-N 3.29Å; Y655-Q659 HydrophobicContact CD2-CG 4.27Å; Y655-Q659 HydrophobicContact CE1-CG 4.18Å; Y655-Q659 HydrophobicContact CE2-CG 3.74Å; Y655-Q659 PolarHBondContact O-N 3.43Å; Y655-A950 HydrophobicContact CD1-CB 4.05Å; Y655-A950 HydrophobicContact CE1-CB 4.32Å; Y655-K954 VanDerWaalsContact CE2-NZ 3.31Å; Y655-K954 PolarHBondContact OH-NZ 3.27Å; Y655-V1302 HydrophobicContact CD2-CG2 4.29Å; Y655-D1305 HydrophobicContact CE2-CB 4.48Å
656	S	90.7	Very high	85.2	Confident	1 Å²	1	16 Å²	16	1%	0.007	7%	0.074	C	C	.	.	H	α-helix	trans	-60.3	-43.7	-177.5	-62	0	0	0	0	111.8	E652 F653 S658 Q659 A660	E652-S656 VanDerWaalsContact O-CB 3.32Å; E652-S656 WeakPolarHBondContact O-CB 3.35Å; E652-S656 PolarHBondContact O-N 3.35Å; E652-S656 PolarHBondContact O-OG 2.81Å; F653-S656 PolarHBondContact O-N 3.1Å; S656-S658 VanDerWaalsContact C-N 3.33Å; S656-S658 PolarHBondContact O-N 3.4Å; S656-Q659 WeakPolarHBondContact O-CB 3.31Å; S656-Q659 PolarHBondContact O-N 2.85Å; S656-A660 PolarHBondContact O-N 3.21Å
657	G	92.2	Very high	85.5	Confident	1 Å²	1	16.9 Å²	16.9	1%	0.01	8%	0.077	C	C	.	.	H	α-helix	trans	-65.1	-34.7	174.8	0	0	0	0	0	113	L639 F653 Y655 A660 L661 Q682	L639-G657 WeakPolarHBondContact CD2-O 3.37Å; F653-G657 PolarHBondContact O-N 3.13Å; Y655-G657 VanDerWaalsContact C-N 3.33Å; Y655-G657 PolarHBondContact O-N 3.27Å; G657-A660 PolarHBondContact O-N 3.44Å; G657-L661 WeakPolarHBondContact O-CG 3.23Å; G657-L661 PolarHBondContact O-N 3.28Å; G657-L661 VanDerWaalsContact O-N 3.11Å; G657-Q682 VanDerWaalsContact CA-NE2 3.34Å
658	S	92.4	Very high	85.9	Confident	0 Å²	0	20 Å²	20	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-66.1	-40.6	173.1	-62.9	0	0	0	0	112.1	D654 Y655 S656 L661 K662 Q682	D654-S658 VanDerWaalsContact O-CB 3.31Å; D654-S658 WeakPolarHBondContact O-CB 3.36Å; D654-S658 PolarHBondContact O-N 2.94Å; D654-S658 PolarHBondContact O-OG 2.79Å; Y655-S658 WeakPolarHBondContact O-CA 3.22Å; Y655-S658 WeakPolarHBondContact O-CB 3.44Å; Y655-S658 PolarHBondContact O-N 3.29Å; S656-S658 VanDerWaalsContact C-N 3.33Å; S656-S658 PolarHBondContact O-N 3.4Å; S658-L661 PolarHBondContact O-N 2.79Å; S658-K662 WeakPolarHBondContact O-CG 3.26Å; S658-K662 PolarHBondContact O-N 2.79Å; S658-K662 VanDerWaalsContact O-N 3.15Å; S658-Q682 WeakPolarHBondContact OG-CA 3.38Å; S658-Q682 WeakPolarHBondContact OG-CB 3.48Å
659	Q	92.3	Very high	87	Confident	1 Å²	1	19.9 Å²	19.9	1%	0.005	11%	0.107	C	C	.	.	H	α-helix	trans	-61.8	-43.3	173.9	-68.4	-51.2	-50.5	0	0	112	Y655 S656 L661 K662 A663 A961 D1305	Y655-Q659 HydrophobicContact CD2-CG 4.27Å; Y655-Q659 HydrophobicContact CE1-CG 4.18Å; Y655-Q659 HydrophobicContact CE2-CG 3.74Å; Y655-Q659 PolarHBondContact O-N 3.43Å; S656-Q659 WeakPolarHBondContact O-CB 3.31Å; S656-Q659 PolarHBondContact O-N 2.85Å; Q659-L661 PolarHBondContact O-N 3.38Å; Q659-K662 PolarHBondContact O-N 3.31Å; Q659-A663 PolarHBondContact O-N 3.43Å; Q659-A961 HydrophobicContact CB-CB 3.77Å; Q659-A961 HydrophobicContact CG-CB 4.13Å; Q659-D1305 VanDerWaalsContact NE2-CG 3.25Å; Q659-D1305 PolarHBondContact NE2-OD1 3.01Å; Q659-D1305 PolarHBondContact NE2-OD2 3.45Å
660	A	93.9	Very high	88	Confident	0 Å²	0	21.9 Å²	21.9	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-60.3	-45.5	177.7	0	0	0	0	0	111.6	L639 S656 G657 K662 A663 L664 F717 A965	L639-A660 HydrophobicContact CD1-CB 4.39Å; L639-A660 HydrophobicContact CD2-CB 4.43Å; S656-A660 PolarHBondContact O-N 3.21Å; G657-A660 PolarHBondContact O-N 3.44Å; A660-K662 PolarHBondContact O-N 3.1Å; A660-A663 PolarHBondContact O-N 3.45Å; A660-L664 VanDerWaalsContact O-CG 3.25Å; A660-L664 WeakPolarHBondContact O-CG 3.41Å; A660-L664 PolarHBondContact O-N 3.42Å; A660-F717 HydrophobicContact CB-CD1 3.74Å; A660-F717 HydrophobicContact CB-CD2 4.33Å; A660-F717 HydrophobicContact CB-CE1 3.87Å; A660-F717 HydrophobicContact CB-CE2 4.47Å; A660-F717 HydrophobicContact CB-CG 3.99Å; A660-F717 HydrophobicContact CB-CZ 4.24Å; A660-A965 HydrophobicContact CB-CB 3.9Å
661	L	94	Very high	89.5	Confident	1 Å²	1	21.7 Å²	21.7	1%	0.005	12%	0.115	C	C	.	.	H	α-helix	trans	-60.1	-42.7	177.2	-69.7	170.8	0	0	0	112.4	L639 G657 S658 Q659 L664 R665 T671 L673 Q682 M687 A688	L639-L661 HydrophobicContact CB-CD2 4.4Å; L639-L661 HydrophobicContact CD2-CD1 4.2Å; L639-L661 HydrophobicContact CD2-CD2 3.87Å; L639-L661 HydrophobicContact CD2-CG 3.69Å; G657-L661 WeakPolarHBondContact O-CG 3.23Å; G657-L661 PolarHBondContact O-N 3.28Å; G657-L661 VanDerWaalsContact O-N 3.11Å; S658-L661 PolarHBondContact O-N 2.79Å; Q659-L661 PolarHBondContact O-N 3.38Å; L661-L664 PolarHBondContact O-N 3.24Å; L661-R665 WeakPolarHBondContact O-CB 3.44Å; L661-R665 PolarHBondContact O-N 3.3Å; L661-T671 HydrophobicContact CD2-CG2 4.07Å; L661-L673 HydrophobicContact CD1-CD2 4.22Å; L661-Q682 HydrophobicContact CD1-CG 3.85Å; L661-M687 HydrophobicContact CD1-CB 4.49Å; L661-A688 HydrophobicContact CD1-CB 4.17Å; L661-A688 HydrophobicContact CD2-CB 3.87Å
662	K	90.8	Very high	90.4	Very high	20 Å²	20	21.7 Å²	21.7	9%	0.087	12%	0.115	C	C	.	.	H	α-helix	trans	-59.6	-48	174.9	-69	178.5	-176.3	-173	0	111.4	S658 Q659 A660 L664 R665 E666 D1305 D1307	S658-K662 WeakPolarHBondContact O-CG 3.26Å; S658-K662 PolarHBondContact O-N 2.79Å; S658-K662 VanDerWaalsContact O-N 3.15Å; Q659-K662 PolarHBondContact O-N 3.31Å; A660-K662 PolarHBondContact O-N 3.1Å; K662-L664 PolarHBondContact O-N 3.47Å; K662-R665 PolarHBondContact O-N 2.97Å; K662-E666 PolarHBondContact O-N 3.48Å; K662-D1305 IonicContact NZ-OD2 2.69Å; K662-D1305 PolarHBondContact NZ-OD2 2.88Å; K662-D1307 IonicContact NZ-OD1 3.08Å; K662-D1307 PolarHBondContact NZ-OD1 3.47Å; K662-D1307 IonicContact NZ-OD2 2.61Å; K662-D1307 PolarHBondContact NZ-OD2 2.74Å
663	A	92.3	Very high	91.1	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-60.4	-44.9	179.4	0	0	0	0	0	112.5	Q659 A660 E666 E667 Y962 A965 K966	Q659-A663 PolarHBondContact O-N 3.43Å; A660-A663 PolarHBondContact O-N 3.45Å; A663-E666 PolarHBondContact O-N 3.04Å; A663-E667 PolarHBondContact O-N 3.47Å; A663-Y962 HydrophobicContact CB-CD2 3.67Å; A663-Y962 HydrophobicContact CB-CE2 3.65Å; A663-Y962 HydrophobicContact CB-CG 4.32Å; A663-A965 HydrophobicContact CB-CB 3.78Å; A663-K966 HydrophobicContact CB-CD 4.22Å; A663-K966 HydrophobicContact CB-CG 4.13Å; A663-K966 PolarHBondContact O-NZ 2.99Å
664	L	94.6	Very high	91.4	Very high	1 Å²	1	21.3 Å²	21.3	1%	0.005	11%	0.113	C	C	.	.	H	α-helix	trans	-62.1	-45.6	177.3	-69.8	176.4	0	0	0	111.7	V637 A660 L661 K662 E666 E667 G668 V669 T671 L714 L969	V637-L664 HydrophobicContact CB-CD1 4.25Å; V637-L664 HydrophobicContact CG1-CD1 3.98Å; A660-L664 VanDerWaalsContact O-CG 3.25Å; A660-L664 WeakPolarHBondContact O-CG 3.41Å; A660-L664 PolarHBondContact O-N 3.42Å; L661-L664 PolarHBondContact O-N 3.24Å; K662-L664 PolarHBondContact O-N 3.47Å; L664-E666 VanDerWaalsContact C-N 3.35Å; L664-E666 PolarHBondContact O-N 3.2Å; L664-E667 CarbonylContact O-C 3.24Å; L664-E667 PolarHBondContact O-N 2.89Å; L664-E667 VanDerWaalsContact O-N 3.09Å; L664-G668 PolarHBondContact O-N 3.36Å; L664-V669 HydrophobicContact CB-CB 4.27Å; L664-V669 HydrophobicContact CD2-CB 4.49Å; L664-V669 HydrophobicContact CD2-CG1 4.41Å; L664-V669 WeakPolarHBondContact O-CB 3.07Å; L664-V669 PolarHBondContact O-N 3.32Å; L664-T671 HydrophobicContact CB-CG2 3.57Å; L664-T671 HydrophobicContact CD1-CG2 3.89Å; L664-T671 HydrophobicContact CG-CG2 4.41Å; L664-L714 HydrophobicContact CD1-CD1 3.89Å; L664-L714 HydrophobicContact CD2-CD1 4.29Å; L664-L714 HydrophobicContact CG-CD1 4.46Å; L664-L969 HydrophobicContact CD2-CD1 3.78Å; L664-L969 HydrophobicContact CD2-CD2 3.87Å; L664-L969 HydrophobicContact CD2-CG 4.05Å
665	R	90	Very high	91.7	Very high	129 Å²	129	21.2 Å²	21.2	49%	0.487	11%	0.112	S	C	.	.	H	α-helix	trans	-61.7	-42.5	179.1	-175.1	176.8	64.3	-171.8	-0.1	111.8	L661 K662 E667 G668 G686	L661-R665 WeakPolarHBondContact O-CB 3.44Å; L661-R665 PolarHBondContact O-N 3.3Å; K662-R665 PolarHBondContact O-N 2.97Å; R665-E667 PolarHBondContact O-N 2.82Å; R665-G668 PolarHBondContact O-N 2.8Å; R665-G686 PolarHBondContact NH1-O 3.39Å
666	E	88.4	Confident	91.8	Very high	133 Å²	133	21.1 Å²	21.1	62%	0.621	11%	0.112	S	C	*	.	H	α-helix	trans	-63.3	-29.9	175.7	-169.5	-173.3	107.2	0	0	112.4	K662 A663 L664 G668 Y962 K966	K662-E666 PolarHBondContact O-N 3.48Å; A663-E666 PolarHBondContact O-N 3.04Å; L664-E666 VanDerWaalsContact C-N 3.35Å; L664-E666 PolarHBondContact O-N 3.2Å; E666-G668 PolarHBondContact O-N 2.74Å; E666-Y962 PolarHBondContact OE1-OH 3.4Å; E666-Y962 PolarHBondContact OE2-OH 2.92Å; E666-K966 IonicContact OE1-NZ 3.93Å; E666-K966 PolarHBondContact OE1-NZ 3.36Å
667	E	88.9	Confident	91.9	Very high	31 Å²	31	21 Å²	21	15%	0.145	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.2	4	174.1	-68.9	-60.6	145.1	0	0	114.4	K633 A663 L664 R665 V669 K966 L969 K971	K633-E667 PolarHBondContact NZ-O 2.95Å; K633-E667 IonicContact NZ-OE2 2.86Å; A663-E667 PolarHBondContact O-N 3.47Å; L664-E667 CarbonylContact O-C 3.24Å; L664-E667 PolarHBondContact O-N 2.89Å; L664-E667 VanDerWaalsContact O-N 3.09Å; R665-E667 PolarHBondContact O-N 2.82Å; E667-V669 VanDerWaalsContact C-N 3.32Å; E667-V669 HydrophobicContact CB-CG2 4.16Å; E667-K966 HydrophobicContact CG-CD 3.63Å; E667-K966 WeakPolarHBondContact OE1-CD 3.34Å; E667-K966 IonicContact OE1-NZ 3.93Å; E667-K966 PolarHBondContact OE1-NZ 2.86Å; E667-L969 HydrophobicContact CB-CD1 3.86Å; E667-L969 HydrophobicContact CG-CD1 3.78Å; E667-K971 VanDerWaalsContact CD-CE 3.46Å; E667-K971 IonicContact OE1-NZ 3.27Å; E667-K971 PolarHBondContact OE1-NZ 3.39Å; E667-K971 WeakPolarHBondContact OE2-CE 3.46Å; E667-K971 IonicContact OE2-NZ 3.12Å; E667-K971 PolarHBondContact OE2-NZ 3.46Å
668	G	84.3	Confident	91.8	Very high	68 Å²	68	21 Å²	21	70%	0.701	11%	0.111	S	C	*	.	T	Hydrogen-bonded Turn	trans	70.7	24.6	-178.9	0	0	0	0	0	113.8	L664 R665 E666	L664-G668 PolarHBondContact O-N 3.36Å; R665-G668 PolarHBondContact O-N 2.8Å; E666-G668 PolarHBondContact O-N 2.74Å
669	V	90.9	Very high	91.6	Very high	6 Å²	6	21 Å²	21	4%	0.036	11%	0.111	C	C	.	.			trans	-89	130.8	177.4	-179.7	0	0	0	0	109.2	V637 L664 E667 T671 L969	V637-V669 HydrophobicContact CB-CG1 3.88Å; V637-V669 HydrophobicContact CG2-CG1 3.57Å; L664-V669 HydrophobicContact CB-CB 4.27Å; L664-V669 HydrophobicContact CD2-CB 4.49Å; L664-V669 HydrophobicContact CD2-CG1 4.41Å; L664-V669 WeakPolarHBondContact O-CB 3.07Å; L664-V669 PolarHBondContact O-N 3.32Å; E667-V669 VanDerWaalsContact C-N 3.32Å; E667-V669 HydrophobicContact CB-CG2 4.16Å; V669-T671 PolarHBondContact O-N 2.85Å; V669-L969 HydrophobicContact CG2-CD1 4.18Å
670	Q	89	Confident	91.5	Very high	48 Å²	48	21 Å²	21	22%	0.224	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	128.5	171.4	-171.7	179.8	16.7	0	0	109.7	R635 K636 V637 D689	R635-Q670 PolarHBondContact O-N 2.95Å; K636-Q670 CarbonylContact C-O 3.43Å; K636-Q670 VanDerWaalsContact CA-O 3.28Å; K636-Q670 WeakPolarHBondContact CA-O 2.97Å; K636-Q670 HydrophobicContact CB-CB 4.35Å; K636-Q670 HydrophobicContact CG-CB 4.16Å; K636-Q670 HydrophobicContact CG-CG 4.32Å; V637-Q670 PolarHBondContact N-O 3.07Å; Q670-D689 WeakPolarHBondContact CA-OD2 3.2Å; Q670-D689 HydrophobicContact CG-CB 4.07Å
671	T	94.2	Very high	91.3	Very high	2 Å²	2	21.1 Å²	21.1	1%	0.012	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	127.8	-170.3	54.9	0	0	0	0	111.9	L661 L664 V669 A688 D689 K690	L661-T671 HydrophobicContact CD2-CG2 4.07Å; L664-T671 HydrophobicContact CB-CG2 3.57Å; L664-T671 HydrophobicContact CD1-CG2 3.89Å; L664-T671 HydrophobicContact CG-CG2 4.41Å; V669-T671 PolarHBondContact O-N 2.85Å; T671-A688 VanDerWaalsContact OG1-CA 3.26Å; T671-A688 WeakPolarHBondContact OG1-CA 3.16Å; T671-D689 PolarHBondContact N-OD2 2.94Å; T671-D689 WeakPolarHBondContact O-CB 3.33Å; T671-D689 PolarHBondContact O-N 3.32Å; T671-D689 PolarHBondContact OG1-N 2.86Å; T671-D689 VanDerWaalsContact OG1-N 3.09Å; T671-D689 PolarHBondContact OG1-OD2 3.38Å; T671-K690 PolarHBondContact O-N 3.2Å
672	L	94.1	Very high	91.2	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	140.4	169.2	-49.6	175.1	0	0	0	108.6	K636 V637 L638 L639 K690 E708 P710	K636-L672 HydrophobicContact CD-CD1 3.77Å; K636-L672 HydrophobicContact CD-CD2 4.32Å; K636-L672 HydrophobicContact CD-CG 4.1Å; K636-L672 HydrophobicContact CG-CD1 4.15Å; K636-L672 HydrophobicContact CG-CG 4.13Å; V637-L672 PolarHBondContact O-N 3.25Å; L638-L672 CarbonylContact C-O 3.58Å; L638-L672 WeakPolarHBondContact CA-O 3.35Å; L638-L672 HydrophobicContact CB-CB 4.37Å; L638-L672 HydrophobicContact CD1-CB 3.7Å; L639-L672 PolarHBondContact N-O 3.33Å; L672-K690 WeakPolarHBondContact CA-O 3.39Å; L672-K690 HydrophobicContact CD2-CB 3.87Å; L672-K690 HydrophobicContact CD2-CD 4.2Å; L672-K690 HydrophobicContact CD2-CG 4.35Å; L672-E708 HydrophobicContact CD1-CB 3.48Å; L672-E708 VanDerWaalsContact CD1-CB 3.48Å; L672-E708 HydrophobicContact CD1-CG 3.98Å; L672-P710 HydrophobicContact CD1-CB 4.16Å; L672-P710 HydrophobicContact CD1-CG 4.45Å
673	L	96	Very high	91.2	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	133.8	176.6	175.1	65	0	0	0	110.4	L639 L661 N675 Q682 T683 A688 K690 I691 F692	L639-L673 HydrophobicContact CB-CD1 4.29Å; L639-L673 HydrophobicContact CD2-CD1 4.09Å; L639-L673 HydrophobicContact CG-CD1 4.27Å; L639-L673 WeakPolarHBondContact O-CA 3.36Å; L661-L673 HydrophobicContact CD1-CD2 4.22Å; L673-N675 HydrophobicContact CD1-CB 4.14Å; L673-N675 HydrophobicContact CD2-CB 4.35Å; L673-N675 HydrophobicContact CG-CB 4.19Å; L673-Q682 HydrophobicContact CD1-CG 4.41Å; L673-Q682 HydrophobicContact CD2-CB 4.43Å; L673-Q682 HydrophobicContact CD2-CG 3.73Å; L673-Q682 VanDerWaalsContact CD2-O 3.25Å; L673-Q682 WeakPolarHBondContact CD2-O 3.35Å; L673-T683 HydrophobicContact CD2-CG2 4.08Å; L673-A688 HydrophobicContact CB-CB 3.97Å; L673-K690 PolarHBondContact N-O 2.98Å; L673-I691 HydrophobicContact CB-CG1 4.22Å; L673-I691 HydrophobicContact CD2-CG1 4.2Å; L673-I691 HydrophobicContact CD2-CG2 4.07Å; L673-I691 HydrophobicContact CG-CG2 4.44Å; L673-I691 CarbonylContact O-C 3.59Å; L673-I691 WeakPolarHBondContact O-CA 3.04Å; L673-F692 PolarHBondContact O-N 3.33Å
674	I	94.4	Very high	91.1	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	112.5	161	-60.4	163.5	0	0	0	107.8	L638 L639 L640 G641 F692 L694 I696 V701 V704	L638-I674 HydrophobicContact CD1-CD1 3.9Å; L638-I674 HydrophobicContact CD1-CG1 3.92Å; L638-I674 HydrophobicContact CD2-CD1 4.06Å; L639-I674 PolarHBondContact O-N 3.18Å; L640-I674 HydrophobicContact CD2-CB 4.12Å; L640-I674 HydrophobicContact CD2-CD1 3.94Å; L640-I674 HydrophobicContact CD2-CG1 4.5Å; G641-I674 PolarHBondContact N-O 2.8Å; I674-F692 WeakPolarHBondContact CA-O 3.45Å; I674-F692 HydrophobicContact CG1-CB 4.06Å; I674-F692 HydrophobicContact CG1-CD2 4.23Å; I674-L694 HydrophobicContact CG2-CB 4.21Å; I674-I696 HydrophobicContact CG2-CG1 4.24Å; I674-V701 HydrophobicContact CD1-CB 4.27Å; I674-V701 HydrophobicContact CD1-CG1 4.34Å; I674-V701 HydrophobicContact CD1-CG2 3.87Å; I674-V704 HydrophobicContact CD1-CB 3.79Å; I674-V704 HydrophobicContact CD1-CG1 4Å; I674-V704 HydrophobicContact CD1-CG2 3.73Å; I674-V704 HydrophobicContact CG1-CG1 4.41Å; I674-V704 HydrophobicContact CG1-CG2 4.14Å
675	N	93.9	Very high	90.5	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.141	C	C	.	.			trans	-151.8	128.7	171.5	-169.1	-1.3	0	0	0	109.3	G643 D654 L673 N677 Q682 T683 F692 L693	G643-N675 VanDerWaalsContact CA-OD1 3.31Å; G643-N675 WeakPolarHBondContact CA-OD1 3.41Å; G643-N675 PolarHBondContact N-OD1 2.92Å; D654-N675 PolarHBondContact OD1-ND2 2.92Å; D654-N675 VanDerWaalsContact OD1-ND2 3.12Å; L673-N675 HydrophobicContact CD1-CB 4.14Å; L673-N675 HydrophobicContact CD2-CB 4.35Å; L673-N675 HydrophobicContact CG-CB 4.19Å; N675-N677 WeakPolarHBondContact OD1-CB 3.39Å; N675-N677 PolarHBondContact OD1-N 3.35Å; N675-Q682 PolarHBondContact ND2-OE1 2.82Å; N675-T683 HydrophobicContact CB-CG2 3.9Å; N675-F692 PolarHBondContact N-O 3.03Å; N675-F692 VanDerWaalsContact N-O 3.16Å; N675-L693 VanDerWaalsContact O-CD2 3.32Å; N675-L693 WeakPolarHBondContact O-CD2 3.47Å
676	S	90.9	Very high	90	Very high	1 Å²	1	22 Å²	22	1%	0.007	13%	0.132	C	C	.	.			trans	-86.1	-7.4	177	56.4	0	0	0	0	113.4	I678 V1637 A1638	S676-I678 PolarHBondContact O-N 3.48Å; S676-V1637 WeakPolarHBondContact O-CA 3.48Å; S676-A1638 PolarHBondContact O-N 2.79Å
677	N	92.5	Very high	89.9	Confident	0 Å²	0	16.1 Å²	16.1	0%	0	10%	0.104	C	C	.	.			trans	-69.3	100.7	172.4	-168.8	-7.8	0	0	0	109.9	G643 D654 N675 A679 T680 T683	G643-N677 WeakPolarHBondContact O-CB 3.33Å; D654-N677 PolarHBondContact OD2-ND2 2.95Å; N675-N677 WeakPolarHBondContact OD1-CB 3.39Å; N675-N677 PolarHBondContact OD1-N 3.35Å; N677-A679 VanDerWaalsContact C-N 3.29Å; N677-A679 WeakPolarHBondContact OD1-CB 3.32Å; N677-A679 PolarHBondContact OD1-N 3.1Å; N677-T680 HydrophobicContact CB-CG2 3.92Å; N677-T680 VanDerWaalsContact O-CG2 3.31Å; N677-T680 WeakPolarHBondContact O-CG2 3.47Å; N677-T683 WeakPolarHBondContact O-CG2 3.14Å; N677-T683 PolarHBondContact O-OG1 3.32Å
678	I	89.3	Confident	90	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	10%	0.098	C	C	.	.	S	Bend	trans	-77.5	-19	179.9	-164.6	61	0	0	0	112.6	S676 L693 F1548 K1551 A1638	S676-I678 PolarHBondContact O-N 3.48Å; I678-L693 HydrophobicContact CD1-CD1 3.36Å; I678-L693 HydrophobicContact CD1-CD2 3.63Å; I678-L693 HydrophobicContact CD1-CG 4.13Å; I678-F1548 HydrophobicContact CG1-CB 4.35Å; I678-F1548 HydrophobicContact CG1-CD2 4.19Å; I678-F1548 HydrophobicContact CG2-CB 4.12Å; I678-F1548 HydrophobicContact CG2-CD2 4.31Å; I678-K1551 HydrophobicContact CD1-CB 3.8Å; I678-K1551 HydrophobicContact CD1-CD 3.43Å; I678-K1551 VanDerWaalsContact CD1-CD 3.43Å; I678-K1551 HydrophobicContact CD1-CG 4.24Å; I678-K1551 HydrophobicContact CG1-CB 4.45Å; I678-K1551 HydrophobicContact CG1-CD 4.01Å; I678-K1551 PolarHBondContact O-NZ 2.73Å; I678-A1638 HydrophobicContact CB-CB 3.74Å; I678-A1638 HydrophobicContact CG1-CB 4.14Å; I678-A1638 HydrophobicContact CG2-CB 3.61Å
679	A	89.5	Confident	90.2	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	8%	0.079	C	C	.	.	S	Bend	trans	-78.7	-25.5	-174.4	0	0	0	0	0	113.2	N677 V1272 E1273 W1276 E1636	N677-A679 VanDerWaalsContact C-N 3.29Å; N677-A679 WeakPolarHBondContact OD1-CB 3.32Å; N677-A679 PolarHBondContact OD1-N 3.1Å; A679-V1272 HydrophobicContact CB-CG2 3.5Å; A679-V1272 VanDerWaalsContact CB-CG2 3.5Å; A679-E1273 HydrophobicContact CB-CB 4.47Å; A679-E1273 HydrophobicContact CB-CG 3.68Å; A679-W1276 VanDerWaalsContact O-CB 3.31Å; A679-W1276 WeakPolarHBondContact O-CB 3.48Å; A679-E1636 HydrophobicContact CB-CG 4.46Å
680	T	90.4	Very high	90	Very high	2 Å²	2	14.6 Å²	14.6	1%	0.012	8%	0.081	C	C	.	.	S	Bend	trans	-76.8	155	-171	178.8	0	0	0	0	114.9	D654 N677 Q682 T683 K1551	D654-T680 VanDerWaalsContact CB-OG1 3.28Å; D654-T680 WeakPolarHBondContact CB-OG1 3.43Å; D654-T680 WeakPolarHBondContact OD2-CB 3.43Å; N677-T680 HydrophobicContact CB-CG2 3.92Å; N677-T680 VanDerWaalsContact O-CG2 3.31Å; N677-T680 WeakPolarHBondContact O-CG2 3.47Å; T680-Q682 HydrophobicContact CG2-CB 3.75Å; T680-Q682 PolarHBondContact O-N 3.12Å; T680-Q682 PolarHBondContact OG1-N 3.16Å; T680-Q682 VanDerWaalsContact OG1-N 3.14Å; T680-T683 HydrophobicContact CG2-CG2 4.06Å; T680-T683 PolarHBondContact O-N 3.18Å; T680-T683 PolarHBondContact O-OG1 3.08Å; T680-K1551 PolarHBondContact O-NZ 3.07Å
681	V	89.1	Confident	90.2	Very high	1 Å²	1	12.4 Å²	12.4	1%	0.006	7%	0.07	C	C	.	.	G	3₁₀ helix	trans	-57.5	-33	167.2	-179.7	0	0	0	0	111.7	T683 T684 M687 W1276 V1279 V1302	V681-T683 PolarHBondContact O-N 2.76Å; V681-T683 VanDerWaalsContact O-N 3.15Å; V681-T684 WeakPolarHBondContact CA-OG1 3.43Å; V681-T684 WeakPolarHBondContact O-CB 3.14Å; V681-T684 PolarHBondContact O-N 2.9Å; V681-T684 PolarHBondContact O-OG1 3Å; V681-M687 HydrophobicContact CG1-SD 4.45Å; V681-M687 WeakPolarHBondContact O-CG 3.36Å; V681-W1276 HydrophobicContact CG2-CB 4.23Å; V681-W1276 HydrophobicContact CG2-CG 4.46Å; V681-V1279 HydrophobicContact CG1-CG1 4.1Å; V681-V1279 HydrophobicContact CG2-CB 4.03Å; V681-V1279 HydrophobicContact CG2-CG1 4.07Å; V681-V1279 HydrophobicContact CG2-CG2 4.11Å; V681-V1302 HydrophobicContact CB-CB 4.25Å; V681-V1302 HydrophobicContact CB-CG1 4.22Å; V681-V1302 HydrophobicContact CB-CG2 4.23Å; V681-V1302 HydrophobicContact CG1-CG1 3.97Å; V681-V1302 HydrophobicContact CG2-CB 4.14Å; V681-V1302 HydrophobicContact CG2-CG1 4.33Å
682	Q	91.2	Very high	90	Very high	0 Å²	0	12.3 Å²	12.3	0%	0	7%	0.07	C	C	.	.	G	3₁₀ helix	trans	-56.8	-34.6	-177.9	-158.3	-164.2	23.8	0	0	113	G657 S658 L661 L673 N675 T680 T684	G657-Q682 VanDerWaalsContact CA-NE2 3.34Å; S658-Q682 WeakPolarHBondContact OG-CA 3.38Å; S658-Q682 WeakPolarHBondContact OG-CB 3.48Å; L661-Q682 HydrophobicContact CD1-CG 3.85Å; L673-Q682 HydrophobicContact CD1-CG 4.41Å; L673-Q682 HydrophobicContact CD2-CB 4.43Å; L673-Q682 HydrophobicContact CD2-CG 3.73Å; L673-Q682 VanDerWaalsContact CD2-O 3.25Å; L673-Q682 WeakPolarHBondContact CD2-O 3.35Å; N675-Q682 PolarHBondContact ND2-OE1 2.82Å; T680-Q682 HydrophobicContact CG2-CB 3.75Å; T680-Q682 PolarHBondContact O-N 3.12Å; T680-Q682 PolarHBondContact OG1-N 3.16Å; T680-Q682 VanDerWaalsContact OG1-N 3.14Å; Q682-T684 VanDerWaalsContact C-N 3.32Å; Q682-T684 PolarHBondContact O-N 3.5Å
683	T	91.5	Very high	89.7	Confident	0 Å²	0	12.6 Å²	12.6	0%	0	7%	0.071	C	C	.	.	G	3₁₀ helix	trans	-93.2	18.9	-179.9	56.8	0	0	0	0	113.3	L673 N675 N677 T680 V681 I691 L693 K1551	L673-T683 HydrophobicContact CD2-CG2 4.08Å; N675-T683 HydrophobicContact CB-CG2 3.9Å; N677-T683 WeakPolarHBondContact O-CG2 3.14Å; N677-T683 PolarHBondContact O-OG1 3.32Å; T680-T683 HydrophobicContact CG2-CG2 4.06Å; T680-T683 PolarHBondContact O-N 3.18Å; T680-T683 PolarHBondContact O-OG1 3.08Å; V681-T683 PolarHBondContact O-N 2.76Å; V681-T683 VanDerWaalsContact O-N 3.15Å; T683-I691 HydrophobicContact CG2-CG2 4.02Å; T683-L693 HydrophobicContact CG2-CD2 4.08Å; T683-K1551 WeakPolarHBondContact O-CE 3.46Å; T683-K1551 PolarHBondContact OG1-NZ 2.75Å
684	T	89.1	Confident	89.4	Confident	29 Å²	29	13.2 Å²	13.2	18%	0.178	8%	0.075	C	C	.	.	S	Bend	trans	-79.8	142.5	173.5	-48.6	0	0	0	0	110.8	V681 Q682 G686 M687 I691 W1276	V681-T684 WeakPolarHBondContact CA-OG1 3.43Å; V681-T684 WeakPolarHBondContact O-CB 3.14Å; V681-T684 PolarHBondContact O-N 2.9Å; V681-T684 PolarHBondContact O-OG1 3Å; Q682-T684 VanDerWaalsContact C-N 3.32Å; Q682-T684 PolarHBondContact O-N 3.5Å; T684-G686 PolarHBondContact O-N 3.18Å; T684-M687 WeakPolarHBondContact O-CB 3.32Å; T684-M687 PolarHBondContact O-N 3.49Å; T684-M687 VanDerWaalsContact O-N 3.11Å; T684-I691 WeakPolarHBondContact O-CD1 3.08Å; T684-W1276 PolarHBondContact OG1-NE1 3.15Å
685	E	82.4	Confident	89	Confident	113 Å²	113	13.3 Å²	13.3	53%	0.528	8%	0.075	S	C	.	.	B	Isolated β-bridge	trans	-53.1	135.2	173.3	-166.5	178.2	151.8	0	0	111.7	M687 I1844 S1846	E685-M687 VanDerWaalsContact C-N 3.3Å; E685-M687 PolarHBondContact O-N 3.14Å; E685-I1844 HydrophobicContact CB-CG2 4Å; E685-I1844 HydrophobicContact CG-CG2 4.21Å; E685-S1846 WeakPolarHBondContact OE1-CA 3.38Å
686	G	80.4	Confident	88.8	Confident	29 Å²	29	13.8 Å²	13.8	30%	0.299	8%	0.077	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.8	-6.5	-177.7	0	0	0	0	0	115.7	R665 T684	R665-G686 PolarHBondContact NH1-O 3.39Å; T684-G686 PolarHBondContact O-N 3.18Å
687	M	86.4	Confident	88.5	Confident	8 Å²	8	14.9 Å²	14.9	4%	0.039	8%	0.084	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-39.6	169.1	-75.8	-64.1	-62.6	0	0	112.1	L661 V681 T684 E685	L661-M687 HydrophobicContact CD1-CB 4.49Å; V681-M687 HydrophobicContact CG1-SD 4.45Å; V681-M687 WeakPolarHBondContact O-CG 3.36Å; T684-M687 WeakPolarHBondContact O-CB 3.32Å; T684-M687 PolarHBondContact O-N 3.49Å; T684-M687 VanDerWaalsContact O-N 3.11Å; E685-M687 VanDerWaalsContact C-N 3.3Å; E685-M687 PolarHBondContact O-N 3.14Å
688	A	90	Very high	88.1	Confident	3 Å²	3	16.6 Å²	16.6	3%	0.025	10%	0.096	C	C	.	.	B	Isolated β-bridge	trans	-127.5	158.2	166.9	0	0	0	0	0	109.6	L661 T671 L673 K690 I691	L661-A688 HydrophobicContact CD1-CB 4.17Å; L661-A688 HydrophobicContact CD2-CB 3.87Å; T671-A688 VanDerWaalsContact OG1-CA 3.26Å; T671-A688 WeakPolarHBondContact OG1-CA 3.16Å; L673-A688 HydrophobicContact CB-CB 3.97Å; A688-K690 VanDerWaalsContact C-N 3.33Å; A688-K690 PolarHBondContact O-N 3.47Å; A688-I691 HydrophobicContact CB-CG1 3.89Å
689	D	88.1	Confident	87.4	Confident	55 Å²	55	19 Å²	19	29%	0.294	11%	0.109	S	C	.	.	S	Bend	trans	-66.3	-36.9	179.9	-59.5	-84.5	0	0	0	111.9	Q670 T671 T1845	Q670-D689 WeakPolarHBondContact CA-OD2 3.2Å; Q670-D689 HydrophobicContact CG-CB 4.07Å; T671-D689 PolarHBondContact N-OD2 2.94Å; T671-D689 WeakPolarHBondContact O-CB 3.33Å; T671-D689 PolarHBondContact O-N 3.32Å; T671-D689 PolarHBondContact OG1-N 2.86Å; T671-D689 VanDerWaalsContact OG1-N 3.09Å; T671-D689 PolarHBondContact OG1-OD2 3.38Å; D689-T1845 WeakPolarHBondContact O-CB 3.34Å; D689-T1845 PolarHBondContact O-OG1 2.64Å
690	K	88.5	Confident	87	Confident	16 Å²	16	19.2 Å²	19.2	7%	0.07	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	131.9	170	-67.1	-176.9	176.9	179.3	0	111.2	T671 L672 L673 A688 F692 E708 I1844 E2155 R2199	T671-K690 PolarHBondContact O-N 3.2Å; L672-K690 WeakPolarHBondContact CA-O 3.39Å; L672-K690 HydrophobicContact CD2-CB 3.87Å; L672-K690 HydrophobicContact CD2-CD 4.2Å; L672-K690 HydrophobicContact CD2-CG 4.35Å; L673-K690 PolarHBondContact N-O 2.98Å; A688-K690 VanDerWaalsContact C-N 3.33Å; A688-K690 PolarHBondContact O-N 3.47Å; K690-F692 HydrophobicContact CB-CE2 4.15Å; K690-F692 HydrophobicContact CB-CZ 4.35Å; K690-F692 HydrophobicContact CD-CZ 4.33Å; K690-E708 IonicContact NZ-OE1 2.73Å; K690-E708 PolarHBondContact NZ-OE1 3.3Å; K690-E708 IonicContact NZ-OE2 3.34Å; K690-E708 PolarHBondContact NZ-OE2 3.44Å; K690-I1844 WeakPolarHBondContact CA-O 3.27Å; K690-E2155 IonicContact NZ-OE1 2.8Å; K690-E2155 PolarHBondContact NZ-OE1 3.41Å; K690-R2199 VanDerWaalsContact NZ-NH2 3.17Å
691	I	91.7	Very high	86.9	Confident	1 Å²	1	19.1 Å²	19.1	1%	0.005	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	123	178.6	-59	158.3	0	0	0	109.2	L673 T683 T684 A688 S1843 I1844	L673-I691 HydrophobicContact CB-CG1 4.22Å; L673-I691 HydrophobicContact CD2-CG1 4.2Å; L673-I691 HydrophobicContact CD2-CG2 4.07Å; L673-I691 HydrophobicContact CG-CG2 4.44Å; L673-I691 CarbonylContact O-C 3.59Å; L673-I691 WeakPolarHBondContact O-CA 3.04Å; T683-I691 HydrophobicContact CG2-CG2 4.02Å; T684-I691 WeakPolarHBondContact O-CD1 3.08Å; A688-I691 HydrophobicContact CB-CG1 3.89Å; I691-S1843 CarbonylContact O-C 3.51Å; I691-S1843 WeakPolarHBondContact O-CA 3.45Å; I691-S1843 VanDerWaalsContact O-CB 3.24Å; I691-S1843 WeakPolarHBondContact O-CB 3.36Å; I691-I1844 HydrophobicContact CB-CB 4.19Å; I691-I1844 PolarHBondContact N-O 2.88Å; I691-I1844 PolarHBondContact O-N 3.2Å
692	F	89.9	Confident	86.6	Confident	0 Å²	0	19.3 Å²	19.3	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	114.3	176.6	-59.4	-82.1	0	0	0	109.7	L673 I674 N675 K690 L694 V704 E708 L1841	L673-F692 PolarHBondContact O-N 3.33Å; I674-F692 WeakPolarHBondContact CA-O 3.45Å; I674-F692 HydrophobicContact CG1-CB 4.06Å; I674-F692 HydrophobicContact CG1-CD2 4.23Å; N675-F692 PolarHBondContact N-O 3.03Å; N675-F692 VanDerWaalsContact N-O 3.16Å; K690-F692 HydrophobicContact CB-CE2 4.15Å; K690-F692 HydrophobicContact CB-CZ 4.35Å; K690-F692 HydrophobicContact CD-CZ 4.33Å; F692-L694 HydrophobicContact CB-CD1 3.97Å; F692-L694 HydrophobicContact CB-CG 4.15Å; F692-L694 HydrophobicContact CD1-CD1 4.46Å; F692-L694 PolarHBondContact O-N 2.76Å; F692-V704 HydrophobicContact CD1-CG2 4.39Å; F692-V704 HydrophobicContact CD2-CG1 3.97Å; F692-V704 HydrophobicContact CD2-CG2 4.2Å; F692-V704 HydrophobicContact CE2-CG1 3.74Å; F692-V704 HydrophobicContact CE2-CG2 4.49Å; F692-V704 HydrophobicContact CG-CG2 4.15Å; F692-V704 HydrophobicContact CZ-CG1 4.29Å; F692-E708 HydrophobicContact CE2-CG 4.13Å; F692-E708 HydrophobicContact CZ-CG 3.8Å; F692-L1841 HydrophobicContact CD1-CB 4.14Å; F692-L1841 HydrophobicContact CE1-CB 3.82Å
693	L	89.3	Confident	86	Confident	6 Å²	6	22.3 Å²	22.3	3%	0.031	12%	0.122	C	C	.	.			trans	-81.9	67.1	174.2	-64	171.7	0	0	0	110.1	N675 I678 T683 C1639 F1640 I1844	N675-L693 VanDerWaalsContact O-CD2 3.32Å; N675-L693 WeakPolarHBondContact O-CD2 3.47Å; I678-L693 HydrophobicContact CD1-CD1 3.36Å; I678-L693 HydrophobicContact CD1-CD2 3.63Å; I678-L693 HydrophobicContact CD1-CG 4.13Å; T683-L693 HydrophobicContact CG2-CD2 4.08Å; L693-C1639 PolarHBondContact O-SG 3.37Å; L693-F1640 HydrophobicContact CD1-CD1 4.07Å; L693-F1640 HydrophobicContact CD1-CD2 4.04Å; L693-F1640 HydrophobicContact CD1-CE1 3.52Å; L693-F1640 HydrophobicContact CD1-CE2 3.52Å; L693-F1640 HydrophobicContact CD1-CG 4.31Å; L693-F1640 HydrophobicContact CD1-CZ 3.22Å; L693-I1844 HydrophobicContact CD1-CD1 3.85Å; L693-I1844 HydrophobicContact CG-CD1 4.3Å
694	L	88.6	Confident	85.7	Confident	14 Å²	14	22.3 Å²	22.3	7%	0.073	12%	0.122	C	C	.	.			trans	-122.1	156.5	-175.5	-65	174.3	0	0	0	111.3	I674 F692 I696 V704 L1650 L1841	I674-L694 HydrophobicContact CG2-CB 4.21Å; F692-L694 HydrophobicContact CB-CD1 3.97Å; F692-L694 HydrophobicContact CB-CG 4.15Å; F692-L694 HydrophobicContact CD1-CD1 4.46Å; F692-L694 PolarHBondContact O-N 2.76Å; L694-I696 PolarHBondContact O-N 2.88Å; L694-V704 HydrophobicContact CD1-CG2 4.17Å; L694-L1650 HydrophobicContact CD2-CD1 4.28Å; L694-L1841 HydrophobicContact CD1-CD2 3.71Å
695	P	87	Confident	85.7	Confident	2 Å²	2	20.9 Å²	20.9	1%	0.013	11%	0.113	C	C	.	.			trans	-58.8	135.9	171.4	-21.6	32.9	0	0	0	111.5	T697 S700 L1650 A1653 A1654	P695-T697 HydrophobicContact CB-CG2 3.98Å; P695-T697 PolarHBondContact O-N 2.91Å; P695-T697 PolarHBondContact O-OG1 3.14Å; P695-S700 WeakPolarHBondContact O-CB 3.3Å; P695-S700 PolarHBondContact O-OG 3.45Å; P695-L1650 VanDerWaalsContact CG-O 3.28Å; P695-L1650 WeakPolarHBondContact CG-O 3.48Å; P695-A1653 HydrophobicContact CB-CB 4.19Å; P695-A1653 HydrophobicContact CG-CB 3.73Å; P695-A1654 HydrophobicContact CB-CB 4.14Å; P695-A1654 HydrophobicContact CG-CB 4.06Å
696	I	89.6	Confident	85.5	Confident	9 Å²	9	19 Å²	19	5%	0.046	10%	0.103	C	C	.	.			trans	-79.3	74.5	176.3	-52.3	-177.8	0	0	0	108.9	L640 G641 I674 L694 T721 C725	L640-I696 HydrophobicContact CB-CG2 4.33Å; L640-I696 HydrophobicContact CD1-CG2 4.29Å; G641-I696 WeakPolarHBondContact O-CD1 3.48Å; I674-I696 HydrophobicContact CG2-CG1 4.24Å; L694-I696 PolarHBondContact O-N 2.88Å; I696-T721 HydrophobicContact CB-CG2 3.98Å; I696-T721 HydrophobicContact CD1-CG2 4.41Å; I696-T721 HydrophobicContact CG2-CG2 4.23Å; I696-C725 HydrophobicContact CG2-CB 3.92Å
697	T	84.4	Confident	85.2	Confident	25 Å²	25	18.1 Å²	18.1	15%	0.153	9%	0.093	C	C	.	.	S	Bend	trans	-121	151.1	-179	50.4	0	0	0	0	110.3	P695 D699 S700 V701 C1657	P695-T697 HydrophobicContact CB-CG2 3.98Å; P695-T697 PolarHBondContact O-N 2.91Å; P695-T697 PolarHBondContact O-OG1 3.14Å; T697-D699 PolarHBondContact O-N 2.94Å; T697-D699 VanDerWaalsContact O-N 3.15Å; T697-S700 PolarHBondContact O-N 2.98Å; T697-S700 VanDerWaalsContact O-N 3.13Å; T697-S700 VanDerWaalsContact OG1-CB 3.29Å; T697-S700 WeakPolarHBondContact OG1-CB 3.15Å; T697-S700 PolarHBondContact OG1-N 2.94Å; T697-S700 PolarHBondContact OG1-OG 3.46Å; T697-V701 WeakPolarHBondContact O-CB 3.4Å; T697-V701 WeakPolarHBondContact O-CG2 3.42Å; T697-V701 PolarHBondContact O-N 3.26Å; T697-C1657 WeakPolarHBondContact CG2-SG 3.45Å
698	P	83	Confident	85	Confident	36 Å²	36	17.8 Å²	17.8	23%	0.234	9%	0.092	C	C	.	.	H	α-helix	trans	-53.1	-38	176.2	-29.5	37	0	0	0	113.3	A702 A728 L729 L737	P698-A702 WeakPolarHBondContact O-CB 3.42Å; P698-A702 PolarHBondContact O-N 2.73Å; P698-A728 HydrophobicContact CG-CB 3.64Å; P698-L729 HydrophobicContact CB-CD2 4.02Å; P698-L729 HydrophobicContact CB-CG 4.37Å; P698-L737 HydrophobicContact CB-CD1 3.75Å
699	D	76.1	Confident	84.8	Confident	51 Å²	51	20.6 Å²	20.6	27%	0.273	10%	0.102	S	C	.	.	H	α-helix	trans	-63	-53.6	175.8	178.3	86.2	0	0	0	112.5	T697 V701 A702 R703 L737	T697-D699 PolarHBondContact O-N 2.94Å; T697-D699 VanDerWaalsContact O-N 3.15Å; D699-V701 VanDerWaalsContact C-N 3.35Å; D699-V701 PolarHBondContact O-N 3.49Å; D699-A702 PolarHBondContact O-N 2.94Å; D699-R703 WeakPolarHBondContact O-CG 3.33Å; D699-R703 PolarHBondContact O-N 2.85Å; D699-R703 IonicContact OD2-CZ 3.3Å; D699-R703 IonicContact OD2-NE 2.94Å; D699-R703 PolarHBondContact OD2-NE 2.98Å; D699-R703 IonicContact OD2-NH2 3.85Å; D699-R703 PolarHBondContact OD2-NH2 3.27Å; D699-L737 HydrophobicContact CB-CD2 4.4Å
700	S	80.5	Confident	85	Confident	4 Å²	4	18 Å²	18	3%	0.028	9%	0.088	C	C	.	.	H	α-helix	trans	-66.2	-39.9	-176.6	-58.4	0	0	0	0	111.5	P695 T697 R703 V704	P695-S700 WeakPolarHBondContact O-CB 3.3Å; P695-S700 PolarHBondContact O-OG 3.45Å; T697-S700 PolarHBondContact O-N 2.98Å; T697-S700 VanDerWaalsContact O-N 3.13Å; T697-S700 VanDerWaalsContact OG1-CB 3.29Å; T697-S700 WeakPolarHBondContact OG1-CB 3.15Å; T697-S700 PolarHBondContact OG1-N 2.94Å; T697-S700 PolarHBondContact OG1-OG 3.46Å; S700-R703 PolarHBondContact O-N 3.48Å; S700-R703 PolarHBondContact OG-NH2 3.43Å; S700-V704 WeakPolarHBondContact O-CG2 3.47Å; S700-V704 PolarHBondContact O-N 2.81Å; S700-V704 VanDerWaalsContact O-N 3.11Å
701	V	88.6	Confident	85.1	Confident	0 Å²	0	19 Å²	19	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-66.9	-43.8	176.3	178.9	0	0	0	0	110.8	L638 L640 I674 T697 D699 R703 V704 I705 L729	L638-V701 HydrophobicContact CD2-CG1 4.16Å; L640-V701 HydrophobicContact CD1-CG1 4.47Å; L640-V701 HydrophobicContact CD1-CG2 4.26Å; L640-V701 HydrophobicContact CD2-CG1 4.01Å; L640-V701 HydrophobicContact CD2-CG2 3.71Å; I674-V701 HydrophobicContact CD1-CB 4.27Å; I674-V701 HydrophobicContact CD1-CG1 4.34Å; I674-V701 HydrophobicContact CD1-CG2 3.87Å; T697-V701 WeakPolarHBondContact O-CB 3.4Å; T697-V701 WeakPolarHBondContact O-CG2 3.42Å; T697-V701 PolarHBondContact O-N 3.26Å; D699-V701 VanDerWaalsContact C-N 3.35Å; D699-V701 PolarHBondContact O-N 3.49Å; V701-R703 VanDerWaalsContact C-N 3.29Å; V701-R703 PolarHBondContact O-N 3.1Å; V701-V704 PolarHBondContact O-N 2.75Å; V701-V704 VanDerWaalsContact O-N 3.16Å; V701-I705 HydrophobicContact CG1-CD1 3.86Å; V701-I705 HydrophobicContact CG1-CG1 4.31Å; V701-I705 WeakPolarHBondContact O-CG1 3.36Å; V701-I705 PolarHBondContact O-N 3.09Å; V701-L729 HydrophobicContact CB-CD1 4.02Å; V701-L729 HydrophobicContact CG1-CD1 3.53Å
702	A	83.2	Confident	85.2	Confident	4 Å²	4	19 Å²	19	3%	0.033	9%	0.094	C	C	.	.	H	α-helix	trans	-59.9	-38.5	175.2	0	0	0	0	0	112.2	P698 D699 I705 K706 L729 V751	P698-A702 WeakPolarHBondContact O-CB 3.42Å; P698-A702 PolarHBondContact O-N 2.73Å; D699-A702 PolarHBondContact O-N 2.94Å; A702-I705 PolarHBondContact O-N 3.35Å; A702-K706 VanDerWaalsContact O-CB 3.3Å; A702-K706 WeakPolarHBondContact O-CB 3.49Å; A702-K706 PolarHBondContact O-N 2.84Å; A702-L729 HydrophobicContact CB-CD2 4.4Å; A702-V751 HydrophobicContact CB-CG1 3.85Å; A702-V751 HydrophobicContact CB-CG2 4.39Å
703	R	78	Confident	85.4	Confident	63 Å²	63	19 Å²	19	24%	0.238	9%	0.094	C	C	.	.	H	α-helix	trans	-61.6	-44.5	174.2	-74.9	-170.2	-74.7	147.6	2.1	111.9	D699 S700 V701 K706 A707	D699-R703 WeakPolarHBondContact O-CG 3.33Å; D699-R703 PolarHBondContact O-N 2.85Å; D699-R703 IonicContact OD2-CZ 3.3Å; D699-R703 IonicContact OD2-NE 2.94Å; D699-R703 PolarHBondContact OD2-NE 2.98Å; D699-R703 IonicContact OD2-NH2 3.85Å; D699-R703 PolarHBondContact OD2-NH2 3.27Å; S700-R703 PolarHBondContact O-N 3.48Å; S700-R703 PolarHBondContact OG-NH2 3.43Å; V701-R703 VanDerWaalsContact C-N 3.29Å; V701-R703 PolarHBondContact O-N 3.1Å; R703-K706 PolarHBondContact O-N 2.92Å; R703-A707 VanDerWaalsContact O-CB 3.28Å; R703-A707 WeakPolarHBondContact O-CB 3.5Å; R703-A707 PolarHBondContact O-N 3.21Å
704	V	85.9	Confident	85.7	Confident	0 Å²	0	18.8 Å²	18.8	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-66.5	-42.4	176.1	175.2	0	0	0	0	111.2	L638 I674 F692 L694 S700 V701 K706 A707 E708 L1841	L638-V704 HydrophobicContact CD1-CG1 4.31Å; L638-V704 HydrophobicContact CD2-CG1 4.26Å; I674-V704 HydrophobicContact CD1-CB 3.79Å; I674-V704 HydrophobicContact CD1-CG1 4Å; I674-V704 HydrophobicContact CD1-CG2 3.73Å; I674-V704 HydrophobicContact CG1-CG1 4.41Å; I674-V704 HydrophobicContact CG1-CG2 4.14Å; F692-V704 HydrophobicContact CD1-CG2 4.39Å; F692-V704 HydrophobicContact CD2-CG1 3.97Å; F692-V704 HydrophobicContact CD2-CG2 4.2Å; F692-V704 HydrophobicContact CE2-CG1 3.74Å; F692-V704 HydrophobicContact CE2-CG2 4.49Å; F692-V704 HydrophobicContact CG-CG2 4.15Å; F692-V704 HydrophobicContact CZ-CG1 4.29Å; L694-V704 HydrophobicContact CD1-CG2 4.17Å; S700-V704 WeakPolarHBondContact O-CG2 3.47Å; S700-V704 PolarHBondContact O-N 2.81Å; S700-V704 VanDerWaalsContact O-N 3.11Å; V701-V704 PolarHBondContact O-N 2.75Å; V701-V704 VanDerWaalsContact O-N 3.16Å; V704-K706 VanDerWaalsContact C-N 3.34Å; V704-K706 PolarHBondContact O-N 3.1Å; V704-A707 PolarHBondContact O-N 2.88Å; V704-E708 HydrophobicContact CG1-CB 4.46Å; V704-E708 HydrophobicContact CG1-CG 4.07Å; V704-E708 WeakPolarHBondContact O-CB 3.48Å; V704-E708 PolarHBondContact O-N 2.86Å; V704-L1841 HydrophobicContact CG2-CD1 4.22Å
705	I	88	Confident	85.9	Confident	0 Å²	0	18.3 Å²	18.3	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-62.3	-42.6	176.2	-66	172.4	0	0	0	110.8	L638 V701 A702 A707 R709 P710 L752 Y755 C757	L638-I705 HydrophobicContact CD2-CD1 4.41Å; L638-I705 HydrophobicContact CD2-CG1 3.79Å; V701-I705 HydrophobicContact CG1-CD1 3.86Å; V701-I705 HydrophobicContact CG1-CG1 4.31Å; V701-I705 WeakPolarHBondContact O-CG1 3.36Å; V701-I705 PolarHBondContact O-N 3.09Å; A702-I705 PolarHBondContact O-N 3.35Å; I705-A707 VanDerWaalsContact C-N 3.32Å; I705-A707 PolarHBondContact O-N 3.37Å; I705-R709 WeakPolarHBondContact O-CA 3.03Å; I705-R709 PolarHBondContact O-N 3.4Å; I705-P710 HydrophobicContact CG1-CG 4.15Å; I705-L752 HydrophobicContact CD1-CD2 3.75Å; I705-Y755 HydrophobicContact CG2-CD2 3.82Å; I705-Y755 HydrophobicContact CG2-CG 4.31Å; I705-C757 HydrophobicContact CG2-CB 4.09Å
706	K	79.3	Confident	86.1	Confident	72 Å²	72	19.2 Å²	19.2	31%	0.313	10%	0.098	S	C	.	.	H	α-helix	trans	-59.7	-42.7	175.1	-176.6	178.7	178.9	-175.4	0	111.4	A702 R703 V704 R709 Y755	A702-K706 VanDerWaalsContact O-CB 3.3Å; A702-K706 WeakPolarHBondContact O-CB 3.49Å; A702-K706 PolarHBondContact O-N 2.84Å; R703-K706 PolarHBondContact O-N 2.92Å; V704-K706 VanDerWaalsContact C-N 3.34Å; V704-K706 PolarHBondContact O-N 3.1Å; K706-R709 VanDerWaalsContact O-CZ 3.25Å; K706-R709 PolarHBondContact O-NE 3.23Å; K706-R709 PolarHBondContact O-NH1 3.28Å; K706-Y755 HydrophobicContact CB-CE2 3.75Å; K706-Y755 WeakPolarHBondContact CD-OH 3.45Å; K706-Y755 HydrophobicContact CG-CE2 4.17Å; K706-Y755 WeakPolarHBondContact CG-OH 3.36Å
707	A	73.8	Confident	86.2	Confident	11 Å²	11	18.9 Å²	18.9	9%	0.091	10%	0.096	C	C	.	.	H	α-helix	trans	-83.7	-35.2	-173.5	0	0	0	0	0	114.8	R703 V704 I705 L1841 R2199	R703-A707 VanDerWaalsContact O-CB 3.28Å; R703-A707 WeakPolarHBondContact O-CB 3.5Å; R703-A707 PolarHBondContact O-N 3.21Å; V704-A707 PolarHBondContact O-N 2.88Å; I705-A707 VanDerWaalsContact C-N 3.32Å; I705-A707 PolarHBondContact O-N 3.37Å; A707-L1841 HydrophobicContact CB-CD1 3.88Å; A707-R2199 PolarHBondContact O-NH1 3.22Å
708	E	82.2	Confident	86.4	Confident	1 Å²	1	17.7 Å²	17.7	1%	0.005	9%	0.089	C	C	.	.	H	α-helix	trans	-106.4	-13.6	-173.3	-63.1	-67.5	153.5	0	0	113.7	K636 L672 K690 F692 V704 R2199	K636-E708 PolarHBondContact NZ-O 2.98Å; L672-E708 HydrophobicContact CD1-CB 3.48Å; L672-E708 VanDerWaalsContact CD1-CB 3.48Å; L672-E708 HydrophobicContact CD1-CG 3.98Å; K690-E708 IonicContact NZ-OE1 2.73Å; K690-E708 PolarHBondContact NZ-OE1 3.3Å; K690-E708 IonicContact NZ-OE2 3.34Å; K690-E708 PolarHBondContact NZ-OE2 3.44Å; F692-E708 HydrophobicContact CE2-CG 4.13Å; F692-E708 HydrophobicContact CZ-CG 3.8Å; V704-E708 HydrophobicContact CG1-CB 4.46Å; V704-E708 HydrophobicContact CG1-CG 4.07Å; V704-E708 WeakPolarHBondContact O-CB 3.48Å; V704-E708 PolarHBondContact O-N 2.86Å; E708-R2199 IonicContact OE1-CZ 2.78Å; E708-R2199 IonicContact OE1-NH1 3.38Å; E708-R2199 PolarHBondContact OE1-NH1 3.47Å; E708-R2199 IonicContact OE1-NH2 2.94Å; E708-R2199 PolarHBondContact OE1-NH2 3.43Å; E708-R2199 VanDerWaalsContact OE1-NH2 3.15Å; E708-R2199 IonicContact OE2-NH1 3.87Å
709	R	85.5	Confident	86.6	Confident	62 Å²	62	16 Å²	16	23%	0.234	8%	0.078	C	C	.	.			trans	48.6	53.8	178.2	-55.4	-59.6	-169.9	-163.5	5.5	114.4	I705 K706 V2209	I705-R709 WeakPolarHBondContact O-CA 3.03Å; I705-R709 PolarHBondContact O-N 3.4Å; K706-R709 VanDerWaalsContact O-CZ 3.25Å; K706-R709 PolarHBondContact O-NE 3.23Å; K706-R709 PolarHBondContact O-NH1 3.28Å; R709-V2209 HydrophobicContact CG-CG1 4.04Å
710	P	92.1	Very high	86.8	Confident	1 Å²	1	14.9 Å²	14.9	1%	0.006	7%	0.071	C	C	.	.			trans	-67.3	143.7	176	29.4	-33.6	0	0	0	111.8	K636 L638 L672 I705 C757	K636-P710 HydrophobicContact CG-CB 4.42Å; L638-P710 HydrophobicContact CB-CB 3.97Å; L638-P710 HydrophobicContact CB-CG 3.92Å; L638-P710 HydrophobicContact CD2-CG 4.36Å; L672-P710 HydrophobicContact CD1-CB 4.16Å; L672-P710 HydrophobicContact CD1-CG 4.45Å; I705-P710 HydrophobicContact CG1-CG 4.15Å; P710-C757 WeakPolarHBondContact O-CB 2.98Å; P710-C757 PolarHBondContact O-SG 3.06Å; P710-C757 VanDerWaalsContact O-SG 3.35Å
711	D	91.4	Very high	86.9	Confident	37 Å²	37	15.1 Å²	15.1	20%	0.198	7%	0.072	C	C	.	.	S	Bend	trans	-75.9	-28.2	177.2	-52.3	-58.4	0	0	0	111.6	P634 R635 K636 R758	P634-D711 HydrophobicContact CB-CB 3.99Å; R635-D711 WeakPolarHBondContact CA-OD2 3.41Å; R635-D711 PolarHBondContact N-OD2 2.66Å; K636-D711 PolarHBondContact N-OD2 2.91Å; K636-D711 PolarHBondContact O-N 3.13Å; D711-R758 PolarHBondContact O-N 2.89Å
712	G	92.8	Very high	86.9	Confident	0 Å²	0	15.1 Å²	15.1	0%	0	7%	0.072	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	156.1	-178.3	0	0	0	0	0	114.6	K636 V637 L638 R758	K636-G712 PolarHBondContact O-N 3.34Å; V637-G712 CarbonylContact C-O 3.54Å; V637-G712 WeakPolarHBondContact CA-O 3.19Å; L638-G712 PolarHBondContact N-O 2.86Å; G712-R758 CarbonylContact C-O 3.54Å; G712-R758 VanDerWaalsContact CA-O 3.24Å; G712-R758 WeakPolarHBondContact CA-O 3.43Å
713	L	95	Very high	87.1	Confident	0 Å²	0	15 Å²	15	0%	0	7%	0.071	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	125.9	179.3	177.4	62.3	0	0	0	109.9	L638 L640 I715 L729 L752 R758 I759 L760	L638-L713 HydrophobicContact CB-CD1 4.05Å; L638-L713 HydrophobicContact CD2-CD1 3.94Å; L638-L713 HydrophobicContact CG-CD1 3.77Å; L638-L713 CarbonylContact O-C 3.58Å; L638-L713 VanDerWaalsContact O-CA 3.32Å; L638-L713 WeakPolarHBondContact O-CA 3.37Å; L638-L713 WeakPolarHBondContact O-CD1 3.49Å; L640-L713 HydrophobicContact CD1-CD1 4.19Å; L640-L713 HydrophobicContact CD2-CD1 4.12Å; L640-L713 HydrophobicContact CG-CD1 3.82Å; L713-I715 HydrophobicContact CD1-CG2 4.43Å; L713-I715 HydrophobicContact CD2-CG2 4.11Å; L713-I715 HydrophobicContact CG-CG2 3.87Å; L713-L729 HydrophobicContact CD2-CD1 4.32Å; L713-L752 HydrophobicContact CD2-CD2 4.04Å; L713-R758 PolarHBondContact N-O 2.68Å; L713-I759 HydrophobicContact CB-CD1 4.11Å; L713-I759 HydrophobicContact CD2-CD1 3.7Å; L713-I759 HydrophobicContact CG-CD1 3.97Å; L713-I759 WeakPolarHBondContact O-CA 3.45Å; L713-L760 PolarHBondContact O-N 3.37Å
714	L	95.1	Very high	87.3	Confident	2 Å²	2	14.5 Å²	14.5	1%	0.01	8%	0.077	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	119.5	175.6	-74.3	172.5	0	0	0	110.3	V637 L638 L639 L640 L664 F717 L760	V637-L714 HydrophobicContact CG1-CD1 3.84Å; V637-L714 HydrophobicContact CG1-CG 3.92Å; L638-L714 PolarHBondContact O-N 3.34Å; L639-L714 HydrophobicContact CD1-CB 3.58Å; L639-L714 HydrophobicContact CD1-CD1 4.17Å; L640-L714 PolarHBondContact N-O 3.44Å; L664-L714 HydrophobicContact CD1-CD1 3.89Å; L664-L714 HydrophobicContact CD2-CD1 4.29Å; L664-L714 HydrophobicContact CG-CD1 4.46Å; L714-F717 HydrophobicContact CB-CD2 4.26Å; L714-F717 HydrophobicContact CD1-CE2 4.4Å; L714-F717 HydrophobicContact CD2-CE2 4.04Å; L714-L760 HydrophobicContact CD2-CB 3.58Å; L714-L760 HydrophobicContact CD2-CD1 4.49Å; L714-L760 HydrophobicContact CG-CB 4.29Å; L714-L760 HydrophobicContact CG-CD1 4.49Å
715	I	92.3	Very high	87.3	Confident	5 Å²	5	14.7 Å²	14.7	3%	0.026	8%	0.079	C	C	.	.			trans	-115	-16.5	-177.5	64.1	171.1	0	0	0	114.5	L640 L713 F717 S722 L723 I759 I764	L640-I715 HydrophobicContact CD1-CG2 4.14Å; L713-I715 HydrophobicContact CD1-CG2 4.43Å; L713-I715 HydrophobicContact CD2-CG2 4.11Å; L713-I715 HydrophobicContact CG-CG2 3.87Å; I715-F717 PolarHBondContact O-N 3.04Å; I715-S722 VanDerWaalsContact C-OG 3.31Å; I715-S722 WeakPolarHBondContact CA-OG 3.38Å; I715-S722 WeakPolarHBondContact O-CB 3.32Å; I715-S722 PolarHBondContact O-OG 3.35Å; I715-L723 HydrophobicContact CB-CD2 4.34Å; I715-L723 HydrophobicContact CD1-CD2 3.87Å; I715-L723 HydrophobicContact CG1-CD2 3.9Å; I715-I759 HydrophobicContact CD1-CD1 4.23Å; I715-I759 HydrophobicContact CD1-CG2 4.33Å; I715-I759 HydrophobicContact CG1-CG2 4.3Å; I715-I759 HydrophobicContact CG2-CD1 4.09Å; I715-I764 HydrophobicContact CD1-CD1 3.59Å
716	A	91	Very high	87.2	Confident	21 Å²	21	14.7 Å²	14.7	17%	0.174	8%	0.079	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-9	-174.5	0	0	0	0	0	114.7	R944 L945	A716-R944 HydrophobicContact CB-CB 4.13Å; A716-L945 PolarHBondContact O-N 3.43Å
717	F	93.2	Very high	87.5	Confident	2 Å²	2	12.4 Å²	12.4	1%	0.009	7%	0.07	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.5	-17.3	-173.1	-63.5	-91.6	0	0	0	113.9	L639 A660 L714 I715 L945 A961 A964 A965	L639-F717 HydrophobicContact CD1-CB 4.01Å; L639-F717 HydrophobicContact CD1-CD2 4.19Å; L639-F717 HydrophobicContact CD1-CG 4.32Å; A660-F717 HydrophobicContact CB-CD1 3.74Å; A660-F717 HydrophobicContact CB-CD2 4.33Å; A660-F717 HydrophobicContact CB-CE1 3.87Å; A660-F717 HydrophobicContact CB-CE2 4.47Å; A660-F717 HydrophobicContact CB-CG 3.99Å; A660-F717 HydrophobicContact CB-CZ 4.24Å; L714-F717 HydrophobicContact CB-CD2 4.26Å; L714-F717 HydrophobicContact CD1-CE2 4.4Å; L714-F717 HydrophobicContact CD2-CE2 4.04Å; I715-F717 PolarHBondContact O-N 3.04Å; F717-L945 HydrophobicContact CD1-CD2 4.18Å; F717-L945 HydrophobicContact CD1-CG 4.27Å; F717-L945 HydrophobicContact CE1-CD2 3.97Å; F717-L945 HydrophobicContact CE1-CG 4.41Å; F717-L945 HydrophobicContact CZ-CD2 4.41Å; F717-A961 HydrophobicContact CD1-CB 4.49Å; F717-A961 HydrophobicContact CE1-CB 4.26Å; F717-A961 WeakPolarHBondContact CE1-O 3.18Å; F717-A964 HydrophobicContact CE1-CB 4.41Å; F717-A964 HydrophobicContact CZ-CB 4.2Å; F717-A965 HydrophobicContact CE1-CB 4.21Å; F717-A965 HydrophobicContact CZ-CB 3.85Å
718	G	88.2	Confident	87.9	Confident	0 Å²	0	13.6 Å²	13.6	0%	0	8%	0.079	C	C	.	.	S	Bend	trans	-100.6	21.8	-175.1	0	0	0	0	0	114.8	L640 G641 S642 S722	L640-G718 WeakPolarHBondContact O-CA 3.37Å; G641-G718 WeakPolarHBondContact O-CA 3.42Å; S642-G718 WeakPolarHBondContact CA-O 3.26Å; G718-S722 WeakPolarHBondContact O-CB 3.49Å; G718-S722 PolarHBondContact O-N 3.46Å
719	G	85.7	Confident	88	Confident	0 Å²	0	13.5 Å²	13.5	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	61.2	-157.3	-178.9	0	0	0	0	0	114.2	T721 S722 L723	G719-T721 PolarHBondContact O-N 3Å; G719-S722 PolarHBondContact O-N 3.18Å; G719-L723 PolarHBondContact O-N 3.48Å; G719-L723 VanDerWaalsContact O-N 3.1Å
720	Q	80.6	Confident	87.8	Confident	27 Å²	27	12 Å²	12	13%	0.126	8%	0.077	C	C	.	.	H	α-helix	trans	-68.5	-29.7	-175.5	-71.5	-62.8	-8.6	0	0	114.3	S722 L723 S724 E771 L818	Q720-S722 VanDerWaalsContact C-N 3.32Å; Q720-S722 PolarHBondContact O-N 3.44Å; Q720-L723 PolarHBondContact O-N 3.01Å; Q720-S724 WeakPolarHBondContact O-CB 3.01Å; Q720-S724 PolarHBondContact O-N 2.94Å; Q720-S724 PolarHBondContact O-OG 3.3Å; Q720-E771 PolarHBondContact NE2-OE1 2.9Å; Q720-L818 HydrophobicContact CB-CD1 3.79Å; Q720-L818 HydrophobicContact CG-CB 4.38Å; Q720-L818 HydrophobicContact CG-CD1 3.35Å; Q720-L818 HydrophobicContact CG-CG 4.45Å
721	T	83.1	Confident	86.9	Confident	9 Å²	9	18.3 Å²	18.3	6%	0.055	10%	0.104	C	C	.	.	H	α-helix	trans	-60.6	-46.7	177.5	-51.4	0	0	0	0	110.2	S642 Q649 I696 G719 C725	S642-T721 WeakPolarHBondContact O-CB 3.4Å; S642-T721 PolarHBondContact O-OG1 3.13Å; Q649-T721 PolarHBondContact NE2-OG1 2.88Å; Q649-T721 PolarHBondContact OE1-OG1 3.09Å; I696-T721 HydrophobicContact CB-CG2 3.98Å; I696-T721 HydrophobicContact CD1-CG2 4.41Å; I696-T721 HydrophobicContact CG2-CG2 4.23Å; G719-T721 PolarHBondContact O-N 3Å; T721-C725 WeakPolarHBondContact O-CB 3.46Å; T721-C725 PolarHBondContact O-N 3.11Å; T721-C725 VanDerWaalsContact O-N 3.13Å
722	S	89.5	Confident	85.1	Confident	0 Å²	0	22.5 Å²	22.5	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-64.9	-48.3	175.2	168.8	0	0	0	0	112.5	L640 I715 G718 G719 Q720 S724 C725 G726	L640-S722 WeakPolarHBondContact CB-OG 3.27Å; I715-S722 VanDerWaalsContact C-OG 3.31Å; I715-S722 WeakPolarHBondContact CA-OG 3.38Å; I715-S722 WeakPolarHBondContact O-CB 3.32Å; I715-S722 PolarHBondContact O-OG 3.35Å; G718-S722 WeakPolarHBondContact O-CB 3.49Å; G718-S722 PolarHBondContact O-N 3.46Å; G719-S722 PolarHBondContact O-N 3.18Å; Q720-S722 VanDerWaalsContact C-N 3.32Å; Q720-S722 PolarHBondContact O-N 3.44Å; S722-S724 PolarHBondContact O-N 2.63Å; S722-C725 PolarHBondContact O-N 3.12Å; S722-G726 PolarHBondContact O-N 3.2Å
723	L	86.7	Confident	83	Confident	2 Å²	2	24.1 Å²	24.1	1%	0.01	15%	0.148	C	C	.	.	H	α-helix	trans	-60.2	-47.9	178.6	-75.5	-171.6	0	0	0	112.3	I715 G719 Q720 C725 G726 L727 V767 R944	I715-L723 HydrophobicContact CB-CD2 4.34Å; I715-L723 HydrophobicContact CD1-CD2 3.87Å; I715-L723 HydrophobicContact CG1-CD2 3.9Å; G719-L723 PolarHBondContact O-N 3.48Å; G719-L723 VanDerWaalsContact O-N 3.1Å; Q720-L723 PolarHBondContact O-N 3.01Å; L723-C725 VanDerWaalsContact C-N 3.29Å; L723-C725 PolarHBondContact O-N 3.49Å; L723-G726 PolarHBondContact O-N 3.04Å; L723-G726 VanDerWaalsContact O-N 3.14Å; L723-L727 WeakPolarHBondContact O-CB 3.37Å; L723-L727 WeakPolarHBondContact O-CG 3.43Å; L723-L727 PolarHBondContact O-N 3.49Å; L723-V767 HydrophobicContact CD1-CG1 4.09Å; L723-V767 HydrophobicContact CD2-CG1 4.15Å; L723-R944 HydrophobicContact CD1-CG 3.93Å; L723-R944 VanDerWaalsContact CD1-NE 3.32Å
724	S	81.2	Confident	80.8	Confident	52 Å²	52	24.7 Å²	24.7	36%	0.364	15%	0.151	S	C	.	.	H	α-helix	trans	-60.3	-41.9	-179.8	-61.5	0	0	0	0	111.1	Q720 S722 A728	Q720-S724 WeakPolarHBondContact O-CB 3.01Å; Q720-S724 PolarHBondContact O-N 2.94Å; Q720-S724 PolarHBondContact O-OG 3.3Å; S722-S724 PolarHBondContact O-N 2.63Å; S724-A728 VanDerWaalsContact O-CB 3.31Å; S724-A728 WeakPolarHBondContact O-CB 3.31Å; S724-A728 PolarHBondContact O-N 3.22Å
725	C	86.3	Confident	78.3	Confident	5 Å²	5	26.7 Å²	26.7	3%	0.034	17%	0.166	C	C	.	.	H	α-helix	trans	-66	-44.1	174.3	-173.7	0	0	0	0	111.9	L640 I696 T721 S722 L723 A728 L729	L640-C725 HydrophobicContact CD1-CB 4.37Å; I696-C725 HydrophobicContact CG2-CB 3.92Å; T721-C725 WeakPolarHBondContact O-CB 3.46Å; T721-C725 PolarHBondContact O-N 3.11Å; T721-C725 VanDerWaalsContact O-N 3.13Å; S722-C725 PolarHBondContact O-N 3.12Å; L723-C725 VanDerWaalsContact C-N 3.29Å; L723-C725 PolarHBondContact O-N 3.49Å; C725-A728 PolarHBondContact O-N 2.97Å; C725-L729 VanDerWaalsContact O-CG 3.32Å; C725-L729 WeakPolarHBondContact O-CG 3.08Å; C725-L729 PolarHBondContact O-N 3.2Å
726	G	87.4	Confident	76.1	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-59.5	-47.8	177.5	0	0	0	0	0	113	S722 L723 A728 L729 T730	S722-G726 PolarHBondContact O-N 3.2Å; L723-G726 PolarHBondContact O-N 3.04Å; L723-G726 VanDerWaalsContact O-N 3.14Å; G726-A728 VanDerWaalsContact C-N 3.34Å; G726-A728 PolarHBondContact O-N 3.04Å; G726-L729 WeakPolarHBondContact O-CB 3.25Å; G726-L729 PolarHBondContact O-N 3.41Å; G726-T730 PolarHBondContact O-N 3.39Å
727	L	84.3	Confident	74.2	Confident	24 Å²	24	33.2 Å²	33.2	13%	0.126	21%	0.205	C	C	.	.	H	α-helix	trans	-64.2	-36	175.6	-70.9	169.1	0	0	0	112.3	L723 L729 T730 K731 I764 V767 E768	L723-L727 WeakPolarHBondContact O-CB 3.37Å; L723-L727 WeakPolarHBondContact O-CG 3.43Å; L723-L727 PolarHBondContact O-N 3.49Å; L727-L729 VanDerWaalsContact C-N 3.3Å; L727-L729 PolarHBondContact O-N 3.37Å; L727-T730 PolarHBondContact O-N 2.93Å; L727-T730 PolarHBondContact O-OG1 3.15Å; L727-K731 WeakPolarHBondContact O-CG 3.41Å; L727-I764 HydrophobicContact CD2-CD1 4.23Å; L727-I764 HydrophobicContact CD2-CG2 3.69Å; L727-V767 HydrophobicContact CD1-CG1 4.33Å; L727-E768 HydrophobicContact CD2-CG 3.79Å
728	A	82.7	Confident	72.1	Confident	35 Å²	35	33.9 Å²	33.9	29%	0.289	21%	0.209	S	C	.	.	H	α-helix	trans	-68.3	-30.3	175.5	0	0	0	0	0	112.5	P698 S724 C725 G726	P698-A728 HydrophobicContact CG-CB 3.64Å; S724-A728 VanDerWaalsContact O-CB 3.31Å; S724-A728 WeakPolarHBondContact O-CB 3.31Å; S724-A728 PolarHBondContact O-N 3.22Å; C725-A728 PolarHBondContact O-N 2.97Å; G726-A728 VanDerWaalsContact C-N 3.34Å; G726-A728 PolarHBondContact O-N 3.04Å
729	L	84.6	Confident	70.1	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-73.1	-25.4	177.7	-72.6	165.5	0	0	0	113.2	P698 V701 A702 L713 C725 G726 L727 S734 N750 L752	P698-L729 HydrophobicContact CB-CD2 4.02Å; P698-L729 HydrophobicContact CB-CG 4.37Å; V701-L729 HydrophobicContact CB-CD1 4.02Å; V701-L729 HydrophobicContact CG1-CD1 3.53Å; A702-L729 HydrophobicContact CB-CD2 4.4Å; L713-L729 HydrophobicContact CD2-CD1 4.32Å; C725-L729 VanDerWaalsContact O-CG 3.32Å; C725-L729 WeakPolarHBondContact O-CG 3.08Å; C725-L729 PolarHBondContact O-N 3.2Å; G726-L729 WeakPolarHBondContact O-CB 3.25Å; G726-L729 PolarHBondContact O-N 3.41Å; L727-L729 VanDerWaalsContact C-N 3.3Å; L727-L729 PolarHBondContact O-N 3.37Å; L729-S734 PolarHBondContact O-OG 3.11Å; L729-N750 WeakPolarHBondContact O-CB 3.42Å; L729-L752 HydrophobicContact CB-CD1 4.43Å; L729-L752 HydrophobicContact CB-CG 4.36Å
730	T	80.1	Confident	68.2	Low	31 Å²	31	42.5 Å²	42.5	19%	0.19	26%	0.261	C	S	.	.	H	α-helix	trans	-83.3	-24.1	179.7	58	0	0	0	0	113.6	G726 L727 N750 L752 I764	G726-T730 PolarHBondContact O-N 3.39Å; L727-T730 PolarHBondContact O-N 2.93Å; L727-T730 PolarHBondContact O-OG1 3.15Å; T730-N750 PolarHBondContact O-ND2 2.8Å; T730-L752 HydrophobicContact CG2-CD1 3.77Å; T730-I764 HydrophobicContact CG2-CD1 4.34Å; T730-I764 HydrophobicContact CG2-CG1 4.13Å
731	K	74.3	Confident	66.4	Low	133 Å²	133	43.6 Å²	43.6	58%	0.578	27%	0.267	S	S	*	.	S	Bend	trans	-64.6	137.8	-177.1	-74.4	177.8	-177.5	-178.1	0	112.7	L727 S734	L727-K731 WeakPolarHBondContact O-CG 3.41Å; K731-S734 VanDerWaalsContact O-CB 3.32Å; K731-S734 WeakPolarHBondContact O-CB 3.43Å; K731-S734 PolarHBondContact O-N 3.37Å; K731-S734 PolarHBondContact O-OG 2.97Å
732	V	53.2	Low	64.6	Low	124 Å²	124	52.3 Å²	52.3	75%	0.752	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	132.7	177.5	-177.2	0	0	0	0	110.5	S749	V732-S749 WeakPolarHBondContact CA-O 3.44Å
733	G	49.5	Very low	62.7	Low	35 Å²	35	55 Å²	55	36%	0.361	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	94.6	-3.1	-174.7	0	0	0	0	0	114.9	S735 S736	G733-S735 PolarHBondContact O-N 2.85Å; G733-S735 VanDerWaalsContact O-N 3.09Å; G733-S736 PolarHBondContact O-N 2.95Å; G733-S736 PolarHBondContact O-OG 3.16Å
734	S	47.3	Very low	60.8	Low	11 Å²	11	62.5 Å²	62.5	8%	0.077	37%	0.367	C	S	.	.	G	3₁₀ helix	trans	-60.9	-11.4	164.2	59.3	0	0	0	0	112.1	L729 K731 S736 L737	L729-S734 PolarHBondContact O-OG 3.11Å; K731-S734 VanDerWaalsContact O-CB 3.32Å; K731-S734 WeakPolarHBondContact O-CB 3.43Å; K731-S734 PolarHBondContact O-N 3.37Å; K731-S734 PolarHBondContact O-OG 2.97Å; S734-S736 PolarHBondContact O-N 2.93Å; S734-L737 WeakPolarHBondContact O-CB 3Å; S734-L737 WeakPolarHBondContact O-CD1 3.22Å; S734-L737 VanDerWaalsContact O-CG 3.28Å; S734-L737 WeakPolarHBondContact O-CG 3.49Å; S734-L737 PolarHBondContact O-N 3.21Å
735	S	43.3	Very low	59.2	Low	45 Å²	45	63.5 Å²	63.5	32%	0.315	37%	0.368	S	S	.	.	G	3₁₀ helix	trans	-55.2	-26.1	166	59.3	0	0	0	0	114.3	G733 L737 I738	G733-S735 PolarHBondContact O-N 2.85Å; G733-S735 VanDerWaalsContact O-N 3.09Å; S735-L737 PolarHBondContact O-N 3.4Å; S735-L737 VanDerWaalsContact O-N 3.09Å; S735-I738 CarbonylContact O-C 3.45Å; S735-I738 PolarHBondContact O-N 2.79Å; S735-I738 VanDerWaalsContact O-O 3.1Å
736	S	47	Very low	57.3	Low	102 Å²	102	67.2 Å²	67.2	71%	0.713	39%	0.394	S	S	*	.	G	3₁₀ helix	trans	-60.8	-15.6	172.3	56.3	0	0	0	0	113.6	G733 S734 I738	G733-S736 PolarHBondContact O-N 2.95Å; G733-S736 PolarHBondContact O-OG 3.16Å; S734-S736 PolarHBondContact O-N 2.93Å; S736-I738 VanDerWaalsContact C-N 3.26Å
737	L	50.2	Low	55.4	Low	60 Å²	60	75.4 Å²	75.4	31%	0.314	43%	0.43	S	S	.	.	G	3₁₀ helix	trans	-74.6	-13.5	171.3	-60.9	164.2	0	0	0	112.9	P698 D699 S734 S735	P698-L737 HydrophobicContact CB-CD1 3.75Å; D699-L737 HydrophobicContact CB-CD2 4.4Å; S734-L737 WeakPolarHBondContact O-CB 3Å; S734-L737 WeakPolarHBondContact O-CD1 3.22Å; S734-L737 VanDerWaalsContact O-CG 3.28Å; S734-L737 WeakPolarHBondContact O-CG 3.49Å; S734-L737 PolarHBondContact O-N 3.21Å; S735-L737 PolarHBondContact O-N 3.4Å; S735-L737 VanDerWaalsContact O-N 3.09Å
738	I	49	Very low	53.7	Low	17 Å²	17	78.2 Å²	78.2	9%	0.087	44%	0.441	C	S	.	.			trans	-129.1	91.2	-179.3	-51.1	174.9	0	0	0	108.6	S735 S736 D740 V751 L754 Y755	S735-I738 CarbonylContact O-C 3.45Å; S735-I738 PolarHBondContact O-N 2.79Å; S735-I738 VanDerWaalsContact O-O 3.1Å; S736-I738 VanDerWaalsContact C-N 3.26Å; I738-D740 PolarHBondContact O-N 3.03Å; I738-V751 HydrophobicContact CD1-CG1 4.21Å; I738-V751 HydrophobicContact CD1-CG2 3.88Å; I738-V751 HydrophobicContact CG1-CG2 4.5Å; I738-L754 HydrophobicContact CD1-CD2 3.84Å; I738-Y755 HydrophobicContact CD1-CE2 3.72Å
739	P	46	Very low	52.6	Low	103 Å²	103	78.9 Å²	78.9	67%	0.669	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-5	-172.2	22.3	-31.2	0	0	0	116
740	D	45.8	Very low	52.2	Low	77 Å²	77	79.8 Å²	79.8	41%	0.412	45%	0.448	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	9.1	-170.3	-68.1	-36.8	0	0	0	115.7	I738 K742 Q1832	I738-D740 PolarHBondContact O-N 3.03Å; D740-K742 PolarHBondContact O-N 2.77Å; D740-K742 VanDerWaalsContact O-N 3.12Å; D740-Q1832 PolarHBondContact OD1-NE2 3.45Å; D740-Q1832 VanDerWaalsContact OD1-NE2 3.15Å
741	L	43.6	Very low	52.1	Low	50 Å²	50	78.3 Å²	78.3	26%	0.262	44%	0.439	S	S	.	.			trans	-74.1	105.3	-177.7	-71.5	162.3	0	0	0	112.1	D745 L754	L741-D745 HydrophobicContact CD2-CB 3.56Å; L741-L754 HydrophobicContact CD1-CD2 4.46Å; L741-L754 HydrophobicContact CD2-CD1 3.76Å; L741-L754 HydrophobicContact CD2-CD2 3.95Å
742	K	43.8	Very low	52.7	Low	192 Å²	192	72.4 Å²	72.4	84%	0.835	41%	0.414	S	S	*	.			trans	-110.7	145.2	167.4	-67.7	-174.8	-179.8	179.6	0	110.1	D740	D740-K742 PolarHBondContact O-N 2.77Å; D740-K742 VanDerWaalsContact O-N 3.12Å
743	G	49.5	Very low	54.1	Low	56 Å²	56	70.2 Å²	70.2	58%	0.577	40%	0.398	S	S	*	.	G	3₁₀ helix	trans	80.7	-152.4	172.7	0	0	0	0	0	115	D745 S746	G743-D745 PolarHBondContact O-N 3.35Å; G743-S746 WeakPolarHBondContact O-CB 3.31Å; G743-S746 PolarHBondContact O-N 3.34Å; G743-S746 PolarHBondContact O-OG 3.08Å
744	E	47.8	Very low	55.5	Low	161 Å²	161	69.6 Å²	69.6	75%	0.752	39%	0.386	S	S	*	.	G	3₁₀ helix	trans	-58.8	-26	-175	-82.5	-171.7	149.9	0	0	114.2	S746 K747	E744-S746 PolarHBondContact O-N 3.27Å; E744-K747 VanDerWaalsContact O-CB 3.3Å; E744-K747 WeakPolarHBondContact O-CB 3.38Å; E744-K747 PolarHBondContact O-N 3.08Å
745	D	47.2	Very low	57.1	Low	73 Å²	73	70.8 Å²	70.8	39%	0.39	39%	0.39	S	S	.	.	G	3₁₀ helix	trans	-65.1	-20.2	176	-75.4	-45	0	0	0	113.3	L741 G743 K747 K748 L754	L741-D745 HydrophobicContact CD2-CB 3.56Å; G743-D745 PolarHBondContact O-N 3.35Å; D745-K747 PolarHBondContact O-N 3.43Å; D745-K748 PolarHBondContact O-N 2.89Å; D745-K748 VanDerWaalsContact O-N 3.1Å; D745-K748 WeakPolarHBondContact OD1-CE 3.46Å; D745-K748 IonicContact OD1-NZ 2.79Å; D745-L754 HydrophobicContact CB-CD1 4.16Å
746	S	46.6	Very low	59	Low	83 Å²	83	75.3 Å²	75.3	58%	0.58	41%	0.41	S	S	*	.	G	3₁₀ helix	trans	-64.3	-15.8	169.9	66.2	0	0	0	0	113.5	G743 E744	G743-S746 WeakPolarHBondContact O-CB 3.31Å; G743-S746 PolarHBondContact O-N 3.34Å; G743-S746 PolarHBondContact O-OG 3.08Å; E744-S746 PolarHBondContact O-N 3.27Å
747	K	47.9	Very low	61	Low	171 Å²	171	70.7 Å²	70.7	74%	0.743	38%	0.378	S	S	*	.	G	3₁₀ helix	trans	-84.6	-13.1	173.6	-66.2	-178.7	177.3	172.3	0	113.5	E744 D745	E744-K747 VanDerWaalsContact O-CB 3.3Å; E744-K747 WeakPolarHBondContact O-CB 3.38Å; E744-K747 PolarHBondContact O-N 3.08Å; D745-K747 PolarHBondContact O-N 3.43Å
748	K	48.3	Very low	62.8	Low	84 Å²	84	70.4 Å²	70.4	37%	0.365	37%	0.372	S	S	.	.			trans	-71.8	133.3	174.8	-67.8	-170.6	-175.6	179.1	0	109.8	D745 L754	D745-K748 PolarHBondContact O-N 2.89Å; D745-K748 VanDerWaalsContact O-N 3.1Å; D745-K748 WeakPolarHBondContact OD1-CE 3.46Å; D745-K748 IonicContact OD1-NZ 2.79Å; K748-L754 HydrophobicContact CD-CB 4.34Å; K748-L754 HydrophobicContact CD-CD1 3.86Å; K748-L754 PolarHBondContact NZ-O 3.41Å
749	S	59.5	Low	64.8	Low	49 Å²	49	71.3 Å²	71.3	34%	0.343	38%	0.377	S	S	.	.			trans	-66.8	-40	-169.7	18.2	0	0	0	0	113.9	V732 D753	V732-S749 WeakPolarHBondContact CA-O 3.44Å; S749-D753 PolarHBondContact OG-OD2 3.27Å
750	N	76.7	Confident	67	Low	18 Å²	18	66.6 Å²	66.6	10%	0.096	35%	0.346	C	S	.	.	S	Bend	trans	-152.4	172	-170.2	66.3	50.6	0	0	0	113.1	L729 T730 L752 D753 L754	L729-N750 WeakPolarHBondContact O-CB 3.42Å; T730-N750 PolarHBondContact O-ND2 2.8Å; N750-L752 VanDerWaalsContact C-N 3.32Å; N750-L752 PolarHBondContact O-N 2.81Å; N750-L752 WeakPolarHBondContact OD1-CA 3.32Å; N750-L752 WeakPolarHBondContact OD1-CB 3.21Å; N750-L752 PolarHBondContact OD1-N 3.32Å; N750-D753 VanDerWaalsContact CG-OD2 3.26Å; N750-D753 PolarHBondContact ND2-OD2 3.47Å; N750-D753 PolarHBondContact O-N 3.28Å; N750-D753 VanDerWaalsContact OD1-CG 3.22Å; N750-D753 PolarHBondContact OD1-N 3.21Å; N750-D753 PolarHBondContact OD1-OD2 3.22Å; N750-L754 WeakPolarHBondContact O-CB 3.24Å; N750-L754 PolarHBondContact O-N 2.93Å
751	V	78.3	Confident	69.2	Low	1 Å²	1	63.1 Å²	63.1	1%	0.006	33%	0.329	C	S	.	.	H	α-helix	trans	-63.1	-33.5	-177.9	175.8	0	0	0	0	113.2	A702 I738 L754 Y755	A702-V751 HydrophobicContact CB-CG1 3.85Å; A702-V751 HydrophobicContact CB-CG2 4.39Å; I738-V751 HydrophobicContact CD1-CG1 4.21Å; I738-V751 HydrophobicContact CD1-CG2 3.88Å; I738-V751 HydrophobicContact CG1-CG2 4.5Å; V751-L754 PolarHBondContact O-N 2.97Å; V751-Y755 HydrophobicContact CG1-CD2 3.9Å; V751-Y755 HydrophobicContact CG1-CE2 4.08Å; V751-Y755 WeakPolarHBondContact O-CD2 3.2Å; V751-Y755 PolarHBondContact O-N 3.25Å
752	L	86.7	Confident	71.5	Confident	8 Å²	8	61.3 Å²	61.3	4%	0.042	32%	0.32	C	S	.	.	H	α-helix	trans	-67.9	-47	-179.2	-66.5	-175.7	0	0	0	111.1	I705 L713 L729 T730 N750 L754 Y755 N756 C757 I759	I705-L752 HydrophobicContact CD1-CD2 3.75Å; L713-L752 HydrophobicContact CD2-CD2 4.04Å; L729-L752 HydrophobicContact CB-CD1 4.43Å; L729-L752 HydrophobicContact CB-CG 4.36Å; T730-L752 HydrophobicContact CG2-CD1 3.77Å; N750-L752 VanDerWaalsContact C-N 3.32Å; N750-L752 PolarHBondContact O-N 2.81Å; N750-L752 WeakPolarHBondContact OD1-CA 3.32Å; N750-L752 WeakPolarHBondContact OD1-CB 3.21Å; N750-L752 PolarHBondContact OD1-N 3.32Å; L752-L754 VanDerWaalsContact C-N 3.34Å; L752-L754 PolarHBondContact O-N 3.21Å; L752-Y755 CarbonylContact O-C 3.53Å; L752-Y755 PolarHBondContact O-N 3Å; L752-N756 WeakPolarHBondContact O-CA 3.41Å; L752-N756 PolarHBondContact O-N 3.18Å; L752-C757 VanDerWaalsContact CB-O 3.27Å; L752-C757 WeakPolarHBondContact CB-O 3.29Å; L752-C757 HydrophobicContact CD2-CB 4.22Å; L752-C757 PolarHBondContact O-N 3.11Å; L752-I759 HydrophobicContact CD1-CD1 4.04Å; L752-I759 HydrophobicContact CD1-CG1 4.1Å
753	D	82.4	Confident	73.5	Confident	78 Å²	78	53.1 Å²	53.1	42%	0.417	29%	0.287	S	S	.	.	H	α-helix	trans	-66	-37	175.4	-59.9	-27.8	0	0	0	111.7	S749 N750 Y755 N756	S749-D753 PolarHBondContact OG-OD2 3.27Å; N750-D753 VanDerWaalsContact CG-OD2 3.26Å; N750-D753 PolarHBondContact ND2-OD2 3.47Å; N750-D753 PolarHBondContact O-N 3.28Å; N750-D753 VanDerWaalsContact OD1-CG 3.22Å; N750-D753 PolarHBondContact OD1-N 3.21Å; N750-D753 PolarHBondContact OD1-OD2 3.22Å; D753-Y755 PolarHBondContact O-N 3.45Å; D753-N756 PolarHBondContact O-N 3Å
754	L	78	Confident	75.2	Confident	22 Å²	22	51.9 Å²	51.9	12%	0.115	27%	0.266	C	S	.	.	H	α-helix	trans	-57.2	-40.2	177.3	-177	63.2	0	0	0	111.6	I738 L741 D745 K748 N750 V751 L752	I738-L754 HydrophobicContact CD1-CD2 3.84Å; L741-L754 HydrophobicContact CD1-CD2 4.46Å; L741-L754 HydrophobicContact CD2-CD1 3.76Å; L741-L754 HydrophobicContact CD2-CD2 3.95Å; D745-L754 HydrophobicContact CB-CD1 4.16Å; K748-L754 HydrophobicContact CD-CB 4.34Å; K748-L754 HydrophobicContact CD-CD1 3.86Å; K748-L754 PolarHBondContact NZ-O 3.41Å; N750-L754 WeakPolarHBondContact O-CB 3.24Å; N750-L754 PolarHBondContact O-N 2.93Å; V751-L754 PolarHBondContact O-N 2.97Å; L752-L754 VanDerWaalsContact C-N 3.34Å; L752-L754 PolarHBondContact O-N 3.21Å
755	Y	80.9	Confident	76.9	Confident	37 Å²	37	47.3 Å²	47.3	15%	0.145	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.9	12.9	-173.5	-57.7	-38.9	0	0	0	114.4	I705 K706 I738 V751 L752 D753 C757	I705-Y755 HydrophobicContact CG2-CD2 3.82Å; I705-Y755 HydrophobicContact CG2-CG 4.31Å; K706-Y755 HydrophobicContact CB-CE2 3.75Å; K706-Y755 WeakPolarHBondContact CD-OH 3.45Å; K706-Y755 HydrophobicContact CG-CE2 4.17Å; K706-Y755 WeakPolarHBondContact CG-OH 3.36Å; I738-Y755 HydrophobicContact CD1-CE2 3.72Å; V751-Y755 HydrophobicContact CG1-CD2 3.9Å; V751-Y755 HydrophobicContact CG1-CE2 4.08Å; V751-Y755 WeakPolarHBondContact O-CD2 3.2Å; V751-Y755 PolarHBondContact O-N 3.25Å; L752-Y755 CarbonylContact O-C 3.53Å; L752-Y755 PolarHBondContact O-N 3Å; D753-Y755 PolarHBondContact O-N 3.45Å; Y755-C757 PolarHBondContact O-N 3.24Å
756	N	83.7	Confident	78.8	Confident	140 Å²	140	43.9 Å²	43.9	75%	0.749	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.9	40.4	179	-164.8	43.9	0	0	0	113.3	L752 D753	L752-N756 WeakPolarHBondContact O-CA 3.41Å; L752-N756 PolarHBondContact O-N 3.18Å; D753-N756 PolarHBondContact O-N 3Å
757	C	88.7	Confident	80.6	Confident	4 Å²	4	40.3 Å²	40.3	3%	0.027	21%	0.209	C	C	.	.			trans	-105.3	118	177.5	-175.8	0	0	0	0	108.9	I705 P710 L752 Y755	I705-C757 HydrophobicContact CG2-CB 4.09Å; P710-C757 WeakPolarHBondContact O-CB 2.98Å; P710-C757 PolarHBondContact O-SG 3.06Å; P710-C757 VanDerWaalsContact O-SG 3.35Å; L752-C757 VanDerWaalsContact CB-O 3.27Å; L752-C757 WeakPolarHBondContact CB-O 3.29Å; L752-C757 HydrophobicContact CD2-CB 4.22Å; L752-C757 PolarHBondContact O-N 3.11Å; Y755-C757 PolarHBondContact O-N 3.24Å
758	R	88.4	Confident	82.3	Confident	55 Å²	55	36 Å²	36	21%	0.208	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	153.2	-175.4	67.4	178	-177	-123.7	3.7	113.3	N632 D711 G712 L713 L760	N632-R758 PolarHBondContact ND2-NH1 3.49Å; N632-R758 PolarHBondContact O-NH2 2.9Å; N632-R758 PolarHBondContact OD1-NH1 3.24Å; D711-R758 PolarHBondContact O-N 2.89Å; G712-R758 CarbonylContact C-O 3.54Å; G712-R758 VanDerWaalsContact CA-O 3.24Å; G712-R758 WeakPolarHBondContact CA-O 3.43Å; L713-R758 PolarHBondContact N-O 2.68Å; R758-L760 HydrophobicContact CG-CD2 3.96Å
759	I	90.7	Very high	84.1	Confident	35 Å²	35	34.4 Å²	34.4	18%	0.179	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	131.1	169.1	-58.1	-68.5	0	0	0	109.1	L713 I715 L752 I764	L713-I759 HydrophobicContact CB-CD1 4.11Å; L713-I759 HydrophobicContact CD2-CD1 3.7Å; L713-I759 HydrophobicContact CG-CD1 3.97Å; L713-I759 WeakPolarHBondContact O-CA 3.45Å; I715-I759 HydrophobicContact CD1-CD1 4.23Å; I715-I759 HydrophobicContact CD1-CG2 4.33Å; I715-I759 HydrophobicContact CG1-CG2 4.3Å; I715-I759 HydrophobicContact CG2-CD1 4.09Å; L752-I759 HydrophobicContact CD1-CD1 4.04Å; L752-I759 HydrophobicContact CD1-CG1 4.1Å; I759-I764 HydrophobicContact CB-CG1 4.33Å; I759-I764 HydrophobicContact CD1-CD1 4.41Å; I759-I764 HydrophobicContact CG1-CD1 3.98Å; I759-I764 HydrophobicContact CG1-CG1 3.95Å; I759-I764 HydrophobicContact CG2-CD1 4.15Å; I759-I764 HydrophobicContact CG2-CG1 4.31Å
760	L	92.5	Very high	85.3	Confident	5 Å²	5	32.6 Å²	32.6	3%	0.026	17%	0.173	C	C	.	.			trans	-102.1	150.7	177.4	-60.2	179.7	0	0	0	110.9	L627 P634 V637 L713 L714 R758 L969	L627-L760 HydrophobicContact CD2-CD2 3.72Å; P634-L760 HydrophobicContact CG-CD1 4.12Å; V637-L760 HydrophobicContact CG1-CD1 4.09Å; V637-L760 HydrophobicContact CG2-CD1 3.68Å; L713-L760 PolarHBondContact O-N 3.37Å; L714-L760 HydrophobicContact CD2-CB 3.58Å; L714-L760 HydrophobicContact CD2-CD1 4.49Å; L714-L760 HydrophobicContact CG-CB 4.29Å; L714-L760 HydrophobicContact CG-CD1 4.49Å; R758-L760 HydrophobicContact CG-CD2 3.96Å; L760-L969 HydrophobicContact CD1-CD2 4.23Å
761	G	92.1	Very high	85.3	Confident	4 Å²	4	33.4 Å²	33.4	4%	0.041	18%	0.176	C	C	.	.	S	Bend	trans	85.1	-139.2	-177.3	0	0	0	0	0	112.7	V920 S968	G761-V920 CarbonylContact C-O 3.54Å; G761-S968 WeakPolarHBondContact CA-OG 3.21Å
762	T	91.2	Very high	85.2	Confident	12 Å²	12	35.5 Å²	35.5	7%	0.074	19%	0.187	C	C	.	.	S	Bend	trans	-60.5	138.8	-178.5	-67.7	0	0	0	0	111.6	A766 V767 I919 V920 A943	T762-A766 HydrophobicContact CG2-CB 3.7Å; T762-V767 HydrophobicContact CG2-CG2 4.35Å; T762-I919 HydrophobicContact CG2-CD1 3.76Å; T762-V920 PolarHBondContact N-O 3.37Å; T762-V920 VanDerWaalsContact N-O 3.09Å; T762-V920 PolarHBondContact OG1-N 2.73Å; T762-V920 PolarHBondContact OG1-O 3.31Å; T762-A943 HydrophobicContact CG2-CB 4.37Å
763	S	87	Confident	84.7	Confident	20 Å²	20	37.1 Å²	37.1	14%	0.14	19%	0.193	C	C	.	.			trans	-66.7	150.8	-176.9	71.8	0	0	0	0	112.1	S765 A766 V767	S763-S765 PolarHBondContact O-N 2.87Å; S763-S765 PolarHBondContact OG-OG 3.41Å; S763-A766 PolarHBondContact O-N 3.32Å; S763-A766 VanDerWaalsContact O-N 3.11Å; S763-A766 WeakPolarHBondContact OG-CB 3.24Å; S763-A766 PolarHBondContact OG-N 3.18Å; S763-V767 PolarHBondContact O-N 2.68Å
764	I	84.4	Confident	84.4	Confident	29 Å²	29	39.5 Å²	39.5	15%	0.149	20%	0.201	C	C	.	.	H	α-helix	trans	-59	-38.2	174.8	-68	-66.1	0	0	0	111.7	I715 L727 T730 I759 A766 V767 E768	I715-I764 HydrophobicContact CD1-CD1 3.59Å; L727-I764 HydrophobicContact CD2-CD1 4.23Å; L727-I764 HydrophobicContact CD2-CG2 3.69Å; T730-I764 HydrophobicContact CG2-CD1 4.34Å; T730-I764 HydrophobicContact CG2-CG1 4.13Å; I759-I764 HydrophobicContact CB-CG1 4.33Å; I759-I764 HydrophobicContact CD1-CD1 4.41Å; I759-I764 HydrophobicContact CG1-CD1 3.98Å; I759-I764 HydrophobicContact CG1-CG1 3.95Å; I759-I764 HydrophobicContact CG2-CD1 4.15Å; I759-I764 HydrophobicContact CG2-CG1 4.31Å; I764-A766 VanDerWaalsContact C-N 3.29Å; I764-A766 PolarHBondContact O-N 2.87Å; I764-V767 PolarHBondContact O-N 3.02Å; I764-E768 HydrophobicContact CG2-CG 4.27Å; I764-E768 WeakPolarHBondContact O-CG 3.35Å; I764-E768 PolarHBondContact O-N 3.41Å
765	S	84.2	Confident	84.7	Confident	65 Å²	65	42.5 Å²	42.5	46%	0.455	22%	0.217	S	C	.	.	H	α-helix	trans	-59.8	-38.1	176.2	55.2	0	0	0	0	112.8	S763 E768 I769	S763-S765 PolarHBondContact O-N 2.87Å; S763-S765 PolarHBondContact OG-OG 3.41Å; S765-E768 PolarHBondContact O-N 3.2Å; S765-I769 WeakPolarHBondContact O-CB 3.13Å; S765-I769 WeakPolarHBondContact O-CD1 3.39Å; S765-I769 WeakPolarHBondContact O-CG1 3.49Å; S765-I769 PolarHBondContact O-N 3.49Å
766	A	86.7	Confident	84.9	Confident	2 Å²	2	41 Å²	41	2%	0.017	21%	0.211	C	C	.	.	H	α-helix	trans	-69.7	-38.2	177.7	0	0	0	0	0	111.8	T762 S763 I764 I769 T770 L917 I919	T762-A766 HydrophobicContact CG2-CB 3.7Å; S763-A766 PolarHBondContact O-N 3.32Å; S763-A766 VanDerWaalsContact O-N 3.11Å; S763-A766 WeakPolarHBondContact OG-CB 3.24Å; S763-A766 PolarHBondContact OG-N 3.18Å; I764-A766 VanDerWaalsContact C-N 3.29Å; I764-A766 PolarHBondContact O-N 2.87Å; A766-I769 PolarHBondContact O-N 2.85Å; A766-T770 WeakPolarHBondContact O-CG2 3.45Å; A766-T770 PolarHBondContact O-N 2.79Å; A766-T770 VanDerWaalsContact O-N 3.08Å; A766-T770 PolarHBondContact O-OG1 3.41Å; A766-L917 VanDerWaalsContact CB-O 3.23Å; A766-L917 WeakPolarHBondContact CB-O 3.43Å; A766-I919 HydrophobicContact CB-CD1 4.35Å
767	V	84.2	Confident	84.9	Confident	7 Å²	7	35 Å²	35	4%	0.042	18%	0.181	C	C	.	.	H	α-helix	trans	-63.3	-44.6	172.9	179	0	0	0	0	110.7	L723 L727 T762 S763 I764 T770 E771	L723-V767 HydrophobicContact CD1-CG1 4.09Å; L723-V767 HydrophobicContact CD2-CG1 4.15Å; L727-V767 HydrophobicContact CD1-CG1 4.33Å; T762-V767 HydrophobicContact CG2-CG2 4.35Å; S763-V767 PolarHBondContact O-N 2.68Å; I764-V767 PolarHBondContact O-N 3.02Å; V767-T770 PolarHBondContact O-N 2.88Å; V767-T770 PolarHBondContact O-OG1 3.37Å; V767-T770 VanDerWaalsContact O-OG1 3.05Å; V767-E771 HydrophobicContact CG1-CG 4.37Å; V767-E771 WeakPolarHBondContact O-CB 3.26Å; V767-E771 VanDerWaalsContact O-CG 3.32Å; V767-E771 WeakPolarHBondContact O-CG 3.33Å; V767-E771 PolarHBondContact O-N 3.3Å
768	E	83.4	Confident	84.8	Confident	81 Å²	81	38.6 Å²	38.6	38%	0.379	20%	0.204	S	C	.	.	H	α-helix	trans	-63.5	-43.5	177.2	-71.7	176.9	154.4	0	0	112.4	L727 I764 S765 T770 E771 D772	L727-E768 HydrophobicContact CD2-CG 3.79Å; I764-E768 HydrophobicContact CG2-CG 4.27Å; I764-E768 WeakPolarHBondContact O-CG 3.35Å; I764-E768 PolarHBondContact O-N 3.41Å; S765-E768 PolarHBondContact O-N 3.2Å; E768-T770 VanDerWaalsContact C-N 3.28Å; E768-T770 PolarHBondContact O-N 3.43Å; E768-E771 PolarHBondContact O-N 3.45Å; E768-D772 WeakPolarHBondContact O-CB 3.28Å; E768-D772 PolarHBondContact O-N 3.42Å
769	I	85.8	Confident	84.8	Confident	50 Å²	50	36.6 Å²	36.6	26%	0.256	20%	0.199	S	C	.	.	H	α-helix	trans	-62.7	-35.1	177.6	-70.8	163.3	0	0	0	111.8	S765 A766 D772 L775 F776 A779 L917	S765-I769 WeakPolarHBondContact O-CB 3.13Å; S765-I769 WeakPolarHBondContact O-CD1 3.39Å; S765-I769 WeakPolarHBondContact O-CG1 3.49Å; S765-I769 PolarHBondContact O-N 3.49Å; A766-I769 PolarHBondContact O-N 2.85Å; I769-D772 VanDerWaalsContact O-O 3.08Å; I769-L775 HydrophobicContact CG1-CB 4.45Å; I769-F776 WeakPolarHBondContact O-CA 3.39Å; I769-F776 VanDerWaalsContact O-CB 3.32Å; I769-F776 WeakPolarHBondContact O-CB 3.44Å; I769-F776 PolarHBondContact O-N 2.63Å; I769-A779 HydrophobicContact CG2-CB 3.89Å; I769-L917 HydrophobicContact CG2-CD2 3.72Å
770	T	84.7	Confident	84.8	Confident	11 Å²	11	35 Å²	35	7%	0.067	19%	0.19	C	C	.	.	H	α-helix	trans	-82.2	-29.6	-177.6	46.4	0	0	0	0	113.3	A766 V767 E768 L917 V941 A943	A766-T770 WeakPolarHBondContact O-CG2 3.45Å; A766-T770 PolarHBondContact O-N 2.79Å; A766-T770 VanDerWaalsContact O-N 3.08Å; A766-T770 PolarHBondContact O-OG1 3.41Å; V767-T770 PolarHBondContact O-N 2.88Å; V767-T770 PolarHBondContact O-OG1 3.37Å; V767-T770 VanDerWaalsContact O-OG1 3.05Å; E768-T770 VanDerWaalsContact C-N 3.28Å; E768-T770 PolarHBondContact O-N 3.43Å; T770-L917 HydrophobicContact CG2-CD1 3.63Å; T770-L917 HydrophobicContact CG2-CD2 4.44Å; T770-V941 WeakPolarHBondContact CB-O 3.26Å; T770-V941 HydrophobicContact CG2-CB 4.06Å; T770-V941 HydrophobicContact CG2-CG1 3.95Å; T770-A943 HydrophobicContact CG2-CB 3.99Å; T770-A943 WeakPolarHBondContact OG1-CB 3.13Å
771	E	77.2	Confident	84.7	Confident	36 Å²	36	41.7 Å²	41.7	17%	0.168	22%	0.215	C	C	.	.	H	α-helix	trans	-80.5	-34	175.5	-69.5	-75.1	165.2	0	0	112.7	Q720 V767 E768 F816	Q720-E771 PolarHBondContact NE2-OE1 2.9Å; V767-E771 HydrophobicContact CG1-CG 4.37Å; V767-E771 WeakPolarHBondContact O-CB 3.26Å; V767-E771 VanDerWaalsContact O-CG 3.32Å; V767-E771 WeakPolarHBondContact O-CG 3.33Å; V767-E771 PolarHBondContact O-N 3.3Å; E768-E771 PolarHBondContact O-N 3.45Å; E771-F816 HydrophobicContact CB-CD1 4.32Å; E771-F816 HydrophobicContact CB-CE1 4.13Å
772	D	76.3	Confident	84.6	Confident	44 Å²	44	45.4 Å²	45.4	24%	0.235	24%	0.241	C	C	.	.			trans	-86.9	116.6	176.3	-172.8	-57.9	0	0	0	111.3	E768 I769 E774 L775 F776	E768-D772 WeakPolarHBondContact O-CB 3.28Å; E768-D772 PolarHBondContact O-N 3.42Å; I769-D772 VanDerWaalsContact O-O 3.08Å; D772-E774 PolarHBondContact O-N 3.08Å; D772-E774 PolarHBondContact OD1-N 2.86Å; D772-L775 HydrophobicContact CB-CB 4.03Å; D772-L775 HydrophobicContact CB-CD1 3.88Å; D772-L775 HydrophobicContact CB-CG 3.96Å; D772-L775 PolarHBondContact O-N 2.82Å; D772-L775 PolarHBondContact OD1-N 2.73Å; D772-F776 VanDerWaalsContact O-CB 3.25Å; D772-F776 WeakPolarHBondContact O-CB 3.42Å; D772-F776 PolarHBondContact O-N 2.98Å
773	R	75.2	Confident	84.4	Confident	42 Å²	42	46 Å²	46	16%	0.158	24%	0.243	C	C	.	.	H	α-helix	trans	-69.5	-29.7	-174.1	-68.2	-67.7	-178.8	172.2	-1.6	114.1	A777 R813 F847 I939 E940	R773-A777 VanDerWaalsContact O-CB 3.22Å; R773-A777 WeakPolarHBondContact O-CB 3.37Å; R773-A777 PolarHBondContact O-N 3.26Å; R773-R813 VanDerWaalsContact NH2-NH1 3.19Å; R773-F847 HydrophobicContact CB-CD1 3.91Å; R773-F847 HydrophobicContact CB-CD2 4.04Å; R773-F847 HydrophobicContact CB-CE1 3.7Å; R773-F847 HydrophobicContact CB-CE2 3.85Å; R773-F847 HydrophobicContact CB-CG 4.08Å; R773-F847 HydrophobicContact CB-CZ 3.69Å; R773-F847 HydrophobicContact CG-CD2 4.03Å; R773-F847 HydrophobicContact CG-CE2 4.13Å; R773-F847 HydrophobicContact CG-CG 4.27Å; R773-F847 HydrophobicContact CG-CZ 4.47Å; R773-I939 PolarHBondContact NH1-O 3.1Å; R773-E940 IonicContact NH2-OE2 2.82Å; R773-E940 PolarHBondContact NH2-OE2 3.26Å
774	E	77.4	Confident	84.5	Confident	128 Å²	128	48.1 Å²	48.1	60%	0.598	27%	0.268	S	S	*	.	H	α-helix	trans	-72.8	-43.4	177.8	-173.1	174.7	-179.3	0	0	110.1	D772 T778	D772-E774 PolarHBondContact O-N 3.08Å; D772-E774 PolarHBondContact OD1-N 2.86Å; E774-T778 VanDerWaalsContact O-CB 3.31Å; E774-T778 WeakPolarHBondContact O-CB 3.37Å; E774-T778 PolarHBondContact O-N 3.48Å; E774-T778 PolarHBondContact O-OG1 2.83Å
775	L	83.1	Confident	84.8	Confident	85 Å²	85	47.6 Å²	47.6	45%	0.445	26%	0.264	S	S	.	.	H	α-helix	trans	-62.6	-44.3	172.6	-62.5	-176.5	0	0	0	111.2	I769 D772 T778 A779	I769-L775 HydrophobicContact CG1-CB 4.45Å; D772-L775 HydrophobicContact CB-CB 4.03Å; D772-L775 HydrophobicContact CB-CD1 3.88Å; D772-L775 HydrophobicContact CB-CG 3.96Å; D772-L775 PolarHBondContact O-N 2.82Å; D772-L775 PolarHBondContact OD1-N 2.73Å; L775-T778 PolarHBondContact O-N 3.42Å; L775-A779 WeakPolarHBondContact O-CB 3.47Å; L775-A779 PolarHBondContact O-N 2.97Å
776	F	85.4	Confident	84.8	Confident	5 Å²	5	48.9 Å²	48.9	2%	0.022	26%	0.262	C	S	.	.	H	α-helix	trans	-58.5	-52.9	176.4	-179.8	-107.4	0	0	0	111.9	I769 D772 T778 A779 M780 V787 I938 V941	I769-F776 WeakPolarHBondContact O-CA 3.39Å; I769-F776 VanDerWaalsContact O-CB 3.32Å; I769-F776 WeakPolarHBondContact O-CB 3.44Å; I769-F776 PolarHBondContact O-N 2.63Å; D772-F776 VanDerWaalsContact O-CB 3.25Å; D772-F776 WeakPolarHBondContact O-CB 3.42Å; D772-F776 PolarHBondContact O-N 2.98Å; F776-T778 VanDerWaalsContact C-N 3.27Å; F776-T778 PolarHBondContact O-N 3.01Å; F776-A779 PolarHBondContact O-N 2.8Å; F776-M780 HydrophobicContact CD1-CG 4.28Å; F776-M780 HydrophobicContact CD2-CE 4.09Å; F776-M780 HydrophobicContact CD2-CG 4.3Å; F776-M780 HydrophobicContact CE1-CG 3.87Å; F776-M780 HydrophobicContact CE2-CE 3.73Å; F776-M780 HydrophobicContact CE2-CG 3.87Å; F776-M780 HydrophobicContact CE2-SD 3.92Å; F776-M780 HydrophobicContact CG-CG 4.49Å; F776-M780 HydrophobicContact CZ-CE 4.38Å; F776-M780 HydrophobicContact CZ-CG 3.64Å; F776-M780 HydrophobicContact CZ-SD 3.98Å; F776-M780 WeakPolarHBondContact O-CG 3.43Å; F776-M780 PolarHBondContact O-N 3.38Å; F776-V787 HydrophobicContact CD1-CG1 4.16Å; F776-V787 HydrophobicContact CE1-CG1 3.67Å; F776-V787 HydrophobicContact CZ-CG1 4.48Å; F776-I938 HydrophobicContact CE1-CG2 4.39Å; F776-I938 HydrophobicContact CZ-CG2 3.75Å; F776-V941 HydrophobicContact CE2-CB 3.88Å; F776-V941 HydrophobicContact CE2-CG2 3.51Å; F776-V941 HydrophobicContact CZ-CB 4.47Å; F776-V941 HydrophobicContact CZ-CG2 3.83Å
777	A	83.7	Confident	84.8	Confident	15 Å²	15	49.7 Å²	49.7	12%	0.124	27%	0.266	C	S	.	.	H	α-helix	trans	-60.5	-39.1	179.9	0	0	0	0	0	111.8	R773 R781 V787	R773-A777 VanDerWaalsContact O-CB 3.22Å; R773-A777 WeakPolarHBondContact O-CB 3.37Å; R773-A777 PolarHBondContact O-N 3.26Å; A777-R781 WeakPolarHBondContact O-CB 3.28Å; A777-R781 VanDerWaalsContact O-CG 3.27Å; A777-R781 WeakPolarHBondContact O-CG 3.19Å; A777-R781 PolarHBondContact O-N 3.24Å; A777-V787 HydrophobicContact CB-CG2 3.89Å
778	T	86.8	Confident	84.6	Confident	80 Å²	80	49.9 Å²	49.9	49%	0.491	27%	0.269	S	S	.	.	H	α-helix	trans	-65.9	-44.7	176.3	-58.4	0	0	0	0	111.3	E774 L775 F776 R781 S782	E774-T778 VanDerWaalsContact O-CB 3.31Å; E774-T778 WeakPolarHBondContact O-CB 3.37Å; E774-T778 PolarHBondContact O-N 3.48Å; E774-T778 PolarHBondContact O-OG1 2.83Å; L775-T778 PolarHBondContact O-N 3.42Å; F776-T778 VanDerWaalsContact C-N 3.27Å; F776-T778 PolarHBondContact O-N 3.01Å; T778-R781 PolarHBondContact O-N 3.08Å; T778-S782 PolarHBondContact O-N 3.12Å
779	A	87.8	Confident	84.4	Confident	13 Å²	13	48.4 Å²	48.4	11%	0.107	27%	0.266	C	S	.	.	H	α-helix	trans	-60.2	-46.8	175.6	0	0	0	0	0	111.4	I769 L775 F776 S782 M783	I769-A779 HydrophobicContact CG2-CB 3.89Å; L775-A779 WeakPolarHBondContact O-CB 3.47Å; L775-A779 PolarHBondContact O-N 2.97Å; F776-A779 PolarHBondContact O-N 2.8Å; A779-S782 PolarHBondContact O-N 3.45Å; A779-S782 PolarHBondContact O-OG 2.86Å; A779-M783 PolarHBondContact O-N 2.88Å
780	M	92.3	Very high	84.2	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-63.3	-45.7	178.1	-64.5	-51.2	104	0	0	112.3	F776 S782 M783 G784 E785 V787 V913 L917 I938	F776-M780 HydrophobicContact CD1-CG 4.28Å; F776-M780 HydrophobicContact CD2-CE 4.09Å; F776-M780 HydrophobicContact CD2-CG 4.3Å; F776-M780 HydrophobicContact CE1-CG 3.87Å; F776-M780 HydrophobicContact CE2-CE 3.73Å; F776-M780 HydrophobicContact CE2-CG 3.87Å; F776-M780 HydrophobicContact CE2-SD 3.92Å; F776-M780 HydrophobicContact CG-CG 4.49Å; F776-M780 HydrophobicContact CZ-CE 4.38Å; F776-M780 HydrophobicContact CZ-CG 3.64Å; F776-M780 HydrophobicContact CZ-SD 3.98Å; F776-M780 WeakPolarHBondContact O-CG 3.43Å; F776-M780 PolarHBondContact O-N 3.38Å; M780-S782 VanDerWaalsContact C-N 3.28Å; M780-S782 PolarHBondContact O-N 2.82Å; M780-M783 HydrophobicContact CE-CE 3.36Å; M780-M783 WeakPolarHBondContact O-CB 3.42Å; M780-M783 PolarHBondContact O-N 3.36Å; M780-M783 VanDerWaalsContact O-N 3.08Å; M780-M783 HydrophobicContact SD-CE 3.47Å; M780-M783 WeakPolarHBondContact SD-CE 3.29Å; M780-G784 PolarHBondContact O-N 3.02Å; M780-E785 HydrophobicContact CB-CB 4.3Å; M780-E785 PolarHBondContact O-N 3.33Å; M780-V787 HydrophobicContact CB-CG1 3.67Å; M780-V787 HydrophobicContact CG-CG1 3.62Å; M780-V913 HydrophobicContact CE-CG1 4.09Å; M780-V913 HydrophobicContact SD-CG1 4.12Å; M780-V913 HydrophobicContact SD-CG2 3.89Å; M780-L917 HydrophobicContact CE-CD1 4.42Å; M780-L917 HydrophobicContact CE-CD2 4.37Å; M780-L917 HydrophobicContact CE-CG 4.5Å; M780-I938 HydrophobicContact CG-CD1 4.35Å; M780-I938 HydrophobicContact SD-CD1 3.73Å
781	R	89.1	Confident	84.1	Confident	146 Å²	146	51.7 Å²	51.7	55%	0.551	29%	0.289	S	S	*	.	H	α-helix	trans	-61.8	-35	177.1	-74.8	176.5	-166.7	139	2.5	112.7	A777 T778 M783 G784	A777-R781 WeakPolarHBondContact O-CB 3.28Å; A777-R781 VanDerWaalsContact O-CG 3.27Å; A777-R781 WeakPolarHBondContact O-CG 3.19Å; A777-R781 PolarHBondContact O-N 3.24Å; T778-R781 PolarHBondContact O-N 3.08Å; R781-M783 PolarHBondContact O-N 3.48Å; R781-G784 PolarHBondContact O-N 3.31Å
782	S	91.3	Very high	84.3	Confident	83 Å²	83	51 Å²	51	58%	0.58	29%	0.289	S	S	*	.	H	α-helix	trans	-62.4	-25.8	177	83.2	0	0	0	0	113	T778 A779 M780 H916	T778-S782 PolarHBondContact O-N 3.12Å; A779-S782 PolarHBondContact O-N 3.45Å; A779-S782 PolarHBondContact O-OG 2.86Å; M780-S782 VanDerWaalsContact C-N 3.28Å; M780-S782 PolarHBondContact O-N 2.82Å; S782-H916 PolarHBondContact OG-NE2 3.36Å
783	M	87.1	Confident	84.8	Confident	25 Å²	25	48.9 Å²	48.9	12%	0.123	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	-4.8	174.3	-68.1	-171.6	-75.2	0	0	113.9	A779 M780 R781 E785 K912 V913 H916	A779-M783 PolarHBondContact O-N 2.88Å; M780-M783 HydrophobicContact CE-CE 3.36Å; M780-M783 WeakPolarHBondContact O-CB 3.42Å; M780-M783 PolarHBondContact O-N 3.36Å; M780-M783 VanDerWaalsContact O-N 3.08Å; M780-M783 HydrophobicContact SD-CE 3.47Å; M780-M783 WeakPolarHBondContact SD-CE 3.29Å; R781-M783 PolarHBondContact O-N 3.48Å; M783-E785 VanDerWaalsContact C-N 3.31Å; M783-E785 HydrophobicContact CB-CG 3.95Å; M783-E785 HydrophobicContact CE-CG 4.41Å; M783-K912 PolarHBondContact O-NZ 3.14Å; M783-K912 HydrophobicContact SD-CG 4.3Å; M783-V913 HydrophobicContact CE-CG2 3.96Å; M783-H916 HydrophobicContact CE-CB 4.15Å; M783-H916 HydrophobicContact CG-CB 4.21Å; M783-H916 HydrophobicContact SD-CB 3.2Å; M783-H916 WeakPolarHBondContact SD-CB 3.28Å
784	G	88	Confident	85.2	Confident	63 Å²	63	51.3 Å²	51.3	65%	0.649	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.8	13.1	-169.4	0	0	0	0	0	114.3	M780 R781	M780-G784 PolarHBondContact O-N 3.02Å; R781-G784 PolarHBondContact O-N 3.31Å
785	E	92	Very high	85.6	Confident	18 Å²	18	47.3 Å²	47.3	8%	0.084	28%	0.284	C	S	.	.			trans	-87.3	149.2	-179.7	-60.5	-55.2	155	0	0	112.5	M780 M783 V909 K912 Y936 I938	M780-E785 HydrophobicContact CB-CB 4.3Å; M780-E785 PolarHBondContact O-N 3.33Å; M783-E785 VanDerWaalsContact C-N 3.31Å; M783-E785 HydrophobicContact CB-CG 3.95Å; M783-E785 HydrophobicContact CE-CG 4.41Å; E785-V909 HydrophobicContact CG-CG1 4.43Å; E785-K912 WeakPolarHBondContact OE1-CD 3.35Å; E785-K912 WeakPolarHBondContact OE1-CE 3.47Å; E785-K912 IonicContact OE1-NZ 2.69Å; E785-K912 PolarHBondContact OE1-NZ 3.19Å; E785-Y936 PolarHBondContact OE2-OH 3.28Å; E785-I938 HydrophobicContact CB-CD1 3.88Å; E785-I938 HydrophobicContact CG-CD1 4.38Å
786	K	83.7	Confident	85.8	Confident	93 Å²	93	45 Å²	45	40%	0.404	27%	0.273	S	S	.	.			trans	-93.6	124.5	-174.7	-61.9	177.4	-176.1	172	0	111.1	N935 Y937 I938	K786-N935 PolarHBondContact NZ-OD1 3.2Å; K786-Y937 HydrophobicContact CB-CD1 3.71Å; K786-Y937 HydrophobicContact CB-CE1 3.92Å; K786-Y937 HydrophobicContact CD-CE1 4.45Å; K786-I938 PolarHBondContact O-N 2.92Å
787	V	85.4	Confident	86	Confident	18 Å²	18	51.8 Å²	51.8	11%	0.109	31%	0.305	C	S	.	.	B	Isolated β-bridge	trans	-108.8	153.2	162.8	-67.7	0	0	0	0	109.2	F776 A777 M780 Y937	F776-V787 HydrophobicContact CD1-CG1 4.16Å; F776-V787 HydrophobicContact CE1-CG1 3.67Å; F776-V787 HydrophobicContact CZ-CG1 4.48Å; A777-V787 HydrophobicContact CB-CG2 3.89Å; M780-V787 HydrophobicContact CB-CG1 3.67Å; M780-V787 HydrophobicContact CG-CG1 3.62Å; V787-Y937 VanDerWaalsContact C-CD1 3.43Å; V787-Y937 WeakPolarHBondContact O-CD1 3.47Å
788	A	80.6	Confident	86.2	Confident	12 Å²	12	53.4 Å²	53.4	10%	0.099	31%	0.311	C	S	.	.			trans	-53.8	136.5	175.3	0	0	0	0	0	110	A790 L852	A788-A790 PolarHBondContact O-N 3.09Å; A788-L852 HydrophobicContact CB-CD1 4.14Å
789	P	79.6	Confident	86.3	Confident	49 Å²	49	49.6 Å²	49.6	32%	0.318	29%	0.288	S	S	.	.			trans	-55.4	125	172.9	-25.9	34.9	0	0	0	110.4	L806 K850	P789-L806 HydrophobicContact CB-CD2 3.79Å; P789-K850 HydrophobicContact CB-CB 4.36Å; P789-K850 HydrophobicContact CG-CD 4.46Å; P789-K850 PolarHBondContact O-N 2.94Å
790	A	81	Confident	86.5	Confident	34 Å²	34	50 Å²	50	28%	0.281	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	150.6	-170	0	0	0	0	0	110.8	A788 I848 D849	A788-A790 PolarHBondContact O-N 3.09Å; A790-I848 VanDerWaalsContact CA-O 3.31Å; A790-I848 WeakPolarHBondContact CA-O 3.39Å; A790-D849 HydrophobicContact CB-CB 4.5Å; A790-D849 WeakPolarHBondContact CB-OD1 3.35Å
791	N	82.4	Confident	86.5	Confident	96 Å²	96	56.3 Å²	56.3	51%	0.513	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	150.1	166.9	-146.3	1	0	0	0	110.8	V802 I848	N791-V802 HydrophobicContact CB-CB 4.34Å; N791-V802 HydrophobicContact CB-CG1 3.45Å; N791-V802 VanDerWaalsContact CB-CG1 3.45Å; N791-V802 HydrophobicContact CB-CG2 3.89Å; N791-I848 PolarHBondContact N-O 2.89Å; N791-I848 PolarHBondContact O-N 3.37Å
792	A	82.4	Confident	86.4	Confident	22 Å²	22	49.6 Å²	49.6	18%	0.182	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	147.1	176.1	0	0	0	0	0	110.7	Q845 I846 F847	A792-Q845 HydrophobicContact CB-CG 4.18Å; A792-I846 CarbonylContact C-O 3.59Å; A792-I846 WeakPolarHBondContact CA-O 3.46Å; A792-F847 HydrophobicContact CB-CD1 3.96Å; A792-F847 HydrophobicContact CB-CE1 3.62Å; A792-F847 HydrophobicContact CB-CZ 4.19Å
793	A	86.2	Confident	86.4	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	137.3	172.6	0	0	0	0	0	110.7	D798 A799 I846 I848	A793-D798 VanDerWaalsContact CA-OD2 3.3Å; A793-D798 WeakPolarHBondContact CA-OD2 3.39Å; A793-D798 HydrophobicContact CB-CB 4.17Å; A793-A799 HydrophobicContact CB-CB 3.79Å; A793-I846 HydrophobicContact CB-CG1 4.05Å; A793-I846 PolarHBondContact N-O 3.47Å; A793-I846 WeakPolarHBondContact O-CG1 3.33Å; A793-I846 PolarHBondContact O-N 2.98Å; A793-I848 HydrophobicContact CB-CG1 4.3Å
794	T	84.5	Confident	86.5	Confident	92 Å²	92	49.4 Å²	49.4	56%	0.564	29%	0.285	S	S	*	.	S	Bend	trans	-110.8	-7.7	-179.4	55.8	0	0	0	0	113.5	D798 Q845	T794-D798 PolarHBondContact N-OD2 2.87Å; T794-Q845 HydrophobicContact CG2-CG 4.33Å
795	S	85.7	Confident	86.6	Confident	44 Å²	44	52.3 Å²	52.3	31%	0.308	29%	0.286	S	S	.	.	S	Bend	trans	-140	164.3	173.7	69	0	0	0	0	110.3	Q797 D798 A799 L840	S795-Q797 VanDerWaalsContact C-N 3.31Å; S795-Q797 PolarHBondContact O-N 3.25Å; S795-D798 WeakPolarHBondContact O-CB 3.3Å; S795-D798 PolarHBondContact O-N 3.15Å; S795-D798 VanDerWaalsContact OG-CB 3.25Å; S795-D798 WeakPolarHBondContact OG-CB 3.47Å; S795-D798 PolarHBondContact OG-N 2.9Å; S795-A799 PolarHBondContact O-N 3.15Å; S795-L840 VanDerWaalsContact C-CD1 3.49Å
796	V	86.7	Confident	86.3	Confident	36 Å²	36	53.5 Å²	53.5	22%	0.218	29%	0.292	C	S	.	.	H	α-helix	trans	-63.1	-39.9	178.4	178.1	0	0	0	0	111.2	D798 A799 V800 E833 A836 L840	V796-D798 VanDerWaalsContact C-N 3.32Å; V796-D798 PolarHBondContact O-N 2.82Å; V796-A799 WeakPolarHBondContact O-CB 3.48Å; V796-A799 PolarHBondContact O-N 2.93Å; V796-V800 WeakPolarHBondContact O-CG2 3.34Å; V796-V800 PolarHBondContact O-N 2.94Å; V796-V800 VanDerWaalsContact O-N 3.09Å; V796-E833 HydrophobicContact CG1-CB 3.94Å; V796-E833 HydrophobicContact CG1-CG 3.76Å; V796-A836 HydrophobicContact CG2-CB 4.37Å; V796-L840 HydrophobicContact CG2-CD1 4.09Å
797	Q	88.8	Confident	86.4	Confident	148 Å²	148	50.6 Å²	50.6	69%	0.692	29%	0.289	S	S	*	.	H	α-helix	trans	-64.8	-38.4	177.5	-65.4	80.3	3.7	0	0	112	S795 V800 K801	S795-Q797 VanDerWaalsContact C-N 3.31Å; S795-Q797 PolarHBondContact O-N 3.25Å; Q797-V800 PolarHBondContact O-N 3.31Å; Q797-K801 PolarHBondContact O-N 3.49Å; Q797-K801 VanDerWaalsContact O-N 3.08Å
798	D	89.5	Confident	86.4	Confident	49 Å²	49	52.9 Å²	52.9	26%	0.262	30%	0.296	S	S	.	.	H	α-helix	trans	-64.2	-41.7	175.2	-165.5	29.5	0	0	0	110.9	A793 T794 S795 V796 V800 K801 V802	A793-D798 VanDerWaalsContact CA-OD2 3.3Å; A793-D798 WeakPolarHBondContact CA-OD2 3.39Å; A793-D798 HydrophobicContact CB-CB 4.17Å; T794-D798 PolarHBondContact N-OD2 2.87Å; S795-D798 WeakPolarHBondContact O-CB 3.3Å; S795-D798 PolarHBondContact O-N 3.15Å; S795-D798 VanDerWaalsContact OG-CB 3.25Å; S795-D798 WeakPolarHBondContact OG-CB 3.47Å; S795-D798 PolarHBondContact OG-N 2.9Å; V796-D798 VanDerWaalsContact C-N 3.32Å; V796-D798 PolarHBondContact O-N 2.82Å; D798-V800 PolarHBondContact O-N 3Å; D798-K801 WeakPolarHBondContact O-CB 3.44Å; D798-K801 PolarHBondContact O-N 2.95Å; D798-V802 WeakPolarHBondContact O-CG2 3.25Å; D798-V802 PolarHBondContact O-N 3.19Å
799	A	88.6	Confident	86.7	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-61	-44.6	175.9	0	0	0	0	0	112.7	A793 S795 V796 K801 V802 A803 L832 A836 I846 I848	A793-A799 HydrophobicContact CB-CB 3.79Å; S795-A799 PolarHBondContact O-N 3.15Å; V796-A799 WeakPolarHBondContact O-CB 3.48Å; V796-A799 PolarHBondContact O-N 2.93Å; A799-K801 VanDerWaalsContact C-N 3.33Å; A799-K801 PolarHBondContact O-N 3.35Å; A799-V802 PolarHBondContact O-N 3.37Å; A799-A803 WeakPolarHBondContact O-CB 3.32Å; A799-A803 PolarHBondContact O-N 2.98Å; A799-L832 HydrophobicContact CB-CD1 4.49Å; A799-A836 HydrophobicContact CB-CB 3.95Å; A799-I846 HydrophobicContact CB-CD1 4.04Å; A799-I848 HydrophobicContact CB-CD1 3.98Å; A799-I848 HydrophobicContact CB-CG1 4.02Å
800	V	92	Very high	87.2	Confident	22 Å²	22	52.1 Å²	52.1	13%	0.133	29%	0.29	C	S	.	.	H	α-helix	trans	-62.9	-40.3	176.6	174.9	0	0	0	0	111.4	V796 Q797 D798 A803 N804 A829 L832 E833	V796-V800 WeakPolarHBondContact O-CG2 3.34Å; V796-V800 PolarHBondContact O-N 2.94Å; V796-V800 VanDerWaalsContact O-N 3.09Å; Q797-V800 PolarHBondContact O-N 3.31Å; D798-V800 PolarHBondContact O-N 3Å; V800-A803 PolarHBondContact O-N 3.11Å; V800-N804 PolarHBondContact O-N 2.66Å; V800-N804 PolarHBondContact O-ND2 3.29Å; V800-A829 HydrophobicContact CG1-CB 4.32Å; V800-L832 HydrophobicContact CG2-CD2 4.17Å; V800-E833 HydrophobicContact CG2-CG 3.71Å
801	K	91.6	Very high	87.4	Confident	132 Å²	132	51.8 Å²	51.8	57%	0.574	28%	0.283	S	S	*	.	H	α-helix	trans	-60.6	-50.9	175.3	-176.9	-173.5	173.7	-169.8	0	111.3	Q797 D798 A799 A803 N804 D805	Q797-K801 PolarHBondContact O-N 3.49Å; Q797-K801 VanDerWaalsContact O-N 3.08Å; D798-K801 WeakPolarHBondContact O-CB 3.44Å; D798-K801 PolarHBondContact O-N 2.95Å; A799-K801 VanDerWaalsContact C-N 3.33Å; A799-K801 PolarHBondContact O-N 3.35Å; K801-A803 VanDerWaalsContact C-N 3.31Å; K801-A803 PolarHBondContact O-N 3.37Å; K801-N804 PolarHBondContact O-N 3.13Å; K801-D805 PolarHBondContact O-N 3.02Å; K801-D805 VanDerWaalsContact O-N 3.16Å
802	V	87.5	Confident	87.5	Confident	6 Å²	6	47.2 Å²	47.2	4%	0.036	26%	0.259	C	S	.	.	H	α-helix	trans	-58.7	-43.5	177.9	171.9	0	0	0	0	111.3	N791 D798 A799 N804 D805 L806 I848	N791-V802 HydrophobicContact CB-CB 4.34Å; N791-V802 HydrophobicContact CB-CG1 3.45Å; N791-V802 VanDerWaalsContact CB-CG1 3.45Å; N791-V802 HydrophobicContact CB-CG2 3.89Å; D798-V802 WeakPolarHBondContact O-CG2 3.25Å; D798-V802 PolarHBondContact O-N 3.19Å; A799-V802 PolarHBondContact O-N 3.37Å; V802-N804 VanDerWaalsContact C-N 3.33Å; V802-N804 PolarHBondContact O-N 3.36Å; V802-D805 PolarHBondContact O-N 2.89Å; V802-L806 HydrophobicContact CG1-CD1 3.8Å; V802-L806 HydrophobicContact CG1-CG 4.33Å; V802-L806 WeakPolarHBondContact O-CG 3.35Å; V802-L806 PolarHBondContact O-N 3.05Å; V802-I848 HydrophobicContact CB-CB 4.34Å; V802-I848 HydrophobicContact CB-CG1 4.45Å; V802-I848 HydrophobicContact CG1-CB 3.7Å; V802-I848 HydrophobicContact CG1-CG1 4.31Å; V802-I848 HydrophobicContact CG1-CG2 4.09Å
803	A	90	Very high	87.3	Confident	0 Å²	0	48 Å²	48	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-65.5	-34.6	179.4	0	0	0	0	0	113.2	A799 V800 K801 D805 L806 G807 Y808 V810 L832 I848	A799-A803 WeakPolarHBondContact O-CB 3.32Å; A799-A803 PolarHBondContact O-N 2.98Å; V800-A803 PolarHBondContact O-N 3.11Å; K801-A803 VanDerWaalsContact C-N 3.31Å; K801-A803 PolarHBondContact O-N 3.37Å; A803-D805 VanDerWaalsContact C-N 3.31Å; A803-L806 PolarHBondContact O-N 3.33Å; A803-G807 WeakPolarHBondContact O-CA 3.42Å; A803-G807 PolarHBondContact O-N 3.17Å; A803-Y808 HydrophobicContact CB-CE1 3.99Å; A803-Y808 HydrophobicContact CB-CE2 4.13Å; A803-Y808 WeakPolarHBondContact CB-OH 3.36Å; A803-V810 HydrophobicContact CB-CB 4.49Å; A803-V810 HydrophobicContact CB-CG1 3.9Å; A803-V810 HydrophobicContact CB-CG2 3.95Å; A803-L832 HydrophobicContact CB-CD2 3.29Å; A803-I848 HydrophobicContact CB-CG2 4.08Å
804	N	91	Very high	86.6	Confident	103 Å²	103	48.7 Å²	48.7	55%	0.551	26%	0.263	S	S	*	.	H	α-helix	trans	-66.6	-34	173.7	-69.6	-24.3	0	0	0	112.1	V800 K801 V802	V800-N804 PolarHBondContact O-N 2.66Å; V800-N804 PolarHBondContact O-ND2 3.29Å; K801-N804 PolarHBondContact O-N 3.13Å; V802-N804 VanDerWaalsContact C-N 3.33Å; V802-N804 PolarHBondContact O-N 3.36Å
805	D	88.4	Confident	85.6	Confident	125 Å²	125	44.9 Å²	44.9	67%	0.668	24%	0.241	S	C	*	.	H	α-helix	trans	-72.6	-36.4	176.2	-66.1	-21.5	0	0	0	112	K801 V802 A803	K801-D805 PolarHBondContact O-N 3.02Å; K801-D805 VanDerWaalsContact O-N 3.16Å; V802-D805 PolarHBondContact O-N 2.89Å; A803-D805 VanDerWaalsContact C-N 3.31Å
806	L	87	Confident	84.4	Confident	43 Å²	43	49.1 Å²	49.1	23%	0.225	25%	0.254	C	S	.	.	H	α-helix	trans	-80.5	-32.2	178.9	-68.4	174.2	0	0	0	113.7	P789 V802 A803 V810 I848	P789-L806 HydrophobicContact CB-CD2 3.79Å; V802-L806 HydrophobicContact CG1-CD1 3.8Å; V802-L806 HydrophobicContact CG1-CG 4.33Å; V802-L806 WeakPolarHBondContact O-CG 3.35Å; V802-L806 PolarHBondContact O-N 3.05Å; A803-L806 PolarHBondContact O-N 3.33Å; L806-V810 HydrophobicContact CB-CG1 4.43Å; L806-I848 HydrophobicContact CD1-CG2 4.15Å; L806-I848 VanDerWaalsContact CD1-O 3.23Å; L806-I848 WeakPolarHBondContact CD1-O 3.19Å
807	G	86	Confident	82.9	Confident	32 Å²	32	49.1 Å²	49.1	33%	0.33	26%	0.257	S	S	.	.			trans	84.7	141.7	-169.6	0	0	0	0	0	113.1	A803 V810	A803-G807 WeakPolarHBondContact O-CA 3.42Å; A803-G807 PolarHBondContact O-N 3.17Å; G807-V810 WeakPolarHBondContact O-CG1 3.32Å
808	Y	85.4	Confident	81.1	Confident	66 Å²	66	43 Å²	43	26%	0.259	23%	0.23	S	C	.	.	S	Bend	trans	-79.2	152.3	175.1	-69.1	-87.3	0	0	0	112.2	A803 V810 A826 E827 N828 A829 L832	A803-Y808 HydrophobicContact CB-CE1 3.99Å; A803-Y808 HydrophobicContact CB-CE2 4.13Å; A803-Y808 WeakPolarHBondContact CB-OH 3.36Å; Y808-V810 HydrophobicContact CD1-CG1 4.44Å; Y808-V810 HydrophobicContact CD1-CG2 3.91Å; Y808-V810 HydrophobicContact CE1-CG2 3.8Å; Y808-A826 WeakPolarHBondContact CD1-O 3.26Å; Y808-A826 HydrophobicContact CE1-CB 4.39Å; Y808-E827 WeakPolarHBondContact CB-O 3.46Å; Y808-N828 WeakPolarHBondContact CE1-O 3.38Å; Y808-A829 VanDerWaalsContact OH-CA 3.22Å; Y808-A829 WeakPolarHBondContact OH-CA 3.33Å; Y808-L832 HydrophobicContact CE1-CB 4.17Å; Y808-L832 HydrophobicContact CE1-CD2 4.1Å; Y808-L832 VanDerWaalsContact OH-CD2 3.22Å; Y808-L832 WeakPolarHBondContact OH-CD2 3.47Å
809	P	86.5	Confident	79.3	Confident	45 Å²	45	41.4 Å²	41.4	29%	0.292	23%	0.225	S	C	.	.	S	Bend	cis	-71.4	151.3	-3.1	22.8	-28.1	0	0	0	113.8	A826 E827 S851	P809-A826 WeakPolarHBondContact CA-O 3.45Å; P809-E827 WeakPolarHBondContact CB-OE2 3.49Å; P809-S851 WeakPolarHBondContact O-CB 3.34Å; P809-S851 PolarHBondContact O-N 3.45Å
810	V	89.4	Confident	77.8	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	153.2	175	-62.7	0	0	0	0	111	A803 L806 G807 Y808 F825 A826 L832 I848 D849	A803-V810 HydrophobicContact CB-CB 4.49Å; A803-V810 HydrophobicContact CB-CG1 3.9Å; A803-V810 HydrophobicContact CB-CG2 3.95Å; L806-V810 HydrophobicContact CB-CG1 4.43Å; G807-V810 WeakPolarHBondContact O-CG1 3.32Å; Y808-V810 HydrophobicContact CD1-CG1 4.44Å; Y808-V810 HydrophobicContact CD1-CG2 3.91Å; Y808-V810 HydrophobicContact CE1-CG2 3.8Å; V810-F825 WeakPolarHBondContact O-CA 3.28Å; V810-A826 HydrophobicContact CG2-CB 4.07Å; V810-A826 PolarHBondContact N-O 3.4Å; V810-A826 PolarHBondContact O-N 2.83Å; V810-L832 HydrophobicContact CG2-CD1 4.27Å; V810-L832 HydrophobicContact CG2-CD2 4.35Å; V810-I848 HydrophobicContact CB-CG2 3.77Å; V810-I848 HydrophobicContact CG1-CG2 4.06Å; V810-I848 HydrophobicContact CG2-CG2 3.94Å; V810-D849 CarbonylContact C-O 3.49Å; V810-D849 VanDerWaalsContact CA-O 3.26Å; V810-D849 WeakPolarHBondContact CA-O 3.39Å; V810-D849 WeakPolarHBondContact CB-O 3.1Å
811	L	85.2	Confident	76.3	Confident	27 Å²	27	43.1 Å²	43.1	14%	0.141	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	125.4	171.2	172.2	65	0	0	0	109	R813 F825 I848 D849	L811-R813 HydrophobicContact CD1-CG 4.46Å; L811-R813 HydrophobicContact CD2-CG 3.98Å; L811-R813 HydrophobicContact CG-CG 3.91Å; L811-F825 HydrophobicContact CB-CD1 4.03Å; L811-F825 HydrophobicContact CB-CE1 3.8Å; L811-F825 HydrophobicContact CB-CZ 4.4Å; L811-F825 HydrophobicContact CD1-CD1 4.19Å; L811-F825 HydrophobicContact CD1-CD2 4.16Å; L811-F825 HydrophobicContact CD1-CE1 3.95Å; L811-F825 HydrophobicContact CD1-CE2 3.88Å; L811-F825 HydrophobicContact CD1-CG 4.29Å; L811-F825 HydrophobicContact CD1-CZ 3.78Å; L811-F825 HydrophobicContact CD2-CE1 4.48Å; L811-F825 HydrophobicContact CD2-CZ 4.35Å; L811-F825 HydrophobicContact CG-CE1 4.27Å; L811-F825 HydrophobicContact CG-CZ 4.39Å; L811-I848 WeakPolarHBondContact O-CA 3.23Å; L811-D849 HydrophobicContact CB-CB 4.27Å; L811-D849 PolarHBondContact N-O 3.48Å; L811-D849 PolarHBondContact O-N 2.85Å
812	V	85.2	Confident	75.1	Confident	0 Å²	0	38 Å²	38	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	133.2	169.2	-172.3	0	0	0	0	108.3	S823 G824 L832 L835 A839 I846 F847 I848	V812-S823 CarbonylContact O-C 3.43Å; V812-S823 WeakPolarHBondContact O-CA 3.18Å; V812-S823 VanDerWaalsContact O-CB 3.23Å; V812-S823 WeakPolarHBondContact O-CB 3.27Å; V812-G824 WeakPolarHBondContact CB-O 3.46Å; V812-G824 PolarHBondContact N-O 3.29Å; V812-G824 PolarHBondContact O-N 3.27Å; V812-L832 HydrophobicContact CG2-CD1 3.28Å; V812-L835 HydrophobicContact CG2-CB 4.05Å; V812-L835 HydrophobicContact CG2-CD1 4.4Å; V812-A839 HydrophobicContact CG1-CB 4.35Å; V812-I846 HydrophobicContact CG1-CB 4.43Å; V812-I846 HydrophobicContact CG1-CD1 4.01Å; V812-F847 CarbonylContact C-O 3.59Å; V812-F847 WeakPolarHBondContact CA-O 3.32Å; V812-I848 HydrophobicContact CB-CD1 4.28Å; V812-I848 HydrophobicContact CG1-CD1 4.05Å; V812-I848 HydrophobicContact CG2-CD1 3.93Å
813	R	79.1	Confident	74.5	Confident	38 Å²	38	38.5 Å²	38.5	14%	0.143	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	135.6	171.7	-64.7	-169.8	-79.3	-172	-1.5	110.7	R773 L811 I846 F847 D849	R773-R813 VanDerWaalsContact NH2-NH1 3.19Å; L811-R813 HydrophobicContact CD1-CG 4.46Å; L811-R813 HydrophobicContact CD2-CG 3.98Å; L811-R813 HydrophobicContact CG-CG 3.91Å; R813-I846 CarbonylContact O-C 3.51Å; R813-I846 VanDerWaalsContact O-CA 3.27Å; R813-I846 WeakPolarHBondContact O-CA 3.47Å; R813-I846 WeakPolarHBondContact O-CB 3.37Å; R813-F847 PolarHBondContact N-O 3.16Å; R813-F847 PolarHBondContact O-N 2.81Å; R813-D849 IonicContact CZ-OD1 2.6Å; R813-D849 IonicContact CZ-OD2 2.81Å; R813-D849 IonicContact NE-OD2 2.69Å; R813-D849 PolarHBondContact NE-OD2 3.01Å; R813-D849 IonicContact NH2-OD1 3.97Å; R813-D849 PolarHBondContact NH2-OD1 3.36Å; R813-D849 IonicContact NH2-OD2 3.32Å; R813-D849 PolarHBondContact NH2-OD2 3.03Å
814	A	71	Confident	74	Confident	14 Å²	14	39 Å²	39	12%	0.116	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	135.7	170.5	0	0	0	0	0	110.2	A817 M821 A839 T843	A814-A817 HydrophobicContact CB-CB 3.71Å; A814-A817 WeakPolarHBondContact O-CB 3.43Å; A814-M821 WeakPolarHBondContact CB-O 3.31Å; A814-A839 HydrophobicContact CB-CB 4.44Å; A814-T843 HydrophobicContact CB-CG2 3.63Å
815	A	63.4	Low	73.7	Confident	13 Å²	13	36.1 Å²	36.1	11%	0.107	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	141.6	173.8	0	0	0	0	0	111	A817 T843 Q845 F847	A815-A817 PolarHBondContact O-N 3.49Å; A815-T843 PolarHBondContact O-OG1 3.42Å; A815-Q845 WeakPolarHBondContact CB-O 3.39Å; A815-Q845 PolarHBondContact N-O 3.2Å; A815-F847 HydrophobicContact CB-CD2 4.44Å; A815-F847 HydrophobicContact CB-CE2 4.05Å
816	F	60.2	Low	73.6	Confident	132 Å²	132	30.1 Å²	30.1	58%	0.579	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.3	23.3	-179.4	-53.4	-79.8	0	0	0	115.1	E771	E771-F816 HydrophobicContact CB-CD1 4.32Å; E771-F816 HydrophobicContact CB-CE1 4.13Å
817	A	54.6	Low	73.6	Confident	36 Å²	36	32.1 Å²	32.1	30%	0.298	19%	0.189	S	C	.	.			trans	-89.9	121.1	-176.7	0	0	0	0	0	112.5	A814 A815 M821	A814-A817 HydrophobicContact CB-CB 3.71Å; A814-A817 WeakPolarHBondContact O-CB 3.43Å; A815-A817 PolarHBondContact O-N 3.49Å; A817-M821 HydrophobicContact CB-CB 4.21Å; A817-M821 WeakPolarHBondContact CB-O 3.19Å
818	L	51.9	Low	73.8	Confident	20 Å²	20	33.5 Å²	33.5	11%	0.105	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	-63.9	133.9	175.1	175.6	78.3	0	0	0	111.7	Q649 Q720 G820 M821 R1619	Q649-L818 HydrophobicContact CG-CD1 3.83Å; Q649-L818 HydrophobicContact CG-CD2 3.63Å; Q649-L818 HydrophobicContact CG-CG 4.32Å; Q720-L818 HydrophobicContact CB-CD1 3.79Å; Q720-L818 HydrophobicContact CG-CB 4.38Å; Q720-L818 HydrophobicContact CG-CD1 3.35Å; Q720-L818 HydrophobicContact CG-CG 4.45Å; L818-G820 PolarHBondContact O-N 2.86Å; L818-M821 HydrophobicContact CB-CE 4.24Å; L818-M821 PolarHBondContact O-N 2.88Å; L818-M821 VanDerWaalsContact O-N 3.07Å; L818-R1619 PolarHBondContact O-NH1 2.89Å; L818-R1619 PolarHBondContact O-NH2 2.74Å
819	G	52.2	Low	74	Confident	16 Å²	16	31.9 Å²	31.9	17%	0.165	19%	0.189	C	C	.	.	G	3₁₀ helix	trans	54.8	37.6	169.5	0	0	0	0	0	113.6	M821 M1019 R1619	G819-M821 VanDerWaalsContact C-N 3.34Å; G819-M821 PolarHBondContact O-N 3.32Å; G819-M1019 PolarHBondContact O-N 3.47Å; G819-M1019 VanDerWaalsContact O-N 3.17Å; G819-R1619 PolarHBondContact O-NH1 3.36Å
820	G	55.8	Low	74	Confident	18 Å²	18	34.8 Å²	34.8	19%	0.186	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	65.3	25.8	-178.2	0	0	0	0	0	115.1	L818 G822 S823 S1018	L818-G820 PolarHBondContact O-N 2.86Å; G820-G822 PolarHBondContact O-N 3.07Å; G820-S823 WeakPolarHBondContact O-CB 3.36Å; G820-S823 PolarHBondContact O-N 3Å; G820-S823 VanDerWaalsContact O-N 3.17Å; G820-S823 PolarHBondContact O-OG 3.17Å; G820-S1018 VanDerWaalsContact O-CB 3.24Å; G820-S1018 WeakPolarHBondContact O-CB 3.36Å; G820-S1018 PolarHBondContact O-OG 3.11Å
821	M	62.2	Low	73.8	Confident	40 Å²	40	38 Å²	38	20%	0.197	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	137.5	173.7	-83.4	-163.3	-73.6	0	0	111.3	A814 A817 L818 G819 S823 R1619	A814-M821 WeakPolarHBondContact CB-O 3.31Å; A817-M821 HydrophobicContact CB-CB 4.21Å; A817-M821 WeakPolarHBondContact CB-O 3.19Å; L818-M821 HydrophobicContact CB-CE 4.24Å; L818-M821 PolarHBondContact O-N 2.88Å; L818-M821 VanDerWaalsContact O-N 3.07Å; G819-M821 VanDerWaalsContact C-N 3.34Å; G819-M821 PolarHBondContact O-N 3.32Å; M821-S823 PolarHBondContact O-N 2.99Å; M821-R1619 HydrophobicContact CG-CG 3.96Å; M821-R1619 VanDerWaalsContact CG-NH1 3.31Å; M821-R1619 HydrophobicContact SD-CG 3.75Å
822	G	64.7	Low	74	Confident	23 Å²	23	36.8 Å²	36.8	24%	0.237	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.4	1.2	-178.7	0	0	0	0	0	115.1	G820 A839	G820-G822 PolarHBondContact O-N 3.07Å; G822-A839 WeakPolarHBondContact O-CB 3.35Å
823	S	75.4	Confident	74.2	Confident	18 Å²	18	41.4 Å²	41.4	13%	0.126	24%	0.236	C	C	.	.			trans	-83.6	157.5	173.9	78.1	0	0	0	0	112.1	V812 G820 M821 S1017	V812-S823 CarbonylContact O-C 3.43Å; V812-S823 WeakPolarHBondContact O-CA 3.18Å; V812-S823 VanDerWaalsContact O-CB 3.23Å; V812-S823 WeakPolarHBondContact O-CB 3.27Å; G820-S823 WeakPolarHBondContact O-CB 3.36Å; G820-S823 PolarHBondContact O-N 3Å; G820-S823 VanDerWaalsContact O-N 3.17Å; G820-S823 PolarHBondContact O-OG 3.17Å; M821-S823 PolarHBondContact O-N 2.99Å; S823-S1017 VanDerWaalsContact OG-CB 3.3Å; S823-S1017 WeakPolarHBondContact OG-CB 3.38Å; S823-S1017 PolarHBondContact OG-O 3.35Å; S823-S1017 PolarHBondContact OG-OG 2.79Å
824	G	79.3	Confident	74.2	Confident	9 Å²	9	46.3 Å²	46.3	9%	0.093	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	176	155.2	174.1	0	0	0	0	0	113	V812 S1017	V812-G824 WeakPolarHBondContact CB-O 3.46Å; V812-G824 PolarHBondContact N-O 3.29Å; V812-G824 PolarHBondContact O-N 3.27Å; G824-S1017 WeakPolarHBondContact CA-OG 3.44Å; G824-S1017 PolarHBondContact N-OG 3.36Å
825	F	85.1	Confident	74.7	Confident	43 Å²	43	46.7 Å²	46.7	19%	0.189	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	140.1	174.6	-66.7	-87.7	0	0	0	111.2	V810 L811 L835 S851 K853 G883	V810-F825 WeakPolarHBondContact O-CA 3.28Å; L811-F825 HydrophobicContact CB-CD1 4.03Å; L811-F825 HydrophobicContact CB-CE1 3.8Å; L811-F825 HydrophobicContact CB-CZ 4.4Å; L811-F825 HydrophobicContact CD1-CD1 4.19Å; L811-F825 HydrophobicContact CD1-CD2 4.16Å; L811-F825 HydrophobicContact CD1-CE1 3.95Å; L811-F825 HydrophobicContact CD1-CE2 3.88Å; L811-F825 HydrophobicContact CD1-CG 4.29Å; L811-F825 HydrophobicContact CD1-CZ 3.78Å; L811-F825 HydrophobicContact CD2-CE1 4.48Å; L811-F825 HydrophobicContact CD2-CZ 4.35Å; L811-F825 HydrophobicContact CG-CE1 4.27Å; L811-F825 HydrophobicContact CG-CZ 4.39Å; F825-L835 WeakPolarHBondContact O-CD1 3.4Å; F825-S851 WeakPolarHBondContact CD1-OG 3.09Å; F825-S851 VanDerWaalsContact CE1-OG 3.29Å; F825-S851 WeakPolarHBondContact CE1-OG 2.89Å; F825-K853 HydrophobicContact CE1-CB 4.37Å; F825-G883 VanDerWaalsContact CE2-O 3.31Å; F825-G883 WeakPolarHBondContact CE2-O 3.41Å
826	A	87.3	Confident	75.7	Confident	0 Å²	0	46 Å²	46	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	124.9	170	0	0	0	0	0	109.1	Y808 P809 V810 E831 L832 L835	Y808-A826 WeakPolarHBondContact CD1-O 3.26Å; Y808-A826 HydrophobicContact CE1-CB 4.39Å; P809-A826 WeakPolarHBondContact CA-O 3.45Å; V810-A826 HydrophobicContact CG2-CB 4.07Å; V810-A826 PolarHBondContact N-O 3.4Å; V810-A826 PolarHBondContact O-N 2.83Å; A826-E831 HydrophobicContact CB-CB 3.96Å; A826-L832 HydrophobicContact CB-CB 3.67Å; A826-L832 HydrophobicContact CB-CD1 4.37Å; A826-L835 HydrophobicContact CB-CD1 4.22Å
827	E	86.5	Confident	76.5	Confident	85 Å²	85	41.4 Å²	41.4	40%	0.397	24%	0.239	S	C	.	.	S	Bend	trans	-86.5	-15.9	175.5	-59.7	-71.9	166.4	0	0	111.3	Y808 P809 E831 K853	Y808-E827 WeakPolarHBondContact CB-O 3.46Å; P809-E827 WeakPolarHBondContact CB-OE2 3.49Å; E827-E831 PolarHBondContact N-OE2 3.15Å; E827-K853 IonicContact OE1-NZ 3.83Å; E827-K853 PolarHBondContact OE1-NZ 3.46Å
828	N	90.8	Very high	77.3	Confident	60 Å²	60	44.3 Å²	44.3	32%	0.321	24%	0.244	S	C	.	.	S	Bend	trans	-153.9	169.9	-178.1	57.5	68.8	0	0	0	111.9	Y808 T830 E831 L832	Y808-N828 WeakPolarHBondContact CE1-O 3.38Å; N828-T830 VanDerWaalsContact C-N 3.29Å; N828-T830 PolarHBondContact O-N 3.12Å; N828-T830 WeakPolarHBondContact OD1-CB 3.45Å; N828-T830 PolarHBondContact OD1-N 2.8Å; N828-T830 VanDerWaalsContact OD1-N 3.15Å; N828-E831 PolarHBondContact ND2-OE1 2.87Å; N828-E831 PolarHBondContact O-N 3.46Å; N828-E831 PolarHBondContact OD1-N 2.72Å; N828-L832 PolarHBondContact O-N 3.31Å; N828-L832 VanDerWaalsContact O-N 3.07Å
829	A	88.9	Confident	78.5	Confident	33 Å²	33	43.3 Å²	43.3	27%	0.273	24%	0.239	S	C	.	.	H	α-helix	trans	-59.8	-34.5	-178.6	0	0	0	0	0	113.8	V800 Y808 L832 E833	V800-A829 HydrophobicContact CG1-CB 4.32Å; Y808-A829 VanDerWaalsContact OH-CA 3.22Å; Y808-A829 WeakPolarHBondContact OH-CA 3.33Å; A829-L832 PolarHBondContact O-N 2.86Å; A829-E833 VanDerWaalsContact O-CG 3.29Å; A829-E833 WeakPolarHBondContact O-CG 3.42Å; A829-E833 PolarHBondContact O-N 3.32Å
830	T	86.1	Confident	79.7	Confident	106 Å²	106	44.3 Å²	44.3	65%	0.65	24%	0.241	S	C	*	.	H	α-helix	trans	-68.1	-43.3	-178.7	-54.1	0	0	0	0	111.1	N828 L832 R834	N828-T830 VanDerWaalsContact C-N 3.29Å; N828-T830 PolarHBondContact O-N 3.12Å; N828-T830 WeakPolarHBondContact OD1-CB 3.45Å; N828-T830 PolarHBondContact OD1-N 2.8Å; N828-T830 VanDerWaalsContact OD1-N 3.15Å; T830-L832 VanDerWaalsContact C-N 3.32Å; T830-R834 PolarHBondContact O-N 2.85Å
831	E	85.8	Confident	80.2	Confident	68 Å²	68	44.8 Å²	44.8	32%	0.318	24%	0.243	S	C	.	.	H	α-helix	trans	-64	-40.3	174.3	-75.5	171.5	-155.7	0	0	112	A826 E827 N828 R834 L835	A826-E831 HydrophobicContact CB-CB 3.96Å; E827-E831 PolarHBondContact N-OE2 3.15Å; N828-E831 PolarHBondContact ND2-OE1 2.87Å; N828-E831 PolarHBondContact O-N 3.46Å; N828-E831 PolarHBondContact OD1-N 2.72Å; E831-R834 PolarHBondContact O-N 3.17Å; E831-L835 WeakPolarHBondContact O-CG 3.33Å; E831-L835 PolarHBondContact O-N 3.25Å
832	L	89.7	Confident	80.2	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-63.1	-48	177.2	177	59.9	0	0	0	111.6	A799 V800 A803 Y808 V810 V812 A826 N828 A829 T830 R834 L835 A836 I848	A799-L832 HydrophobicContact CB-CD1 4.49Å; V800-L832 HydrophobicContact CG2-CD2 4.17Å; A803-L832 HydrophobicContact CB-CD2 3.29Å; Y808-L832 HydrophobicContact CE1-CB 4.17Å; Y808-L832 HydrophobicContact CE1-CD2 4.1Å; Y808-L832 VanDerWaalsContact OH-CD2 3.22Å; Y808-L832 WeakPolarHBondContact OH-CD2 3.47Å; V810-L832 HydrophobicContact CG2-CD1 4.27Å; V810-L832 HydrophobicContact CG2-CD2 4.35Å; V812-L832 HydrophobicContact CG2-CD1 3.28Å; A826-L832 HydrophobicContact CB-CB 3.67Å; A826-L832 HydrophobicContact CB-CD1 4.37Å; N828-L832 PolarHBondContact O-N 3.31Å; N828-L832 VanDerWaalsContact O-N 3.07Å; A829-L832 PolarHBondContact O-N 2.86Å; T830-L832 VanDerWaalsContact C-N 3.32Å; L832-R834 PolarHBondContact O-N 2.93Å; L832-L835 PolarHBondContact O-N 2.96Å; L832-L835 VanDerWaalsContact O-N 3.1Å; L832-A836 HydrophobicContact CD1-CB 4.35Å; L832-A836 WeakPolarHBondContact O-CB 3.38Å; L832-A836 PolarHBondContact O-N 3.11Å; L832-I848 HydrophobicContact CD1-CD1 3.84Å
833	E	87.9	Confident	80.2	Confident	98 Å²	98	45.4 Å²	45.4	46%	0.458	24%	0.241	S	C	.	.	H	α-helix	trans	-56.5	-41.8	178.5	-75	176.3	176.6	0	0	111.6	V796 V800 A829 G837	V796-E833 HydrophobicContact CG1-CB 3.94Å; V796-E833 HydrophobicContact CG1-CG 3.76Å; V800-E833 HydrophobicContact CG2-CG 3.71Å; A829-E833 VanDerWaalsContact O-CG 3.29Å; A829-E833 WeakPolarHBondContact O-CG 3.42Å; A829-E833 PolarHBondContact O-N 3.32Å; E833-G837 PolarHBondContact O-N 3.4Å
834	R	79.9	Confident	79.8	Confident	141 Å²	141	50.7 Å²	50.7	53%	0.532	27%	0.272	S	S	.	.	H	α-helix	trans	-66.5	-40.6	176.8	-170.7	-168.3	66.9	108.5	7.6	112.5	T830 E831 L832 K838	T830-R834 PolarHBondContact O-N 2.85Å; E831-R834 PolarHBondContact O-N 3.17Å; L832-R834 PolarHBondContact O-N 2.93Å; R834-K838 WeakPolarHBondContact O-CD 3.3Å; R834-K838 VanDerWaalsContact O-CG 3.26Å; R834-K838 WeakPolarHBondContact O-CG 3.46Å; R834-K838 PolarHBondContact O-N 2.88Å
835	L	81.5	Confident	79.8	Confident	21 Å²	21	52.7 Å²	52.7	11%	0.11	28%	0.279	C	S	.	.	H	α-helix	trans	-74.5	-50	179.4	-75.6	171.8	0	0	0	111.8	V812 F825 A826 E831 L832 G837 K838 A839	V812-L835 HydrophobicContact CG2-CB 4.05Å; V812-L835 HydrophobicContact CG2-CD1 4.4Å; F825-L835 WeakPolarHBondContact O-CD1 3.4Å; A826-L835 HydrophobicContact CB-CD1 4.22Å; E831-L835 WeakPolarHBondContact O-CG 3.33Å; E831-L835 PolarHBondContact O-N 3.25Å; L832-L835 PolarHBondContact O-N 2.96Å; L832-L835 VanDerWaalsContact O-N 3.1Å; L835-G837 VanDerWaalsContact C-N 3.34Å; L835-G837 PolarHBondContact O-N 2.88Å; L835-K838 WeakPolarHBondContact O-CB 3.44Å; L835-K838 PolarHBondContact O-N 3.01Å; L835-K838 VanDerWaalsContact O-N 3.1Å; L835-A839 WeakPolarHBondContact O-CB 3.37Å; L835-A839 PolarHBondContact O-N 3Å
836	A	84.1	Confident	79.7	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-58.1	-44.9	176.9	0	0	0	0	0	111.4	V796 A799 L832 K838 A839 L840 I846	V796-A836 HydrophobicContact CG2-CB 4.37Å; A799-A836 HydrophobicContact CB-CB 3.95Å; L832-A836 HydrophobicContact CD1-CB 4.35Å; L832-A836 WeakPolarHBondContact O-CB 3.38Å; L832-A836 PolarHBondContact O-N 3.11Å; A836-K838 VanDerWaalsContact C-N 3.25Å; A836-K838 PolarHBondContact O-N 2.83Å; A836-A839 PolarHBondContact O-N 3.28Å; A836-L840 VanDerWaalsContact O-CB 3.28Å; A836-L840 WeakPolarHBondContact O-CB 3.14Å; A836-L840 WeakPolarHBondContact O-CG 3.3Å; A836-L840 PolarHBondContact O-N 3.12Å; A836-I846 HydrophobicContact CB-CD1 3.46Å; A836-I846 VanDerWaalsContact CB-CD1 3.46Å
837	G	77.6	Confident	79.5	Confident	35 Å²	35	51.2 Å²	51.2	36%	0.361	27%	0.273	S	S	.	.	H	α-helix	trans	-61.5	-31.8	176.8	0	0	0	0	0	113.5	E833 L835	E833-G837 PolarHBondContact O-N 3.4Å; L835-G837 VanDerWaalsContact C-N 3.34Å; L835-G837 PolarHBondContact O-N 2.88Å
838	K	71.2	Confident	79.5	Confident	96 Å²	96	47.2 Å²	47.2	42%	0.417	25%	0.254	S	S	.	.	H	α-helix	trans	-76.8	-46.8	174.4	-72.8	172.3	-179.3	-175.2	0	112.1	R834 L835 A836 A841	R834-K838 WeakPolarHBondContact O-CD 3.3Å; R834-K838 VanDerWaalsContact O-CG 3.26Å; R834-K838 WeakPolarHBondContact O-CG 3.46Å; R834-K838 PolarHBondContact O-N 2.88Å; L835-K838 WeakPolarHBondContact O-CB 3.44Å; L835-K838 PolarHBondContact O-N 3.01Å; L835-K838 VanDerWaalsContact O-N 3.1Å; A836-K838 VanDerWaalsContact C-N 3.25Å; A836-K838 PolarHBondContact O-N 2.83Å; K838-A841 VanDerWaalsContact O-CB 3.31Å; K838-A841 WeakPolarHBondContact O-CB 3.45Å; K838-A841 PolarHBondContact O-N 3.28Å; K838-A841 VanDerWaalsContact O-N 3.15Å
839	A	77.6	Confident	79.2	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-62.8	-44.6	-179.1	0	0	0	0	0	111.2	V812 A814 G822 L835 A836 A841 Q842 T843 I846	V812-A839 HydrophobicContact CG1-CB 4.35Å; A814-A839 HydrophobicContact CB-CB 4.44Å; G822-A839 WeakPolarHBondContact O-CB 3.35Å; L835-A839 WeakPolarHBondContact O-CB 3.37Å; L835-A839 PolarHBondContact O-N 3Å; A836-A839 PolarHBondContact O-N 3.28Å; A839-A841 PolarHBondContact O-N 3.12Å; A839-Q842 PolarHBondContact O-N 3.48Å; A839-T843 VanDerWaalsContact O-CG2 3.29Å; A839-T843 WeakPolarHBondContact O-CG2 3.36Å; A839-T843 PolarHBondContact O-N 2.95Å; A839-I846 HydrophobicContact CB-CG2 3.53Å
840	L	77	Confident	79	Confident	36 Å²	36	47.8 Å²	47.8	19%	0.188	25%	0.248	C	C	.	.	H	α-helix	trans	-66.9	-13.8	175.8	-71.6	166.2	0	0	0	114	S795 V796 A836 Q842 T843 I846	S795-L840 VanDerWaalsContact C-CD1 3.49Å; V796-L840 HydrophobicContact CG2-CD1 4.09Å; A836-L840 VanDerWaalsContact O-CB 3.28Å; A836-L840 WeakPolarHBondContact O-CB 3.14Å; A836-L840 WeakPolarHBondContact O-CG 3.3Å; A836-L840 PolarHBondContact O-N 3.12Å; L840-Q842 VanDerWaalsContact C-N 3.32Å; L840-T843 CarbonylContact C-O 3.58Å; L840-T843 VanDerWaalsContact C-O 3.32Å; L840-T843 VanDerWaalsContact CA-O 3.27Å; L840-T843 WeakPolarHBondContact CA-O 3.27Å; L840-I846 HydrophobicContact CD1-CD1 4.03Å; L840-I846 HydrophobicContact CD1-CG1 4.44Å; L840-I846 HydrophobicContact CD2-CG1 4.13Å; L840-I846 HydrophobicContact CD2-CG2 3.89Å; L840-I846 HydrophobicContact CG-CD1 3.99Å; L840-I846 HydrophobicContact CG-CG1 4.14Å; L840-I846 HydrophobicContact CG-CG2 3.89Å
841	A	65.5	Low	79	Confident	29 Å²	29	43.5 Å²	43.5	24%	0.24	22%	0.223	C	C	.	.	H	α-helix	trans	-74.8	-26.1	169.8	0	0	0	0	0	111.9	K838 A839 K1753	K838-A841 VanDerWaalsContact O-CB 3.31Å; K838-A841 WeakPolarHBondContact O-CB 3.45Å; K838-A841 PolarHBondContact O-N 3.28Å; K838-A841 VanDerWaalsContact O-N 3.15Å; A839-A841 PolarHBondContact O-N 3.12Å; A841-K1753 WeakPolarHBondContact O-CE 3.4Å; A841-K1753 PolarHBondContact O-NZ 3.46Å
842	Q	62.2	Low	79	Confident	53 Å²	53	41.1 Å²	41.1	25%	0.248	21%	0.212	C	C	.	.	H	α-helix	trans	-96.1	-37.5	-178.2	-64.6	-174.1	-16.4	0	0	112.1	A839 L840 K1753 D1787	A839-Q842 PolarHBondContact O-N 3.48Å; L840-Q842 VanDerWaalsContact C-N 3.32Å; Q842-K1753 PolarHBondContact O-NZ 3.35Å; Q842-D1787 PolarHBondContact NE2-O 3.28Å
843	T	65.8	Low	78.8	Confident	22 Å²	22	45.9 Å²	45.9	14%	0.135	23%	0.232	C	C	.	.			trans	-125.1	157.6	-179.1	-177.1	0	0	0	0	111.8	A814 A815 A839 L840 Q845 I846	A814-T843 HydrophobicContact CB-CG2 3.63Å; A815-T843 PolarHBondContact O-OG1 3.42Å; A839-T843 VanDerWaalsContact O-CG2 3.29Å; A839-T843 WeakPolarHBondContact O-CG2 3.36Å; A839-T843 PolarHBondContact O-N 2.95Å; L840-T843 CarbonylContact C-O 3.58Å; L840-T843 VanDerWaalsContact C-O 3.32Å; L840-T843 VanDerWaalsContact CA-O 3.27Å; L840-T843 WeakPolarHBondContact CA-O 3.27Å; T843-Q845 VanDerWaalsContact C-N 3.3Å; T843-Q845 WeakPolarHBondContact CG2-O 3.37Å; T843-Q845 PolarHBondContact OG1-O 3.26Å; T843-I846 HydrophobicContact CG2-CG2 3.84Å
844	T	67.2	Low	78.6	Confident	129 Å²	129	42.1 Å²	42.1	79%	0.791	22%	0.22	S	C	*	.	S	Bend	trans	-79	-14.9	178.2	50.1	0	0	0	0	113.4
845	Q	77.3	Confident	79.3	Confident	51 Å²	51	38.1 Å²	38.1	24%	0.238	21%	0.205	C	C	.	.			trans	-147.3	139.4	-174.4	-174.2	-174.9	43.7	0	0	109.9	A792 T794 A815 T843	A792-Q845 HydrophobicContact CB-CG 4.18Å; T794-Q845 HydrophobicContact CG2-CG 4.33Å; A815-Q845 WeakPolarHBondContact CB-O 3.39Å; A815-Q845 PolarHBondContact N-O 3.2Å; T843-Q845 VanDerWaalsContact C-N 3.3Å; T843-Q845 WeakPolarHBondContact CG2-O 3.37Å; T843-Q845 PolarHBondContact OG1-O 3.26Å
846	I	83.3	Confident	79.9	Confident	0 Å²	0	38 Å²	38	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	156.2	174.1	62.3	174.8	0	0	0	109.5	A792 A793 A799 V812 R813 A836 A839 L840 T843 I848	A792-I846 CarbonylContact C-O 3.59Å; A792-I846 WeakPolarHBondContact CA-O 3.46Å; A793-I846 HydrophobicContact CB-CG1 4.05Å; A793-I846 PolarHBondContact N-O 3.47Å; A793-I846 WeakPolarHBondContact O-CG1 3.33Å; A793-I846 PolarHBondContact O-N 2.98Å; A799-I846 HydrophobicContact CB-CD1 4.04Å; V812-I846 HydrophobicContact CG1-CB 4.43Å; V812-I846 HydrophobicContact CG1-CD1 4.01Å; R813-I846 CarbonylContact O-C 3.51Å; R813-I846 VanDerWaalsContact O-CA 3.27Å; R813-I846 WeakPolarHBondContact O-CA 3.47Å; R813-I846 WeakPolarHBondContact O-CB 3.37Å; A836-I846 HydrophobicContact CB-CD1 3.46Å; A836-I846 VanDerWaalsContact CB-CD1 3.46Å; A839-I846 HydrophobicContact CB-CG2 3.53Å; L840-I846 HydrophobicContact CD1-CD1 4.03Å; L840-I846 HydrophobicContact CD1-CG1 4.44Å; L840-I846 HydrophobicContact CD2-CG1 4.13Å; L840-I846 HydrophobicContact CD2-CG2 3.89Å; L840-I846 HydrophobicContact CG-CD1 3.99Å; L840-I846 HydrophobicContact CG-CG1 4.14Å; L840-I846 HydrophobicContact CG-CG2 3.89Å; T843-I846 HydrophobicContact CG2-CG2 3.84Å; I846-I848 HydrophobicContact CD1-CD1 4.03Å; I846-I848 HydrophobicContact CG1-CD1 4.4Å
847	F	82.8	Confident	80.5	Confident	13 Å²	13	38.5 Å²	38.5	6%	0.057	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	134.5	173.7	-70.8	-87.5	0	0	0	109.3	R773 A792 V812 R813 A815	R773-F847 HydrophobicContact CB-CD1 3.91Å; R773-F847 HydrophobicContact CB-CD2 4.04Å; R773-F847 HydrophobicContact CB-CE1 3.7Å; R773-F847 HydrophobicContact CB-CE2 3.85Å; R773-F847 HydrophobicContact CB-CG 4.08Å; R773-F847 HydrophobicContact CB-CZ 3.69Å; R773-F847 HydrophobicContact CG-CD2 4.03Å; R773-F847 HydrophobicContact CG-CE2 4.13Å; R773-F847 HydrophobicContact CG-CG 4.27Å; R773-F847 HydrophobicContact CG-CZ 4.47Å; A792-F847 HydrophobicContact CB-CD1 3.96Å; A792-F847 HydrophobicContact CB-CE1 3.62Å; A792-F847 HydrophobicContact CB-CZ 4.19Å; V812-F847 CarbonylContact C-O 3.59Å; V812-F847 WeakPolarHBondContact CA-O 3.32Å; R813-F847 PolarHBondContact N-O 3.16Å; R813-F847 PolarHBondContact O-N 2.81Å; A815-F847 HydrophobicContact CB-CD2 4.44Å; A815-F847 HydrophobicContact CB-CE2 4.05Å
848	I	87	Confident	81.4	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	116	173.8	-51	-55.1	0	0	0	107.1	A790 N791 A793 A799 V802 A803 L806 V810 L811 V812 L832 I846	A790-I848 VanDerWaalsContact CA-O 3.31Å; A790-I848 WeakPolarHBondContact CA-O 3.39Å; N791-I848 PolarHBondContact N-O 2.89Å; N791-I848 PolarHBondContact O-N 3.37Å; A793-I848 HydrophobicContact CB-CG1 4.3Å; A799-I848 HydrophobicContact CB-CD1 3.98Å; A799-I848 HydrophobicContact CB-CG1 4.02Å; V802-I848 HydrophobicContact CB-CB 4.34Å; V802-I848 HydrophobicContact CB-CG1 4.45Å; V802-I848 HydrophobicContact CG1-CB 3.7Å; V802-I848 HydrophobicContact CG1-CG1 4.31Å; V802-I848 HydrophobicContact CG1-CG2 4.09Å; A803-I848 HydrophobicContact CB-CG2 4.08Å; L806-I848 HydrophobicContact CD1-CG2 4.15Å; L806-I848 VanDerWaalsContact CD1-O 3.23Å; L806-I848 WeakPolarHBondContact CD1-O 3.19Å; V810-I848 HydrophobicContact CB-CG2 3.77Å; V810-I848 HydrophobicContact CG1-CG2 4.06Å; V810-I848 HydrophobicContact CG2-CG2 3.94Å; L811-I848 WeakPolarHBondContact O-CA 3.23Å; V812-I848 HydrophobicContact CB-CD1 4.28Å; V812-I848 HydrophobicContact CG1-CD1 4.05Å; V812-I848 HydrophobicContact CG2-CD1 3.93Å; L832-I848 HydrophobicContact CD1-CD1 3.84Å; I846-I848 HydrophobicContact CD1-CD1 4.03Å; I846-I848 HydrophobicContact CG1-CD1 4.4Å
849	D	84.5	Confident	82.5	Confident	6 Å²	6	32.3 Å²	32.3	3%	0.032	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	149.8	-179.5	-61.3	-84.6	0	0	0	111	A790 V810 L811 R813 S851	A790-D849 HydrophobicContact CB-CB 4.5Å; A790-D849 WeakPolarHBondContact CB-OD1 3.35Å; V810-D849 CarbonylContact C-O 3.49Å; V810-D849 VanDerWaalsContact CA-O 3.26Å; V810-D849 WeakPolarHBondContact CA-O 3.39Å; V810-D849 WeakPolarHBondContact CB-O 3.1Å; L811-D849 HydrophobicContact CB-CB 4.27Å; L811-D849 PolarHBondContact N-O 3.48Å; L811-D849 PolarHBondContact O-N 2.85Å; R813-D849 IonicContact CZ-OD1 2.6Å; R813-D849 IonicContact CZ-OD2 2.81Å; R813-D849 IonicContact NE-OD2 2.69Å; R813-D849 PolarHBondContact NE-OD2 3.01Å; R813-D849 IonicContact NH2-OD1 3.97Å; R813-D849 PolarHBondContact NH2-OD1 3.36Å; R813-D849 IonicContact NH2-OD2 3.32Å; R813-D849 PolarHBondContact NH2-OD2 3.03Å; D849-S851 PolarHBondContact O-N 3.44Å
850	K	85.9	Confident	83.4	Confident	99 Å²	99	32.3 Å²	32.3	43%	0.43	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.7	126.1	163.4	-175.8	173.8	-178.3	177	0	109	P789 L852	P789-K850 HydrophobicContact CB-CB 4.36Å; P789-K850 HydrophobicContact CG-CD 4.46Å; P789-K850 PolarHBondContact O-N 2.94Å; K850-L852 PolarHBondContact O-N 3.19Å
851	S	86.1	Confident	84.4	Confident	17 Å²	17	30.6 Å²	30.6	12%	0.119	16%	0.16	C	C	.	.			trans	-65.3	132.5	177.7	-178	0	0	0	0	111.1	P809 F825 D849 K853	P809-S851 WeakPolarHBondContact O-CB 3.34Å; P809-S851 PolarHBondContact O-N 3.45Å; F825-S851 WeakPolarHBondContact CD1-OG 3.09Å; F825-S851 VanDerWaalsContact CE1-OG 3.29Å; F825-S851 WeakPolarHBondContact CE1-OG 2.89Å; D849-S851 PolarHBondContact O-N 3.44Å; S851-K853 VanDerWaalsContact OG-CB 3.22Å; S851-K853 WeakPolarHBondContact OG-CB 3.4Å; S851-K853 PolarHBondContact OG-N 3.26Å
852	L	86	Confident	85.9	Confident	17 Å²	17	29.3 Å²	29.3	9%	0.089	15%	0.149	C	C	.	.			trans	-105.5	22.3	170	-56.7	178.5	0	0	0	111	A788 K850 G854 W855 V882 A928 Y937	A788-L852 HydrophobicContact CB-CD1 4.14Å; K850-L852 PolarHBondContact O-N 3.19Å; L852-G854 PolarHBondContact O-N 3.35Å; L852-W855 HydrophobicContact CB-CG 4.36Å; L852-W855 WeakPolarHBondContact O-CB 3.4Å; L852-W855 VanDerWaalsContact O-CD1 3.32Å; L852-W855 PolarHBondContact O-N 3.39Å; L852-W855 VanDerWaalsContact O-N 3.15Å; L852-V882 HydrophobicContact CB-CG1 4.18Å; L852-V882 WeakPolarHBondContact O-CB 3.21Å; L852-A928 HydrophobicContact CB-CB 4.26Å; L852-A928 HydrophobicContact CD1-CB 3.56Å; L852-Y937 HydrophobicContact CD1-CD2 3.8Å; L852-Y937 HydrophobicContact CD1-CG 4Å; L852-Y937 HydrophobicContact CD2-CD2 3.76Å; L852-Y937 HydrophobicContact CD2-CE2 4.01Å; L852-Y937 HydrophobicContact CG-CD2 4.47Å
853	K	84	Confident	87.5	Confident	100 Å²	100	26.8 Å²	26.8	44%	0.435	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.3	131.5	-177.1	-177.8	178	172.8	-174.9	0	110.9	F825 E827 S851 V882	F825-K853 HydrophobicContact CE1-CB 4.37Å; E827-K853 IonicContact OE1-NZ 3.83Å; E827-K853 PolarHBondContact OE1-NZ 3.46Å; S851-K853 VanDerWaalsContact OG-CB 3.22Å; S851-K853 WeakPolarHBondContact OG-CB 3.4Å; S851-K853 PolarHBondContact OG-N 3.26Å; K853-V882 VanDerWaalsContact CA-O 3.25Å; K853-V882 WeakPolarHBondContact CA-O 3.47Å
854	G	84	Confident	88.9	Confident	20 Å²	20	25.7 Å²	25.7	21%	0.206	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	93.1	-7.3	-178.5	0	0	0	0	0	115.5	L852 V882	L852-G854 PolarHBondContact O-N 3.35Å; G854-V882 PolarHBondContact N-O 3.42Å
855	W	93.9	Very high	90.3	Very high	57 Å²	57	19.6 Å²	19.6	22%	0.216	9%	0.093	C	C	.	.	S	Bend	trans	-77.3	160.9	175	-71.7	38.1	0	0	0	111.1	L852 P881 V882 A928 D930 N935 Y937	L852-W855 HydrophobicContact CB-CG 4.36Å; L852-W855 WeakPolarHBondContact O-CB 3.4Å; L852-W855 VanDerWaalsContact O-CD1 3.32Å; L852-W855 PolarHBondContact O-N 3.39Å; L852-W855 VanDerWaalsContact O-N 3.15Å; W855-P881 WeakPolarHBondContact O-CA 3.48Å; W855-V882 HydrophobicContact CB-CB 4.48Å; W855-V882 HydrophobicContact CB-CG2 4.19Å; W855-V882 WeakPolarHBondContact O-CG2 3.48Å; W855-V882 PolarHBondContact O-N 2.77Å; W855-A928 HydrophobicContact CB-CB 4.35Å; W855-A928 HydrophobicContact CE3-CB 4.26Å; W855-D930 HydrophobicContact CD2-CB 4.3Å; W855-D930 HydrophobicContact CE3-CB 3.91Å; W855-D930 HydrophobicContact CH2-CB 3.7Å; W855-D930 HydrophobicContact CZ2-CB 4.11Å; W855-D930 HydrophobicContact CZ3-CB 3.6Å; W855-N935 HydrophobicContact CH2-CB 4.46Å; W855-Y937 HydrophobicContact CH2-CD2 4.07Å; W855-Y937 AromaticContact CH2-CE2 3.84Å; W855-Y937 HydrophobicContact CH2-CE2 3.84Å; W855-Y937 AromaticContact CZ3-CD2 3.78Å; W855-Y937 HydrophobicContact CZ3-CD2 3.78Å; W855-Y937 HydrophobicContact CZ3-CE2 4.04Å
856	K	96	Very high	91	Very high	19 Å²	19	17.1 Å²	17.1	8%	0.083	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	135.5	174.1	-59.4	-169.1	175.5	-163.4	0	109.4	T897 A928 L929 P931 D1093	K856-T897 PolarHBondContact NZ-OG1 3.37Å; K856-A928 CarbonylContact O-C 3.31Å; K856-A928 WeakPolarHBondContact O-CA 3.39Å; K856-L929 HydrophobicContact CB-CB 4.29Å; K856-L929 PolarHBondContact N-O 3.34Å; K856-L929 PolarHBondContact O-N 3.15Å; K856-P931 HydrophobicContact CG-CB 4.25Å; K856-D1093 WeakPolarHBondContact CE-OD2 3.24Å; K856-D1093 IonicContact NZ-OD2 2.79Å; K856-D1093 PolarHBondContact NZ-OD2 3.29Å
857	E	95.9	Very high	91.5	Very high	10 Å²	10	20.6 Å²	20.6	5%	0.047	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	124.9	175.2	-167	167.3	-156	0	0	110.1	N878 V882 T886 F927 I939	E857-N878 HydrophobicContact CB-CB 4.09Å; E857-N878 VanDerWaalsContact CD-ND2 3.31Å; E857-N878 PolarHBondContact O-N 3.1Å; E857-N878 PolarHBondContact OE2-ND2 2.83Å; E857-V882 HydrophobicContact CB-CG2 3.72Å; E857-V882 HydrophobicContact CG-CG2 4.16Å; E857-T886 HydrophobicContact CG-CG2 4.35Å; E857-T886 WeakPolarHBondContact OE1-CG2 3.22Å; E857-F927 WeakPolarHBondContact CA-O 3.3Å; E857-I939 HydrophobicContact CG-CD1 4.09Å
858	V	96.5	Very high	92	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	134.5	-174.3	-176.2	0	0	0	0	109.5	Y860 M876 L898 L906 F927	V858-Y860 HydrophobicContact CG1-CD2 4.22Å; V858-Y860 HydrophobicContact CG1-CE2 3.7Å; V858-M876 CarbonylContact C-O 3.48Å; V858-M876 WeakPolarHBondContact CA-O 3.46Å; V858-M876 WeakPolarHBondContact CG1-O 3.2Å; V858-L898 HydrophobicContact CG1-CD1 3.83Å; V858-L898 HydrophobicContact CG2-CD1 4.05Å; V858-L898 HydrophobicContact CG2-CD2 4.23Å; V858-L906 HydrophobicContact CB-CD1 4.05Å; V858-L906 HydrophobicContact CG1-CD1 3.94Å; V858-L906 HydrophobicContact CG2-CD1 4.25Å; V858-F927 PolarHBondContact N-O 2.69Å; V858-F927 PolarHBondContact O-N 2.89Å
859	E	95	Very high	92.4	Very high	1 Å²	1	20.7 Å²	20.7	1%	0.005	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	144.2	179.6	-46.4	-172.7	-165.3	0	0	112	N875 M876 T886 N924 I925 Q926 S948	E859-N875 WeakPolarHBondContact O-CA 3.27Å; E859-M876 HydrophobicContact CB-CB 4.28Å; E859-M876 HydrophobicContact CB-CE 4.18Å; E859-M876 PolarHBondContact N-O 2.84Å; E859-M876 PolarHBondContact O-N 3.01Å; E859-T886 WeakPolarHBondContact OE1-CB 3.29Å; E859-T886 WeakPolarHBondContact OE1-CG2 3.25Å; E859-N924 PolarHBondContact OE2-ND2 3.38Å; E859-N924 VanDerWaalsContact OE2-ND2 3.13Å; E859-I925 WeakPolarHBondContact CA-O 3.44Å; E859-Q926 HydrophobicContact CG-CG 3.99Å; E859-S948 PolarHBondContact OE2-OG 3.24Å
860	Y	96.4	Very high	93	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	126.8	171.4	-78.2	-98.6	0	0	0	110.5	V858 T872 N875 Y903 L906 R907 A910 I925 F927	V858-Y860 HydrophobicContact CG1-CD2 4.22Å; V858-Y860 HydrophobicContact CG1-CE2 3.7Å; Y860-T872 HydrophobicContact CD1-CG2 4.09Å; Y860-N875 HydrophobicContact CD1-CB 4Å; Y860-N875 HydrophobicContact CE1-CB 3.64Å; Y860-N875 HydrophobicContact CE2-CB 4.46Å; Y860-Y903 HydrophobicContact CE1-CE1 4.49Å; Y860-Y903 WeakPolarHBondContact OH-CA 3.44Å; Y860-Y903 PolarHBondContact OH-O 2.79Å; Y860-L906 HydrophobicContact CD2-CB 4.31Å; Y860-L906 HydrophobicContact CE2-CB 3.58Å; Y860-L906 HydrophobicContact CE2-CD1 4.34Å; Y860-R907 HydrophobicContact CD1-CB 4.45Å; Y860-R907 HydrophobicContact CE1-CB 3.87Å; Y860-R907 HydrophobicContact CE1-CG 4.45Å; Y860-A910 HydrophobicContact CG-CB 4.4Å; Y860-I925 PolarHBondContact N-O 3.1Å; Y860-I925 PolarHBondContact O-N 3.28Å; Y860-F927 HydrophobicContact CD2-CD2 4.06Å; Y860-F927 AromaticContact CD2-CE2 3.83Å; Y860-F927 HydrophobicContact CD2-CE2 3.83Å
861	E	96.3	Very high	93.4	Very high	0 Å²	0	16 Å²	16	0%	0	8%	0.076	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	122.6	168.5	-66.4	-77.4	139.4	0	0	108.7	T872 V873 C874 M876 E922 N924 S948 S949 A952 I960	E861-T872 CarbonylContact O-C 3.59Å; E861-T872 WeakPolarHBondContact O-CA 3.3Å; E861-V873 HydrophobicContact CB-CG2 3.64Å; E861-V873 WeakPolarHBondContact O-CG2 3.4Å; E861-V873 PolarHBondContact O-N 3.06Å; E861-C874 HydrophobicContact CB-CB 4.19Å; E861-C874 HydrophobicContact CG-CB 4.27Å; E861-C874 PolarHBondContact N-O 3.24Å; E861-M876 HydrophobicContact CG-CE 3.85Å; E861-E922 VanDerWaalsContact OE2-OE1 3.05Å; E861-N924 WeakPolarHBondContact OE1-CB 3.14Å; E861-N924 PolarHBondContact OE1-ND2 3.48Å; E861-S948 WeakPolarHBondContact OE1-CB 3.27Å; E861-S949 WeakPolarHBondContact OE2-CA 3.45Å; E861-S949 WeakPolarHBondContact OE2-CB 3.33Å; E861-S949 PolarHBondContact OE2-OG 3.13Å; E861-A952 HydrophobicContact CG-CB 3.8Å; E861-I960 HydrophobicContact CB-CD1 4.48Å
862	V	97	Very high	93.9	Very high	1 Å²	1	15.3 Å²	15.3	1%	0.006	7%	0.072	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	134.5	-171.2	-169.1	0	0	0	0	109.9	I871 T872 A910 A914 E922 C923 I925	V862-I871 WeakPolarHBondContact CA-O 3.29Å; V862-I871 WeakPolarHBondContact CG1-O 3.37Å; V862-T872 HydrophobicContact CG2-CG2 4.17Å; V862-A910 HydrophobicContact CG2-CB 3.96Å; V862-A914 HydrophobicContact CB-CB 4.47Å; V862-A914 HydrophobicContact CG1-CB 3.78Å; V862-E922 CarbonylContact O-C 3.56Å; V862-E922 VanDerWaalsContact O-CA 3.25Å; V862-E922 WeakPolarHBondContact O-CA 3.47Å; V862-C923 PolarHBondContact N-O 3.24Å; V862-C923 PolarHBondContact O-N 3.31Å; V862-I925 HydrophobicContact CG2-CD1 4.12Å; V862-I925 HydrophobicContact CG2-CG1 4.39Å
863	I	96	Very high	94.2	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	7%	0.068	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	132.5	174.3	-62.5	-174.1	0	0	0	109.6	C870 I871 V873 G921 E922 Y958 I960 I963 L967 L973	I863-C870 CarbonylContact O-C 3.59Å; I863-C870 VanDerWaalsContact O-CA 3.3Å; I863-C870 WeakPolarHBondContact O-CA 3.23Å; I863-I871 HydrophobicContact CB-CG1 4.1Å; I863-I871 PolarHBondContact N-O 3.05Å; I863-I871 PolarHBondContact O-N 3.34Å; I863-V873 HydrophobicContact CD1-CG1 3.7Å; I863-V873 HydrophobicContact CD1-CG2 4.23Å; I863-V873 HydrophobicContact CG1-CG1 4.01Å; I863-V873 HydrophobicContact CG1-CG2 4.19Å; I863-G921 WeakPolarHBondContact CA-O 3.44Å; I863-E922 HydrophobicContact CG1-CB 4.23Å; I863-E922 HydrophobicContact CG1-CG 4.47Å; I863-Y958 HydrophobicContact CD1-CD1 4.23Å; I863-Y958 HydrophobicContact CD1-CE1 3.5Å; I863-I960 HydrophobicContact CD1-CG1 4.42Å; I863-I960 HydrophobicContact CD1-CG2 4.14Å; I863-I963 HydrophobicContact CD1-CG2 4.39Å; I863-I963 HydrophobicContact CG2-CG2 4.35Å; I863-L967 HydrophobicContact CG2-CD1 3.43Å; I863-L967 VanDerWaalsContact CG2-CD1 3.43Å; I863-L973 HydrophobicContact CG2-CD1 4.21Å; I863-L973 HydrophobicContact CG2-CD2 4.31Å
864	R	96.5	Very high	94.7	Very high	0 Å²	0	10.2 Å²	10.2	0%	0	5%	0.05	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	138.6	176.1	-178.7	177.2	176.8	-79.9	-0.5	111.7	Y618 E624 D868 N869 C870 I919 V920 G921	Y618-R864 PolarHBondContact OH-NH2 3.2Å; Y618-R864 VanDerWaalsContact OH-NH2 3.13Å; E624-R864 IonicContact OE1-CZ 3.82Å; E624-R864 IonicContact OE1-NH1 3.34Å; E624-R864 PolarHBondContact OE1-NH1 3.45Å; E624-R864 IonicContact OE1-NH2 2.77Å; E624-R864 PolarHBondContact OE1-NH2 3.35Å; R864-D868 IonicContact CZ-OD1 3.69Å; R864-D868 VanDerWaalsContact CZ-OD1 3.3Å; R864-D868 IonicContact NE-OD1 3.05Å; R864-D868 PolarHBondContact NE-OD1 2.97Å; R864-D868 IonicContact NH2-OD1 3.63Å; R864-D868 PolarHBondContact NH2-OD1 2.96Å; R864-N869 VanDerWaalsContact CA-O 3.31Å; R864-N869 WeakPolarHBondContact CA-O 3.06Å; R864-C870 HydrophobicContact CB-CB 4.28Å; R864-C870 HydrophobicContact CG-CB 4.21Å; R864-I919 WeakPolarHBondContact CB-O 3.23Å; R864-I919 VanDerWaalsContact CD-O 3.23Å; R864-I919 WeakPolarHBondContact CD-O 3.22Å; R864-I919 VanDerWaalsContact CG-O 3.28Å; R864-I919 WeakPolarHBondContact CG-O 3.48Å; R864-I919 PolarHBondContact NH1-O 3.43Å; R864-V920 WeakPolarHBondContact O-CA 2.99Å; R864-G921 PolarHBondContact N-O 3.38Å; R864-G921 PolarHBondContact O-N 3.45Å
865	D	95.7	Very high	95.2	Very high	0 Å²	0	9.4 Å²	9.4	0%	0	4%	0.041	C	C	.	.			trans	-98.3	173.3	172.4	73.1	13.7	0	0	0	113.3	Y867 D868 N869 L967 S972 L973	D865-Y867 PolarHBondContact O-N 3.34Å; D865-Y867 VanDerWaalsContact O-N 3.15Å; D865-Y867 VanDerWaalsContact OD1-C 3.24Å; D865-Y867 VanDerWaalsContact OD1-CA 3.29Å; D865-Y867 WeakPolarHBondContact OD1-CA 3.39Å; D865-Y867 WeakPolarHBondContact OD1-CB 3.35Å; D865-Y867 PolarHBondContact OD1-N 2.84Å; D865-D868 PolarHBondContact O-N 2.84Å; D865-D868 PolarHBondContact OD1-N 3.23Å; D865-N869 PolarHBondContact N-O 2.98Å; D865-N869 PolarHBondContact OD1-N 2.84Å; D865-N869 PolarHBondContact OD1-ND2 3.47Å; D865-N869 WeakPolarHBondContact OD2-CB 3.39Å; D865-N869 PolarHBondContact OD2-ND2 3.34Å; D865-L967 HydrophobicContact CB-CD1 4.25Å; D865-L967 HydrophobicContact CB-CD2 3.72Å; D865-L967 HydrophobicContact CB-CG 4.47Å; D865-S972 WeakPolarHBondContact OD2-CA 3.36Å; D865-S972 PolarHBondContact OD2-OG 2.98Å; D865-L973 HydrophobicContact CB-CB 4.26Å; D865-L973 PolarHBondContact OD2-N 3.35Å
866	A	93.1	Very high	95.2	Very high	0 Å²	0	6.8 Å²	6.8	0%	0	3%	0.031	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-1.3	177.8	0	0	0	0	0	114	Q620 E624 V920	Q620-A866 PolarHBondContact NE2-O 2.93Å; E624-A866 HydrophobicContact CB-CB 4.13Å; E624-A866 HydrophobicContact CG-CB 4.19Å; A866-V920 HydrophobicContact CB-CG1 4.44Å; A866-V920 HydrophobicContact CB-CG2 4.41Å
867	Y	92.7	Very high	95.3	Very high	73 Å²	73	6 Å²	6	29%	0.286	3%	0.028	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.7	8.2	177.8	-54.6	-85.4	0	0	0	111.8	R530 C628 D865 N869 G970	R530-Y867 WeakPolarHBondContact CD-O 3.09Å; C628-Y867 HydrophobicContact CB-CE1 4.49Å; C628-Y867 WeakPolarHBondContact CB-OH 3.48Å; C628-Y867 PolarHBondContact SG-OH 2.99Å; C628-Y867 VanDerWaalsContact SG-OH 3.34Å; D865-Y867 PolarHBondContact O-N 3.34Å; D865-Y867 VanDerWaalsContact O-N 3.15Å; D865-Y867 VanDerWaalsContact OD1-C 3.24Å; D865-Y867 VanDerWaalsContact OD1-CA 3.29Å; D865-Y867 WeakPolarHBondContact OD1-CA 3.39Å; D865-Y867 WeakPolarHBondContact OD1-CB 3.35Å; D865-Y867 PolarHBondContact OD1-N 2.84Å; Y867-N869 VanDerWaalsContact C-N 3.25Å; Y867-N869 PolarHBondContact O-N 3.28Å; Y867-G970 PolarHBondContact OH-O 3.44Å
868	D	93.1	Very high	95.3	Very high	13 Å²	13	5.9 Å²	5.9	7%	0.07	3%	0.027	C	C	.	.			trans	67	20.7	178	-166.1	59.7	0	0	0	114.4	R530 Y618 R864 D865 R915	R530-D868 VanDerWaalsContact CZ-O 3.27Å; R530-D868 IonicContact CZ-OD2 3.99Å; R530-D868 VanDerWaalsContact NH1-CB 3.3Å; R530-D868 IonicContact NH1-OD2 3.6Å; R530-D868 PolarHBondContact NH1-OD2 2.97Å; R530-D868 PolarHBondContact NH2-O 3.29Å; R530-D868 IonicContact NH2-OD2 3.15Å; R530-D868 PolarHBondContact NH2-OD2 2.83Å; Y618-D868 HydrophobicContact CD1-CB 3.64Å; Y618-D868 HydrophobicContact CD2-CB 3.96Å; Y618-D868 HydrophobicContact CE1-CB 3.74Å; Y618-D868 HydrophobicContact CE2-CB 4.08Å; Y618-D868 HydrophobicContact CG-CB 3.76Å; R864-D868 IonicContact CZ-OD1 3.69Å; R864-D868 VanDerWaalsContact CZ-OD1 3.3Å; R864-D868 IonicContact NE-OD1 3.05Å; R864-D868 PolarHBondContact NE-OD1 2.97Å; R864-D868 IonicContact NH2-OD1 3.63Å; R864-D868 PolarHBondContact NH2-OD1 2.96Å; D865-D868 PolarHBondContact O-N 2.84Å; D865-D868 PolarHBondContact OD1-N 3.23Å; D868-R915 WeakPolarHBondContact OD1-CG 3.02Å; D868-R915 IonicContact OD1-NE 3.03Å; D868-R915 IonicContact OD2-NE 3Å
869	N	95.5	Very high	95.3	Very high	2 Å²	2	6.1 Å²	6.1	1%	0.011	3%	0.029	C	C	.	.			trans	-73.1	129	160.6	-53	-57.9	0	0	0	107.8	C531 R864 D865 Y867 S972 L973 P974	C531-N869 PolarHBondContact N-OD1 3.1Å; R864-N869 VanDerWaalsContact CA-O 3.31Å; R864-N869 WeakPolarHBondContact CA-O 3.06Å; D865-N869 PolarHBondContact N-O 2.98Å; D865-N869 PolarHBondContact OD1-N 2.84Å; D865-N869 PolarHBondContact OD1-ND2 3.47Å; D865-N869 WeakPolarHBondContact OD2-CB 3.39Å; D865-N869 PolarHBondContact OD2-ND2 3.34Å; Y867-N869 VanDerWaalsContact C-N 3.25Å; Y867-N869 PolarHBondContact O-N 3.28Å; N869-S972 PolarHBondContact ND2-OG 2.89Å; N869-L973 HydrophobicContact CB-CB 4.44Å; N869-P974 WeakPolarHBondContact ND2-CD 3.25Å
870	C	96.7	Very high	95.3	Very high	4 Å²	4	6.8 Å²	6.8	3%	0.027	3%	0.032	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	129.6	-171.2	-168.6	0	0	0	0	109.6	I863 R864 I911 R915	I863-C870 CarbonylContact O-C 3.59Å; I863-C870 VanDerWaalsContact O-CA 3.3Å; I863-C870 WeakPolarHBondContact O-CA 3.23Å; R864-C870 HydrophobicContact CB-CB 4.28Å; R864-C870 HydrophobicContact CG-CB 4.21Å; C870-I911 HydrophobicContact CB-CG2 4.22Å; C870-R915 HydrophobicContact CB-CG 4.35Å
871	I	95.9	Very high	95.1	Very high	1 Å²	1	7.5 Å²	7.5	1%	0.005	4%	0.037	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	156.4	-176	60.1	165.2	0	0	0	110.7	I533 V862 I863 V873 L973 F989 E990	I533-I871 HydrophobicContact CD1-CG2 3.83Å; I533-I871 HydrophobicContact CG1-CG2 3.75Å; V862-I871 WeakPolarHBondContact CA-O 3.29Å; V862-I871 WeakPolarHBondContact CG1-O 3.37Å; I863-I871 HydrophobicContact CB-CG1 4.1Å; I863-I871 PolarHBondContact N-O 3.05Å; I863-I871 PolarHBondContact O-N 3.34Å; I871-V873 HydrophobicContact CD1-CG1 3.7Å; I871-V873 HydrophobicContact CG1-CG1 4.18Å; I871-L973 HydrophobicContact CD1-CD2 3.71Å; I871-L973 HydrophobicContact CG1-CD2 3.72Å; I871-L973 HydrophobicContact CG2-CD2 4.29Å; I871-F989 WeakPolarHBondContact CD1-O 3.44Å; I871-E990 HydrophobicContact CB-CG 4.12Å
872	T	95	Very high	94.9	Very high	4 Å²	4	8.2 Å²	8.2	3%	0.025	4%	0.041	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	117.5	169.4	61.6	0	0	0	0	110.4	Y860 E861 V862 R907 I911 E990	Y860-T872 HydrophobicContact CD1-CG2 4.09Å; E861-T872 CarbonylContact O-C 3.59Å; E861-T872 WeakPolarHBondContact O-CA 3.3Å; V862-T872 HydrophobicContact CG2-CG2 4.17Å; T872-R907 HydrophobicContact CG2-CG 3.72Å; T872-I911 HydrophobicContact CG2-CD1 4.22Å; T872-I911 HydrophobicContact CG2-CG1 3.9Å; T872-E990 PolarHBondContact N-OE1 2.75Å; T872-E990 VanDerWaalsContact O-CB 3.3Å; T872-E990 WeakPolarHBondContact O-CB 3.45Å; T872-E990 WeakPolarHBondContact O-CG 3.31Å; T872-E990 PolarHBondContact OG1-OE1 3.32Å; T872-E990 PolarHBondContact OG1-OE2 2.91Å
873	V	92.9	Very high	94.2	Very high	3 Å²	3	8.9 Å²	8.9	2%	0.018	5%	0.048	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	-25.2	-171	-71.4	0	0	0	0	113.5	E861 I863 I871 T956 Y958 I960 P991	E861-V873 HydrophobicContact CB-CG2 3.64Å; E861-V873 WeakPolarHBondContact O-CG2 3.4Å; E861-V873 PolarHBondContact O-N 3.06Å; I863-V873 HydrophobicContact CD1-CG1 3.7Å; I863-V873 HydrophobicContact CD1-CG2 4.23Å; I863-V873 HydrophobicContact CG1-CG1 4.01Å; I863-V873 HydrophobicContact CG1-CG2 4.19Å; I871-V873 HydrophobicContact CD1-CG1 3.7Å; I871-V873 HydrophobicContact CG1-CG1 4.18Å; V873-T956 WeakPolarHBondContact O-CG2 3.21Å; V873-Y958 HydrophobicContact CG1-CD1 4.04Å; V873-Y958 HydrophobicContact CG1-CD2 4.38Å; V873-Y958 HydrophobicContact CG1-CE1 3.94Å; V873-Y958 HydrophobicContact CG1-CE2 4.25Å; V873-Y958 HydrophobicContact CG1-CG 4.28Å; V873-I960 HydrophobicContact CG2-CD1 3.71Å; V873-I960 HydrophobicContact CG2-CG1 4.09Å; V873-P991 WeakPolarHBondContact O-CD 3.25Å; V873-P991 VanDerWaalsContact O-CG 3.28Å; V873-P991 WeakPolarHBondContact O-CG 3.39Å
874	C	94.1	Very high	93.9	Very high	7 Å²	7	9.3 Å²	9.3	5%	0.047	5%	0.051	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	141.5	179.3	-171.9	0	0	0	0	109.5	E861 S893 A952 T956	E861-C874 HydrophobicContact CB-CB 4.19Å; E861-C874 HydrophobicContact CG-CB 4.27Å; E861-C874 PolarHBondContact N-O 3.24Å; C874-S893 PolarHBondContact SG-OG 2.91Å; C874-S893 VanDerWaalsContact SG-OG 3.36Å; C874-A952 HydrophobicContact CB-CB 3.61Å; C874-T956 HydrophobicContact CB-CG2 3.92Å
875	N	94.7	Very high	93.4	Very high	2 Å²	2	11 Å²	11	1%	0.011	6%	0.058	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	141.5	169.2	91.8	-68.3	0	0	0	109.6	E859 Y860 S893 P894 S895 Y903	E859-N875 WeakPolarHBondContact O-CA 3.27Å; Y860-N875 HydrophobicContact CD1-CB 4Å; Y860-N875 HydrophobicContact CE1-CB 3.64Å; Y860-N875 HydrophobicContact CE2-CB 4.46Å; N875-S893 PolarHBondContact O-OG 3.17Å; N875-P894 VanDerWaalsContact OD1-CB 3.29Å; N875-P894 WeakPolarHBondContact OD1-CB 3.5Å; N875-S895 WeakPolarHBondContact ND2-CB 3.18Å; N875-S895 PolarHBondContact ND2-N 3.24Å; N875-S895 PolarHBondContact ND2-OG 3.22Å; N875-Y903 HydrophobicContact CB-CE2 4.04Å; N875-Y903 VanDerWaalsContact ND2-CE2 3.28Å; N875-Y903 WeakPolarHBondContact ND2-CE2 3.31Å; N875-Y903 WeakPolarHBondContact OD1-CE2 3.32Å
876	M	95.1	Very high	92.8	Very high	3 Å²	3	11.5 Å²	11.5	2%	0.015	6%	0.062	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	143.7	-174.4	-75.2	168.9	-70.5	0	0	110.2	V858 E859 E861 V891 V892 L951	V858-M876 CarbonylContact C-O 3.48Å; V858-M876 WeakPolarHBondContact CA-O 3.46Å; V858-M876 WeakPolarHBondContact CG1-O 3.2Å; E859-M876 HydrophobicContact CB-CB 4.28Å; E859-M876 HydrophobicContact CB-CE 4.18Å; E859-M876 PolarHBondContact N-O 2.84Å; E859-M876 PolarHBondContact O-N 3.01Å; E861-M876 HydrophobicContact CG-CE 3.85Å; M876-V891 HydrophobicContact CB-CG1 3.67Å; M876-V891 HydrophobicContact CG-CG1 4Å; M876-V891 HydrophobicContact SD-CG1 4.26Å; M876-V892 WeakPolarHBondContact CA-O 3.48Å; M876-L951 HydrophobicContact SD-CD2 4.03Å
877	E	96.6	Very high	92.4	Very high	3 Å²	3	11.9 Å²	11.9	1%	0.014	7%	0.065	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	131.2	173.8	-178.4	-178.6	175.4	0	0	109.2	V892 Q896 T897 F1096	E877-V892 PolarHBondContact N-O 3.28Å; E877-V892 PolarHBondContact O-N 3.47Å; E877-Q896 PolarHBondContact OE2-N 3.23Å; E877-T897 PolarHBondContact OE1-OG1 3.18Å; E877-T897 PolarHBondContact OE2-N 3.33Å; E877-T897 PolarHBondContact OE2-OG1 3.47Å; E877-F1096 HydrophobicContact CG-CE2 4.48Å; E877-F1096 HydrophobicContact CG-CZ 4.42Å
878	N	96.5	Very high	92.2	Very high	7 Å²	7	8.5 Å²	8.5	4%	0.037	5%	0.052	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	133.1	173.8	-64.9	-2.9	0	0	0	109.4	E857 D880 V891	E857-N878 HydrophobicContact CB-CB 4.09Å; E857-N878 VanDerWaalsContact CD-ND2 3.31Å; E857-N878 PolarHBondContact O-N 3.1Å; E857-N878 PolarHBondContact OE2-ND2 2.83Å; N878-D880 VanDerWaalsContact C-N 3.27Å; N878-D880 WeakPolarHBondContact CB-O 3.31Å; N878-V891 VanDerWaalsContact OD1-CG2 3.29Å; N878-V891 WeakPolarHBondContact OD1-CG2 3.28Å
879	V	97	Very high	92.2	Very high	4 Å²	4	7.9 Å²	7.9	2%	0.024	5%	0.049	C	C	.	.	S	Bend	trans	-66	-39.6	169.8	178.6	0	0	0	0	109.6	I890 V892 F1032 I1092 F1096 M1100	V879-I890 HydrophobicContact CB-CB 4.12Å; V879-I890 HydrophobicContact CB-CG2 4.26Å; V879-I890 HydrophobicContact CG2-CB 4.14Å; V879-I890 HydrophobicContact CG2-CG2 3.72Å; V879-I890 PolarHBondContact N-O 2.93Å; V879-V892 HydrophobicContact CG2-CG2 3.65Å; V879-F1032 HydrophobicContact CG2-CE2 4.36Å; V879-I1092 HydrophobicContact CG1-CG2 3.83Å; V879-F1096 HydrophobicContact CG1-CB 4.18Å; V879-F1096 HydrophobicContact CG1-CD2 4.22Å; V879-F1096 HydrophobicContact CG1-CG 4.1Å; V879-F1096 HydrophobicContact CG2-CD1 4.09Å; V879-F1096 HydrophobicContact CG2-CD2 4.47Å; V879-F1096 HydrophobicContact CG2-CE1 4.04Å; V879-F1096 HydrophobicContact CG2-CE2 4.43Å; V879-F1096 HydrophobicContact CG2-CG 4.32Å; V879-F1096 HydrophobicContact CG2-CZ 4.22Å; V879-M1100 HydrophobicContact CG1-CE 3.92Å
880	D	94.9	Very high	92.3	Very high	16 Å²	16	8.3 Å²	8.3	9%	0.086	5%	0.051	C	C	.	.	S	Bend	trans	-75.9	138.2	173	-69.3	-68.2	0	0	0	110.7	N878 I884 I890 R1069	N878-D880 VanDerWaalsContact C-N 3.27Å; N878-D880 WeakPolarHBondContact CB-O 3.31Å; D880-I884 HydrophobicContact CB-CB 4.42Å; D880-I884 HydrophobicContact CB-CD1 3.62Å; D880-I890 PolarHBondContact OD2-N 2.84Å; D880-I890 VanDerWaalsContact OD2-N 3.15Å; D880-R1069 IonicContact OD1-NH1 3.95Å; D880-R1069 PolarHBondContact OD1-NH1 2.83Å
881	P	92.3	Very high	92.3	Very high	15 Å²	15	8.4 Å²	8.4	10%	0.097	5%	0.051	C	C	.	.	P	Polyproline II helix	trans	-71.9	166.4	177.3	34.5	-40.2	0	0	0	111.6	W855 G883 T1090	W855-P881 WeakPolarHBondContact O-CA 3.48Å; P881-G883 PolarHBondContact O-N 3.21Å; P881-T1090 WeakPolarHBondContact CG-O 3.25Å
882	V	90.7	Very high	92.3	Very high	14 Å²	14	8.3 Å²	8.3	9%	0.085	5%	0.051	C	C	.	.	T	Hydrogen-bonded Turn	trans	-49.6	130.1	170.1	175.2	0	0	0	0	109.5	L852 K853 G854 W855 E857 A928 I939	L852-V882 HydrophobicContact CB-CG1 4.18Å; L852-V882 WeakPolarHBondContact O-CB 3.21Å; K853-V882 VanDerWaalsContact CA-O 3.25Å; K853-V882 WeakPolarHBondContact CA-O 3.47Å; G854-V882 PolarHBondContact N-O 3.42Å; W855-V882 HydrophobicContact CB-CB 4.48Å; W855-V882 HydrophobicContact CB-CG2 4.19Å; W855-V882 WeakPolarHBondContact O-CG2 3.48Å; W855-V882 PolarHBondContact O-N 2.77Å; E857-V882 HydrophobicContact CB-CG2 3.72Å; E857-V882 HydrophobicContact CG-CG2 4.16Å; V882-A928 HydrophobicContact CG2-CB 3.91Å; V882-I939 HydrophobicContact CG2-CD1 4.2Å
883	G	83.8	Confident	92.3	Very high	15 Å²	15	8.4 Å²	8.4	16%	0.155	5%	0.052	C	C	.	.	T	Hydrogen-bonded Turn	trans	135.8	-27.9	-174	0	0	0	0	0	112.8	F825 P881 G1016 S1017	F825-G883 VanDerWaalsContact CE2-O 3.31Å; F825-G883 WeakPolarHBondContact CE2-O 3.41Å; P881-G883 PolarHBondContact O-N 3.21Å; G883-G1016 CarbonylContact O-C 3.59Å; G883-G1016 WeakPolarHBondContact O-CA 3.49Å; G883-S1017 PolarHBondContact O-N 2.94Å
884	I	88.7	Confident	92.4	Very high	10 Å²	10	8.3 Å²	8.3	5%	0.051	5%	0.051	C	C	.	.	S	Bend	trans	-103.7	136.5	172.2	-65.4	154.4	0	0	0	107.4	D880 T886 E888 S889 I1015 P1065	D880-I884 HydrophobicContact CB-CB 4.42Å; D880-I884 HydrophobicContact CB-CD1 3.62Å; I884-T886 PolarHBondContact O-N 2.65Å; I884-E888 HydrophobicContact CG2-CB 3.71Å; I884-S889 WeakPolarHBondContact CG2-OG 3.48Å; I884-I1015 HydrophobicContact CG2-CG2 3.72Å; I884-P1065 HydrophobicContact CD1-CB 3.68Å; I884-P1065 HydrophobicContact CD1-CG 3.72Å; I884-P1065 HydrophobicContact CG1-CB 4.08Å; I884-P1065 HydrophobicContact CG1-CG 3.71Å
885	H	87.1	Confident	92.4	Very high	35 Å²	35	8.2 Å²	8.2	16%	0.162	5%	0.05	C	C	.	.			trans	-62.1	137.4	176.8	-172.3	-59.3	0	0	0	109.2	G887 E888 S889 G1016 S1017 M1019	H885-G887 VanDerWaalsContact C-N 3.29Å; H885-G887 PolarHBondContact ND1-N 3.31Å; H885-G887 VanDerWaalsContact ND1-N 3.13Å; H885-G887 PolarHBondContact O-N 3.27Å; H885-G887 VanDerWaalsContact O-N 3.15Å; H885-E888 HydrophobicContact CB-CG 4.06Å; H885-E888 CarbonylContact O-C 3.57Å; H885-E888 VanDerWaalsContact O-CA 3.31Å; H885-E888 WeakPolarHBondContact O-CA 3.45Å; H885-E888 VanDerWaalsContact O-CB 3.32Å; H885-E888 WeakPolarHBondContact O-CB 3.33Å; H885-E888 PolarHBondContact O-N 3.2Å; H885-S889 PolarHBondContact O-N 3.32Å; H885-S889 VanDerWaalsContact O-N 3.12Å; H885-S889 PolarHBondContact O-OG 3.04Å; H885-G1016 WeakPolarHBondContact CB-O 3.34Å; H885-G1016 PolarHBondContact N-O 3.12Å; H885-S1017 PolarHBondContact CD2-O 2.88Å; H885-M1019 HydrophobicContact CB-CG 4.24Å; H885-M1019 VanDerWaalsContact CE1-CG 3.45Å; H885-M1019 WeakPolarHBondContact CE1-CG 3.48Å; H885-M1019 PolarHBondContact CE1-SD 3.44Å; H885-M1019 VanDerWaalsContact CG-CG 3.5Å; H885-M1019 WeakPolarHBondContact ND1-CG 3.35Å
886	T	83.4	Confident	92.4	Very high	11 Å²	11	8.1 Å²	8.1	7%	0.067	5%	0.05	C	C	.	.	G	3₁₀ helix	trans	-48.3	-44.5	-179.4	56	0	0	0	0	114.6	E857 E859 I884 E888 S889 K999	E857-T886 HydrophobicContact CG-CG2 4.35Å; E857-T886 WeakPolarHBondContact OE1-CG2 3.22Å; E859-T886 WeakPolarHBondContact OE1-CB 3.29Å; E859-T886 WeakPolarHBondContact OE1-CG2 3.25Å; I884-T886 PolarHBondContact O-N 2.65Å; T886-E888 PolarHBondContact O-N 2.89Å; T886-S889 PolarHBondContact O-N 2.85Å; T886-S889 VanDerWaalsContact O-N 3.12Å; T886-K999 PolarHBondContact O-NZ 3.27Å
887	G	83.8	Confident	92.5	Very high	7 Å²	7	8 Å²	8	7%	0.072	5%	0.049	C	C	.	.	G	3₁₀ helix	trans	-59.8	-20.8	171.2	0	0	0	0	0	116.3	H885 P1001 S1021	H885-G887 VanDerWaalsContact C-N 3.29Å; H885-G887 PolarHBondContact ND1-N 3.31Å; H885-G887 VanDerWaalsContact ND1-N 3.13Å; H885-G887 PolarHBondContact O-N 3.27Å; H885-G887 VanDerWaalsContact O-N 3.15Å; G887-P1001 WeakPolarHBondContact O-CB 3.45Å; G887-S1021 PolarHBondContact O-OG 2.61Å
888	E	89.2	Confident	92.4	Very high	3 Å²	3	7.8 Å²	7.8	1%	0.014	5%	0.048	C	C	.	.	G	3₁₀ helix	trans	-99	-9.8	174.1	-54.8	-70.5	113.6	0	0	113.4	I884 H885 T886 P1001 W1003 I1015 M1019 K1020 S1021	I884-E888 HydrophobicContact CG2-CB 3.71Å; H885-E888 HydrophobicContact CB-CG 4.06Å; H885-E888 CarbonylContact O-C 3.57Å; H885-E888 VanDerWaalsContact O-CA 3.31Å; H885-E888 WeakPolarHBondContact O-CA 3.45Å; H885-E888 VanDerWaalsContact O-CB 3.32Å; H885-E888 WeakPolarHBondContact O-CB 3.33Å; H885-E888 PolarHBondContact O-N 3.2Å; T886-E888 PolarHBondContact O-N 2.89Å; E888-P1001 VanDerWaalsContact O-CG 3.29Å; E888-P1001 WeakPolarHBondContact O-CG 3.36Å; E888-W1003 WeakPolarHBondContact O-CZ2 3.36Å; E888-W1003 PolarHBondContact OE2-NE1 3.01Å; E888-I1015 HydrophobicContact CB-CG2 3.55Å; E888-I1015 HydrophobicContact CG-CG2 3.96Å; E888-M1019 HydrophobicContact CG-CG 4.4Å; E888-M1019 WeakPolarHBondContact OE1-CA 3.32Å; E888-K1020 PolarHBondContact OE1-N 3.44Å; E888-K1020 PolarHBondContact OE2-N 2.81Å; E888-S1021 WeakPolarHBondContact OE1-CB 3.41Å; E888-S1021 PolarHBondContact OE1-N 2.71Å; E888-S1021 PolarHBondContact OE1-OG 3.29Å; E888-S1021 PolarHBondContact OE2-N 3.45Å
889	S	93.1	Very high	92.3	Very high	0 Å²	0	8 Å²	8	0%	0	5%	0.051	C	C	.	.	S	Bend	trans	-84.7	151.1	-179.9	-60.8	0	0	0	0	111.7	I884 H885 T886 K999	I884-S889 WeakPolarHBondContact CG2-OG 3.48Å; H885-S889 PolarHBondContact O-N 3.32Å; H885-S889 VanDerWaalsContact O-N 3.12Å; H885-S889 PolarHBondContact O-OG 3.04Å; T886-S889 PolarHBondContact O-N 2.85Å; T886-S889 VanDerWaalsContact O-N 3.12Å; S889-K999 PolarHBondContact O-NZ 3.18Å
890	I	96.4	Very high	92.2	Very high	11 Å²	11	8 Å²	8	6%	0.056	5%	0.05	C	C	.	.			trans	-72.2	128.4	160.3	-59.7	177.6	0	0	0	107.6	V879 D880 V998 K999 V1000 I1070	V879-I890 HydrophobicContact CB-CB 4.12Å; V879-I890 HydrophobicContact CB-CG2 4.26Å; V879-I890 HydrophobicContact CG2-CB 4.14Å; V879-I890 HydrophobicContact CG2-CG2 3.72Å; V879-I890 PolarHBondContact N-O 2.93Å; D880-I890 PolarHBondContact OD2-N 2.84Å; D880-I890 VanDerWaalsContact OD2-N 3.15Å; I890-V998 HydrophobicContact CG2-CG1 3.88Å; I890-K999 WeakPolarHBondContact CA-O 3.2Å; I890-V1000 HydrophobicContact CD1-CG2 4.49Å; I890-V1000 HydrophobicContact CG1-CG2 4.27Å; I890-V1000 HydrophobicContact CG2-CG2 4.28Å; I890-I1070 HydrophobicContact CD1-CB 4.49Å; I890-I1070 HydrophobicContact CD1-CD1 3.81Å; I890-I1070 HydrophobicContact CD1-CG1 4.05Å
891	V	96.4	Very high	92.1	Very high	5 Å²	5	8.9 Å²	8.9	3%	0.03	6%	0.056	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	139.9	-173.5	-173.4	0	0	0	0	109.9	M876 N878 V998 K999	M876-V891 HydrophobicContact CB-CG1 3.67Å; M876-V891 HydrophobicContact CG-CG1 4Å; M876-V891 HydrophobicContact SD-CG1 4.26Å; N878-V891 VanDerWaalsContact OD1-CG2 3.29Å; N878-V891 WeakPolarHBondContact OD1-CG2 3.28Å; V891-V998 WeakPolarHBondContact O-CA 3.22Å; V891-K999 HydrophobicContact CB-CB 4.3Å; V891-K999 HydrophobicContact CG2-CD 4.47Å; V891-K999 PolarHBondContact N-O 3.25Å; V891-K999 VanDerWaalsContact N-O 3.09Å; V891-K999 PolarHBondContact O-N 2.95Å
892	V	97	Very high	92.2	Very high	0 Å²	0	8.2 Å²	8.2	0%	0	5%	0.052	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	138	179.7	-168.6	0	0	0	0	110.3	M876 E877 V879 Q896 C996 V997 V998 F1032 F1096	M876-V892 WeakPolarHBondContact CA-O 3.48Å; E877-V892 PolarHBondContact N-O 3.28Å; E877-V892 PolarHBondContact O-N 3.47Å; V879-V892 HydrophobicContact CG2-CG2 3.65Å; V892-Q896 HydrophobicContact CB-CG 4.41Å; V892-Q896 HydrophobicContact CG1-CG 3.7Å; V892-C996 VanDerWaalsContact CG1-SG 3.56Å; V892-V997 VanDerWaalsContact CA-O 3.31Å; V892-V997 WeakPolarHBondContact CA-O 3.18Å; V892-V998 HydrophobicContact CG1-CG2 4.37Å; V892-V998 HydrophobicContact CG2-CG2 4.25Å; V892-F1032 HydrophobicContact CG1-CD2 4.34Å; V892-F1032 HydrophobicContact CG2-CD2 4.05Å; V892-F1032 HydrophobicContact CG2-CE2 3.7Å; V892-F1096 HydrophobicContact CG2-CE1 3.86Å; V892-F1096 HydrophobicContact CG2-CZ 4.29Å
893	S	95.1	Very high	92.5	Very high	6 Å²	6	8 Å²	8	4%	0.042	5%	0.05	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	134.4	171.2	-168.1	0	0	0	0	111	C874 N875 V997	C874-S893 PolarHBondContact SG-OG 2.91Å; C874-S893 VanDerWaalsContact SG-OG 3.36Å; N875-S893 PolarHBondContact O-OG 3.17Å; S893-V997 PolarHBondContact N-O 3.35Å; S893-V997 PolarHBondContact O-N 3.24Å
894	P	94.3	Very high	93	Very high	1 Å²	1	8.1 Å²	8.1	1%	0.006	5%	0.045	C	C	.	.	S	Bend	cis	-67.4	178.1	-8.3	33.1	-35	0	0	0	111.3	M275 Y296 N875 Q896	M275-P894 HydrophobicContact CB-CB 4.48Å; M275-P894 HydrophobicContact CB-CG 4.27Å; M275-P894 HydrophobicContact CE-CB 4.08Å; M275-P894 HydrophobicContact CG-CG 4.36Å; M275-P894 HydrophobicContact SD-CB 3.59Å; M275-P894 VanDerWaalsContact SD-CB 3.59Å; M275-P894 HydrophobicContact SD-CG 3.68Å; Y296-P894 HydrophobicContact CD2-CG 4.11Å; Y296-P894 HydrophobicContact CE2-CG 3.41Å; Y296-P894 VanDerWaalsContact CE2-CG 3.41Å; N875-P894 VanDerWaalsContact OD1-CB 3.29Å; N875-P894 WeakPolarHBondContact OD1-CB 3.5Å; P894-Q896 PolarHBondContact O-NE2 2.84Å
895	S	95.1	Very high	93.3	Very high	4 Å²	4	9.7 Å²	9.7	3%	0.028	5%	0.053	C	C	.	.			trans	-57.2	138.9	169.5	59.2	0	0	0	0	111.7	N875	N875-S895 WeakPolarHBondContact ND2-CB 3.18Å; N875-S895 PolarHBondContact ND2-N 3.24Å; N875-S895 PolarHBondContact ND2-OG 3.22Å
896	Q	95	Very high	93.7	Very high	0 Å²	0	8 Å²	8	0%	0	5%	0.045	C	C	.	.	S	Bend	trans	-100.1	-18.9	-176.4	-57.9	-56.7	-64.5	0	0	113.8	Y296 N301 E877 V892 P894 W1095 F1096	Y296-Q896 PolarHBondContact OH-NE2 3.21Å; Y296-Q896 PolarHBondContact OH-OE1 3.08Å; N301-Q896 WeakPolarHBondContact CB-O 3.43Å; N301-Q896 VanDerWaalsContact CG-O 3.31Å; N301-Q896 PolarHBondContact ND2-O 3.08Å; E877-Q896 PolarHBondContact OE2-N 3.23Å; V892-Q896 HydrophobicContact CB-CG 4.41Å; V892-Q896 HydrophobicContact CG1-CG 3.7Å; P894-Q896 PolarHBondContact O-NE2 2.84Å; Q896-W1095 HydrophobicContact CB-CE3 3.84Å; Q896-W1095 HydrophobicContact CB-CH2 3.77Å; Q896-W1095 HydrophobicContact CB-CZ2 4.44Å; Q896-W1095 HydrophobicContact CB-CZ3 3.44Å; Q896-W1095 VanDerWaalsContact CB-CZ3 3.44Å; Q896-W1095 HydrophobicContact CG-CE3 4.47Å; Q896-W1095 HydrophobicContact CG-CH2 3.81Å; Q896-W1095 HydrophobicContact CG-CZ3 3.62Å; Q896-F1096 HydrophobicContact CB-CE1 4.06Å; Q896-F1096 HydrophobicContact CB-CZ 4.06Å; Q896-F1096 HydrophobicContact CG-CE1 3.95Å; Q896-F1096 HydrophobicContact CG-CZ 4.26Å
897	T	95.6	Very high	94.3	Very high	0 Å²	0	7.5 Å²	7.5	0%	0	4%	0.042	C	C	.	.	S	Bend	trans	-120.1	2.6	-172.3	75.4	0	0	0	0	114.4	K856 E877 D1093 W1095 F1096	K856-T897 PolarHBondContact NZ-OG1 3.37Å; E877-T897 PolarHBondContact OE1-OG1 3.18Å; E877-T897 PolarHBondContact OE2-N 3.33Å; E877-T897 PolarHBondContact OE2-OG1 3.47Å; T897-D1093 HydrophobicContact CG2-CB 4.37Å; T897-W1095 HydrophobicContact CG2-CB 3.93Å; T897-W1095 HydrophobicContact CG2-CD2 4.44Å; T897-W1095 HydrophobicContact CG2-CE3 4.33Å; T897-W1095 HydrophobicContact CG2-CG 4.31Å; T897-F1096 HydrophobicContact CG2-CE2 4.14Å; T897-F1096 HydrophobicContact CG2-CZ 4.44Å
898	L	95.6	Very high	94.8	Very high	0 Å²	0	9 Å²	9	0%	0	5%	0.051	C	C	.	.			trans	-82.4	132.4	178.3	-57.9	-173.6	0	0	0	111.5	Y302 V858 E902 L929	Y302-L898 VanDerWaalsContact CD1-O 3.31Å; Y302-L898 WeakPolarHBondContact CD1-O 3.39Å; V858-L898 HydrophobicContact CG1-CD1 3.83Å; V858-L898 HydrophobicContact CG2-CD1 4.05Å; V858-L898 HydrophobicContact CG2-CD2 4.23Å; L898-E902 WeakPolarHBondContact CA-OE2 3.22Å; L898-E902 HydrophobicContact CB-CB 4.35Å; L898-E902 HydrophobicContact CD2-CB 4.37Å; L898-L929 HydrophobicContact CD2-CD2 3.53Å
899	S	94.4	Very high	95.1	Very high	12 Å²	12	9.2 Å²	9.2	8%	0.084	5%	0.053	C	C	.	.			trans	-71.6	163.8	166.6	64.3	0	0	0	0	111.2	H340 V901 E902 Y903	H340-S899 WeakPolarHBondContact NE2-CB 3.24Å; H340-S899 PolarHBondContact NE2-OG 3.11Å; S899-V901 PolarHBondContact O-N 3.1Å; S899-E902 PolarHBondContact N-OE2 3.22Å; S899-E902 PolarHBondContact O-N 3.4Å; S899-E902 WeakPolarHBondContact OG-CG 3.3Å; S899-E902 PolarHBondContact OG-N 3.3Å; S899-E902 PolarHBondContact OG-OE2 3.11Å; S899-E902 VanDerWaalsContact OG-OE2 3.1Å; S899-Y903 WeakPolarHBondContact O-CB 3.48Å; S899-Y903 PolarHBondContact O-N 3.11Å
900	N	93.7	Very high	95.3	Very high	2 Å²	2	9.2 Å²	9.2	1%	0.011	5%	0.053	C	C	.	.	H	α-helix	trans	-56.5	-38	175.5	161.9	73.7	0	0	0	112.6	V276 E280 A584 G585 Y904	V276-N900 HydrophobicContact CB-CB 4.48Å; V276-N900 HydrophobicContact CG2-CB 4.2Å; E280-N900 VanDerWaalsContact OE1-CB 3.28Å; E280-N900 WeakPolarHBondContact OE1-CB 2.91Å; E280-N900 PolarHBondContact OE1-ND2 3.45Å; A584-N900 WeakPolarHBondContact CA-OD1 3.4Å; A584-N900 HydrophobicContact CB-CB 4.09Å; A584-N900 WeakPolarHBondContact CB-OD1 3.35Å; G585-N900 PolarHBondContact N-OD1 3.01Å; N900-Y904 WeakPolarHBondContact O-CD2 3.43Å; N900-Y904 PolarHBondContact O-N 3.38Å; N900-Y904 WeakPolarHBondContact OD1-CD2 3.48Å; N900-Y904 VanDerWaalsContact OD1-CE2 3.25Å; N900-Y904 WeakPolarHBondContact OD1-CE2 3.39Å
901	V	93.4	Very high	95.2	Very high	35 Å²	35	8.9 Å²	8.9	21%	0.212	5%	0.051	C	C	.	.	H	α-helix	trans	-64.8	-46	177.7	175.4	0	0	0	0	111.3	W318 S899 M905 L934	W318-V901 HydrophobicContact CE3-CG2 3.91Å; W318-V901 HydrophobicContact CZ3-CB 4.21Å; W318-V901 HydrophobicContact CZ3-CG1 4.16Å; W318-V901 HydrophobicContact CZ3-CG2 3.85Å; S899-V901 PolarHBondContact O-N 3.1Å; V901-M905 WeakPolarHBondContact O-CB 3.25Å; V901-M905 PolarHBondContact O-N 2.88Å; V901-L934 HydrophobicContact CG1-CD1 4.16Å; V901-L934 HydrophobicContact CG1-CD2 4.42Å
902	E	95.4	Very high	95.2	Very high	2 Å²	2	12.8 Å²	12.8	1%	0.009	7%	0.068	C	C	.	.	H	α-helix	trans	-64.9	-45.9	177.8	-68.3	167.5	141	0	0	111.6	H340 L898 S899 Y904 M905 L906 L929 L934	H340-E902 IonicContact CD2-OE1 3.33Å; H340-E902 IonicContact CD2-OE2 3.3Å; H340-E902 PolarHBondContact CD2-OE2 3.25Å; H340-E902 VanDerWaalsContact NE2-CD 3.29Å; H340-E902 IonicContact NE2-OE1 2.64Å; H340-E902 PolarHBondContact NE2-OE1 2.96Å; H340-E902 IonicContact NE2-OE2 3.15Å; H340-E902 PolarHBondContact NE2-OE2 2.94Å; L898-E902 WeakPolarHBondContact CA-OE2 3.22Å; L898-E902 HydrophobicContact CB-CB 4.35Å; L898-E902 HydrophobicContact CD2-CB 4.37Å; S899-E902 PolarHBondContact N-OE2 3.22Å; S899-E902 PolarHBondContact O-N 3.4Å; S899-E902 WeakPolarHBondContact OG-CG 3.3Å; S899-E902 PolarHBondContact OG-N 3.3Å; S899-E902 PolarHBondContact OG-OE2 3.11Å; S899-E902 VanDerWaalsContact OG-OE2 3.1Å; E902-Y904 PolarHBondContact O-N 3.08Å; E902-M905 PolarHBondContact O-N 2.95Å; E902-L906 WeakPolarHBondContact O-CG 3.44Å; E902-L906 PolarHBondContact O-N 3.05Å; E902-L929 HydrophobicContact CB-CD2 4.22Å; E902-L929 HydrophobicContact CG-CD2 4.16Å; E902-L934 HydrophobicContact CG-CD2 3.7Å
903	Y	95.4	Very high	95.1	Very high	10 Å²	10	12.8 Å²	12.8	4%	0.039	7%	0.068	C	C	.	.	H	α-helix	trans	-55.9	-54.1	179.3	-174.4	-76.7	0	0	0	111.5	M275 V276 Y860 N875 S899 R907	M275-Y903 WeakPolarHBondContact CE-OH 3.45Å; V276-Y903 HydrophobicContact CG1-CD2 4.08Å; V276-Y903 HydrophobicContact CG1-CG 4.49Å; V276-Y903 HydrophobicContact CG2-CD1 4.25Å; V276-Y903 HydrophobicContact CG2-CD2 4.23Å; V276-Y903 HydrophobicContact CG2-CG 3.93Å; Y860-Y903 HydrophobicContact CE1-CE1 4.49Å; Y860-Y903 WeakPolarHBondContact OH-CA 3.44Å; Y860-Y903 PolarHBondContact OH-O 2.79Å; N875-Y903 HydrophobicContact CB-CE2 4.04Å; N875-Y903 VanDerWaalsContact ND2-CE2 3.28Å; N875-Y903 WeakPolarHBondContact ND2-CE2 3.31Å; N875-Y903 WeakPolarHBondContact OD1-CE2 3.32Å; S899-Y903 WeakPolarHBondContact O-CB 3.48Å; S899-Y903 PolarHBondContact O-N 3.11Å; Y903-R907 VanDerWaalsContact O-CB 3.29Å; Y903-R907 WeakPolarHBondContact O-CB 3.45Å; Y903-R907 PolarHBondContact O-N 3.46Å
904	Y	94.2	Very high	95.1	Very high	17 Å²	17	12.5 Å²	12.5	7%	0.067	7%	0.066	C	C	.	.	H	α-helix	trans	-78.1	-23.8	-177.2	-76.4	-79.7	0	0	0	113.3	V276 H519 G585 P586 N900 E902 S908	V276-Y904 HydrophobicContact CG2-CE2 4.13Å; H519-Y904 VanDerWaalsContact CB-OH 3.25Å; H519-Y904 WeakPolarHBondContact CB-OH 3.05Å; G585-Y904 VanDerWaalsContact C-CD1 3.43Å; G585-Y904 VanDerWaalsContact C-CZ 3.47Å; G585-Y904 VanDerWaalsContact O-CD1 3.27Å; G585-Y904 WeakPolarHBondContact O-CD1 3.27Å; G585-Y904 VanDerWaalsContact O-CG 3.25Å; P586-Y904 HydrophobicContact CB-CD1 4.22Å; P586-Y904 HydrophobicContact CB-CE1 3.99Å; P586-Y904 HydrophobicContact CG-CE1 4.45Å; N900-Y904 WeakPolarHBondContact O-CD2 3.43Å; N900-Y904 PolarHBondContact O-N 3.38Å; N900-Y904 WeakPolarHBondContact OD1-CD2 3.48Å; N900-Y904 VanDerWaalsContact OD1-CE2 3.25Å; N900-Y904 WeakPolarHBondContact OD1-CE2 3.39Å; E902-Y904 PolarHBondContact O-N 3.08Å; Y904-S908 VanDerWaalsContact O-CB 3.27Å; Y904-S908 WeakPolarHBondContact O-CB 3.43Å; Y904-S908 PolarHBondContact O-N 2.76Å; Y904-S908 PolarHBondContact O-OG 3.36Å
905	M	95.2	Very high	95.1	Very high	43 Å²	43	15.3 Å²	15.3	21%	0.212	8%	0.076	C	C	.	.	H	α-helix	trans	-60.6	-55.3	168.4	176.4	-172.2	71	0	0	110.3	V901 E902 S908 V909 L929 L934 Y936	V901-M905 WeakPolarHBondContact O-CB 3.25Å; V901-M905 PolarHBondContact O-N 2.88Å; E902-M905 PolarHBondContact O-N 2.95Å; M905-S908 PolarHBondContact O-N 3.09Å; M905-V909 VanDerWaalsContact O-CG2 3.28Å; M905-V909 WeakPolarHBondContact O-CG2 3.31Å; M905-V909 PolarHBondContact O-N 3.46Å; M905-V909 VanDerWaalsContact O-N 3.11Å; M905-L929 HydrophobicContact CE-CD1 3.99Å; M905-L934 HydrophobicContact SD-CB 4.38Å; M905-Y936 HydrophobicContact CE-CD1 3.56Å; M905-Y936 HydrophobicContact CE-CE1 4.07Å; M905-Y936 HydrophobicContact CE-CG 4.39Å; M905-Y936 HydrophobicContact CG-CE1 4.18Å; M905-Y936 HydrophobicContact SD-CD1 3.87Å; M905-Y936 HydrophobicContact SD-CE1 3.82Å
906	L	96.8	Very high	95	Very high	0 Å²	0	19 Å²	19	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-65.3	-41.1	-179.1	-64.3	-179.4	0	0	0	111.6	V858 Y860 E902 S908 V909 A910 F927 L929 Y936	V858-L906 HydrophobicContact CB-CD1 4.05Å; V858-L906 HydrophobicContact CG1-CD1 3.94Å; V858-L906 HydrophobicContact CG2-CD1 4.25Å; Y860-L906 HydrophobicContact CD2-CB 4.31Å; Y860-L906 HydrophobicContact CE2-CB 3.58Å; Y860-L906 HydrophobicContact CE2-CD1 4.34Å; E902-L906 WeakPolarHBondContact O-CG 3.44Å; E902-L906 PolarHBondContact O-N 3.05Å; L906-S908 VanDerWaalsContact C-N 3.34Å; L906-S908 PolarHBondContact O-N 2.96Å; L906-V909 PolarHBondContact O-N 3.27Å; L906-A910 WeakPolarHBondContact O-CB 2.99Å; L906-A910 PolarHBondContact O-N 3.14Å; L906-F927 HydrophobicContact CB-CD2 4.35Å; L906-F927 HydrophobicContact CB-CE2 4.32Å; L906-F927 HydrophobicContact CD1-CB 4.39Å; L906-F927 HydrophobicContact CD2-CB 4.12Å; L906-F927 HydrophobicContact CD2-CD1 3.8Å; L906-F927 HydrophobicContact CD2-CD2 4.34Å; L906-F927 HydrophobicContact CD2-CE1 4.23Å; L906-F927 HydrophobicContact CD2-CG 3.84Å; L906-L929 HydrophobicContact CD1-CD2 4.4Å; L906-Y936 HydrophobicContact CD2-CD1 4.22Å; L906-Y936 HydrophobicContact CD2-CD2 4.11Å; L906-Y936 HydrophobicContact CD2-CG 3.84Å
907	R	95.5	Very high	94.8	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-54.6	-48	171.8	-178.5	-172	168.3	-78.3	-4.3	112.2	D588 Y860 T872 Y903 V909 A910 I911 E990	D588-R907 IonicContact OD1-CZ 2.66Å; D588-R907 IonicContact OD1-NH1 3.78Å; D588-R907 PolarHBondContact OD1-NH1 3.35Å; D588-R907 IonicContact OD1-NH2 3.91Å; D588-R907 IonicContact OD2-NH1 3.97Å; D588-R907 IonicContact OD2-NH2 3.94Å; D588-R907 PolarHBondContact OD2-NH2 2.71Å; Y860-R907 HydrophobicContact CD1-CB 4.45Å; Y860-R907 HydrophobicContact CE1-CB 3.87Å; Y860-R907 HydrophobicContact CE1-CG 4.45Å; T872-R907 HydrophobicContact CG2-CG 3.72Å; Y903-R907 VanDerWaalsContact O-CB 3.29Å; Y903-R907 WeakPolarHBondContact O-CB 3.45Å; Y903-R907 PolarHBondContact O-N 3.46Å; R907-V909 VanDerWaalsContact C-N 3.31Å; R907-V909 PolarHBondContact O-N 3.07Å; R907-A910 WeakPolarHBondContact O-CB 3.3Å; R907-A910 PolarHBondContact O-N 2.96Å; R907-I911 HydrophobicContact CG-CD1 4.21Å; R907-I911 VanDerWaalsContact CZ-CD1 3.45Å; R907-I911 WeakPolarHBondContact O-CG1 3.26Å; R907-I911 PolarHBondContact O-N 2.97Å; R907-E990 IonicContact CZ-OE1 3.52Å; R907-E990 IonicContact CZ-OE2 3.97Å; R907-E990 IonicContact NE-OE1 3.21Å; R907-E990 PolarHBondContact NE-OE1 2.89Å; R907-E990 IonicContact NE-OE2 2.87Å; R907-E990 PolarHBondContact NE-OE2 3.32Å; R907-E990 IonicContact NH2-OE1 2.77Å; R907-E990 PolarHBondContact NH2-OE1 2.99Å; R907-E990 IonicContact NH2-OE2 3.26Å; R907-E990 PolarHBondContact NH2-OE2 2.53Å
908	S	94.8	Very high	94.7	Very high	37 Å²	37	23.1 Å²	23.1	26%	0.259	11%	0.109	S	C	.	.	H	α-helix	trans	-63.9	-39.6	-177.9	-61.1	0	0	0	0	111.5	Y904 M905 L906 K912	Y904-S908 VanDerWaalsContact O-CB 3.27Å; Y904-S908 WeakPolarHBondContact O-CB 3.43Å; Y904-S908 PolarHBondContact O-N 2.76Å; Y904-S908 PolarHBondContact O-OG 3.36Å; M905-S908 PolarHBondContact O-N 3.09Å; L906-S908 VanDerWaalsContact C-N 3.34Å; L906-S908 PolarHBondContact O-N 2.96Å; S908-K912 VanDerWaalsContact O-CB 3.29Å; S908-K912 WeakPolarHBondContact O-CB 3.33Å; S908-K912 PolarHBondContact O-N 2.95Å
909	V	95.5	Very high	94.6	Very high	9 Å²	9	23.1 Å²	23.1	6%	0.055	11%	0.109	C	C	.	.	H	α-helix	trans	-65.1	-44.9	175	178.2	0	0	0	0	110.3	E785 M905 L906 R907 I911 K912 V913 F927 Y936 I938	E785-V909 HydrophobicContact CG-CG1 4.43Å; M905-V909 VanDerWaalsContact O-CG2 3.28Å; M905-V909 WeakPolarHBondContact O-CG2 3.31Å; M905-V909 PolarHBondContact O-N 3.46Å; M905-V909 VanDerWaalsContact O-N 3.11Å; L906-V909 PolarHBondContact O-N 3.27Å; R907-V909 VanDerWaalsContact C-N 3.31Å; R907-V909 PolarHBondContact O-N 3.07Å; V909-I911 PolarHBondContact O-N 3.08Å; V909-K912 WeakPolarHBondContact O-CB 3.42Å; V909-K912 PolarHBondContact O-N 2.84Å; V909-V913 HydrophobicContact CG1-CG2 4.15Å; V909-V913 WeakPolarHBondContact O-CB 3.04Å; V909-V913 WeakPolarHBondContact O-CG2 3.42Å; V909-V913 PolarHBondContact O-N 3.42Å; V909-F927 HydrophobicContact CB-CE1 4.15Å; V909-F927 HydrophobicContact CB-CZ 4.24Å; V909-F927 HydrophobicContact CG1-CE1 3.72Å; V909-F927 HydrophobicContact CG1-CZ 4.11Å; V909-Y936 HydrophobicContact CG1-CE2 4.08Å; V909-Y936 HydrophobicContact CG2-CE1 4.44Å; V909-Y936 HydrophobicContact CG2-CE2 4.13Å; V909-Y936 WeakPolarHBondContact CG2-OH 3.22Å; V909-I938 HydrophobicContact CG1-CD1 3.98Å; V909-I938 HydrophobicContact CG1-CG1 4.43Å
910	A	96	Very high	94.6	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-57.5	-48	178.2	0	0	0	0	0	111.8	Y860 V862 L906 R907 K912 V913 A914 I925 F927	Y860-A910 HydrophobicContact CG-CB 4.4Å; V862-A910 HydrophobicContact CG2-CB 3.96Å; L906-A910 WeakPolarHBondContact O-CB 2.99Å; L906-A910 PolarHBondContact O-N 3.14Å; R907-A910 WeakPolarHBondContact O-CB 3.3Å; R907-A910 PolarHBondContact O-N 2.96Å; A910-K912 PolarHBondContact O-N 3.2Å; A910-V913 PolarHBondContact O-N 2.98Å; A910-A914 WeakPolarHBondContact O-CB 3.23Å; A910-A914 PolarHBondContact O-N 2.88Å; A910-I925 HydrophobicContact CB-CD1 3.95Å; A910-I925 VanDerWaalsContact O-CD1 3.29Å; A910-I925 WeakPolarHBondContact O-CD1 3.41Å; A910-F927 HydrophobicContact CB-CE2 4.18Å; A910-F927 HydrophobicContact CB-CZ 4.06Å
911	I	95.5	Very high	94.6	Very high	4 Å²	4	22.7 Å²	22.7	2%	0.021	11%	0.106	C	C	.	.	H	α-helix	trans	-62.4	-44.3	176	-70.3	175	0	0	0	111.2	C870 T872 R907 V909 V913 A914 R915	C870-I911 HydrophobicContact CB-CG2 4.22Å; T872-I911 HydrophobicContact CG2-CD1 4.22Å; T872-I911 HydrophobicContact CG2-CG1 3.9Å; R907-I911 HydrophobicContact CG-CD1 4.21Å; R907-I911 VanDerWaalsContact CZ-CD1 3.45Å; R907-I911 WeakPolarHBondContact O-CG1 3.26Å; R907-I911 PolarHBondContact O-N 2.97Å; V909-I911 PolarHBondContact O-N 3.08Å; I911-V913 VanDerWaalsContact C-N 3.35Å; I911-V913 PolarHBondContact O-N 2.94Å; I911-A914 PolarHBondContact O-N 2.89Å; I911-R915 HydrophobicContact CG2-CG 4.42Å; I911-R915 VanDerWaalsContact CG2-NH1 3.28Å; I911-R915 WeakPolarHBondContact O-CB 3.11Å; I911-R915 VanDerWaalsContact O-CG 3.3Å; I911-R915 WeakPolarHBondContact O-CG 3.47Å; I911-R915 PolarHBondContact O-N 2.82Å
912	K	94.8	Very high	94.7	Very high	87 Å²	87	21.2 Å²	21.2	38%	0.378	10%	0.097	S	C	.	.	H	α-helix	trans	-59.6	-45.3	178.5	-178.5	-178.3	172.7	-167.2	0	111.4	M783 E785 S908 V909 A910 R915 H916	M783-K912 PolarHBondContact O-NZ 3.14Å; M783-K912 HydrophobicContact SD-CG 4.3Å; E785-K912 WeakPolarHBondContact OE1-CD 3.35Å; E785-K912 WeakPolarHBondContact OE1-CE 3.47Å; E785-K912 IonicContact OE1-NZ 2.69Å; E785-K912 PolarHBondContact OE1-NZ 3.19Å; S908-K912 VanDerWaalsContact O-CB 3.29Å; S908-K912 WeakPolarHBondContact O-CB 3.33Å; S908-K912 PolarHBondContact O-N 2.95Å; V909-K912 WeakPolarHBondContact O-CB 3.42Å; V909-K912 PolarHBondContact O-N 2.84Å; A910-K912 PolarHBondContact O-N 3.2Å; K912-R915 PolarHBondContact O-N 3.06Å; K912-H916 WeakPolarHBondContact O-CB 3.38Å; K912-H916 PolarHBondContact O-N 3.04Å
913	V	95.4	Very high	94.6	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-63.2	-49.5	177.8	169.6	0	0	0	0	111.1	M780 M783 V909 A910 I911 R915 H916 L917 I925 I938 V941	M780-V913 HydrophobicContact CE-CG1 4.09Å; M780-V913 HydrophobicContact SD-CG1 4.12Å; M780-V913 HydrophobicContact SD-CG2 3.89Å; M783-V913 HydrophobicContact CE-CG2 3.96Å; V909-V913 HydrophobicContact CG1-CG2 4.15Å; V909-V913 WeakPolarHBondContact O-CB 3.04Å; V909-V913 WeakPolarHBondContact O-CG2 3.42Å; V909-V913 PolarHBondContact O-N 3.42Å; A910-V913 PolarHBondContact O-N 2.98Å; I911-V913 VanDerWaalsContact C-N 3.35Å; I911-V913 PolarHBondContact O-N 2.94Å; V913-R915 VanDerWaalsContact C-N 3.32Å; V913-R915 PolarHBondContact O-N 2.77Å; V913-H916 PolarHBondContact O-N 3.32Å; V913-L917 HydrophobicContact CG1-CD1 3.85Å; V913-L917 HydrophobicContact CG1-CG 4.49Å; V913-L917 WeakPolarHBondContact O-CG 3.12Å; V913-L917 PolarHBondContact O-N 3.11Å; V913-I925 HydrophobicContact CB-CD1 3.96Å; V913-I925 HydrophobicContact CG1-CD1 3.83Å; V913-I938 HydrophobicContact CG2-CD1 3.85Å; V913-V941 HydrophobicContact CG1-CG2 3.69Å
914	A	94.7	Very high	94.5	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-60.5	-39.5	178.7	0	0	0	0	0	112.6	V862 A910 I911 R918 I919	V862-A914 HydrophobicContact CB-CB 4.47Å; V862-A914 HydrophobicContact CG1-CB 3.78Å; A910-A914 WeakPolarHBondContact O-CB 3.23Å; A910-A914 PolarHBondContact O-N 2.88Å; I911-A914 PolarHBondContact O-N 2.89Å; A914-R918 PolarHBondContact O-N 2.69Å; A914-I919 HydrophobicContact CB-CG1 4.45Å; A914-I919 PolarHBondContact O-N 3.45Å
915	R	94.1	Very high	94.5	Very high	60 Å²	60	19.9 Å²	19.9	23%	0.226	9%	0.092	C	C	.	.	H	α-helix	trans	-66.2	-40.8	175.2	-73.8	-176.6	177.6	138.8	5.6	112.6	D868 C870 I911 K912 V913 R918	D868-R915 WeakPolarHBondContact OD1-CG 3.02Å; D868-R915 IonicContact OD1-NE 3.03Å; D868-R915 IonicContact OD2-NE 3Å; C870-R915 HydrophobicContact CB-CG 4.35Å; I911-R915 HydrophobicContact CG2-CG 4.42Å; I911-R915 VanDerWaalsContact CG2-NH1 3.28Å; I911-R915 WeakPolarHBondContact O-CB 3.11Å; I911-R915 VanDerWaalsContact O-CG 3.3Å; I911-R915 WeakPolarHBondContact O-CG 3.47Å; I911-R915 PolarHBondContact O-N 2.82Å; K912-R915 PolarHBondContact O-N 3.06Å; V913-R915 VanDerWaalsContact C-N 3.32Å; V913-R915 PolarHBondContact O-N 2.77Å; R915-R918 WeakPolarHBondContact O-CD 3.37Å; R915-R918 PolarHBondContact O-N 3.47Å; R915-R918 PolarHBondContact O-NH1 3.32Å
916	H	92.9	Very high	94.5	Very high	82 Å²	82	18.3 Å²	18.3	38%	0.38	8%	0.084	S	C	.	.	H	α-helix	trans	-68.4	-40.8	179.5	-175.6	87.4	0	0	0	112.2	S782 M783 K912 V913 R918	S782-H916 PolarHBondContact OG-NE2 3.36Å; M783-H916 HydrophobicContact CE-CB 4.15Å; M783-H916 HydrophobicContact CG-CB 4.21Å; M783-H916 HydrophobicContact SD-CB 3.2Å; M783-H916 WeakPolarHBondContact SD-CB 3.28Å; K912-H916 WeakPolarHBondContact O-CB 3.38Å; K912-H916 PolarHBondContact O-N 3.04Å; V913-H916 PolarHBondContact O-N 3.32Å; H916-R918 PolarHBondContact O-N 2.83Å
917	L	92.5	Very high	94.4	Very high	8 Å²	8	18.3 Å²	18.3	4%	0.042	8%	0.084	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-3.5	176.1	-65.3	174.5	0	0	0	113.4	A766 I769 T770 M780 V913 I919 V941	A766-L917 VanDerWaalsContact CB-O 3.23Å; A766-L917 WeakPolarHBondContact CB-O 3.43Å; I769-L917 HydrophobicContact CG2-CD2 3.72Å; T770-L917 HydrophobicContact CG2-CD1 3.63Å; T770-L917 HydrophobicContact CG2-CD2 4.44Å; M780-L917 HydrophobicContact CE-CD1 4.42Å; M780-L917 HydrophobicContact CE-CD2 4.37Å; M780-L917 HydrophobicContact CE-CG 4.5Å; V913-L917 HydrophobicContact CG1-CD1 3.85Å; V913-L917 HydrophobicContact CG1-CG 4.49Å; V913-L917 WeakPolarHBondContact O-CG 3.12Å; V913-L917 PolarHBondContact O-N 3.11Å; L917-I919 VanDerWaalsContact C-N 3.28Å; L917-I919 HydrophobicContact CB-CD1 3.98Å; L917-I919 HydrophobicContact CB-CG1 4.04Å; L917-I919 PolarHBondContact O-N 2.87Å; L917-V941 HydrophobicContact CD1-CB 4.41Å; L917-V941 HydrophobicContact CD1-CG1 3.86Å
918	R	91.9	Very high	94.4	Very high	78 Å²	78	18.3 Å²	18.3	29%	0.294	8%	0.084	S	C	.	.	T	Hydrogen-bonded Turn	trans	55	41.8	180	-54.8	-63.1	-172.8	-159.8	7.2	112.8	F623 A914 R915 H916 V920	F623-R918 HydrophobicContact CE1-CB 4.37Å; F623-R918 HydrophobicContact CZ-CB 4.16Å; A914-R918 PolarHBondContact O-N 2.69Å; R915-R918 WeakPolarHBondContact O-CD 3.37Å; R915-R918 PolarHBondContact O-N 3.47Å; R915-R918 PolarHBondContact O-NH1 3.32Å; H916-R918 PolarHBondContact O-N 2.83Å; R918-V920 PolarHBondContact O-N 3.1Å
919	I	93.9	Very high	94.5	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	7%	0.072	C	C	.	.			trans	-61.3	136.5	176.4	-56.9	-58	0	0	0	109.5	T762 A766 R864 A914 L917 C923 A943	T762-I919 HydrophobicContact CG2-CD1 3.76Å; A766-I919 HydrophobicContact CB-CD1 4.35Å; R864-I919 WeakPolarHBondContact CB-O 3.23Å; R864-I919 VanDerWaalsContact CD-O 3.23Å; R864-I919 WeakPolarHBondContact CD-O 3.22Å; R864-I919 VanDerWaalsContact CG-O 3.28Å; R864-I919 WeakPolarHBondContact CG-O 3.48Å; R864-I919 PolarHBondContact NH1-O 3.43Å; A914-I919 HydrophobicContact CB-CG1 4.45Å; A914-I919 PolarHBondContact O-N 3.45Å; L917-I919 VanDerWaalsContact C-N 3.28Å; L917-I919 HydrophobicContact CB-CD1 3.98Å; L917-I919 HydrophobicContact CB-CG1 4.04Å; L917-I919 PolarHBondContact O-N 2.87Å; I919-C923 HydrophobicContact CD1-CB 4.5Å; I919-C923 HydrophobicContact CG1-CB 4.27Å; I919-C923 HydrophobicContact CG2-CB 4.1Å; I919-A943 HydrophobicContact CD1-CB 3.53Å
920	V	94.3	Very high	94.5	Very high	2 Å²	2	17.4 Å²	17.4	1%	0.012	8%	0.076	C	C	.	.			trans	-128.9	113.5	170.3	178.9	0	0	0	0	107.1	F623 E624 G761 T762 R864 A866 R918	F623-V920 HydrophobicContact CE2-CG2 4.04Å; F623-V920 HydrophobicContact CZ-CG2 4.36Å; E624-V920 HydrophobicContact CG-CG2 4.38Å; G761-V920 CarbonylContact C-O 3.54Å; T762-V920 PolarHBondContact N-O 3.37Å; T762-V920 VanDerWaalsContact N-O 3.09Å; T762-V920 PolarHBondContact OG1-N 2.73Å; T762-V920 PolarHBondContact OG1-O 3.31Å; R864-V920 WeakPolarHBondContact O-CA 2.99Å; A866-V920 HydrophobicContact CB-CG1 4.44Å; A866-V920 HydrophobicContact CB-CG2 4.41Å; R918-V920 PolarHBondContact O-N 3.1Å
921	G	94.3	Very high	94.3	Very high	2 Å²	2	18.9 Å²	18.9	2%	0.021	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	111.7	-129.5	-165.6	0	0	0	0	0	110.6	I863 R864	I863-G921 WeakPolarHBondContact CA-O 3.44Å; R864-G921 PolarHBondContact N-O 3.38Å; R864-G921 PolarHBondContact O-N 3.45Å
922	E	95.1	Very high	94.3	Very high	4 Å²	4	25 Å²	25	2%	0.019	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	152.4	-176.4	170.7	-81.4	152.6	0	0	111.6	E861 V862 I863 N924 L945 S949 I960 A964	E861-E922 VanDerWaalsContact OE2-OE1 3.05Å; V862-E922 CarbonylContact O-C 3.56Å; V862-E922 VanDerWaalsContact O-CA 3.25Å; V862-E922 WeakPolarHBondContact O-CA 3.47Å; I863-E922 HydrophobicContact CG1-CB 4.23Å; I863-E922 HydrophobicContact CG1-CG 4.47Å; E922-N924 PolarHBondContact OE1-N 2.66Å; E922-N924 VanDerWaalsContact OE1-N 3.17Å; E922-L945 WeakPolarHBondContact OE2-CA 3.23Å; E922-L945 PolarHBondContact OE2-N 3.31Å; E922-S949 PolarHBondContact OE1-OG 2.99Å; E922-I960 HydrophobicContact CB-CG2 3.91Å; E922-I960 HydrophobicContact CG-CG2 3.6Å; E922-A964 HydrophobicContact CB-CB 4.33Å
923	C	94.3	Very high	94.2	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	153.8	161.8	66.4	0	0	0	0	112.3	V862 I919 V941 N942	V862-C923 PolarHBondContact N-O 3.24Å; V862-C923 PolarHBondContact O-N 3.31Å; I919-C923 HydrophobicContact CD1-CB 4.5Å; I919-C923 HydrophobicContact CG1-CB 4.27Å; I919-C923 HydrophobicContact CG2-CB 4.1Å; C923-V941 HydrophobicContact CB-CG1 4.48Å; C923-N942 CarbonylContact C-O 3.56Å; C923-N942 WeakPolarHBondContact CA-O 3.47Å; C923-N942 WeakPolarHBondContact CB-O 3.39Å
924	N	93.5	Very high	94.1	Very high	1 Å²	1	25 Å²	25	1%	0.005	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	136.1	173.3	168.4	-88.6	0	0	0	109.7	E859 E861 E922 Q926 V941 N942	E859-N924 PolarHBondContact OE2-ND2 3.38Å; E859-N924 VanDerWaalsContact OE2-ND2 3.13Å; E861-N924 WeakPolarHBondContact OE1-CB 3.14Å; E861-N924 PolarHBondContact OE1-ND2 3.48Å; E922-N924 PolarHBondContact OE1-N 2.66Å; E922-N924 VanDerWaalsContact OE1-N 3.17Å; N924-Q926 WeakPolarHBondContact OD1-CG 3.32Å; N924-Q926 PolarHBondContact OD1-NE2 3.35Å; N924-V941 CarbonylContact O-C 3.56Å; N924-V941 WeakPolarHBondContact O-CA 3.47Å; N924-N942 HydrophobicContact CB-CB 4.27Å; N924-N942 PolarHBondContact N-O 2.86Å; N924-N942 PolarHBondContact O-N 2.86Å
925	I	94.3	Very high	94.1	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	129.2	179.6	-53.8	-176.6	0	0	0	109.2	E859 Y860 V862 A910 V913 F927 I938 V941	E859-I925 WeakPolarHBondContact CA-O 3.44Å; Y860-I925 PolarHBondContact N-O 3.1Å; Y860-I925 PolarHBondContact O-N 3.28Å; V862-I925 HydrophobicContact CG2-CD1 4.12Å; V862-I925 HydrophobicContact CG2-CG1 4.39Å; A910-I925 HydrophobicContact CB-CD1 3.95Å; A910-I925 VanDerWaalsContact O-CD1 3.29Å; A910-I925 WeakPolarHBondContact O-CD1 3.41Å; V913-I925 HydrophobicContact CB-CD1 3.96Å; V913-I925 HydrophobicContact CG1-CD1 3.83Å; I925-F927 HydrophobicContact CB-CE2 4.23Å; I925-F927 HydrophobicContact CB-CZ 4.47Å; I925-F927 HydrophobicContact CG2-CD2 4.35Å; I925-F927 HydrophobicContact CG2-CE1 4.15Å; I925-F927 HydrophobicContact CG2-CE2 3.63Å; I925-F927 HydrophobicContact CG2-CZ 3.52Å; I925-I938 HydrophobicContact CG2-CG2 4.24Å; I925-V941 HydrophobicContact CB-CG2 4.5Å; I925-V941 HydrophobicContact CD1-CG2 4.4Å; I925-V941 HydrophobicContact CG1-CG1 4.1Å; I925-V941 HydrophobicContact CG1-CG2 4.04Å; I925-V941 HydrophobicContact CG2-CG2 4.08Å
926	Q	93.5	Very high	94.1	Very high	11 Å²	11	27 Å²	27	5%	0.051	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	135.3	-176.3	-58.1	173.3	12.6	0	0	110.9	E859 N924 I939 E940	E859-Q926 HydrophobicContact CG-CG 3.99Å; N924-Q926 WeakPolarHBondContact OD1-CG 3.32Å; N924-Q926 PolarHBondContact OD1-NE2 3.35Å; Q926-I939 HydrophobicContact CB-CB 4.16Å; Q926-I939 PolarHBondContact O-N 2.77Å; Q926-E940 HydrophobicContact CB-CG 4.28Å; Q926-E940 HydrophobicContact CG-CG 4.25Å; Q926-E940 PolarHBondContact N-O 3.18Å; Q926-E940 PolarHBondContact NE2-OE1 3.13Å; Q926-E940 VanDerWaalsContact NE2-OE1 3.11Å; Q926-E940 PolarHBondContact OE1-OE1 3.1Å
927	F	96.1	Very high	94.2	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	141.5	-176.8	-60.5	-84.3	0	0	0	111.2	E857 V858 Y860 L906 V909 A910 I925 Y936 Y937 I938	E857-F927 WeakPolarHBondContact CA-O 3.3Å; V858-F927 PolarHBondContact N-O 2.69Å; V858-F927 PolarHBondContact O-N 2.89Å; Y860-F927 HydrophobicContact CD2-CD2 4.06Å; Y860-F927 AromaticContact CD2-CE2 3.83Å; Y860-F927 HydrophobicContact CD2-CE2 3.83Å; L906-F927 HydrophobicContact CB-CD2 4.35Å; L906-F927 HydrophobicContact CB-CE2 4.32Å; L906-F927 HydrophobicContact CD1-CB 4.39Å; L906-F927 HydrophobicContact CD2-CB 4.12Å; L906-F927 HydrophobicContact CD2-CD1 3.8Å; L906-F927 HydrophobicContact CD2-CD2 4.34Å; L906-F927 HydrophobicContact CD2-CE1 4.23Å; L906-F927 HydrophobicContact CD2-CG 3.84Å; V909-F927 HydrophobicContact CB-CE1 4.15Å; V909-F927 HydrophobicContact CB-CZ 4.24Å; V909-F927 HydrophobicContact CG1-CE1 3.72Å; V909-F927 HydrophobicContact CG1-CZ 4.11Å; A910-F927 HydrophobicContact CB-CE2 4.18Å; A910-F927 HydrophobicContact CB-CZ 4.06Å; I925-F927 HydrophobicContact CB-CE2 4.23Å; I925-F927 HydrophobicContact CB-CZ 4.47Å; I925-F927 HydrophobicContact CG2-CD2 4.35Å; I925-F927 HydrophobicContact CG2-CE1 4.15Å; I925-F927 HydrophobicContact CG2-CE2 3.63Å; I925-F927 HydrophobicContact CG2-CZ 3.52Å; F927-Y936 AromaticContact CD1-CD2 3.98Å; F927-Y936 HydrophobicContact CD1-CD2 3.98Å; F927-Y936 HydrophobicContact CD1-CE2 4.47Å; F927-Y936 HydrophobicContact CE1-CD2 4.39Å; F927-Y936 HydrophobicContact CE1-CE2 4.44Å; F927-Y937 WeakPolarHBondContact CA-O 3.35Å; F927-I938 HydrophobicContact CD1-CG1 4.07Å; F927-I938 HydrophobicContact CE1-CG1 3.81Å
928	A	95.2	Very high	94.2	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	115.4	161.1	0	0	0	0	0	108.1	L852 W855 K856 V882 Y936 Y937 I939	L852-A928 HydrophobicContact CB-CB 4.26Å; L852-A928 HydrophobicContact CD1-CB 3.56Å; W855-A928 HydrophobicContact CB-CB 4.35Å; W855-A928 HydrophobicContact CE3-CB 4.26Å; K856-A928 CarbonylContact O-C 3.31Å; K856-A928 WeakPolarHBondContact O-CA 3.39Å; V882-A928 HydrophobicContact CG2-CB 3.91Å; A928-Y936 CarbonylContact O-C 3.55Å; A928-Y936 WeakPolarHBondContact O-CA 3.35Å; A928-Y936 WeakPolarHBondContact O-CB 3.48Å; A928-Y937 PolarHBondContact N-O 3.08Å; A928-Y937 PolarHBondContact O-N 3.33Å; A928-I939 HydrophobicContact CB-CD1 3.98Å; A928-I939 HydrophobicContact CB-CG1 3.96Å
929	L	96.7	Very high	93.9	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	130.7	178.3	176.8	68.7	0	0	0	110.2	K856 L898 E902 M905 L906 P931	K856-L929 HydrophobicContact CB-CB 4.29Å; K856-L929 PolarHBondContact N-O 3.34Å; K856-L929 PolarHBondContact O-N 3.15Å; L898-L929 HydrophobicContact CD2-CD2 3.53Å; E902-L929 HydrophobicContact CB-CD2 4.22Å; E902-L929 HydrophobicContact CG-CD2 4.16Å; M905-L929 HydrophobicContact CE-CD1 3.99Å; L906-L929 HydrophobicContact CD1-CD2 4.4Å; L929-P931 WeakPolarHBondContact O-CD 3.19Å
930	D	94.9	Very high	93.6	Very high	27 Å²	27	24.9 Å²	24.9	14%	0.144	13%	0.125	C	C	.	.			trans	-66.4	122	175.3	-178.7	1.3	0	0	0	109.6	W855 H932 S933 N935	W855-D930 HydrophobicContact CD2-CB 4.3Å; W855-D930 HydrophobicContact CE3-CB 3.91Å; W855-D930 HydrophobicContact CH2-CB 3.7Å; W855-D930 HydrophobicContact CZ2-CB 4.11Å; W855-D930 HydrophobicContact CZ3-CB 3.6Å; D930-H932 PolarHBondContact O-N 3.22Å; D930-H932 PolarHBondContact OD1-N 3.39Å; D930-S933 PolarHBondContact O-N 3.03Å; D930-S933 WeakPolarHBondContact OD2-CB 3.41Å; D930-S933 PolarHBondContact OD2-OG 3.38Å; D930-N935 HydrophobicContact CB-CB 4.26Å; D930-N935 VanDerWaalsContact CB-O 3.3Å; D930-N935 WeakPolarHBondContact CB-O 3.26Å; D930-N935 PolarHBondContact N-O 3.01Å
931	P	93.2	Very high	93.4	Very high	31 Å²	31	25 Å²	25	20%	0.201	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-11	178.4	26.5	-35.2	0	0	0	114.2	K856 L929	K856-P931 HydrophobicContact CG-CB 4.25Å; L929-P931 WeakPolarHBondContact O-CD 3.19Å
932	H	93.9	Very high	93.1	Very high	133 Å²	133	26.1 Å²	26.1	62%	0.616	13%	0.131	S	C	*	.	T	Hydrogen-bonded Turn	trans	-116.3	1	-175	-56.3	-50.1	0	0	0	114.7	D930	D930-H932 PolarHBondContact O-N 3.22Å; D930-H932 PolarHBondContact OD1-N 3.39Å
933	S	94.4	Very high	92.7	Very high	25 Å²	25	26.1 Å²	26.1	18%	0.175	13%	0.132	C	C	.	.	S	Bend	trans	-158.5	175.5	178.7	77.7	0	0	0	0	111.7	D930 N935	D930-S933 PolarHBondContact O-N 3.03Å; D930-S933 WeakPolarHBondContact OD2-CB 3.41Å; D930-S933 PolarHBondContact OD2-OG 3.38Å; S933-N935 PolarHBondContact O-N 2.96Å; S933-N935 WeakPolarHBondContact OG-CB 3.48Å; S933-N935 PolarHBondContact OG-N 2.65Å; S933-N935 PolarHBondContact OG-ND2 2.87Å
934	L	92.5	Very high	92.5	Very high	62 Å²	62	27.1 Å²	27.1	33%	0.325	14%	0.135	S	C	.	.	S	Bend	trans	-82.3	14.2	173.9	-59.2	179.6	0	0	0	113.3	W318 F341 V901 E902 M905	W318-L934 HydrophobicContact CH2-CD1 4.18Å; F341-L934 HydrophobicContact CE1-CD2 4.27Å; F341-L934 HydrophobicContact CZ-CD2 4.09Å; F341-L934 HydrophobicContact CZ-CG 4.25Å; V901-L934 HydrophobicContact CG1-CD1 4.16Å; V901-L934 HydrophobicContact CG1-CD2 4.42Å; E902-L934 HydrophobicContact CG-CD2 3.7Å; M905-L934 HydrophobicContact SD-CB 4.38Å
935	N	94.1	Very high	92.2	Very high	72 Å²	72	27.2 Å²	27.2	39%	0.385	14%	0.136	S	C	.	.			trans	-76.9	135.8	176.8	-73	-61.7	0	0	0	110.7	K786 W855 D930 S933	K786-N935 PolarHBondContact NZ-OD1 3.2Å; W855-N935 HydrophobicContact CH2-CB 4.46Å; D930-N935 HydrophobicContact CB-CB 4.26Å; D930-N935 VanDerWaalsContact CB-O 3.3Å; D930-N935 WeakPolarHBondContact CB-O 3.26Å; D930-N935 PolarHBondContact N-O 3.01Å; S933-N935 PolarHBondContact O-N 2.96Å; S933-N935 WeakPolarHBondContact OG-CB 3.48Å; S933-N935 PolarHBondContact OG-N 2.65Å; S933-N935 PolarHBondContact OG-ND2 2.87Å
936	Y	95.4	Very high	91.7	Very high	28 Å²	28	27.7 Å²	27.7	11%	0.11	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	164.7	174.6	67.5	-86.7	0	0	0	111	E785 M905 L906 V909 F927 A928 I938	E785-Y936 PolarHBondContact OE2-OH 3.28Å; M905-Y936 HydrophobicContact CE-CD1 3.56Å; M905-Y936 HydrophobicContact CE-CE1 4.07Å; M905-Y936 HydrophobicContact CE-CG 4.39Å; M905-Y936 HydrophobicContact CG-CE1 4.18Å; M905-Y936 HydrophobicContact SD-CD1 3.87Å; M905-Y936 HydrophobicContact SD-CE1 3.82Å; L906-Y936 HydrophobicContact CD2-CD1 4.22Å; L906-Y936 HydrophobicContact CD2-CD2 4.11Å; L906-Y936 HydrophobicContact CD2-CG 3.84Å; V909-Y936 HydrophobicContact CG1-CE2 4.08Å; V909-Y936 HydrophobicContact CG2-CE1 4.44Å; V909-Y936 HydrophobicContact CG2-CE2 4.13Å; V909-Y936 WeakPolarHBondContact CG2-OH 3.22Å; F927-Y936 AromaticContact CD1-CD2 3.98Å; F927-Y936 HydrophobicContact CD1-CD2 3.98Å; F927-Y936 HydrophobicContact CD1-CE2 4.47Å; F927-Y936 HydrophobicContact CE1-CD2 4.39Å; F927-Y936 HydrophobicContact CE1-CE2 4.44Å; A928-Y936 CarbonylContact O-C 3.55Å; A928-Y936 WeakPolarHBondContact O-CA 3.35Å; A928-Y936 WeakPolarHBondContact O-CB 3.48Å; Y936-I938 HydrophobicContact CE2-CG1 4.48Å
937	Y	93.5	Very high	91	Very high	54 Å²	54	28.3 Å²	28.3	21%	0.212	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	141.9	169.1	-69.4	-77	0	0	0	109.9	K786 V787 L852 W855 F927 A928 I939	K786-Y937 HydrophobicContact CB-CD1 3.71Å; K786-Y937 HydrophobicContact CB-CE1 3.92Å; K786-Y937 HydrophobicContact CD-CE1 4.45Å; V787-Y937 VanDerWaalsContact C-CD1 3.43Å; V787-Y937 WeakPolarHBondContact O-CD1 3.47Å; L852-Y937 HydrophobicContact CD1-CD2 3.8Å; L852-Y937 HydrophobicContact CD1-CG 4Å; L852-Y937 HydrophobicContact CD2-CD2 3.76Å; L852-Y937 HydrophobicContact CD2-CE2 4.01Å; L852-Y937 HydrophobicContact CG-CD2 4.47Å; W855-Y937 HydrophobicContact CH2-CD2 4.07Å; W855-Y937 AromaticContact CH2-CE2 3.84Å; W855-Y937 HydrophobicContact CH2-CE2 3.84Å; W855-Y937 AromaticContact CZ3-CD2 3.78Å; W855-Y937 HydrophobicContact CZ3-CD2 3.78Å; W855-Y937 HydrophobicContact CZ3-CE2 4.04Å; F927-Y937 WeakPolarHBondContact CA-O 3.35Å; A928-Y937 PolarHBondContact N-O 3.08Å; A928-Y937 PolarHBondContact O-N 3.33Å; Y937-I939 PolarHBondContact O-N 3.37Å
938	I	92.3	Very high	90.4	Very high	2 Å²	2	29.2 Å²	29.2	1%	0.01	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	119.2	169.5	-53.4	172.3	0	0	0	107.6	F776 M780 E785 K786 V909 V913 I925 F927 Y936 V941	F776-I938 HydrophobicContact CE1-CG2 4.39Å; F776-I938 HydrophobicContact CZ-CG2 3.75Å; M780-I938 HydrophobicContact CG-CD1 4.35Å; M780-I938 HydrophobicContact SD-CD1 3.73Å; E785-I938 HydrophobicContact CB-CD1 3.88Å; E785-I938 HydrophobicContact CG-CD1 4.38Å; K786-I938 PolarHBondContact O-N 2.92Å; V909-I938 HydrophobicContact CG1-CD1 3.98Å; V909-I938 HydrophobicContact CG1-CG1 4.43Å; V913-I938 HydrophobicContact CG2-CD1 3.85Å; I925-I938 HydrophobicContact CG2-CG2 4.24Å; F927-I938 HydrophobicContact CD1-CG1 4.07Å; F927-I938 HydrophobicContact CE1-CG1 3.81Å; Y936-I938 HydrophobicContact CE2-CG1 4.48Å; I938-V941 HydrophobicContact CG2-CG2 4.31Å
939	I	86.6	Confident	90.1	Very high	29 Å²	29	29.2 Å²	29.2	15%	0.149	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	-53.5	179	-59.6	175.5	0	0	0	109	R773 E857 V882 Q926 A928 Y937	R773-I939 PolarHBondContact NH1-O 3.1Å; E857-I939 HydrophobicContact CG-CD1 4.09Å; V882-I939 HydrophobicContact CG2-CD1 4.2Å; Q926-I939 HydrophobicContact CB-CB 4.16Å; Q926-I939 PolarHBondContact O-N 2.77Å; A928-I939 HydrophobicContact CB-CD1 3.98Å; A928-I939 HydrophobicContact CB-CG1 3.96Å; Y937-I939 PolarHBondContact O-N 3.37Å
940	E	87.2	Confident	89.7	Confident	40 Å²	40	29.2 Å²	29.2	19%	0.187	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164.3	167.6	179.6	64.9	-179.6	-153.5	0	0	112.9	R773 Q926 N942	R773-E940 IonicContact NH2-OE2 2.82Å; R773-E940 PolarHBondContact NH2-OE2 3.26Å; Q926-E940 HydrophobicContact CB-CG 4.28Å; Q926-E940 HydrophobicContact CG-CG 4.25Å; Q926-E940 PolarHBondContact N-O 3.18Å; Q926-E940 PolarHBondContact NE2-OE1 3.13Å; Q926-E940 VanDerWaalsContact NE2-OE1 3.11Å; Q926-E940 PolarHBondContact OE1-OE1 3.1Å; E940-N942 PolarHBondContact OE1-ND2 2.81Å
941	V	89.7	Confident	89.3	Confident	3 Å²	3	28.3 Å²	28.3	2%	0.018	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	123.6	172.2	176.8	0	0	0	0	107.7	T770 F776 V913 L917 C923 N924 I925 I938	T770-V941 WeakPolarHBondContact CB-O 3.26Å; T770-V941 HydrophobicContact CG2-CB 4.06Å; T770-V941 HydrophobicContact CG2-CG1 3.95Å; F776-V941 HydrophobicContact CE2-CB 3.88Å; F776-V941 HydrophobicContact CE2-CG2 3.51Å; F776-V941 HydrophobicContact CZ-CB 4.47Å; F776-V941 HydrophobicContact CZ-CG2 3.83Å; V913-V941 HydrophobicContact CG1-CG2 3.69Å; L917-V941 HydrophobicContact CD1-CB 4.41Å; L917-V941 HydrophobicContact CD1-CG1 3.86Å; C923-V941 HydrophobicContact CB-CG1 4.48Å; N924-V941 CarbonylContact O-C 3.56Å; N924-V941 WeakPolarHBondContact O-CA 3.47Å; I925-V941 HydrophobicContact CB-CG2 4.5Å; I925-V941 HydrophobicContact CD1-CG2 4.4Å; I925-V941 HydrophobicContact CG1-CG1 4.1Å; I925-V941 HydrophobicContact CG1-CG2 4.04Å; I925-V941 HydrophobicContact CG2-CG2 4.08Å; I938-V941 HydrophobicContact CG2-CG2 4.31Å
942	N	88.1	Confident	89.3	Confident	27 Å²	27	26.8 Å²	26.8	14%	0.144	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	100.6	173.7	-67.9	-61.7	0	0	0	108.1	C923 N924 E940 R944	C923-N942 CarbonylContact C-O 3.56Å; C923-N942 WeakPolarHBondContact CA-O 3.47Å; C923-N942 WeakPolarHBondContact CB-O 3.39Å; N924-N942 HydrophobicContact CB-CB 4.27Å; N924-N942 PolarHBondContact N-O 2.86Å; N924-N942 PolarHBondContact O-N 2.86Å; E940-N942 PolarHBondContact OE1-ND2 2.81Å; N942-R944 PolarHBondContact O-N 2.87Å
943	A	88.2	Confident	89.1	Confident	4 Å²	4	20.6 Å²	20.6	3%	0.033	11%	0.105	C	C	.	.			trans	-76.6	36	-177.9	0	0	0	0	0	114	T762 T770 I919	T762-A943 HydrophobicContact CG2-CB 4.37Å; T770-A943 HydrophobicContact CG2-CB 3.99Å; T770-A943 WeakPolarHBondContact OG1-CB 3.13Å; I919-A943 HydrophobicContact CD1-CB 3.53Å
944	R	88.2	Confident	88.9	Confident	21 Å²	21	19.4 Å²	19.4	8%	0.079	10%	0.096	C	C	.	.	S	Bend	trans	-161.7	168.2	-177.7	56.6	144.7	174	103.1	6	109.7	A716 L723 N942 S946	A716-R944 HydrophobicContact CB-CB 4.13Å; L723-R944 HydrophobicContact CD1-CG 3.93Å; L723-R944 VanDerWaalsContact CD1-NE 3.32Å; N942-R944 PolarHBondContact O-N 2.87Å; R944-S946 PolarHBondContact O-N 3.42Å
945	L	88.2	Confident	88.8	Confident	3 Å²	3	16.5 Å²	16.5	2%	0.016	8%	0.081	C	C	.	.			trans	-53.8	136.5	173.8	-79.6	-68.3	0	0	0	110.2	F653 A716 F717 E922 I960 A961 A964	F653-L945 WeakPolarHBondContact CE1-O 2.98Å; A716-L945 PolarHBondContact O-N 3.43Å; F717-L945 HydrophobicContact CD1-CD2 4.18Å; F717-L945 HydrophobicContact CD1-CG 4.27Å; F717-L945 HydrophobicContact CE1-CD2 3.97Å; F717-L945 HydrophobicContact CE1-CG 4.41Å; F717-L945 HydrophobicContact CZ-CD2 4.41Å; E922-L945 WeakPolarHBondContact OE2-CA 3.23Å; E922-L945 PolarHBondContact OE2-N 3.31Å; L945-I960 HydrophobicContact CD1-CG2 4.11Å; L945-A961 HydrophobicContact CD1-CB 4.03Å; L945-A961 HydrophobicContact CG-CB 4.47Å; L945-A964 HydrophobicContact CD2-CB 4.35Å
946	S	83	Confident	88.7	Confident	10 Å²	10	13.1 Å²	13.1	7%	0.07	6%	0.063	C	C	.	.			trans	-121.7	176.1	-179.8	79.1	0	0	0	0	110.6	R944 S948 S949	R944-S946 PolarHBondContact O-N 3.42Å; S946-S948 VanDerWaalsContact C-N 3.32Å; S946-S948 WeakPolarHBondContact OG-CB 3.39Å; S946-S948 PolarHBondContact OG-N 3.23Å; S946-S949 PolarHBondContact N-OG 2.94Å; S946-S949 WeakPolarHBondContact O-CB 3.44Å; S946-S949 PolarHBondContact O-N 3.33Å; S946-S949 PolarHBondContact OG-N 2.79Å; S946-S949 PolarHBondContact OG-OG 2.87Å; S946-S949 VanDerWaalsContact OG-OG 3.09Å
947	R	80.1	Confident	88.2	Confident	23 Å²	23	12.2 Å²	12.2	9%	0.087	6%	0.062	C	C	.	.	H	α-helix	trans	-64.2	-40.4	171.2	-174.1	-178	-84.1	-173.9	-5.6	111.1	E652 S949 A950 L951 E1300	E652-R947 HydrophobicContact CG-CB 4.1Å; E652-R947 HydrophobicContact CG-CG 4.38Å; E652-R947 IonicContact OE1-NE 3.94Å; E652-R947 IonicContact OE2-NE 3.25Å; R947-S949 PolarHBondContact O-N 3.32Å; R947-A950 PolarHBondContact O-N 2.75Å; R947-A950 VanDerWaalsContact O-N 3.13Å; R947-L951 PolarHBondContact O-N 3.41Å; R947-E1300 IonicContact CZ-OE1 3.04Å; R947-E1300 IonicContact NE-OE1 3.67Å; R947-E1300 PolarHBondContact NE-OE1 3.11Å; R947-E1300 IonicContact NH2-OE1 3.44Å
948	S	84	Confident	88.1	Confident	19 Å²	19	9.7 Å²	9.7	13%	0.133	5%	0.052	C	C	.	.	H	α-helix	trans	-56.9	-29.9	174.1	-58.3	0	0	0	0	112.1	E859 E861 S946 A950 L951 A952	E859-S948 PolarHBondContact OE2-OG 3.24Å; E861-S948 WeakPolarHBondContact OE1-CB 3.27Å; S946-S948 VanDerWaalsContact C-N 3.32Å; S946-S948 WeakPolarHBondContact OG-CB 3.39Å; S946-S948 PolarHBondContact OG-N 3.23Å; S948-A950 PolarHBondContact O-N 2.6Å; S948-L951 PolarHBondContact O-N 3.29Å; S948-A952 WeakPolarHBondContact O-CB 3.47Å; S948-A952 PolarHBondContact O-N 3.21Å
949	S	88.3	Confident	88	Confident	1 Å²	1	10 Å²	10	1%	0.007	5%	0.054	C	C	.	.	H	α-helix	trans	-67.8	-36	178.1	-46	0	0	0	0	113.4	E861 E922 S946 R947 S953	E861-S949 WeakPolarHBondContact OE2-CA 3.45Å; E861-S949 WeakPolarHBondContact OE2-CB 3.33Å; E861-S949 PolarHBondContact OE2-OG 3.13Å; E922-S949 PolarHBondContact OE1-OG 2.99Å; S946-S949 PolarHBondContact N-OG 2.94Å; S946-S949 WeakPolarHBondContact O-CB 3.44Å; S946-S949 PolarHBondContact O-N 3.33Å; S946-S949 PolarHBondContact OG-N 2.79Å; S946-S949 PolarHBondContact OG-OG 2.87Å; S946-S949 VanDerWaalsContact OG-OG 3.09Å; R947-S949 PolarHBondContact O-N 3.32Å; S949-S953 WeakPolarHBondContact O-CB 3.5Å; S949-S953 PolarHBondContact O-N 3.46Å; S949-S953 PolarHBondContact O-OG 2.91Å
950	A	87	Confident	88.3	Confident	0 Å²	0	8.6 Å²	8.6	0%	0	5%	0.047	C	C	.	.	H	α-helix	trans	-67.9	-47.9	173.8	0	0	0	0	0	110.4	E652 Y655 R947 S948 A952 S953 K954	E652-A950 HydrophobicContact CB-CB 4.03Å; Y655-A950 HydrophobicContact CD1-CB 4.05Å; Y655-A950 HydrophobicContact CE1-CB 4.32Å; R947-A950 PolarHBondContact O-N 2.75Å; R947-A950 VanDerWaalsContact O-N 3.13Å; S948-A950 PolarHBondContact O-N 2.6Å; A950-A952 PolarHBondContact O-N 2.69Å; A950-S953 WeakPolarHBondContact O-CB 3.45Å; A950-S953 PolarHBondContact O-N 3.39Å; A950-K954 WeakPolarHBondContact O-CG 3.42Å; A950-K954 PolarHBondContact O-N 3.2Å; A950-K954 VanDerWaalsContact O-N 3.15Å
951	L	87.9	Confident	88.6	Confident	7 Å²	7	6.7 Å²	6.7	4%	0.037	4%	0.038	C	C	.	.	H	α-helix	trans	-55.1	-53.6	174.7	177.6	67.7	0	0	0	111.5	M876 R947 S948 S953 K954 A955 K999 M1026 P1299	M876-L951 HydrophobicContact SD-CD2 4.03Å; R947-L951 PolarHBondContact O-N 3.41Å; S948-L951 PolarHBondContact O-N 3.29Å; L951-S953 VanDerWaalsContact C-N 3.27Å; L951-S953 PolarHBondContact O-N 3.14Å; L951-K954 PolarHBondContact O-N 2.82Å; L951-K954 VanDerWaalsContact O-N 3.07Å; L951-A955 VanDerWaalsContact O-CB 3.27Å; L951-A955 WeakPolarHBondContact O-CB 3.47Å; L951-A955 PolarHBondContact O-N 3.47Å; L951-K999 HydrophobicContact CD1-CB 3.99Å; L951-K999 HydrophobicContact CD1-CG 4.11Å; L951-K999 HydrophobicContact CD2-CB 3.85Å; L951-K999 HydrophobicContact CD2-CG 3.97Å; L951-M1026 HydrophobicContact CD1-CB 4.02Å; L951-M1026 HydrophobicContact CD1-CG 3.82Å; L951-M1026 HydrophobicContact CD1-SD 3.75Å; L951-P1299 HydrophobicContact CD1-CB 4.29Å; L951-P1299 HydrophobicContact CD1-CG 4.16Å
952	A	91.5	Very high	88.8	Confident	0 Å²	0	8.2 Å²	8.2	0%	0	4%	0.044	C	C	.	.	H	α-helix	trans	-59.2	-37.8	179.4	0	0	0	0	0	112.3	E861 C874 S948 A950 K954 A955 T956 I960	E861-A952 HydrophobicContact CG-CB 3.8Å; C874-A952 HydrophobicContact CB-CB 3.61Å; S948-A952 WeakPolarHBondContact O-CB 3.47Å; S948-A952 PolarHBondContact O-N 3.21Å; A950-A952 PolarHBondContact O-N 2.69Å; A952-K954 VanDerWaalsContact C-N 3.32Å; A952-K954 PolarHBondContact O-N 3.13Å; A952-A955 PolarHBondContact O-N 3.17Å; A952-T956 WeakPolarHBondContact O-CB 3.29Å; A952-T956 WeakPolarHBondContact O-CG2 3.41Å; A952-T956 PolarHBondContact O-N 3Å; A952-T956 PolarHBondContact O-OG1 3.34Å; A952-I960 HydrophobicContact CB-CD1 3.73Å
953	S	91.5	Very high	89.1	Confident	3 Å²	3	7.2 Å²	7.2	2%	0.021	4%	0.039	C	C	.	.	H	α-helix	trans	-62.9	-38.9	176.1	-61.1	0	0	0	0	112.4	S949 A950 L951 G957 Y958 I960	S949-S953 WeakPolarHBondContact O-CB 3.5Å; S949-S953 PolarHBondContact O-N 3.46Å; S949-S953 PolarHBondContact O-OG 2.91Å; A950-S953 WeakPolarHBondContact O-CB 3.45Å; A950-S953 PolarHBondContact O-N 3.39Å; L951-S953 VanDerWaalsContact C-N 3.27Å; L951-S953 PolarHBondContact O-N 3.14Å; S953-G957 CarbonylContact O-C 3.57Å; S953-G957 VanDerWaalsContact O-CA 3.27Å; S953-G957 WeakPolarHBondContact O-CA 3.45Å; S953-G957 PolarHBondContact O-N 2.96Å; S953-Y958 WeakPolarHBondContact CA-O 3.31Å; S953-Y958 WeakPolarHBondContact CB-O 3.28Å; S953-Y958 PolarHBondContact O-N 2.76Å; S953-Y958 PolarHBondContact OG-O 3.31Å; S953-I960 WeakPolarHBondContact OG-CB 3.42Å; S953-I960 WeakPolarHBondContact OG-CG1 3.44Å; S953-I960 PolarHBondContact OG-N 3.03Å
954	K	89.9	Confident	89.4	Confident	0 Å²	0	7.1 Å²	7.1	0%	0	4%	0.037	C	C	.	.	H	α-helix	trans	-81.3	-36.6	179.1	-55.8	-45.1	-175.7	-179.8	0	112.3	Y655 A950 L951 A952 M1026 Y1201 P1299 T1304 D1305 F1314	Y655-K954 VanDerWaalsContact CE2-NZ 3.31Å; Y655-K954 PolarHBondContact OH-NZ 3.27Å; A950-K954 WeakPolarHBondContact O-CG 3.42Å; A950-K954 PolarHBondContact O-N 3.2Å; A950-K954 VanDerWaalsContact O-N 3.15Å; L951-K954 PolarHBondContact O-N 2.82Å; L951-K954 VanDerWaalsContact O-N 3.07Å; A952-K954 VanDerWaalsContact C-N 3.32Å; A952-K954 PolarHBondContact O-N 3.13Å; K954-M1026 HydrophobicContact CB-CE 3.54Å; K954-M1026 HydrophobicContact CB-SD 3.91Å; K954-Y1201 HydrophobicContact CD-CE2 4.42Å; K954-Y1201 PolarHBondContact NZ-OH 2.84Å; K954-P1299 HydrophobicContact CB-CB 4.36Å; K954-P1299 HydrophobicContact CG-CB 4.1Å; K954-T1304 VanDerWaalsContact CE-O 3.28Å; K954-T1304 WeakPolarHBondContact CE-O 3.43Å; K954-T1304 PolarHBondContact NZ-O 2.93Å; K954-D1305 IonicContact NZ-OD1 2.75Å; K954-D1305 PolarHBondContact NZ-OD1 3.04Å; K954-F1314 HydrophobicContact CB-CE1 4.34Å; K954-F1314 HydrophobicContact CB-CE2 4.41Å; K954-F1314 HydrophobicContact CB-CZ 3.78Å; K954-F1314 HydrophobicContact CD-CZ 3.94Å; K954-F1314 HydrophobicContact CG-CE1 4.44Å; K954-F1314 HydrophobicContact CG-CZ 3.81Å
955	A	90	Very high	89.8	Confident	1 Å²	1	6.1 Å²	6.1	1%	0.008	3%	0.034	C	C	.	.	H	α-helix	trans	-64.2	-43.6	177.9	0	0	0	0	0	111.3	L951 A952 Y995 V997 M1026	L951-A955 VanDerWaalsContact O-CB 3.27Å; L951-A955 WeakPolarHBondContact O-CB 3.47Å; L951-A955 PolarHBondContact O-N 3.47Å; A952-A955 PolarHBondContact O-N 3.17Å; A955-Y995 WeakPolarHBondContact O-CE2 3.17Å; A955-Y995 PolarHBondContact O-OH 2.9Å; A955-V997 HydrophobicContact CB-CB 4.28Å; A955-V997 HydrophobicContact CB-CG1 3.98Å; A955-V997 HydrophobicContact CB-CG2 4.05Å; A955-M1026 HydrophobicContact CB-SD 4.09Å
956	T	91.1	Very high	90.1	Very high	1 Å²	1	6.1 Å²	6.1	1%	0.006	3%	0.034	C	C	.	.	H	α-helix	trans	-91.4	-26.9	-177.9	61.6	0	0	0	0	112.9	V873 C874 A952 Y958 P991 L993 T1190	V873-T956 WeakPolarHBondContact O-CG2 3.21Å; C874-T956 HydrophobicContact CB-CG2 3.92Å; A952-T956 WeakPolarHBondContact O-CB 3.29Å; A952-T956 WeakPolarHBondContact O-CG2 3.41Å; A952-T956 PolarHBondContact O-N 3Å; A952-T956 PolarHBondContact O-OG1 3.34Å; T956-Y958 VanDerWaalsContact C-N 3.3Å; T956-Y958 VanDerWaalsContact OG1-CB 3.27Å; T956-Y958 WeakPolarHBondContact OG1-CB 3.37Å; T956-Y958 PolarHBondContact OG1-N 2.97Å; T956-P991 HydrophobicContact CG2-CB 4.12Å; T956-P991 HydrophobicContact CG2-CG 4.29Å; T956-L993 HydrophobicContact CG2-CD2 4.16Å; T956-T1190 WeakPolarHBondContact O-CG2 3.46Å
957	G	86.5	Confident	90.7	Very high	8 Å²	8	5.6 Å²	5.6	8%	0.082	3%	0.03	C	C	.	.			trans	83.9	-0.1	-165.2	0	0	0	0	0	113.9	S953 V980	S953-G957 CarbonylContact O-C 3.57Å; S953-G957 VanDerWaalsContact O-CA 3.27Å; S953-G957 WeakPolarHBondContact O-CA 3.45Å; S953-G957 PolarHBondContact O-N 2.96Å; G957-V980 WeakPolarHBondContact O-CG2 3.44Å
958	Y	91.1	Very high	91.3	Very high	1 Å²	1	4.8 Å²	4.8	0%	0.004	3%	0.028	C	C	.	.			trans	-84.5	119.7	-179.6	-166.4	-76	0	0	0	111.1	I863 V873 S953 T956 I960 I963 A987 F989 P991	I863-Y958 HydrophobicContact CD1-CD1 4.23Å; I863-Y958 HydrophobicContact CD1-CE1 3.5Å; V873-Y958 HydrophobicContact CG1-CD1 4.04Å; V873-Y958 HydrophobicContact CG1-CD2 4.38Å; V873-Y958 HydrophobicContact CG1-CE1 3.94Å; V873-Y958 HydrophobicContact CG1-CE2 4.25Å; V873-Y958 HydrophobicContact CG1-CG 4.28Å; S953-Y958 WeakPolarHBondContact CA-O 3.31Å; S953-Y958 WeakPolarHBondContact CB-O 3.28Å; S953-Y958 PolarHBondContact O-N 2.76Å; S953-Y958 PolarHBondContact OG-O 3.31Å; T956-Y958 VanDerWaalsContact C-N 3.3Å; T956-Y958 VanDerWaalsContact OG1-CB 3.27Å; T956-Y958 WeakPolarHBondContact OG1-CB 3.37Å; T956-Y958 PolarHBondContact OG1-N 2.97Å; Y958-I960 HydrophobicContact CD1-CG1 4Å; Y958-I960 PolarHBondContact O-N 2.78Å; Y958-I963 HydrophobicContact CE1-CB 4.26Å; Y958-I963 HydrophobicContact CE1-CG1 3.84Å; Y958-I963 HydrophobicContact CE1-CG2 4.41Å; Y958-A987 HydrophobicContact CE2-CB 4.49Å; Y958-A987 VanDerWaalsContact CE2-O 3.26Å; Y958-A987 WeakPolarHBondContact CE2-O 3.5Å; Y958-A987 PolarHBondContact OH-O 3.39Å; Y958-F989 AromaticContact CD2-CE1 3.8Å; Y958-F989 HydrophobicContact CD2-CE1 3.8Å; Y958-F989 AromaticContact CD2-CZ 3.89Å; Y958-F989 HydrophobicContact CD2-CZ 3.89Å; Y958-F989 HydrophobicContact CE2-CD1 4.15Å; Y958-F989 AromaticContact CE2-CE1 3.65Å; Y958-F989 HydrophobicContact CE2-CE1 3.65Å; Y958-F989 HydrophobicContact CE2-CZ 4.2Å; Y958-P991 HydrophobicContact CD2-CG 4.1Å; Y958-P991 HydrophobicContact CG-CG 4.48Å
959	P	90.1	Very high	91.7	Very high	8 Å²	8	4.6 Å²	4.6	5%	0.052	3%	0.025	C	C	.	.			trans	-81.4	76.7	-172.4	34.1	-37.1	0	0	0	112.6	A961 Y962 I963 F1306	P959-A961 PolarHBondContact O-N 3.42Å; P959-Y962 WeakPolarHBondContact O-CB 3.48Å; P959-Y962 PolarHBondContact O-N 3.46Å; P959-I963 HydrophobicContact CG-CG1 4.3Å; P959-I963 WeakPolarHBondContact O-CG1 3.31Å; P959-I963 PolarHBondContact O-N 2.92Å; P959-F1306 HydrophobicContact CB-CE1 4.24Å
960	I	93.3	Very high	91.8	Very high	0 Å²	0	5 Å²	5	0%	0	3%	0.029	C	C	.	.	H	α-helix	trans	-54	-54.5	-170	-62.1	177.9	0	0	0	112.7	E861 I863 V873 E922 L945 A952 S953 Y958 Y962 I963 A964	E861-I960 HydrophobicContact CB-CD1 4.48Å; I863-I960 HydrophobicContact CD1-CG1 4.42Å; I863-I960 HydrophobicContact CD1-CG2 4.14Å; V873-I960 HydrophobicContact CG2-CD1 3.71Å; V873-I960 HydrophobicContact CG2-CG1 4.09Å; E922-I960 HydrophobicContact CB-CG2 3.91Å; E922-I960 HydrophobicContact CG-CG2 3.6Å; L945-I960 HydrophobicContact CD1-CG2 4.11Å; A952-I960 HydrophobicContact CB-CD1 3.73Å; S953-I960 WeakPolarHBondContact OG-CB 3.42Å; S953-I960 WeakPolarHBondContact OG-CG1 3.44Å; S953-I960 PolarHBondContact OG-N 3.03Å; Y958-I960 HydrophobicContact CD1-CG1 4Å; Y958-I960 PolarHBondContact O-N 2.78Å; I960-Y962 VanDerWaalsContact C-N 3.32Å; I960-Y962 PolarHBondContact O-N 2.76Å; I960-I963 PolarHBondContact O-N 2.9Å; I960-A964 WeakPolarHBondContact O-CB 3.46Å; I960-A964 PolarHBondContact O-N 2.86Å
961	A	93	Very high	92	Very high	1 Å²	1	8 Å²	8	1%	0.008	4%	0.042	C	C	.	.	H	α-helix	trans	-63.7	-36.5	-177	0	0	0	0	0	112.8	Q659 F717 L945 P959 A965	Q659-A961 HydrophobicContact CB-CB 3.77Å; Q659-A961 HydrophobicContact CG-CB 4.13Å; F717-A961 HydrophobicContact CD1-CB 4.49Å; F717-A961 HydrophobicContact CE1-CB 4.26Å; F717-A961 WeakPolarHBondContact CE1-O 3.18Å; L945-A961 HydrophobicContact CD1-CB 4.03Å; L945-A961 HydrophobicContact CG-CB 4.47Å; P959-A961 PolarHBondContact O-N 3.42Å; A961-A965 WeakPolarHBondContact O-CB 3.36Å; A961-A965 PolarHBondContact O-N 3.23Å
962	Y	93.6	Very high	92.2	Very high	35 Å²	35	8.2 Å²	8.2	14%	0.137	5%	0.045	C	C	.	.	H	α-helix	trans	-63.2	-47.6	175.8	178.8	-92.8	0	0	0	111.1	A663 E666 P959 I960 A965 K966	A663-Y962 HydrophobicContact CB-CD2 3.67Å; A663-Y962 HydrophobicContact CB-CE2 3.65Å; A663-Y962 HydrophobicContact CB-CG 4.32Å; E666-Y962 PolarHBondContact OE1-OH 3.4Å; E666-Y962 PolarHBondContact OE2-OH 2.92Å; P959-Y962 WeakPolarHBondContact O-CB 3.48Å; P959-Y962 PolarHBondContact O-N 3.46Å; I960-Y962 VanDerWaalsContact C-N 3.32Å; I960-Y962 PolarHBondContact O-N 2.76Å; Y962-A965 PolarHBondContact O-N 3.14Å; Y962-K966 HydrophobicContact CE1-CG 4.3Å; Y962-K966 VanDerWaalsContact CZ-CE 3.49Å; Y962-K966 PolarHBondContact O-N 3.47Å; Y962-K966 WeakPolarHBondContact OH-CE 3.16Å; Y962-K966 PolarHBondContact OH-NZ 3.28Å
963	I	94.9	Very high	92.3	Very high	6 Å²	6	8.2 Å²	8.2	3%	0.031	5%	0.045	C	C	.	.	H	α-helix	trans	-63.9	-48.1	177.3	-64.2	-64.3	0	0	0	110.4	I863 Y958 P959 I960 A965 K966 L967 L973 L976 A987	I863-I963 HydrophobicContact CD1-CG2 4.39Å; I863-I963 HydrophobicContact CG2-CG2 4.35Å; Y958-I963 HydrophobicContact CE1-CB 4.26Å; Y958-I963 HydrophobicContact CE1-CG1 3.84Å; Y958-I963 HydrophobicContact CE1-CG2 4.41Å; P959-I963 HydrophobicContact CG-CG1 4.3Å; P959-I963 WeakPolarHBondContact O-CG1 3.31Å; P959-I963 PolarHBondContact O-N 2.92Å; I960-I963 PolarHBondContact O-N 2.9Å; I963-A965 PolarHBondContact O-N 3.29Å; I963-K966 WeakPolarHBondContact O-CB 3.23Å; I963-K966 PolarHBondContact O-N 2.77Å; I963-L967 HydrophobicContact CG2-CD1 4.09Å; I963-L967 HydrophobicContact CG2-CG 4.17Å; I963-L967 WeakPolarHBondContact O-CG 3.38Å; I963-L967 PolarHBondContact O-N 2.9Å; I963-L973 HydrophobicContact CG2-CD1 3.7Å; I963-L976 HydrophobicContact CD1-CB 4.32Å; I963-L976 HydrophobicContact CD1-CD1 3.91Å; I963-L976 HydrophobicContact CG2-CD1 3.94Å; I963-A987 HydrophobicContact CD1-CB 4.03Å
964	A	95.2	Very high	92.4	Very high	1 Å²	1	8.5 Å²	8.5	1%	0.008	5%	0.046	C	C	.	.	H	α-helix	trans	-57.1	-37	178.9	0	0	0	0	0	112.7	F717 E922 L945 I960 L967 S968	F717-A964 HydrophobicContact CE1-CB 4.41Å; F717-A964 HydrophobicContact CZ-CB 4.2Å; E922-A964 HydrophobicContact CB-CB 4.33Å; L945-A964 HydrophobicContact CD2-CB 4.35Å; I960-A964 WeakPolarHBondContact O-CB 3.46Å; I960-A964 PolarHBondContact O-N 2.86Å; A964-L967 PolarHBondContact O-N 3.23Å; A964-S968 WeakPolarHBondContact O-CB 3.41Å; A964-S968 PolarHBondContact O-N 2.91Å; A964-S968 PolarHBondContact O-OG 3.06Å
965	A	94.9	Very high	92.5	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-67	-41.2	175.5	0	0	0	0	0	112.4	A660 A663 F717 A961 Y962 I963 S968 L969	A660-A965 HydrophobicContact CB-CB 3.9Å; A663-A965 HydrophobicContact CB-CB 3.78Å; F717-A965 HydrophobicContact CE1-CB 4.21Å; F717-A965 HydrophobicContact CZ-CB 3.85Å; A961-A965 WeakPolarHBondContact O-CB 3.36Å; A961-A965 PolarHBondContact O-N 3.23Å; Y962-A965 PolarHBondContact O-N 3.14Å; I963-A965 PolarHBondContact O-N 3.29Å; A965-S968 WeakPolarHBondContact O-CB 3.33Å; A965-S968 PolarHBondContact O-N 3.33Å; A965-L969 PolarHBondContact O-N 3.08Å
966	K	95.1	Very high	92.6	Very high	3 Å²	3	15.6 Å²	15.6	1%	0.013	8%	0.08	C	C	.	.	H	α-helix	trans	-64.4	-41.9	173.6	-65.3	-75.1	-166.1	169.5	0	111.6	A663 E666 E667 Y962 I963 S968 L969 K971 L976	A663-K966 HydrophobicContact CB-CD 4.22Å; A663-K966 HydrophobicContact CB-CG 4.13Å; A663-K966 PolarHBondContact O-NZ 2.99Å; E666-K966 IonicContact OE1-NZ 3.93Å; E666-K966 PolarHBondContact OE1-NZ 3.36Å; E667-K966 HydrophobicContact CG-CD 3.63Å; E667-K966 WeakPolarHBondContact OE1-CD 3.34Å; E667-K966 IonicContact OE1-NZ 3.93Å; E667-K966 PolarHBondContact OE1-NZ 2.86Å; Y962-K966 HydrophobicContact CE1-CG 4.3Å; Y962-K966 VanDerWaalsContact CZ-CE 3.49Å; Y962-K966 PolarHBondContact O-N 3.47Å; Y962-K966 WeakPolarHBondContact OH-CE 3.16Å; Y962-K966 PolarHBondContact OH-NZ 3.28Å; I963-K966 WeakPolarHBondContact O-CB 3.23Å; I963-K966 PolarHBondContact O-N 2.77Å; K966-S968 VanDerWaalsContact C-N 3.29Å; K966-S968 PolarHBondContact O-N 2.69Å; K966-L969 WeakPolarHBondContact O-CB 3.45Å; K966-L969 PolarHBondContact O-N 3.32Å; K966-L969 VanDerWaalsContact O-N 3.08Å; K966-K971 HydrophobicContact CB-CG 4.39Å; K966-K971 WeakPolarHBondContact O-CB 3.3Å; K966-K971 WeakPolarHBondContact O-CG 3.13Å; K966-K971 PolarHBondContact O-N 3.38Å; K966-L976 HydrophobicContact CB-CD1 4.09Å; K966-L976 HydrophobicContact CB-CD2 4.17Å; K966-L976 HydrophobicContact CG-CD2 4.44Å
967	L	95.3	Very high	92.5	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-63.2	-36.4	176.6	-63.5	-174.7	0	0	0	111.8	I863 D865 I963 A964 L969 G970 K971 L973 L976	I863-L967 HydrophobicContact CG2-CD1 3.43Å; I863-L967 VanDerWaalsContact CG2-CD1 3.43Å; D865-L967 HydrophobicContact CB-CD1 4.25Å; D865-L967 HydrophobicContact CB-CD2 3.72Å; D865-L967 HydrophobicContact CB-CG 4.47Å; I963-L967 HydrophobicContact CG2-CD1 4.09Å; I963-L967 HydrophobicContact CG2-CG 4.17Å; I963-L967 WeakPolarHBondContact O-CG 3.38Å; I963-L967 PolarHBondContact O-N 2.9Å; A964-L967 PolarHBondContact O-N 3.23Å; L967-L969 PolarHBondContact O-N 3.31Å; L967-L969 VanDerWaalsContact O-N 3.14Å; L967-G970 PolarHBondContact O-N 3.25Å; L967-K971 VanDerWaalsContact CD2-O 3.25Å; L967-K971 WeakPolarHBondContact CD2-O 3.37Å; L967-L973 HydrophobicContact CD1-CD1 4.29Å; L967-L973 HydrophobicContact CD2-CB 4.32Å; L967-L973 HydrophobicContact CD2-CD1 4.4Å; L967-L976 HydrophobicContact CD2-CD1 3.83Å; L967-L976 HydrophobicContact CG-CD1 4.41Å
968	S	93.3	Very high	92.5	Very high	5 Å²	5	19.7 Å²	19.7	4%	0.035	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-15.5	174.8	-59.1	0	0	0	0	113.7	G761 A964 A965 K966	G761-S968 WeakPolarHBondContact CA-OG 3.21Å; A964-S968 WeakPolarHBondContact O-CB 3.41Å; A964-S968 PolarHBondContact O-N 2.91Å; A964-S968 PolarHBondContact O-OG 3.06Å; A965-S968 WeakPolarHBondContact O-CB 3.33Å; A965-S968 PolarHBondContact O-N 3.33Å; K966-S968 VanDerWaalsContact C-N 3.29Å; K966-S968 PolarHBondContact O-N 2.69Å
969	L	91.9	Very high	91.9	Very high	15 Å²	15	21.8 Å²	21.8	8%	0.079	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.7	8.7	172.2	-62.9	179.9	0	0	0	113.6	P634 L664 E667 V669 L760 A965 K966 L967	P634-L969 HydrophobicContact CG-CD2 3.62Å; L664-L969 HydrophobicContact CD2-CD1 3.78Å; L664-L969 HydrophobicContact CD2-CD2 3.87Å; L664-L969 HydrophobicContact CD2-CG 4.05Å; E667-L969 HydrophobicContact CB-CD1 3.86Å; E667-L969 HydrophobicContact CG-CD1 3.78Å; V669-L969 HydrophobicContact CG2-CD1 4.18Å; L760-L969 HydrophobicContact CD1-CD2 4.23Å; A965-L969 PolarHBondContact O-N 3.08Å; K966-L969 WeakPolarHBondContact O-CB 3.45Å; K966-L969 PolarHBondContact O-N 3.32Å; K966-L969 VanDerWaalsContact O-N 3.08Å; L967-L969 PolarHBondContact O-N 3.31Å; L967-L969 VanDerWaalsContact O-N 3.14Å
970	G	89.7	Confident	91.5	Very high	9 Å²	9	21.7 Å²	21.7	9%	0.093	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	84.7	16.8	178.6	0	0	0	0	0	114.9	Y867 L967	Y867-G970 PolarHBondContact OH-O 3.44Å; L967-G970 PolarHBondContact O-N 3.25Å
971	K	91.9	Very high	91	Very high	63 Å²	63	21.7 Å²	21.7	27%	0.274	12%	0.118	S	C	.	.			trans	-74.9	150.8	173.2	-63	-74.9	-177.6	153.7	0	111.2	E667 K966 L967 L976	E667-K971 VanDerWaalsContact CD-CE 3.46Å; E667-K971 IonicContact OE1-NZ 3.27Å; E667-K971 PolarHBondContact OE1-NZ 3.39Å; E667-K971 WeakPolarHBondContact OE2-CE 3.46Å; E667-K971 IonicContact OE2-NZ 3.12Å; E667-K971 PolarHBondContact OE2-NZ 3.46Å; K966-K971 HydrophobicContact CB-CG 4.39Å; K966-K971 WeakPolarHBondContact O-CB 3.3Å; K966-K971 WeakPolarHBondContact O-CG 3.13Å; K966-K971 PolarHBondContact O-N 3.38Å; L967-K971 VanDerWaalsContact CD2-O 3.25Å; L967-K971 WeakPolarHBondContact CD2-O 3.37Å; K971-L976 HydrophobicContact CB-CD2 4.28Å
972	S	92.8	Very high	90.4	Very high	12 Å²	12	24.2 Å²	24.2	8%	0.084	14%	0.143	C	C	.	.			trans	-92.3	137.5	175	-166.9	0	0	0	0	110.8	D865 N869 P974 E975 L976	D865-S972 WeakPolarHBondContact OD2-CA 3.36Å; D865-S972 PolarHBondContact OD2-OG 2.98Å; N869-S972 PolarHBondContact ND2-OG 2.89Å; S972-P974 WeakPolarHBondContact OG-CD 3.35Å; S972-E975 WeakPolarHBondContact O-CB 3.46Å; S972-E975 PolarHBondContact O-N 3.32Å; S972-L976 PolarHBondContact O-N 3.09Å
973	L	94	Very high	89.8	Confident	0 Å²	0	24.1 Å²	24.1	0%	0	15%	0.153	C	C	.	.	G	3₁₀ helix	trans	-59.8	-40.5	-176.9	-170.1	63.7	0	0	0	113.2	I863 D865 N869 I871 I963 L967 E975 L976 A987 C988	I863-L973 HydrophobicContact CG2-CD1 4.21Å; I863-L973 HydrophobicContact CG2-CD2 4.31Å; D865-L973 HydrophobicContact CB-CB 4.26Å; D865-L973 PolarHBondContact OD2-N 3.35Å; N869-L973 HydrophobicContact CB-CB 4.44Å; I871-L973 HydrophobicContact CD1-CD2 3.71Å; I871-L973 HydrophobicContact CG1-CD2 3.72Å; I871-L973 HydrophobicContact CG2-CD2 4.29Å; I963-L973 HydrophobicContact CG2-CD1 3.7Å; L967-L973 HydrophobicContact CD1-CD1 4.29Å; L967-L973 HydrophobicContact CD2-CB 4.32Å; L967-L973 HydrophobicContact CD2-CD1 4.4Å; L973-E975 PolarHBondContact O-N 3.47Å; L973-L976 HydrophobicContact CD1-CD1 4.41Å; L973-L976 PolarHBondContact O-N 2.98Å; L973-A987 HydrophobicContact CD1-CB 4.44Å; L973-C988 HydrophobicContact CB-CB 4.3Å; L973-C988 HydrophobicContact CD2-CB 4.11Å; L973-C988 HydrophobicContact CG-CB 3.78Å
974	P	93.3	Very high	89.4	Confident	9 Å²	9	28.5 Å²	28.5	6%	0.058	18%	0.176	C	C	.	.	G	3₁₀ helix	trans	-66.5	-17.8	174.3	-22.6	35.4	0	0	0	114.9	C531 K558 N869 S972 T986 C988	C531-P974 HydrophobicContact CB-CB 4.3Å; C531-P974 HydrophobicContact CB-CG 3.46Å; C531-P974 VanDerWaalsContact CB-CG 3.46Å; K558-P974 WeakPolarHBondContact CE-O 3.33Å; K558-P974 PolarHBondContact NZ-O 3.31Å; N869-P974 WeakPolarHBondContact ND2-CD 3.25Å; S972-P974 WeakPolarHBondContact OG-CD 3.35Å; P974-T986 WeakPolarHBondContact CA-OG1 3.19Å; P974-T986 PolarHBondContact O-OG1 3.36Å; P974-C988 HydrophobicContact CB-CB 4.3Å; P974-C988 HydrophobicContact CG-CB 4.03Å
975	E	90.5	Very high	89.1	Confident	129 Å²	129	28.7 Å²	28.7	60%	0.603	18%	0.177	S	C	*	.	G	3₁₀ helix	trans	-82.4	-22.9	175.7	-64.9	176.9	166.9	0	0	112.1	S972 L973	S972-E975 WeakPolarHBondContact O-CB 3.46Å; S972-E975 PolarHBondContact O-N 3.32Å; L973-E975 PolarHBondContact O-N 3.47Å
976	L	92.9	Very high	89	Confident	21 Å²	21	29 Å²	29	11%	0.11	18%	0.179	C	C	.	.	S	Bend	trans	-76.5	141.9	176.3	-59	178.1	0	0	0	110.1	I963 K966 L967 K971 S972 L973 T986 A987	I963-L976 HydrophobicContact CD1-CB 4.32Å; I963-L976 HydrophobicContact CD1-CD1 3.91Å; I963-L976 HydrophobicContact CG2-CD1 3.94Å; K966-L976 HydrophobicContact CB-CD1 4.09Å; K966-L976 HydrophobicContact CB-CD2 4.17Å; K966-L976 HydrophobicContact CG-CD2 4.44Å; L967-L976 HydrophobicContact CD2-CD1 3.83Å; L967-L976 HydrophobicContact CG-CD1 4.41Å; K971-L976 HydrophobicContact CB-CD2 4.28Å; S972-L976 PolarHBondContact O-N 3.09Å; L973-L976 HydrophobicContact CD1-CD1 4.41Å; L973-L976 PolarHBondContact O-N 2.98Å; L976-T986 CarbonylContact O-C 3.57Å; L976-T986 WeakPolarHBondContact O-CA 3.17Å; L976-T986 PolarHBondContact O-OG1 2.88Å; L976-T986 VanDerWaalsContact O-OG1 3.12Å; L976-A987 HydrophobicContact CB-CB 3.86Å; L976-A987 PolarHBondContact O-N 3.02Å
977	T	89.6	Confident	88.8	Confident	92 Å²	92	29 Å²	29	56%	0.564	18%	0.18	S	C	*	.	B	Isolated β-bridge	trans	-97	147.9	179.9	53.6	0	0	0	0	110.6	S979	T977-S979 PolarHBondContact O-N 3.27Å
978	N	86.4	Confident	88.8	Confident	3 Å²	3	29 Å²	29	2%	0.016	18%	0.18	C	C	.	.	P	Polyproline II helix	trans	-78	118.2	173.4	-178.7	2.4	0	0	0	109.7	V980 T981 G983 T985 F989 T1190	N978-V980 VanDerWaalsContact C-N 3.31Å; N978-V980 PolarHBondContact O-N 2.9Å; N978-V980 WeakPolarHBondContact OD1-CB 3.46Å; N978-V980 PolarHBondContact OD1-N 2.92Å; N978-T981 PolarHBondContact O-OG1 3.29Å; N978-G983 WeakPolarHBondContact O-CA 3.31Å; N978-G983 PolarHBondContact O-N 3.15Å; N978-T985 VanDerWaalsContact CB-OG1 3.25Å; N978-T985 WeakPolarHBondContact CB-OG1 3.4Å; N978-T985 PolarHBondContact N-O 3.47Å; N978-T985 PolarHBondContact ND2-OG1 2.87Å; N978-F989 HydrophobicContact CB-CE1 4.04Å; N978-F989 VanDerWaalsContact ND2-CE1 3.32Å; N978-F989 WeakPolarHBondContact ND2-CE1 3.44Å; N978-F989 WeakPolarHBondContact ND2-CZ 3.37Å; N978-T1190 PolarHBondContact ND2-OG1 2.97Å
979	S	79	Confident	88.7	Confident	46 Å²	46	29.1 Å²	29.1	32%	0.322	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-31.2	177.8	51	0	0	0	0	112.8	T977 T981 G982	T977-S979 PolarHBondContact O-N 3.27Å; S979-T981 VanDerWaalsContact C-N 3.32Å; S979-T981 PolarHBondContact O-N 3.15Å; S979-G982 PolarHBondContact O-N 3.1Å
980	V	80.1	Confident	88.7	Confident	6 Å²	6	28.5 Å²	28.5	4%	0.036	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-32.9	-178.8	175	0	0	0	0	111.7	G957 N978 G982 T1190 A1197 T1198 T1199	G957-V980 WeakPolarHBondContact O-CG2 3.44Å; N978-V980 VanDerWaalsContact C-N 3.31Å; N978-V980 PolarHBondContact O-N 2.9Å; N978-V980 WeakPolarHBondContact OD1-CB 3.46Å; N978-V980 PolarHBondContact OD1-N 2.92Å; V980-G982 VanDerWaalsContact C-N 3.33Å; V980-T1190 HydrophobicContact CB-CG2 3.95Å; V980-T1190 HydrophobicContact CG1-CG2 3.98Å; V980-T1190 HydrophobicContact CG2-CG2 3.7Å; V980-A1197 HydrophobicContact CG1-CB 4.16Å; V980-A1197 CarbonylContact O-C 3.51Å; V980-A1197 WeakPolarHBondContact O-CA 3.08Å; V980-T1198 PolarHBondContact O-N 3.48Å; V980-T1198 PolarHBondContact O-OG1 3.25Å; V980-T1199 HydrophobicContact CG1-CG2 4.29Å
981	T	83.5	Confident	88.8	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.5	14.6	177.7	61.4	0	0	0	0	113	N978 S979 G983 L984 T985 V1191 W1195 P1196	N978-T981 PolarHBondContact O-OG1 3.29Å; S979-T981 VanDerWaalsContact C-N 3.32Å; S979-T981 PolarHBondContact O-N 3.15Å; T981-G983 PolarHBondContact O-N 2.85Å; T981-L984 WeakPolarHBondContact O-CB 3.5Å; T981-L984 WeakPolarHBondContact O-CD1 3.49Å; T981-L984 WeakPolarHBondContact O-CG 3.18Å; T981-L984 PolarHBondContact O-N 3.46Å; T981-T985 HydrophobicContact CG2-CG2 4.2Å; T981-T985 PolarHBondContact OG1-N 3.38Å; T981-T985 PolarHBondContact OG1-OG1 3.05Å; T981-V1191 HydrophobicContact CG2-CG2 4.47Å; T981-W1195 HydrophobicContact CG2-CB 4.09Å; T981-P1196 WeakPolarHBondContact CA-O 3.45Å
982	G	80.1	Confident	88.8	Confident	53 Å²	53	25.7 Å²	25.7	55%	0.546	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.1	26.4	-178.6	0	0	0	0	0	113.3	S979 V980 T1198	S979-G982 PolarHBondContact O-N 3.1Å; V980-G982 VanDerWaalsContact C-N 3.33Å; G982-T1198 WeakPolarHBondContact CA-OG1 3.31Å; G982-T1198 PolarHBondContact N-OG1 2.99Å; G982-T1198 VanDerWaalsContact N-OG1 3.12Å
983	G	82.3	Confident	88.8	Confident	33 Å²	33	25.3 Å²	25.3	34%	0.34	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.9	10.6	-177.5	0	0	0	0	0	115.5	N978 T981 T985	N978-G983 WeakPolarHBondContact O-CA 3.31Å; N978-G983 PolarHBondContact O-N 3.15Å; T981-G983 PolarHBondContact O-N 2.85Å; G983-T985 VanDerWaalsContact C-N 3.31Å
984	L	84.8	Confident	88.7	Confident	98 Å²	98	25.4 Å²	25.4	51%	0.513	16%	0.161	S	C	.	.	S	Bend	trans	-68.7	-29.8	175.3	-67.7	172.7	0	0	0	112.7	T981 P1196	T981-L984 WeakPolarHBondContact O-CB 3.5Å; T981-L984 WeakPolarHBondContact O-CD1 3.49Å; T981-L984 WeakPolarHBondContact O-CG 3.18Å; T981-L984 PolarHBondContact O-N 3.46Å; L984-P1196 HydrophobicContact CD1-CB 4.25Å; L984-P1196 HydrophobicContact CD1-CG 3.92Å
985	T	89.5	Confident	88.8	Confident	5 Å²	5	25 Å²	25	3%	0.031	16%	0.158	C	C	.	.	S	Bend	trans	-118.3	161	-179.7	67.6	0	0	0	0	111.4	N559 N978 T981 G983 W1195	N559-T985 HydrophobicContact CB-CG2 4.22Å; N559-T985 WeakPolarHBondContact OD1-CA 3.48Å; N559-T985 VanDerWaalsContact OD1-CB 3.28Å; N559-T985 WeakPolarHBondContact OD1-CB 3.24Å; N978-T985 VanDerWaalsContact CB-OG1 3.25Å; N978-T985 WeakPolarHBondContact CB-OG1 3.4Å; N978-T985 PolarHBondContact N-O 3.47Å; N978-T985 PolarHBondContact ND2-OG1 2.87Å; T981-T985 HydrophobicContact CG2-CG2 4.2Å; T981-T985 PolarHBondContact OG1-N 3.38Å; T981-T985 PolarHBondContact OG1-OG1 3.05Å; G983-T985 VanDerWaalsContact C-N 3.31Å; T985-W1195 HydrophobicContact CG2-CB 4.33Å; T985-W1195 HydrophobicContact CG2-CD2 3.74Å; T985-W1195 HydrophobicContact CG2-CE3 4.18Å; T985-W1195 HydrophobicContact CG2-CG 3.78Å
986	T	93.1	Very high	89	Confident	8 Å²	8	18.9 Å²	18.9	5%	0.049	13%	0.129	C	C	.	.	B	Isolated β-bridge	trans	-71.8	157	170.6	-176.1	0	0	0	0	111.4	P522 K558 N559 P974 L976 C988 F989	P522-T986 HydrophobicContact CB-CG2 4.12Å; P522-T986 HydrophobicContact CG-CG2 3.81Å; K558-T986 HydrophobicContact CB-CG2 4.03Å; K558-T986 HydrophobicContact CG-CG2 3.64Å; N559-T986 PolarHBondContact OD1-N 3.22Å; P974-T986 WeakPolarHBondContact CA-OG1 3.19Å; P974-T986 PolarHBondContact O-OG1 3.36Å; L976-T986 CarbonylContact O-C 3.57Å; L976-T986 WeakPolarHBondContact O-CA 3.17Å; L976-T986 PolarHBondContact O-OG1 2.88Å; L976-T986 VanDerWaalsContact O-OG1 3.12Å; T986-C988 HydrophobicContact CG2-CB 3.98Å; T986-C988 PolarHBondContact OG1-N 2.87Å; T986-C988 VanDerWaalsContact OG1-N 3.14Å; T986-F989 WeakPolarHBondContact O-CD1 3.34Å
987	A	91.7	Very high	89.3	Confident	2 Å²	2	18 Å²	18	2%	0.017	13%	0.125	C	C	.	.	S	Bend	trans	-76.1	-10.2	166.6	0	0	0	0	0	112.6	Y958 I963 L973 L976 F989	Y958-A987 HydrophobicContact CE2-CB 4.49Å; Y958-A987 VanDerWaalsContact CE2-O 3.26Å; Y958-A987 WeakPolarHBondContact CE2-O 3.5Å; Y958-A987 PolarHBondContact OH-O 3.39Å; I963-A987 HydrophobicContact CD1-CB 4.03Å; L973-A987 HydrophobicContact CD1-CB 4.44Å; L976-A987 HydrophobicContact CB-CB 3.86Å; L976-A987 PolarHBondContact O-N 3.02Å; A987-F989 VanDerWaalsContact C-N 3.28Å; A987-F989 PolarHBondContact O-N 3.28Å
988	C	94.1	Very high	89.7	Confident	1 Å²	1	13.7 Å²	13.7	1%	0.007	10%	0.098	C	C	.	.			trans	-80.6	67.4	175.9	-168.1	0	0	0	0	111.8	P522 L973 P974 T986	P522-C988 WeakPolarHBondContact CB-O 3.47Å; L973-C988 HydrophobicContact CB-CB 4.3Å; L973-C988 HydrophobicContact CD2-CB 4.11Å; L973-C988 HydrophobicContact CG-CB 3.78Å; P974-C988 HydrophobicContact CB-CB 4.3Å; P974-C988 HydrophobicContact CG-CB 4.03Å; T986-C988 HydrophobicContact CG2-CB 3.98Å; T986-C988 PolarHBondContact OG1-N 2.87Å; T986-C988 VanDerWaalsContact OG1-N 3.14Å
989	F	91.2	Very high	90.1	Very high	6 Å²	6	13.9 Å²	13.9	3%	0.026	10%	0.099	C	C	.	.	S	Bend	trans	-149.4	161.1	178.5	76.4	-74.4	0	0	0	110.9	I871 Y958 N978 T986 A987 P991 T1190 V1191	I871-F989 WeakPolarHBondContact CD1-O 3.44Å; Y958-F989 AromaticContact CD2-CE1 3.8Å; Y958-F989 HydrophobicContact CD2-CE1 3.8Å; Y958-F989 AromaticContact CD2-CZ 3.89Å; Y958-F989 HydrophobicContact CD2-CZ 3.89Å; Y958-F989 HydrophobicContact CE2-CD1 4.15Å; Y958-F989 AromaticContact CE2-CE1 3.65Å; Y958-F989 HydrophobicContact CE2-CE1 3.65Å; Y958-F989 HydrophobicContact CE2-CZ 4.2Å; N978-F989 HydrophobicContact CB-CE1 4.04Å; N978-F989 VanDerWaalsContact ND2-CE1 3.32Å; N978-F989 WeakPolarHBondContact ND2-CE1 3.44Å; N978-F989 WeakPolarHBondContact ND2-CZ 3.37Å; T986-F989 WeakPolarHBondContact O-CD1 3.34Å; A987-F989 VanDerWaalsContact C-N 3.28Å; A987-F989 PolarHBondContact O-N 3.28Å; F989-P991 HydrophobicContact CE2-CB 4.37Å; F989-P991 HydrophobicContact CE2-CG 4.1Å; F989-P991 HydrophobicContact CZ-CG 4.43Å; F989-T1190 HydrophobicContact CZ-CG2 4.29Å; F989-V1191 HydrophobicContact CD2-CG1 4.18Å; F989-V1191 HydrophobicContact CE2-CG1 3.77Å; F989-V1191 HydrophobicContact CZ-CG1 4.49Å
990	E	92.5	Very high	90.9	Very high	3 Å²	3	12 Å²	12	1%	0.014	9%	0.085	C	C	.	.			trans	-98.8	120.3	174.9	-56.6	-168.2	156.7	0	0	109.4	N520 I533 I871 T872 R907	N520-E990 HydrophobicContact CB-CB 4.1Å; N520-E990 VanDerWaalsContact CB-O 3.29Å; N520-E990 WeakPolarHBondContact CB-O 3.42Å; N520-E990 PolarHBondContact ND2-O 3.24Å; I533-E990 HydrophobicContact CG1-CG 4.18Å; I533-E990 HydrophobicContact CG2-CG 4.24Å; I871-E990 HydrophobicContact CB-CG 4.12Å; T872-E990 PolarHBondContact N-OE1 2.75Å; T872-E990 VanDerWaalsContact O-CB 3.3Å; T872-E990 WeakPolarHBondContact O-CB 3.45Å; T872-E990 WeakPolarHBondContact O-CG 3.31Å; T872-E990 PolarHBondContact OG1-OE1 3.32Å; T872-E990 PolarHBondContact OG1-OE2 2.91Å; R907-E990 IonicContact CZ-OE1 3.52Å; R907-E990 IonicContact CZ-OE2 3.97Å; R907-E990 IonicContact NE-OE1 3.21Å; R907-E990 PolarHBondContact NE-OE1 2.89Å; R907-E990 IonicContact NE-OE2 2.87Å; R907-E990 PolarHBondContact NE-OE2 3.32Å; R907-E990 IonicContact NH2-OE1 2.77Å; R907-E990 PolarHBondContact NH2-OE1 2.99Å; R907-E990 IonicContact NH2-OE2 3.26Å; R907-E990 PolarHBondContact NH2-OE2 2.53Å
991	P	92.1	Very high	91.6	Very high	7 Å²	7	11.7 Å²	11.7	5%	0.045	8%	0.084	C	C	.	.			trans	-55.4	138.7	-179.9	-28	36.3	0	0	0	114	V873 T956 Y958 F989 L993 T1190	V873-P991 WeakPolarHBondContact O-CD 3.25Å; V873-P991 VanDerWaalsContact O-CG 3.28Å; V873-P991 WeakPolarHBondContact O-CG 3.39Å; T956-P991 HydrophobicContact CG2-CB 4.12Å; T956-P991 HydrophobicContact CG2-CG 4.29Å; Y958-P991 HydrophobicContact CD2-CG 4.1Å; Y958-P991 HydrophobicContact CG-CG 4.48Å; F989-P991 HydrophobicContact CE2-CB 4.37Å; F989-P991 HydrophobicContact CE2-CG 4.1Å; F989-P991 HydrophobicContact CZ-CG 4.43Å; P991-L993 HydrophobicContact CB-CD2 4.46Å; P991-T1190 CarbonylContact C-O 3.58Å; P991-T1190 VanDerWaalsContact CA-O 3.24Å; P991-T1190 WeakPolarHBondContact CA-O 3.42Å
992	S	90.8	Very high	92	Very high	6 Å²	6	13.2 Å²	13.2	4%	0.042	9%	0.089	C	C	.	.	B	Isolated β-bridge	trans	-111.4	119	171.7	-76.9	0	0	0	0	108.6	T273 N520 T1190 A1192	T273-S992 WeakPolarHBondContact O-CB 3.4Å; T273-S992 PolarHBondContact O-OG 3.43Å; N520-S992 PolarHBondContact ND2-OG 3Å; S992-T1190 PolarHBondContact N-O 3.16Å; S992-T1190 CarbonylContact O-C 3.58Å; S992-A1192 PolarHBondContact O-N 3.06Å
993	L	92.7	Very high	92.5	Very high	4 Å²	4	12.9 Å²	12.9	2%	0.021	7%	0.072	C	C	.	.			trans	-94.8	137.8	-177.9	-48.6	-177.5	0	0	0	109.6	M275 Y296 T956 P991 Y995	M275-L993 HydrophobicContact SD-CB 3.82Å; M275-L993 HydrophobicContact SD-CD1 4.42Å; M275-L993 HydrophobicContact SD-CG 3.85Å; M275-L993 PolarHBondContact SD-N 3.1Å; M275-L993 VanDerWaalsContact SD-N 3.38Å; Y296-L993 WeakPolarHBondContact CD2-O 3.41Å; T956-L993 HydrophobicContact CG2-CD2 4.16Å; P991-L993 HydrophobicContact CB-CD2 4.46Å; L993-Y995 HydrophobicContact CB-CE2 4.34Å; L993-Y995 HydrophobicContact CD1-CE2 4.46Å; L993-Y995 HydrophobicContact CD2-CE2 4.1Å; L993-Y995 WeakPolarHBondContact CD2-OH 2.99Å
994	D	93	Very high	92.6	Very high	2 Å²	2	11.7 Å²	11.7	1%	0.011	6%	0.057	C	C	.	.	S	Bend	trans	-109.8	27.3	167.6	63.2	-6.8	0	0	0	110.8	P297 R365 R1030 A1192	P297-D994 WeakPolarHBondContact CG-O 3.48Å; R365-D994 WeakPolarHBondContact CD-OD2 3.17Å; R365-D994 IonicContact CZ-OD2 3.29Å; R365-D994 IonicContact NE-OD2 3.55Å; R365-D994 IonicContact NH1-OD2 3.45Å; R365-D994 PolarHBondContact NH1-OD2 3.42Å; D994-R1030 VanDerWaalsContact O-CD 3.32Å; D994-R1030 WeakPolarHBondContact O-CD 3.16Å; D994-R1030 PolarHBondContact O-NH1 3.35Å; D994-A1192 HydrophobicContact CB-CB 3.87Å
995	Y	95.3	Very high	92.6	Very high	0 Å²	0	7.1 Å²	7.1	0%	0	3%	0.034	C	C	.	.	S	Bend	trans	-149.9	164.9	178	47.5	-94.1	0	0	0	109.4	A955 L993 V997 I1028 A1029 V1188 Y1203	A955-Y995 WeakPolarHBondContact O-CE2 3.17Å; A955-Y995 PolarHBondContact O-OH 2.9Å; L993-Y995 HydrophobicContact CB-CE2 4.34Å; L993-Y995 HydrophobicContact CD1-CE2 4.46Å; L993-Y995 HydrophobicContact CD2-CE2 4.1Å; L993-Y995 WeakPolarHBondContact CD2-OH 2.99Å; Y995-V997 HydrophobicContact CD2-CG2 3.68Å; Y995-V997 HydrophobicContact CE2-CG2 3.73Å; Y995-I1028 HydrophobicContact CD2-CG2 3.57Å; Y995-I1028 HydrophobicContact CE2-CG2 4.24Å; Y995-I1028 HydrophobicContact CG-CG2 3.89Å; Y995-A1029 WeakPolarHBondContact CB-O 3.25Å; Y995-V1188 HydrophobicContact CE1-CG1 4.36Å; Y995-V1188 HydrophobicContact CE2-CG1 4.45Å; Y995-V1188 WeakPolarHBondContact OH-CG1 3.37Å; Y995-Y1203 HydrophobicContact CD1-CE1 4.29Å; Y995-Y1203 HydrophobicContact CG-CE1 4.46Å
996	C	95.3	Very high	91.9	Very high	0 Å²	0	10.6 Å²	10.6	0%	0	6%	0.063	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	132.8	175.4	-178.6	0	0	0	0	109.2	V892 A1029	V892-C996 VanDerWaalsContact CG1-SG 3.56Å; C996-A1029 PolarHBondContact N-O 3.17Å; C996-A1029 PolarHBondContact O-N 3.22Å; C996-A1029 VanDerWaalsContact O-O 3.06Å
997	V	97.1	Very high	91.1	Very high	4 Å²	4	12.1 Å²	12.1	2%	0.024	7%	0.068	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	129.6	177	-174.9	0	0	0	0	108.7	V892 S893 A955 Y995 M1026 A1027 I1028	V892-V997 VanDerWaalsContact CA-O 3.31Å; V892-V997 WeakPolarHBondContact CA-O 3.18Å; S893-V997 PolarHBondContact N-O 3.35Å; S893-V997 PolarHBondContact O-N 3.24Å; A955-V997 HydrophobicContact CB-CB 4.28Å; A955-V997 HydrophobicContact CB-CG1 3.98Å; A955-V997 HydrophobicContact CB-CG2 4.05Å; Y995-V997 HydrophobicContact CD2-CG2 3.68Å; Y995-V997 HydrophobicContact CE2-CG2 3.73Å; V997-M1026 HydrophobicContact CG1-CG 3.33Å; V997-M1026 HydrophobicContact CG1-SD 3.69Å; V997-A1027 WeakPolarHBondContact CA-O 3.26Å; V997-I1028 HydrophobicContact CG1-CG1 4.45Å; V997-I1028 HydrophobicContact CG2-CG1 4.2Å; V997-I1028 HydrophobicContact CG2-CG2 4.41Å
998	V	98.1	Very high	90.4	Very high	0 Å²	0	12.6 Å²	12.6	0%	0	7%	0.07	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	125.7	175.6	178.2	0	0	0	0	109.6	I890 V891 V892 V1000 A1027 F1032 A1035 L1036	I890-V998 HydrophobicContact CG2-CG1 3.88Å; V891-V998 WeakPolarHBondContact O-CA 3.22Å; V892-V998 HydrophobicContact CG1-CG2 4.37Å; V892-V998 HydrophobicContact CG2-CG2 4.25Å; V998-V1000 HydrophobicContact CG1-CG2 4.18Å; V998-A1027 PolarHBondContact N-O 3.34Å; V998-A1027 PolarHBondContact O-N 2.8Å; V998-F1032 HydrophobicContact CG2-CD2 3.82Å; V998-F1032 HydrophobicContact CG2-CE2 4.02Å; V998-A1035 HydrophobicContact CB-CB 3.89Å; V998-A1035 HydrophobicContact CG2-CB 3.48Å; V998-A1035 VanDerWaalsContact CG2-CB 3.48Å; V998-L1036 HydrophobicContact CG1-CD1 4.26Å
999	K	95.7	Very high	89.1	Confident	8 Å²	8	14.4 Å²	14.4	4%	0.035	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	131.9	171.4	-179.5	-95.3	-84.6	178.5	0	110	T886 S889 I890 V891 L951 E1024 V1025	T886-K999 PolarHBondContact O-NZ 3.27Å; S889-K999 PolarHBondContact O-NZ 3.18Å; I890-K999 WeakPolarHBondContact CA-O 3.2Å; V891-K999 HydrophobicContact CB-CB 4.3Å; V891-K999 HydrophobicContact CG2-CD 4.47Å; V891-K999 PolarHBondContact N-O 3.25Å; V891-K999 VanDerWaalsContact N-O 3.09Å; V891-K999 PolarHBondContact O-N 2.95Å; L951-K999 HydrophobicContact CD1-CB 3.99Å; L951-K999 HydrophobicContact CD1-CG 4.11Å; L951-K999 HydrophobicContact CD2-CB 3.85Å; L951-K999 HydrophobicContact CD2-CG 3.97Å; K999-E1024 HydrophobicContact CD-CB 4.09Å; K999-E1024 WeakPolarHBondContact CD-OE2 3.47Å; K999-E1024 VanDerWaalsContact CE-OE2 3.29Å; K999-E1024 WeakPolarHBondContact CE-OE2 3.19Å; K999-E1024 HydrophobicContact CG-CB 4.12Å; K999-E1024 HydrophobicContact CG-CG 4.34Å; K999-E1024 IonicContact NZ-OE2 2.64Å; K999-V1025 VanDerWaalsContact CA-O 3.27Å; K999-V1025 WeakPolarHBondContact CA-O 3.18Å
1000	V	96.2	Very high	88.1	Confident	5 Å²	5	21.5 Å²	21.5	3%	0.03	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	128.3	171.6	-178.5	0	0	0	0	109.4	I890 V998 V1025 S1039 L1040 T1043	I890-V1000 HydrophobicContact CD1-CG2 4.49Å; I890-V1000 HydrophobicContact CG1-CG2 4.27Å; I890-V1000 HydrophobicContact CG2-CG2 4.28Å; V998-V1000 HydrophobicContact CG1-CG2 4.18Å; V1000-V1025 HydrophobicContact CB-CG2 4.12Å; V1000-V1025 PolarHBondContact N-O 2.85Å; V1000-V1025 WeakPolarHBondContact O-CG2 3.29Å; V1000-V1025 PolarHBondContact O-N 3.29Å; V1000-S1039 VanDerWaalsContact CG2-OG 3.3Å; V1000-S1039 WeakPolarHBondContact CG2-OG 3.44Å; V1000-L1040 HydrophobicContact CG1-CD2 4.25Å; V1000-T1043 HydrophobicContact CB-CG2 4.02Å; V1000-T1043 HydrophobicContact CG1-CG2 3.62Å
1001	P	93.8	Very high	87.5	Confident	1 Å²	1	22 Å²	22	1%	0.006	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	154.7	176.3	27	-31.7	0	0	0	112.8	G887 E888 W1003	G887-P1001 WeakPolarHBondContact O-CB 3.45Å; E888-P1001 VanDerWaalsContact O-CG 3.29Å; E888-P1001 WeakPolarHBondContact O-CG 3.36Å; P1001-W1003 HydrophobicContact CB-CH2 4.28Å; P1001-W1003 HydrophobicContact CB-CZ2 3.96Å; P1001-W1003 HydrophobicContact CG-CH2 3.45Å; P1001-W1003 VanDerWaalsContact CG-CH2 3.45Å; P1001-W1003 HydrophobicContact CG-CZ2 3.4Å; P1001-W1003 HydrophobicContact CG-CZ3 4.23Å
1002	R	92	Very high	86.8	Confident	31 Å²	31	24.1 Å²	24.1	12%	0.117	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	131.8	177.7	170.9	61.4	-169.4	-157.8	9.4	110.9	D1004 S1021 V1022 G1023 T1043 N1044 V1265	R1002-D1004 IonicContact CZ-OD1 3.78Å; R1002-D1004 IonicContact NE-OD1 3.05Å; R1002-D1004 PolarHBondContact NE-OD1 3.18Å; R1002-D1004 IonicContact NH2-OD1 2.68Å; R1002-D1004 PolarHBondContact NH2-OD1 3.06Å; R1002-S1021 CarbonylContact O-C 3.58Å; R1002-S1021 VanDerWaalsContact O-CA 3.26Å; R1002-S1021 WeakPolarHBondContact O-CA 3.44Å; R1002-S1021 WeakPolarHBondContact O-CB 3.38Å; R1002-V1022 HydrophobicContact CG-CG2 4.04Å; R1002-V1022 WeakPolarHBondContact O-CG2 3.47Å; R1002-V1022 PolarHBondContact O-N 3.36Å; R1002-G1023 PolarHBondContact N-O 3.07Å; R1002-T1043 WeakPolarHBondContact CD-O 3.17Å; R1002-T1043 PolarHBondContact NH1-O 3.29Å; R1002-N1044 PolarHBondContact NH1-ND2 3.23Å; R1002-V1265 HydrophobicContact CB-CG2 3.66Å; R1002-V1265 HydrophobicContact CG-CG1 4.31Å; R1002-V1265 HydrophobicContact CG-CG2 4.01Å
1003	W	90.5	Very high	86.5	Confident	46 Å²	46	29 Å²	29	17%	0.174	15%	0.145	C	C	.	.			trans	-119	146.6	175.3	-57.3	-83.6	0	0	0	112.4	E888 P1001 L1005 I1015 D1067	E888-W1003 WeakPolarHBondContact O-CZ2 3.36Å; E888-W1003 PolarHBondContact OE2-NE1 3.01Å; P1001-W1003 HydrophobicContact CB-CH2 4.28Å; P1001-W1003 HydrophobicContact CB-CZ2 3.96Å; P1001-W1003 HydrophobicContact CG-CH2 3.45Å; P1001-W1003 VanDerWaalsContact CG-CH2 3.45Å; P1001-W1003 HydrophobicContact CG-CZ2 3.4Å; P1001-W1003 HydrophobicContact CG-CZ3 4.23Å; W1003-L1005 HydrophobicContact CB-CG 4.23Å; W1003-I1015 HydrophobicContact CD2-CD1 4.16Å; W1003-I1015 HydrophobicContact CH2-CD1 3.86Å; W1003-I1015 HydrophobicContact CZ2-CD1 3.23Å; W1003-D1067 HydrophobicContact CB-CB 4.26Å; W1003-D1067 HydrophobicContact CD2-CB 3.98Å; W1003-D1067 HydrophobicContact CE3-CB 3.98Å; W1003-D1067 HydrophobicContact CG-CB 4.11Å
1004	D	85.8	Confident	86.2	Confident	8 Å²	8	34.1 Å²	34.1	4%	0.043	17%	0.167	C	C	.	.			trans	-121.2	28.8	174.1	-83.7	0.6	0	0	0	111.8	R1002 A1006 K1007 V1022 I1268	R1002-D1004 IonicContact CZ-OD1 3.78Å; R1002-D1004 IonicContact NE-OD1 3.05Å; R1002-D1004 PolarHBondContact NE-OD1 3.18Å; R1002-D1004 IonicContact NH2-OD1 2.68Å; R1002-D1004 PolarHBondContact NH2-OD1 3.06Å; D1004-A1006 PolarHBondContact O-N 2.96Å; D1004-A1006 VanDerWaalsContact O-N 3.13Å; D1004-K1007 HydrophobicContact CB-CD 4.38Å; D1004-K1007 PolarHBondContact O-N 3.4Å; D1004-K1007 VanDerWaalsContact O-N 3.14Å; D1004-K1007 IonicContact OD2-NZ 3.55Å; D1004-V1022 HydrophobicContact CB-CG2 4.47Å; D1004-I1268 HydrophobicContact CB-CD1 4.02Å; D1004-I1268 HydrophobicContact CB-CG1 4.24Å; D1004-I1268 WeakPolarHBondContact OD2-CB 3.31Å; D1004-I1268 PolarHBondContact OD2-N 2.87Å
1005	L	83.9	Confident	85.9	Confident	3 Å²	3	34.7 Å²	34.7	2%	0.016	17%	0.17	C	C	.	.	G	3₁₀ helix	trans	-59.7	-27.5	-174.9	-62.9	-179.1	0	0	0	113.4	W1003 K1007 F1008 V1011 K1020 D1067 L1620	W1003-L1005 HydrophobicContact CB-CG 4.23Å; L1005-K1007 PolarHBondContact O-N 3.27Å; L1005-K1007 VanDerWaalsContact O-N 3.17Å; L1005-F1008 PolarHBondContact O-N 3.15Å; L1005-F1008 VanDerWaalsContact O-N 3.1Å; L1005-V1011 HydrophobicContact CB-CG1 3.9Å; L1005-V1011 HydrophobicContact CD2-CG1 4.21Å; L1005-V1011 HydrophobicContact CD2-CG2 4.23Å; L1005-V1011 WeakPolarHBondContact O-CG1 3.49Å; L1005-K1020 HydrophobicContact CD1-CD 4.44Å; L1005-K1020 HydrophobicContact CD2-CB 4.3Å; L1005-K1020 HydrophobicContact CD2-CD 4.38Å; L1005-D1067 HydrophobicContact CD1-CB 4.29Å; L1005-L1620 HydrophobicContact CD2-CD2 3.83Å
1006	A	75.8	Confident	85.2	Confident	77 Å²	77	35.6 Å²	35.6	64%	0.636	18%	0.18	S	C	*	.	G	3₁₀ helix	trans	-61.1	-22.5	178.4	0	0	0	0	0	114.2	D1004 F1008	D1004-A1006 PolarHBondContact O-N 2.96Å; D1004-A1006 VanDerWaalsContact O-N 3.13Å; A1006-F1008 PolarHBondContact O-N 3Å
1007	K	75.4	Confident	84.4	Confident	40 Å²	40	36.6 Å²	36.6	17%	0.174	19%	0.187	C	C	.	.	G	3₁₀ helix	trans	-72.4	-15.2	177.1	-58	-167.4	-175.5	-168	0	113.5	D1004 L1005 I1268	D1004-K1007 HydrophobicContact CB-CD 4.38Å; D1004-K1007 PolarHBondContact O-N 3.4Å; D1004-K1007 VanDerWaalsContact O-N 3.14Å; D1004-K1007 IonicContact OD2-NZ 3.55Å; L1005-K1007 PolarHBondContact O-N 3.27Å; L1005-K1007 VanDerWaalsContact O-N 3.17Å; K1007-I1268 HydrophobicContact CD-CB 4.31Å; K1007-I1268 HydrophobicContact CD-CG2 4.29Å; K1007-I1268 PolarHBondContact NZ-O 3.01Å
1008	F	76.6	Confident	83.4	Confident	13 Å²	13	37.7 Å²	37.7	6%	0.057	19%	0.194	C	C	.	.	S	Bend	trans	-113.1	111.5	-172.1	-58.1	-84.4	0	0	0	111.7	L1005 A1006 R1010 V1011 I1268 F1617 L1620 A1623 V1632	L1005-F1008 PolarHBondContact O-N 3.15Å; L1005-F1008 VanDerWaalsContact O-N 3.1Å; A1006-F1008 PolarHBondContact O-N 3Å; F1008-R1010 PolarHBondContact O-N 3.11Å; F1008-V1011 HydrophobicContact CB-CB 3.76Å; F1008-V1011 HydrophobicContact CB-CG1 3.82Å; F1008-V1011 HydrophobicContact CB-CG2 4.46Å; F1008-V1011 WeakPolarHBondContact O-CG1 3.15Å; F1008-V1011 PolarHBondContact O-N 3.31Å; F1008-I1268 HydrophobicContact CE2-CD1 3.53Å; F1008-I1268 HydrophobicContact CZ-CD1 3.51Å; F1008-F1617 HydrophobicContact CE1-CE1 4.29Å; F1008-L1620 HydrophobicContact CD1-CD1 3.9Å; F1008-L1620 HydrophobicContact CD2-CD1 3.92Å; F1008-L1620 HydrophobicContact CE1-CD1 3.5Å; F1008-L1620 VanDerWaalsContact CE1-CD1 3.5Å; F1008-L1620 HydrophobicContact CE2-CD1 3.53Å; F1008-L1620 HydrophobicContact CG-CD1 4.09Å; F1008-L1620 HydrophobicContact CZ-CD1 3.3Å; F1008-A1623 HydrophobicContact CB-CB 4.07Å; F1008-A1623 HydrophobicContact CD1-CB 3.93Å; F1008-A1623 HydrophobicContact CG-CB 4.34Å; F1008-V1632 HydrophobicContact CD1-CG1 4.5Å; F1008-V1632 HydrophobicContact CE1-CB 3.9Å; F1008-V1632 HydrophobicContact CE1-CG1 3.86Å; F1008-V1632 HydrophobicContact CZ-CB 4.34Å; F1008-V1632 HydrophobicContact CZ-CG1 4.45Å
1009	S	66.7	Low	82.7	Confident	39 Å²	39	38.2 Å²	38.2	27%	0.273	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	134.8	174.3	55.9	0	0	0	0	111.9	V1011	S1009-V1011 PolarHBondContact O-N 3.28Å
1010	R	70.7	Confident	82.3	Confident	155 Å²	155	38.9 Å²	38.9	59%	0.585	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.4	5.5	-178.1	-55.8	-178.7	69.9	-172.2	4.7	116.1	F1008 S1012	F1008-R1010 PolarHBondContact O-N 3.11Å; R1010-S1012 PolarHBondContact O-N 3.25Å
1011	V	80.1	Confident	82	Confident	14 Å²	14	38.7 Å²	38.7	9%	0.085	20%	0.198	C	C	.	.			trans	-63.4	138.4	174.5	79.6	0	0	0	0	109.8	L1005 F1008 S1009 R1013 L1620 L1621	L1005-V1011 HydrophobicContact CB-CG1 3.9Å; L1005-V1011 HydrophobicContact CD2-CG1 4.21Å; L1005-V1011 HydrophobicContact CD2-CG2 4.23Å; L1005-V1011 WeakPolarHBondContact O-CG1 3.49Å; F1008-V1011 HydrophobicContact CB-CB 3.76Å; F1008-V1011 HydrophobicContact CB-CG1 3.82Å; F1008-V1011 HydrophobicContact CB-CG2 4.46Å; F1008-V1011 WeakPolarHBondContact O-CG1 3.15Å; F1008-V1011 PolarHBondContact O-N 3.31Å; S1009-V1011 PolarHBondContact O-N 3.28Å; V1011-R1013 PolarHBondContact O-N 3.37Å; V1011-L1620 HydrophobicContact CG2-CB 4.02Å; V1011-L1620 HydrophobicContact CG2-CD2 4.16Å; V1011-L1621 WeakPolarHBondContact CA-O 3.35Å
1012	S	77.8	Confident	81.6	Confident	50 Å²	50	39.6 Å²	39.6	35%	0.35	20%	0.204	S	C	.	.			trans	-70.6	124	173.9	175.6	0	0	0	0	110.6	R1010 K1014 K1020 L1621	R1010-S1012 PolarHBondContact O-N 3.25Å; S1012-K1014 VanDerWaalsContact C-N 3.33Å; S1012-K1014 PolarHBondContact OG-N 2.85Å; S1012-K1020 PolarHBondContact O-NZ 2.77Å; S1012-L1621 PolarHBondContact N-O 3.5Å
1013	R	84.1	Confident	81.5	Confident	110 Å²	110	38.1 Å²	38.1	42%	0.415	20%	0.199	S	C	.	.			trans	-81.1	-7.4	173.4	-71.7	-170.9	-179.8	-123.2	12	114.6	V1011 I1015 T1066 D1067	V1011-R1013 PolarHBondContact O-N 3.37Å; R1013-I1015 PolarHBondContact O-N 2.98Å; R1013-T1066 WeakPolarHBondContact O-CA 3.44Å; R1013-D1067 WeakPolarHBondContact CB-OD1 3.43Å; R1013-D1067 WeakPolarHBondContact CD-OD1 3.44Å; R1013-D1067 IonicContact CZ-OD2 3.39Å; R1013-D1067 IonicContact NH1-OD1 3.07Å; R1013-D1067 IonicContact NH1-OD2 3.52Å; R1013-D1067 PolarHBondContact NH1-OD2 2.88Å; R1013-D1067 PolarHBondContact O-N 3.4Å
1014	K	85.9	Confident	81.5	Confident	111 Å²	111	36 Å²	36	48%	0.483	19%	0.191	S	C	.	.	B	Isolated β-bridge	trans	-63.8	129.5	174	-66.1	-162.3	176.8	-161.3	0	110.2	S1012 K1020 D1064	S1012-K1014 VanDerWaalsContact C-N 3.33Å; S1012-K1014 PolarHBondContact OG-N 2.85Å; K1014-K1020 PolarHBondContact O-NZ 3.31Å; K1014-D1064 IonicContact NZ-OD2 3.79Å; K1014-D1064 PolarHBondContact NZ-OD2 3.18Å
1015	I	86.1	Confident	81.9	Confident	14 Å²	14	35.7 Å²	35.7	7%	0.072	19%	0.189	C	C	.	.			trans	-98.1	146.9	173.4	-62.5	-173.8	0	0	0	108	I884 E888 W1003 R1013 P1065 D1067	I884-I1015 HydrophobicContact CG2-CG2 3.72Å; E888-I1015 HydrophobicContact CB-CG2 3.55Å; E888-I1015 HydrophobicContact CG-CG2 3.96Å; W1003-I1015 HydrophobicContact CD2-CD1 4.16Å; W1003-I1015 HydrophobicContact CH2-CD1 3.86Å; W1003-I1015 HydrophobicContact CZ2-CD1 3.23Å; R1013-I1015 PolarHBondContact O-N 2.98Å; I1015-P1065 PolarHBondContact N-O 3.43Å; I1015-D1067 HydrophobicContact CD1-CB 4.11Å
1016	G	82.6	Confident	82.4	Confident	19 Å²	19	35.5 Å²	35.5	20%	0.196	19%	0.188	C	C	.	.	S	Bend	trans	-169	-146.9	-178.4	0	0	0	0	0	110.9	G883 H885 S1018	G883-G1016 CarbonylContact O-C 3.59Å; G883-G1016 WeakPolarHBondContact O-CA 3.49Å; H885-G1016 WeakPolarHBondContact CB-O 3.34Å; H885-G1016 PolarHBondContact N-O 3.12Å; G1016-S1018 PolarHBondContact O-N 3.13Å
1017	S	77.8	Confident	83.4	Confident	21 Å²	21	31.9 Å²	31.9	15%	0.147	16%	0.158	C	C	.	.	S	Bend	trans	-70.3	5	-175.1	61.9	0	0	0	0	116	S823 G824 G883 H885	S823-S1017 VanDerWaalsContact OG-CB 3.3Å; S823-S1017 WeakPolarHBondContact OG-CB 3.38Å; S823-S1017 PolarHBondContact OG-O 3.35Å; S823-S1017 PolarHBondContact OG-OG 2.79Å; G824-S1017 WeakPolarHBondContact CA-OG 3.44Å; G824-S1017 PolarHBondContact N-OG 3.36Å; G883-S1017 PolarHBondContact O-N 2.94Å; H885-S1017 PolarHBondContact CD2-O 2.88Å
1018	S	76.8	Confident	84.4	Confident	27 Å²	27	30 Å²	30	19%	0.189	15%	0.15	C	C	.	.	S	Bend	trans	-128.1	130.4	-178.8	-162.3	0	0	0	0	110.5	G820 G1016	G820-S1018 VanDerWaalsContact O-CB 3.24Å; G820-S1018 WeakPolarHBondContact O-CB 3.36Å; G820-S1018 PolarHBondContact O-OG 3.11Å; G1016-S1018 PolarHBondContact O-N 3.13Å
1019	M	83.2	Confident	85.3	Confident	11 Å²	11	29.4 Å²	29.4	5%	0.054	15%	0.147	C	C	.	.			trans	-70.7	138.5	-176.2	-66.3	176	69.4	0	0	113.1	G819 H885 E888	G819-M1019 PolarHBondContact O-N 3.47Å; G819-M1019 VanDerWaalsContact O-N 3.17Å; H885-M1019 HydrophobicContact CB-CG 4.24Å; H885-M1019 VanDerWaalsContact CE1-CG 3.45Å; H885-M1019 WeakPolarHBondContact CE1-CG 3.48Å; H885-M1019 PolarHBondContact CE1-SD 3.44Å; H885-M1019 VanDerWaalsContact CG-CG 3.5Å; H885-M1019 WeakPolarHBondContact ND1-CG 3.35Å; E888-M1019 HydrophobicContact CG-CG 4.4Å; E888-M1019 WeakPolarHBondContact OE1-CA 3.32Å
1020	K	87	Confident	86.5	Confident	22 Å²	22	27.7 Å²	27.7	10%	0.096	14%	0.135	C	C	.	.			trans	-132.9	-12.8	175.2	-65.9	179.4	-178.2	174.7	0	113.1	E888 L1005 S1012 K1014	E888-K1020 PolarHBondContact OE1-N 3.44Å; E888-K1020 PolarHBondContact OE2-N 2.81Å; L1005-K1020 HydrophobicContact CD1-CD 4.44Å; L1005-K1020 HydrophobicContact CD2-CB 4.3Å; L1005-K1020 HydrophobicContact CD2-CD 4.38Å; S1012-K1020 PolarHBondContact O-NZ 2.77Å; K1014-K1020 PolarHBondContact O-NZ 3.31Å
1021	S	88.6	Confident	87.6	Confident	0 Å²	0	20.8 Å²	20.8	0%	0	11%	0.11	C	C	.	.			trans	-61.5	141.4	174	56	0	0	0	0	111.3	G887 E888 R1002	G887-S1021 PolarHBondContact O-OG 2.61Å; E888-S1021 WeakPolarHBondContact OE1-CB 3.41Å; E888-S1021 PolarHBondContact OE1-N 2.71Å; E888-S1021 PolarHBondContact OE1-OG 3.29Å; E888-S1021 PolarHBondContact OE2-N 3.45Å; R1002-S1021 CarbonylContact O-C 3.58Å; R1002-S1021 VanDerWaalsContact O-CA 3.26Å; R1002-S1021 WeakPolarHBondContact O-CA 3.44Å; R1002-S1021 WeakPolarHBondContact O-CB 3.38Å
1022	V	86.1	Confident	88.4	Confident	21 Å²	21	20.1 Å²	20.1	13%	0.127	11%	0.106	C	C	.	.			trans	-97.4	-14.8	-178.3	-67.2	0	0	0	0	112.6	I647 R1002 D1004 I1268	I647-V1022 HydrophobicContact CD1-CG1 4.07Å; I647-V1022 HydrophobicContact CG1-CG1 3.99Å; R1002-V1022 HydrophobicContact CG-CG2 4.04Å; R1002-V1022 WeakPolarHBondContact O-CG2 3.47Å; R1002-V1022 PolarHBondContact O-N 3.36Å; D1004-V1022 HydrophobicContact CB-CG2 4.47Å; V1022-I1268 HydrophobicContact CG1-CD1 4.41Å; V1022-I1268 HydrophobicContact CG1-CG1 4.13Å
1023	G	89.1	Confident	89.3	Confident	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-179.5	-171.4	177.6	0	0	0	0	0	110.6	R1002 E1300	R1002-G1023 PolarHBondContact N-O 3.07Å; G1023-E1300 WeakPolarHBondContact CA-OE2 3.09Å
1024	E	91.6	Very high	89.9	Confident	2 Å²	2	12.6 Å²	12.6	1%	0.009	7%	0.07	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	165	-179.3	60.9	-170.1	-160.7	0	0	112.8	K999 P1299 E1300	K999-E1024 HydrophobicContact CD-CB 4.09Å; K999-E1024 WeakPolarHBondContact CD-OE2 3.47Å; K999-E1024 VanDerWaalsContact CE-OE2 3.29Å; K999-E1024 WeakPolarHBondContact CE-OE2 3.19Å; K999-E1024 HydrophobicContact CG-CB 4.12Å; K999-E1024 HydrophobicContact CG-CG 4.34Å; K999-E1024 IonicContact NZ-OE2 2.64Å; E1024-P1299 HydrophobicContact CG-CG 4.05Å; E1024-E1300 HydrophobicContact CG-CG 4.16Å; E1024-E1300 PolarHBondContact N-OE2 3.44Å
1025	V	94.4	Very high	90.5	Very high	0 Å²	0	7.3 Å²	7.3	0%	0	5%	0.047	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	150.5	175.2	-58.3	0	0	0	0	110.3	K999 V1000 S1039 M1042 T1043 V1265	K999-V1025 VanDerWaalsContact CA-O 3.27Å; K999-V1025 WeakPolarHBondContact CA-O 3.18Å; V1000-V1025 HydrophobicContact CB-CG2 4.12Å; V1000-V1025 PolarHBondContact N-O 2.85Å; V1000-V1025 WeakPolarHBondContact O-CG2 3.29Å; V1000-V1025 PolarHBondContact O-N 3.29Å; V1025-S1039 VanDerWaalsContact CG2-O 3.23Å; V1025-S1039 WeakPolarHBondContact CG2-O 3.16Å; V1025-M1042 HydrophobicContact CB-CB 3.74Å; V1025-M1042 HydrophobicContact CB-SD 4.48Å; V1025-M1042 HydrophobicContact CG1-CB 3.81Å; V1025-M1042 HydrophobicContact CG2-CB 3.8Å; V1025-T1043 HydrophobicContact CG2-CG2 3.76Å; V1025-V1265 HydrophobicContact CG1-CB 3.43Å; V1025-V1265 VanDerWaalsContact CG1-CB 3.43Å; V1025-V1265 HydrophobicContact CG1-CG1 4.43Å; V1025-V1265 HydrophobicContact CG1-CG2 3.38Å
1026	M	94.2	Very high	91.1	Very high	0 Å²	0	6.6 Å²	6.6	0%	0	4%	0.043	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	125.4	176.5	-174.9	-172.8	70.8	0	0	109.2	L951 K954 A955 V997 I1028 C1297 P1299 F1314	L951-M1026 HydrophobicContact CD1-CB 4.02Å; L951-M1026 HydrophobicContact CD1-CG 3.82Å; L951-M1026 HydrophobicContact CD1-SD 3.75Å; K954-M1026 HydrophobicContact CB-CE 3.54Å; K954-M1026 HydrophobicContact CB-SD 3.91Å; A955-M1026 HydrophobicContact CB-SD 4.09Å; V997-M1026 HydrophobicContact CG1-CG 3.33Å; V997-M1026 HydrophobicContact CG1-SD 3.69Å; M1026-I1028 HydrophobicContact CE-CD1 3.93Å; M1026-I1028 HydrophobicContact CE-CG1 4.2Å; M1026-C1297 PolarHBondContact N-O 3.31Å; M1026-C1297 VanDerWaalsContact N-O 3.12Å; M1026-P1299 HydrophobicContact CB-CB 4.16Å; M1026-P1299 HydrophobicContact CB-CG 4.01Å; M1026-P1299 HydrophobicContact SD-CB 4.42Å; M1026-F1314 HydrophobicContact CE-CD1 3.59Å; M1026-F1314 HydrophobicContact CE-CD2 4.48Å; M1026-F1314 HydrophobicContact CE-CE1 3.6Å; M1026-F1314 HydrophobicContact CE-CE2 4.46Å; M1026-F1314 HydrophobicContact CE-CG 4.03Å; M1026-F1314 HydrophobicContact CE-CZ 4.02Å
1027	A	96.3	Very high	91.8	Very high	0 Å²	0	5.7 Å²	5.7	0%	0	3%	0.034	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	141	171.9	0	0	0	0	0	110.7	V997 V998 A1035 K1038 M1042	V997-A1027 WeakPolarHBondContact CA-O 3.26Å; V998-A1027 PolarHBondContact N-O 3.34Å; V998-A1027 PolarHBondContact O-N 2.8Å; A1027-A1035 VanDerWaalsContact CB-O 3.28Å; A1027-A1035 WeakPolarHBondContact CB-O 3.38Å; A1027-K1038 HydrophobicContact CB-CB 3.67Å; A1027-M1042 HydrophobicContact CB-CE 4.02Å; A1027-M1042 HydrophobicContact CB-SD 3.79Å
1028	I	96.3	Very high	92.7	Very high	1 Å²	1	4.8 Å²	4.8	1%	0.005	3%	0.027	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	133.4	178.6	-50.6	179.6	0	0	0	108.7	Y995 V997 M1026 V1188 Y1203 F1314	Y995-I1028 HydrophobicContact CD2-CG2 3.57Å; Y995-I1028 HydrophobicContact CE2-CG2 4.24Å; Y995-I1028 HydrophobicContact CG-CG2 3.89Å; V997-I1028 HydrophobicContact CG1-CG1 4.45Å; V997-I1028 HydrophobicContact CG2-CG1 4.2Å; V997-I1028 HydrophobicContact CG2-CG2 4.41Å; M1026-I1028 HydrophobicContact CE-CD1 3.93Å; M1026-I1028 HydrophobicContact CE-CG1 4.2Å; I1028-V1188 HydrophobicContact CD1-CG2 3.72Å; I1028-Y1203 HydrophobicContact CB-CD1 4.27Å; I1028-Y1203 HydrophobicContact CB-CD2 4.16Å; I1028-Y1203 HydrophobicContact CB-CG 3.86Å; I1028-Y1203 HydrophobicContact CG2-CD1 3.65Å; I1028-Y1203 HydrophobicContact CG2-CD2 3.82Å; I1028-Y1203 HydrophobicContact CG2-CE1 3.87Å; I1028-Y1203 HydrophobicContact CG2-CE2 4.04Å; I1028-Y1203 HydrophobicContact CG2-CG 3.62Å; I1028-F1314 HydrophobicContact CD1-CB 4.22Å
1029	A	95.5	Very high	93.6	Very high	0 Å²	0	3.5 Å²	3.5	0%	0	2%	0.018	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	173.8	175.5	0	0	0	0	0	111.3	Y995 C996 E1034 A1035	Y995-A1029 WeakPolarHBondContact CB-O 3.25Å; C996-A1029 PolarHBondContact N-O 3.17Å; C996-A1029 PolarHBondContact O-N 3.22Å; C996-A1029 VanDerWaalsContact O-O 3.06Å; A1029-E1034 HydrophobicContact CB-CB 3.7Å; A1029-E1034 HydrophobicContact CB-CG 3.64Å; A1029-E1034 WeakPolarHBondContact CB-OE2 3.12Å; A1029-A1035 HydrophobicContact CB-CB 3.87Å
1030	R	92.8	Very high	94.3	Very high	4 Å²	4	3 Å²	3	2%	0.015	2%	0.016	C	C	.	.	S	Bend	trans	-87.7	-4.5	176.9	-60.7	-88.7	-70	165.3	7.2	113.4	P297 T364 D994 Y1203 T1205 A1207 D1208	P297-R1030 WeakPolarHBondContact CB-O 3.39Å; P297-R1030 HydrophobicContact CG-CB 4.41Å; P297-R1030 WeakPolarHBondContact CG-O 3.4Å; T364-R1030 PolarHBondContact OG1-NH2 2.83Å; D994-R1030 VanDerWaalsContact O-CD 3.32Å; D994-R1030 WeakPolarHBondContact O-CD 3.16Å; D994-R1030 PolarHBondContact O-NH1 3.35Å; R1030-Y1203 HydrophobicContact CG-CE2 4.43Å; R1030-T1205 HydrophobicContact CG-CG2 3.95Å; R1030-A1207 HydrophobicContact CB-CB 3.81Å; R1030-D1208 IonicContact CZ-OD1 3.2Å; R1030-D1208 IonicContact NE-OD1 2.95Å; R1030-D1208 PolarHBondContact NE-OD1 3.38Å; R1030-D1208 IonicContact NE-OD2 3.52Å; R1030-D1208 PolarHBondContact NE-OD2 2.88Å; R1030-D1208 IonicContact NH2-OD1 2.54Å; R1030-D1208 PolarHBondContact NH2-OD1 3.02Å
1031	C	93.1	Very high	94.6	Very high	9 Å²	9	3.3 Å²	3.3	6%	0.061	2%	0.016	C	C	.	.	S	Bend	trans	-142.4	160.2	171.5	67.5	0	0	0	0	111.3	E1034 A1035	C1031-E1034 VanDerWaalsContact SG-CB 3.59Å; C1031-A1035 PolarHBondContact O-N 3.42Å
1032	F	96.5	Very high	94.9	Very high	1 Å²	1	4 Å²	4	0%	0.004	2%	0.02	C	C	.	.	H	α-helix	trans	-62.8	-42.9	-177.8	170.8	-101.9	0	0	0	112.7	V879 V892 V998 E1034 A1035 L1036 W1095 F1096 R1099 M1100	V879-F1032 HydrophobicContact CG2-CE2 4.36Å; V892-F1032 HydrophobicContact CG1-CD2 4.34Å; V892-F1032 HydrophobicContact CG2-CD2 4.05Å; V892-F1032 HydrophobicContact CG2-CE2 3.7Å; V998-F1032 HydrophobicContact CG2-CD2 3.82Å; V998-F1032 HydrophobicContact CG2-CE2 4.02Å; F1032-E1034 PolarHBondContact O-N 3.12Å; F1032-A1035 PolarHBondContact O-N 3.32Å; F1032-L1036 HydrophobicContact CE1-CB 4.49Å; F1032-L1036 HydrophobicContact CE1-CD2 3.9Å; F1032-L1036 HydrophobicContact CZ-CB 4.34Å; F1032-L1036 HydrophobicContact CZ-CD2 3.9Å; F1032-L1036 HydrophobicContact CZ-CG 4.48Å; F1032-L1036 WeakPolarHBondContact O-CB 3.48Å; F1032-L1036 PolarHBondContact O-N 3.29Å; F1032-W1095 HydrophobicContact CB-CH2 4.03Å; F1032-W1095 HydrophobicContact CB-CZ3 4.36Å; F1032-W1095 HydrophobicContact CD1-CZ3 4.49Å; F1032-W1095 HydrophobicContact CG-CH2 4.41Å; F1032-W1095 HydrophobicContact CG-CZ3 4.25Å; F1032-F1096 HydrophobicContact CD2-CD1 4.3Å; F1032-F1096 HydrophobicContact CD2-CE1 4.31Å; F1032-F1096 HydrophobicContact CE1-CD1 4.1Å; F1032-F1096 AromaticContact CE2-CD1 3.79Å; F1032-F1096 HydrophobicContact CE2-CD1 3.79Å; F1032-F1096 AromaticContact CE2-CE1 4Å; F1032-F1096 HydrophobicContact CE2-CE1 4Å; F1032-F1096 AromaticContact CZ-CD1 3.67Å; F1032-F1096 HydrophobicContact CZ-CD1 3.67Å; F1032-F1096 HydrophobicContact CZ-CE1 4.34Å; F1032-R1099 HydrophobicContact CD1-CB 3.59Å; F1032-R1099 HydrophobicContact CD1-CG 4.09Å; F1032-R1099 HydrophobicContact CE1-CB 3.98Å; F1032-M1100 HydrophobicContact CE1-CE 4.43Å; F1032-M1100 HydrophobicContact CE1-CG 4.38Å; F1032-M1100 HydrophobicContact CZ-CE 4.11Å
1033	E	97.1	Very high	95.2	Very high	1 Å²	1	3.4 Å²	3.4	1%	0.005	2%	0.016	C	C	.	.	H	α-helix	trans	-60.5	-45	-178.6	-69.2	91.5	154.3	0	0	112.4	L1036 Q1037 R1099 I1103 L1154	E1033-L1036 PolarHBondContact O-N 3.19Å; E1033-Q1037 WeakPolarHBondContact O-CG 3.48Å; E1033-Q1037 PolarHBondContact O-N 3Å; E1033-R1099 HydrophobicContact CG-CB 4.37Å; E1033-R1099 WeakPolarHBondContact CG-O 3.42Å; E1033-R1099 IonicContact OE1-CZ 3.02Å; E1033-R1099 IonicContact OE1-NE 2.55Å; E1033-R1099 PolarHBondContact OE1-NE 3.01Å; E1033-R1099 IonicContact OE1-NH2 3.89Å; E1033-R1099 PolarHBondContact OE1-NH2 3.14Å; E1033-R1099 IonicContact OE2-CZ 3.61Å; E1033-R1099 IonicContact OE2-NE 2.92Å; E1033-R1099 IonicContact OE2-NH2 2.86Å; E1033-R1099 PolarHBondContact OE2-NH2 2.94Å; E1033-I1103 HydrophobicContact CB-CD1 3.94Å; E1033-I1103 HydrophobicContact CB-CG1 3.89Å; E1033-I1103 HydrophobicContact CG-CD1 3.9Å; E1033-I1103 HydrophobicContact CG-CG1 3.64Å; E1033-L1154 CarbonylContact C-O 3.56Å; E1033-L1154 HydrophobicContact CB-CB 4.4Å; E1033-L1154 HydrophobicContact CB-CD2 4.04Å; E1033-L1154 HydrophobicContact CG-CD2 4.09Å
1034	E	97.4	Very high	95	Very high	0 Å²	0	5.5 Å²	5.5	0%	0	3%	0.028	C	C	.	.	H	α-helix	trans	-64.8	-44.2	179.8	-178.2	179.9	-162.9	0	0	111.1	A1029 C1031 F1032 Q1037 K1038 T1205 Y1206	A1029-E1034 HydrophobicContact CB-CB 3.7Å; A1029-E1034 HydrophobicContact CB-CG 3.64Å; A1029-E1034 WeakPolarHBondContact CB-OE2 3.12Å; C1031-E1034 VanDerWaalsContact SG-CB 3.59Å; F1032-E1034 PolarHBondContact O-N 3.12Å; E1034-Q1037 PolarHBondContact O-N 2.7Å; E1034-K1038 VanDerWaalsContact CD-NZ 3.29Å; E1034-K1038 HydrophobicContact CG-CD 4.23Å; E1034-K1038 WeakPolarHBondContact O-CB 3.38Å; E1034-K1038 WeakPolarHBondContact O-CG 3.46Å; E1034-K1038 PolarHBondContact O-N 3.13Å; E1034-K1038 VanDerWaalsContact O-N 3.08Å; E1034-K1038 VanDerWaalsContact OE1-CE 3.3Å; E1034-K1038 WeakPolarHBondContact OE1-CE 3.46Å; E1034-K1038 IonicContact OE1-NZ 2.75Å; E1034-K1038 PolarHBondContact OE1-NZ 3.42Å; E1034-K1038 IonicContact OE2-NZ 3.99Å; E1034-T1205 WeakPolarHBondContact OE1-CA 3.29Å; E1034-T1205 PolarHBondContact OE2-OG1 2.9Å; E1034-Y1206 PolarHBondContact OE1-N 2.86Å
1035	A	97.5	Very high	94.1	Very high	0 Å²	0	10 Å²	10	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-63.9	-42.1	177.2	0	0	0	0	0	111.8	V998 A1027 A1029 C1031 F1032 S1039	V998-A1035 HydrophobicContact CB-CB 3.89Å; V998-A1035 HydrophobicContact CG2-CB 3.48Å; V998-A1035 VanDerWaalsContact CG2-CB 3.48Å; A1027-A1035 VanDerWaalsContact CB-O 3.28Å; A1027-A1035 WeakPolarHBondContact CB-O 3.38Å; A1029-A1035 HydrophobicContact CB-CB 3.87Å; C1031-A1035 PolarHBondContact O-N 3.42Å; F1032-A1035 PolarHBondContact O-N 3.32Å; A1035-S1039 WeakPolarHBondContact O-CB 3.5Å; A1035-S1039 PolarHBondContact O-N 3.43Å; A1035-S1039 PolarHBondContact O-OG 3Å
1036	L	98.1	Very high	93.3	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-63	-46.9	177.3	-179.7	65.5	0	0	0	111.7	V998 F1032 E1033 K1038 S1039 L1040 F1050 M1100 I1103	V998-L1036 HydrophobicContact CG1-CD1 4.26Å; F1032-L1036 HydrophobicContact CE1-CB 4.49Å; F1032-L1036 HydrophobicContact CE1-CD2 3.9Å; F1032-L1036 HydrophobicContact CZ-CB 4.34Å; F1032-L1036 HydrophobicContact CZ-CD2 3.9Å; F1032-L1036 HydrophobicContact CZ-CG 4.48Å; F1032-L1036 WeakPolarHBondContact O-CB 3.48Å; F1032-L1036 PolarHBondContact O-N 3.29Å; E1033-L1036 PolarHBondContact O-N 3.19Å; L1036-K1038 PolarHBondContact O-N 3.5Å; L1036-S1039 WeakPolarHBondContact CA-OG 3.26Å; L1036-S1039 PolarHBondContact O-N 3.18Å; L1036-S1039 PolarHBondContact O-OG 3.08Å; L1036-L1040 HydrophobicContact CD1-CD1 4.26Å; L1036-L1040 HydrophobicContact CD1-CG 4.39Å; L1036-L1040 HydrophobicContact CG-CD1 4.16Å; L1036-L1040 WeakPolarHBondContact O-CG 3.46Å; L1036-L1040 PolarHBondContact O-N 3.33Å; L1036-F1050 HydrophobicContact CD2-CD2 4.45Å; L1036-M1100 HydrophobicContact CD2-CE 4.04Å; L1036-M1100 HydrophobicContact CD2-CG 3.89Å; L1036-I1103 HydrophobicContact CD2-CD1 4.33Å
1037	Q	97.4	Very high	93	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-66.8	-39.5	-178.9	-68.3	-146.1	82.3	0	0	112.5	E1033 E1034 R1041 F1050 I1103 L1154 G1155	E1033-Q1037 WeakPolarHBondContact O-CG 3.48Å; E1033-Q1037 PolarHBondContact O-N 3Å; E1034-Q1037 PolarHBondContact O-N 2.7Å; Q1037-R1041 WeakPolarHBondContact O-CG 3.47Å; Q1037-R1041 PolarHBondContact O-N 3.2Å; Q1037-R1041 PolarHBondContact O-NH1 2.68Å; Q1037-F1050 HydrophobicContact CG-CB 4.34Å; Q1037-I1103 HydrophobicContact CG-CD1 3.87Å; Q1037-I1103 HydrophobicContact CG-CG2 4.43Å; Q1037-L1154 PolarHBondContact NE2-O 3.07Å; Q1037-G1155 WeakPolarHBondContact CB-O 3.37Å
1038	K	97.1	Very high	92.6	Very high	2 Å²	2	16.6 Å²	16.6	1%	0.009	9%	0.094	C	C	.	.	H	α-helix	trans	-62.1	-50.8	173.7	-76.6	175.6	-175.6	165.3	0	111.8	A1027 E1034 L1036 L1040 R1041 M1042 T1204	A1027-K1038 HydrophobicContact CB-CB 3.67Å; E1034-K1038 VanDerWaalsContact CD-NZ 3.29Å; E1034-K1038 HydrophobicContact CG-CD 4.23Å; E1034-K1038 WeakPolarHBondContact O-CB 3.38Å; E1034-K1038 WeakPolarHBondContact O-CG 3.46Å; E1034-K1038 PolarHBondContact O-N 3.13Å; E1034-K1038 VanDerWaalsContact O-N 3.08Å; E1034-K1038 VanDerWaalsContact OE1-CE 3.3Å; E1034-K1038 WeakPolarHBondContact OE1-CE 3.46Å; E1034-K1038 IonicContact OE1-NZ 2.75Å; E1034-K1038 PolarHBondContact OE1-NZ 3.42Å; E1034-K1038 IonicContact OE2-NZ 3.99Å; L1036-K1038 PolarHBondContact O-N 3.5Å; K1038-L1040 VanDerWaalsContact C-N 3.32Å; K1038-L1040 PolarHBondContact O-N 2.96Å; K1038-R1041 PolarHBondContact O-N 3.42Å; K1038-R1041 VanDerWaalsContact O-N 3.12Å; K1038-M1042 HydrophobicContact CB-CE 4.33Å; K1038-M1042 VanDerWaalsContact O-CG 3.28Å; K1038-M1042 WeakPolarHBondContact O-CG 3.28Å; K1038-M1042 PolarHBondContact O-N 2.98Å; K1038-T1204 PolarHBondContact NZ-O 3.01Å
1039	S	96.8	Very high	92.4	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-60.1	-41.9	-178.4	51.6	0	0	0	0	111.6	V1000 V1025 A1035 L1036 R1041 M1042 T1043	V1000-S1039 VanDerWaalsContact CG2-OG 3.3Å; V1000-S1039 WeakPolarHBondContact CG2-OG 3.44Å; V1025-S1039 VanDerWaalsContact CG2-O 3.23Å; V1025-S1039 WeakPolarHBondContact CG2-O 3.16Å; A1035-S1039 WeakPolarHBondContact O-CB 3.5Å; A1035-S1039 PolarHBondContact O-N 3.43Å; A1035-S1039 PolarHBondContact O-OG 3Å; L1036-S1039 WeakPolarHBondContact CA-OG 3.26Å; L1036-S1039 PolarHBondContact O-N 3.18Å; L1036-S1039 PolarHBondContact O-OG 3.08Å; S1039-R1041 PolarHBondContact O-N 2.81Å; S1039-M1042 WeakPolarHBondContact O-CB 3.4Å; S1039-M1042 PolarHBondContact O-N 3.44Å; S1039-M1042 VanDerWaalsContact O-N 3.14Å; S1039-T1043 WeakPolarHBondContact O-CG2 3.5Å; S1039-T1043 PolarHBondContact O-N 3.45Å
1040	L	96.8	Very high	92.4	Very high	1 Å²	1	16.9 Å²	16.9	1%	0.005	10%	0.095	C	C	.	.	H	α-helix	trans	-57.9	-44.8	174.2	-71.3	171	0	0	0	112.5	V1000 L1036 K1038 M1042 T1043 V1047 F1050 I1070 Y1071	V1000-L1040 HydrophobicContact CG1-CD2 4.25Å; L1036-L1040 HydrophobicContact CD1-CD1 4.26Å; L1036-L1040 HydrophobicContact CD1-CG 4.39Å; L1036-L1040 HydrophobicContact CG-CD1 4.16Å; L1036-L1040 WeakPolarHBondContact O-CG 3.46Å; L1036-L1040 PolarHBondContact O-N 3.33Å; K1038-L1040 VanDerWaalsContact C-N 3.32Å; K1038-L1040 PolarHBondContact O-N 2.96Å; L1040-M1042 VanDerWaalsContact C-N 3.34Å; L1040-M1042 PolarHBondContact O-N 2.79Å; L1040-T1043 PolarHBondContact O-N 2.91Å; L1040-T1043 PolarHBondContact O-OG1 3.07Å; L1040-V1047 HydrophobicContact CB-CG1 4.09Å; L1040-V1047 WeakPolarHBondContact O-CG1 3.11Å; L1040-F1050 HydrophobicContact CD1-CB 3.79Å; L1040-F1050 HydrophobicContact CD1-CD2 3.98Å; L1040-F1050 HydrophobicContact CD1-CG 4.4Å; L1040-I1070 HydrophobicContact CD1-CG1 4.49Å; L1040-I1070 HydrophobicContact CD2-CG1 4.27Å; L1040-I1070 HydrophobicContact CD2-CG2 4.05Å; L1040-Y1071 HydrophobicContact CD2-CE1 4.48Å
1041	R	94.6	Very high	92.2	Very high	28 Å²	28	18.3 Å²	18.3	11%	0.106	10%	0.103	C	C	.	.	H	α-helix	trans	-65.1	-34.3	175.7	-69.8	-165.4	-65.8	-83.3	-4.6	113.4	Q1037 K1038 S1039 T1043 N1044 V1047 S1048 G1155 E1316	Q1037-R1041 WeakPolarHBondContact O-CG 3.47Å; Q1037-R1041 PolarHBondContact O-N 3.2Å; Q1037-R1041 PolarHBondContact O-NH1 2.68Å; K1038-R1041 PolarHBondContact O-N 3.42Å; K1038-R1041 VanDerWaalsContact O-N 3.12Å; S1039-R1041 PolarHBondContact O-N 2.81Å; R1041-T1043 PolarHBondContact O-N 3.41Å; R1041-N1044 CarbonylContact O-C 3.5Å; R1041-N1044 PolarHBondContact O-N 3.4Å; R1041-V1047 WeakPolarHBondContact CG-O 3.36Å; R1041-S1048 VanDerWaalsContact CD-O 3.23Å; R1041-S1048 WeakPolarHBondContact CD-O 3.3Å; R1041-S1048 VanDerWaalsContact CG-C 3.41Å; R1041-S1048 WeakPolarHBondContact CG-O 3.37Å; R1041-G1155 PolarHBondContact NH1-O 2.73Å; R1041-G1155 PolarHBondContact NH2-O 2.82Å; R1041-E1316 IonicContact CZ-OE2 2.69Å; R1041-E1316 VanDerWaalsContact CZ-OE2 3.25Å; R1041-E1316 IonicContact NE-OE1 3.46Å; R1041-E1316 IonicContact NE-OE2 3.83Å; R1041-E1316 PolarHBondContact NE-OE2 3.08Å; R1041-E1316 IonicContact NH2-OE2 3.73Å; R1041-E1316 PolarHBondContact NH2-OE2 3.3Å
1042	M	94.8	Very high	91.6	Very high	14 Å²	14	18 Å²	18	7%	0.069	10%	0.101	C	C	.	.	H	α-helix	trans	-66.5	-25.5	177.4	-68.8	162.4	170.8	0	0	112.4	V1025 A1027 K1038 S1039 L1040 C1297 E1316	V1025-M1042 HydrophobicContact CB-CB 3.74Å; V1025-M1042 HydrophobicContact CB-SD 4.48Å; V1025-M1042 HydrophobicContact CG1-CB 3.81Å; V1025-M1042 HydrophobicContact CG2-CB 3.8Å; A1027-M1042 HydrophobicContact CB-CE 4.02Å; A1027-M1042 HydrophobicContact CB-SD 3.79Å; K1038-M1042 HydrophobicContact CB-CE 4.33Å; K1038-M1042 VanDerWaalsContact O-CG 3.28Å; K1038-M1042 WeakPolarHBondContact O-CG 3.28Å; K1038-M1042 PolarHBondContact O-N 2.98Å; S1039-M1042 WeakPolarHBondContact O-CB 3.4Å; S1039-M1042 PolarHBondContact O-N 3.44Å; S1039-M1042 VanDerWaalsContact O-N 3.14Å; L1040-M1042 VanDerWaalsContact C-N 3.34Å; L1040-M1042 PolarHBondContact O-N 2.79Å; M1042-C1297 HydrophobicContact CB-CB 4.23Å; M1042-C1297 HydrophobicContact CE-CB 3.99Å; M1042-C1297 HydrophobicContact CG-CB 3.83Å; M1042-C1297 HydrophobicContact SD-CB 3.73Å; M1042-E1316 HydrophobicContact CE-CB 4.19Å; M1042-E1316 VanDerWaalsContact CE-N 3.29Å; M1042-E1316 HydrophobicContact CG-CB 3.87Å
1043	T	91.7	Very high	90.6	Very high	9 Å²	9	20.6 Å²	20.6	6%	0.055	12%	0.12	C	C	.	.	H	α-helix	trans	-69	-37	178.6	68.4	0	0	0	0	113	V1000 R1002 V1025 S1039 L1040 R1041	V1000-T1043 HydrophobicContact CB-CG2 4.02Å; V1000-T1043 HydrophobicContact CG1-CG2 3.62Å; R1002-T1043 WeakPolarHBondContact CD-O 3.17Å; R1002-T1043 PolarHBondContact NH1-O 3.29Å; V1025-T1043 HydrophobicContact CG2-CG2 3.76Å; S1039-T1043 WeakPolarHBondContact O-CG2 3.5Å; S1039-T1043 PolarHBondContact O-N 3.45Å; L1040-T1043 PolarHBondContact O-N 2.91Å; L1040-T1043 PolarHBondContact O-OG1 3.07Å; R1041-T1043 PolarHBondContact O-N 3.41Å
1044	N	84.7	Confident	89.5	Confident	44 Å²	44	28.1 Å²	28.1	24%	0.235	16%	0.159	C	C	.	.			trans	-155.7	136.1	-176.5	-159.2	-26.4	0	0	0	111.4	R1002 R1041 S1046 V1047	R1002-N1044 PolarHBondContact NH1-ND2 3.23Å; R1041-N1044 CarbonylContact O-C 3.5Å; R1041-N1044 PolarHBondContact O-N 3.4Å; N1044-S1046 VanDerWaalsContact CG-OG 3.27Å; N1044-S1046 PolarHBondContact ND2-OG 2.86Å; N1044-S1046 PolarHBondContact O-N 2.91Å; N1044-S1046 VanDerWaalsContact O-N 3.15Å; N1044-S1046 PolarHBondContact OD1-N 3.27Å; N1044-S1046 PolarHBondContact OD1-OG 2.9Å; N1044-V1047 HydrophobicContact CB-CB 4.31Å; N1044-V1047 HydrophobicContact CB-CG2 3.82Å; N1044-V1047 PolarHBondContact O-N 2.89Å
1045	E	73.9	Confident	88.8	Confident	95 Å²	95	31.7 Å²	31.7	44%	0.444	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-28.1	173.7	-61.8	164.7	-129.5	0	0	112.8	V1047 R1267 T1342 N1345	E1045-V1047 VanDerWaalsContact C-N 3.32Å; E1045-R1267 IonicContact OE1-CZ 3.56Å; E1045-R1267 IonicContact OE1-NH1 3.25Å; E1045-R1267 PolarHBondContact OE1-NH1 2.96Å; E1045-R1267 IonicContact OE1-NH2 2.85Å; E1045-R1267 PolarHBondContact OE1-NH2 3.23Å; E1045-T1342 HydrophobicContact CG-CG2 4.13Å; E1045-N1345 PolarHBondContact OE2-ND2 3.2Å
1046	S	76.8	Confident	88.2	Confident	97 Å²	97	34.8 Å²	34.8	68%	0.678	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-11.6	177.3	70.3	0	0	0	0	114.4	N1044	N1044-S1046 VanDerWaalsContact CG-OG 3.27Å; N1044-S1046 PolarHBondContact ND2-OG 2.86Å; N1044-S1046 PolarHBondContact O-N 2.91Å; N1044-S1046 VanDerWaalsContact O-N 3.15Å; N1044-S1046 PolarHBondContact OD1-N 3.27Å; N1044-S1046 PolarHBondContact OD1-OG 2.9Å
1047	V	87.7	Confident	87.7	Confident	24 Å²	24	36.7 Å²	36.7	15%	0.145	21%	0.214	C	C	.	.			trans	-95.1	122.3	-177.4	172.7	0	0	0	0	108.6	L1040 R1041 N1044 E1045 Y1071	L1040-V1047 HydrophobicContact CB-CG1 4.09Å; L1040-V1047 WeakPolarHBondContact O-CG1 3.11Å; R1041-V1047 WeakPolarHBondContact CG-O 3.36Å; N1044-V1047 HydrophobicContact CB-CB 4.31Å; N1044-V1047 HydrophobicContact CB-CG2 3.82Å; N1044-V1047 PolarHBondContact O-N 2.89Å; E1045-V1047 VanDerWaalsContact C-N 3.32Å; V1047-Y1071 HydrophobicContact CG1-CE1 3.91Å; V1047-Y1071 WeakPolarHBondContact CG1-OH 3.37Å; V1047-Y1071 HydrophobicContact CG2-CE1 4.49Å; V1047-Y1071 WeakPolarHBondContact CG2-OH 3.37Å
1048	S	87.5	Confident	87.3	Confident	19 Å²	19	39.2 Å²	39.2	13%	0.133	23%	0.227	C	C	.	.			trans	-88.8	-11	-178.9	50.5	0	0	0	0	114.4	R1041 S1157 Q1160 R1163	R1041-S1048 VanDerWaalsContact CD-O 3.23Å; R1041-S1048 WeakPolarHBondContact CD-O 3.3Å; R1041-S1048 VanDerWaalsContact CG-C 3.41Å; R1041-S1048 WeakPolarHBondContact CG-O 3.37Å; S1048-S1157 PolarHBondContact O-OG 2.91Å; S1048-Q1160 WeakPolarHBondContact O-CG 3.42Å; S1048-Q1160 PolarHBondContact O-OE1 3.05Å; S1048-R1163 PolarHBondContact OG-NH1 3.04Å
1049	G	93	Very high	87	Confident	1 Å²	1	44.1 Å²	44.1	1%	0.01	25%	0.25	C	S	.	.	S	Bend	trans	142	-151.9	-176.2	0	0	0	0	0	111.1	D1051	G1049-D1051 PolarHBondContact O-N 3.43Å
1050	F	95.9	Very high	86.6	Confident	5 Å²	5	49.6 Å²	49.6	2%	0.022	28%	0.28	C	S	.	.	S	Bend	trans	-79.1	67.6	176	-171.8	-110.8	0	0	0	111.5	L1036 Q1037 L1040 I1070 L1073 S1074 L1077 M1100 I1103 V1104	L1036-F1050 HydrophobicContact CD2-CD2 4.45Å; Q1037-F1050 HydrophobicContact CG-CB 4.34Å; L1040-F1050 HydrophobicContact CD1-CB 3.79Å; L1040-F1050 HydrophobicContact CD1-CD2 3.98Å; L1040-F1050 HydrophobicContact CD1-CG 4.4Å; F1050-I1070 HydrophobicContact CD2-CD1 4.16Å; F1050-I1070 HydrophobicContact CD2-CG1 3.94Å; F1050-I1070 HydrophobicContact CE2-CD1 3.63Å; F1050-I1070 HydrophobicContact CE2-CG1 3.76Å; F1050-I1070 VanDerWaalsContact CE2-O 3.23Å; F1050-I1070 WeakPolarHBondContact CE2-O 3.4Å; F1050-L1073 HydrophobicContact CZ-CG 4.43Å; F1050-S1074 PolarHBondContact O-OG 2.9Å; F1050-S1074 VanDerWaalsContact O-OG 3.09Å; F1050-L1077 HydrophobicContact CE1-CD1 4.04Å; F1050-L1077 HydrophobicContact CZ-CD1 4.14Å; F1050-M1100 HydrophobicContact CD1-CB 4.45Å; F1050-M1100 HydrophobicContact CE1-CB 3.67Å; F1050-M1100 HydrophobicContact CE1-CG 4.16Å; F1050-M1100 HydrophobicContact CE2-CG 4.36Å; F1050-M1100 HydrophobicContact CE2-SD 4.04Å; F1050-M1100 HydrophobicContact CZ-CB 3.79Å; F1050-M1100 HydrophobicContact CZ-CG 3.95Å; F1050-M1100 HydrophobicContact CZ-SD 3.84Å; F1050-I1103 HydrophobicContact CB-CD1 4.22Å; F1050-I1103 HydrophobicContact CB-CG2 4.37Å; F1050-I1103 HydrophobicContact CD1-CB 4.31Å; F1050-I1103 HydrophobicContact CD1-CD1 4.24Å; F1050-I1103 HydrophobicContact CD1-CG2 4.31Å; F1050-I1103 HydrophobicContact CG-CD1 4.47Å; F1050-V1104 HydrophobicContact CD1-CG2 4.28Å; F1050-V1104 HydrophobicContact CE1-CG2 3.96Å
1051	D	87.7	Confident	86.1	Confident	34 Å²	34	51.3 Å²	51.3	18%	0.182	29%	0.289	C	S	.	.			trans	-123.8	111.2	-173.5	-177.7	3.7	0	0	0	111.7	G1049 S1053 R1163	G1049-D1051 PolarHBondContact O-N 3.43Å; D1051-S1053 VanDerWaalsContact CG-OG 3.28Å; D1051-S1053 WeakPolarHBondContact OD1-CB 3.4Å; D1051-S1053 PolarHBondContact OD1-N 3.32Å; D1051-S1053 PolarHBondContact OD1-OG 2.82Å; D1051-S1053 PolarHBondContact OD2-OG 2.79Å; D1051-R1163 IonicContact OD2-CZ 2.98Å; D1051-R1163 IonicContact OD2-NH1 3.68Å; D1051-R1163 PolarHBondContact OD2-NH1 3.47Å
1052	G	80.1	Confident	86	Confident	2 Å²	2	50 Å²	50	2%	0.021	28%	0.284	C	S	.	.			trans	-98.6	18	175.7	0	0	0	0	0	114.6	L1054 E1055 S1074	G1052-L1054 PolarHBondContact O-N 3.49Å; G1052-E1055 PolarHBondContact O-N 3.25Å; G1052-E1055 VanDerWaalsContact O-O 3.1Å; G1052-S1074 PolarHBondContact N-OG 2.91Å
1053	S	77	Confident	85.8	Confident	56 Å²	56	51.7 Å²	51.7	39%	0.392	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-24.3	-175	53.3	0	0	0	0	115.3	D1051	D1051-S1053 VanDerWaalsContact CG-OG 3.28Å; D1051-S1053 WeakPolarHBondContact OD1-CB 3.4Å; D1051-S1053 PolarHBondContact OD1-N 3.32Å; D1051-S1053 PolarHBondContact OD1-OG 2.82Å; D1051-S1053 PolarHBondContact OD2-OG 2.79Å
1054	L	73.9	Confident	85.6	Confident	159 Å²	159	54.5 Å²	54.5	83%	0.832	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.8	-5.7	175.9	-62	176.4	0	0	0	113.1	G1052	G1052-L1054 PolarHBondContact O-N 3.49Å
1055	E	82	Confident	85.8	Confident	76 Å²	76	53.5 Å²	53.5	36%	0.355	31%	0.307	S	S	.	.	S	Bend	trans	-110.2	147.4	-174.6	-65.9	-62.5	155	0	0	111	G1052 K1072 A1075	G1052-E1055 PolarHBondContact O-N 3.25Å; G1052-E1055 VanDerWaalsContact O-O 3.1Å; E1055-K1072 HydrophobicContact CB-CD 4.32Å; E1055-K1072 WeakPolarHBondContact OE2-CE 3.41Å; E1055-K1072 IonicContact OE2-NZ 3.86Å; E1055-K1072 PolarHBondContact OE2-NZ 2.93Å; E1055-A1075 HydrophobicContact CB-CB 4.18Å; E1055-A1075 WeakPolarHBondContact O-CB 3.46Å
1056	A	84.3	Confident	86.6	Confident	65 Å²	65	49.6 Å²	49.6	54%	0.537	29%	0.29	S	S	.	.			trans	-93.2	141.9	165.4	0	0	0	0	0	109.8	K1072	A1056-K1072 VanDerWaalsContact O-CD 3.28Å; A1056-K1072 WeakPolarHBondContact O-CD 3.44Å; A1056-K1072 PolarHBondContact O-NZ 3.44Å; A1056-K1072 VanDerWaalsContact O-NZ 3.11Å
1057	P	87.6	Confident	87.2	Confident	39 Å²	39	46 Å²	46	25%	0.253	26%	0.263	S	S	.	.			trans	-55.4	138.2	169.1	-17.3	27.7	0	0	0	110.3	A1075 A1076 S1079 W1081	P1057-A1075 HydrophobicContact CG-CB 4.23Å; P1057-A1076 HydrophobicContact CB-CB 4.09Å; P1057-S1079 VanDerWaalsContact CG-OG 3.24Å; P1057-S1079 WeakPolarHBondContact CG-OG 3.43Å; P1057-W1081 HydrophobicContact CB-CH2 4.24Å; P1057-W1081 HydrophobicContact CB-CZ2 3.93Å
1058	D	89.7	Confident	87.3	Confident	54 Å²	54	46.8 Å²	46.8	29%	0.289	27%	0.266	S	S	.	.			trans	-141.5	122.7	176.4	-177.4	76.3	0	0	0	109.4	N1060 D1061 L1062	D1058-N1060 VanDerWaalsContact C-N 3.31Å; D1058-N1060 PolarHBondContact O-N 2.61Å; D1058-N1060 WeakPolarHBondContact OD2-CA 3.36Å; D1058-N1060 VanDerWaalsContact OD2-CB 3.3Å; D1058-N1060 WeakPolarHBondContact OD2-CB 3.28Å; D1058-N1060 PolarHBondContact OD2-N 3.27Å; D1058-N1060 VanDerWaalsContact OD2-N 3.07Å; D1058-D1061 HydrophobicContact CB-CB 4.28Å; D1058-D1061 PolarHBondContact OD2-N 3.15Å; D1058-L1062 VanDerWaalsContact O-CG 3.29Å; D1058-L1062 WeakPolarHBondContact O-CG 3.44Å; D1058-L1062 PolarHBondContact O-N 2.9Å
1059	E	91.2	Very high	87.7	Confident	104 Å²	104	46.8 Å²	46.8	49%	0.486	26%	0.264	S	S	.	.	H	α-helix	trans	-65.9	-34.9	-178.5	-67.6	-175.3	-176.7	0	0	111.8	L1062 S1063 W1081 L1089	E1059-L1062 PolarHBondContact O-N 3Å; E1059-S1063 PolarHBondContact O-N 2.95Å; E1059-S1063 PolarHBondContact O-OG 3.25Å; E1059-W1081 HydrophobicContact CG-CH2 3.61Å; E1059-W1081 HydrophobicContact CG-CZ3 4.01Å; E1059-L1089 HydrophobicContact CG-CD1 4.4Å
1060	N	88.1	Confident	87.8	Confident	116 Å²	116	47.9 Å²	47.9	62%	0.62	27%	0.269	S	S	*	.	H	α-helix	trans	-68.1	-45.8	-177.7	-56.4	-63.8	0	0	0	110.8	D1058 L1062 S1063 D1064	D1058-N1060 VanDerWaalsContact C-N 3.31Å; D1058-N1060 PolarHBondContact O-N 2.61Å; D1058-N1060 WeakPolarHBondContact OD2-CA 3.36Å; D1058-N1060 VanDerWaalsContact OD2-CB 3.3Å; D1058-N1060 WeakPolarHBondContact OD2-CB 3.28Å; D1058-N1060 PolarHBondContact OD2-N 3.27Å; D1058-N1060 VanDerWaalsContact OD2-N 3.07Å; N1060-L1062 PolarHBondContact O-N 2.8Å; N1060-S1063 PolarHBondContact O-N 3.28Å; N1060-D1064 WeakPolarHBondContact O-CA 3.29Å; N1060-D1064 WeakPolarHBondContact O-CB 3.42Å; N1060-D1064 PolarHBondContact O-N 2.87Å
1061	D	86.6	Confident	87.7	Confident	37 Å²	37	49.4 Å²	49.4	20%	0.198	28%	0.275	C	S	.	.	H	α-helix	trans	-64.1	-27.7	176.2	-80	-40.6	0	0	0	112.8	D1058 T1066 K1072	D1058-D1061 HydrophobicContact CB-CB 4.28Å; D1058-D1061 PolarHBondContact OD2-N 3.15Å; D1061-T1066 VanDerWaalsContact OD1-CG2 3.25Å; D1061-T1066 WeakPolarHBondContact OD1-CG2 3.27Å; D1061-T1066 PolarHBondContact OD1-OG1 3.3Å; D1061-K1072 HydrophobicContact CB-CB 4.48Å; D1061-K1072 HydrophobicContact CB-CG 3.86Å; D1061-K1072 WeakPolarHBondContact OD2-CE 3.47Å
1062	L	92.8	Very high	88	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-76.3	-42.3	176.6	-70.8	172.5	0	0	0	112.1	D1058 E1059 N1060 R1069 K1072 L1073 A1076 W1081 L1086 L1089 T1090	D1058-L1062 VanDerWaalsContact O-CG 3.29Å; D1058-L1062 WeakPolarHBondContact O-CG 3.44Å; D1058-L1062 PolarHBondContact O-N 2.9Å; E1059-L1062 PolarHBondContact O-N 3Å; N1060-L1062 PolarHBondContact O-N 2.8Å; L1062-R1069 PolarHBondContact O-NE 3.08Å; L1062-R1069 PolarHBondContact O-NH2 3.11Å; L1062-K1072 HydrophobicContact CD2-CB 4.18Å; L1062-K1072 HydrophobicContact CG-CB 4.47Å; L1062-L1073 HydrophobicContact CD2-CB 3.98Å; L1062-L1073 HydrophobicContact CD2-CD1 4.05Å; L1062-A1076 HydrophobicContact CD1-CB 4.18Å; L1062-W1081 HydrophobicContact CD1-CE3 4.34Å; L1062-W1081 HydrophobicContact CD1-CZ3 3.82Å; L1062-L1086 HydrophobicContact CD1-CD2 3.95Å; L1062-L1089 HydrophobicContact CB-CB 4.48Å; L1062-L1089 HydrophobicContact CD1-CD1 4.21Å; L1062-T1090 HydrophobicContact CB-CG2 4.13Å; L1062-T1090 HydrophobicContact CD2-CG2 4.19Å
1063	S	89.5	Confident	88.8	Confident	50 Å²	50	48.7 Å²	48.7	35%	0.35	27%	0.27	S	S	.	.	H	α-helix	trans	-82.3	-36.9	179.7	-68.1	0	0	0	0	114.1	E1059 N1060 P1065 L1089	E1059-S1063 PolarHBondContact O-N 2.95Å; E1059-S1063 PolarHBondContact O-OG 3.25Å; N1060-S1063 PolarHBondContact O-N 3.28Å; S1063-P1065 WeakPolarHBondContact O-CD 3.25Å; S1063-L1089 WeakPolarHBondContact CA-O 3.44Å; S1063-L1089 WeakPolarHBondContact OG-CD2 3.44Å; S1063-L1089 PolarHBondContact OG-O 3.45Å
1064	D	87	Confident	89.7	Confident	67 Å²	67	46.2 Å²	46.2	36%	0.358	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.9	94.8	172.8	-81.6	-18.2	0	0	0	109.2	K1014 N1060 T1066	K1014-D1064 IonicContact NZ-OD2 3.79Å; K1014-D1064 PolarHBondContact NZ-OD2 3.18Å; N1060-D1064 WeakPolarHBondContact O-CA 3.29Å; N1060-D1064 WeakPolarHBondContact O-CB 3.42Å; N1060-D1064 PolarHBondContact O-N 2.87Å; D1064-T1066 PolarHBondContact O-N 3.1Å
1065	P	89.2	Confident	90.7	Very high	23 Å²	23	38.8 Å²	38.8	15%	0.149	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	134.8	-169.1	22	-33.8	0	0	0	113.2	I884 I1015 S1063	I884-P1065 HydrophobicContact CD1-CB 3.68Å; I884-P1065 HydrophobicContact CD1-CG 3.72Å; I884-P1065 HydrophobicContact CG1-CB 4.08Å; I884-P1065 HydrophobicContact CG1-CG 3.71Å; I1015-P1065 PolarHBondContact N-O 3.43Å; S1063-P1065 WeakPolarHBondContact O-CD 3.25Å
1066	T	90.9	Very high	91.4	Very high	14 Å²	14	35.1 Å²	35.1	9%	0.086	20%	0.197	C	C	.	.	B	Isolated β-bridge	trans	-127	170.9	175.7	62.8	0	0	0	0	111.8	R1013 D1061 D1064 I1068 R1069	R1013-T1066 WeakPolarHBondContact O-CA 3.44Å; D1061-T1066 VanDerWaalsContact OD1-CG2 3.25Å; D1061-T1066 WeakPolarHBondContact OD1-CG2 3.27Å; D1061-T1066 PolarHBondContact OD1-OG1 3.3Å; D1064-T1066 PolarHBondContact O-N 3.1Å; T1066-I1068 PolarHBondContact O-N 3.41Å; T1066-I1068 WeakPolarHBondContact OG1-CG1 3.25Å; T1066-R1069 WeakPolarHBondContact O-CB 3.29Å; T1066-R1069 PolarHBondContact O-N 2.55Å; T1066-R1069 VanDerWaalsContact O-N 3.11Å
1067	D	89.4	Confident	92	Very high	20 Å²	20	32.3 Å²	32.3	11%	0.107	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-12.1	176.6	61.5	-42.9	0	0	0	114.2	W1003 L1005 R1013 I1015	W1003-D1067 HydrophobicContact CB-CB 4.26Å; W1003-D1067 HydrophobicContact CD2-CB 3.98Å; W1003-D1067 HydrophobicContact CE3-CB 3.98Å; W1003-D1067 HydrophobicContact CG-CB 4.11Å; L1005-D1067 HydrophobicContact CD1-CB 4.29Å; R1013-D1067 WeakPolarHBondContact CB-OD1 3.43Å; R1013-D1067 WeakPolarHBondContact CD-OD1 3.44Å; R1013-D1067 IonicContact CZ-OD2 3.39Å; R1013-D1067 IonicContact NH1-OD1 3.07Å; R1013-D1067 IonicContact NH1-OD2 3.52Å; R1013-D1067 PolarHBondContact NH1-OD2 2.88Å; R1013-D1067 PolarHBondContact O-N 3.4Å; I1015-D1067 HydrophobicContact CD1-CB 4.11Å
1068	I	90.5	Very high	92.3	Very high	42 Å²	42	33.7 Å²	33.7	22%	0.215	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114	4.6	179.5	62.9	172.5	0	0	0	113.7	T1066 I1070 Y1071 K1072	T1066-I1068 PolarHBondContact O-N 3.41Å; T1066-I1068 WeakPolarHBondContact OG1-CG1 3.25Å; I1068-I1070 PolarHBondContact O-N 3.28Å; I1068-I1070 VanDerWaalsContact O-N 3.14Å; I1068-Y1071 HydrophobicContact CB-CD2 4.32Å; I1068-Y1071 PolarHBondContact O-N 3.41Å; I1068-K1072 HydrophobicContact CG1-CG 4.46Å; I1068-K1072 PolarHBondContact O-N 2.88Å
1069	R	94.5	Very high	92.4	Very high	19 Å²	19	34.6 Å²	34.6	7%	0.072	18%	0.183	C	C	.	.	H	α-helix	trans	-50	-42.3	-176.2	-174.8	-171.5	-159.7	-161.6	5.7	113.1	D880 L1062 T1066 Y1071 K1072 L1073 T1090	D880-R1069 IonicContact OD1-NH1 3.95Å; D880-R1069 PolarHBondContact OD1-NH1 2.83Å; L1062-R1069 PolarHBondContact O-NE 3.08Å; L1062-R1069 PolarHBondContact O-NH2 3.11Å; T1066-R1069 WeakPolarHBondContact O-CB 3.29Å; T1066-R1069 PolarHBondContact O-N 2.55Å; T1066-R1069 VanDerWaalsContact O-N 3.11Å; R1069-Y1071 VanDerWaalsContact C-N 3.29Å; R1069-Y1071 PolarHBondContact O-N 2.99Å; R1069-K1072 WeakPolarHBondContact O-CB 3.34Å; R1069-K1072 PolarHBondContact O-N 3.39Å; R1069-L1073 WeakPolarHBondContact O-CB 3.47Å; R1069-L1073 PolarHBondContact O-N 2.64Å; R1069-T1090 VanDerWaalsContact NH2-CB 3.25Å; R1069-T1090 PolarHBondContact NH2-O 3.16Å
1070	I	95	Very high	92.5	Very high	23 Å²	23	32.4 Å²	32.4	12%	0.118	19%	0.188	C	C	.	.	H	α-helix	trans	-62.7	-34	-178.3	-165.2	63.3	0	0	0	112.6	I890 L1040 F1050 I1068 L1073 S1074 M1100	I890-I1070 HydrophobicContact CD1-CB 4.49Å; I890-I1070 HydrophobicContact CD1-CD1 3.81Å; I890-I1070 HydrophobicContact CD1-CG1 4.05Å; L1040-I1070 HydrophobicContact CD1-CG1 4.49Å; L1040-I1070 HydrophobicContact CD2-CG1 4.27Å; L1040-I1070 HydrophobicContact CD2-CG2 4.05Å; F1050-I1070 HydrophobicContact CD2-CD1 4.16Å; F1050-I1070 HydrophobicContact CD2-CG1 3.94Å; F1050-I1070 HydrophobicContact CE2-CD1 3.63Å; F1050-I1070 HydrophobicContact CE2-CG1 3.76Å; F1050-I1070 VanDerWaalsContact CE2-O 3.23Å; F1050-I1070 WeakPolarHBondContact CE2-O 3.4Å; I1068-I1070 PolarHBondContact O-N 3.28Å; I1068-I1070 VanDerWaalsContact O-N 3.14Å; I1070-L1073 HydrophobicContact CD1-CD2 4.37Å; I1070-L1073 WeakPolarHBondContact O-CB 3.19Å; I1070-S1074 PolarHBondContact O-N 3.47Å; I1070-M1100 HydrophobicContact CD1-CE 3.95Å; I1070-M1100 HydrophobicContact CD1-SD 4.21Å
1071	Y	94.1	Very high	92.9	Very high	37 Å²	37	30.2 Å²	30.2	15%	0.145	17%	0.171	C	C	.	.	H	α-helix	trans	-79.1	-34.6	177.7	-52.6	-66.8	0	0	0	111.7	L1040 V1047 I1068 R1069 L1073 S1074 A1075	L1040-Y1071 HydrophobicContact CD2-CE1 4.48Å; V1047-Y1071 HydrophobicContact CG1-CE1 3.91Å; V1047-Y1071 WeakPolarHBondContact CG1-OH 3.37Å; V1047-Y1071 HydrophobicContact CG2-CE1 4.49Å; V1047-Y1071 WeakPolarHBondContact CG2-OH 3.37Å; I1068-Y1071 HydrophobicContact CB-CD2 4.32Å; I1068-Y1071 PolarHBondContact O-N 3.41Å; R1069-Y1071 VanDerWaalsContact C-N 3.29Å; R1069-Y1071 PolarHBondContact O-N 2.99Å; Y1071-L1073 VanDerWaalsContact C-N 3.28Å; Y1071-L1073 PolarHBondContact O-N 3.46Å; Y1071-S1074 PolarHBondContact O-N 2.93Å; Y1071-A1075 PolarHBondContact O-N 3.34Å
1072	K	94.5	Very high	93.4	Very high	20 Å²	20	31 Å²	31	9%	0.087	18%	0.179	C	C	.	.	H	α-helix	trans	-61.2	-39	169.9	-62.4	-57.7	-165.5	-174.3	0	111.8	E1055 A1056 D1061 L1062 I1068 R1069 A1075 A1076	E1055-K1072 HydrophobicContact CB-CD 4.32Å; E1055-K1072 WeakPolarHBondContact OE2-CE 3.41Å; E1055-K1072 IonicContact OE2-NZ 3.86Å; E1055-K1072 PolarHBondContact OE2-NZ 2.93Å; A1056-K1072 VanDerWaalsContact O-CD 3.28Å; A1056-K1072 WeakPolarHBondContact O-CD 3.44Å; A1056-K1072 PolarHBondContact O-NZ 3.44Å; A1056-K1072 VanDerWaalsContact O-NZ 3.11Å; D1061-K1072 HydrophobicContact CB-CB 4.48Å; D1061-K1072 HydrophobicContact CB-CG 3.86Å; D1061-K1072 WeakPolarHBondContact OD2-CE 3.47Å; L1062-K1072 HydrophobicContact CD2-CB 4.18Å; L1062-K1072 HydrophobicContact CG-CB 4.47Å; I1068-K1072 HydrophobicContact CG1-CG 4.46Å; I1068-K1072 PolarHBondContact O-N 2.88Å; R1069-K1072 WeakPolarHBondContact O-CB 3.34Å; R1069-K1072 PolarHBondContact O-N 3.39Å; K1072-A1075 PolarHBondContact O-N 3.06Å; K1072-A1076 WeakPolarHBondContact O-CB 3.38Å; K1072-A1076 PolarHBondContact O-N 3.29Å
1073	L	96.8	Very high	93.5	Very high	2 Å²	2	31 Å²	31	1%	0.01	18%	0.18	C	C	.	.	H	α-helix	trans	-63.6	-44.1	174.9	-173.2	64.6	0	0	0	112	F1050 L1062 R1069 I1070 Y1071 A1075 A1076 L1077 L1086 I1092 L1097 M1100	F1050-L1073 HydrophobicContact CZ-CG 4.43Å; L1062-L1073 HydrophobicContact CD2-CB 3.98Å; L1062-L1073 HydrophobicContact CD2-CD1 4.05Å; R1069-L1073 WeakPolarHBondContact O-CB 3.47Å; R1069-L1073 PolarHBondContact O-N 2.64Å; I1070-L1073 HydrophobicContact CD1-CD2 4.37Å; I1070-L1073 WeakPolarHBondContact O-CB 3.19Å; Y1071-L1073 VanDerWaalsContact C-N 3.28Å; Y1071-L1073 PolarHBondContact O-N 3.46Å; L1073-A1075 PolarHBondContact O-N 2.91Å; L1073-A1076 PolarHBondContact O-N 2.74Å; L1073-L1077 WeakPolarHBondContact O-CG 3.44Å; L1073-L1077 PolarHBondContact O-N 2.83Å; L1073-L1086 HydrophobicContact CD1-CB 4.28Å; L1073-L1086 HydrophobicContact CD1-CD1 3.88Å; L1073-L1086 HydrophobicContact CD1-CD2 3.85Å; L1073-L1086 HydrophobicContact CD1-CG 4.22Å; L1073-I1092 HydrophobicContact CD2-CD1 4.11Å; L1073-L1097 HydrophobicContact CD1-CD2 3.91Å; L1073-L1097 HydrophobicContact CD2-CD2 3.83Å; L1073-L1097 HydrophobicContact CG-CD2 4.34Å; L1073-M1100 HydrophobicContact CD2-CE 4.49Å; L1073-M1100 HydrophobicContact CD2-SD 3.48Å; L1073-M1100 WeakPolarHBondContact CD2-SD 3.08Å; L1073-M1100 HydrophobicContact CG-SD 4.49Å
1074	S	96.3	Very high	93.9	Very high	3 Å²	3	33.8 Å²	33.8	2%	0.021	19%	0.187	C	C	.	.	H	α-helix	trans	-59.8	-44.4	173.4	-177.2	0	0	0	0	111.9	F1050 G1052 I1070 Y1071 A1076 L1077 R1078	F1050-S1074 PolarHBondContact O-OG 2.9Å; F1050-S1074 VanDerWaalsContact O-OG 3.09Å; G1052-S1074 PolarHBondContact N-OG 2.91Å; I1070-S1074 PolarHBondContact O-N 3.47Å; Y1071-S1074 PolarHBondContact O-N 2.93Å; S1074-A1076 PolarHBondContact O-N 2.99Å; S1074-L1077 PolarHBondContact O-N 3.03Å; S1074-R1078 VanDerWaalsContact O-CB 3.27Å; S1074-R1078 WeakPolarHBondContact O-CB 3.46Å; S1074-R1078 PolarHBondContact O-N 3.44Å
1075	A	95.3	Very high	94.4	Very high	3 Å²	3	34 Å²	34	3%	0.025	19%	0.186	C	C	.	.	H	α-helix	trans	-61.4	-40.9	176.5	0	0	0	0	0	112.5	E1055 P1057 Y1071 K1072 L1073 R1078 S1079	E1055-A1075 HydrophobicContact CB-CB 4.18Å; E1055-A1075 WeakPolarHBondContact O-CB 3.46Å; P1057-A1075 HydrophobicContact CG-CB 4.23Å; Y1071-A1075 PolarHBondContact O-N 3.34Å; K1072-A1075 PolarHBondContact O-N 3.06Å; L1073-A1075 PolarHBondContact O-N 2.91Å; A1075-R1078 PolarHBondContact O-N 3.46Å; A1075-S1079 WeakPolarHBondContact O-CB 3.36Å; A1075-S1079 PolarHBondContact O-N 3.14Å; A1075-S1079 PolarHBondContact O-OG 2.71Å
1076	A	97.1	Very high	94.8	Very high	0 Å²	0	33 Å²	33	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-66.4	-47.1	178.5	0	0	0	0	0	112.4	P1057 L1062 K1072 L1073 S1074 R1078 S1079 G1080 W1081 L1086	P1057-A1076 HydrophobicContact CB-CB 4.09Å; L1062-A1076 HydrophobicContact CD1-CB 4.18Å; K1072-A1076 WeakPolarHBondContact O-CB 3.38Å; K1072-A1076 PolarHBondContact O-N 3.29Å; L1073-A1076 PolarHBondContact O-N 2.74Å; S1074-A1076 PolarHBondContact O-N 2.99Å; A1076-R1078 VanDerWaalsContact C-N 3.28Å; A1076-R1078 PolarHBondContact O-N 3.28Å; A1076-S1079 CarbonylContact O-C 3.58Å; A1076-S1079 PolarHBondContact O-N 3.26Å; A1076-S1079 VanDerWaalsContact O-N 3.11Å; A1076-G1080 PolarHBondContact O-N 2.87Å; A1076-W1081 HydrophobicContact CB-CB 4.41Å; A1076-W1081 HydrophobicContact CB-CD2 3.94Å; A1076-W1081 HydrophobicContact CB-CE3 3.84Å; A1076-W1081 HydrophobicContact CB-CG 4.22Å; A1076-W1081 HydrophobicContact CB-CZ3 4.41Å; A1076-W1081 WeakPolarHBondContact O-CB 3.41Å; A1076-W1081 PolarHBondContact O-N 2.87Å; A1076-W1081 VanDerWaalsContact O-N 3.13Å; A1076-L1086 HydrophobicContact CB-CD2 3.82Å
1077	L	96.8	Very high	95	Very high	5 Å²	5	35 Å²	35	3%	0.026	19%	0.188	C	C	.	.	H	α-helix	trans	-58.9	-41.1	173.3	-75.2	170.5	0	0	0	111.4	F1050 L1073 S1074 S1079 G1080 L1086 M1100 R1101 V1104	F1050-L1077 HydrophobicContact CE1-CD1 4.04Å; F1050-L1077 HydrophobicContact CZ-CD1 4.14Å; L1073-L1077 WeakPolarHBondContact O-CG 3.44Å; L1073-L1077 PolarHBondContact O-N 2.83Å; S1074-L1077 PolarHBondContact O-N 3.03Å; L1077-S1079 VanDerWaalsContact C-N 3.3Å; L1077-S1079 PolarHBondContact O-N 3.39Å; L1077-G1080 PolarHBondContact O-N 3.01Å; L1077-L1086 HydrophobicContact CD2-CD1 3.38Å; L1077-L1086 HydrophobicContact CG-CD1 3.62Å; L1077-M1100 HydrophobicContact CD1-CB 3.88Å; L1077-R1101 HydrophobicContact CD2-CB 4.01Å; L1077-R1101 HydrophobicContact CD2-CG 4.19Å; L1077-V1104 HydrophobicContact CB-CB 4.42Å; L1077-V1104 HydrophobicContact CB-CG1 4.38Å; L1077-V1104 HydrophobicContact CB-CG2 3.97Å; L1077-V1104 HydrophobicContact CD1-CG2 4.43Å
1078	R	92.6	Very high	95.3	Very high	68 Å²	68	37.7 Å²	37.7	26%	0.257	21%	0.212	S	C	.	.	H	α-helix	trans	-65.3	-35.1	176.8	-169.6	174.3	174.8	94.1	5.9	112	S1074 A1075 A1076 G1080 V1104 K1108 E1111	S1074-R1078 VanDerWaalsContact O-CB 3.27Å; S1074-R1078 WeakPolarHBondContact O-CB 3.46Å; S1074-R1078 PolarHBondContact O-N 3.44Å; A1075-R1078 PolarHBondContact O-N 3.46Å; A1076-R1078 VanDerWaalsContact C-N 3.28Å; A1076-R1078 PolarHBondContact O-N 3.28Å; R1078-G1080 PolarHBondContact O-N 3.11Å; R1078-V1104 HydrophobicContact CB-CG1 3.92Å; R1078-V1104 HydrophobicContact CG-CG1 4.37Å; R1078-K1108 WeakPolarHBondContact O-CE 3.4Å; R1078-K1108 PolarHBondContact O-NZ 3.02Å; R1078-E1111 IonicContact CZ-OE1 2.8Å; R1078-E1111 VanDerWaalsContact CZ-OE1 3.26Å; R1078-E1111 IonicContact CZ-OE2 3.97Å; R1078-E1111 IonicContact NH1-OE1 2.72Å; R1078-E1111 PolarHBondContact NH1-OE1 3.49Å; R1078-E1111 IonicContact NH1-OE2 4Å; R1078-E1111 IonicContact NH2-OE1 3.15Å; R1078-E1111 PolarHBondContact NH2-OE1 3.28Å; R1078-E1111 IonicContact NH2-OE2 3.39Å; R1078-E1111 PolarHBondContact NH2-OE2 3.31Å
1079	S	93.2	Very high	95.5	Very high	74 Å²	74	37.1 Å²	37.1	52%	0.517	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-2.3	173.7	-56.5	0	0	0	0	113.8	P1057 A1075 A1076 L1077	P1057-S1079 VanDerWaalsContact CG-OG 3.24Å; P1057-S1079 WeakPolarHBondContact CG-OG 3.43Å; A1075-S1079 WeakPolarHBondContact O-CB 3.36Å; A1075-S1079 PolarHBondContact O-N 3.14Å; A1075-S1079 PolarHBondContact O-OG 2.71Å; A1076-S1079 CarbonylContact O-C 3.58Å; A1076-S1079 PolarHBondContact O-N 3.26Å; A1076-S1079 VanDerWaalsContact O-N 3.11Å; L1077-S1079 VanDerWaalsContact C-N 3.3Å; L1077-S1079 PolarHBondContact O-N 3.39Å
1080	G	91.8	Very high	95.5	Very high	57 Å²	57	36.4 Å²	36.4	59%	0.588	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	88.3	18.1	174	0	0	0	0	0	114.7	A1076 L1077 R1078	A1076-G1080 PolarHBondContact O-N 2.87Å; L1077-G1080 PolarHBondContact O-N 3.01Å; R1078-G1080 PolarHBondContact O-N 3.11Å
1081	W	96.8	Very high	95.5	Very high	70 Å²	70	37.7 Å²	37.7	27%	0.265	22%	0.218	S	C	.	.			trans	-65.8	142.7	175.1	-68.6	20.2	0	0	0	110.7	P1057 E1059 L1062 A1076 H1085 L1086 L1089	P1057-W1081 HydrophobicContact CB-CH2 4.24Å; P1057-W1081 HydrophobicContact CB-CZ2 3.93Å; E1059-W1081 HydrophobicContact CG-CH2 3.61Å; E1059-W1081 HydrophobicContact CG-CZ3 4.01Å; L1062-W1081 HydrophobicContact CD1-CE3 4.34Å; L1062-W1081 HydrophobicContact CD1-CZ3 3.82Å; A1076-W1081 HydrophobicContact CB-CB 4.41Å; A1076-W1081 HydrophobicContact CB-CD2 3.94Å; A1076-W1081 HydrophobicContact CB-CE3 3.84Å; A1076-W1081 HydrophobicContact CB-CG 4.22Å; A1076-W1081 HydrophobicContact CB-CZ3 4.41Å; A1076-W1081 WeakPolarHBondContact O-CB 3.41Å; A1076-W1081 PolarHBondContact O-N 2.87Å; A1076-W1081 VanDerWaalsContact O-N 3.13Å; W1081-H1085 AromaticContact CD2-CD2 4Å; W1081-H1085 AromaticContact CE3-CD2 3.51Å; W1081-H1085 AromaticContact CE3-NE2 3.65Å; W1081-H1085 AromaticContact CZ3-NE2 3.72Å; W1081-L1086 HydrophobicContact CB-CD2 4.44Å; W1081-L1086 HydrophobicContact CB-CG 4.34Å; W1081-L1086 HydrophobicContact CE3-CD2 3.82Å; W1081-L1089 HydrophobicContact CE3-CD1 4.32Å; W1081-L1089 HydrophobicContact CZ3-CD1 3.79Å
1082	S	96.8	Very high	95.6	Very high	53 Å²	53	36.1 Å²	36.1	37%	0.371	21%	0.212	S	C	.	.			trans	-75.4	154.8	-177.7	98.3	0	0	0	0	111.6	E1084 H1085 L1086	S1082-E1084 VanDerWaalsContact C-N 3.28Å; S1082-E1084 WeakPolarHBondContact CB-OE2 3.35Å; S1082-E1084 PolarHBondContact O-N 3.34Å; S1082-E1084 PolarHBondContact OG-N 3.21Å; S1082-E1084 PolarHBondContact OG-OE2 2.99Å; S1082-H1085 PolarHBondContact O-N 3.16Å; S1082-H1085 PolarHBondContact OG-N 3.04Å; S1082-L1086 WeakPolarHBondContact O-CG 3.43Å; S1082-L1086 PolarHBondContact O-N 3.32Å
1083	V	96.6	Very high	95.7	Very high	1 Å²	1	36 Å²	36	1%	0.006	21%	0.212	C	C	.	.	H	α-helix	trans	-66.1	-35.3	179	166.6	0	0	0	0	110.8	H1085 L1086 H1087 P1094 L1097 Y1098	V1083-H1085 VanDerWaalsContact C-N 3.34Å; V1083-H1085 PolarHBondContact O-N 2.99Å; V1083-L1086 PolarHBondContact O-N 3.15Å; V1083-H1087 VanDerWaalsContact O-CB 3.26Å; V1083-H1087 WeakPolarHBondContact O-CB 3.05Å; V1083-H1087 PolarHBondContact O-N 3.24Å; V1083-P1094 HydrophobicContact CG1-CB 4.09Å; V1083-L1097 HydrophobicContact CB-CB 4.48Å; V1083-L1097 HydrophobicContact CG1-CB 3.69Å; V1083-L1097 HydrophobicContact CG1-CD1 4.02Å; V1083-L1097 HydrophobicContact CG2-CB 4.22Å; V1083-Y1098 HydrophobicContact CB-CD1 4.29Å; V1083-Y1098 HydrophobicContact CB-CE1 3.84Å; V1083-Y1098 HydrophobicContact CG1-CD1 4.3Å; V1083-Y1098 HydrophobicContact CG1-CD2 4.28Å; V1083-Y1098 HydrophobicContact CG1-CE1 4.02Å; V1083-Y1098 HydrophobicContact CG1-CE2 3.99Å; V1083-Y1098 HydrophobicContact CG1-CG 4.42Å; V1083-Y1098 HydrophobicContact CG2-CD1 3.71Å; V1083-Y1098 HydrophobicContact CG2-CE1 3.66Å; V1083-Y1098 HydrophobicContact CG2-CG 4.41Å
1084	E	95.9	Very high	95.7	Very high	108 Å²	108	37.2 Å²	37.2	51%	0.505	22%	0.22	S	C	.	.	H	α-helix	trans	-64.1	-41.2	177.2	-55.3	72.3	-157.7	0	0	111.1	S1082 A1088 Y1098	S1082-E1084 VanDerWaalsContact C-N 3.28Å; S1082-E1084 WeakPolarHBondContact CB-OE2 3.35Å; S1082-E1084 PolarHBondContact O-N 3.34Å; S1082-E1084 PolarHBondContact OG-N 3.21Å; S1082-E1084 PolarHBondContact OG-OE2 2.99Å; E1084-A1088 WeakPolarHBondContact O-CB 3.47Å; E1084-A1088 PolarHBondContact O-N 2.81Å; E1084-Y1098 PolarHBondContact OE1-OH 3.1Å
1085	H	97.7	Very high	95.8	Very high	73 Å²	73	37 Å²	37	34%	0.338	22%	0.219	S	C	.	.	H	α-helix	trans	-66.6	-45	176.2	-178.6	50.2	0	0	0	111.5	W1081 S1082 V1083 A1088 L1089	W1081-H1085 AromaticContact CD2-CD2 4Å; W1081-H1085 AromaticContact CE3-CD2 3.51Å; W1081-H1085 AromaticContact CE3-NE2 3.65Å; W1081-H1085 AromaticContact CZ3-NE2 3.72Å; S1082-H1085 PolarHBondContact O-N 3.16Å; S1082-H1085 PolarHBondContact OG-N 3.04Å; V1083-H1085 VanDerWaalsContact C-N 3.34Å; V1083-H1085 PolarHBondContact O-N 2.99Å; H1085-A1088 WeakPolarHBondContact O-CB 3.46Å; H1085-A1088 PolarHBondContact O-N 3.46Å; H1085-L1089 WeakPolarHBondContact O-CG 3.47Å; H1085-L1089 PolarHBondContact O-N 3.24Å
1086	L	97.6	Very high	95.9	Very high	0 Å²	0	37 Å²	37	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-65.2	-39.1	177	-68.9	173.3	0	0	0	112.4	L1062 L1073 A1076 L1077 W1081 S1082 V1083 L1089 T1090 L1097	L1062-L1086 HydrophobicContact CD1-CD2 3.95Å; L1073-L1086 HydrophobicContact CD1-CB 4.28Å; L1073-L1086 HydrophobicContact CD1-CD1 3.88Å; L1073-L1086 HydrophobicContact CD1-CD2 3.85Å; L1073-L1086 HydrophobicContact CD1-CG 4.22Å; A1076-L1086 HydrophobicContact CB-CD2 3.82Å; L1077-L1086 HydrophobicContact CD2-CD1 3.38Å; L1077-L1086 HydrophobicContact CG-CD1 3.62Å; W1081-L1086 HydrophobicContact CB-CD2 4.44Å; W1081-L1086 HydrophobicContact CB-CG 4.34Å; W1081-L1086 HydrophobicContact CE3-CD2 3.82Å; S1082-L1086 WeakPolarHBondContact O-CG 3.43Å; S1082-L1086 PolarHBondContact O-N 3.32Å; V1083-L1086 PolarHBondContact O-N 3.15Å; L1086-L1089 PolarHBondContact O-N 3.17Å; L1086-T1090 WeakPolarHBondContact O-CB 3.17Å; L1086-T1090 WeakPolarHBondContact O-CG2 3.29Å; L1086-T1090 PolarHBondContact O-N 3.36Å; L1086-T1090 PolarHBondContact O-OG1 3.13Å; L1086-L1097 HydrophobicContact CB-CD1 4.02Å; L1086-L1097 HydrophobicContact CB-CD2 4.49Å
1087	H	96.3	Very high	96	Very high	58 Å²	58	37 Å²	37	27%	0.269	22%	0.218	S	C	.	.	H	α-helix	trans	-61.1	-44.3	172.7	176	64.3	0	0	0	111	V1083 L1089 T1090 S1091 I1092 P1094 L1097	V1083-H1087 VanDerWaalsContact O-CB 3.26Å; V1083-H1087 WeakPolarHBondContact O-CB 3.05Å; V1083-H1087 PolarHBondContact O-N 3.24Å; H1087-L1089 VanDerWaalsContact C-N 3.28Å; H1087-L1089 PolarHBondContact O-N 3.17Å; H1087-T1090 PolarHBondContact O-N 3.14Å; H1087-S1091 WeakPolarHBondContact O-CA 3.49Å; H1087-S1091 PolarHBondContact O-N 3.5Å; H1087-I1092 PolarHBondContact ND1-O 2.9Å; H1087-P1094 HydrophobicContact CB-CG 4.43Å; H1087-L1097 HydrophobicContact CB-CD1 3.91Å
1088	A	94.4	Very high	96	Very high	75 Å²	75	38.8 Å²	38.8	62%	0.62	23%	0.225	S	C	*	.	H	α-helix	trans	-61.7	-34.8	176.9	0	0	0	0	0	112.9	E1084 H1085	E1084-A1088 WeakPolarHBondContact O-CB 3.47Å; E1084-A1088 PolarHBondContact O-N 2.81Å; H1085-A1088 WeakPolarHBondContact O-CB 3.46Å; H1085-A1088 PolarHBondContact O-N 3.46Å
1089	L	94.6	Very high	96.2	Very high	31 Å²	31	36.4 Å²	36.4	16%	0.162	22%	0.216	C	C	.	.	H	α-helix	trans	-78.4	-38.7	177.7	-69.2	175.3	0	0	0	113.2	E1059 L1062 S1063 W1081 H1085 L1086 H1087	E1059-L1089 HydrophobicContact CG-CD1 4.4Å; L1062-L1089 HydrophobicContact CB-CB 4.48Å; L1062-L1089 HydrophobicContact CD1-CD1 4.21Å; S1063-L1089 WeakPolarHBondContact CA-O 3.44Å; S1063-L1089 WeakPolarHBondContact OG-CD2 3.44Å; S1063-L1089 PolarHBondContact OG-O 3.45Å; W1081-L1089 HydrophobicContact CE3-CD1 4.32Å; W1081-L1089 HydrophobicContact CZ3-CD1 3.79Å; H1085-L1089 WeakPolarHBondContact O-CG 3.47Å; H1085-L1089 PolarHBondContact O-N 3.24Å; L1086-L1089 PolarHBondContact O-N 3.17Å; H1087-L1089 VanDerWaalsContact C-N 3.28Å; H1087-L1089 PolarHBondContact O-N 3.17Å
1090	T	95.3	Very high	96.4	Very high	4 Å²	4	32.9 Å²	32.9	3%	0.025	19%	0.192	C	C	.	.	H	α-helix	trans	-106.4	-22.5	-166.3	63.8	0	0	0	0	114.8	P881 L1062 R1069 L1086 H1087 I1092	P881-T1090 WeakPolarHBondContact CG-O 3.25Å; L1062-T1090 HydrophobicContact CB-CG2 4.13Å; L1062-T1090 HydrophobicContact CD2-CG2 4.19Å; R1069-T1090 VanDerWaalsContact NH2-CB 3.25Å; R1069-T1090 PolarHBondContact NH2-O 3.16Å; L1086-T1090 WeakPolarHBondContact O-CB 3.17Å; L1086-T1090 WeakPolarHBondContact O-CG2 3.29Å; L1086-T1090 PolarHBondContact O-N 3.36Å; L1086-T1090 PolarHBondContact O-OG1 3.13Å; H1087-T1090 PolarHBondContact O-N 3.14Å; T1090-I1092 HydrophobicContact CG2-CD1 4.38Å; T1090-I1092 PolarHBondContact O-N 3.47Å; T1090-I1092 WeakPolarHBondContact OG1-CB 3.43Å; T1090-I1092 PolarHBondContact OG1-N 3.1Å
1091	S	94.4	Very high	96.7	Very high	49 Å²	49	33.7 Å²	33.7	34%	0.343	18%	0.177	S	C	.	.			trans	54.5	15.5	-165.1	-46.3	0	0	0	0	115.1	H1087	H1087-S1091 WeakPolarHBondContact O-CA 3.49Å; H1087-S1091 PolarHBondContact O-N 3.5Å
1092	I	97.1	Very high	96.6	Very high	5 Å²	5	32.1 Å²	32.1	3%	0.026	18%	0.177	C	C	.	.			trans	-66.4	135.6	169.8	-65.3	171.5	0	0	0	108.4	V879 L1073 H1087 T1090 F1096 L1097	V879-I1092 HydrophobicContact CG1-CG2 3.83Å; L1073-I1092 HydrophobicContact CD2-CD1 4.11Å; H1087-I1092 PolarHBondContact ND1-O 2.9Å; T1090-I1092 HydrophobicContact CG2-CD1 4.38Å; T1090-I1092 PolarHBondContact O-N 3.47Å; T1090-I1092 WeakPolarHBondContact OG1-CB 3.43Å; T1090-I1092 PolarHBondContact OG1-N 3.1Å; I1092-F1096 HydrophobicContact CG2-CB 4Å; I1092-L1097 HydrophobicContact CB-CD2 4.22Å; I1092-L1097 HydrophobicContact CB-CG 4.29Å; I1092-L1097 HydrophobicContact CG2-CD2 3.96Å; I1092-L1097 HydrophobicContact CG2-CG 3.94Å
1093	D	97.1	Very high	96.6	Very high	16 Å²	16	29.7 Å²	29.7	9%	0.086	16%	0.16	C	C	.	.			trans	-56.5	134.6	-178.1	-171	-72.4	0	0	0	111.4	S339 K856 T897 W1095 F1096 L1097	S339-D1093 WeakPolarHBondContact CB-OD1 3.48Å; S339-D1093 PolarHBondContact OG-OD1 3.02Å; S339-D1093 PolarHBondContact OG-OD2 3.05Å; K856-D1093 WeakPolarHBondContact CE-OD2 3.24Å; K856-D1093 IonicContact NZ-OD2 2.79Å; K856-D1093 PolarHBondContact NZ-OD2 3.29Å; T897-D1093 HydrophobicContact CG2-CB 4.37Å; D1093-W1095 PolarHBondContact O-N 2.8Å; D1093-W1095 VanDerWaalsContact O-N 3.08Å; D1093-W1095 WeakPolarHBondContact OD1-CB 3.16Å; D1093-W1095 PolarHBondContact OD1-N 3.2Å; D1093-F1096 HydrophobicContact CB-CD2 3.92Å; D1093-F1096 HydrophobicContact CB-CE2 4.35Å; D1093-F1096 PolarHBondContact O-N 3.01Å; D1093-F1096 VanDerWaalsContact O-N 3.12Å; D1093-L1097 PolarHBondContact O-N 2.98Å
1094	P	97	Very high	96.6	Very high	28 Å²	28	29.9 Å²	29.9	18%	0.182	16%	0.161	C	C	.	.	H	α-helix	trans	-51.4	-33.3	-179.8	-29.8	36.2	0	0	0	114.5	V1083 H1087 F1096 L1097 Y1098	V1083-P1094 HydrophobicContact CG1-CB 4.09Å; H1087-P1094 HydrophobicContact CB-CG 4.43Å; P1094-F1096 PolarHBondContact O-N 2.83Å; P1094-L1097 PolarHBondContact O-N 3.03Å; P1094-Y1098 HydrophobicContact CB-CD2 4.31Å; P1094-Y1098 HydrophobicContact CB-CE2 4.04Å; P1094-Y1098 WeakPolarHBondContact O-CD2 3.42Å; P1094-Y1098 PolarHBondContact O-N 3.5Å
1095	W	97.2	Very high	96.5	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-58.7	-49.9	178.7	-175.3	88.1	0	0	0	111.5	N301 E337 Q896 T897 F1032 D1093 L1097 Y1098 R1099	N301-W1095 HydrophobicContact CB-CZ2 4.25Å; E337-W1095 VanDerWaalsContact O-CD1 3.23Å; Q896-W1095 HydrophobicContact CB-CE3 3.84Å; Q896-W1095 HydrophobicContact CB-CH2 3.77Å; Q896-W1095 HydrophobicContact CB-CZ2 4.44Å; Q896-W1095 HydrophobicContact CB-CZ3 3.44Å; Q896-W1095 VanDerWaalsContact CB-CZ3 3.44Å; Q896-W1095 HydrophobicContact CG-CE3 4.47Å; Q896-W1095 HydrophobicContact CG-CH2 3.81Å; Q896-W1095 HydrophobicContact CG-CZ3 3.62Å; T897-W1095 HydrophobicContact CG2-CB 3.93Å; T897-W1095 HydrophobicContact CG2-CD2 4.44Å; T897-W1095 HydrophobicContact CG2-CE3 4.33Å; T897-W1095 HydrophobicContact CG2-CG 4.31Å; F1032-W1095 HydrophobicContact CB-CH2 4.03Å; F1032-W1095 HydrophobicContact CB-CZ3 4.36Å; F1032-W1095 HydrophobicContact CD1-CZ3 4.49Å; F1032-W1095 HydrophobicContact CG-CH2 4.41Å; F1032-W1095 HydrophobicContact CG-CZ3 4.25Å; D1093-W1095 PolarHBondContact O-N 2.8Å; D1093-W1095 VanDerWaalsContact O-N 3.08Å; D1093-W1095 WeakPolarHBondContact OD1-CB 3.16Å; D1093-W1095 PolarHBondContact OD1-N 3.2Å; W1095-L1097 VanDerWaalsContact C-N 3.31Å; W1095-L1097 PolarHBondContact O-N 2.76Å; W1095-Y1098 PolarHBondContact O-N 3.37Å; W1095-R1099 HydrophobicContact CD2-CG 4.04Å; W1095-R1099 HydrophobicContact CE3-CG 4.01Å; W1095-R1099 HydrophobicContact CH2-CG 3.86Å; W1095-R1099 HydrophobicContact CZ2-CG 3.88Å; W1095-R1099 HydrophobicContact CZ3-CG 3.91Å; W1095-R1099 WeakPolarHBondContact O-CG 3.42Å; W1095-R1099 PolarHBondContact O-N 3.24Å
1096	F	98	Very high	96.4	Very high	1 Å²	1	24.9 Å²	24.9	0%	0.004	14%	0.141	C	C	.	.	H	α-helix	trans	-60.5	-41.5	177.6	-67.5	-63.4	0	0	0	111.8	E877 V879 V892 Q896 T897 F1032 I1092 D1093 P1094 Y1098 R1099 M1100	E877-F1096 HydrophobicContact CG-CE2 4.48Å; E877-F1096 HydrophobicContact CG-CZ 4.42Å; V879-F1096 HydrophobicContact CG1-CB 4.18Å; V879-F1096 HydrophobicContact CG1-CD2 4.22Å; V879-F1096 HydrophobicContact CG1-CG 4.1Å; V879-F1096 HydrophobicContact CG2-CD1 4.09Å; V879-F1096 HydrophobicContact CG2-CD2 4.47Å; V879-F1096 HydrophobicContact CG2-CE1 4.04Å; V879-F1096 HydrophobicContact CG2-CE2 4.43Å; V879-F1096 HydrophobicContact CG2-CG 4.32Å; V879-F1096 HydrophobicContact CG2-CZ 4.22Å; V892-F1096 HydrophobicContact CG2-CE1 3.86Å; V892-F1096 HydrophobicContact CG2-CZ 4.29Å; Q896-F1096 HydrophobicContact CB-CE1 4.06Å; Q896-F1096 HydrophobicContact CB-CZ 4.06Å; Q896-F1096 HydrophobicContact CG-CE1 3.95Å; Q896-F1096 HydrophobicContact CG-CZ 4.26Å; T897-F1096 HydrophobicContact CG2-CE2 4.14Å; T897-F1096 HydrophobicContact CG2-CZ 4.44Å; F1032-F1096 HydrophobicContact CD2-CD1 4.3Å; F1032-F1096 HydrophobicContact CD2-CE1 4.31Å; F1032-F1096 HydrophobicContact CE1-CD1 4.1Å; F1032-F1096 AromaticContact CE2-CD1 3.79Å; F1032-F1096 HydrophobicContact CE2-CD1 3.79Å; F1032-F1096 AromaticContact CE2-CE1 4Å; F1032-F1096 HydrophobicContact CE2-CE1 4Å; F1032-F1096 AromaticContact CZ-CD1 3.67Å; F1032-F1096 HydrophobicContact CZ-CD1 3.67Å; F1032-F1096 HydrophobicContact CZ-CE1 4.34Å; I1092-F1096 HydrophobicContact CG2-CB 4Å; D1093-F1096 HydrophobicContact CB-CD2 3.92Å; D1093-F1096 HydrophobicContact CB-CE2 4.35Å; D1093-F1096 PolarHBondContact O-N 3.01Å; D1093-F1096 VanDerWaalsContact O-N 3.12Å; P1094-F1096 PolarHBondContact O-N 2.83Å; F1096-Y1098 VanDerWaalsContact C-N 3.35Å; F1096-Y1098 PolarHBondContact O-N 2.78Å; F1096-R1099 PolarHBondContact O-N 3.29Å; F1096-M1100 WeakPolarHBondContact O-CG 3.37Å; F1096-M1100 PolarHBondContact O-N 3.03Å
1097	L	98.2	Very high	96.2	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-63.7	-39.1	177.9	-65.5	177.2	0	0	0	112.1	L1073 V1083 L1086 H1087 I1092 D1093 P1094 W1095 M1100 R1101	L1073-L1097 HydrophobicContact CD1-CD2 3.91Å; L1073-L1097 HydrophobicContact CD2-CD2 3.83Å; L1073-L1097 HydrophobicContact CG-CD2 4.34Å; V1083-L1097 HydrophobicContact CB-CB 4.48Å; V1083-L1097 HydrophobicContact CG1-CB 3.69Å; V1083-L1097 HydrophobicContact CG1-CD1 4.02Å; V1083-L1097 HydrophobicContact CG2-CB 4.22Å; L1086-L1097 HydrophobicContact CB-CD1 4.02Å; L1086-L1097 HydrophobicContact CB-CD2 4.49Å; H1087-L1097 HydrophobicContact CB-CD1 3.91Å; I1092-L1097 HydrophobicContact CB-CD2 4.22Å; I1092-L1097 HydrophobicContact CB-CG 4.29Å; I1092-L1097 HydrophobicContact CG2-CD2 3.96Å; I1092-L1097 HydrophobicContact CG2-CG 3.94Å; D1093-L1097 PolarHBondContact O-N 2.98Å; P1094-L1097 PolarHBondContact O-N 3.03Å; W1095-L1097 VanDerWaalsContact C-N 3.31Å; W1095-L1097 PolarHBondContact O-N 2.76Å; L1097-M1100 PolarHBondContact O-N 2.69Å; L1097-R1101 WeakPolarHBondContact O-CB 3.43Å; L1097-R1101 PolarHBondContact O-N 2.8Å
1098	Y	97.4	Very high	96	Very high	43 Å²	43	26.6 Å²	26.6	17%	0.169	15%	0.15	C	C	.	.	H	α-helix	trans	-62.6	-44	173.3	-75.9	-55.6	0	0	0	111.8	E337 V1083 E1084 P1094 W1095 F1096 M1100 R1101 S1102	E337-Y1098 HydrophobicContact CB-CD2 3.8Å; E337-Y1098 HydrophobicContact CB-CE2 4.4Å; E337-Y1098 HydrophobicContact CB-CG 3.89Å; E337-Y1098 HydrophobicContact CG-CD1 4.14Å; E337-Y1098 HydrophobicContact CG-CD2 4.24Å; E337-Y1098 HydrophobicContact CG-CG 3.98Å; V1083-Y1098 HydrophobicContact CB-CD1 4.29Å; V1083-Y1098 HydrophobicContact CB-CE1 3.84Å; V1083-Y1098 HydrophobicContact CG1-CD1 4.3Å; V1083-Y1098 HydrophobicContact CG1-CD2 4.28Å; V1083-Y1098 HydrophobicContact CG1-CE1 4.02Å; V1083-Y1098 HydrophobicContact CG1-CE2 3.99Å; V1083-Y1098 HydrophobicContact CG1-CG 4.42Å; V1083-Y1098 HydrophobicContact CG2-CD1 3.71Å; V1083-Y1098 HydrophobicContact CG2-CE1 3.66Å; V1083-Y1098 HydrophobicContact CG2-CG 4.41Å; E1084-Y1098 PolarHBondContact OE1-OH 3.1Å; P1094-Y1098 HydrophobicContact CB-CD2 4.31Å; P1094-Y1098 HydrophobicContact CB-CE2 4.04Å; P1094-Y1098 WeakPolarHBondContact O-CD2 3.42Å; P1094-Y1098 PolarHBondContact O-N 3.5Å; W1095-Y1098 PolarHBondContact O-N 3.37Å; F1096-Y1098 VanDerWaalsContact C-N 3.35Å; F1096-Y1098 PolarHBondContact O-N 2.78Å; Y1098-M1100 PolarHBondContact O-N 2.83Å; Y1098-R1101 VanDerWaalsContact CD1-CZ 3.42Å; Y1098-R1101 VanDerWaalsContact CE1-CZ 3.48Å; Y1098-R1101 WeakPolarHBondContact O-CB 3.48Å; Y1098-R1101 PolarHBondContact O-N 2.95Å; Y1098-S1102 PolarHBondContact O-N 2.87Å; Y1098-S1102 PolarHBondContact O-OG 3.14Å
1099	R	96.5	Very high	95.8	Very high	18 Å²	18	27.1 Å²	27.1	7%	0.068	14%	0.14	C	C	.	.	H	α-helix	trans	-63.3	-42.2	176.6	-55.7	-37.9	-57.6	-140.4	-15.5	112.1	E333 F1032 E1033 W1095 F1096 R1101 S1102 I1103	E333-R1099 IonicContact OE1-CZ 3.13Å; E333-R1099 IonicContact OE1-NH1 3.2Å; E333-R1099 PolarHBondContact OE1-NH1 3.17Å; E333-R1099 IonicContact OE1-NH2 3.69Å; E333-R1099 PolarHBondContact OE1-NH2 2.98Å; F1032-R1099 HydrophobicContact CD1-CB 3.59Å; F1032-R1099 HydrophobicContact CD1-CG 4.09Å; F1032-R1099 HydrophobicContact CE1-CB 3.98Å; E1033-R1099 HydrophobicContact CG-CB 4.37Å; E1033-R1099 WeakPolarHBondContact CG-O 3.42Å; E1033-R1099 IonicContact OE1-CZ 3.02Å; E1033-R1099 IonicContact OE1-NE 2.55Å; E1033-R1099 PolarHBondContact OE1-NE 3.01Å; E1033-R1099 IonicContact OE1-NH2 3.89Å; E1033-R1099 PolarHBondContact OE1-NH2 3.14Å; E1033-R1099 IonicContact OE2-CZ 3.61Å; E1033-R1099 IonicContact OE2-NE 2.92Å; E1033-R1099 IonicContact OE2-NH2 2.86Å; E1033-R1099 PolarHBondContact OE2-NH2 2.94Å; W1095-R1099 HydrophobicContact CD2-CG 4.04Å; W1095-R1099 HydrophobicContact CE3-CG 4.01Å; W1095-R1099 HydrophobicContact CH2-CG 3.86Å; W1095-R1099 HydrophobicContact CZ2-CG 3.88Å; W1095-R1099 HydrophobicContact CZ3-CG 3.91Å; W1095-R1099 WeakPolarHBondContact O-CG 3.42Å; W1095-R1099 PolarHBondContact O-N 3.24Å; F1096-R1099 PolarHBondContact O-N 3.29Å; R1099-R1101 VanDerWaalsContact C-N 3.32Å; R1099-R1101 PolarHBondContact O-N 3.38Å; R1099-S1102 WeakPolarHBondContact O-CB 3.49Å; R1099-S1102 PolarHBondContact O-N 3.48Å; R1099-I1103 PolarHBondContact O-N 3.39Å
1100	M	98	Very high	95.6	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-62.6	-37.8	173.7	-71.5	177.9	-166.4	0	0	112.4	V879 F1032 L1036 F1050 I1070 L1073 L1077 F1096 L1097 Y1098 S1102 I1103 V1104	V879-M1100 HydrophobicContact CG1-CE 3.92Å; F1032-M1100 HydrophobicContact CE1-CE 4.43Å; F1032-M1100 HydrophobicContact CE1-CG 4.38Å; F1032-M1100 HydrophobicContact CZ-CE 4.11Å; L1036-M1100 HydrophobicContact CD2-CE 4.04Å; L1036-M1100 HydrophobicContact CD2-CG 3.89Å; F1050-M1100 HydrophobicContact CD1-CB 4.45Å; F1050-M1100 HydrophobicContact CE1-CB 3.67Å; F1050-M1100 HydrophobicContact CE1-CG 4.16Å; F1050-M1100 HydrophobicContact CE2-CG 4.36Å; F1050-M1100 HydrophobicContact CE2-SD 4.04Å; F1050-M1100 HydrophobicContact CZ-CB 3.79Å; F1050-M1100 HydrophobicContact CZ-CG 3.95Å; F1050-M1100 HydrophobicContact CZ-SD 3.84Å; I1070-M1100 HydrophobicContact CD1-CE 3.95Å; I1070-M1100 HydrophobicContact CD1-SD 4.21Å; L1073-M1100 HydrophobicContact CD2-CE 4.49Å; L1073-M1100 HydrophobicContact CD2-SD 3.48Å; L1073-M1100 WeakPolarHBondContact CD2-SD 3.08Å; L1073-M1100 HydrophobicContact CG-SD 4.49Å; L1077-M1100 HydrophobicContact CD1-CB 3.88Å; F1096-M1100 WeakPolarHBondContact O-CG 3.37Å; F1096-M1100 PolarHBondContact O-N 3.03Å; L1097-M1100 PolarHBondContact O-N 2.69Å; Y1098-M1100 PolarHBondContact O-N 2.83Å; M1100-S1102 VanDerWaalsContact C-N 3.32Å; M1100-S1102 PolarHBondContact O-N 2.88Å; M1100-I1103 WeakPolarHBondContact O-CB 3.45Å; M1100-I1103 PolarHBondContact O-N 3.26Å; M1100-V1104 PolarHBondContact O-N 2.92Å
1101	R	97.4	Very high	95.3	Very high	74 Å²	74	29.1 Å²	29.1	28%	0.279	15%	0.148	S	C	.	.	H	α-helix	trans	-63.6	-36.5	175.1	-171.7	176.3	68.8	179.4	4.6	112	L1077 L1097 Y1098 R1099 I1103 V1104 N1105	L1077-R1101 HydrophobicContact CD2-CB 4.01Å; L1077-R1101 HydrophobicContact CD2-CG 4.19Å; L1097-R1101 WeakPolarHBondContact O-CB 3.43Å; L1097-R1101 PolarHBondContact O-N 2.8Å; Y1098-R1101 VanDerWaalsContact CD1-CZ 3.42Å; Y1098-R1101 VanDerWaalsContact CE1-CZ 3.48Å; Y1098-R1101 WeakPolarHBondContact O-CB 3.48Å; Y1098-R1101 PolarHBondContact O-N 2.95Å; R1099-R1101 VanDerWaalsContact C-N 3.32Å; R1099-R1101 PolarHBondContact O-N 3.38Å; R1101-I1103 VanDerWaalsContact C-N 3.27Å; R1101-I1103 PolarHBondContact O-N 3.28Å; R1101-V1104 PolarHBondContact O-N 3.25Å; R1101-V1104 VanDerWaalsContact O-N 3.13Å; R1101-N1105 WeakPolarHBondContact O-CB 3.21Å; R1101-N1105 VanDerWaalsContact O-CG 3.29Å; R1101-N1105 PolarHBondContact O-N 3.34Å
1102	S	94.9	Very high	94.8	Very high	38 Å²	38	30.8 Å²	30.8	27%	0.266	16%	0.16	S	C	.	.	H	α-helix	trans	-59	-38.3	175.5	-60.9	0	0	0	0	112.3	Y1098 R1099 M1100 C1106	Y1098-S1102 PolarHBondContact O-N 2.87Å; Y1098-S1102 PolarHBondContact O-OG 3.14Å; R1099-S1102 WeakPolarHBondContact O-CB 3.49Å; R1099-S1102 PolarHBondContact O-N 3.48Å; M1100-S1102 VanDerWaalsContact C-N 3.32Å; M1100-S1102 PolarHBondContact O-N 2.88Å; S1102-C1106 WeakPolarHBondContact O-CB 3.31Å; S1102-C1106 PolarHBondContact O-N 2.79Å
1103	I	97.2	Very high	94	Very high	2 Å²	2	31.7 Å²	31.7	1%	0.01	16%	0.164	C	C	.	.	H	α-helix	trans	-61.5	-50.5	172.9	-57.4	170.2	0	0	0	110.2	E1033 L1036 Q1037 F1050 R1099 M1100 R1101 N1105 C1106 A1107 F1156	E1033-I1103 HydrophobicContact CB-CD1 3.94Å; E1033-I1103 HydrophobicContact CB-CG1 3.89Å; E1033-I1103 HydrophobicContact CG-CD1 3.9Å; E1033-I1103 HydrophobicContact CG-CG1 3.64Å; L1036-I1103 HydrophobicContact CD2-CD1 4.33Å; Q1037-I1103 HydrophobicContact CG-CD1 3.87Å; Q1037-I1103 HydrophobicContact CG-CG2 4.43Å; F1050-I1103 HydrophobicContact CB-CD1 4.22Å; F1050-I1103 HydrophobicContact CB-CG2 4.37Å; F1050-I1103 HydrophobicContact CD1-CB 4.31Å; F1050-I1103 HydrophobicContact CD1-CD1 4.24Å; F1050-I1103 HydrophobicContact CD1-CG2 4.31Å; F1050-I1103 HydrophobicContact CG-CD1 4.47Å; R1099-I1103 PolarHBondContact O-N 3.39Å; M1100-I1103 WeakPolarHBondContact O-CB 3.45Å; M1100-I1103 PolarHBondContact O-N 3.26Å; R1101-I1103 VanDerWaalsContact C-N 3.27Å; R1101-I1103 PolarHBondContact O-N 3.28Å; I1103-N1105 VanDerWaalsContact C-N 3.35Å; I1103-N1105 PolarHBondContact O-N 2.84Å; I1103-C1106 PolarHBondContact O-N 3.29Å; I1103-A1107 PolarHBondContact O-N 3.18Å; I1103-F1156 HydrophobicContact CG2-CE2 3.86Å; I1103-F1156 HydrophobicContact CG2-CZ 3.9Å; I1103-F1156 WeakPolarHBondContact O-CZ 3.46Å
1104	V	96.2	Very high	92.6	Very high	5 Å²	5	40.1 Å²	40.1	3%	0.03	20%	0.196	C	C	.	.	H	α-helix	trans	-63.1	-40.4	-178.5	173.4	0	0	0	0	112	F1050 L1077 R1078 M1100 R1101 A1107 K1108	F1050-V1104 HydrophobicContact CD1-CG2 4.28Å; F1050-V1104 HydrophobicContact CE1-CG2 3.96Å; L1077-V1104 HydrophobicContact CB-CB 4.42Å; L1077-V1104 HydrophobicContact CB-CG1 4.38Å; L1077-V1104 HydrophobicContact CB-CG2 3.97Å; L1077-V1104 HydrophobicContact CD1-CG2 4.43Å; R1078-V1104 HydrophobicContact CB-CG1 3.92Å; R1078-V1104 HydrophobicContact CG-CG1 4.37Å; M1100-V1104 PolarHBondContact O-N 2.92Å; R1101-V1104 PolarHBondContact O-N 3.25Å; R1101-V1104 VanDerWaalsContact O-N 3.13Å; V1104-A1107 PolarHBondContact O-N 3.45Å; V1104-K1108 HydrophobicContact CG1-CD 4.47Å; V1104-K1108 WeakPolarHBondContact O-CG 3.27Å; V1104-K1108 PolarHBondContact O-N 3.09Å
1105	N	95	Very high	90.7	Very high	67 Å²	67	44.5 Å²	44.5	36%	0.358	21%	0.214	S	C	.	.	H	α-helix	trans	-64	-44.2	177	-71.8	-11.2	0	0	0	111.1	R1101 I1103 A1107 K1108 E1109	R1101-N1105 WeakPolarHBondContact O-CB 3.21Å; R1101-N1105 VanDerWaalsContact O-CG 3.29Å; R1101-N1105 PolarHBondContact O-N 3.34Å; I1103-N1105 VanDerWaalsContact C-N 3.35Å; I1103-N1105 PolarHBondContact O-N 2.84Å; N1105-A1107 VanDerWaalsContact C-N 3.32Å; N1105-A1107 PolarHBondContact O-N 3Å; N1105-K1108 PolarHBondContact O-N 3.07Å; N1105-E1109 WeakPolarHBondContact O-CG 3.41Å; N1105-E1109 PolarHBondContact O-N 3.36Å
1106	C	95	Very high	89.2	Confident	9 Å²	9	46.5 Å²	46.5	6%	0.061	24%	0.236	C	C	.	.	H	α-helix	trans	-59.5	-42.3	175	-175.6	0	0	0	0	111.9	S1102 I1103 K1108 E1109 L1110 L1154 F1156	S1102-C1106 WeakPolarHBondContact O-CB 3.31Å; S1102-C1106 PolarHBondContact O-N 2.79Å; I1103-C1106 PolarHBondContact O-N 3.29Å; C1106-K1108 PolarHBondContact O-N 3.15Å; C1106-E1109 PolarHBondContact O-N 3.37Å; C1106-L1110 WeakPolarHBondContact O-CG 3.37Å; C1106-L1110 PolarHBondContact O-N 2.94Å; C1106-L1154 HydrophobicContact CB-CD1 3.73Å; C1106-F1156 HydrophobicContact CB-CE2 4.02Å; C1106-F1156 HydrophobicContact CB-CZ 4.03Å
1107	A	93.4	Very high	87.9	Confident	15 Å²	15	46.9 Å²	46.9	12%	0.124	24%	0.239	C	C	.	.	H	α-helix	trans	-60.5	-46.3	175.8	0	0	0	0	0	112.2	I1103 V1104 N1105 E1109 L1110 E1111 F1156	I1103-A1107 PolarHBondContact O-N 3.18Å; V1104-A1107 PolarHBondContact O-N 3.45Å; N1105-A1107 VanDerWaalsContact C-N 3.32Å; N1105-A1107 PolarHBondContact O-N 3Å; A1107-E1109 VanDerWaalsContact C-N 3.34Å; A1107-E1109 PolarHBondContact O-N 3.29Å; A1107-L1110 PolarHBondContact O-N 3.48Å; A1107-E1111 VanDerWaalsContact O-CG 3.31Å; A1107-E1111 WeakPolarHBondContact O-CG 3.49Å; A1107-E1111 PolarHBondContact O-N 2.98Å; A1107-F1156 HydrophobicContact CB-CE1 3.91Å; A1107-F1156 HydrophobicContact CB-CZ 3.97Å
1108	K	91.4	Very high	87	Confident	78 Å²	78	47.4 Å²	47.4	34%	0.339	24%	0.242	S	C	.	.	H	α-helix	trans	-61.8	-40.7	176.4	-73.3	177	175	178.8	0	112.4	R1078 V1104 N1105 C1106 E1111 S1112	R1078-K1108 WeakPolarHBondContact O-CE 3.4Å; R1078-K1108 PolarHBondContact O-NZ 3.02Å; V1104-K1108 HydrophobicContact CG1-CD 4.47Å; V1104-K1108 WeakPolarHBondContact O-CG 3.27Å; V1104-K1108 PolarHBondContact O-N 3.09Å; N1105-K1108 PolarHBondContact O-N 3.07Å; C1106-K1108 PolarHBondContact O-N 3.15Å; K1108-E1111 PolarHBondContact O-N 2.84Å; K1108-S1112 PolarHBondContact O-N 2.9Å; K1108-S1112 VanDerWaalsContact O-N 3.09Å
1109	E	90.4	Very high	86.2	Confident	87 Å²	87	47.7 Å²	47.7	41%	0.407	25%	0.253	S	S	.	.	H	α-helix	trans	-63.4	-41.8	176.5	-75.4	-178.7	-162.2	0	0	111.8	N1105 C1106 A1107 S1112 K1147	N1105-E1109 WeakPolarHBondContact O-CG 3.41Å; N1105-E1109 PolarHBondContact O-N 3.36Å; C1106-E1109 PolarHBondContact O-N 3.37Å; A1107-E1109 VanDerWaalsContact C-N 3.34Å; A1107-E1109 PolarHBondContact O-N 3.29Å; E1109-S1112 PolarHBondContact O-N 3.01Å; E1109-S1112 PolarHBondContact O-OG 3.01Å; E1109-K1147 IonicContact OE2-NZ 3.46Å; E1109-K1147 PolarHBondContact OE2-NZ 3.12Å
1110	L	90.6	Very high	85.4	Confident	1 Å²	1	52 Å²	52	1%	0.005	28%	0.277	C	S	.	.	H	α-helix	trans	-63.3	-42.8	175.7	-72.1	165.5	0	0	0	112	C1106 A1107 S1112 L1113 K1147 A1151 F1156 L1161 A1164 L1165	C1106-L1110 WeakPolarHBondContact O-CG 3.37Å; C1106-L1110 PolarHBondContact O-N 2.94Å; A1107-L1110 PolarHBondContact O-N 3.48Å; L1110-S1112 PolarHBondContact O-N 2.84Å; L1110-L1113 HydrophobicContact CD2-CD1 4.28Å; L1110-L1113 WeakPolarHBondContact O-CB 3.28Å; L1110-L1113 WeakPolarHBondContact O-CG 3.43Å; L1110-L1113 PolarHBondContact O-N 2.93Å; L1110-L1113 VanDerWaalsContact O-N 3.17Å; L1110-K1147 HydrophobicContact CD2-CB 4Å; L1110-A1151 HydrophobicContact CD1-CB 3.86Å; L1110-F1156 HydrophobicContact CD1-CD1 4.25Å; L1110-F1156 HydrophobicContact CD1-CE1 4.13Å; L1110-L1161 HydrophobicContact CD1-CD2 3.68Å; L1110-L1161 HydrophobicContact CD2-CD2 4.32Å; L1110-A1164 HydrophobicContact CB-CB 3.8Å; L1110-A1164 HydrophobicContact CD1-CB 4.42Å; L1110-L1165 HydrophobicContact CB-CD2 4.46Å; L1110-L1165 HydrophobicContact CD2-CD2 4.13Å
1111	E	88.8	Confident	84.7	Confident	75 Å²	75	52 Å²	52	35%	0.35	28%	0.278	S	S	.	.	H	α-helix	trans	-67	-22.4	177.9	-70.3	165.8	-165.5	0	0	113.5	R1078 A1107 K1108 L1113 A1164	R1078-E1111 IonicContact CZ-OE1 2.8Å; R1078-E1111 VanDerWaalsContact CZ-OE1 3.26Å; R1078-E1111 IonicContact CZ-OE2 3.97Å; R1078-E1111 IonicContact NH1-OE1 2.72Å; R1078-E1111 PolarHBondContact NH1-OE1 3.49Å; R1078-E1111 IonicContact NH1-OE2 4Å; R1078-E1111 IonicContact NH2-OE1 3.15Å; R1078-E1111 PolarHBondContact NH2-OE1 3.28Å; R1078-E1111 IonicContact NH2-OE2 3.39Å; R1078-E1111 PolarHBondContact NH2-OE2 3.31Å; A1107-E1111 VanDerWaalsContact O-CG 3.31Å; A1107-E1111 WeakPolarHBondContact O-CG 3.49Å; A1107-E1111 PolarHBondContact O-N 2.98Å; K1108-E1111 PolarHBondContact O-N 2.84Å; E1111-L1113 VanDerWaalsContact C-N 3.26Å; E1111-L1113 PolarHBondContact O-N 3.4Å; E1111-A1164 HydrophobicContact CG-CB 4Å
1112	S	84.8	Confident	84	Confident	85 Å²	85	49 Å²	49	59%	0.594	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-7.8	175.2	78.4	0	0	0	0	113.8	K1108 E1109 L1110	K1108-S1112 PolarHBondContact O-N 2.9Å; K1108-S1112 VanDerWaalsContact O-N 3.09Å; E1109-S1112 PolarHBondContact O-N 3.01Å; E1109-S1112 PolarHBondContact O-OG 3.01Å; L1110-S1112 PolarHBondContact O-N 2.84Å
1113	L	80.4	Confident	83.5	Confident	23 Å²	23	54 Å²	54	12%	0.12	28%	0.284	C	S	.	.	S	Bend	trans	-72.4	137.1	175.5	-62.2	173.3	0	0	0	110.3	L1110 E1111 K1147 L1165	L1110-L1113 HydrophobicContact CD2-CD1 4.28Å; L1110-L1113 WeakPolarHBondContact O-CB 3.28Å; L1110-L1113 WeakPolarHBondContact O-CG 3.43Å; L1110-L1113 PolarHBondContact O-N 2.93Å; L1110-L1113 VanDerWaalsContact O-N 3.17Å; E1111-L1113 VanDerWaalsContact C-N 3.26Å; E1111-L1113 PolarHBondContact O-N 3.4Å; L1113-K1147 HydrophobicContact CD1-CB 4.49Å; L1113-L1165 HydrophobicContact CB-CD2 4.43Å; L1113-L1165 HydrophobicContact CD1-CD2 3.69Å
1114	Y	66	Low	82.8	Confident	193 Å²	193	55.1 Å²	55.1	76%	0.757	29%	0.289	S	S	*	.	P	Polyproline II helix	trans	-61.4	137.8	-173.1	-174.7	-94.3	0	0	0	112.9	G1116 A1117	Y1114-G1116 PolarHBondContact O-N 2.84Å; Y1114-A1117 WeakPolarHBondContact O-CB 3.27Å; Y1114-A1117 PolarHBondContact O-N 2.84Å; Y1114-A1117 VanDerWaalsContact O-N 3.12Å
1115	E	58.9	Low	82.2	Confident	120 Å²	120	55.3 Å²	55.3	56%	0.561	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	127.3	-178.8	-163.1	163.5	-145	0	0	111.2	R1166	E1115-R1166 WeakPolarHBondContact OE1-CD 3.32Å; E1115-R1166 IonicContact OE1-CZ 3.5Å; E1115-R1166 IonicContact OE1-NE 3.26Å; E1115-R1166 IonicContact OE1-NH1 3.77Å; E1115-R1166 PolarHBondContact OE1-NH1 3.24Å; E1115-R1166 IonicContact OE2-NH1 2.56Å; E1115-R1166 PolarHBondContact OE2-NH1 3.05Å
1116	G	64.3	Low	81.5	Confident	43 Å²	43	58.8 Å²	58.8	44%	0.443	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.8	-10.7	-174.8	0	0	0	0	0	115.5	Y1114 L1118 A1119 N1120	Y1114-G1116 PolarHBondContact O-N 2.84Å; G1116-L1118 VanDerWaalsContact C-N 3.32Å; G1116-L1118 PolarHBondContact O-N 3.21Å; G1116-A1119 PolarHBondContact O-N 2.94Å; G1116-A1119 VanDerWaalsContact O-N 3.17Å; G1116-N1120 PolarHBondContact O-N 2.78Å
1117	A	70.3	Confident	80.8	Confident	9 Å²	9	60.8 Å²	60.8	7%	0.074	32%	0.318	C	S	.	.	H	α-helix	trans	-62.9	-35.1	179.4	0	0	0	0	0	113.2	Y1114 A1119 N1120 A1121 T1140	Y1114-A1117 WeakPolarHBondContact O-CB 3.27Å; Y1114-A1117 PolarHBondContact O-N 2.84Å; Y1114-A1117 VanDerWaalsContact O-N 3.12Å; A1117-A1119 PolarHBondContact O-N 2.82Å; A1117-N1120 PolarHBondContact O-N 3.08Å; A1117-A1121 WeakPolarHBondContact O-CB 3.41Å; A1117-A1121 PolarHBondContact O-N 3.02Å; A1117-T1140 HydrophobicContact CB-CG2 4.18Å
1118	L	80.1	Confident	80	Confident	11 Å²	11	61.1 Å²	61.1	6%	0.058	32%	0.318	C	S	.	.	H	α-helix	trans	-62.2	-41.3	174.8	-177.5	66.3	0	0	0	111.8	G1116 N1120 A1121 M1122 L1165 F1175	G1116-L1118 VanDerWaalsContact C-N 3.32Å; G1116-L1118 PolarHBondContact O-N 3.21Å; L1118-N1120 VanDerWaalsContact C-N 3.32Å; L1118-N1120 PolarHBondContact O-N 3.24Å; L1118-A1121 PolarHBondContact O-N 3.2Å; L1118-M1122 HydrophobicContact CD1-CG 4.41Å; L1118-M1122 HydrophobicContact CD2-SD 4.47Å; L1118-M1122 HydrophobicContact CG-CG 4.37Å; L1118-M1122 HydrophobicContact CG-SD 4Å; L1118-M1122 WeakPolarHBondContact O-CB 3.42Å; L1118-M1122 WeakPolarHBondContact O-CG 3.39Å; L1118-M1122 PolarHBondContact O-N 2.92Å; L1118-L1165 HydrophobicContact CD2-CB 4.31Å; L1118-L1165 HydrophobicContact CD2-CD1 4.19Å; L1118-F1175 HydrophobicContact CD1-CD1 3.85Å; L1118-F1175 HydrophobicContact CD1-CD2 4.25Å; L1118-F1175 HydrophobicContact CD1-CE1 4.01Å; L1118-F1175 HydrophobicContact CD1-CE2 4.4Å; L1118-F1175 HydrophobicContact CD1-CG 3.97Å; L1118-F1175 HydrophobicContact CD1-CZ 4.28Å
1119	A	80.6	Confident	78.8	Confident	49 Å²	49	62 Å²	62	41%	0.405	33%	0.332	S	S	.	.	H	α-helix	trans	-64.3	-38.2	178.4	0	0	0	0	0	111.8	G1116 A1117 K1123	G1116-A1119 PolarHBondContact O-N 2.94Å; G1116-A1119 VanDerWaalsContact O-N 3.17Å; A1117-A1119 PolarHBondContact O-N 2.82Å; A1119-K1123 WeakPolarHBondContact O-CG 3.47Å; A1119-K1123 PolarHBondContact O-N 3.13Å; A1119-K1123 VanDerWaalsContact O-N 3.09Å
1120	N	79.7	Confident	77.8	Confident	107 Å²	107	63.7 Å²	63.7	57%	0.572	35%	0.348	S	S	*	.	H	α-helix	trans	-66.8	-43.7	173.5	-70.3	-16.4	0	0	0	111.7	G1116 A1117 L1118 M1122 K1123 L1124	G1116-N1120 PolarHBondContact O-N 2.78Å; A1117-N1120 PolarHBondContact O-N 3.08Å; L1118-N1120 VanDerWaalsContact C-N 3.32Å; L1118-N1120 PolarHBondContact O-N 3.24Å; N1120-M1122 VanDerWaalsContact C-N 3.33Å; N1120-M1122 PolarHBondContact O-N 3.3Å; N1120-K1123 PolarHBondContact O-N 3.32Å; N1120-L1124 PolarHBondContact O-N 3.15Å
1121	A	83.1	Confident	76.9	Confident	2 Å²	2	67.3 Å²	67.3	2%	0.017	37%	0.37	C	S	.	.	H	α-helix	trans	-61	-40.9	175.9	0	0	0	0	0	112	A1117 L1118 L1124 L1125 L1141 F1175	A1117-A1121 WeakPolarHBondContact O-CB 3.41Å; A1117-A1121 PolarHBondContact O-N 3.02Å; L1118-A1121 PolarHBondContact O-N 3.2Å; A1121-L1124 PolarHBondContact O-N 3.4Å; A1121-L1125 WeakPolarHBondContact O-CB 3.36Å; A1121-L1125 PolarHBondContact O-N 2.83Å; A1121-L1141 HydrophobicContact CB-CB 4.39Å; A1121-L1141 HydrophobicContact CB-CD1 4.08Å; A1121-F1175 HydrophobicContact CB-CE2 4.26Å
1122	M	84	Confident	76	Confident	11 Å²	11	67.5 Å²	67.5	5%	0.054	38%	0.376	C	S	.	.	H	α-helix	trans	-63.8	-47.2	176.7	-70.8	171.2	82.4	0	0	112.1	L1118 N1120 L1124 L1125 E1126 M1171 W1174 F1175	L1118-M1122 HydrophobicContact CD1-CG 4.41Å; L1118-M1122 HydrophobicContact CD2-SD 4.47Å; L1118-M1122 HydrophobicContact CG-CG 4.37Å; L1118-M1122 HydrophobicContact CG-SD 4Å; L1118-M1122 WeakPolarHBondContact O-CB 3.42Å; L1118-M1122 WeakPolarHBondContact O-CG 3.39Å; L1118-M1122 PolarHBondContact O-N 2.92Å; N1120-M1122 VanDerWaalsContact C-N 3.33Å; N1120-M1122 PolarHBondContact O-N 3.3Å; M1122-L1124 VanDerWaalsContact C-N 3.27Å; M1122-L1124 PolarHBondContact O-N 3.49Å; M1122-L1125 PolarHBondContact O-N 2.99Å; M1122-E1126 PolarHBondContact O-N 2.55Å; M1122-M1171 HydrophobicContact CE-CB 4.03Å; M1122-M1171 HydrophobicContact CE-CE 3.32Å; M1122-M1171 HydrophobicContact CE-CG 4.49Å; M1122-M1171 WeakPolarHBondContact CE-O 3.37Å; M1122-M1171 HydrophobicContact CE-SD 3.77Å; M1122-M1171 HydrophobicContact SD-CB 4.4Å; M1122-M1171 HydrophobicContact SD-CE 3.71Å; M1122-W1174 HydrophobicContact CB-CE3 4.28Å; M1122-W1174 HydrophobicContact CB-CH2 4.3Å; M1122-W1174 HydrophobicContact CB-CZ3 3.65Å; M1122-W1174 HydrophobicContact CE-CB 4.19Å; M1122-W1174 HydrophobicContact CE-CD2 3.73Å; M1122-W1174 HydrophobicContact CE-CE3 3.2Å; M1122-W1174 HydrophobicContact CE-CG 4.17Å; M1122-W1174 HydrophobicContact CE-CZ3 3.83Å; M1122-W1174 HydrophobicContact CG-CE3 4.01Å; M1122-W1174 HydrophobicContact CG-CZ3 3.79Å; M1122-W1174 HydrophobicContact SD-CE3 4.48Å; M1122-F1175 HydrophobicContact CG-CB 4.27Å; M1122-F1175 HydrophobicContact CG-CD2 3.71Å; M1122-F1175 HydrophobicContact CG-CE2 4.47Å; M1122-F1175 HydrophobicContact CG-CG 4.31Å
1123	K	83.5	Confident	75.5	Confident	141 Å²	141	63.6 Å²	63.6	61%	0.613	35%	0.349	S	S	*	.	H	α-helix	trans	-57.2	-42.4	174.7	-76.4	178.3	-179.3	177.1	0	111.7	A1119 N1120 E1126 C1127	A1119-K1123 WeakPolarHBondContact O-CG 3.47Å; A1119-K1123 PolarHBondContact O-N 3.13Å; A1119-K1123 VanDerWaalsContact O-N 3.09Å; N1120-K1123 PolarHBondContact O-N 3.32Å; K1123-E1126 PolarHBondContact O-N 3.45Å; K1123-C1127 PolarHBondContact O-N 2.94Å; K1123-C1127 PolarHBondContact O-SG 3.1Å; K1123-C1127 VanDerWaalsContact O-SG 3.32Å
1124	L	83.3	Confident	75.5	Confident	26 Å²	26	65.8 Å²	65.8	14%	0.136	36%	0.361	C	S	.	.	H	α-helix	trans	-63.8	-44.4	178	-162.9	67.4	0	0	0	111.8	N1120 A1121 M1122 E1126 C1127 I1128 P1133 S1137 L1141	N1120-L1124 PolarHBondContact O-N 3.15Å; A1121-L1124 PolarHBondContact O-N 3.4Å; M1122-L1124 VanDerWaalsContact C-N 3.27Å; M1122-L1124 PolarHBondContact O-N 3.49Å; L1124-E1126 VanDerWaalsContact C-N 3.29Å; L1124-E1126 PolarHBondContact O-N 2.95Å; L1124-C1127 PolarHBondContact O-N 2.77Å; L1124-C1127 VanDerWaalsContact O-N 3.09Å; L1124-I1128 WeakPolarHBondContact O-CG1 3.41Å; L1124-I1128 PolarHBondContact O-N 2.99Å; L1124-P1133 HydrophobicContact CD1-CB 3.71Å; L1124-P1133 HydrophobicContact CD2-CB 3.94Å; L1124-P1133 HydrophobicContact CG-CB 4.15Å; L1124-S1137 WeakPolarHBondContact CD2-O 3.43Å; L1124-L1141 HydrophobicContact CD2-CB 4.01Å; L1124-L1141 HydrophobicContact CD2-CD2 4.01Å; L1124-L1141 HydrophobicContact CG-CD2 4.42Å
1125	L	82.4	Confident	75.9	Confident	10 Å²	10	58.1 Å²	58.1	5%	0.052	33%	0.333	C	S	.	.	H	α-helix	trans	-62.6	-36	-179.5	-168	62.8	0	0	0	112.2	A1121 M1122 C1127 I1128 L1141 F1175 H1178 L1179 M1242	A1121-L1125 WeakPolarHBondContact O-CB 3.36Å; A1121-L1125 PolarHBondContact O-N 2.83Å; M1122-L1125 PolarHBondContact O-N 2.99Å; L1125-C1127 VanDerWaalsContact C-N 3.29Å; L1125-C1127 PolarHBondContact O-N 2.76Å; L1125-I1128 PolarHBondContact O-N 3.46Å; L1125-L1141 HydrophobicContact CB-CD1 4.21Å; L1125-L1141 HydrophobicContact CD1-CD1 4.22Å; L1125-L1141 HydrophobicContact CD1-CD2 4.19Å; L1125-F1175 HydrophobicContact CD2-CD2 3.96Å; L1125-F1175 HydrophobicContact CD2-CE2 3.98Å; L1125-H1178 HydrophobicContact CD2-CB 3.45Å; L1125-H1178 VanDerWaalsContact CD2-CB 3.45Å; L1125-H1178 HydrophobicContact CG-CB 4.1Å; L1125-L1179 HydrophobicContact CD1-CD2 4.02Å; L1125-L1179 HydrophobicContact CD2-CD2 3.9Å; L1125-L1179 HydrophobicContact CD2-CG 3.96Å; L1125-M1242 HydrophobicContact CD1-CE 3.6Å; L1125-M1242 HydrophobicContact CD1-SD 4.2Å; L1125-M1242 HydrophobicContact CG-CE 4.5Å
1126	E	81.4	Confident	76.8	Confident	139 Å²	139	56.1 Å²	56.1	65%	0.65	33%	0.332	S	S	*	.	H	α-helix	trans	-66.5	-30.2	174.6	-164.1	173.1	-169	0	0	112.5	M1122 K1123 L1124 W1174	M1122-E1126 PolarHBondContact O-N 2.55Å; K1123-E1126 PolarHBondContact O-N 3.45Å; L1124-E1126 VanDerWaalsContact C-N 3.29Å; L1124-E1126 PolarHBondContact O-N 2.95Å; E1126-W1174 HydrophobicContact CB-CH2 4.17Å; E1126-W1174 HydrophobicContact CB-CZ2 4.48Å
1127	C	80.4	Confident	77.5	Confident	52 Å²	52	56.2 Å²	56.2	35%	0.351	33%	0.326	S	S	.	.	H	α-helix	trans	-85.8	-13.7	-179.8	-64.8	0	0	0	0	114.3	K1123 L1124 L1125 P1129 T1130 T1131	K1123-C1127 PolarHBondContact O-N 2.94Å; K1123-C1127 PolarHBondContact O-SG 3.1Å; K1123-C1127 VanDerWaalsContact O-SG 3.32Å; L1124-C1127 PolarHBondContact O-N 2.77Å; L1124-C1127 VanDerWaalsContact O-N 3.09Å; L1125-C1127 VanDerWaalsContact C-N 3.29Å; L1125-C1127 PolarHBondContact O-N 2.76Å; C1127-P1129 CarbonylContact O-C 3.34Å; C1127-T1130 WeakPolarHBondContact O-CA 3.49Å; C1127-T1130 PolarHBondContact O-N 2.89Å; C1127-T1130 PolarHBondContact O-OG1 3.31Å; C1127-T1131 PolarHBondContact O-N 3.15Å
1128	I	74.8	Confident	78.1	Confident	22 Å²	22	55.8 Å²	55.8	11%	0.113	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	128.7	177.6	-67.7	170.7	0	0	0	109	L1124 L1125 F1138 L1141 I1235 L1238 L1239	L1124-I1128 WeakPolarHBondContact O-CG1 3.41Å; L1124-I1128 PolarHBondContact O-N 2.99Å; L1125-I1128 PolarHBondContact O-N 3.46Å; I1128-F1138 HydrophobicContact CD1-CE2 4.34Å; I1128-L1141 HydrophobicContact CD1-CD2 3.8Å; I1128-I1235 HydrophobicContact CG2-CG2 4.09Å; I1128-L1238 HydrophobicContact CD1-CD2 4.47Å; I1128-L1239 HydrophobicContact CG2-CD1 4.49Å; I1128-L1239 HydrophobicContact CG2-CD2 4.01Å; I1128-L1239 HydrophobicContact CG2-CG 4.37Å
1129	P	67	Low	78.1	Confident	97 Å²	97	58.4 Å²	58.4	63%	0.63	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	cis	-98.9	7.9	12.4	37.5	-35	0	0	0	115.4	C1127 T1131	C1127-P1129 CarbonylContact O-C 3.34Å; P1129-T1131 VanDerWaalsContact C-N 3.31Å; P1129-T1131 PolarHBondContact O-N 3.1Å
1130	T	70.7	Confident	78.3	Confident	121 Å²	121	58.3 Å²	58.3	74%	0.742	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-22.2	-173.3	63.9	0	0	0	0	115.2	C1127	C1127-T1130 WeakPolarHBondContact O-CA 3.49Å; C1127-T1130 PolarHBondContact O-N 2.89Å; C1127-T1130 PolarHBondContact O-OG1 3.31Å
1131	T	70	Confident	78.6	Confident	77 Å²	77	53.2 Å²	53.2	47%	0.472	30%	0.299	S	S	.	.	S	Bend	trans	-127.4	134.7	-177.9	-46.3	0	0	0	0	110.3	C1127 P1129 P1133	C1127-T1131 PolarHBondContact O-N 3.15Å; P1129-T1131 VanDerWaalsContact C-N 3.31Å; P1129-T1131 PolarHBondContact O-N 3.1Å; T1131-P1133 WeakPolarHBondContact O-CD 3.41Å
1132	V	70.8	Confident	78.8	Confident	80 Å²	80	53.1 Å²	53.1	49%	0.485	30%	0.298	S	S	.	.	P	Polyproline II helix	trans	-81.3	116.5	173.3	-174.8	0	0	0	0	108.6	L1229 I1235	V1132-L1229 HydrophobicContact CB-CD2 4.36Å; V1132-L1229 HydrophobicContact CG1-CD2 3.73Å; V1132-I1235 HydrophobicContact CG1-CD1 4.47Å
1133	P	74.8	Confident	79	Confident	3 Å²	3	57.3 Å²	57.3	2%	0.019	31%	0.314	C	S	.	.	P	Polyproline II helix	trans	-76.2	151.7	-177.4	31.2	-32.7	0	0	0	111.7	L1124 T1131 F1138 V1230 I1235	L1124-P1133 HydrophobicContact CD1-CB 3.71Å; L1124-P1133 HydrophobicContact CD2-CB 3.94Å; L1124-P1133 HydrophobicContact CG-CB 4.15Å; T1131-P1133 WeakPolarHBondContact O-CD 3.41Å; P1133-F1138 HydrophobicContact CB-CB 4.14Å; P1133-F1138 HydrophobicContact CB-CD2 4.23Å; P1133-F1138 HydrophobicContact CG-CB 4.06Å; P1133-F1138 HydrophobicContact CG-CD2 3.44Å; P1133-F1138 VanDerWaalsContact CG-CD2 3.44Å; P1133-F1138 HydrophobicContact CG-CE2 4.21Å; P1133-F1138 HydrophobicContact CG-CG 4.11Å; P1133-V1230 HydrophobicContact CG-CG2 4.23Å; P1133-I1235 HydrophobicContact CG-CD1 4.38Å
1134	D	78.9	Confident	79.2	Confident	69 Å²	69	51 Å²	51	37%	0.369	29%	0.286	S	S	.	.	B	Isolated β-bridge	trans	-73	157.9	167.2	73.5	-69.8	0	0	0	110.8	S1136 S1137 F1138	D1134-S1136 VanDerWaalsContact C-N 3.28Å; D1134-S1136 PolarHBondContact O-N 2.83Å; D1134-S1136 WeakPolarHBondContact OD2-CB 3.22Å; D1134-S1136 PolarHBondContact OD2-N 2.73Å; D1134-S1136 VanDerWaalsContact OD2-N 3.13Å; D1134-S1136 PolarHBondContact OD2-OG 3.17Å; D1134-S1137 PolarHBondContact O-N 3.15Å; D1134-S1137 WeakPolarHBondContact OD1-CB 3.32Å; D1134-S1137 PolarHBondContact OD1-OG 2.92Å; D1134-S1137 PolarHBondContact OD2-N 3.19Å; D1134-F1138 WeakPolarHBondContact O-CB 3.41Å; D1134-F1138 PolarHBondContact O-N 3.43Å
1135	N	74.4	Confident	79.4	Confident	32 Å²	32	49.8 Å²	49.8	17%	0.171	28%	0.28	C	S	.	.	H	α-helix	trans	-59.7	-34.3	-175.4	-83.7	-12.9	0	0	0	113.8	Y1139 E1227 V1230	N1135-Y1139 VanDerWaalsContact O-CB 3.24Å; N1135-Y1139 WeakPolarHBondContact O-CB 3.31Å; N1135-Y1139 PolarHBondContact O-N 3.43Å; N1135-E1227 PolarHBondContact ND2-O 2.95Å; N1135-V1230 WeakPolarHBondContact OD1-CA 3.24Å; N1135-V1230 WeakPolarHBondContact OD1-CG2 3.14Å; N1135-V1230 PolarHBondContact OD1-N 3.32Å
1136	S	78	Confident	79.7	Confident	77 Å²	77	50.6 Å²	50.6	54%	0.538	28%	0.283	S	S	.	.	H	α-helix	trans	-73.9	-43.5	-176.9	79	0	0	0	0	112.3	D1134 T1140	D1134-S1136 VanDerWaalsContact C-N 3.28Å; D1134-S1136 PolarHBondContact O-N 2.83Å; D1134-S1136 WeakPolarHBondContact OD2-CB 3.22Å; D1134-S1136 PolarHBondContact OD2-N 2.73Å; D1134-S1136 VanDerWaalsContact OD2-N 3.13Å; D1134-S1136 PolarHBondContact OD2-OG 3.17Å; S1136-T1140 WeakPolarHBondContact O-CB 3.45Å; S1136-T1140 PolarHBondContact O-N 2.83Å; S1136-T1140 PolarHBondContact O-OG1 3.11Å
1137	S	79	Confident	80.2	Confident	46 Å²	46	46 Å²	46	32%	0.322	26%	0.261	S	S	.	.	H	α-helix	trans	-68.3	-40.8	177.5	-55.9	0	0	0	0	111.4	L1124 D1134 T1140 L1141	L1124-S1137 WeakPolarHBondContact CD2-O 3.43Å; D1134-S1137 PolarHBondContact O-N 3.15Å; D1134-S1137 WeakPolarHBondContact OD1-CB 3.32Å; D1134-S1137 PolarHBondContact OD1-OG 2.92Å; D1134-S1137 PolarHBondContact OD2-N 3.19Å; S1137-T1140 WeakPolarHBondContact O-CB 3.42Å; S1137-T1140 PolarHBondContact O-N 2.88Å; S1137-L1141 PolarHBondContact O-N 3.48Å
1138	F	82.6	Confident	80.7	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-65.8	-45.1	177.2	-168.3	-93.7	0	0	0	112.1	I1128 P1133 D1134 T1140 L1141 V1142 L1217 F1221 V1230 I1235 L1238	I1128-F1138 HydrophobicContact CD1-CE2 4.34Å; P1133-F1138 HydrophobicContact CB-CB 4.14Å; P1133-F1138 HydrophobicContact CB-CD2 4.23Å; P1133-F1138 HydrophobicContact CG-CB 4.06Å; P1133-F1138 HydrophobicContact CG-CD2 3.44Å; P1133-F1138 VanDerWaalsContact CG-CD2 3.44Å; P1133-F1138 HydrophobicContact CG-CE2 4.21Å; P1133-F1138 HydrophobicContact CG-CG 4.11Å; D1134-F1138 WeakPolarHBondContact O-CB 3.41Å; D1134-F1138 PolarHBondContact O-N 3.43Å; F1138-T1140 PolarHBondContact O-N 3.24Å; F1138-L1141 WeakPolarHBondContact O-CB 3.45Å; F1138-L1141 PolarHBondContact O-N 2.7Å; F1138-L1141 VanDerWaalsContact O-N 3.16Å; F1138-V1142 HydrophobicContact CD1-CG2 3.72Å; F1138-V1142 HydrophobicContact CE1-CG2 3.5Å; F1138-V1142 VanDerWaalsContact CE1-CG2 3.5Å; F1138-V1142 HydrophobicContact CG-CG2 4.46Å; F1138-V1142 HydrophobicContact CZ-CG2 4.07Å; F1138-V1142 WeakPolarHBondContact O-CG2 3.34Å; F1138-V1142 PolarHBondContact O-N 3.44Å; F1138-L1217 HydrophobicContact CE1-CD2 3.98Å; F1138-L1217 HydrophobicContact CZ-CD2 4.25Å; F1138-F1221 HydrophobicContact CD1-CD2 4.49Å; F1138-F1221 HydrophobicContact CD1-CE1 4.09Å; F1138-F1221 AromaticContact CD1-CE2 3.39Å; F1138-F1221 HydrophobicContact CD1-CE2 3.39Å; F1138-F1221 AromaticContact CD1-CZ 3.13Å; F1138-F1221 HydrophobicContact CD1-CZ 3.13Å; F1138-F1221 AromaticContact CE1-CE2 3.41Å; F1138-F1221 HydrophobicContact CE1-CE2 3.41Å; F1138-F1221 VanDerWaalsContact CE1-CE2 3.41Å; F1138-F1221 AromaticContact CE1-CZ 3.55Å; F1138-F1221 HydrophobicContact CE1-CZ 3.55Å; F1138-F1221 HydrophobicContact CG-CZ 4.16Å; F1138-V1230 HydrophobicContact CB-CG2 3.55Å; F1138-V1230 HydrophobicContact CD1-CG1 4.04Å; F1138-V1230 HydrophobicContact CD1-CG2 4.07Å; F1138-V1230 HydrophobicContact CD2-CG1 4.48Å; F1138-V1230 HydrophobicContact CD2-CG2 4.35Å; F1138-V1230 HydrophobicContact CE1-CG1 4.02Å; F1138-V1230 HydrophobicContact CE2-CG1 4.46Å; F1138-V1230 HydrophobicContact CG-CG1 4.22Å; F1138-V1230 HydrophobicContact CG-CG2 3.74Å; F1138-V1230 HydrophobicContact CZ-CG1 4.21Å; F1138-I1235 HydrophobicContact CE2-CG1 4.11Å; F1138-I1235 HydrophobicContact CZ-CG1 4.41Å; F1138-L1238 HydrophobicContact CE2-CD2 3.56Å; F1138-L1238 HydrophobicContact CZ-CB 4.04Å; F1138-L1238 HydrophobicContact CZ-CD2 3.64Å; F1138-L1238 HydrophobicContact CZ-CG 4.45Å
1139	Y	82.1	Confident	81.5	Confident	66 Å²	66	43.7 Å²	43.7	26%	0.259	25%	0.245	S	C	.	.	H	α-helix	trans	-55.3	-43.7	173.2	176.7	-96.6	0	0	0	111.4	N1135 V1142 R1143 L1218 F1221 H1222	N1135-Y1139 VanDerWaalsContact O-CB 3.24Å; N1135-Y1139 WeakPolarHBondContact O-CB 3.31Å; N1135-Y1139 PolarHBondContact O-N 3.43Å; Y1139-V1142 PolarHBondContact O-N 3.2Å; Y1139-R1143 VanDerWaalsContact O-CB 3.27Å; Y1139-R1143 WeakPolarHBondContact O-CB 3.45Å; Y1139-R1143 PolarHBondContact O-N 3.26Å; Y1139-L1218 HydrophobicContact CD2-CD2 4.2Å; Y1139-L1218 HydrophobicContact CE2-CD2 3.98Å; Y1139-F1221 HydrophobicContact CD2-CB 4.11Å; Y1139-F1221 HydrophobicContact CD2-CG 4.36Å; Y1139-H1222 AromaticContact CE2-NE2 3.98Å
1140	T	82.7	Confident	82.7	Confident	47 Å²	47	40.9 Å²	40.9	29%	0.288	23%	0.225	S	C	.	.	H	α-helix	trans	-61	-45.4	177.3	-58.1	0	0	0	0	111.8	A1117 S1136 S1137 F1138 R1143 H1144	A1117-T1140 HydrophobicContact CB-CG2 4.18Å; S1136-T1140 WeakPolarHBondContact O-CB 3.45Å; S1136-T1140 PolarHBondContact O-N 2.83Å; S1136-T1140 PolarHBondContact O-OG1 3.11Å; S1137-T1140 WeakPolarHBondContact O-CB 3.42Å; S1137-T1140 PolarHBondContact O-N 2.88Å; F1138-T1140 PolarHBondContact O-N 3.24Å; T1140-R1143 PolarHBondContact O-N 3.35Å; T1140-H1144 PolarHBondContact O-N 3.43Å; T1140-H1144 PolarHBondContact O-ND1 3.19Å
1141	L	86.7	Confident	83.8	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-58.9	-51.6	175.7	168.6	62.5	0	0	0	111.8	A1121 L1124 L1125 I1128 S1137 F1138 R1143 H1144 A1145 F1175 L1238	A1121-L1141 HydrophobicContact CB-CB 4.39Å; A1121-L1141 HydrophobicContact CB-CD1 4.08Å; L1124-L1141 HydrophobicContact CD2-CB 4.01Å; L1124-L1141 HydrophobicContact CD2-CD2 4.01Å; L1124-L1141 HydrophobicContact CG-CD2 4.42Å; L1125-L1141 HydrophobicContact CB-CD1 4.21Å; L1125-L1141 HydrophobicContact CD1-CD1 4.22Å; L1125-L1141 HydrophobicContact CD1-CD2 4.19Å; I1128-L1141 HydrophobicContact CD1-CD2 3.8Å; S1137-L1141 PolarHBondContact O-N 3.48Å; F1138-L1141 WeakPolarHBondContact O-CB 3.45Å; F1138-L1141 PolarHBondContact O-N 2.7Å; F1138-L1141 VanDerWaalsContact O-N 3.16Å; L1141-R1143 VanDerWaalsContact C-N 3.33Å; L1141-R1143 PolarHBondContact O-N 2.93Å; L1141-H1144 PolarHBondContact O-N 3.28Å; L1141-A1145 WeakPolarHBondContact O-CB 3.3Å; L1141-A1145 PolarHBondContact O-N 3.02Å; L1141-F1175 HydrophobicContact CD1-CE2 3.85Å; L1141-F1175 HydrophobicContact CD1-CZ 4.09Å; L1141-L1238 HydrophobicContact CD2-CD2 4.08Å
1142	V	87.6	Confident	85	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-63.3	-41.7	-177.6	-178.5	0	0	0	0	110.8	F1138 Y1139 H1144 A1145 E1146 I1214 L1217 L1218 L1238	F1138-V1142 HydrophobicContact CD1-CG2 3.72Å; F1138-V1142 HydrophobicContact CE1-CG2 3.5Å; F1138-V1142 VanDerWaalsContact CE1-CG2 3.5Å; F1138-V1142 HydrophobicContact CG-CG2 4.46Å; F1138-V1142 HydrophobicContact CZ-CG2 4.07Å; F1138-V1142 WeakPolarHBondContact O-CG2 3.34Å; F1138-V1142 PolarHBondContact O-N 3.44Å; Y1139-V1142 PolarHBondContact O-N 3.2Å; V1142-H1144 PolarHBondContact O-N 2.87Å; V1142-A1145 PolarHBondContact O-N 3.09Å; V1142-E1146 PolarHBondContact O-N 2.84Å; V1142-I1214 HydrophobicContact CG1-CG1 3.93Å; V1142-L1217 HydrophobicContact CB-CD2 4.32Å; V1142-L1217 HydrophobicContact CG1-CB 4.42Å; V1142-L1217 HydrophobicContact CG1-CD2 3.72Å; V1142-L1217 HydrophobicContact CG1-CG 4.38Å; V1142-L1217 HydrophobicContact CG2-CD2 3.53Å; V1142-L1218 HydrophobicContact CB-CD2 4.03Å; V1142-L1218 HydrophobicContact CB-CG 4.45Å; V1142-L1218 HydrophobicContact CG1-CD1 4.24Å; V1142-L1218 HydrophobicContact CG1-CD2 3.66Å; V1142-L1218 HydrophobicContact CG1-CG 3.54Å; V1142-L1238 HydrophobicContact CG2-CD1 4.41Å; V1142-L1238 HydrophobicContact CG2-CD2 4.43Å
1143	R	87.2	Confident	86.1	Confident	99 Å²	99	29.9 Å²	29.9	37%	0.374	15%	0.152	S	C	.	.	H	α-helix	trans	-62.5	-41.8	177.2	-174.6	179.7	175.1	-164	-2.4	111.9	Y1139 T1140 L1141 K1147 L1218	Y1139-R1143 VanDerWaalsContact O-CB 3.27Å; Y1139-R1143 WeakPolarHBondContact O-CB 3.45Å; Y1139-R1143 PolarHBondContact O-N 3.26Å; T1140-R1143 PolarHBondContact O-N 3.35Å; L1141-R1143 VanDerWaalsContact C-N 3.33Å; L1141-R1143 PolarHBondContact O-N 2.93Å; R1143-K1147 VanDerWaalsContact O-CG 3.32Å; R1143-K1147 WeakPolarHBondContact O-CG 3.31Å; R1143-K1147 PolarHBondContact O-N 3.02Å; R1143-L1218 HydrophobicContact CB-CD2 4.21Å
1144	H	88.3	Confident	87	Confident	7 Å²	7	31.1 Å²	31.1	3%	0.032	16%	0.158	C	C	.	.	H	α-helix	trans	-66.4	-42.8	175.6	-78.4	72.9	0	0	0	111.7	T1140 L1141 V1142 K1147 V1148 F1175	T1140-H1144 PolarHBondContact O-N 3.43Å; T1140-H1144 PolarHBondContact O-ND1 3.19Å; L1141-H1144 PolarHBondContact O-N 3.28Å; V1142-H1144 PolarHBondContact O-N 2.87Å; H1144-K1147 PolarHBondContact O-N 3.3Å; H1144-V1148 WeakPolarHBondContact O-CB 3.22Å; H1144-V1148 VanDerWaalsContact O-CG2 3.28Å; H1144-V1148 WeakPolarHBondContact O-CG2 3.48Å; H1144-V1148 PolarHBondContact O-N 3.01Å; H1144-F1175 HydrophobicContact CB-CE1 4.29Å; H1144-F1175 HydrophobicContact CB-CZ 4.07Å
1145	A	88.2	Confident	87.8	Confident	1 Å²	1	28 Å²	28	1%	0.008	14%	0.143	C	C	.	.	H	α-helix	trans	-59.6	-46.7	176.6	0	0	0	0	0	111.3	L1141 V1142 V1148 M1149 L1179 I1214	L1141-A1145 WeakPolarHBondContact O-CB 3.3Å; L1141-A1145 PolarHBondContact O-N 3.02Å; V1142-A1145 PolarHBondContact O-N 3.09Å; A1145-V1148 PolarHBondContact O-N 3.42Å; A1145-M1149 WeakPolarHBondContact O-CB 3.39Å; A1145-M1149 WeakPolarHBondContact O-CG 3.18Å; A1145-M1149 PolarHBondContact O-N 2.85Å; A1145-L1179 HydrophobicContact CB-CD1 3.6Å; A1145-L1179 HydrophobicContact CB-CD2 3.96Å; A1145-L1179 HydrophobicContact CB-CG 4.46Å; A1145-I1214 HydrophobicContact CB-CD1 3.58Å
1146	E	88.7	Confident	88.9	Confident	27 Å²	27	26.8 Å²	26.8	13%	0.126	14%	0.136	C	C	.	.	H	α-helix	trans	-58.7	-51.2	175.5	-174.3	-150.2	-160.9	0	0	111.8	V1142 V1148 M1149 I1150 I1214 Q1215 L1218	V1142-E1146 PolarHBondContact O-N 2.84Å; E1146-V1148 PolarHBondContact O-N 3.14Å; E1146-M1149 WeakPolarHBondContact O-CB 3.25Å; E1146-M1149 PolarHBondContact O-N 3.28Å; E1146-M1149 VanDerWaalsContact O-N 3.16Å; E1146-I1150 HydrophobicContact CG-CD1 3.88Å; E1146-I1150 WeakPolarHBondContact O-CG1 3.2Å; E1146-I1150 PolarHBondContact O-N 3.23Å; E1146-I1214 HydrophobicContact CB-CD1 4.46Å; E1146-I1214 HydrophobicContact CB-CG2 4.44Å; E1146-I1214 HydrophobicContact CG-CG2 4.36Å; E1146-Q1215 HydrophobicContact CG-CG 4.05Å; E1146-Q1215 WeakPolarHBondContact OE1-CG 3.36Å; E1146-Q1215 PolarHBondContact OE1-NE2 3.06Å; E1146-L1218 HydrophobicContact CB-CD1 3.65Å; E1146-L1218 HydrophobicContact CG-CD1 3.8Å; E1146-L1218 WeakPolarHBondContact OE2-CD1 3.4Å
1147	K	91.2	Very high	89.7	Confident	42 Å²	42	23.3 Å²	23.3	18%	0.183	11%	0.112	C	C	.	.	H	α-helix	trans	-64.4	-39.2	-177.8	-67.8	-64.9	176.9	-175.8	0	112.6	E1109 L1110 L1113 R1143 H1144 A1151	E1109-K1147 IonicContact OE2-NZ 3.46Å; E1109-K1147 PolarHBondContact OE2-NZ 3.12Å; L1110-K1147 HydrophobicContact CD2-CB 4Å; L1113-K1147 HydrophobicContact CD1-CB 4.49Å; R1143-K1147 VanDerWaalsContact O-CG 3.32Å; R1143-K1147 WeakPolarHBondContact O-CG 3.31Å; R1143-K1147 PolarHBondContact O-N 3.02Å; H1144-K1147 PolarHBondContact O-N 3.3Å; K1147-A1151 VanDerWaalsContact O-CB 3.29Å; K1147-A1151 WeakPolarHBondContact O-CB 3.28Å; K1147-A1151 PolarHBondContact O-N 2.88Å
1148	V	91.4	Very high	90.5	Very high	2 Å²	2	21.4 Å²	21.4	1%	0.012	10%	0.098	C	C	.	.	H	α-helix	trans	-64.9	-42.6	173.2	171.2	0	0	0	0	110.7	H1144 A1145 E1146 A1151 K1152 L1161 L1165 F1175 R1176 L1181	H1144-V1148 WeakPolarHBondContact O-CB 3.22Å; H1144-V1148 VanDerWaalsContact O-CG2 3.28Å; H1144-V1148 WeakPolarHBondContact O-CG2 3.48Å; H1144-V1148 PolarHBondContact O-N 3.01Å; A1145-V1148 PolarHBondContact O-N 3.42Å; E1146-V1148 PolarHBondContact O-N 3.14Å; V1148-A1151 PolarHBondContact O-N 3.5Å; V1148-K1152 HydrophobicContact CG1-CG 4.4Å; V1148-K1152 WeakPolarHBondContact O-CG 3.45Å; V1148-K1152 PolarHBondContact O-N 2.91Å; V1148-L1161 HydrophobicContact CG1-CD1 4.15Å; V1148-L1165 HydrophobicContact CG2-CD1 4.18Å; V1148-F1175 HydrophobicContact CG2-CD1 4.32Å; V1148-F1175 HydrophobicContact CG2-CE1 4.12Å; V1148-R1176 HydrophobicContact CG1-CG 4Å; V1148-L1181 HydrophobicContact CG1-CD2 3.98Å
1149	M	90.8	Very high	91	Very high	24 Å²	24	24.8 Å²	24.8	12%	0.118	12%	0.118	C	C	.	.	H	α-helix	trans	-60.1	-48	176.1	-73.7	176	76.1	0	0	112.1	A1145 E1146 A1151 K1152 R1153 L1181 I1209 L1211 I1214	A1145-M1149 WeakPolarHBondContact O-CB 3.39Å; A1145-M1149 WeakPolarHBondContact O-CG 3.18Å; A1145-M1149 PolarHBondContact O-N 2.85Å; E1146-M1149 WeakPolarHBondContact O-CB 3.25Å; E1146-M1149 PolarHBondContact O-N 3.28Å; E1146-M1149 VanDerWaalsContact O-N 3.16Å; M1149-A1151 PolarHBondContact O-N 3.04Å; M1149-K1152 PolarHBondContact O-N 3.25Å; M1149-R1153 WeakPolarHBondContact O-CG 3.48Å; M1149-R1153 PolarHBondContact O-N 3.04Å; M1149-L1181 HydrophobicContact CB-CD2 4.42Å; M1149-L1181 HydrophobicContact CG-CD1 3.93Å; M1149-L1181 HydrophobicContact CG-CD2 3.74Å; M1149-L1181 HydrophobicContact CG-CG 4.42Å; M1149-I1209 HydrophobicContact CE-CG2 3.89Å; M1149-L1211 HydrophobicContact CB-CD2 3.76Å; M1149-L1211 HydrophobicContact CE-CD2 4.1Å; M1149-I1214 HydrophobicContact CE-CG2 4.44Å; M1149-I1214 HydrophobicContact SD-CB 4.48Å; M1149-I1214 HydrophobicContact SD-CD1 3.62Å; M1149-I1214 HydrophobicContact SD-CG2 4Å
1150	I	91.8	Very high	91.5	Very high	39 Å²	39	22.2 Å²	22.2	20%	0.2	11%	0.109	C	C	.	.	H	α-helix	trans	-59.3	-47.6	176.6	-68.4	167.7	0	0	0	110.3	E1146 K1152 R1153 L1154 L1211	E1146-I1150 HydrophobicContact CG-CD1 3.88Å; E1146-I1150 WeakPolarHBondContact O-CG1 3.2Å; E1146-I1150 PolarHBondContact O-N 3.23Å; I1150-K1152 PolarHBondContact O-N 3.3Å; I1150-R1153 WeakPolarHBondContact O-CB 3.2Å; I1150-R1153 PolarHBondContact O-N 3.16Å; I1150-R1153 VanDerWaalsContact O-N 3.14Å; I1150-L1154 HydrophobicContact CG2-CD1 4.26Å; I1150-L1154 WeakPolarHBondContact O-CG 2.99Å; I1150-L1154 PolarHBondContact O-N 3.48Å; I1150-L1211 HydrophobicContact CG1-CD1 3.96Å; I1150-L1211 HydrophobicContact CG1-CD2 4.12Å
1151	A	95.5	Very high	92	Very high	0 Å²	0	20 Å²	20	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-61.7	-42.4	179.5	0	0	0	0	0	112.4	L1110 K1147 V1148 M1149 R1153 L1154 G1155 F1156 L1161	L1110-A1151 HydrophobicContact CD1-CB 3.86Å; K1147-A1151 VanDerWaalsContact O-CB 3.29Å; K1147-A1151 WeakPolarHBondContact O-CB 3.28Å; K1147-A1151 PolarHBondContact O-N 2.88Å; V1148-A1151 PolarHBondContact O-N 3.5Å; M1149-A1151 PolarHBondContact O-N 3.04Å; A1151-R1153 VanDerWaalsContact C-N 3.34Å; A1151-R1153 PolarHBondContact O-N 3.17Å; A1151-L1154 CarbonylContact O-C 3.55Å; A1151-L1154 PolarHBondContact O-N 3.11Å; A1151-L1154 VanDerWaalsContact O-N 3.16Å; A1151-G1155 PolarHBondContact O-N 2.81Å; A1151-F1156 HydrophobicContact CB-CB 4.04Å; A1151-F1156 HydrophobicContact CB-CD2 4Å; A1151-F1156 HydrophobicContact CB-CG 3.94Å; A1151-F1156 WeakPolarHBondContact O-CB 3.32Å; A1151-F1156 WeakPolarHBondContact O-CD2 3.12Å; A1151-F1156 PolarHBondContact O-N 3.38Å; A1151-L1161 HydrophobicContact CB-CD2 3.7Å
1152	K	95.3	Very high	92.2	Very high	3 Å²	3	20.1 Å²	20.1	1%	0.013	10%	0.097	C	C	.	.	H	α-helix	trans	-62.8	-39.5	174.3	-65	-55.5	-72.3	-174.7	0	111.8	V1148 M1149 I1150 L1154 G1155 F1156 D1158 L1161 L1181 Y1206 E1320	V1148-K1152 HydrophobicContact CG1-CG 4.4Å; V1148-K1152 WeakPolarHBondContact O-CG 3.45Å; V1148-K1152 PolarHBondContact O-N 2.91Å; M1149-K1152 PolarHBondContact O-N 3.25Å; I1150-K1152 PolarHBondContact O-N 3.3Å; K1152-L1154 PolarHBondContact O-N 3.43Å; K1152-G1155 WeakPolarHBondContact O-CA 3.36Å; K1152-G1155 PolarHBondContact O-N 2.96Å; K1152-F1156 WeakPolarHBondContact CD-O 3.16Å; K1152-F1156 WeakPolarHBondContact CE-O 3.49Å; K1152-F1156 PolarHBondContact NZ-O 2.91Å; K1152-D1158 IonicContact NZ-OD1 2.92Å; K1152-D1158 PolarHBondContact NZ-OD1 3.41Å; K1152-L1161 HydrophobicContact CD-CD1 3.64Å; K1152-L1161 HydrophobicContact CG-CD1 4.36Å; K1152-L1181 HydrophobicContact CB-CD2 4.49Å; K1152-L1181 HydrophobicContact CG-CD2 3.95Å; K1152-Y1206 HydrophobicContact CB-CD1 3.68Å; K1152-Y1206 HydrophobicContact CB-CD2 4.2Å; K1152-Y1206 HydrophobicContact CB-CE1 4.1Å; K1152-Y1206 HydrophobicContact CB-CG 3.75Å; K1152-Y1206 VanDerWaalsContact CE-CZ 3.43Å; K1152-Y1206 HydrophobicContact CG-CD1 4.34Å; K1152-Y1206 HydrophobicContact CG-CE1 4.28Å; K1152-Y1206 WeakPolarHBondContact O-CB 3.41Å; K1152-E1320 IonicContact NZ-OE1 2.86Å; K1152-E1320 PolarHBondContact NZ-OE1 2.88Å; K1152-E1320 IonicContact NZ-OE2 3.02Å
1153	R	92.3	Very high	92.2	Very high	43 Å²	43	26.2 Å²	26.2	16%	0.162	12%	0.12	C	C	.	.	H	α-helix	trans	-61.4	-30.6	174.2	-72.4	-175.4	68.6	163.1	-5.4	113	M1149 I1150 A1151 G1155 Y1206 A1207 I1209 L1211	M1149-R1153 WeakPolarHBondContact O-CG 3.48Å; M1149-R1153 PolarHBondContact O-N 3.04Å; I1150-R1153 WeakPolarHBondContact O-CB 3.2Å; I1150-R1153 PolarHBondContact O-N 3.16Å; I1150-R1153 VanDerWaalsContact O-N 3.14Å; A1151-R1153 VanDerWaalsContact C-N 3.34Å; A1151-R1153 PolarHBondContact O-N 3.17Å; R1153-G1155 VanDerWaalsContact C-N 3.29Å; R1153-Y1206 WeakPolarHBondContact CG-O 3.17Å; R1153-A1207 PolarHBondContact NE-O 2.94Å; R1153-A1207 VanDerWaalsContact NE-O 3.08Å; R1153-A1207 PolarHBondContact NH2-O 3.17Å; R1153-I1209 PolarHBondContact NH1-O 3.13Å; R1153-L1211 VanDerWaalsContact NH1-CG 3.32Å
1154	L	95.1	Very high	92.3	Very high	29 Å²	29	22 Å²	22	15%	0.152	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.1	3.8	172.9	-62.8	177.3	0	0	0	113.5	E1033 Q1037 C1106 I1150 A1151 K1152 F1156	E1033-L1154 CarbonylContact C-O 3.56Å; E1033-L1154 HydrophobicContact CB-CB 4.4Å; E1033-L1154 HydrophobicContact CB-CD2 4.04Å; E1033-L1154 HydrophobicContact CG-CD2 4.09Å; Q1037-L1154 PolarHBondContact NE2-O 3.07Å; C1106-L1154 HydrophobicContact CB-CD1 3.73Å; I1150-L1154 HydrophobicContact CG2-CD1 4.26Å; I1150-L1154 WeakPolarHBondContact O-CG 2.99Å; I1150-L1154 PolarHBondContact O-N 3.48Å; A1151-L1154 CarbonylContact O-C 3.55Å; A1151-L1154 PolarHBondContact O-N 3.11Å; A1151-L1154 VanDerWaalsContact O-N 3.16Å; K1152-L1154 PolarHBondContact O-N 3.43Å; L1154-F1156 HydrophobicContact CB-CD2 4.08Å; L1154-F1156 HydrophobicContact CB-CE2 4.15Å
1155	G	95.5	Very high	92.3	Very high	4 Å²	4	22.6 Å²	22.6	4%	0.041	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	85.7	17.5	176.4	0	0	0	0	0	116.6	Q1037 R1041 A1151 K1152 R1153 S1157	Q1037-G1155 WeakPolarHBondContact CB-O 3.37Å; R1041-G1155 PolarHBondContact NH1-O 2.73Å; R1041-G1155 PolarHBondContact NH2-O 2.82Å; A1151-G1155 PolarHBondContact O-N 2.81Å; K1152-G1155 WeakPolarHBondContact O-CA 3.36Å; K1152-G1155 PolarHBondContact O-N 2.96Å; R1153-G1155 VanDerWaalsContact C-N 3.29Å; G1155-S1157 PolarHBondContact O-N 3.12Å
1156	F	97.1	Very high	92.2	Very high	6 Å²	6	30.7 Å²	30.7	3%	0.026	14%	0.139	C	C	.	.			trans	-63.9	131	175.2	-78.5	-113.2	0	0	0	111.4	I1103 C1106 A1107 L1110 A1151 K1152 L1154 Q1160 L1161	I1103-F1156 HydrophobicContact CG2-CE2 3.86Å; I1103-F1156 HydrophobicContact CG2-CZ 3.9Å; I1103-F1156 WeakPolarHBondContact O-CZ 3.46Å; C1106-F1156 HydrophobicContact CB-CE2 4.02Å; C1106-F1156 HydrophobicContact CB-CZ 4.03Å; A1107-F1156 HydrophobicContact CB-CE1 3.91Å; A1107-F1156 HydrophobicContact CB-CZ 3.97Å; L1110-F1156 HydrophobicContact CD1-CD1 4.25Å; L1110-F1156 HydrophobicContact CD1-CE1 4.13Å; A1151-F1156 HydrophobicContact CB-CB 4.04Å; A1151-F1156 HydrophobicContact CB-CD2 4Å; A1151-F1156 HydrophobicContact CB-CG 3.94Å; A1151-F1156 WeakPolarHBondContact O-CB 3.32Å; A1151-F1156 WeakPolarHBondContact O-CD2 3.12Å; A1151-F1156 PolarHBondContact O-N 3.38Å; K1152-F1156 WeakPolarHBondContact CD-O 3.16Å; K1152-F1156 WeakPolarHBondContact CE-O 3.49Å; K1152-F1156 PolarHBondContact NZ-O 2.91Å; L1154-F1156 HydrophobicContact CB-CD2 4.08Å; L1154-F1156 HydrophobicContact CB-CE2 4.15Å; F1156-Q1160 HydrophobicContact CD1-CB 3.89Å; F1156-L1161 HydrophobicContact CB-CD2 4.29Å; F1156-L1161 HydrophobicContact CB-CG 4.21Å
1157	S	95.4	Very high	92.2	Very high	5 Å²	5	31.3 Å²	31.3	4%	0.035	15%	0.147	C	C	.	.			trans	-75.6	160	170.4	61.7	0	0	0	0	111.5	S1048 G1155 V1159 Q1160 L1161	S1048-S1157 PolarHBondContact O-OG 2.91Å; G1155-S1157 PolarHBondContact O-N 3.12Å; S1157-V1159 PolarHBondContact O-N 3.26Å; S1157-Q1160 PolarHBondContact O-N 2.98Å; S1157-Q1160 VanDerWaalsContact O-N 3.12Å; S1157-Q1160 WeakPolarHBondContact OG-CG 2.99Å; S1157-Q1160 PolarHBondContact OG-N 3.42Å; S1157-Q1160 PolarHBondContact OG-OE1 2.9Å; S1157-L1161 WeakPolarHBondContact O-CG 3.34Å; S1157-L1161 PolarHBondContact O-N 3.46Å
1158	D	95	Very high	92.1	Very high	5 Å²	5	32.8 Å²	32.8	3%	0.027	16%	0.159	C	C	.	.	H	α-helix	trans	-62.5	-26.1	174.3	-69.5	-4.9	0	0	0	111.3	K1152 A1162 P1169 V1172 R1176 E1320	K1152-D1158 IonicContact NZ-OD1 2.92Å; K1152-D1158 PolarHBondContact NZ-OD1 3.41Å; D1158-A1162 WeakPolarHBondContact O-CB 3.37Å; D1158-A1162 PolarHBondContact O-N 3.2Å; D1158-P1169 HydrophobicContact CB-CB 4.36Å; D1158-V1172 HydrophobicContact CB-CB 4.35Å; D1158-V1172 HydrophobicContact CB-CG1 4.06Å; D1158-R1176 IonicContact OD1-CZ 3.11Å; D1158-R1176 IonicContact OD1-NE 3.23Å; D1158-R1176 PolarHBondContact OD1-NE 3.03Å; D1158-R1176 IonicContact OD1-NH2 2.73Å; D1158-R1176 IonicContact OD2-CZ 3.21Å; D1158-R1176 IonicContact OD2-NE 2.88Å; D1158-R1176 PolarHBondContact OD2-NE 3.01Å; D1158-R1176 IonicContact OD2-NH2 2.78Å; D1158-R1176 PolarHBondContact OD2-NH2 3.02Å; D1158-E1320 WeakPolarHBondContact CB-OE2 3.24Å; D1158-E1320 VanDerWaalsContact CG-CD 3.5Å; D1158-E1320 PolarHBondContact N-OE2 2.98Å
1159	V	92.6	Very high	92	Very high	71 Å²	71	35.4 Å²	35.4	43%	0.43	18%	0.176	S	C	.	.	H	α-helix	trans	-67.4	-45.7	172.2	177.5	0	0	0	0	111.7	S1157 A1162 R1163 P1169	S1157-V1159 PolarHBondContact O-N 3.26Å; V1159-A1162 PolarHBondContact O-N 3.34Å; V1159-R1163 PolarHBondContact O-N 2.86Å; V1159-P1169 HydrophobicContact CG2-CB 4.34Å; V1159-P1169 HydrophobicContact CG2-CG 3.97Å
1160	Q	93.2	Very high	91.9	Very high	12 Å²	12	38.9 Å²	38.9	6%	0.056	20%	0.199	C	C	.	.	H	α-helix	trans	-64.5	-43.6	176.2	-71.7	171.9	-71.4	0	0	111.4	S1048 F1156 S1157 R1163 A1164	S1048-Q1160 WeakPolarHBondContact O-CG 3.42Å; S1048-Q1160 PolarHBondContact O-OE1 3.05Å; F1156-Q1160 HydrophobicContact CD1-CB 3.89Å; S1157-Q1160 PolarHBondContact O-N 2.98Å; S1157-Q1160 VanDerWaalsContact O-N 3.12Å; S1157-Q1160 WeakPolarHBondContact OG-CG 2.99Å; S1157-Q1160 PolarHBondContact OG-N 3.42Å; S1157-Q1160 PolarHBondContact OG-OE1 2.9Å; Q1160-R1163 PolarHBondContact O-N 3.37Å; Q1160-A1164 WeakPolarHBondContact O-CB 3.28Å; Q1160-A1164 PolarHBondContact O-N 3.31Å
1161	L	92.9	Very high	91.7	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-62.1	-43.3	176.1	-72	177.4	0	0	0	111.9	L1110 V1148 A1151 K1152 F1156 S1157 R1163 A1164 L1165 V1172	L1110-L1161 HydrophobicContact CD1-CD2 3.68Å; L1110-L1161 HydrophobicContact CD2-CD2 4.32Å; V1148-L1161 HydrophobicContact CG1-CD1 4.15Å; A1151-L1161 HydrophobicContact CB-CD2 3.7Å; K1152-L1161 HydrophobicContact CD-CD1 3.64Å; K1152-L1161 HydrophobicContact CG-CD1 4.36Å; F1156-L1161 HydrophobicContact CB-CD2 4.29Å; F1156-L1161 HydrophobicContact CB-CG 4.21Å; S1157-L1161 WeakPolarHBondContact O-CG 3.34Å; S1157-L1161 PolarHBondContact O-N 3.46Å; L1161-R1163 VanDerWaalsContact C-N 3.33Å; L1161-R1163 PolarHBondContact O-N 3.36Å; L1161-A1164 PolarHBondContact O-N 2.95Å; L1161-L1165 VanDerWaalsContact O-CB 3.24Å; L1161-L1165 WeakPolarHBondContact O-CB 3.47Å; L1161-L1165 VanDerWaalsContact O-CG 3.27Å; L1161-L1165 WeakPolarHBondContact O-CG 3.49Å; L1161-L1165 PolarHBondContact O-N 3.04Å; L1161-V1172 HydrophobicContact CB-CG1 3.78Å; L1161-V1172 HydrophobicContact CB-CG2 4.14Å; L1161-V1172 HydrophobicContact CD1-CG1 3.7Å; L1161-V1172 HydrophobicContact CG-CG1 4.4Å
1162	A	90.9	Very high	91.5	Very high	4 Å²	4	41 Å²	41	3%	0.033	21%	0.209	C	C	.	.	H	α-helix	trans	-61.7	-42.4	177.7	0	0	0	0	0	111.5	D1158 V1159 R1166 S1167 T1168 P1169 V1172	D1158-A1162 WeakPolarHBondContact O-CB 3.37Å; D1158-A1162 PolarHBondContact O-N 3.2Å; V1159-A1162 PolarHBondContact O-N 3.34Å; A1162-R1166 CarbonylContact O-C 3.32Å; A1162-R1166 WeakPolarHBondContact O-CA 3.26Å; A1162-R1166 PolarHBondContact O-N 2.79Å; A1162-S1167 PolarHBondContact O-N 3.48Å; A1162-T1168 VanDerWaalsContact CB-C 3.42Å; A1162-P1169 HydrophobicContact CB-CG 4.01Å; A1162-V1172 HydrophobicContact CB-CG2 4Å
1163	R	88.3	Confident	91.4	Very high	128 Å²	128	42.3 Å²	42.3	48%	0.483	21%	0.214	S	C	.	.	H	α-helix	trans	-63.1	-48.7	175.2	-173.6	-179.3	-67.1	155.1	0.1	111.8	S1048 D1051 V1159 Q1160 L1161 R1166	S1048-R1163 PolarHBondContact OG-NH1 3.04Å; D1051-R1163 IonicContact OD2-CZ 2.98Å; D1051-R1163 IonicContact OD2-NH1 3.68Å; D1051-R1163 PolarHBondContact OD2-NH1 3.47Å; V1159-R1163 PolarHBondContact O-N 2.86Å; Q1160-R1163 PolarHBondContact O-N 3.37Å; L1161-R1163 VanDerWaalsContact C-N 3.33Å; L1161-R1163 PolarHBondContact O-N 3.36Å; R1163-R1166 PolarHBondContact O-N 3.29Å
1164	A	88.6	Confident	91.4	Very high	10 Å²	10	43.7 Å²	43.7	8%	0.083	22%	0.219	C	C	.	.	H	α-helix	trans	-65.5	-39.2	-178.5	0	0	0	0	0	112.7	L1110 E1111 Q1160 L1161	L1110-A1164 HydrophobicContact CB-CB 3.8Å; L1110-A1164 HydrophobicContact CD1-CB 4.42Å; E1111-A1164 HydrophobicContact CG-CB 4Å; Q1160-A1164 WeakPolarHBondContact O-CB 3.28Å; Q1160-A1164 PolarHBondContact O-N 3.31Å; L1161-A1164 PolarHBondContact O-N 2.95Å
1165	L	88.5	Confident	91.2	Very high	20 Å²	20	42.4 Å²	42.4	11%	0.105	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.1	6.1	-179.1	-59.1	174.1	0	0	0	113.6	L1110 L1113 L1118 V1148 L1161 S1167	L1110-L1165 HydrophobicContact CB-CD2 4.46Å; L1110-L1165 HydrophobicContact CD2-CD2 4.13Å; L1113-L1165 HydrophobicContact CB-CD2 4.43Å; L1113-L1165 HydrophobicContact CD1-CD2 3.69Å; L1118-L1165 HydrophobicContact CD2-CB 4.31Å; L1118-L1165 HydrophobicContact CD2-CD1 4.19Å; V1148-L1165 HydrophobicContact CG2-CD1 4.18Å; L1161-L1165 VanDerWaalsContact O-CB 3.24Å; L1161-L1165 WeakPolarHBondContact O-CB 3.47Å; L1161-L1165 VanDerWaalsContact O-CG 3.27Å; L1161-L1165 WeakPolarHBondContact O-CG 3.49Å; L1161-L1165 PolarHBondContact O-N 3.04Å; L1165-S1167 VanDerWaalsContact C-N 3.32Å; L1165-S1167 PolarHBondContact O-N 3.04Å
1166	R	85.7	Confident	91	Very high	170 Å²	170	42.2 Å²	42.2	64%	0.642	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.7	49.7	-177.1	-53.4	-175.7	-171.4	-173.1	5.5	112.9	E1115 A1162 R1163	E1115-R1166 WeakPolarHBondContact OE1-CD 3.32Å; E1115-R1166 IonicContact OE1-CZ 3.5Å; E1115-R1166 IonicContact OE1-NE 3.26Å; E1115-R1166 IonicContact OE1-NH1 3.77Å; E1115-R1166 PolarHBondContact OE1-NH1 3.24Å; E1115-R1166 IonicContact OE2-NH1 2.56Å; E1115-R1166 PolarHBondContact OE2-NH1 3.05Å; A1162-R1166 CarbonylContact O-C 3.32Å; A1162-R1166 WeakPolarHBondContact O-CA 3.26Å; A1162-R1166 PolarHBondContact O-N 2.79Å; R1163-R1166 PolarHBondContact O-N 3.29Å
1167	S	88.6	Confident	90.7	Very high	41 Å²	41	44.3 Å²	44.3	29%	0.287	22%	0.219	S	C	.	.	S	Bend	trans	-129.1	-167.5	-177.3	-168.8	0	0	0	0	110.7	A1162 L1165 M1171	A1162-S1167 PolarHBondContact O-N 3.48Å; L1165-S1167 VanDerWaalsContact C-N 3.32Å; L1165-S1167 PolarHBondContact O-N 3.04Å; S1167-M1171 WeakPolarHBondContact OG-CB 3.26Å
1168	T	88.7	Confident	90.3	Very high	72 Å²	72	48 Å²	48	44%	0.442	24%	0.236	S	C	.	.			trans	-111	151.4	172.9	69.8	0	0	0	0	111	A1162 V1170 M1171 V1172	A1162-T1168 VanDerWaalsContact CB-C 3.42Å; T1168-V1170 PolarHBondContact O-N 2.87Å; T1168-V1170 VanDerWaalsContact O-N 3.15Å; T1168-M1171 PolarHBondContact O-N 3.11Å; T1168-M1171 VanDerWaalsContact OG1-CG 3.31Å; T1168-M1171 WeakPolarHBondContact OG1-CG 3.5Å; T1168-M1171 PolarHBondContact OG1-N 3.46Å; T1168-V1172 PolarHBondContact O-N 3.36Å; T1168-V1172 VanDerWaalsContact O-N 3.09Å
1169	P	90.6	Very high	89.8	Confident	57 Å²	57	48.5 Å²	48.5	37%	0.37	24%	0.239	S	C	.	.	H	α-helix	trans	-56.3	-33.4	179.3	-25.6	34	0	0	0	113.2	D1158 V1159 A1162 V1172 R1173	D1158-P1169 HydrophobicContact CB-CB 4.36Å; V1159-P1169 HydrophobicContact CG2-CB 4.34Å; V1159-P1169 HydrophobicContact CG2-CG 3.97Å; A1162-P1169 HydrophobicContact CB-CG 4.01Å; P1169-V1172 PolarHBondContact O-N 2.83Å; P1169-R1173 WeakPolarHBondContact O-CB 3.12Å; P1169-R1173 PolarHBondContact O-N 3.48Å
1170	V	87.7	Confident	89.3	Confident	98 Å²	98	48.1 Å²	48.1	59%	0.594	23%	0.234	S	C	*	.	H	α-helix	trans	-65.5	-41.9	177.3	179.7	0	0	0	0	111.6	T1168 R1173 W1174	T1168-V1170 PolarHBondContact O-N 2.87Å; T1168-V1170 VanDerWaalsContact O-N 3.15Å; V1170-R1173 PolarHBondContact O-N 3.46Å; V1170-W1174 PolarHBondContact O-N 2.91Å
1171	M	87.9	Confident	89.1	Confident	82 Å²	82	47.9 Å²	47.9	40%	0.404	23%	0.233	S	C	.	.	H	α-helix	trans	-68.8	-38.2	177.4	-68.6	-64.8	-83.6	0	0	111.6	M1122 S1167 T1168 W1174 F1175	M1122-M1171 HydrophobicContact CE-CB 4.03Å; M1122-M1171 HydrophobicContact CE-CE 3.32Å; M1122-M1171 HydrophobicContact CE-CG 4.49Å; M1122-M1171 WeakPolarHBondContact CE-O 3.37Å; M1122-M1171 HydrophobicContact CE-SD 3.77Å; M1122-M1171 HydrophobicContact SD-CB 4.4Å; M1122-M1171 HydrophobicContact SD-CE 3.71Å; S1167-M1171 WeakPolarHBondContact OG-CB 3.26Å; T1168-M1171 PolarHBondContact O-N 3.11Å; T1168-M1171 VanDerWaalsContact OG1-CG 3.31Å; T1168-M1171 WeakPolarHBondContact OG1-CG 3.5Å; T1168-M1171 PolarHBondContact OG1-N 3.46Å; M1171-W1174 PolarHBondContact O-N 2.97Å; M1171-F1175 PolarHBondContact O-N 3.43Å
1172	V	92.1	Very high	89	Confident	1 Å²	1	49.6 Å²	49.6	1%	0.006	24%	0.242	C	C	.	.	H	α-helix	trans	-61.7	-46.6	172.8	174.6	0	0	0	0	110.8	D1158 L1161 A1162 T1168 P1169 W1174 F1175 R1176	D1158-V1172 HydrophobicContact CB-CB 4.35Å; D1158-V1172 HydrophobicContact CB-CG1 4.06Å; L1161-V1172 HydrophobicContact CB-CG1 3.78Å; L1161-V1172 HydrophobicContact CB-CG2 4.14Å; L1161-V1172 HydrophobicContact CD1-CG1 3.7Å; L1161-V1172 HydrophobicContact CG-CG1 4.4Å; A1162-V1172 HydrophobicContact CB-CG2 4Å; T1168-V1172 PolarHBondContact O-N 3.36Å; T1168-V1172 VanDerWaalsContact O-N 3.09Å; P1169-V1172 PolarHBondContact O-N 2.83Å; V1172-W1174 PolarHBondContact O-N 2.78Å; V1172-F1175 PolarHBondContact O-N 3.33Å; V1172-R1176 WeakPolarHBondContact O-CG 2.98Å; V1172-R1176 PolarHBondContact O-N 3.33Å
1173	R	93	Very high	89.1	Confident	31 Å²	31	49.8 Å²	49.8	12%	0.117	24%	0.243	C	C	.	.	H	α-helix	trans	-57.6	-47.8	175	-177.5	177.8	-174.2	74.7	0.4	111.2	P1169 V1170 F1175 R1176 K1177 D1324 E1327	P1169-R1173 WeakPolarHBondContact O-CB 3.12Å; P1169-R1173 PolarHBondContact O-N 3.48Å; V1170-R1173 PolarHBondContact O-N 3.46Å; R1173-F1175 VanDerWaalsContact C-N 3.29Å; R1173-F1175 PolarHBondContact O-N 2.97Å; R1173-R1176 PolarHBondContact O-N 3.11Å; R1173-K1177 HydrophobicContact CG-CG 4.17Å; R1173-K1177 WeakPolarHBondContact O-CB 3.33Å; R1173-K1177 VanDerWaalsContact O-CG 3.28Å; R1173-K1177 WeakPolarHBondContact O-CG 3.21Å; R1173-K1177 PolarHBondContact O-N 3.12Å; R1173-D1324 IonicContact CZ-OD1 3.35Å; R1173-D1324 IonicContact NH1-OD1 2.92Å; R1173-D1324 PolarHBondContact NH1-OD1 3.34Å; R1173-D1324 IonicContact NH2-OD1 3.65Å; R1173-D1324 PolarHBondContact NH2-OD1 3.44Å; R1173-E1327 IonicContact CZ-OE1 3.03Å; R1173-E1327 IonicContact NE-OE1 3.95Å; R1173-E1327 IonicContact NH2-OE1 2.81Å; R1173-E1327 PolarHBondContact NH2-OE1 2.89Å; R1173-E1327 IonicContact NH2-OE2 3.73Å; R1173-E1327 PolarHBondContact NH2-OE2 3.28Å
1174	W	91.5	Very high	89.2	Confident	72 Å²	72	44.2 Å²	44.2	27%	0.273	22%	0.223	S	C	.	.	H	α-helix	trans	-54.3	-48.4	176.6	-176.8	101.5	0	0	0	110.8	M1122 E1126 V1170 M1171 V1172 R1176 K1177 H1178	M1122-W1174 HydrophobicContact CB-CE3 4.28Å; M1122-W1174 HydrophobicContact CB-CH2 4.3Å; M1122-W1174 HydrophobicContact CB-CZ3 3.65Å; M1122-W1174 HydrophobicContact CE-CB 4.19Å; M1122-W1174 HydrophobicContact CE-CD2 3.73Å; M1122-W1174 HydrophobicContact CE-CE3 3.2Å; M1122-W1174 HydrophobicContact CE-CG 4.17Å; M1122-W1174 HydrophobicContact CE-CZ3 3.83Å; M1122-W1174 HydrophobicContact CG-CE3 4.01Å; M1122-W1174 HydrophobicContact CG-CZ3 3.79Å; M1122-W1174 HydrophobicContact SD-CE3 4.48Å; E1126-W1174 HydrophobicContact CB-CH2 4.17Å; E1126-W1174 HydrophobicContact CB-CZ2 4.48Å; V1170-W1174 PolarHBondContact O-N 2.91Å; M1171-W1174 PolarHBondContact O-N 2.97Å; V1172-W1174 PolarHBondContact O-N 2.78Å; W1174-R1176 PolarHBondContact O-N 3.09Å; W1174-K1177 PolarHBondContact O-N 3.32Å; W1174-H1178 AromaticContact CD1-CE1 3.52Å; W1174-H1178 AromaticContact CD1-ND1 3.94Å; W1174-H1178 AromaticContact CD2-CE1 3.51Å; W1174-H1178 AromaticContact CD2-ND1 3.33Å; W1174-H1178 VanDerWaalsContact CD2-ND1 3.33Å; W1174-H1178 AromaticContact CE2-CE1 3.07Å; W1174-H1178 AromaticContact CE2-ND1 3.37Å; W1174-H1178 AromaticContact CE2-NE2 3.57Å; W1174-H1178 AromaticContact CE3-ND1 3.68Å; W1174-H1178 AromaticContact CG-CE1 3.8Å; W1174-H1178 AromaticContact CG-ND1 3.75Å; W1174-H1178 AromaticContact CH2-CD2 4Å; W1174-H1178 AromaticContact CH2-CG 3.97Å; W1174-H1178 AromaticContact CZ2-CD2 3.79Å; W1174-H1178 AromaticContact CZ2-CE1 3.5Å; W1174-H1178 VanDerWaalsContact CZ2-CE1 3.5Å; W1174-H1178 WeakPolarHBondContact CZ2-CE1 3.19Å; W1174-H1178 AromaticContact CZ2-CG 3.97Å; W1174-H1178 AromaticContact CZ2-ND1 3.78Å; W1174-H1178 AromaticContact CZ2-NE2 3.49Å; W1174-H1178 WeakPolarHBondContact CZ2-NE2 3.38Å; W1174-H1178 HydrophobicContact CZ3-CB 4.39Å; W1174-H1178 AromaticContact NE1-CE1 3.07Å; W1174-H1178 PolarHBondContact NE1-CE1 3.46Å; W1174-H1178 AromaticContact NE1-ND1 3.74Å; W1174-H1178 AromaticContact NE1-NE2 3.74Å; W1174-H1178 PolarHBondContact O-N 3.01Å; W1174-H1178 PolarHBondContact O-ND1 3.41Å
1175	F	91.5	Very high	89.5	Confident	1 Å²	1	44 Å²	44	0%	0.004	22%	0.22	C	C	.	.	H	α-helix	trans	-61.6	-46.3	-179.5	-174.7	-115.9	0	0	0	111.7	L1118 A1121 M1122 L1125 L1141 H1144 V1148 M1171 V1172 R1173 K1177 H1178 L1179	L1118-F1175 HydrophobicContact CD1-CD1 3.85Å; L1118-F1175 HydrophobicContact CD1-CD2 4.25Å; L1118-F1175 HydrophobicContact CD1-CE1 4.01Å; L1118-F1175 HydrophobicContact CD1-CE2 4.4Å; L1118-F1175 HydrophobicContact CD1-CG 3.97Å; L1118-F1175 HydrophobicContact CD1-CZ 4.28Å; A1121-F1175 HydrophobicContact CB-CE2 4.26Å; M1122-F1175 HydrophobicContact CG-CB 4.27Å; M1122-F1175 HydrophobicContact CG-CD2 3.71Å; M1122-F1175 HydrophobicContact CG-CE2 4.47Å; M1122-F1175 HydrophobicContact CG-CG 4.31Å; L1125-F1175 HydrophobicContact CD2-CD2 3.96Å; L1125-F1175 HydrophobicContact CD2-CE2 3.98Å; L1141-F1175 HydrophobicContact CD1-CE2 3.85Å; L1141-F1175 HydrophobicContact CD1-CZ 4.09Å; H1144-F1175 HydrophobicContact CB-CE1 4.29Å; H1144-F1175 HydrophobicContact CB-CZ 4.07Å; V1148-F1175 HydrophobicContact CG2-CD1 4.32Å; V1148-F1175 HydrophobicContact CG2-CE1 4.12Å; M1171-F1175 PolarHBondContact O-N 3.43Å; V1172-F1175 PolarHBondContact O-N 3.33Å; R1173-F1175 VanDerWaalsContact C-N 3.29Å; R1173-F1175 PolarHBondContact O-N 2.97Å; F1175-K1177 PolarHBondContact O-N 3.2Å; F1175-H1178 PolarHBondContact O-N 3.44Å; F1175-L1179 HydrophobicContact CD1-CD1 3.92Å; F1175-L1179 HydrophobicContact CE1-CD1 3.53Å; F1175-L1179 HydrophobicContact CE2-CD1 4.21Å; F1175-L1179 HydrophobicContact CG-CD1 4.42Å; F1175-L1179 HydrophobicContact CZ-CD1 3.7Å; F1175-L1179 HydrophobicContact CZ-CG 4.48Å; F1175-L1179 WeakPolarHBondContact O-CG 3.45Å; F1175-L1179 PolarHBondContact O-N 2.88Å
1176	R	92	Very high	89.6	Confident	0 Å²	0	43 Å²	43	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-59.4	-45.4	174.6	-69.1	-165.4	-56.8	102.1	-7.1	112.6	V1148 D1158 V1172 R1173 W1174 H1178 L1179 N1180 L1181 Y1206 E1320 D1324	V1148-R1176 HydrophobicContact CG1-CG 4Å; D1158-R1176 IonicContact OD1-CZ 3.11Å; D1158-R1176 IonicContact OD1-NE 3.23Å; D1158-R1176 PolarHBondContact OD1-NE 3.03Å; D1158-R1176 IonicContact OD1-NH2 2.73Å; D1158-R1176 IonicContact OD2-CZ 3.21Å; D1158-R1176 IonicContact OD2-NE 2.88Å; D1158-R1176 PolarHBondContact OD2-NE 3.01Å; D1158-R1176 IonicContact OD2-NH2 2.78Å; D1158-R1176 PolarHBondContact OD2-NH2 3.02Å; V1172-R1176 WeakPolarHBondContact O-CG 2.98Å; V1172-R1176 PolarHBondContact O-N 3.33Å; R1173-R1176 PolarHBondContact O-N 3.11Å; W1174-R1176 PolarHBondContact O-N 3.09Å; R1176-H1178 VanDerWaalsContact C-N 3.34Å; R1176-H1178 PolarHBondContact O-N 3.03Å; R1176-L1179 CarbonylContact O-C 3.52Å; R1176-L1179 PolarHBondContact O-N 3.36Å; R1176-N1180 PolarHBondContact O-N 2.85Å; R1176-N1180 VanDerWaalsContact O-N 3.08Å; R1176-L1181 HydrophobicContact CB-CB 4.2Å; R1176-L1181 HydrophobicContact CG-CD2 4.12Å; R1176-L1181 PolarHBondContact NH1-O 3.21Å; R1176-L1181 PolarHBondContact O-N 3.44Å; R1176-Y1206 PolarHBondContact NH1-OH 2.96Å; R1176-E1320 IonicContact NH2-OE1 2.68Å; R1176-D1324 IonicContact NH2-OD2 2.79Å
1177	K	89.4	Confident	89.9	Confident	50 Å²	50	35.7 Å²	35.7	22%	0.217	19%	0.189	C	C	.	.	H	α-helix	trans	-64.1	-39	-178.2	-68.5	-67.4	175.6	-172.6	0	111.7	R1173 W1174 F1175 L1179 N1180 N1182 D1324 E1327	R1173-K1177 HydrophobicContact CG-CG 4.17Å; R1173-K1177 WeakPolarHBondContact O-CB 3.33Å; R1173-K1177 VanDerWaalsContact O-CG 3.28Å; R1173-K1177 WeakPolarHBondContact O-CG 3.21Å; R1173-K1177 PolarHBondContact O-N 3.12Å; W1174-K1177 PolarHBondContact O-N 3.32Å; F1175-K1177 PolarHBondContact O-N 3.2Å; K1177-L1179 VanDerWaalsContact C-N 3.34Å; K1177-N1180 WeakPolarHBondContact O-CA 3.48Å; K1177-N1180 PolarHBondContact O-N 3.42Å; K1177-N1182 VanDerWaalsContact CD-OD1 3.31Å; K1177-N1182 WeakPolarHBondContact CD-OD1 3.35Å; K1177-N1182 WeakPolarHBondContact CE-OD1 3.3Å; K1177-N1182 PolarHBondContact NZ-OD1 3.11Å; K1177-D1324 IonicContact NZ-OD1 3.53Å; K1177-D1324 PolarHBondContact NZ-OD1 3.28Å; K1177-E1327 VanDerWaalsContact CE-OE2 3.24Å; K1177-E1327 WeakPolarHBondContact CE-OE2 3.46Å; K1177-E1327 IonicContact NZ-OE2 2.91Å; K1177-E1327 PolarHBondContact NZ-OE2 2.94Å
1178	H	87.1	Confident	90	Very high	84 Å²	84	33.8 Å²	33.8	39%	0.389	18%	0.175	S	C	.	.	H	α-helix	trans	-69.1	-32.7	175.5	-73	72.3	0	0	0	112.2	L1125 W1174 F1175 R1176 N1180 M1242	L1125-H1178 HydrophobicContact CD2-CB 3.45Å; L1125-H1178 VanDerWaalsContact CD2-CB 3.45Å; L1125-H1178 HydrophobicContact CG-CB 4.1Å; W1174-H1178 AromaticContact CD1-CE1 3.52Å; W1174-H1178 AromaticContact CD1-ND1 3.94Å; W1174-H1178 AromaticContact CD2-CE1 3.51Å; W1174-H1178 AromaticContact CD2-ND1 3.33Å; W1174-H1178 VanDerWaalsContact CD2-ND1 3.33Å; W1174-H1178 AromaticContact CE2-CE1 3.07Å; W1174-H1178 AromaticContact CE2-ND1 3.37Å; W1174-H1178 AromaticContact CE2-NE2 3.57Å; W1174-H1178 AromaticContact CE3-ND1 3.68Å; W1174-H1178 AromaticContact CG-CE1 3.8Å; W1174-H1178 AromaticContact CG-ND1 3.75Å; W1174-H1178 AromaticContact CH2-CD2 4Å; W1174-H1178 AromaticContact CH2-CG 3.97Å; W1174-H1178 AromaticContact CZ2-CD2 3.79Å; W1174-H1178 AromaticContact CZ2-CE1 3.5Å; W1174-H1178 VanDerWaalsContact CZ2-CE1 3.5Å; W1174-H1178 WeakPolarHBondContact CZ2-CE1 3.19Å; W1174-H1178 AromaticContact CZ2-CG 3.97Å; W1174-H1178 AromaticContact CZ2-ND1 3.78Å; W1174-H1178 AromaticContact CZ2-NE2 3.49Å; W1174-H1178 WeakPolarHBondContact CZ2-NE2 3.38Å; W1174-H1178 HydrophobicContact CZ3-CB 4.39Å; W1174-H1178 AromaticContact NE1-CE1 3.07Å; W1174-H1178 PolarHBondContact NE1-CE1 3.46Å; W1174-H1178 AromaticContact NE1-ND1 3.74Å; W1174-H1178 AromaticContact NE1-NE2 3.74Å; W1174-H1178 PolarHBondContact O-N 3.01Å; W1174-H1178 PolarHBondContact O-ND1 3.41Å; F1175-H1178 PolarHBondContact O-N 3.44Å; R1176-H1178 VanDerWaalsContact C-N 3.34Å; R1176-H1178 PolarHBondContact O-N 3.03Å; H1178-N1180 PolarHBondContact O-N 3.15Å; H1178-M1242 WeakPolarHBondContact O-CE 3.41Å
1179	L	84.2	Confident	89.9	Confident	15 Å²	15	30.4 Å²	30.4	8%	0.079	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-0.1	168.8	-66.1	175	0	0	0	113.9	L1125 A1145 F1175 R1176 K1177 L1181 M1242	L1125-L1179 HydrophobicContact CD1-CD2 4.02Å; L1125-L1179 HydrophobicContact CD2-CD2 3.9Å; L1125-L1179 HydrophobicContact CD2-CG 3.96Å; A1145-L1179 HydrophobicContact CB-CD1 3.6Å; A1145-L1179 HydrophobicContact CB-CD2 3.96Å; A1145-L1179 HydrophobicContact CB-CG 4.46Å; F1175-L1179 HydrophobicContact CD1-CD1 3.92Å; F1175-L1179 HydrophobicContact CE1-CD1 3.53Å; F1175-L1179 HydrophobicContact CE2-CD1 4.21Å; F1175-L1179 HydrophobicContact CG-CD1 4.42Å; F1175-L1179 HydrophobicContact CZ-CD1 3.7Å; F1175-L1179 HydrophobicContact CZ-CG 4.48Å; F1175-L1179 WeakPolarHBondContact O-CG 3.45Å; F1175-L1179 PolarHBondContact O-N 2.88Å; R1176-L1179 CarbonylContact O-C 3.52Å; R1176-L1179 PolarHBondContact O-N 3.36Å; K1177-L1179 VanDerWaalsContact C-N 3.34Å; L1179-L1181 HydrophobicContact CB-CB 4.38Å; L1179-L1181 PolarHBondContact O-N 3.41Å; L1179-M1242 HydrophobicContact CD2-CE 4.29Å; L1179-M1242 HydrophobicContact CD2-CG 4.36Å; L1179-M1242 HydrophobicContact CD2-SD 4.31Å
1180	N	83.6	Confident	89.6	Confident	62 Å²	62	27.7 Å²	27.7	33%	0.332	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.9	22	-173.3	-156.2	23.4	0	0	0	114.4	R1176 K1177 H1178 N1182 M1242 K1246	R1176-N1180 PolarHBondContact O-N 2.85Å; R1176-N1180 VanDerWaalsContact O-N 3.08Å; K1177-N1180 WeakPolarHBondContact O-CA 3.48Å; K1177-N1180 PolarHBondContact O-N 3.42Å; H1178-N1180 PolarHBondContact O-N 3.15Å; N1180-N1182 PolarHBondContact O-N 2.87Å; N1180-N1182 VanDerWaalsContact O-N 3.08Å; N1180-M1242 WeakPolarHBondContact CB-O 3.42Å; N1180-M1242 VanDerWaalsContact CG-O 3.32Å; N1180-M1242 PolarHBondContact ND2-O 3.05Å; N1180-K1246 WeakPolarHBondContact O-CE 3.26Å; N1180-K1246 PolarHBondContact O-NZ 3.4Å; N1180-K1246 WeakPolarHBondContact OD1-CE 3.43Å; N1180-K1246 PolarHBondContact OD1-NZ 3.15Å
1181	L	88.1	Confident	89.6	Confident	8 Å²	8	23.6 Å²	23.6	4%	0.042	11%	0.112	C	C	.	.			trans	-81.3	84.1	-178.7	-176.2	62.2	0	0	0	110.9	V1148 M1149 K1152 R1176 L1179 Y1206 I1209	V1148-L1181 HydrophobicContact CG1-CD2 3.98Å; M1149-L1181 HydrophobicContact CB-CD2 4.42Å; M1149-L1181 HydrophobicContact CG-CD1 3.93Å; M1149-L1181 HydrophobicContact CG-CD2 3.74Å; M1149-L1181 HydrophobicContact CG-CG 4.42Å; K1152-L1181 HydrophobicContact CB-CD2 4.49Å; K1152-L1181 HydrophobicContact CG-CD2 3.95Å; R1176-L1181 HydrophobicContact CB-CB 4.2Å; R1176-L1181 HydrophobicContact CG-CD2 4.12Å; R1176-L1181 PolarHBondContact NH1-O 3.21Å; R1176-L1181 PolarHBondContact O-N 3.44Å; L1179-L1181 HydrophobicContact CB-CB 4.38Å; L1179-L1181 PolarHBondContact O-N 3.41Å; L1181-Y1206 HydrophobicContact CD1-CD1 4.13Å; L1181-Y1206 HydrophobicContact CD1-CE1 4.36Å; L1181-Y1206 HydrophobicContact CG-CD1 4.36Å; L1181-Y1206 HydrophobicContact CG-CE1 4.14Å; L1181-I1209 HydrophobicContact CD1-CD1 3.67Å; L1181-I1209 HydrophobicContact CD1-CG2 4.22Å
1182	N	90.2	Very high	89.7	Confident	35 Å²	35	19.7 Å²	19.7	19%	0.187	9%	0.093	C	C	.	.			trans	-109.8	153.1	174.1	-70	-23.5	0	0	0	110.5	K1177 N1180 I1209 K1246	K1177-N1182 VanDerWaalsContact CD-OD1 3.31Å; K1177-N1182 WeakPolarHBondContact CD-OD1 3.35Å; K1177-N1182 WeakPolarHBondContact CE-OD1 3.3Å; K1177-N1182 PolarHBondContact NZ-OD1 3.11Å; N1180-N1182 PolarHBondContact O-N 2.87Å; N1180-N1182 VanDerWaalsContact O-N 3.08Å; N1182-I1209 VanDerWaalsContact O-CD1 3.26Å; N1182-I1209 WeakPolarHBondContact O-CD1 3.4Å; N1182-K1246 PolarHBondContact ND2-NZ 3.5Å
1183	P	93	Very high	89.4	Confident	8 Å²	8	19.6 Å²	19.6	5%	0.052	9%	0.092	C	C	.	.			trans	-67.8	145.7	174.3	33.1	-34.9	0	0	0	110.1	Y1206 R1321 D1324	P1183-Y1206 HydrophobicContact CB-CD2 4Å; P1183-Y1206 HydrophobicContact CB-CE1 4.23Å; P1183-Y1206 HydrophobicContact CB-CE2 3.64Å; P1183-Y1206 HydrophobicContact CB-CG 4.44Å; P1183-Y1206 WeakPolarHBondContact CD-OH 3.46Å; P1183-Y1206 HydrophobicContact CG-CE2 4.28Å; P1183-R1321 VanDerWaalsContact CG-NH1 3.28Å; P1183-D1324 WeakPolarHBondContact CD-OD2 3.03Å; P1183-D1324 HydrophobicContact CG-CB 3.94Å
1184	L	92	Very high	89.1	Confident	12 Å²	12	18.7 Å²	18.7	6%	0.063	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	154	170	-61.3	174.9	0	0	0	109.6	T1204 T1205 D1208 I1209 K1246	L1184-T1204 CarbonylContact O-C 3.58Å; L1184-T1204 VanDerWaalsContact O-CA 3.24Å; L1184-T1204 WeakPolarHBondContact O-CA 3.29Å; L1184-T1205 PolarHBondContact N-O 3.3Å; L1184-T1205 PolarHBondContact O-N 2.72Å; L1184-D1208 HydrophobicContact CD1-CB 3.94Å; L1184-I1209 HydrophobicContact CD1-CG1 4.08Å; L1184-I1209 HydrophobicContact CG-CG1 4.18Å; L1184-K1246 HydrophobicContact CD2-CB 3.92Å; L1184-K1246 HydrophobicContact CD2-CG 4.24Å
1185	I	93.4	Very high	88.9	Confident	4 Å²	4	17 Å²	17	2%	0.021	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	120.7	-178.4	-65.4	166.6	0	0	0	107.5	L1202 T1204 H1248 D1249 V1250 Y1313 F1328	I1185-L1202 HydrophobicContact CG2-CB 4.18Å; I1185-L1202 HydrophobicContact CG2-CD1 4.18Å; I1185-L1202 HydrophobicContact CG2-CD2 3.98Å; I1185-L1202 HydrophobicContact CG2-CG 4.35Å; I1185-T1204 HydrophobicContact CG1-CG2 4.39Å; I1185-H1248 HydrophobicContact CB-CB 4.42Å; I1185-H1248 PolarHBondContact N-ND1 3.16Å; I1185-D1249 PolarHBondContact O-N 2.87Å; I1185-V1250 HydrophobicContact CG2-CG2 3.85Å; I1185-Y1313 HydrophobicContact CD1-CE1 4.06Å; I1185-Y1313 HydrophobicContact CG1-CE1 4.17Å; I1185-Y1313 HydrophobicContact CG2-CE1 3.82Å; I1185-F1328 HydrophobicContact CD1-CB 3.82Å; I1185-F1328 HydrophobicContact CD1-CD1 3.07Å; I1185-F1328 HydrophobicContact CD1-CD2 3.61Å; I1185-F1328 HydrophobicContact CD1-CE1 3.36Å; I1185-F1328 HydrophobicContact CD1-CE2 3.87Å; I1185-F1328 HydrophobicContact CD1-CG 3.19Å; I1185-F1328 HydrophobicContact CD1-CZ 3.74Å
1186	R	92.1	Very high	88.6	Confident	0 Å²	0	19.3 Å²	19.3	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	148.5	-172.7	-67.4	-70.5	178.5	-119.7	-1.9	110.1	D363 L1202 Y1203 T1205 D1208 I1247 D1249	D363-R1186 IonicContact OD1-NH2 2.89Å; D363-R1186 IonicContact OD2-CZ 3.94Å; D363-R1186 IonicContact OD2-NH2 3.73Å; D363-R1186 PolarHBondContact OD2-NH2 2.72Å; R1186-L1202 VanDerWaalsContact O-CA 3.28Å; R1186-L1202 WeakPolarHBondContact O-CA 3.39Å; R1186-Y1203 HydrophobicContact CB-CD1 4.07Å; R1186-Y1203 HydrophobicContact CB-CD2 4.42Å; R1186-Y1203 HydrophobicContact CB-CE1 3.48Å; R1186-Y1203 VanDerWaalsContact CB-CE1 3.48Å; R1186-Y1203 HydrophobicContact CB-CE2 3.86Å; R1186-Y1203 HydrophobicContact CG-CE2 4.29Å; R1186-Y1203 PolarHBondContact N-O 3.03Å; R1186-Y1203 PolarHBondContact O-N 3.17Å; R1186-T1205 HydrophobicContact CG-CG2 3.73Å; R1186-D1208 IonicContact CZ-OD2 3.89Å; R1186-D1208 IonicContact NE-OD2 3.01Å; R1186-D1208 PolarHBondContact NE-OD2 2.95Å; R1186-D1208 IonicContact NH2-OD2 3.25Å; R1186-I1247 PolarHBondContact NH1-O 2.92Å; R1186-D1249 WeakPolarHBondContact CD-OD1 3.23Å; R1186-D1249 IonicContact CZ-OD1 3.7Å; R1186-D1249 IonicContact NE-OD1 3.97Å; R1186-D1249 IonicContact NH1-OD1 4Å; R1186-D1249 PolarHBondContact NH1-OD1 2.77Å
1187	L	91.3	Very high	88.2	Confident	17 Å²	17	20.4 Å²	20.4	9%	0.089	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	143	173.8	-72.2	159.6	0	0	0	110.3	D1189 T1199 Y1201 L1202 D1249 V1250	L1187-D1189 PolarHBondContact O-N 3.05Å; L1187-T1199 HydrophobicContact CB-CG2 4.33Å; L1187-T1199 HydrophobicContact CD2-CG2 4Å; L1187-T1199 VanDerWaalsContact CD2-O 3.24Å; L1187-T1199 WeakPolarHBondContact CD2-O 3.05Å; L1187-Y1201 WeakPolarHBondContact CA-O 3.45Å; L1187-L1202 HydrophobicContact CD2-CD2 3.39Å; L1187-L1202 HydrophobicContact CD2-CG 4.49Å; L1187-L1202 HydrophobicContact CG-CD2 3.88Å; L1187-D1249 HydrophobicContact CB-CB 4.4Å; L1187-D1249 HydrophobicContact CD1-CB 3.84Å; L1187-D1249 HydrophobicContact CG-CB 3.92Å; L1187-D1249 PolarHBondContact N-OD2 3.37Å; L1187-V1250 HydrophobicContact CD1-CG1 3.93Å; L1187-V1250 HydrophobicContact CD2-CG1 3.81Å; L1187-V1250 HydrophobicContact CG-CG1 3.92Å
1188	V	89.7	Confident	87.7	Confident	0 Å²	0	22.4 Å²	22.4	0%	0	12%	0.124	C	C	.	.			trans	-74.2	108.1	166.1	177.7	0	0	0	0	108.2	Y995 I1028 T1199 Y1201 Y1203	Y995-V1188 HydrophobicContact CE1-CG1 4.36Å; Y995-V1188 HydrophobicContact CE2-CG1 4.45Å; Y995-V1188 WeakPolarHBondContact OH-CG1 3.37Å; I1028-V1188 HydrophobicContact CD1-CG2 3.72Å; V1188-T1199 WeakPolarHBondContact O-CG2 3.37Å; V1188-Y1201 HydrophobicContact CB-CD2 4.43Å; V1188-Y1201 HydrophobicContact CG1-CD2 4.47Å; V1188-Y1201 PolarHBondContact N-O 3.41Å; V1188-Y1203 HydrophobicContact CG2-CD1 3.99Å; V1188-Y1203 HydrophobicContact CG2-CE1 4.49Å
1189	D	87.7	Confident	87.5	Confident	1 Å²	1	19.3 Å²	19.3	1%	0.005	11%	0.111	C	C	.	.			trans	-112.6	120.8	-173.8	-168.2	-23.1	0	0	0	111.1	R365 L1187 V1191 G1193 A1197	R365-D1189 IonicContact CZ-OD2 2.92Å; R365-D1189 IonicContact NH1-OD2 3.45Å; R365-D1189 PolarHBondContact NH1-OD2 3.31Å; R365-D1189 IonicContact NH2-OD2 3.49Å; R365-D1189 PolarHBondContact NH2-OD2 2.95Å; L1187-D1189 PolarHBondContact O-N 3.05Å; D1189-V1191 PolarHBondContact O-N 2.78Å; D1189-V1191 VanDerWaalsContact OD1-CG2 3.22Å; D1189-V1191 WeakPolarHBondContact OD1-CG2 3.49Å; D1189-V1191 PolarHBondContact OD1-N 2.85Å; D1189-G1193 WeakPolarHBondContact OD2-CA 3.4Å; D1189-G1193 PolarHBondContact OD2-N 2.68Å; D1189-A1197 HydrophobicContact CB-CB 4.46Å
1190	T	83.8	Confident	87.6	Confident	0 Å²	0	19.6 Å²	19.6	0%	0	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-13.1	-179.4	50.7	0	0	0	0	113.7	T956 N978 V980 F989 P991 S992	T956-T1190 WeakPolarHBondContact O-CG2 3.46Å; N978-T1190 PolarHBondContact ND2-OG1 2.97Å; V980-T1190 HydrophobicContact CB-CG2 3.95Å; V980-T1190 HydrophobicContact CG1-CG2 3.98Å; V980-T1190 HydrophobicContact CG2-CG2 3.7Å; F989-T1190 HydrophobicContact CZ-CG2 4.29Å; P991-T1190 CarbonylContact C-O 3.58Å; P991-T1190 VanDerWaalsContact CA-O 3.24Å; P991-T1190 WeakPolarHBondContact CA-O 3.42Å; S992-T1190 PolarHBondContact N-O 3.16Å; S992-T1190 CarbonylContact O-C 3.58Å
1191	V	88.1	Confident	87.9	Confident	12 Å²	12	16.9 Å²	16.9	7%	0.073	10%	0.098	C	C	.	.	B	Isolated β-bridge	trans	-130.8	25.5	-172.6	-63.2	0	0	0	0	112.4	T981 F989 D1189 G1193 E1194 W1195	T981-V1191 HydrophobicContact CG2-CG2 4.47Å; F989-V1191 HydrophobicContact CD2-CG1 4.18Å; F989-V1191 HydrophobicContact CE2-CG1 3.77Å; F989-V1191 HydrophobicContact CZ-CG1 4.49Å; D1189-V1191 PolarHBondContact O-N 2.78Å; D1189-V1191 VanDerWaalsContact OD1-CG2 3.22Å; D1189-V1191 WeakPolarHBondContact OD1-CG2 3.49Å; D1189-V1191 PolarHBondContact OD1-N 2.85Å; V1191-G1193 PolarHBondContact O-N 2.82Å; V1191-E1194 HydrophobicContact CB-CB 4.28Å; V1191-E1194 HydrophobicContact CG2-CB 4.34Å; V1191-E1194 WeakPolarHBondContact O-CB 3.16Å; V1191-E1194 PolarHBondContact O-N 3.07Å; V1191-W1195 HydrophobicContact CG2-CB 3.92Å
1192	A	89.6	Confident	88.2	Confident	0 Å²	0	16.6 Å²	16.6	0%	0	10%	0.096	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.5	33.1	174.1	0	0	0	0	0	114.7	T273 S992 D994	T273-A1192 HydrophobicContact CG2-CB 4.12Å; S992-A1192 PolarHBondContact O-N 3.06Å; D994-A1192 HydrophobicContact CB-CB 3.87Å
1193	G	86.3	Confident	88.4	Confident	0 Å²	0	14.9 Å²	14.9	0%	0	9%	0.087	C	C	.	.	T	Hydrogen-bonded Turn	trans	84.2	5.7	178.5	0	0	0	0	0	115.3	R372 D1189 V1191	R372-G1193 WeakPolarHBondContact CD-O 3.41Å; D1189-G1193 WeakPolarHBondContact OD2-CA 3.4Å; D1189-G1193 PolarHBondContact OD2-N 2.68Å; V1191-G1193 PolarHBondContact O-N 2.82Å
1194	E	86.9	Confident	88.5	Confident	11 Å²	11	14.6 Å²	14.6	5%	0.051	9%	0.085	C	C	.	.	S	Bend	trans	-65.3	-43.1	177.1	-168.9	-179.7	139.4	0	0	112	F271 T273 R372 Y514 Q521 V1191	F271-E1194 HydrophobicContact CE2-CB 4.32Å; F271-E1194 HydrophobicContact CE2-CG 4.14Å; F271-E1194 HydrophobicContact CZ-CG 4.48Å; T273-E1194 HydrophobicContact CG2-CB 4.16Å; T273-E1194 PolarHBondContact OG1-OE2 3.01Å; T273-E1194 VanDerWaalsContact OG1-OE2 3.11Å; R372-E1194 WeakPolarHBondContact CD-O 3.45Å; R372-E1194 VanDerWaalsContact CG-O 3.31Å; R372-E1194 WeakPolarHBondContact CG-O 3.37Å; Y514-E1194 HydrophobicContact CE2-CG 4.32Å; Q521-E1194 PolarHBondContact NE2-OE1 2.83Å; Q521-E1194 PolarHBondContact NE2-OE2 2.84Å; V1191-E1194 HydrophobicContact CB-CB 4.28Å; V1191-E1194 HydrophobicContact CG2-CB 4.34Å; V1191-E1194 WeakPolarHBondContact O-CB 3.16Å; V1191-E1194 PolarHBondContact O-N 3.07Å
1195	W	86.9	Confident	88.6	Confident	36 Å²	36	14 Å²	14	14%	0.136	8%	0.082	C	C	.	.	S	Bend	trans	-116.1	157	177.2	-63.9	82.1	0	0	0	111.4	N559 D560 T981 T985 V1191 A1197	N559-W1195 HydrophobicContact CB-CH2 4.38Å; N559-W1195 HydrophobicContact CB-CZ2 3.91Å; D560-W1195 HydrophobicContact CB-CH2 3.89Å; D560-W1195 HydrophobicContact CB-CZ2 4.08Å; T981-W1195 HydrophobicContact CG2-CB 4.09Å; T985-W1195 HydrophobicContact CG2-CB 4.33Å; T985-W1195 HydrophobicContact CG2-CD2 3.74Å; T985-W1195 HydrophobicContact CG2-CE3 4.18Å; T985-W1195 HydrophobicContact CG2-CG 3.78Å; V1191-W1195 HydrophobicContact CG2-CB 3.92Å; W1195-A1197 PolarHBondContact O-N 2.85Å
1196	P	84.9	Confident	88.5	Confident	51 Å²	51	14 Å²	14	33%	0.331	8%	0.081	S	C	.	.			trans	-58.8	120.2	170.8	-12.8	23.3	0	0	0	111.8	R372 T981 L984	R372-P1196 VanDerWaalsContact NH1-CB 3.26Å; R372-P1196 VanDerWaalsContact NH1-N 3.15Å; T981-P1196 WeakPolarHBondContact CA-O 3.45Å; L984-P1196 HydrophobicContact CD1-CB 4.25Å; L984-P1196 HydrophobicContact CD1-CG 3.92Å
1197	A	84.4	Confident	88.2	Confident	23 Å²	23	14.3 Å²	14.3	19%	0.19	9%	0.085	C	C	.	.			trans	-90.9	136.4	169.1	0	0	0	0	0	110.5	V980 D1189 W1195 T1199	V980-A1197 HydrophobicContact CG1-CB 4.16Å; V980-A1197 CarbonylContact O-C 3.51Å; V980-A1197 WeakPolarHBondContact O-CA 3.08Å; D1189-A1197 HydrophobicContact CB-CB 4.46Å; W1195-A1197 PolarHBondContact O-N 2.85Å; A1197-T1199 HydrophobicContact CB-CG2 4.34Å
1198	T	79.2	Confident	87.7	Confident	92 Å²	92	13.9 Å²	13.9	56%	0.564	8%	0.082	S	C	*	.			trans	-116.6	19	176.7	59.5	0	0	0	0	111.9	V980 G982	V980-T1198 PolarHBondContact O-N 3.48Å; V980-T1198 PolarHBondContact O-OG1 3.25Å; G982-T1198 WeakPolarHBondContact CA-OG1 3.31Å; G982-T1198 PolarHBondContact N-OG1 2.99Å; G982-T1198 VanDerWaalsContact N-OG1 3.12Å
1199	T	82.7	Confident	87.3	Confident	18 Å²	18	14.9 Å²	14.9	11%	0.11	9%	0.088	C	C	.	.			trans	-68.4	153.2	177.3	-177.6	0	0	0	0	111.8	V980 L1187 V1188 A1197 Y1201	V980-T1199 HydrophobicContact CG1-CG2 4.29Å; L1187-T1199 HydrophobicContact CB-CG2 4.33Å; L1187-T1199 HydrophobicContact CD2-CG2 4Å; L1187-T1199 VanDerWaalsContact CD2-O 3.24Å; L1187-T1199 WeakPolarHBondContact CD2-O 3.05Å; V1188-T1199 WeakPolarHBondContact O-CG2 3.37Å; A1197-T1199 HydrophobicContact CB-CG2 4.34Å; T1199-Y1201 PolarHBondContact OG1-N 3.2Å; T1199-Y1201 VanDerWaalsContact OG1-N 3.15Å
1200	N	85	Confident	86.7	Confident	22 Å²	22	17.2 Å²	17.2	12%	0.118	10%	0.103	C	C	.	.			trans	-95.8	0.4	172.5	66.6	-27.4	0	0	0	112.9	L1202 F1306 C1309 D1310 L1312	N1200-L1202 PolarHBondContact O-N 3.02Å; N1200-F1306 PolarHBondContact ND2-O 3.22Å; N1200-F1306 WeakPolarHBondContact OD1-CA 3.47Å; N1200-F1306 PolarHBondContact OD1-O 2.95Å; N1200-F1306 VanDerWaalsContact OD1-O 3.05Å; N1200-C1309 PolarHBondContact ND2-O 3.34Å; N1200-D1310 VanDerWaalsContact CB-O 3.27Å; N1200-D1310 WeakPolarHBondContact CB-O 3.46Å; N1200-L1312 PolarHBondContact O-N 3.36Å
1201	Y	90	Very high	86.4	Confident	5 Å²	5	18 Å²	18	2%	0.02	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	120.3	179.8	-69.1	-3.1	0	0	0	110.9	K954 L1187 V1188 T1199 T1304 D1305 F1306 L1312 F1314	K954-Y1201 HydrophobicContact CD-CE2 4.42Å; K954-Y1201 PolarHBondContact NZ-OH 2.84Å; L1187-Y1201 WeakPolarHBondContact CA-O 3.45Å; V1188-Y1201 HydrophobicContact CB-CD2 4.43Å; V1188-Y1201 HydrophobicContact CG1-CD2 4.47Å; V1188-Y1201 PolarHBondContact N-O 3.41Å; T1199-Y1201 PolarHBondContact OG1-N 3.2Å; T1199-Y1201 VanDerWaalsContact OG1-N 3.15Å; Y1201-T1304 PolarHBondContact OH-O 2.89Å; Y1201-T1304 VanDerWaalsContact OH-O 3.07Å; Y1201-D1305 WeakPolarHBondContact OH-CA 3.18Å; Y1201-F1306 HydrophobicContact CE1-CB 3.74Å; Y1201-F1306 PolarHBondContact OH-N 3.3Å; Y1201-L1312 HydrophobicContact CD1-CB 4.11Å; Y1201-L1312 HydrophobicContact CD1-CD2 3.63Å; Y1201-L1312 HydrophobicContact CD1-CG 4.4Å; Y1201-L1312 HydrophobicContact CE1-CD2 3.52Å; Y1201-F1314 HydrophobicContact CD1-CE2 4.29Å; Y1201-F1314 HydrophobicContact CD2-CE2 4.22Å; Y1201-F1314 HydrophobicContact CE1-CE2 4.31Å; Y1201-F1314 HydrophobicContact CE2-CE2 4.3Å; Y1201-F1314 HydrophobicContact CG-CE2 4.24Å
1202	L	94.3	Very high	85.6	Confident	1 Å²	1	17.6 Å²	17.6	1%	0.005	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	147.6	-177.3	-59.4	173.1	0	0	0	109.9	I1185 R1186 L1187 N1200 V1250 R1311 L1312 Y1313 F1314	I1185-L1202 HydrophobicContact CG2-CB 4.18Å; I1185-L1202 HydrophobicContact CG2-CD1 4.18Å; I1185-L1202 HydrophobicContact CG2-CD2 3.98Å; I1185-L1202 HydrophobicContact CG2-CG 4.35Å; R1186-L1202 VanDerWaalsContact O-CA 3.28Å; R1186-L1202 WeakPolarHBondContact O-CA 3.39Å; L1187-L1202 HydrophobicContact CD2-CD2 3.39Å; L1187-L1202 HydrophobicContact CD2-CG 4.49Å; L1187-L1202 HydrophobicContact CG-CD2 3.88Å; N1200-L1202 PolarHBondContact O-N 3.02Å; L1202-V1250 HydrophobicContact CD1-CG2 4.06Å; L1202-V1250 HydrophobicContact CD2-CG1 3.9Å; L1202-V1250 HydrophobicContact CD2-CG2 3.88Å; L1202-R1311 HydrophobicContact CD1-CB 4.15Å; L1202-R1311 HydrophobicContact CD1-CG 4.21Å; L1202-L1312 PolarHBondContact N-O 2.77Å; L1202-Y1313 HydrophobicContact CB-CD1 3.83Å; L1202-Y1313 HydrophobicContact CB-CE1 3.82Å; L1202-Y1313 HydrophobicContact CB-CG 4.24Å; L1202-Y1313 HydrophobicContact CD1-CD2 4.39Å; L1202-Y1313 HydrophobicContact CD1-CE1 3.93Å; L1202-Y1313 HydrophobicContact CD1-CE2 3.73Å; L1202-Y1313 VanDerWaalsContact CD1-CZ 3.46Å; L1202-Y1313 CarbonylContact O-C 3.16Å; L1202-Y1313 WeakPolarHBondContact O-CA 3.34Å; L1202-F1314 PolarHBondContact O-N 3.4Å
1203	Y	95.2	Very high	84.8	Confident	0 Å²	0	19 Å²	19	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	153.9	166.3	67.8	-82.2	0	0	0	108.8	Y995 I1028 R1030 R1186 V1188 T1205	Y995-Y1203 HydrophobicContact CD1-CE1 4.29Å; Y995-Y1203 HydrophobicContact CG-CE1 4.46Å; I1028-Y1203 HydrophobicContact CB-CD1 4.27Å; I1028-Y1203 HydrophobicContact CB-CD2 4.16Å; I1028-Y1203 HydrophobicContact CB-CG 3.86Å; I1028-Y1203 HydrophobicContact CG2-CD1 3.65Å; I1028-Y1203 HydrophobicContact CG2-CD2 3.82Å; I1028-Y1203 HydrophobicContact CG2-CE1 3.87Å; I1028-Y1203 HydrophobicContact CG2-CE2 4.04Å; I1028-Y1203 HydrophobicContact CG2-CG 3.62Å; R1030-Y1203 HydrophobicContact CG-CE2 4.43Å; R1186-Y1203 HydrophobicContact CB-CD1 4.07Å; R1186-Y1203 HydrophobicContact CB-CD2 4.42Å; R1186-Y1203 HydrophobicContact CB-CE1 3.48Å; R1186-Y1203 VanDerWaalsContact CB-CE1 3.48Å; R1186-Y1203 HydrophobicContact CB-CE2 3.86Å; R1186-Y1203 HydrophobicContact CG-CE2 4.29Å; R1186-Y1203 PolarHBondContact N-O 3.03Å; R1186-Y1203 PolarHBondContact O-N 3.17Å; V1188-Y1203 HydrophobicContact CG2-CD1 3.99Å; V1188-Y1203 HydrophobicContact CG2-CE1 4.49Å; Y1203-T1205 HydrophobicContact CD2-CG2 4.44Å; Y1203-T1205 HydrophobicContact CE2-CG2 3.89Å
1204	T	95.5	Very high	84.5	Confident	1 Å²	1	19.3 Å²	19.3	1%	0.006	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	148	175.5	76.5	0	0	0	0	109.9	K1038 L1184 I1185 Y1313 D1315 R1321 I1325	K1038-T1204 PolarHBondContact NZ-O 3.01Å; L1184-T1204 CarbonylContact O-C 3.58Å; L1184-T1204 VanDerWaalsContact O-CA 3.24Å; L1184-T1204 WeakPolarHBondContact O-CA 3.29Å; I1185-T1204 HydrophobicContact CG1-CG2 4.39Å; T1204-Y1313 HydrophobicContact CG2-CD1 4.24Å; T1204-Y1313 HydrophobicContact CG2-CE1 4.47Å; T1204-D1315 VanDerWaalsContact CB-OD2 3.3Å; T1204-D1315 WeakPolarHBondContact CB-OD2 3.47Å; T1204-D1315 WeakPolarHBondContact CG2-OD2 3.25Å; T1204-D1315 PolarHBondContact N-OD2 3.18Å; T1204-D1315 PolarHBondContact OG1-OD2 3.37Å; T1204-R1321 WeakPolarHBondContact OG1-CD 3.33Å; T1204-R1321 PolarHBondContact OG1-NE 2.96Å; T1204-R1321 VanDerWaalsContact OG1-NE 3.14Å; T1204-R1321 PolarHBondContact OG1-NH1 3.28Å; T1204-R1321 PolarHBondContact OG1-NH2 3.09Å; T1204-I1325 HydrophobicContact CG2-CD1 4.19Å; T1204-I1325 HydrophobicContact CG2-CG1 3.99Å
1205	T	94	Very high	84	Confident	0 Å²	0	19.9 Å²	19.9	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	143.5	175.8	177.9	0	0	0	0	111.6	R1030 E1034 L1184 R1186 Y1203 A1207	R1030-T1205 HydrophobicContact CG-CG2 3.95Å; E1034-T1205 WeakPolarHBondContact OE1-CA 3.29Å; E1034-T1205 PolarHBondContact OE2-OG1 2.9Å; L1184-T1205 PolarHBondContact N-O 3.3Å; L1184-T1205 PolarHBondContact O-N 2.72Å; R1186-T1205 HydrophobicContact CG-CG2 3.73Å; Y1203-T1205 HydrophobicContact CD2-CG2 4.44Å; Y1203-T1205 HydrophobicContact CE2-CG2 3.89Å; T1205-A1207 PolarHBondContact OG1-N 2.94Å; T1205-A1207 VanDerWaalsContact OG1-N 3.14Å
1206	Y	91.9	Very high	83.3	Confident	3 Å²	3	21.6 Å²	21.6	1%	0.012	13%	0.126	C	C	.	.	S	Bend	trans	-94.5	-17.5	169.7	-73	-92	0	0	0	112.4	E1034 K1152 R1153 R1176 L1181 P1183 D1208 I1209 D1324	E1034-Y1206 PolarHBondContact OE1-N 2.86Å; K1152-Y1206 HydrophobicContact CB-CD1 3.68Å; K1152-Y1206 HydrophobicContact CB-CD2 4.2Å; K1152-Y1206 HydrophobicContact CB-CE1 4.1Å; K1152-Y1206 HydrophobicContact CB-CG 3.75Å; K1152-Y1206 VanDerWaalsContact CE-CZ 3.43Å; K1152-Y1206 HydrophobicContact CG-CD1 4.34Å; K1152-Y1206 HydrophobicContact CG-CE1 4.28Å; K1152-Y1206 WeakPolarHBondContact O-CB 3.41Å; R1153-Y1206 WeakPolarHBondContact CG-O 3.17Å; R1176-Y1206 PolarHBondContact NH1-OH 2.96Å; L1181-Y1206 HydrophobicContact CD1-CD1 4.13Å; L1181-Y1206 HydrophobicContact CD1-CE1 4.36Å; L1181-Y1206 HydrophobicContact CG-CD1 4.36Å; L1181-Y1206 HydrophobicContact CG-CE1 4.14Å; P1183-Y1206 HydrophobicContact CB-CD2 4Å; P1183-Y1206 HydrophobicContact CB-CE1 4.23Å; P1183-Y1206 HydrophobicContact CB-CE2 3.64Å; P1183-Y1206 HydrophobicContact CB-CG 4.44Å; P1183-Y1206 WeakPolarHBondContact CD-OH 3.46Å; P1183-Y1206 HydrophobicContact CG-CE2 4.28Å; Y1206-D1208 VanDerWaalsContact C-N 3.26Å; Y1206-D1208 PolarHBondContact O-N 3.3Å; Y1206-D1208 VanDerWaalsContact O-N 3.15Å; Y1206-I1209 HydrophobicContact CD1-CD1 3.54Å; Y1206-I1209 HydrophobicContact CE1-CD1 4.38Å; Y1206-I1209 HydrophobicContact CG-CD1 4.26Å; Y1206-I1209 WeakPolarHBondContact O-CB 3.43Å; Y1206-I1209 VanDerWaalsContact O-CG1 3.27Å; Y1206-I1209 WeakPolarHBondContact O-CG1 3.27Å; Y1206-I1209 PolarHBondContact O-N 3.12Å; Y1206-D1324 PolarHBondContact OH-OD2 3.43Å
1207	A	84.8	Confident	83	Confident	8 Å²	8	19.2 Å²	19.2	7%	0.066	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-23.4	-167.5	0	0	0	0	0	115	R1030 R1153 T1205	R1030-A1207 HydrophobicContact CB-CB 3.81Å; R1153-A1207 PolarHBondContact NE-O 2.94Å; R1153-A1207 VanDerWaalsContact NE-O 3.08Å; R1153-A1207 PolarHBondContact NH2-O 3.17Å; T1205-A1207 PolarHBondContact OG1-N 2.94Å; T1205-A1207 VanDerWaalsContact OG1-N 3.14Å
1208	D	80.9	Confident	82.6	Confident	7 Å²	7	18.7 Å²	18.7	4%	0.037	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.6	0.3	175.6	-67.8	-28.8	0	0	0	113.7	D363 R1030 L1184 R1186 Y1206	D363-D1208 HydrophobicContact CB-CB 4.38Å; R1030-D1208 IonicContact CZ-OD1 3.2Å; R1030-D1208 IonicContact NE-OD1 2.95Å; R1030-D1208 PolarHBondContact NE-OD1 3.38Å; R1030-D1208 IonicContact NE-OD2 3.52Å; R1030-D1208 PolarHBondContact NE-OD2 2.88Å; R1030-D1208 IonicContact NH2-OD1 2.54Å; R1030-D1208 PolarHBondContact NH2-OD1 3.02Å; L1184-D1208 HydrophobicContact CD1-CB 3.94Å; R1186-D1208 IonicContact CZ-OD2 3.89Å; R1186-D1208 IonicContact NE-OD2 3.01Å; R1186-D1208 PolarHBondContact NE-OD2 2.95Å; R1186-D1208 IonicContact NH2-OD2 3.25Å; Y1206-D1208 VanDerWaalsContact C-N 3.26Å; Y1206-D1208 PolarHBondContact O-N 3.3Å; Y1206-D1208 VanDerWaalsContact O-N 3.15Å
1209	I	82.2	Confident	82.2	Confident	22 Å²	22	18.2 Å²	18.2	11%	0.113	9%	0.092	C	C	.	.	S	Bend	trans	-73.9	122.7	180	-61.8	175	0	0	0	110.1	M1149 R1153 L1181 N1182 L1184 Y1206 L1211	M1149-I1209 HydrophobicContact CE-CG2 3.89Å; R1153-I1209 PolarHBondContact NH1-O 3.13Å; L1181-I1209 HydrophobicContact CD1-CD1 3.67Å; L1181-I1209 HydrophobicContact CD1-CG2 4.22Å; N1182-I1209 VanDerWaalsContact O-CD1 3.26Å; N1182-I1209 WeakPolarHBondContact O-CD1 3.4Å; L1184-I1209 HydrophobicContact CD1-CG1 4.08Å; L1184-I1209 HydrophobicContact CG-CG1 4.18Å; Y1206-I1209 HydrophobicContact CD1-CD1 3.54Å; Y1206-I1209 HydrophobicContact CE1-CD1 4.38Å; Y1206-I1209 HydrophobicContact CG-CD1 4.26Å; Y1206-I1209 WeakPolarHBondContact O-CB 3.43Å; Y1206-I1209 VanDerWaalsContact O-CG1 3.27Å; Y1206-I1209 WeakPolarHBondContact O-CG1 3.27Å; Y1206-I1209 PolarHBondContact O-N 3.12Å; I1209-L1211 PolarHBondContact O-N 2.79Å
1210	P	73.9	Confident	81.7	Confident	50 Å²	50	18.6 Å²	18.6	33%	0.325	10%	0.096	S	C	.	.			trans	-67.6	129.2	-172.6	24.5	-32.6	0	0	0	112.6	V1244	P1210-V1244 HydrophobicContact CG-CG1 4.04Å
1211	L	77.6	Confident	81	Confident	17 Å²	17	18.5 Å²	18.5	9%	0.089	9%	0.094	C	C	.	.			trans	-95	-18	175.3	-74.4	171.2	0	0	0	113.2	F257 M1149 I1150 R1153 I1209 N1213 I1214 Q1215	F257-L1211 HydrophobicContact CE2-CB 4.42Å; F257-L1211 HydrophobicContact CZ-CB 4.39Å; M1149-L1211 HydrophobicContact CB-CD2 3.76Å; M1149-L1211 HydrophobicContact CE-CD2 4.1Å; I1150-L1211 HydrophobicContact CG1-CD1 3.96Å; I1150-L1211 HydrophobicContact CG1-CD2 4.12Å; R1153-L1211 VanDerWaalsContact NH1-CG 3.32Å; I1209-L1211 PolarHBondContact O-N 2.79Å; L1211-N1213 VanDerWaalsContact C-N 3.29Å; L1211-N1213 PolarHBondContact O-N 3.33Å; L1211-N1213 VanDerWaalsContact O-N 3.13Å; L1211-I1214 HydrophobicContact CD2-CG2 4.24Å; L1211-I1214 WeakPolarHBondContact O-CG2 3.08Å; L1211-I1214 PolarHBondContact O-N 2.88Å; L1211-Q1215 HydrophobicContact CB-CG 4.39Å; L1211-Q1215 WeakPolarHBondContact O-CG 3.32Å; L1211-Q1215 PolarHBondContact O-N 3.19Å; L1211-Q1215 VanDerWaalsContact O-N 3.1Å
1212	G	70.8	Confident	79.8	Confident	3 Å²	3	23.4 Å²	23.4	3%	0.031	12%	0.117	C	C	.	.	H	α-helix	trans	-52.9	-42.4	-169.5	0	0	0	0	0	114.1	H1216	G1212-H1216 WeakPolarHBondContact O-CB 3.3Å; G1212-H1216 PolarHBondContact O-N 2.77Å
1213	N	73.4	Confident	78.2	Confident	30 Å²	30	30 Å²	30	16%	0.16	15%	0.152	C	C	.	.	H	α-helix	trans	-72.5	-41	-176.3	-60.2	-20	0	0	0	112.9	N255 L1211 H1216 L1217 C1241	N255-N1213 PolarHBondContact ND2-OD1 3.39Å; L1211-N1213 VanDerWaalsContact C-N 3.29Å; L1211-N1213 PolarHBondContact O-N 3.33Å; L1211-N1213 VanDerWaalsContact O-N 3.13Å; N1213-H1216 PolarHBondContact O-N 3.46Å; N1213-L1217 PolarHBondContact O-N 3.01Å; N1213-C1241 WeakPolarHBondContact CB-SG 3.5Å
1214	I	79.3	Confident	76.5	Confident	6 Å²	6	32.8 Å²	32.8	3%	0.031	17%	0.171	C	C	.	.	H	α-helix	trans	-72.2	-35	-179	-160.6	165.7	0	0	0	111.6	V1142 A1145 E1146 M1149 L1211 L1217 L1218	V1142-I1214 HydrophobicContact CG1-CG1 3.93Å; A1145-I1214 HydrophobicContact CB-CD1 3.58Å; E1146-I1214 HydrophobicContact CB-CD1 4.46Å; E1146-I1214 HydrophobicContact CB-CG2 4.44Å; E1146-I1214 HydrophobicContact CG-CG2 4.36Å; M1149-I1214 HydrophobicContact CE-CG2 4.44Å; M1149-I1214 HydrophobicContact SD-CB 4.48Å; M1149-I1214 HydrophobicContact SD-CD1 3.62Å; M1149-I1214 HydrophobicContact SD-CG2 4Å; L1211-I1214 HydrophobicContact CD2-CG2 4.24Å; L1211-I1214 WeakPolarHBondContact O-CG2 3.08Å; L1211-I1214 PolarHBondContact O-N 2.88Å; I1214-L1217 WeakPolarHBondContact O-CB 3.22Å; I1214-L1217 PolarHBondContact O-N 2.95Å; I1214-L1218 PolarHBondContact O-N 3.16Å; I1214-L1218 VanDerWaalsContact O-N 3.15Å
1215	Q	76.5	Confident	74.5	Confident	23 Å²	23	40.6 Å²	40.6	11%	0.107	21%	0.208	C	C	.	.	H	α-helix	trans	-73.9	-34.3	175.5	-65.9	-169.2	-46.8	0	0	112.1	F257 E1146 L1211 L1217 L1218 R1219	F257-Q1215 HydrophobicContact CE1-CB 4.46Å; F257-Q1215 VanDerWaalsContact CE1-OE1 3.26Å; F257-Q1215 HydrophobicContact CZ-CB 4.45Å; E1146-Q1215 HydrophobicContact CG-CG 4.05Å; E1146-Q1215 WeakPolarHBondContact OE1-CG 3.36Å; E1146-Q1215 PolarHBondContact OE1-NE2 3.06Å; L1211-Q1215 HydrophobicContact CB-CG 4.39Å; L1211-Q1215 WeakPolarHBondContact O-CG 3.32Å; L1211-Q1215 PolarHBondContact O-N 3.19Å; L1211-Q1215 VanDerWaalsContact O-N 3.1Å; Q1215-L1217 VanDerWaalsContact C-N 3.33Å; Q1215-L1218 PolarHBondContact O-N 2.78Å; Q1215-R1219 WeakPolarHBondContact O-CG 3.47Å; Q1215-R1219 PolarHBondContact O-N 2.95Å; Q1215-R1219 VanDerWaalsContact O-N 3.11Å
1216	H	72.9	Confident	72.5	Confident	71 Å²	71	47.1 Å²	47.1	33%	0.329	25%	0.248	S	C	.	.	H	α-helix	trans	-60.2	-44.9	169.8	-178.7	53	0	0	0	111.1	G1212 N1213 L1218 R1219 S1220	G1212-H1216 WeakPolarHBondContact O-CB 3.3Å; G1212-H1216 PolarHBondContact O-N 2.77Å; N1213-H1216 PolarHBondContact O-N 3.46Å; H1216-L1218 PolarHBondContact O-N 3.15Å; H1216-R1219 PolarHBondContact O-N 3Å; H1216-S1220 PolarHBondContact O-N 2.92Å; H1216-S1220 PolarHBondContact O-OG 3.29Å
1217	L	78.4	Confident	70.6	Confident	1 Å²	1	52.4 Å²	52.4	1%	0.005	27%	0.273	C	S	.	.	H	α-helix	trans	-55.9	-49.4	175.9	-163.7	78.3	0	0	0	111.6	F1138 V1142 N1213 I1214 Q1215 R1219 S1220 F1221 M1234 L1237 L1238	F1138-L1217 HydrophobicContact CE1-CD2 3.98Å; F1138-L1217 HydrophobicContact CZ-CD2 4.25Å; V1142-L1217 HydrophobicContact CB-CD2 4.32Å; V1142-L1217 HydrophobicContact CG1-CB 4.42Å; V1142-L1217 HydrophobicContact CG1-CD2 3.72Å; V1142-L1217 HydrophobicContact CG1-CG 4.38Å; V1142-L1217 HydrophobicContact CG2-CD2 3.53Å; N1213-L1217 PolarHBondContact O-N 3.01Å; I1214-L1217 WeakPolarHBondContact O-CB 3.22Å; I1214-L1217 PolarHBondContact O-N 2.95Å; Q1215-L1217 VanDerWaalsContact C-N 3.33Å; L1217-R1219 VanDerWaalsContact C-N 3.3Å; L1217-R1219 PolarHBondContact O-N 3.06Å; L1217-S1220 PolarHBondContact O-N 3.34Å; L1217-F1221 HydrophobicContact CG-CE2 4.43Å; L1217-F1221 WeakPolarHBondContact O-CD2 3.43Å; L1217-F1221 PolarHBondContact O-N 2.86Å; L1217-F1221 VanDerWaalsContact O-N 3.17Å; L1217-M1234 HydrophobicContact CD1-CB 3.91Å; L1217-M1234 HydrophobicContact CD1-CG 4.22Å; L1217-M1234 WeakPolarHBondContact CD1-O 3.37Å; L1217-L1237 HydrophobicContact CD1-CB 4.05Å; L1217-L1237 HydrophobicContact CD1-CD2 3.78Å; L1217-L1237 HydrophobicContact CD1-CG 4.08Å; L1217-L1238 HydrophobicContact CD2-CB 3.89Å; L1217-L1238 HydrophobicContact CD2-CD1 4.07Å; L1217-L1238 HydrophobicContact CD2-CG 4.48Å
1218	L	77	Confident	69.5	Low	12 Å²	12	58 Å²	58	6%	0.063	31%	0.306	C	S	.	.	H	α-helix	trans	-59.4	-38	177.5	-78.4	166.4	0	0	0	113.4	Y1139 V1142 R1143 E1146 I1214 Q1215 H1216 F1221 H1222	Y1139-L1218 HydrophobicContact CD2-CD2 4.2Å; Y1139-L1218 HydrophobicContact CE2-CD2 3.98Å; V1142-L1218 HydrophobicContact CB-CD2 4.03Å; V1142-L1218 HydrophobicContact CB-CG 4.45Å; V1142-L1218 HydrophobicContact CG1-CD1 4.24Å; V1142-L1218 HydrophobicContact CG1-CD2 3.66Å; V1142-L1218 HydrophobicContact CG1-CG 3.54Å; R1143-L1218 HydrophobicContact CB-CD2 4.21Å; E1146-L1218 HydrophobicContact CB-CD1 3.65Å; E1146-L1218 HydrophobicContact CG-CD1 3.8Å; E1146-L1218 WeakPolarHBondContact OE2-CD1 3.4Å; I1214-L1218 PolarHBondContact O-N 3.16Å; I1214-L1218 VanDerWaalsContact O-N 3.15Å; Q1215-L1218 PolarHBondContact O-N 2.78Å; H1216-L1218 PolarHBondContact O-N 3.15Å; L1218-F1221 WeakPolarHBondContact O-CB 3.49Å; L1218-F1221 PolarHBondContact O-N 2.64Å; L1218-H1222 PolarHBondContact O-CD2 3.03Å; L1218-H1222 VanDerWaalsContact O-CD2 3.29Å; L1218-H1222 PolarHBondContact O-N 3Å
1219	R	70.6	Confident	68.8	Low	83 Å²	83	62.5 Å²	62.5	31%	0.313	33%	0.329	S	S	.	.	H	α-helix	trans	-69.7	-41.4	177.1	-71.4	178.8	-171.2	-177.7	4.6	112	E241 Q1215 H1216 L1217 F1221 H1222 D1223	E241-R1219 VanDerWaalsContact CB-NH2 3.31Å; E241-R1219 PolarHBondContact O-NH1 2.69Å; E241-R1219 PolarHBondContact O-NH2 3.25Å; E241-R1219 IonicContact OE2-NH2 3.31Å; E241-R1219 PolarHBondContact OE2-NH2 3.44Å; Q1215-R1219 WeakPolarHBondContact O-CG 3.47Å; Q1215-R1219 PolarHBondContact O-N 2.95Å; Q1215-R1219 VanDerWaalsContact O-N 3.11Å; H1216-R1219 PolarHBondContact O-N 3Å; L1217-R1219 VanDerWaalsContact C-N 3.3Å; L1217-R1219 PolarHBondContact O-N 3.06Å; R1219-F1221 PolarHBondContact O-N 2.84Å; R1219-H1222 WeakPolarHBondContact O-CA 3.3Å; R1219-H1222 WeakPolarHBondContact O-CB 3.22Å; R1219-H1222 PolarHBondContact O-N 2.81Å; R1219-D1223 PolarHBondContact O-N 3.07Å; R1219-D1223 VanDerWaalsContact O-N 3.14Å
1220	S	70.7	Confident	68.3	Low	26 Å²	26	61.8 Å²	61.8	18%	0.182	33%	0.326	C	S	.	.	H	α-helix	trans	-57.9	-32.8	174	-58.5	0	0	0	0	112.2	H1216 L1217 D1223 C1224	H1216-S1220 PolarHBondContact O-N 2.92Å; H1216-S1220 PolarHBondContact O-OG 3.29Å; L1217-S1220 PolarHBondContact O-N 3.34Å; S1220-D1223 PolarHBondContact O-N 3.11Å; S1220-C1224 VanDerWaalsContact O-CB 3.3Å; S1220-C1224 WeakPolarHBondContact O-CB 3.42Å; S1220-C1224 PolarHBondContact O-N 3.11Å; S1220-C1224 PolarHBondContact O-SG 3.11Å
1221	F	70.6	Confident	68.4	Low	20 Å²	20	61.3 Å²	61.3	9%	0.088	32%	0.323	C	S	.	.	H	α-helix	trans	-65.7	-38.6	170.7	-90.8	-83.3	0	0	0	113.8	F1138 Y1139 L1217 L1218 R1219 D1223 C1224 V1230 M1234	F1138-F1221 HydrophobicContact CD1-CD2 4.49Å; F1138-F1221 HydrophobicContact CD1-CE1 4.09Å; F1138-F1221 AromaticContact CD1-CE2 3.39Å; F1138-F1221 HydrophobicContact CD1-CE2 3.39Å; F1138-F1221 AromaticContact CD1-CZ 3.13Å; F1138-F1221 HydrophobicContact CD1-CZ 3.13Å; F1138-F1221 AromaticContact CE1-CE2 3.41Å; F1138-F1221 HydrophobicContact CE1-CE2 3.41Å; F1138-F1221 VanDerWaalsContact CE1-CE2 3.41Å; F1138-F1221 AromaticContact CE1-CZ 3.55Å; F1138-F1221 HydrophobicContact CE1-CZ 3.55Å; F1138-F1221 HydrophobicContact CG-CZ 4.16Å; Y1139-F1221 HydrophobicContact CD2-CB 4.11Å; Y1139-F1221 HydrophobicContact CD2-CG 4.36Å; L1217-F1221 HydrophobicContact CG-CE2 4.43Å; L1217-F1221 WeakPolarHBondContact O-CD2 3.43Å; L1217-F1221 PolarHBondContact O-N 2.86Å; L1217-F1221 VanDerWaalsContact O-N 3.17Å; L1218-F1221 WeakPolarHBondContact O-CB 3.49Å; L1218-F1221 PolarHBondContact O-N 2.64Å; R1219-F1221 PolarHBondContact O-N 2.84Å; F1221-D1223 VanDerWaalsContact C-N 3.26Å; F1221-D1223 PolarHBondContact O-N 2.51Å; F1221-C1224 PolarHBondContact O-N 3.24Å; F1221-V1230 HydrophobicContact CE1-CG2 4.28Å; F1221-V1230 HydrophobicContact CZ-CG1 3.89Å; F1221-V1230 HydrophobicContact CZ-CG2 4.04Å; F1221-M1234 HydrophobicContact CD2-SD 4.09Å; F1221-M1234 HydrophobicContact CE1-SD 4.48Å; F1221-M1234 HydrophobicContact CE2-SD 3.46Å; F1221-M1234 WeakPolarHBondContact CE2-SD 3.44Å; F1221-M1234 HydrophobicContact CZ-SD 3.68Å
1222	H	65.4	Low	68.4	Low	108 Å²	108	65.3 Å²	65.3	50%	0.5	34%	0.341	S	S	.	.	H	α-helix	trans	-66.5	-30.3	177.2	-79.6	-65	0	0	0	112.4	Y1139 L1218 R1219	Y1139-H1222 AromaticContact CE2-NE2 3.98Å; L1218-H1222 PolarHBondContact O-CD2 3.03Å; L1218-H1222 VanDerWaalsContact O-CD2 3.29Å; L1218-H1222 PolarHBondContact O-N 3Å; R1219-H1222 WeakPolarHBondContact O-CA 3.3Å; R1219-H1222 WeakPolarHBondContact O-CB 3.22Å; R1219-H1222 PolarHBondContact O-N 2.81Å
1223	D	61.6	Low	68.6	Low	139 Å²	139	72.9 Å²	72.9	74%	0.743	38%	0.376	S	S	*	.	H	α-helix	trans	-82.4	-34.4	176.7	-64.9	-29.2	0	0	0	112.8	R1219 S1220 F1221 Q1225	R1219-D1223 PolarHBondContact O-N 3.07Å; R1219-D1223 VanDerWaalsContact O-N 3.14Å; S1220-D1223 PolarHBondContact O-N 3.11Å; F1221-D1223 VanDerWaalsContact C-N 3.26Å; F1221-D1223 PolarHBondContact O-N 2.51Å; D1223-Q1225 PolarHBondContact O-N 3.27Å
1224	C	58.6	Low	68.8	Low	59 Å²	59	72.5 Å²	72.5	40%	0.399	37%	0.373	S	S	.	.			trans	-90	66.7	-179.6	-72.3	0	0	0	0	112.8	S1220 F1221 T1226 M1234	S1220-C1224 VanDerWaalsContact O-CB 3.3Å; S1220-C1224 WeakPolarHBondContact O-CB 3.42Å; S1220-C1224 PolarHBondContact O-N 3.11Å; S1220-C1224 PolarHBondContact O-SG 3.11Å; F1221-C1224 PolarHBondContact O-N 3.24Å; C1224-T1226 VanDerWaalsContact C-N 3.29Å; C1224-T1226 PolarHBondContact O-N 3.49Å; C1224-M1234 HydrophobicContact CB-CE 4.4Å
1225	Q	53.6	Low	68.8	Low	165 Å²	165	72.5 Å²	72.5	77%	0.771	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.8	0.2	179.5	-70.9	-157	-13.3	0	0	115.7	D1223	D1223-Q1225 PolarHBondContact O-N 3.27Å
1226	T	52	Low	68.8	Low	137 Å²	137	75.2 Å²	75.2	84%	0.84	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.7	-2.8	-161.9	48.8	0	0	0	0	117.2	C1224	C1224-T1226 VanDerWaalsContact C-N 3.29Å; C1224-T1226 PolarHBondContact O-N 3.49Å
1227	E	52.2	Low	69	Low	114 Å²	114	74 Å²	74	53%	0.533	38%	0.384	S	S	.	.			trans	-105.6	154	179.4	-67.3	-174.9	174.3	0	0	111.9	N1135	N1135-E1227 PolarHBondContact ND2-O 2.95Å
1228	T	60.4	Low	69.1	Low	124 Å²	124	74 Å²	74	76%	0.761	39%	0.385	S	S	*	.	S	Bend	trans	-91.6	-21.6	174.8	36.4	0	0	0	0	113.4
1229	L	67.2	Low	69.1	Low	102 Å²	102	75.9 Å²	75.9	53%	0.534	39%	0.394	S	S	.	.	B	Isolated β-bridge	trans	-119.7	147	-178.3	-77.9	139.8	0	0	0	109.6	V1132	V1132-L1229 HydrophobicContact CB-CD2 4.36Å; V1132-L1229 HydrophobicContact CG1-CD2 3.73Å
1230	V	71.6	Confident	69.3	Low	7 Å²	7	78.5 Å²	78.5	4%	0.042	41%	0.408	C	S	.	.			trans	-73.9	128.9	178	-179.2	0	0	0	0	109.8	P1133 N1135 F1138 F1221 M1234 I1235	P1133-V1230 HydrophobicContact CG-CG2 4.23Å; N1135-V1230 WeakPolarHBondContact OD1-CA 3.24Å; N1135-V1230 WeakPolarHBondContact OD1-CG2 3.14Å; N1135-V1230 PolarHBondContact OD1-N 3.32Å; F1138-V1230 HydrophobicContact CB-CG2 3.55Å; F1138-V1230 HydrophobicContact CD1-CG1 4.04Å; F1138-V1230 HydrophobicContact CD1-CG2 4.07Å; F1138-V1230 HydrophobicContact CD2-CG1 4.48Å; F1138-V1230 HydrophobicContact CD2-CG2 4.35Å; F1138-V1230 HydrophobicContact CE1-CG1 4.02Å; F1138-V1230 HydrophobicContact CE2-CG1 4.46Å; F1138-V1230 HydrophobicContact CG-CG1 4.22Å; F1138-V1230 HydrophobicContact CG-CG2 3.74Å; F1138-V1230 HydrophobicContact CZ-CG1 4.21Å; F1221-V1230 HydrophobicContact CE1-CG2 4.28Å; F1221-V1230 HydrophobicContact CZ-CG1 3.89Å; F1221-V1230 HydrophobicContact CZ-CG2 4.04Å; V1230-M1234 HydrophobicContact CG1-CB 3.86Å; V1230-M1234 HydrophobicContact CG1-SD 4.45Å; V1230-I1235 HydrophobicContact CG1-CG1 3.96Å
1231	P	76.6	Confident	69.3	Low	40 Å²	40	78.5 Å²	78.5	26%	0.26	41%	0.408	S	S	.	.			trans	-57.3	138.6	173	-25.6	33.8	0	0	0	112.3	E1233 M1234 I1235	P1231-E1233 PolarHBondContact O-N 2.67Å; P1231-E1233 VanDerWaalsContact O-N 3.16Å; P1231-M1234 HydrophobicContact CB-CG 4.42Å; P1231-M1234 HydrophobicContact CG-SD 4.41Å; P1231-M1234 WeakPolarHBondContact O-CB 3.46Å; P1231-M1234 PolarHBondContact O-N 3.41Å; P1231-I1235 PolarHBondContact O-N 2.75Å
1232	Q	76.9	Confident	69.3	Low	102 Å²	102	78.9 Å²	78.9	48%	0.477	41%	0.41	S	S	.	.	H	α-helix	trans	-55.6	-35.5	178.3	-173.6	63.2	34.5	0	0	112.2	M1234 I1235 D1236	Q1232-M1234 PolarHBondContact O-N 3.45Å; Q1232-I1235 WeakPolarHBondContact O-CB 3.35Å; Q1232-I1235 PolarHBondContact O-N 3.04Å; Q1232-I1235 VanDerWaalsContact O-N 3.11Å; Q1232-D1236 PolarHBondContact NE2-OD1 3.17Å; Q1232-D1236 VanDerWaalsContact O-CG 3.26Å; Q1232-D1236 PolarHBondContact O-N 3.45Å
1233	E	74.3	Confident	69.2	Low	162 Å²	162	78.4 Å²	78.4	76%	0.757	42%	0.415	S	S	*	.	H	α-helix	trans	-58.6	-34	176.7	-64.4	178.1	178.1	0	0	113	P1231 L1237	P1231-E1233 PolarHBondContact O-N 2.67Å; P1231-E1233 VanDerWaalsContact O-N 3.16Å; E1233-L1237 VanDerWaalsContact O-CB 3.32Å; E1233-L1237 WeakPolarHBondContact O-CB 3.39Å; E1233-L1237 PolarHBondContact O-N 2.66Å
1234	M	78.4	Confident	69	Low	22 Å²	22	74.4 Å²	74.4	11%	0.108	40%	0.395	C	S	.	.	H	α-helix	trans	-74.2	-37.3	176.3	-70.1	-170.2	-179.4	0	0	111.9	L1217 F1221 C1224 V1230 P1231 Q1232 L1237 L1238	L1217-M1234 HydrophobicContact CD1-CB 3.91Å; L1217-M1234 HydrophobicContact CD1-CG 4.22Å; L1217-M1234 WeakPolarHBondContact CD1-O 3.37Å; F1221-M1234 HydrophobicContact CD2-SD 4.09Å; F1221-M1234 HydrophobicContact CE1-SD 4.48Å; F1221-M1234 HydrophobicContact CE2-SD 3.46Å; F1221-M1234 WeakPolarHBondContact CE2-SD 3.44Å; F1221-M1234 HydrophobicContact CZ-SD 3.68Å; C1224-M1234 HydrophobicContact CB-CE 4.4Å; V1230-M1234 HydrophobicContact CG1-CB 3.86Å; V1230-M1234 HydrophobicContact CG1-SD 4.45Å; P1231-M1234 HydrophobicContact CB-CG 4.42Å; P1231-M1234 HydrophobicContact CG-SD 4.41Å; P1231-M1234 WeakPolarHBondContact O-CB 3.46Å; P1231-M1234 PolarHBondContact O-N 3.41Å; Q1232-M1234 PolarHBondContact O-N 3.45Å; M1234-L1237 PolarHBondContact O-N 2.7Å; M1234-L1238 PolarHBondContact O-N 3.49Å
1235	I	78.4	Confident	68.7	Low	5 Å²	5	77.4 Å²	77.4	3%	0.026	41%	0.412	C	S	.	.	H	α-helix	trans	-64.1	-46	173.6	-59	175.7	0	0	0	109.3	I1128 V1132 P1133 F1138 V1230 P1231 Q1232 L1237 L1238 L1239	I1128-I1235 HydrophobicContact CG2-CG2 4.09Å; V1132-I1235 HydrophobicContact CG1-CD1 4.47Å; P1133-I1235 HydrophobicContact CG-CD1 4.38Å; F1138-I1235 HydrophobicContact CE2-CG1 4.11Å; F1138-I1235 HydrophobicContact CZ-CG1 4.41Å; V1230-I1235 HydrophobicContact CG1-CG1 3.96Å; P1231-I1235 PolarHBondContact O-N 2.75Å; Q1232-I1235 WeakPolarHBondContact O-CB 3.35Å; Q1232-I1235 PolarHBondContact O-N 3.04Å; Q1232-I1235 VanDerWaalsContact O-N 3.11Å; I1235-L1237 VanDerWaalsContact C-N 3.29Å; I1235-L1237 PolarHBondContact O-N 3.42Å; I1235-L1238 PolarHBondContact O-N 2.76Å; I1235-L1239 HydrophobicContact CG2-CD1 4.13Å; I1235-L1239 WeakPolarHBondContact O-CB 3.37Å; I1235-L1239 WeakPolarHBondContact O-CG 3.26Å; I1235-L1239 PolarHBondContact O-N 3.35Å
1236	D	78	Confident	69	Low	81 Å²	81	72.5 Å²	72.5	43%	0.433	39%	0.388	S	S	.	.	H	α-helix	trans	-62.5	-36.9	176.7	-66.7	-10.7	0	0	0	111.2	Q1232 K1240	Q1232-D1236 PolarHBondContact NE2-OD1 3.17Å; Q1232-D1236 VanDerWaalsContact O-CG 3.26Å; Q1232-D1236 PolarHBondContact O-N 3.45Å; D1236-K1240 VanDerWaalsContact O-CB 3.26Å; D1236-K1240 WeakPolarHBondContact O-CB 3.21Å; D1236-K1240 PolarHBondContact O-N 3.01Å
1237	L	76.5	Confident	70.1	Confident	45 Å²	45	70.9 Å²	70.9	24%	0.236	37%	0.373	C	S	.	.	H	α-helix	trans	-68.3	-41.8	174.4	-176.1	60.9	0	0	0	112.2	L1217 E1233 M1234 I1235 K1240 C1241	L1217-L1237 HydrophobicContact CD1-CB 4.05Å; L1217-L1237 HydrophobicContact CD1-CD2 3.78Å; L1217-L1237 HydrophobicContact CD1-CG 4.08Å; E1233-L1237 VanDerWaalsContact O-CB 3.32Å; E1233-L1237 WeakPolarHBondContact O-CB 3.39Å; E1233-L1237 PolarHBondContact O-N 2.66Å; M1234-L1237 PolarHBondContact O-N 2.7Å; I1235-L1237 VanDerWaalsContact C-N 3.29Å; I1235-L1237 PolarHBondContact O-N 3.42Å; L1237-K1240 WeakPolarHBondContact O-CB 3.43Å; L1237-K1240 PolarHBondContact O-N 3.33Å; L1237-C1241 PolarHBondContact O-N 3.24Å; L1237-C1241 PolarHBondContact O-SG 3.18Å
1238	L	80.1	Confident	71.8	Confident	2 Å²	2	67.6 Å²	67.6	1%	0.01	36%	0.358	C	S	.	.	H	α-helix	trans	-60.8	-47.9	172.8	178.3	64.5	0	0	0	110.8	I1128 F1138 L1141 V1142 L1217 M1234 I1235 K1240 C1241 M1242	I1128-L1238 HydrophobicContact CD1-CD2 4.47Å; F1138-L1238 HydrophobicContact CE2-CD2 3.56Å; F1138-L1238 HydrophobicContact CZ-CB 4.04Å; F1138-L1238 HydrophobicContact CZ-CD2 3.64Å; F1138-L1238 HydrophobicContact CZ-CG 4.45Å; L1141-L1238 HydrophobicContact CD2-CD2 4.08Å; V1142-L1238 HydrophobicContact CG2-CD1 4.41Å; V1142-L1238 HydrophobicContact CG2-CD2 4.43Å; L1217-L1238 HydrophobicContact CD2-CB 3.89Å; L1217-L1238 HydrophobicContact CD2-CD1 4.07Å; L1217-L1238 HydrophobicContact CD2-CG 4.48Å; M1234-L1238 PolarHBondContact O-N 3.49Å; I1235-L1238 PolarHBondContact O-N 2.76Å; L1238-K1240 VanDerWaalsContact C-N 3.25Å; L1238-K1240 PolarHBondContact O-N 3.45Å; L1238-C1241 WeakPolarHBondContact O-CA 3.25Å; L1238-C1241 VanDerWaalsContact O-CB 3.26Å; L1238-C1241 WeakPolarHBondContact O-CB 3.32Å; L1238-C1241 PolarHBondContact O-N 2.78Å; L1238-M1242 HydrophobicContact CD1-SD 4.4Å; L1238-M1242 HydrophobicContact CG-SD 3.96Å; L1238-M1242 VanDerWaalsContact O-CG 3.3Å; L1238-M1242 WeakPolarHBondContact O-CG 3.34Å; L1238-M1242 PolarHBondContact O-N 3.21Å
1239	L	78.3	Confident	73	Confident	50 Å²	50	63.2 Å²	63.2	26%	0.262	33%	0.33	S	S	.	.	H	α-helix	trans	-58.1	-40.9	174.3	-72.8	171.7	0	0	0	110.8	I1128 I1235 C1241 M1242 T1243	I1128-L1239 HydrophobicContact CG2-CD1 4.49Å; I1128-L1239 HydrophobicContact CG2-CD2 4.01Å; I1128-L1239 HydrophobicContact CG2-CG 4.37Å; I1235-L1239 HydrophobicContact CG2-CD1 4.13Å; I1235-L1239 WeakPolarHBondContact O-CB 3.37Å; I1235-L1239 WeakPolarHBondContact O-CG 3.26Å; I1235-L1239 PolarHBondContact O-N 3.35Å; L1239-C1241 PolarHBondContact O-N 3.4Å; L1239-M1242 HydrophobicContact CD2-SD 4.48Å; L1239-M1242 CarbonylContact O-C 3.49Å; L1239-M1242 WeakPolarHBondContact O-CA 3.44Å; L1239-M1242 WeakPolarHBondContact O-CB 3.23Å; L1239-M1242 PolarHBondContact O-N 3.37Å; L1239-M1242 VanDerWaalsContact O-N 3.1Å; L1239-T1243 WeakPolarHBondContact O-CG2 3.24Å; L1239-T1243 PolarHBondContact O-N 3.37Å; L1239-T1243 PolarHBondContact O-OG1 3.38Å; L1239-T1243 VanDerWaalsContact O-OG1 3.13Å
1240	K	73.1	Confident	74	Confident	138 Å²	138	59.8 Å²	59.8	60%	0.6	31%	0.313	S	S	*	.	H	α-helix	trans	-61.8	-42.3	174.5	-165.1	175.8	-177.4	-180	0	111.8	D1236 L1237 L1238 M1242 T1243 V1244	D1236-K1240 VanDerWaalsContact O-CB 3.26Å; D1236-K1240 WeakPolarHBondContact O-CB 3.21Å; D1236-K1240 PolarHBondContact O-N 3.01Å; L1237-K1240 WeakPolarHBondContact O-CB 3.43Å; L1237-K1240 PolarHBondContact O-N 3.33Å; L1238-K1240 VanDerWaalsContact C-N 3.25Å; L1238-K1240 PolarHBondContact O-N 3.45Å; K1240-M1242 VanDerWaalsContact C-N 3.27Å; K1240-M1242 PolarHBondContact O-N 3.32Å; K1240-T1243 VanDerWaalsContact CA-OG1 3.31Å; K1240-T1243 WeakPolarHBondContact CA-OG1 3.43Å; K1240-T1243 PolarHBondContact O-N 2.88Å; K1240-T1243 VanDerWaalsContact O-N 3.16Å; K1240-T1243 PolarHBondContact O-OG1 3.05Å; K1240-V1244 WeakPolarHBondContact O-CG2 3.35Å; K1240-V1244 PolarHBondContact O-N 2.85Å
1241	C	71.8	Confident	74.7	Confident	27 Å²	27	66.3 Å²	66.3	18%	0.182	35%	0.347	C	S	.	.	H	α-helix	trans	-58.8	-38.8	172.4	-59.9	0	0	0	0	111.8	N1213 L1237 L1238 L1239 V1244	N1213-C1241 WeakPolarHBondContact CB-SG 3.5Å; L1237-C1241 PolarHBondContact O-N 3.24Å; L1237-C1241 PolarHBondContact O-SG 3.18Å; L1238-C1241 WeakPolarHBondContact O-CA 3.25Å; L1238-C1241 VanDerWaalsContact O-CB 3.26Å; L1238-C1241 WeakPolarHBondContact O-CB 3.32Å; L1238-C1241 PolarHBondContact O-N 2.78Å; L1239-C1241 PolarHBondContact O-N 3.4Å; C1241-V1244 VanDerWaalsContact O-CG2 3.31Å; C1241-V1244 WeakPolarHBondContact O-CG2 3.27Å
1242	M	70.9	Confident	75	Confident	28 Å²	28	67.3 Å²	67.3	14%	0.138	35%	0.353	C	S	.	.	H	α-helix	trans	-75.9	-23.1	178.1	-63	163.9	68.2	0	0	112.3	L1125 H1178 L1179 N1180 L1238 L1239 K1240	L1125-M1242 HydrophobicContact CD1-CE 3.6Å; L1125-M1242 HydrophobicContact CD1-SD 4.2Å; L1125-M1242 HydrophobicContact CG-CE 4.5Å; H1178-M1242 WeakPolarHBondContact O-CE 3.41Å; L1179-M1242 HydrophobicContact CD2-CE 4.29Å; L1179-M1242 HydrophobicContact CD2-CG 4.36Å; L1179-M1242 HydrophobicContact CD2-SD 4.31Å; N1180-M1242 WeakPolarHBondContact CB-O 3.42Å; N1180-M1242 VanDerWaalsContact CG-O 3.32Å; N1180-M1242 PolarHBondContact ND2-O 3.05Å; L1238-M1242 HydrophobicContact CD1-SD 4.4Å; L1238-M1242 HydrophobicContact CG-SD 3.96Å; L1238-M1242 VanDerWaalsContact O-CG 3.3Å; L1238-M1242 WeakPolarHBondContact O-CG 3.34Å; L1238-M1242 PolarHBondContact O-N 3.21Å; L1239-M1242 HydrophobicContact CD2-SD 4.48Å; L1239-M1242 CarbonylContact O-C 3.49Å; L1239-M1242 WeakPolarHBondContact O-CA 3.44Å; L1239-M1242 WeakPolarHBondContact O-CB 3.23Å; L1239-M1242 PolarHBondContact O-N 3.37Å; L1239-M1242 VanDerWaalsContact O-N 3.1Å; K1240-M1242 VanDerWaalsContact C-N 3.27Å; K1240-M1242 PolarHBondContact O-N 3.32Å
1243	T	63	Low	74.7	Confident	97 Å²	97	64.4 Å²	64.4	60%	0.595	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.1	2.2	178.2	56.4	0	0	0	0	114.8	L1239 K1240 T1245	L1239-T1243 WeakPolarHBondContact O-CG2 3.24Å; L1239-T1243 PolarHBondContact O-N 3.37Å; L1239-T1243 PolarHBondContact O-OG1 3.38Å; L1239-T1243 VanDerWaalsContact O-OG1 3.13Å; K1240-T1243 VanDerWaalsContact CA-OG1 3.31Å; K1240-T1243 WeakPolarHBondContact CA-OG1 3.43Å; K1240-T1243 PolarHBondContact O-N 2.88Å; K1240-T1243 VanDerWaalsContact O-N 3.16Å; K1240-T1243 PolarHBondContact O-OG1 3.05Å; T1243-T1245 PolarHBondContact O-N 3.27Å; T1243-T1245 VanDerWaalsContact O-N 3.17Å
1244	V	57	Low	74.3	Confident	55 Å²	55	64.2 Å²	64.2	33%	0.333	34%	0.339	S	S	.	.			trans	-49.4	125.5	-175.7	174.2	0	0	0	0	110.8	P1210 K1240 C1241 K1246	P1210-V1244 HydrophobicContact CG-CG1 4.04Å; K1240-V1244 WeakPolarHBondContact O-CG2 3.35Å; K1240-V1244 PolarHBondContact O-N 2.85Å; C1241-V1244 VanDerWaalsContact O-CG2 3.31Å; C1241-V1244 WeakPolarHBondContact O-CG2 3.27Å; V1244-K1246 PolarHBondContact O-N 3.26Å; V1244-K1246 VanDerWaalsContact O-N 3.07Å
1245	T	52.6	Low	73.5	Confident	122 Å²	122	71.5 Å²	71.5	75%	0.748	37%	0.37	S	S	*	.			trans	-60.8	110	-177.3	-31.5	0	0	0	0	109.7	T1243 I1247	T1243-T1245 PolarHBondContact O-N 3.27Å; T1243-T1245 VanDerWaalsContact O-N 3.17Å; T1245-I1247 PolarHBondContact O-N 2.87Å
1246	K	60.7	Low	73.3	Confident	63 Å²	63	72.9 Å²	72.9	27%	0.274	38%	0.38	S	S	.	.			trans	-69.9	110.8	175.8	-62.5	175.1	-172.7	164.3	0	109.1	N1180 N1182 L1184 V1244 H1248	N1180-K1246 WeakPolarHBondContact O-CE 3.26Å; N1180-K1246 PolarHBondContact O-NZ 3.4Å; N1180-K1246 WeakPolarHBondContact OD1-CE 3.43Å; N1180-K1246 PolarHBondContact OD1-NZ 3.15Å; N1182-K1246 PolarHBondContact ND2-NZ 3.5Å; L1184-K1246 HydrophobicContact CD2-CB 3.92Å; L1184-K1246 HydrophobicContact CD2-CG 4.24Å; V1244-K1246 PolarHBondContact O-N 3.26Å; V1244-K1246 VanDerWaalsContact O-N 3.07Å; K1246-H1248 PolarHBondContact O-N 2.89Å
1247	I	73.3	Confident	73.9	Confident	103 Å²	103	69 Å²	69	53%	0.528	36%	0.359	S	S	.	.			trans	-95.5	94.5	173.3	-54.5	177.7	0	0	0	106.8	R1186 T1245	R1186-I1247 PolarHBondContact NH1-O 2.92Å; T1245-I1247 PolarHBondContact O-N 2.87Å
1248	H	87.9	Confident	74.7	Confident	45 Å²	45	66.9 Å²	66.9	21%	0.208	35%	0.348	C	S	.	.			trans	-77.3	151.1	166.4	-60.7	-91.4	0	0	0	109.1	I1185 K1246 V1250 F1328	I1185-H1248 HydrophobicContact CB-CB 4.42Å; I1185-H1248 PolarHBondContact N-ND1 3.16Å; K1246-H1248 PolarHBondContact O-N 2.89Å; H1248-V1250 VanDerWaalsContact CB-O 3.28Å; H1248-V1250 WeakPolarHBondContact CB-O 3.26Å; H1248-V1250 PolarHBondContact O-N 2.87Å; H1248-F1328 HydrophobicContact CB-CE2 4.18Å; H1248-F1328 HydrophobicContact CB-CZ 4.35Å; H1248-F1328 AromaticContact CD2-CE2 3.79Å; H1248-F1328 AromaticContact CG-CE2 3.69Å; H1248-F1328 AromaticContact ND1-CE2 3.85Å
1249	D	87.1	Confident	75.4	Confident	32 Å²	32	66.8 Å²	66.8	17%	0.171	35%	0.348	C	S	.	.	S	Bend	trans	-71.7	-23	177.5	-76.7	18.3	0	0	0	112	R365 I1185 R1186 L1187	R365-D1249 IonicContact CZ-OD2 3.14Å; R365-D1249 IonicContact NE-OD2 2.59Å; R365-D1249 PolarHBondContact NE-OD2 3.36Å; R365-D1249 IonicContact NH2-OD2 3.47Å; R365-D1249 PolarHBondContact NH2-OD2 3.11Å; I1185-D1249 PolarHBondContact O-N 2.87Å; R1186-D1249 WeakPolarHBondContact CD-OD1 3.23Å; R1186-D1249 IonicContact CZ-OD1 3.7Å; R1186-D1249 IonicContact NE-OD1 3.97Å; R1186-D1249 IonicContact NH1-OD1 4Å; R1186-D1249 PolarHBondContact NH1-OD1 2.77Å; L1187-D1249 HydrophobicContact CB-CB 4.4Å; L1187-D1249 HydrophobicContact CD1-CB 3.84Å; L1187-D1249 HydrophobicContact CG-CB 3.92Å; L1187-D1249 PolarHBondContact N-OD2 3.37Å
1250	V	88.2	Confident	76.3	Confident	30 Å²	30	64.4 Å²	64.4	18%	0.182	34%	0.335	C	S	.	.	S	Bend	trans	-124.6	153.4	177.4	-62.4	0	0	0	0	110.7	I1185 L1187 L1202 H1248 F1328	I1185-V1250 HydrophobicContact CG2-CG2 3.85Å; L1187-V1250 HydrophobicContact CD1-CG1 3.93Å; L1187-V1250 HydrophobicContact CD2-CG1 3.81Å; L1187-V1250 HydrophobicContact CG-CG1 3.92Å; L1202-V1250 HydrophobicContact CD1-CG2 4.06Å; L1202-V1250 HydrophobicContact CD2-CG1 3.9Å; L1202-V1250 HydrophobicContact CD2-CG2 3.88Å; H1248-V1250 VanDerWaalsContact CB-O 3.28Å; H1248-V1250 WeakPolarHBondContact CB-O 3.26Å; H1248-V1250 PolarHBondContact O-N 2.87Å; V1250-F1328 HydrophobicContact CG2-CE1 4.28Å; V1250-F1328 HydrophobicContact CG2-CZ 4.24Å; V1250-F1328 WeakPolarHBondContact O-CZ 3.4Å
1251	L	86.7	Confident	77.4	Confident	143 Å²	143	57.9 Å²	57.9	75%	0.749	31%	0.307	S	S	*	.	P	Polyproline II helix	trans	-84.5	154.6	168	-63.4	175.8	0	0	0	109.6	E1253 R1311	L1251-E1253 PolarHBondContact O-N 2.84Å; L1251-R1311 PolarHBondContact O-NH1 3.37Å; L1251-R1311 PolarHBondContact O-NH2 3.41Å
1252	P	81.3	Confident	78.3	Confident	62 Å²	62	56.6 Å²	56.6	40%	0.403	30%	0.298	S	S	.	.	P	Polyproline II helix	trans	-49.5	138.3	171.4	-30.5	37.7	0	0	0	112.8	Q1254 F1328	P1252-Q1254 PolarHBondContact O-N 3.42Å; P1252-F1328 VanDerWaalsContact CB-O 3.25Å; P1252-F1328 WeakPolarHBondContact CB-O 3.46Å; P1252-F1328 HydrophobicContact CG-CD2 4.14Å; P1252-F1328 HydrophobicContact CG-CE1 4.37Å; P1252-F1328 HydrophobicContact CG-CE2 3.8Å; P1252-F1328 HydrophobicContact CG-CZ 3.94Å; P1252-F1328 WeakPolarHBondContact CG-O 3.33Å
1253	E	72.1	Confident	79.1	Confident	40 Å²	40	55.3 Å²	55.3	19%	0.187	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-64.9	122.8	166.7	-157.8	65.2	-150.8	0	0	105.4	L1251 K1291 R1311 E1329	L1251-E1253 PolarHBondContact O-N 2.84Å; E1253-K1291 HydrophobicContact CG-CB 4.15Å; E1253-K1291 HydrophobicContact CG-CG 4.47Å; E1253-R1311 VanDerWaalsContact N-NH2 3.17Å; E1253-R1311 IonicContact OE2-CZ 3.74Å; E1253-R1311 IonicContact OE2-NE 3.69Å; E1253-R1311 PolarHBondContact OE2-NE 2.76Å; E1253-R1311 IonicContact OE2-NH2 2.78Å; E1253-R1311 PolarHBondContact OE2-NH2 2.84Å; E1253-E1329 VanDerWaalsContact CB-OE2 3.24Å; E1253-E1329 WeakPolarHBondContact CB-OE2 3.37Å; E1253-E1329 PolarHBondContact N-OE2 3.39Å
1254	Q	64.4	Low	80.3	Confident	159 Å²	159	50.9 Å²	50.9	74%	0.743	27%	0.265	S	S	*	.	P	Polyproline II helix	trans	-54.1	165.9	-176.9	-63.1	179	-7.3	0	0	111.3	P1252 S1256	P1252-Q1254 PolarHBondContact O-N 3.42Å; Q1254-S1256 PolarHBondContact O-N 2.96Å
1255	K	61.9	Low	81.9	Confident	175 Å²	175	48.7 Å²	48.7	76%	0.761	25%	0.252	S	S	*	.	S	Bend	trans	-56.4	17.3	-171.7	-64.5	-172.6	176.5	-174.9	0	117.6	I1332	K1255-I1332 WeakPolarHBondContact O-CG2 3.48Å
1256	S	73.7	Confident	83.6	Confident	34 Å²	34	43 Å²	43	24%	0.238	22%	0.217	C	C	.	.	S	Bend	trans	-114.1	27	177.8	61.8	0	0	0	0	113.3	Q1254 K1291	Q1254-S1256 PolarHBondContact O-N 2.96Å; S1256-K1291 PolarHBondContact O-N 3.45Å
1257	S	90.6	Very high	84.8	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	149.6	177.9	68.4	0	0	0	0	112.4	K1291 P1331 I1332	S1257-K1291 CarbonylContact C-O 3.15Å; S1257-K1291 VanDerWaalsContact CA-O 3.29Å; S1257-K1291 WeakPolarHBondContact CA-O 3.38Å; S1257-P1331 CarbonylContact O-C 3.56Å; S1257-P1331 WeakPolarHBondContact O-CA 3.33Å; S1257-P1331 VanDerWaalsContact O-CB 3.23Å; S1257-P1331 WeakPolarHBondContact O-CB 3.49Å; S1257-I1332 WeakPolarHBondContact O-CG1 3.47Å; S1257-I1332 PolarHBondContact O-N 2.78Å
1258	I	94	Very high	85.3	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	133.9	173.8	-67.1	168.8	0	0	0	108.7	V1260 L1285 W1290 K1291 T1292 V1293 I1332 I1335 L1358 L1566	I1258-V1260 HydrophobicContact CG2-CG2 4.44Å; I1258-L1285 HydrophobicContact CB-CD1 4.23Å; I1258-L1285 HydrophobicContact CD1-CD1 4.44Å; I1258-L1285 HydrophobicContact CD1-CD2 3.75Å; I1258-L1285 HydrophobicContact CG2-CD1 3.88Å; I1258-W1290 HydrophobicContact CD1-CB 3.98Å; I1258-W1290 HydrophobicContact CD1-CD2 3.58Å; I1258-W1290 HydrophobicContact CD1-CE3 3.91Å; I1258-W1290 HydrophobicContact CD1-CG 3.59Å; I1258-W1290 HydrophobicContact CG1-CD2 4.23Å; I1258-W1290 HydrophobicContact CG1-CE3 4.05Å; I1258-W1290 HydrophobicContact CG1-CG 4.46Å; I1258-K1291 PolarHBondContact N-O 3.28Å; I1258-T1292 WeakPolarHBondContact O-CA 3.43Å; I1258-V1293 PolarHBondContact O-N 3.02Å; I1258-I1332 HydrophobicContact CD1-CD1 3.89Å; I1258-I1332 HydrophobicContact CD1-CG1 4.49Å; I1258-I1332 HydrophobicContact CG1-CD1 3.5Å; I1258-I1332 VanDerWaalsContact CG1-CD1 3.5Å; I1258-I1332 HydrophobicContact CG1-CG1 3.57Å; I1258-I1335 HydrophobicContact CG2-CD1 3.86Å; I1258-I1335 HydrophobicContact CG2-CG1 4.11Å; I1258-L1358 HydrophobicContact CG1-CD1 4.32Å; I1258-L1358 HydrophobicContact CG2-CD1 4.02Å; I1258-L1566 HydrophobicContact CD1-CD2 3.62Å
1259	M	95.4	Very high	84.7	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	132.2	174.5	-177.4	-178.1	-73.7	0	0	110.7	L1261 V1293 I1295 V1322 I1325 P1331 G1333 V1334 I1335	M1259-L1261 HydrophobicContact CG-CD2 4.15Å; M1259-L1261 HydrophobicContact SD-CD2 4.06Å; M1259-V1293 CarbonylContact C-O 3.49Å; M1259-V1293 VanDerWaalsContact CA-O 3.3Å; M1259-V1293 WeakPolarHBondContact CA-O 3.45Å; M1259-V1293 HydrophobicContact CB-CB 4.47Å; M1259-V1293 HydrophobicContact CE-CG1 4.37Å; M1259-I1295 HydrophobicContact CE-CD1 3.96Å; M1259-I1295 HydrophobicContact CG-CD1 4.4Å; M1259-I1295 HydrophobicContact SD-CD1 3.63Å; M1259-I1295 HydrophobicContact SD-CG1 4.4Å; M1259-V1322 HydrophobicContact SD-CG1 4.27Å; M1259-I1325 HydrophobicContact CE-CB 4.26Å; M1259-I1325 HydrophobicContact CE-CG2 3.64Å; M1259-P1331 HydrophobicContact CB-CB 4.29Å; M1259-P1331 HydrophobicContact CB-CG 3.99Å; M1259-P1331 HydrophobicContact CE-CG 4.21Å; M1259-G1333 PolarHBondContact N-O 2.83Å; M1259-V1334 HydrophobicContact CB-CG2 4.24Å; M1259-V1334 HydrophobicContact CG-CG1 4.38Å; M1259-V1334 CarbonylContact O-C 3.59Å; M1259-V1334 WeakPolarHBondContact O-CA 3.47Å; M1259-V1334 HydrophobicContact SD-CG1 4.4Å; M1259-V1334 HydrophobicContact SD-CG2 4.04Å; M1259-I1335 PolarHBondContact O-N 2.72Å
1260	V	96.7	Very high	84.3	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	124.2	175.4	-175.7	0	0	0	0	108.3	I1258 V1282 L1285 V1293 I1294 I1295 I1335	I1258-V1260 HydrophobicContact CG2-CG2 4.44Å; V1260-V1282 HydrophobicContact CB-CG2 4.36Å; V1260-V1282 HydrophobicContact CG1-CG2 4.49Å; V1260-V1282 HydrophobicContact CG2-CG2 4.15Å; V1260-L1285 HydrophobicContact CG2-CD1 3.78Å; V1260-V1293 PolarHBondContact N-O 2.91Å; V1260-I1294 HydrophobicContact CB-CG1 4.49Å; V1260-I1294 WeakPolarHBondContact O-CA 3.44Å; V1260-I1295 PolarHBondContact O-N 3.38Å; V1260-I1335 HydrophobicContact CG2-CB 4.42Å; V1260-I1335 HydrophobicContact CG2-CD1 4.42Å
1261	L	96.3	Very high	84	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	124.5	176	-57.6	-169.4	0	0	0	109.9	M1259 I1295 L1317 V1322 V1334 I1335 V1336 P1343 I1346 M1350	M1259-L1261 HydrophobicContact CG-CD2 4.15Å; M1259-L1261 HydrophobicContact SD-CD2 4.06Å; L1261-I1295 HydrophobicContact CD2-CB 4.19Å; L1261-I1295 HydrophobicContact CD2-CD1 3.91Å; L1261-I1295 HydrophobicContact CD2-CG1 4.28Å; L1261-L1317 HydrophobicContact CB-CD2 4.13Å; L1261-L1317 HydrophobicContact CD2-CD2 4.2Å; L1261-V1322 HydrophobicContact CD1-CG1 4.34Å; L1261-V1322 HydrophobicContact CD1-CG2 4.34Å; L1261-V1322 HydrophobicContact CD2-CG1 4.17Å; L1261-V1322 HydrophobicContact CD2-CG2 4.12Å; L1261-V1334 HydrophobicContact CD1-CG1 3.95Å; L1261-V1334 HydrophobicContact CD2-CG1 4.1Å; L1261-V1334 HydrophobicContact CG-CG1 3.67Å; L1261-I1335 PolarHBondContact N-O 2.73Å; L1261-I1335 VanDerWaalsContact N-O 3.08Å; L1261-V1336 HydrophobicContact CD1-CG1 4.11Å; L1261-P1343 HydrophobicContact CB-CB 3.84Å; L1261-P1343 HydrophobicContact CB-CG 3.9Å; L1261-P1343 HydrophobicContact CD1-CB 4.06Å; L1261-I1346 HydrophobicContact CD1-CD1 4Å; L1261-M1350 HydrophobicContact CD1-CE 4.1Å; L1261-M1350 HydrophobicContact CD1-SD 4.48Å
1262	G	91.4	Very high	84.1	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	14%	0.143	C	C	.	.			trans	-70.7	-176	176.1	0	0	0	0	0	112.9	I1295 L1317 P1343	G1262-I1295 PolarHBondContact N-O 3.5Å; G1262-L1317 VanDerWaalsContact O-CD1 3.23Å; G1262-L1317 WeakPolarHBondContact O-CD1 3.45Å; G1262-P1343 VanDerWaalsContact O-CG 3.26Å; G1262-P1343 WeakPolarHBondContact O-CG 3.45Å
1263	S	86.4	Confident	84.6	Confident	1 Å²	1	24.8 Å²	24.8	1%	0.007	12%	0.124	C	C	.	.			trans	-84.2	-15.8	-178.1	56.2	0	0	0	0	115.1	G1339	S1263-G1339 VanDerWaalsContact CA-O 3.26Å; S1263-G1339 WeakPolarHBondContact CA-O 3.33Å
1264	G	89.9	Confident	85.5	Confident	4 Å²	4	23.1 Å²	23.1	4%	0.041	12%	0.116	C	C	.	.			trans	72.8	-148.8	-170.4	0	0	0	0	0	111.6	N1296 N1298	G1264-N1296 WeakPolarHBondContact CA-OD1 3.48Å; G1264-N1296 PolarHBondContact N-OD1 3.48Å; G1264-N1296 VanDerWaalsContact N-OD1 3.09Å; G1264-N1298 VanDerWaalsContact O-CB 3.23Å; G1264-N1298 WeakPolarHBondContact O-CB 3.4Å; G1264-N1298 PolarHBondContact O-ND2 2.87Å
1265	V	90.4	Very high	86.9	Confident	10 Å²	10	15.8 Å²	15.8	6%	0.061	8%	0.082	C	C	.	.	S	Bend	trans	-66.9	145.7	-176	71.3	0	0	0	0	113.2	R1002 V1025	R1002-V1265 HydrophobicContact CB-CG2 3.66Å; R1002-V1265 HydrophobicContact CG-CG1 4.31Å; R1002-V1265 HydrophobicContact CG-CG2 4.01Å; V1025-V1265 HydrophobicContact CG1-CB 3.43Å; V1025-V1265 VanDerWaalsContact CG1-CB 3.43Å; V1025-V1265 HydrophobicContact CG1-CG1 4.43Å; V1025-V1265 HydrophobicContact CG1-CG2 3.38Å
1266	Y	87.9	Confident	88.4	Confident	3 Å²	3	8.1 Å²	8.1	1%	0.012	5%	0.048	C	C	.	.			trans	-66.9	134.6	167.4	-66.8	-24.4	0	0	0	111.8	S1270 S1271 V1272 N1298 E1300 T1301	Y1266-S1270 WeakPolarHBondContact CA-O 3.32Å; Y1266-S1271 VanDerWaalsContact CD1-CA 3.42Å; Y1266-V1272 HydrophobicContact CE2-CG1 4.27Å; Y1266-V1272 WeakPolarHBondContact OH-CG1 3.48Å; Y1266-N1298 WeakPolarHBondContact CD1-ND2 3.49Å; Y1266-N1298 WeakPolarHBondContact CD2-ND2 3.35Å; Y1266-N1298 WeakPolarHBondContact CE1-ND2 3.4Å; Y1266-N1298 PolarHBondContact N-ND2 3.27Å; Y1266-E1300 HydrophobicContact CD2-CB 4.47Å; Y1266-E1300 HydrophobicContact CE2-CB 3.96Å; Y1266-T1301 HydrophobicContact CE1-CG2 3.89Å; Y1266-T1301 WeakPolarHBondContact OH-CG2 3.32Å
1267	R	86.4	Confident	89.4	Confident	50 Å²	50	6.5 Å²	6.5	19%	0.189	4%	0.037	C	C	.	.	B	Isolated β-bridge	trans	-146.4	161.4	176.5	54.6	-177.9	170.8	-173.2	-4.3	109.3	E1045 G1269 S1270 T1342	E1045-R1267 IonicContact OE1-CZ 3.56Å; E1045-R1267 IonicContact OE1-NH1 3.25Å; E1045-R1267 PolarHBondContact OE1-NH1 2.96Å; E1045-R1267 IonicContact OE1-NH2 2.85Å; E1045-R1267 PolarHBondContact OE1-NH2 3.23Å; R1267-G1269 PolarHBondContact O-N 3.21Å; R1267-S1270 PolarHBondContact N-O 2.9Å; R1267-S1270 CarbonylContact O-C 3.49Å; R1267-S1270 PolarHBondContact O-N 2.63Å; R1267-T1342 PolarHBondContact NH2-OG1 2.97Å
1268	I	81.9	Confident	89.6	Confident	7 Å²	7	6.6 Å²	6.6	4%	0.036	4%	0.037	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	116	170.2	-65.2	175.8	0	0	0	107	D1004 K1007 F1008 V1022 M1631	D1004-I1268 HydrophobicContact CB-CD1 4.02Å; D1004-I1268 HydrophobicContact CB-CG1 4.24Å; D1004-I1268 WeakPolarHBondContact OD2-CB 3.31Å; D1004-I1268 PolarHBondContact OD2-N 2.87Å; K1007-I1268 HydrophobicContact CD-CB 4.31Å; K1007-I1268 HydrophobicContact CD-CG2 4.29Å; K1007-I1268 PolarHBondContact NZ-O 3.01Å; F1008-I1268 HydrophobicContact CE2-CD1 3.53Å; F1008-I1268 HydrophobicContact CZ-CD1 3.51Å; V1022-I1268 HydrophobicContact CG1-CD1 4.41Å; V1022-I1268 HydrophobicContact CG1-CG1 4.13Å; I1268-M1631 HydrophobicContact CG2-CB 4.26Å; I1268-M1631 HydrophobicContact CG2-CE 4.35Å; I1268-M1631 HydrophobicContact CG2-CG 4.11Å; I1268-M1631 VanDerWaalsContact CG2-O 3.27Å; I1268-M1631 WeakPolarHBondContact CG2-O 3.27Å; I1268-M1631 HydrophobicContact CG2-SD 4.48Å
1269	G	75.4	Confident	89.6	Confident	21 Å²	21	6.7 Å²	6.7	22%	0.216	4%	0.038	C	C	.	.	T	Hydrogen-bonded Turn	trans	109.4	-20.3	-171	0	0	0	0	0	115.4	R1267 R1544 M1631	R1267-G1269 PolarHBondContact O-N 3.21Å; G1269-R1544 VanDerWaalsContact C-NE 3.31Å; G1269-R1544 PolarHBondContact O-NE 2.97Å; G1269-R1544 PolarHBondContact O-NH2 3.02Å; G1269-M1631 WeakPolarHBondContact CA-SD 3.23Å
1270	S	79.7	Confident	89.5	Confident	6 Å²	6	7.4 Å²	7.4	4%	0.042	5%	0.045	C	C	.	.	B	Isolated β-bridge	trans	-142.8	113.7	177	-171.9	0	0	0	0	112.3	Y1266 R1267 F1274	Y1266-S1270 WeakPolarHBondContact CA-O 3.32Å; R1267-S1270 PolarHBondContact N-O 2.9Å; R1267-S1270 CarbonylContact O-C 3.49Å; R1267-S1270 PolarHBondContact O-N 2.63Å; S1270-F1274 WeakPolarHBondContact OG-CD2 3.4Å
1271	S	82.2	Confident	89.5	Confident	7 Å²	7	7.4 Å²	7.4	5%	0.049	5%	0.045	C	C	.	.	S	Bend	trans	-140.5	-146.7	178.6	-162	0	0	0	0	112.9	L645 Y1266 E1273 F1274	L645-S1271 WeakPolarHBondContact CD1-OG 3.39Å; Y1266-S1271 VanDerWaalsContact CD1-CA 3.42Å; S1271-E1273 VanDerWaalsContact CA-OE2 3.27Å; S1271-E1273 WeakPolarHBondContact CA-OE2 3.43Å; S1271-E1273 VanDerWaalsContact CB-OE2 3.31Å; S1271-E1273 WeakPolarHBondContact CB-OE2 3.38Å; S1271-E1273 PolarHBondContact N-OE2 3.4Å; S1271-E1273 VanDerWaalsContact N-OE2 3.16Å; S1271-E1273 PolarHBondContact O-N 3.17Å; S1271-F1274 PolarHBondContact O-N 3.23Å
1272	V	87.9	Confident	89.4	Confident	3 Å²	3	7.4 Å²	7.4	2%	0.018	5%	0.045	C	C	.	.	H	α-helix	trans	-58.2	-17.7	-175.5	-59.2	0	0	0	0	113.6	L645 A679 Y1266 F1274 D1275 W1276	L645-V1272 HydrophobicContact CD1-CB 4.28Å; L645-V1272 HydrophobicContact CD1-CG1 3.87Å; L645-V1272 HydrophobicContact CD1-CG2 3.56Å; L645-V1272 HydrophobicContact CD2-CG1 4.11Å; A679-V1272 HydrophobicContact CB-CG2 3.5Å; A679-V1272 VanDerWaalsContact CB-CG2 3.5Å; Y1266-V1272 HydrophobicContact CE2-CG1 4.27Å; Y1266-V1272 WeakPolarHBondContact OH-CG1 3.48Å; V1272-F1274 VanDerWaalsContact C-N 3.33Å; V1272-F1274 PolarHBondContact O-N 3.02Å; V1272-D1275 WeakPolarHBondContact O-CB 3.39Å; V1272-D1275 PolarHBondContact O-N 3.49Å; V1272-W1276 PolarHBondContact O-N 3.13Å
1273	E	91.6	Very high	89.4	Confident	0 Å²	0	11.6 Å²	11.6	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-60.8	-43.2	178.2	-51.1	81	169	0	0	111.3	A679 S1271 W1276 C1277 R1544 P1547	A679-E1273 HydrophobicContact CB-CB 4.47Å; A679-E1273 HydrophobicContact CB-CG 3.68Å; S1271-E1273 VanDerWaalsContact CA-OE2 3.27Å; S1271-E1273 WeakPolarHBondContact CA-OE2 3.43Å; S1271-E1273 VanDerWaalsContact CB-OE2 3.31Å; S1271-E1273 WeakPolarHBondContact CB-OE2 3.38Å; S1271-E1273 PolarHBondContact N-OE2 3.4Å; S1271-E1273 VanDerWaalsContact N-OE2 3.16Å; S1271-E1273 PolarHBondContact O-N 3.17Å; E1273-W1276 WeakPolarHBondContact O-CB 3.21Å; E1273-W1276 PolarHBondContact O-N 3.2Å; E1273-C1277 PolarHBondContact O-N 3.48Å; E1273-C1277 VanDerWaalsContact O-N 3.15Å; E1273-C1277 PolarHBondContact O-SG 3.31Å; E1273-R1544 HydrophobicContact CB-CB 4.42Å; E1273-R1544 HydrophobicContact CB-CG 4.33Å; E1273-R1544 HydrophobicContact CG-CB 3.91Å; E1273-R1544 HydrophobicContact CG-CG 3.94Å; E1273-R1544 IonicContact OE1-CZ 2.73Å; E1273-R1544 IonicContact OE1-NE 3.44Å; E1273-R1544 IonicContact OE1-NH1 3.88Å; E1273-R1544 PolarHBondContact OE1-NH1 3.19Å; E1273-R1544 IonicContact OE1-NH2 2.8Å; E1273-R1544 IonicContact OE2-CZ 2.74Å; E1273-R1544 IonicContact OE2-NH2 2.68Å; E1273-P1547 HydrophobicContact CB-CG 4.04Å
1274	F	92.1	Very high	89.7	Confident	6 Å²	6	12.1 Å²	12.1	3%	0.026	7%	0.066	C	C	.	.	H	α-helix	trans	-76.7	-30.7	179.4	-63	-71.8	0	0	0	111.7	S1270 S1271 V1272 W1276 C1277 A1278 V1542 R1544	S1270-F1274 WeakPolarHBondContact OG-CD2 3.4Å; S1271-F1274 PolarHBondContact O-N 3.23Å; V1272-F1274 VanDerWaalsContact C-N 3.33Å; V1272-F1274 PolarHBondContact O-N 3.02Å; F1274-W1276 VanDerWaalsContact C-N 3.33Å; F1274-C1277 PolarHBondContact O-N 3.38Å; F1274-A1278 WeakPolarHBondContact O-CB 3.16Å; F1274-A1278 PolarHBondContact O-N 3.07Å; F1274-V1542 HydrophobicContact CD1-CG2 3.64Å; F1274-V1542 HydrophobicContact CE1-CG2 3.87Å; F1274-V1542 WeakPolarHBondContact CE1-O 3.17Å; F1274-R1544 HydrophobicContact CE2-CG 4.09Å; F1274-R1544 HydrophobicContact CZ-CG 4.23Å
1275	D	92.5	Very high	89.9	Confident	5 Å²	5	11.9 Å²	11.9	3%	0.027	6%	0.064	C	C	.	.	H	α-helix	trans	-61.7	-44.1	170.3	-171.9	48.8	0	0	0	110.9	V1272 C1277 A1278 V1279 T1301 V1302 S1303	V1272-D1275 WeakPolarHBondContact O-CB 3.39Å; V1272-D1275 PolarHBondContact O-N 3.49Å; D1275-C1277 VanDerWaalsContact C-N 3.35Å; D1275-C1277 PolarHBondContact O-N 3.29Å; D1275-A1278 PolarHBondContact O-N 3.32Å; D1275-V1279 WeakPolarHBondContact O-CB 3.43Å; D1275-V1279 WeakPolarHBondContact O-CG2 3.44Å; D1275-V1279 PolarHBondContact O-N 2.93Å; D1275-T1301 HydrophobicContact CB-CG2 4.23Å; D1275-T1301 WeakPolarHBondContact OD1-CB 3.45Å; D1275-V1302 PolarHBondContact OD2-N 2.85Å; D1275-S1303 WeakPolarHBondContact OD1-CA 3.46Å; D1275-S1303 WeakPolarHBondContact OD1-CB 3.26Å; D1275-S1303 PolarHBondContact OD1-N 3.45Å; D1275-S1303 PolarHBondContact OD1-OG 3.38Å
1276	W	93.5	Very high	89.9	Confident	14 Å²	14	16.5 Å²	16.5	5%	0.053	8%	0.08	C	C	.	.	H	α-helix	trans	-58.1	-45.2	174.2	-174.2	88.1	0	0	0	112.5	A679 V681 T684 V1272 E1273 F1274 V1279 G1280 P1547 I1558	A679-W1276 VanDerWaalsContact O-CB 3.31Å; A679-W1276 WeakPolarHBondContact O-CB 3.48Å; V681-W1276 HydrophobicContact CG2-CB 4.23Å; V681-W1276 HydrophobicContact CG2-CG 4.46Å; T684-W1276 PolarHBondContact OG1-NE1 3.15Å; V1272-W1276 PolarHBondContact O-N 3.13Å; E1273-W1276 WeakPolarHBondContact O-CB 3.21Å; E1273-W1276 PolarHBondContact O-N 3.2Å; F1274-W1276 VanDerWaalsContact C-N 3.33Å; W1276-V1279 PolarHBondContact O-N 2.71Å; W1276-G1280 PolarHBondContact O-N 3.07Å; W1276-P1547 HydrophobicContact CB-CG 4.3Å; W1276-P1547 HydrophobicContact CD2-CB 3.98Å; W1276-P1547 HydrophobicContact CD2-CG 4.04Å; W1276-P1547 HydrophobicContact CE3-CB 3.85Å; W1276-P1547 HydrophobicContact CE3-CG 3.63Å; W1276-P1547 HydrophobicContact CG-CB 4.34Å; W1276-P1547 HydrophobicContact CG-CG 4.3Å; W1276-P1547 HydrophobicContact CZ3-CB 4.27Å; W1276-P1547 HydrophobicContact CZ3-CG 4.29Å; W1276-I1558 HydrophobicContact CE3-CG1 3.92Å; W1276-I1558 HydrophobicContact CH2-CG1 3.99Å; W1276-I1558 HydrophobicContact CZ3-CB 4.34Å; W1276-I1558 HydrophobicContact CZ3-CD1 4.26Å; W1276-I1558 HydrophobicContact CZ3-CG1 3.29Å
1277	C	95.5	Very high	89.8	Confident	0 Å²	0	23.8 Å²	23.8	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-64.5	-44.9	178	-63.4	0	0	0	0	112.2	E1273 F1274 D1275 G1280 C1281 M1338 V1542 I1558	E1273-C1277 PolarHBondContact O-N 3.48Å; E1273-C1277 VanDerWaalsContact O-N 3.15Å; E1273-C1277 PolarHBondContact O-SG 3.31Å; F1274-C1277 PolarHBondContact O-N 3.38Å; D1275-C1277 VanDerWaalsContact C-N 3.35Å; D1275-C1277 PolarHBondContact O-N 3.29Å; C1277-G1280 PolarHBondContact O-N 2.98Å; C1277-C1281 WeakPolarHBondContact O-CB 3.36Å; C1277-C1281 PolarHBondContact O-N 2.86Å; C1277-M1338 HydrophobicContact CB-SD 4.36Å; C1277-V1542 HydrophobicContact CB-CB 4.24Å; C1277-V1542 HydrophobicContact CB-CG1 4.08Å; C1277-V1542 HydrophobicContact CB-CG2 3.82Å; C1277-I1558 HydrophobicContact CB-CD1 3.91Å; C1277-I1558 HydrophobicContact CB-CG1 4.43Å; C1277-I1558 WeakPolarHBondContact O-CG2 3.38Å
1278	A	94.4	Very high	89.7	Confident	1 Å²	1	24 Å²	24	1%	0.008	11%	0.112	C	C	.	.	H	α-helix	trans	-62.4	-45	177.3	0	0	0	0	0	111.6	F1274 D1275 C1281 V1282 M1338	F1274-A1278 WeakPolarHBondContact O-CB 3.16Å; F1274-A1278 PolarHBondContact O-N 3.07Å; D1275-A1278 PolarHBondContact O-N 3.32Å; A1278-C1281 PolarHBondContact O-N 2.74Å; A1278-V1282 WeakPolarHBondContact O-CG2 3.22Å; A1278-V1282 PolarHBondContact O-N 3.35Å; A1278-M1338 HydrophobicContact CB-CB 4.48Å
1279	V	93.5	Very high	89.9	Confident	3 Å²	3	26.9 Å²	26.9	2%	0.018	14%	0.144	C	C	.	.	H	α-helix	trans	-62.4	-45.1	176.2	165	0	0	0	0	111.9	V681 D1275 W1276 C1281 V1282 K1283 V1302 M1308	V681-V1279 HydrophobicContact CG1-CG1 4.1Å; V681-V1279 HydrophobicContact CG2-CB 4.03Å; V681-V1279 HydrophobicContact CG2-CG1 4.07Å; V681-V1279 HydrophobicContact CG2-CG2 4.11Å; D1275-V1279 WeakPolarHBondContact O-CB 3.43Å; D1275-V1279 WeakPolarHBondContact O-CG2 3.44Å; D1275-V1279 PolarHBondContact O-N 2.93Å; W1276-V1279 PolarHBondContact O-N 2.71Å; V1279-C1281 VanDerWaalsContact C-N 3.32Å; V1279-C1281 PolarHBondContact O-N 2.94Å; V1279-V1282 PolarHBondContact O-N 3.26Å; V1279-K1283 HydrophobicContact CG1-CD 4.14Å; V1279-K1283 WeakPolarHBondContact O-CB 3.22Å; V1279-K1283 WeakPolarHBondContact O-CG 3.2Å; V1279-K1283 PolarHBondContact O-N 2.83Å; V1279-V1302 HydrophobicContact CG2-CB 4.46Å; V1279-V1302 HydrophobicContact CG2-CG1 4.31Å; V1279-M1308 HydrophobicContact CB-SD 4.24Å; V1279-M1308 HydrophobicContact CG1-CE 4.2Å; V1279-M1308 HydrophobicContact CG1-SD 3.51Å; V1279-M1308 VanDerWaalsContact CG1-SD 3.51Å; V1279-M1308 HydrophobicContact CG2-CE 4.47Å; V1279-M1308 HydrophobicContact CG2-CG 4.03Å; V1279-M1308 HydrophobicContact CG2-SD 4Å
1280	G	93.4	Very high	90.5	Very high	14 Å²	14	27.8 Å²	27.8	14%	0.144	14%	0.141	C	C	.	.	H	α-helix	trans	-59.6	-43.6	176.3	0	0	0	0	0	112	W1276 C1277 K1283 E1284	W1276-G1280 PolarHBondContact O-N 3.07Å; C1277-G1280 PolarHBondContact O-N 2.98Å; G1280-K1283 PolarHBondContact O-N 3.28Å; G1280-E1284 PolarHBondContact O-N 3.45Å
1281	C	96.3	Very high	91.1	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-61.2	-49.9	176.7	-176.5	0	0	0	0	111.5	C1277 A1278 V1279 K1283 E1284 L1285 M1338 I1558 T1562	C1277-C1281 WeakPolarHBondContact O-CB 3.36Å; C1277-C1281 PolarHBondContact O-N 2.86Å; A1278-C1281 PolarHBondContact O-N 2.74Å; V1279-C1281 VanDerWaalsContact C-N 3.32Å; V1279-C1281 PolarHBondContact O-N 2.94Å; C1281-K1283 PolarHBondContact O-N 3.09Å; C1281-E1284 PolarHBondContact O-N 3.14Å; C1281-E1284 VanDerWaalsContact O-N 3.17Å; C1281-L1285 WeakPolarHBondContact O-CG 3.19Å; C1281-L1285 PolarHBondContact O-N 3.25Å; C1281-M1338 HydrophobicContact CB-CE 4.15Å; C1281-M1338 HydrophobicContact CB-CG 3.82Å; C1281-M1338 HydrophobicContact CB-SD 4.05Å; C1281-I1558 HydrophobicContact CB-CG2 4.23Å; C1281-T1562 WeakPolarHBondContact CA-OG1 3.27Å; C1281-T1562 PolarHBondContact SG-OG1 2.81Å; C1281-T1562 VanDerWaalsContact SG-OG1 3.37Å
1282	V	94.9	Very high	91.7	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-61.4	-42.9	-179.4	170	0	0	0	0	111.7	V1260 A1278 V1279 E1284 L1285 R1286 T1292 I1294 M1308 C1309	V1260-V1282 HydrophobicContact CB-CG2 4.36Å; V1260-V1282 HydrophobicContact CG1-CG2 4.49Å; V1260-V1282 HydrophobicContact CG2-CG2 4.15Å; A1278-V1282 WeakPolarHBondContact O-CG2 3.22Å; A1278-V1282 PolarHBondContact O-N 3.35Å; V1279-V1282 PolarHBondContact O-N 3.26Å; V1282-E1284 VanDerWaalsContact C-N 3.34Å; V1282-E1284 PolarHBondContact O-N 3.16Å; V1282-L1285 PolarHBondContact O-N 3.01Å; V1282-R1286 WeakPolarHBondContact O-CG 3.5Å; V1282-R1286 PolarHBondContact O-N 3.45Å; V1282-T1292 HydrophobicContact CG1-CG2 4.15Å; V1282-I1294 HydrophobicContact CB-CD1 4.4Å; V1282-I1294 HydrophobicContact CG1-CD1 4.3Å; V1282-I1294 HydrophobicContact CG2-CD1 3.52Å; V1282-I1294 HydrophobicContact CG2-CG1 3.86Å; V1282-M1308 WeakPolarHBondContact CG1-O 3.45Å; V1282-C1309 HydrophobicContact CG1-CB 4.11Å
1283	K	92.3	Very high	92	Very high	88 Å²	88	31 Å²	31	38%	0.383	15%	0.153	S	C	.	.	H	α-helix	trans	-60	-44	175.1	-77	179	176.3	178.6	0	111.8	V1279 G1280 C1281 R1286 R1287	V1279-K1283 HydrophobicContact CG1-CD 4.14Å; V1279-K1283 WeakPolarHBondContact O-CB 3.22Å; V1279-K1283 WeakPolarHBondContact O-CG 3.2Å; V1279-K1283 PolarHBondContact O-N 2.83Å; G1280-K1283 PolarHBondContact O-N 3.28Å; C1281-K1283 PolarHBondContact O-N 3.09Å; K1283-R1286 PolarHBondContact O-N 3.04Å; K1283-R1287 WeakPolarHBondContact O-CB 3.46Å; K1283-R1287 PolarHBondContact O-N 3.21Å
1284	E	92.9	Very high	92.2	Very high	12 Å²	12	31.1 Å²	31.1	6%	0.056	15%	0.153	C	C	.	.	H	α-helix	trans	-68	-41.4	178.5	-179	65.1	177	0	0	111.9	G1280 C1281 V1282 R1286 R1287 L1288 A1559 T1562 R1563	G1280-E1284 PolarHBondContact O-N 3.45Å; C1281-E1284 PolarHBondContact O-N 3.14Å; C1281-E1284 VanDerWaalsContact O-N 3.17Å; V1282-E1284 VanDerWaalsContact C-N 3.34Å; V1282-E1284 PolarHBondContact O-N 3.16Å; E1284-R1286 VanDerWaalsContact C-N 3.35Å; E1284-R1286 PolarHBondContact O-N 3.09Å; E1284-R1287 WeakPolarHBondContact O-CB 3.4Å; E1284-R1287 PolarHBondContact O-N 3.46Å; E1284-R1287 IonicContact OE1-CZ 3.88Å; E1284-R1287 IonicContact OE1-NE 3.56Å; E1284-R1287 IonicContact OE1-NH2 3.25Å; E1284-R1287 PolarHBondContact OE1-NH2 3.18Å; E1284-R1287 IonicContact OE2-CZ 2.74Å; E1284-R1287 IonicContact OE2-NE 3.98Å; E1284-R1287 PolarHBondContact OE2-NE 3.1Å; E1284-R1287 IonicContact OE2-NH2 2.85Å; E1284-R1287 PolarHBondContact OE2-NH2 3.24Å; E1284-L1288 HydrophobicContact CG-CD1 4.07Å; E1284-L1288 VanDerWaalsContact O-CG 3.28Å; E1284-L1288 WeakPolarHBondContact O-CG 3.38Å; E1284-L1288 PolarHBondContact O-N 3.46Å; E1284-A1559 HydrophobicContact CB-CB 4.39Å; E1284-A1559 HydrophobicContact CG-CB 4.12Å; E1284-T1562 HydrophobicContact CB-CG2 4.02Å; E1284-T1562 HydrophobicContact CG-CG2 3.85Å; E1284-R1563 HydrophobicContact CG-CG 4.5Å; E1284-R1563 WeakPolarHBondContact OE1-CD 3.4Å; E1284-R1563 WeakPolarHBondContact OE1-CG 3.49Å; E1284-R1563 IonicContact OE1-CZ 3.31Å; E1284-R1563 IonicContact OE1-NH1 2.98Å; E1284-R1563 PolarHBondContact OE1-NH1 3.13Å
1285	L	92.9	Very high	92.4	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-57.3	-47.3	174.6	-71.9	179.5	0	0	0	111.7	I1258 V1260 C1281 V1282 L1288 G1289 W1290 T1292 I1335 T1562 L1566	I1258-L1285 HydrophobicContact CB-CD1 4.23Å; I1258-L1285 HydrophobicContact CD1-CD1 4.44Å; I1258-L1285 HydrophobicContact CD1-CD2 3.75Å; I1258-L1285 HydrophobicContact CG2-CD1 3.88Å; V1260-L1285 HydrophobicContact CG2-CD1 3.78Å; C1281-L1285 WeakPolarHBondContact O-CG 3.19Å; C1281-L1285 PolarHBondContact O-N 3.25Å; V1282-L1285 PolarHBondContact O-N 3.01Å; L1285-L1288 CarbonylContact O-C 3.57Å; L1285-L1288 WeakPolarHBondContact O-CA 3.34Å; L1285-L1288 PolarHBondContact O-N 3.47Å; L1285-L1288 VanDerWaalsContact O-N 3.13Å; L1285-G1289 PolarHBondContact O-N 3.29Å; L1285-W1290 HydrophobicContact CB-CB 4.32Å; L1285-W1290 PolarHBondContact O-N 2.65Å; L1285-T1292 HydrophobicContact CB-CG2 3.72Å; L1285-T1292 HydrophobicContact CD1-CG2 4Å; L1285-I1335 HydrophobicContact CD1-CD1 4.1Å; L1285-I1335 HydrophobicContact CD2-CD1 4.47Å; L1285-T1562 HydrophobicContact CD2-CG2 3.61Å; L1285-T1562 HydrophobicContact CG-CG2 3.85Å; L1285-L1566 HydrophobicContact CD2-CD1 3.72Å; L1285-L1566 HydrophobicContact CD2-CD2 4.02Å; L1285-L1566 HydrophobicContact CD2-CG 4.03Å
1286	R	90.4	Very high	92.5	Very high	106 Å²	106	30.6 Å²	30.6	40%	0.4	15%	0.151	S	C	.	.	H	α-helix	trans	-65.2	-39	177.6	-68.6	178.5	75.7	-178.9	2.6	111.8	V1282 K1283 E1284 L1288 G1289 T1292 D1307 M1308 D1310	V1282-R1286 WeakPolarHBondContact O-CG 3.5Å; V1282-R1286 PolarHBondContact O-N 3.45Å; K1283-R1286 PolarHBondContact O-N 3.04Å; E1284-R1286 VanDerWaalsContact C-N 3.35Å; E1284-R1286 PolarHBondContact O-N 3.09Å; R1286-L1288 PolarHBondContact O-N 3.08Å; R1286-G1289 PolarHBondContact O-N 2.97Å; R1286-T1292 HydrophobicContact CG-CG2 3.79Å; R1286-D1307 PolarHBondContact NH1-O 3.21Å; R1286-M1308 PolarHBondContact NH1-O 3.05Å; R1286-D1310 IonicContact NE-OD2 3.5Å
1287	R	86.1	Confident	92.4	Very high	157 Å²	157	30 Å²	30	59%	0.592	15%	0.149	S	C	*	.	H	α-helix	trans	-60.6	-32.6	173.2	-166	-171.3	70.6	81	1.2	112.1	K1283 E1284 G1289	K1283-R1287 WeakPolarHBondContact O-CB 3.46Å; K1283-R1287 PolarHBondContact O-N 3.21Å; E1284-R1287 WeakPolarHBondContact O-CB 3.4Å; E1284-R1287 PolarHBondContact O-N 3.46Å; E1284-R1287 IonicContact OE1-CZ 3.88Å; E1284-R1287 IonicContact OE1-NE 3.56Å; E1284-R1287 IonicContact OE1-NH2 3.25Å; E1284-R1287 PolarHBondContact OE1-NH2 3.18Å; E1284-R1287 IonicContact OE2-CZ 2.74Å; E1284-R1287 IonicContact OE2-NE 3.98Å; E1284-R1287 PolarHBondContact OE2-NE 3.1Å; E1284-R1287 IonicContact OE2-NH2 2.85Å; E1284-R1287 PolarHBondContact OE2-NH2 3.24Å; R1287-G1289 VanDerWaalsContact C-N 3.27Å
1288	L	85.4	Confident	92.3	Very high	54 Å²	54	30 Å²	30	28%	0.283	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.5	1.1	175.2	-64.4	170.9	0	0	0	113.5	E1284 L1285 R1286 R1563 L1566 F1593	E1284-L1288 HydrophobicContact CG-CD1 4.07Å; E1284-L1288 VanDerWaalsContact O-CG 3.28Å; E1284-L1288 WeakPolarHBondContact O-CG 3.38Å; E1284-L1288 PolarHBondContact O-N 3.46Å; L1285-L1288 CarbonylContact O-C 3.57Å; L1285-L1288 WeakPolarHBondContact O-CA 3.34Å; L1285-L1288 PolarHBondContact O-N 3.47Å; L1285-L1288 VanDerWaalsContact O-N 3.13Å; R1286-L1288 PolarHBondContact O-N 3.08Å; L1288-R1563 HydrophobicContact CD1-CG 4.13Å; L1288-L1566 HydrophobicContact CD1-CD1 3.42Å; L1288-L1566 VanDerWaalsContact CD1-CD1 3.42Å; L1288-F1593 HydrophobicContact CD2-CE1 4.47Å
1289	G	84.1	Confident	92.1	Very high	68 Å²	68	30 Å²	30	70%	0.701	15%	0.149	S	C	*	.	T	Hydrogen-bonded Turn	trans	91.4	9	174.1	0	0	0	0	0	115.4	L1285 R1286 R1287	L1285-G1289 PolarHBondContact O-N 3.29Å; R1286-G1289 PolarHBondContact O-N 2.97Å; R1287-G1289 VanDerWaalsContact C-N 3.27Å
1290	W	89.4	Confident	91.8	Very high	40 Å²	40	29.9 Å²	29.9	15%	0.152	15%	0.148	C	C	.	.			trans	-85	143.2	178.8	-67.9	98.2	0	0	0	112.4	I1258 L1285 I1332 I1573	I1258-W1290 HydrophobicContact CD1-CB 3.98Å; I1258-W1290 HydrophobicContact CD1-CD2 3.58Å; I1258-W1290 HydrophobicContact CD1-CE3 3.91Å; I1258-W1290 HydrophobicContact CD1-CG 3.59Å; I1258-W1290 HydrophobicContact CG1-CD2 4.23Å; I1258-W1290 HydrophobicContact CG1-CE3 4.05Å; I1258-W1290 HydrophobicContact CG1-CG 4.46Å; L1285-W1290 HydrophobicContact CB-CB 4.32Å; L1285-W1290 PolarHBondContact O-N 2.65Å; W1290-I1332 HydrophobicContact CE3-CD1 3.99Å; W1290-I1332 HydrophobicContact CH2-CD1 3.63Å; W1290-I1332 HydrophobicContact CZ2-CD1 4.26Å; W1290-I1332 HydrophobicContact CZ3-CD1 3.46Å; W1290-I1332 VanDerWaalsContact CZ3-CD1 3.46Å; W1290-I1332 HydrophobicContact CZ3-CG1 4.31Å; W1290-I1332 HydrophobicContact CZ3-CG2 4.4Å; W1290-I1573 HydrophobicContact CH2-CG2 3.56Å; W1290-I1573 HydrophobicContact CZ2-CG2 4.21Å
1291	K	92.1	Very high	91.6	Very high	84 Å²	84	29.3 Å²	29.3	37%	0.365	14%	0.141	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	142.8	164.5	-71.8	-69.5	-175.1	170.9	0	110	E1253 S1256 S1257 I1258 D1310	E1253-K1291 HydrophobicContact CG-CB 4.15Å; E1253-K1291 HydrophobicContact CG-CG 4.47Å; S1256-K1291 PolarHBondContact O-N 3.45Å; S1257-K1291 CarbonylContact C-O 3.15Å; S1257-K1291 VanDerWaalsContact CA-O 3.29Å; S1257-K1291 WeakPolarHBondContact CA-O 3.38Å; I1258-K1291 PolarHBondContact N-O 3.28Å; K1291-D1310 WeakPolarHBondContact CA-OD2 3.29Å; K1291-D1310 HydrophobicContact CD-CB 4Å; K1291-D1310 WeakPolarHBondContact CD-OD1 3.17Å; K1291-D1310 IonicContact NZ-OD1 3.31Å; K1291-D1310 PolarHBondContact NZ-OD1 3.28Å
1292	T	93.8	Very high	91.1	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	129.5	-170.4	53.4	0	0	0	0	112.2	I1258 V1282 L1285 R1286 C1309 D1310 R1311	I1258-T1292 WeakPolarHBondContact O-CA 3.43Å; V1282-T1292 HydrophobicContact CG1-CG2 4.15Å; L1285-T1292 HydrophobicContact CB-CG2 3.72Å; L1285-T1292 HydrophobicContact CD1-CG2 4Å; R1286-T1292 HydrophobicContact CG-CG2 3.79Å; T1292-C1309 WeakPolarHBondContact OG1-CA 3.4Å; T1292-D1310 PolarHBondContact N-OD2 3.17Å; T1292-D1310 WeakPolarHBondContact O-CB 3.26Å; T1292-D1310 PolarHBondContact O-N 2.96Å; T1292-D1310 PolarHBondContact OG1-N 3.15Å; T1292-D1310 PolarHBondContact OG1-OD2 3.18Å; T1292-R1311 PolarHBondContact O-N 3.49Å
1293	V	94.5	Very high	90.7	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	124.8	172.7	-177.3	0	0	0	0	108.2	I1258 M1259 V1260 R1311 Y1313 E1329	I1258-V1293 PolarHBondContact O-N 3.02Å; M1259-V1293 CarbonylContact C-O 3.49Å; M1259-V1293 VanDerWaalsContact CA-O 3.3Å; M1259-V1293 WeakPolarHBondContact CA-O 3.45Å; M1259-V1293 HydrophobicContact CB-CB 4.47Å; M1259-V1293 HydrophobicContact CE-CG1 4.37Å; V1260-V1293 PolarHBondContact N-O 2.91Å; V1293-R1311 CarbonylContact C-O 3.53Å; V1293-R1311 WeakPolarHBondContact CA-O 3.2Å; V1293-R1311 HydrophobicContact CG1-CB 4.32Å; V1293-R1311 HydrophobicContact CG2-CB 4.27Å; V1293-Y1313 HydrophobicContact CG1-CD2 3.7Å; V1293-Y1313 HydrophobicContact CG1-CE2 3.71Å; V1293-E1329 HydrophobicContact CG1-CG 4.38Å; V1293-E1329 HydrophobicContact CG2-CG 4.37Å
1294	I	95.7	Very high	90.4	Very high	1 Å²	1	25.3 Å²	25.3	1%	0.005	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	139	173.6	-63.4	178.3	0	0	0	109.5	V1260 V1282 N1296 C1309 R1311 L1312 Y1313	V1260-I1294 HydrophobicContact CB-CG1 4.49Å; V1260-I1294 WeakPolarHBondContact O-CA 3.44Å; V1282-I1294 HydrophobicContact CB-CD1 4.4Å; V1282-I1294 HydrophobicContact CG1-CD1 4.3Å; V1282-I1294 HydrophobicContact CG2-CD1 3.52Å; V1282-I1294 HydrophobicContact CG2-CG1 3.86Å; I1294-N1296 HydrophobicContact CG2-CB 4.19Å; I1294-C1309 HydrophobicContact CB-CB 4.39Å; I1294-C1309 HydrophobicContact CD1-CB 3.59Å; I1294-C1309 HydrophobicContact CG1-CB 3.71Å; I1294-R1311 PolarHBondContact N-O 3.01Å; I1294-L1312 HydrophobicContact CB-CD1 3.91Å; I1294-L1312 HydrophobicContact CG2-CD1 3.76Å; I1294-Y1313 PolarHBondContact O-N 3.46Å
1295	I	96.2	Very high	90	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	123.7	164.2	-51.5	174.7	0	0	0	107.7	M1259 V1260 L1261 G1262 L1317 V1322 I1325	M1259-I1295 HydrophobicContact CE-CD1 3.96Å; M1259-I1295 HydrophobicContact CG-CD1 4.4Å; M1259-I1295 HydrophobicContact SD-CD1 3.63Å; M1259-I1295 HydrophobicContact SD-CG1 4.4Å; V1260-I1295 PolarHBondContact O-N 3.38Å; L1261-I1295 HydrophobicContact CD2-CB 4.19Å; L1261-I1295 HydrophobicContact CD2-CD1 3.91Å; L1261-I1295 HydrophobicContact CD2-CG1 4.28Å; G1262-I1295 PolarHBondContact N-O 3.5Å; I1295-L1317 HydrophobicContact CB-CD2 4.04Å; I1295-L1317 HydrophobicContact CG2-CD2 3.87Å; I1295-V1322 HydrophobicContact CD1-CB 4.47Å; I1295-V1322 HydrophobicContact CD1-CG1 4.44Å; I1295-V1322 HydrophobicContact CD1-CG2 4.09Å; I1295-I1325 HydrophobicContact CD1-CB 4.07Å; I1295-I1325 HydrophobicContact CD1-CD1 3.7Å; I1295-I1325 HydrophobicContact CD1-CG1 4.49Å; I1295-I1325 HydrophobicContact CD1-CG2 4.07Å; I1295-I1325 HydrophobicContact CG1-CD1 4.06Å; I1295-I1325 HydrophobicContact CG1-CG2 4.48Å; I1295-I1325 HydrophobicContact CG2-CD1 4.34Å
1296	N	94.7	Very high	89.2	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157	161.8	175.9	-159.9	2	0	0	0	110.4	G1264 I1294 S1303 T1304 Y1313 F1314 D1315	G1264-N1296 WeakPolarHBondContact CA-OD1 3.48Å; G1264-N1296 PolarHBondContact N-OD1 3.48Å; G1264-N1296 VanDerWaalsContact N-OD1 3.09Å; I1294-N1296 HydrophobicContact CG2-CB 4.19Å; N1296-S1303 PolarHBondContact ND2-OG 2.91Å; N1296-T1304 HydrophobicContact CB-CG2 3.82Å; N1296-Y1313 PolarHBondContact N-O 3.37Å; N1296-Y1313 VanDerWaalsContact N-O 3.08Å; N1296-Y1313 VanDerWaalsContact O-O 3.06Å; N1296-F1314 VanDerWaalsContact O-CA 3.31Å; N1296-F1314 WeakPolarHBondContact O-CA 3.49Å; N1296-D1315 PolarHBondContact O-N 3.15Å
1297	C	92.7	Very high	88.6	Confident	3 Å²	3	26 Å²	26	2%	0.02	13%	0.133	C	C	.	.			trans	-129.4	1.3	-176	67.2	0	0	0	0	114.7	M1026 M1042	M1026-C1297 PolarHBondContact N-O 3.31Å; M1026-C1297 VanDerWaalsContact N-O 3.12Å; M1042-C1297 HydrophobicContact CB-CB 4.23Å; M1042-C1297 HydrophobicContact CE-CB 3.99Å; M1042-C1297 HydrophobicContact CG-CB 3.83Å; M1042-C1297 HydrophobicContact SD-CB 3.73Å
1298	N	92.3	Very high	88.6	Confident	0 Å²	0	18.9 Å²	18.9	0%	0	11%	0.107	C	C	.	.			trans	-96.3	113.6	-174.8	-178.2	-18.1	0	0	0	111.2	G1264 Y1266 E1300 T1301 T1304	G1264-N1298 VanDerWaalsContact O-CB 3.23Å; G1264-N1298 WeakPolarHBondContact O-CB 3.4Å; G1264-N1298 PolarHBondContact O-ND2 2.87Å; Y1266-N1298 WeakPolarHBondContact CD1-ND2 3.49Å; Y1266-N1298 WeakPolarHBondContact CD2-ND2 3.35Å; Y1266-N1298 WeakPolarHBondContact CE1-ND2 3.4Å; Y1266-N1298 PolarHBondContact N-ND2 3.27Å; N1298-E1300 PolarHBondContact O-N 3.08Å; N1298-E1300 WeakPolarHBondContact OD1-CB 3.28Å; N1298-E1300 PolarHBondContact OD1-N 3.47Å; N1298-T1301 HydrophobicContact CB-CG2 3.89Å; N1298-T1301 PolarHBondContact O-OG1 3.45Å; N1298-T1304 WeakPolarHBondContact O-CG2 3.48Å; N1298-T1304 PolarHBondContact O-OG1 3.44Å
1299	P	90	Very high	88.7	Confident	0 Å²	0	16.5 Å²	16.5	0%	0	10%	0.095	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-14	-177.2	32.1	-36.3	0	0	0	114	L951 K954 E1024 M1026 T1301	L951-P1299 HydrophobicContact CD1-CB 4.29Å; L951-P1299 HydrophobicContact CD1-CG 4.16Å; K954-P1299 HydrophobicContact CB-CB 4.36Å; K954-P1299 HydrophobicContact CG-CB 4.1Å; E1024-P1299 HydrophobicContact CG-CG 4.05Å; M1026-P1299 HydrophobicContact CB-CB 4.16Å; M1026-P1299 HydrophobicContact CB-CG 4.01Å; M1026-P1299 HydrophobicContact SD-CB 4.42Å; P1299-T1301 VanDerWaalsContact C-N 3.28Å; P1299-T1301 PolarHBondContact O-N 3.37Å
1300	E	88.3	Confident	89.1	Confident	1 Å²	1	14.9 Å²	14.9	1%	0.005	7%	0.07	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88	12.4	-175.6	-53.5	175.2	103.4	0	0	113	A650 G651 R947 G1023 E1024 Y1266 N1298	A650-E1300 WeakPolarHBondContact CB-OE1 3.18Å; G651-E1300 CarbonylContact C-O 3.58Å; R947-E1300 IonicContact CZ-OE1 3.04Å; R947-E1300 IonicContact NE-OE1 3.67Å; R947-E1300 PolarHBondContact NE-OE1 3.11Å; R947-E1300 IonicContact NH2-OE1 3.44Å; G1023-E1300 WeakPolarHBondContact CA-OE2 3.09Å; E1024-E1300 HydrophobicContact CG-CG 4.16Å; E1024-E1300 PolarHBondContact N-OE2 3.44Å; Y1266-E1300 HydrophobicContact CD2-CB 4.47Å; Y1266-E1300 HydrophobicContact CE2-CB 3.96Å; N1298-E1300 PolarHBondContact O-N 3.08Å; N1298-E1300 WeakPolarHBondContact OD1-CB 3.28Å; N1298-E1300 PolarHBondContact OD1-N 3.47Å
1301	T	87.8	Confident	89.2	Confident	1 Å²	1	14.1 Å²	14.1	1%	0.006	7%	0.067	C	C	.	.			trans	-112.1	155.9	-170.2	56.5	0	0	0	0	113.3	Y1266 D1275 N1298 P1299 S1303 T1304	Y1266-T1301 HydrophobicContact CE1-CG2 3.89Å; Y1266-T1301 WeakPolarHBondContact OH-CG2 3.32Å; D1275-T1301 HydrophobicContact CB-CG2 4.23Å; D1275-T1301 WeakPolarHBondContact OD1-CB 3.45Å; N1298-T1301 HydrophobicContact CB-CG2 3.89Å; N1298-T1301 PolarHBondContact O-OG1 3.45Å; P1299-T1301 VanDerWaalsContact C-N 3.28Å; P1299-T1301 PolarHBondContact O-N 3.37Å; T1301-S1303 PolarHBondContact OG1-OG 3.33Å; T1301-T1304 PolarHBondContact O-OG1 3.49Å; T1301-T1304 VanDerWaalsContact OG1-CG2 3.27Å; T1301-T1304 WeakPolarHBondContact OG1-CG2 3.28Å; T1301-T1304 PolarHBondContact OG1-OG1 3.24Å
1302	V	87.3	Confident	89.3	Confident	3 Å²	3	10.1 Å²	10.1	2%	0.018	5%	0.05	C	C	.	.	S	Bend	trans	-83.4	-25.9	174	177.6	0	0	0	0	111.5	Y655 V681 D1275 V1279 T1304 D1305 M1308	Y655-V1302 HydrophobicContact CD2-CG2 4.29Å; V681-V1302 HydrophobicContact CB-CB 4.25Å; V681-V1302 HydrophobicContact CB-CG1 4.22Å; V681-V1302 HydrophobicContact CB-CG2 4.23Å; V681-V1302 HydrophobicContact CG1-CG1 3.97Å; V681-V1302 HydrophobicContact CG2-CB 4.14Å; V681-V1302 HydrophobicContact CG2-CG1 4.33Å; D1275-V1302 PolarHBondContact OD2-N 2.85Å; V1279-V1302 HydrophobicContact CG2-CB 4.46Å; V1279-V1302 HydrophobicContact CG2-CG1 4.31Å; V1302-T1304 PolarHBondContact O-N 2.98Å; V1302-D1305 VanDerWaalsContact O-CB 3.23Å; V1302-D1305 WeakPolarHBondContact O-CB 3.39Å; V1302-D1305 PolarHBondContact O-N 3.45Å; V1302-D1305 VanDerWaalsContact O-N 3.15Å; V1302-M1308 HydrophobicContact CG1-CE 3.52Å
1303	S	86.8	Confident	89.4	Confident	1 Å²	1	10.1 Å²	10.1	1%	0.007	5%	0.05	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-24.6	172.6	55.2	0	0	0	0	113.5	D1275 N1296 T1301 D1305	D1275-S1303 WeakPolarHBondContact OD1-CA 3.46Å; D1275-S1303 WeakPolarHBondContact OD1-CB 3.26Å; D1275-S1303 PolarHBondContact OD1-N 3.45Å; D1275-S1303 PolarHBondContact OD1-OG 3.38Å; N1296-S1303 PolarHBondContact ND2-OG 2.91Å; T1301-S1303 PolarHBondContact OG1-OG 3.33Å; S1303-D1305 VanDerWaalsContact C-N 3.29Å; S1303-D1305 PolarHBondContact O-N 3.46Å
1304	T	85.5	Confident	89.4	Confident	0 Å²	0	10.1 Å²	10.1	0%	0	5%	0.05	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.5	22.6	179.1	60.4	0	0	0	0	113.6	K954 Y1201 N1296 N1298 T1301 V1302 L1312 F1314	K954-T1304 VanDerWaalsContact CE-O 3.28Å; K954-T1304 WeakPolarHBondContact CE-O 3.43Å; K954-T1304 PolarHBondContact NZ-O 2.93Å; Y1201-T1304 PolarHBondContact OH-O 2.89Å; Y1201-T1304 VanDerWaalsContact OH-O 3.07Å; N1296-T1304 HydrophobicContact CB-CG2 3.82Å; N1298-T1304 WeakPolarHBondContact O-CG2 3.48Å; N1298-T1304 PolarHBondContact O-OG1 3.44Å; T1301-T1304 PolarHBondContact O-OG1 3.49Å; T1301-T1304 VanDerWaalsContact OG1-CG2 3.27Å; T1301-T1304 WeakPolarHBondContact OG1-CG2 3.28Å; T1301-T1304 PolarHBondContact OG1-OG1 3.24Å; V1302-T1304 PolarHBondContact O-N 2.98Å; T1304-L1312 VanDerWaalsContact C-CD2 3.49Å; T1304-L1312 VanDerWaalsContact CA-CD2 3.41Å; T1304-L1312 HydrophobicContact CG2-CD1 4.23Å; T1304-L1312 HydrophobicContact CG2-CD2 4.31Å; T1304-L1312 WeakPolarHBondContact O-CD2 3.28Å; T1304-F1314 HydrophobicContact CG2-CD1 4.47Å; T1304-F1314 HydrophobicContact CG2-CE1 3.71Å; T1304-F1314 HydrophobicContact CG2-CZ 3.9Å
1305	D	84.4	Confident	89.3	Confident	0 Å²	0	10.1 Å²	10.1	0%	0	5%	0.05	C	C	.	.	S	Bend	trans	-89.7	149.8	176.5	-160.7	29.3	0	0	0	113.5	Y655 Q659 K662 K954 Y1201 V1302 S1303 D1307 M1308	Y655-D1305 HydrophobicContact CE2-CB 4.48Å; Q659-D1305 VanDerWaalsContact NE2-CG 3.25Å; Q659-D1305 PolarHBondContact NE2-OD1 3.01Å; Q659-D1305 PolarHBondContact NE2-OD2 3.45Å; K662-D1305 IonicContact NZ-OD2 2.69Å; K662-D1305 PolarHBondContact NZ-OD2 2.88Å; K954-D1305 IonicContact NZ-OD1 2.75Å; K954-D1305 PolarHBondContact NZ-OD1 3.04Å; Y1201-D1305 WeakPolarHBondContact OH-CA 3.18Å; V1302-D1305 VanDerWaalsContact O-CB 3.23Å; V1302-D1305 WeakPolarHBondContact O-CB 3.39Å; V1302-D1305 PolarHBondContact O-N 3.45Å; V1302-D1305 VanDerWaalsContact O-N 3.15Å; S1303-D1305 VanDerWaalsContact C-N 3.29Å; S1303-D1305 PolarHBondContact O-N 3.46Å; D1305-D1307 PolarHBondContact O-N 3.29Å; D1305-D1307 VanDerWaalsContact OD2-OD1 3.09Å; D1305-M1308 HydrophobicContact CB-CB 4.41Å; D1305-M1308 WeakPolarHBondContact O-CB 3.44Å; D1305-M1308 PolarHBondContact O-N 3.11Å; D1305-M1308 VanDerWaalsContact O-N 3.16Å
1306	F	75	Confident	89.1	Confident	67 Å²	67	10.4 Å²	10.4	29%	0.294	5%	0.051	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-22.2	-168	70.2	-86.8	0	0	0	113.7	P959 N1200 Y1201	P959-F1306 HydrophobicContact CB-CE1 4.24Å; N1200-F1306 PolarHBondContact ND2-O 3.22Å; N1200-F1306 WeakPolarHBondContact OD1-CA 3.47Å; N1200-F1306 PolarHBondContact OD1-O 2.95Å; N1200-F1306 VanDerWaalsContact OD1-O 3.05Å; Y1201-F1306 HydrophobicContact CE1-CB 3.74Å; Y1201-F1306 PolarHBondContact OH-N 3.3Å
1307	D	78.6	Confident	89	Confident	65 Å²	65	11.3 Å²	11.3	35%	0.348	6%	0.056	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.9	-4.2	180	69	-10.9	0	0	0	113.1	K662 R1286 D1305	K662-D1307 IonicContact NZ-OD1 3.08Å; K662-D1307 PolarHBondContact NZ-OD1 3.47Å; K662-D1307 IonicContact NZ-OD2 2.61Å; K662-D1307 PolarHBondContact NZ-OD2 2.74Å; R1286-D1307 PolarHBondContact NH1-O 3.21Å; D1305-D1307 PolarHBondContact O-N 3.29Å; D1305-D1307 VanDerWaalsContact OD2-OD1 3.09Å
1308	M	85.7	Confident	89	Confident	9 Å²	9	12.8 Å²	12.8	4%	0.044	7%	0.066	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-46.8	-168.3	-161.8	56.7	56.2	0	0	112.5	V1279 V1282 R1286 V1302 D1305	V1279-M1308 HydrophobicContact CB-SD 4.24Å; V1279-M1308 HydrophobicContact CG1-CE 4.2Å; V1279-M1308 HydrophobicContact CG1-SD 3.51Å; V1279-M1308 VanDerWaalsContact CG1-SD 3.51Å; V1279-M1308 HydrophobicContact CG2-CE 4.47Å; V1279-M1308 HydrophobicContact CG2-CG 4.03Å; V1279-M1308 HydrophobicContact CG2-SD 4Å; V1282-M1308 WeakPolarHBondContact CG1-O 3.45Å; R1286-M1308 PolarHBondContact NH1-O 3.05Å; V1302-M1308 HydrophobicContact CG1-CE 3.52Å; D1305-M1308 HydrophobicContact CB-CB 4.41Å; D1305-M1308 WeakPolarHBondContact O-CB 3.44Å; D1305-M1308 PolarHBondContact O-N 3.11Å; D1305-M1308 VanDerWaalsContact O-N 3.16Å
1309	C	88.6	Confident	89.1	Confident	4 Å²	4	15.3 Å²	15.3	3%	0.027	8%	0.079	C	C	.	.	S	Bend	trans	-125.3	167.9	179.8	55.2	0	0	0	0	111.8	N1200 V1282 T1292 I1294 R1311	N1200-C1309 PolarHBondContact ND2-O 3.34Å; V1282-C1309 HydrophobicContact CG1-CB 4.11Å; T1292-C1309 WeakPolarHBondContact OG1-CA 3.4Å; I1294-C1309 HydrophobicContact CB-CB 4.39Å; I1294-C1309 HydrophobicContact CD1-CB 3.59Å; I1294-C1309 HydrophobicContact CG1-CB 3.71Å; C1309-R1311 VanDerWaalsContact SG-C 3.52Å; C1309-R1311 PolarHBondContact SG-O 3.04Å
1310	D	91.3	Very high	89.3	Confident	33 Å²	33	16.2 Å²	16.2	18%	0.176	8%	0.084	C	C	.	.	S	Bend	trans	-75.7	-30.9	177.3	-57.8	-90.8	0	0	0	111.8	N1200 R1286 K1291 T1292	N1200-D1310 VanDerWaalsContact CB-O 3.27Å; N1200-D1310 WeakPolarHBondContact CB-O 3.46Å; R1286-D1310 IonicContact NE-OD2 3.5Å; K1291-D1310 WeakPolarHBondContact CA-OD2 3.29Å; K1291-D1310 HydrophobicContact CD-CB 4Å; K1291-D1310 WeakPolarHBondContact CD-OD1 3.17Å; K1291-D1310 IonicContact NZ-OD1 3.31Å; K1291-D1310 PolarHBondContact NZ-OD1 3.28Å; T1292-D1310 PolarHBondContact N-OD2 3.17Å; T1292-D1310 WeakPolarHBondContact O-CB 3.26Å; T1292-D1310 PolarHBondContact O-N 2.96Å; T1292-D1310 PolarHBondContact OG1-N 3.15Å; T1292-D1310 PolarHBondContact OG1-OD2 3.18Å
1311	R	92.4	Very high	89.6	Confident	25 Å²	25	16.4 Å²	16.4	9%	0.094	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	131.6	171.2	-64.6	-174.6	-174.2	-158.3	-4.1	111.3	L1202 L1251 E1253 T1292 V1293 I1294 C1309 Y1313 E1329	L1202-R1311 HydrophobicContact CD1-CB 4.15Å; L1202-R1311 HydrophobicContact CD1-CG 4.21Å; L1251-R1311 PolarHBondContact O-NH1 3.37Å; L1251-R1311 PolarHBondContact O-NH2 3.41Å; E1253-R1311 VanDerWaalsContact N-NH2 3.17Å; E1253-R1311 IonicContact OE2-CZ 3.74Å; E1253-R1311 IonicContact OE2-NE 3.69Å; E1253-R1311 PolarHBondContact OE2-NE 2.76Å; E1253-R1311 IonicContact OE2-NH2 2.78Å; E1253-R1311 PolarHBondContact OE2-NH2 2.84Å; T1292-R1311 PolarHBondContact O-N 3.49Å; V1293-R1311 CarbonylContact C-O 3.53Å; V1293-R1311 WeakPolarHBondContact CA-O 3.2Å; V1293-R1311 HydrophobicContact CG1-CB 4.32Å; V1293-R1311 HydrophobicContact CG2-CB 4.27Å; I1294-R1311 PolarHBondContact N-O 3.01Å; C1309-R1311 VanDerWaalsContact SG-C 3.52Å; C1309-R1311 PolarHBondContact SG-O 3.04Å; R1311-Y1313 HydrophobicContact CB-CE2 4.31Å; R1311-E1329 WeakPolarHBondContact CD-OE1 3.49Å; R1311-E1329 IonicContact CZ-OE1 3.25Å; R1311-E1329 IonicContact CZ-OE2 3.44Å; R1311-E1329 IonicContact NE-OE1 3.82Å; R1311-E1329 IonicContact NE-OE2 3.63Å; R1311-E1329 IonicContact NH1-OE1 3.59Å; R1311-E1329 PolarHBondContact NH1-OE1 3.02Å; R1311-E1329 IonicContact NH1-OE2 2.77Å; R1311-E1329 PolarHBondContact NH1-OE2 3.05Å
1312	L	94.3	Very high	90	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	118.8	174.5	177.3	64.7	0	0	0	109.7	N1200 Y1201 L1202 I1294 T1304 F1314	N1200-L1312 PolarHBondContact O-N 3.36Å; Y1201-L1312 HydrophobicContact CD1-CB 4.11Å; Y1201-L1312 HydrophobicContact CD1-CD2 3.63Å; Y1201-L1312 HydrophobicContact CD1-CG 4.4Å; Y1201-L1312 HydrophobicContact CE1-CD2 3.52Å; L1202-L1312 PolarHBondContact N-O 2.77Å; I1294-L1312 HydrophobicContact CB-CD1 3.91Å; I1294-L1312 HydrophobicContact CG2-CD1 3.76Å; T1304-L1312 VanDerWaalsContact C-CD2 3.49Å; T1304-L1312 VanDerWaalsContact CA-CD2 3.41Å; T1304-L1312 HydrophobicContact CG2-CD1 4.23Å; T1304-L1312 HydrophobicContact CG2-CD2 4.31Å; T1304-L1312 WeakPolarHBondContact O-CD2 3.28Å; L1312-F1314 HydrophobicContact CD2-CD2 3.7Å; L1312-F1314 HydrophobicContact CD2-CE2 3.28Å; L1312-F1314 HydrophobicContact CD2-CZ 3.92Å; L1312-F1314 HydrophobicContact CG-CD2 4.06Å; L1312-F1314 HydrophobicContact CG-CE2 4.14Å
1313	Y	95.6	Very high	90.4	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	110.9	169.5	-73	-93.8	0	0	0	109.8	I1185 L1202 T1204 V1293 I1294 N1296 R1311 D1315 I1325 F1328 E1329	I1185-Y1313 HydrophobicContact CD1-CE1 4.06Å; I1185-Y1313 HydrophobicContact CG1-CE1 4.17Å; I1185-Y1313 HydrophobicContact CG2-CE1 3.82Å; L1202-Y1313 HydrophobicContact CB-CD1 3.83Å; L1202-Y1313 HydrophobicContact CB-CE1 3.82Å; L1202-Y1313 HydrophobicContact CB-CG 4.24Å; L1202-Y1313 HydrophobicContact CD1-CD2 4.39Å; L1202-Y1313 HydrophobicContact CD1-CE1 3.93Å; L1202-Y1313 HydrophobicContact CD1-CE2 3.73Å; L1202-Y1313 VanDerWaalsContact CD1-CZ 3.46Å; L1202-Y1313 CarbonylContact O-C 3.16Å; L1202-Y1313 WeakPolarHBondContact O-CA 3.34Å; T1204-Y1313 HydrophobicContact CG2-CD1 4.24Å; T1204-Y1313 HydrophobicContact CG2-CE1 4.47Å; V1293-Y1313 HydrophobicContact CG1-CD2 3.7Å; V1293-Y1313 HydrophobicContact CG1-CE2 3.71Å; I1294-Y1313 PolarHBondContact O-N 3.46Å; N1296-Y1313 PolarHBondContact N-O 3.37Å; N1296-Y1313 VanDerWaalsContact N-O 3.08Å; N1296-Y1313 VanDerWaalsContact O-O 3.06Å; R1311-Y1313 HydrophobicContact CB-CE2 4.31Å; Y1313-D1315 VanDerWaalsContact C-N 3.29Å; Y1313-D1315 PolarHBondContact O-N 3.19Å; Y1313-D1315 VanDerWaalsContact O-N 3.09Å; Y1313-I1325 HydrophobicContact CD1-CD1 3.66Å; Y1313-I1325 HydrophobicContact CD1-CG1 3.89Å; Y1313-I1325 HydrophobicContact CD1-CG2 4.14Å; Y1313-I1325 HydrophobicContact CD2-CG2 3.76Å; Y1313-I1325 HydrophobicContact CE1-CD1 4.36Å; Y1313-I1325 HydrophobicContact CE1-CG1 4.09Å; Y1313-I1325 HydrophobicContact CE1-CG2 4Å; Y1313-I1325 HydrophobicContact CE2-CG2 3.62Å; Y1313-I1325 HydrophobicContact CG-CD1 3.75Å; Y1313-I1325 HydrophobicContact CG-CG1 4.29Å; Y1313-I1325 HydrophobicContact CG-CG2 4.02Å; Y1313-F1328 WeakPolarHBondContact OH-CD1 3.42Å; Y1313-E1329 HydrophobicContact CE2-CG 4.1Å; Y1313-E1329 WeakPolarHBondContact CE2-OE1 3.45Å; Y1313-E1329 VanDerWaalsContact CZ-OE1 3.31Å; Y1313-E1329 PolarHBondContact OH-OE1 3.21Å
1314	F	93.8	Very high	90.7	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	78.5	168.4	-89.4	-77.8	0	0	0	109.8	K954 M1026 I1028 Y1201 L1202 N1296 T1304 L1312	K954-F1314 HydrophobicContact CB-CE1 4.34Å; K954-F1314 HydrophobicContact CB-CE2 4.41Å; K954-F1314 HydrophobicContact CB-CZ 3.78Å; K954-F1314 HydrophobicContact CD-CZ 3.94Å; K954-F1314 HydrophobicContact CG-CE1 4.44Å; K954-F1314 HydrophobicContact CG-CZ 3.81Å; M1026-F1314 HydrophobicContact CE-CD1 3.59Å; M1026-F1314 HydrophobicContact CE-CD2 4.48Å; M1026-F1314 HydrophobicContact CE-CE1 3.6Å; M1026-F1314 HydrophobicContact CE-CE2 4.46Å; M1026-F1314 HydrophobicContact CE-CG 4.03Å; M1026-F1314 HydrophobicContact CE-CZ 4.02Å; I1028-F1314 HydrophobicContact CD1-CB 4.22Å; Y1201-F1314 HydrophobicContact CD1-CE2 4.29Å; Y1201-F1314 HydrophobicContact CD2-CE2 4.22Å; Y1201-F1314 HydrophobicContact CE1-CE2 4.31Å; Y1201-F1314 HydrophobicContact CE2-CE2 4.3Å; Y1201-F1314 HydrophobicContact CG-CE2 4.24Å; L1202-F1314 PolarHBondContact O-N 3.4Å; N1296-F1314 VanDerWaalsContact O-CA 3.31Å; N1296-F1314 WeakPolarHBondContact O-CA 3.49Å; T1304-F1314 HydrophobicContact CG2-CD1 4.47Å; T1304-F1314 HydrophobicContact CG2-CE1 3.71Å; T1304-F1314 HydrophobicContact CG2-CZ 3.9Å; L1312-F1314 HydrophobicContact CD2-CD2 3.7Å; L1312-F1314 HydrophobicContact CD2-CE2 3.28Å; L1312-F1314 HydrophobicContact CD2-CZ 3.92Å; L1312-F1314 HydrophobicContact CG-CD2 4.06Å; L1312-F1314 HydrophobicContact CG-CE2 4.14Å
1315	D	94.1	Very high	91.2	Very high	1 Å²	1	17.1 Å²	17.1	1%	0.005	9%	0.088	C	C	.	.	S	Bend	trans	-149.2	172	-175.1	-135.6	-57.3	0	0	0	112.4	T1204 N1296 Y1313 R1321 I1325	T1204-D1315 VanDerWaalsContact CB-OD2 3.3Å; T1204-D1315 WeakPolarHBondContact CB-OD2 3.47Å; T1204-D1315 WeakPolarHBondContact CG2-OD2 3.25Å; T1204-D1315 PolarHBondContact N-OD2 3.18Å; T1204-D1315 PolarHBondContact OG1-OD2 3.37Å; N1296-D1315 PolarHBondContact O-N 3.15Å; Y1313-D1315 VanDerWaalsContact C-N 3.29Å; Y1313-D1315 PolarHBondContact O-N 3.19Å; Y1313-D1315 VanDerWaalsContact O-N 3.09Å; D1315-R1321 HydrophobicContact CB-CG 3.84Å; D1315-R1321 WeakPolarHBondContact OD1-CD 3.46Å; D1315-R1321 WeakPolarHBondContact OD1-CG 3.29Å; D1315-R1321 IonicContact OD1-CZ 3.9Å; D1315-R1321 IonicContact OD1-NE 2.87Å; D1315-R1321 PolarHBondContact OD1-NE 3.37Å; D1315-R1321 IonicContact OD2-NE 3.38Å; D1315-R1321 PolarHBondContact OD2-NE 3.13Å; D1315-I1325 HydrophobicContact CB-CD1 4.43Å
1316	E	92.7	Very high	91.7	Very high	5 Å²	5	19.1 Å²	19.1	2%	0.023	10%	0.096	C	C	.	.			trans	-69.7	143.3	-175.5	63.5	-175.8	-143.9	0	0	112.4	R1041 M1042 S1318 R1321	R1041-E1316 IonicContact CZ-OE2 2.69Å; R1041-E1316 VanDerWaalsContact CZ-OE2 3.25Å; R1041-E1316 IonicContact NE-OE1 3.46Å; R1041-E1316 IonicContact NE-OE2 3.83Å; R1041-E1316 PolarHBondContact NE-OE2 3.08Å; R1041-E1316 IonicContact NH2-OE2 3.73Å; R1041-E1316 PolarHBondContact NH2-OE2 3.3Å; M1042-E1316 HydrophobicContact CE-CB 4.19Å; M1042-E1316 VanDerWaalsContact CE-N 3.29Å; M1042-E1316 HydrophobicContact CG-CB 3.87Å; E1316-S1318 PolarHBondContact O-N 2.83Å; E1316-S1318 VanDerWaalsContact O-N 3.08Å; E1316-S1318 WeakPolarHBondContact OE1-CB 3.47Å; E1316-S1318 PolarHBondContact OE1-OG 3.4Å; E1316-R1321 HydrophobicContact CG-CB 3.48Å; E1316-R1321 VanDerWaalsContact CG-CB 3.48Å; E1316-R1321 HydrophobicContact CG-CG 3.83Å; E1316-R1321 WeakPolarHBondContact O-CB 3.3Å; E1316-R1321 WeakPolarHBondContact O-CG 3.25Å
1317	L	92.2	Very high	92.5	Very high	19 Å²	19	20 Å²	20	10%	0.099	10%	0.101	C	C	.	.			trans	-84.3	44.3	173.1	-69.8	172.3	0	0	0	111.8	L1261 G1262 I1295 T1342	L1261-L1317 HydrophobicContact CB-CD2 4.13Å; L1261-L1317 HydrophobicContact CD2-CD2 4.2Å; G1262-L1317 VanDerWaalsContact O-CD1 3.23Å; G1262-L1317 WeakPolarHBondContact O-CD1 3.45Å; I1295-L1317 HydrophobicContact CB-CD2 4.04Å; I1295-L1317 HydrophobicContact CG2-CD2 3.87Å; L1317-T1342 HydrophobicContact CB-CG2 4.2Å; L1317-T1342 HydrophobicContact CD1-CG2 4.48Å
1318	S	92.7	Very high	93.1	Very high	34 Å²	34	18.3 Å²	18.3	24%	0.238	9%	0.091	C	C	.	.			trans	-90	153.4	176	79.7	0	0	0	0	110.7	E1316 E1320 R1321 V1322	E1316-S1318 PolarHBondContact O-N 2.83Å; E1316-S1318 VanDerWaalsContact O-N 3.08Å; E1316-S1318 WeakPolarHBondContact OE1-CB 3.47Å; E1316-S1318 PolarHBondContact OE1-OG 3.4Å; S1318-E1320 PolarHBondContact O-N 3.33Å; S1318-R1321 PolarHBondContact O-N 2.93Å; S1318-R1321 WeakPolarHBondContact OG-CB 3.49Å; S1318-R1321 PolarHBondContact OG-N 3.32Å; S1318-R1321 VanDerWaalsContact OG-N 3.11Å; S1318-V1322 WeakPolarHBondContact O-CB 3.48Å; S1318-V1322 VanDerWaalsContact O-CG2 3.29Å; S1318-V1322 WeakPolarHBondContact O-CG2 3.4Å; S1318-V1322 PolarHBondContact O-N 2.95Å
1319	L	93.4	Very high	93.5	Very high	53 Å²	53	17.9 Å²	17.9	28%	0.277	9%	0.088	S	C	.	.	H	α-helix	trans	-54.6	-41.5	174	179.8	64.9	0	0	0	111.4	L1323 I1346 P1349 M1350 L1353	L1319-L1323 HydrophobicContact CD1-CD1 3.9Å; L1319-L1323 HydrophobicContact CD1-CG 4.15Å; L1319-L1323 HydrophobicContact CG-CD1 3.89Å; L1319-L1323 WeakPolarHBondContact O-CB 3.13Å; L1319-L1323 WeakPolarHBondContact O-CD1 3.11Å; L1319-L1323 WeakPolarHBondContact O-CG 3.34Å; L1319-L1323 PolarHBondContact O-N 2.86Å; L1319-L1323 VanDerWaalsContact O-N 3.12Å; L1319-I1346 HydrophobicContact CB-CG2 4.38Å; L1319-P1349 HydrophobicContact CD1-CB 4Å; L1319-P1349 HydrophobicContact CD2-CB 3.73Å; L1319-P1349 HydrophobicContact CG-CB 4.47Å; L1319-M1350 HydrophobicContact CD1-CB 4.46Å; L1319-M1350 HydrophobicContact CD1-CG 3.56Å; L1319-L1353 HydrophobicContact CD1-CD1 4.37Å; L1319-L1353 HydrophobicContact CD2-CD1 4.23Å
1320	E	94.3	Very high	93.6	Very high	20 Å²	20	20.5 Å²	20.5	9%	0.093	11%	0.107	C	C	.	.	H	α-helix	trans	-58.8	-53.1	178.9	-177.8	-168.1	148.7	0	0	111.7	K1152 D1158 R1176 S1318 L1323 D1324	K1152-E1320 IonicContact NZ-OE1 2.86Å; K1152-E1320 PolarHBondContact NZ-OE1 2.88Å; K1152-E1320 IonicContact NZ-OE2 3.02Å; D1158-E1320 WeakPolarHBondContact CB-OE2 3.24Å; D1158-E1320 VanDerWaalsContact CG-CD 3.5Å; D1158-E1320 PolarHBondContact N-OE2 2.98Å; R1176-E1320 IonicContact NH2-OE1 2.68Å; S1318-E1320 PolarHBondContact O-N 3.33Å; E1320-L1323 PolarHBondContact O-N 3.02Å; E1320-D1324 PolarHBondContact O-N 3Å; E1320-D1324 VanDerWaalsContact O-N 3.09Å
1321	R	95	Very high	93.7	Very high	4 Å²	4	19.1 Å²	19.1	2%	0.015	10%	0.099	C	C	.	.	H	α-helix	trans	-70.5	-42.5	-174.1	-178.5	59.6	63.6	-154.8	-1.7	112.1	P1183 T1204 D1315 E1316 S1318 L1323 D1324 I1325	P1183-R1321 VanDerWaalsContact CG-NH1 3.28Å; T1204-R1321 WeakPolarHBondContact OG1-CD 3.33Å; T1204-R1321 PolarHBondContact OG1-NE 2.96Å; T1204-R1321 VanDerWaalsContact OG1-NE 3.14Å; T1204-R1321 PolarHBondContact OG1-NH1 3.28Å; T1204-R1321 PolarHBondContact OG1-NH2 3.09Å; D1315-R1321 HydrophobicContact CB-CG 3.84Å; D1315-R1321 WeakPolarHBondContact OD1-CD 3.46Å; D1315-R1321 WeakPolarHBondContact OD1-CG 3.29Å; D1315-R1321 IonicContact OD1-CZ 3.9Å; D1315-R1321 IonicContact OD1-NE 2.87Å; D1315-R1321 PolarHBondContact OD1-NE 3.37Å; D1315-R1321 IonicContact OD2-NE 3.38Å; D1315-R1321 PolarHBondContact OD2-NE 3.13Å; E1316-R1321 HydrophobicContact CG-CB 3.48Å; E1316-R1321 VanDerWaalsContact CG-CB 3.48Å; E1316-R1321 HydrophobicContact CG-CG 3.83Å; E1316-R1321 WeakPolarHBondContact O-CB 3.3Å; E1316-R1321 WeakPolarHBondContact O-CG 3.25Å; S1318-R1321 PolarHBondContact O-N 2.93Å; S1318-R1321 WeakPolarHBondContact OG-CB 3.49Å; S1318-R1321 PolarHBondContact OG-N 3.32Å; S1318-R1321 VanDerWaalsContact OG-N 3.11Å; R1321-L1323 VanDerWaalsContact C-N 3.29Å; R1321-L1323 PolarHBondContact O-N 3.22Å; R1321-D1324 IonicContact NH1-OD2 3.69Å; R1321-D1324 PolarHBondContact O-N 3.46Å; R1321-I1325 HydrophobicContact CG-CD1 3.92Å; R1321-I1325 WeakPolarHBondContact O-CG1 3.43Å; R1321-I1325 PolarHBondContact O-N 3.32Å
1322	V	95.9	Very high	93.5	Very high	1 Å²	1	19.7 Å²	19.7	1%	0.006	10%	0.104	C	C	.	.	H	α-helix	trans	-60.2	-41.8	177.7	173.2	0	0	0	0	110.4	M1259 L1261 I1295 S1318 I1325 Y1326 I1346 M1350	M1259-V1322 HydrophobicContact SD-CG1 4.27Å; L1261-V1322 HydrophobicContact CD1-CG1 4.34Å; L1261-V1322 HydrophobicContact CD1-CG2 4.34Å; L1261-V1322 HydrophobicContact CD2-CG1 4.17Å; L1261-V1322 HydrophobicContact CD2-CG2 4.12Å; I1295-V1322 HydrophobicContact CD1-CB 4.47Å; I1295-V1322 HydrophobicContact CD1-CG1 4.44Å; I1295-V1322 HydrophobicContact CD1-CG2 4.09Å; S1318-V1322 WeakPolarHBondContact O-CB 3.48Å; S1318-V1322 VanDerWaalsContact O-CG2 3.29Å; S1318-V1322 WeakPolarHBondContact O-CG2 3.4Å; S1318-V1322 PolarHBondContact O-N 2.95Å; V1322-I1325 PolarHBondContact O-N 3.24Å; V1322-Y1326 WeakPolarHBondContact O-CB 3.32Å; V1322-Y1326 PolarHBondContact O-N 2.88Å; V1322-I1346 HydrophobicContact CG2-CD1 4.03Å; V1322-M1350 HydrophobicContact CG1-SD 3.63Å
1323	L	95.5	Very high	93.4	Very high	10 Å²	10	19.7 Å²	19.7	5%	0.052	10%	0.104	C	C	.	.	H	α-helix	trans	-65.8	-40.6	175.6	-69.9	170.1	0	0	0	112.7	L1319 E1320 R1321 I1325 Y1326 E1327 L1353 V1355	L1319-L1323 HydrophobicContact CD1-CD1 3.9Å; L1319-L1323 HydrophobicContact CD1-CG 4.15Å; L1319-L1323 HydrophobicContact CG-CD1 3.89Å; L1319-L1323 WeakPolarHBondContact O-CB 3.13Å; L1319-L1323 WeakPolarHBondContact O-CD1 3.11Å; L1319-L1323 WeakPolarHBondContact O-CG 3.34Å; L1319-L1323 PolarHBondContact O-N 2.86Å; L1319-L1323 VanDerWaalsContact O-N 3.12Å; E1320-L1323 PolarHBondContact O-N 3.02Å; R1321-L1323 VanDerWaalsContact C-N 3.29Å; R1321-L1323 PolarHBondContact O-N 3.22Å; L1323-I1325 VanDerWaalsContact C-N 3.32Å; L1323-I1325 PolarHBondContact O-N 2.97Å; L1323-Y1326 PolarHBondContact O-N 3.34Å; L1323-E1327 WeakPolarHBondContact O-CB 3.42Å; L1323-E1327 VanDerWaalsContact O-CG 3.25Å; L1323-E1327 WeakPolarHBondContact O-CG 3.47Å; L1323-E1327 PolarHBondContact O-N 3.37Å; L1323-L1353 HydrophobicContact CD1-CD1 3.57Å; L1323-V1355 HydrophobicContact CD2-CG2 3.52Å
1324	D	94.5	Very high	93.4	Very high	10 Å²	10	19.7 Å²	19.7	5%	0.053	10%	0.104	C	C	.	.	H	α-helix	trans	-62.2	-39.9	177.6	-77.1	-11.9	0	0	0	112.1	R1173 R1176 K1177 P1183 Y1206 E1320 R1321 F1328	R1173-D1324 IonicContact CZ-OD1 3.35Å; R1173-D1324 IonicContact NH1-OD1 2.92Å; R1173-D1324 PolarHBondContact NH1-OD1 3.34Å; R1173-D1324 IonicContact NH2-OD1 3.65Å; R1173-D1324 PolarHBondContact NH2-OD1 3.44Å; R1176-D1324 IonicContact NH2-OD2 2.79Å; K1177-D1324 IonicContact NZ-OD1 3.53Å; K1177-D1324 PolarHBondContact NZ-OD1 3.28Å; P1183-D1324 WeakPolarHBondContact CD-OD2 3.03Å; P1183-D1324 HydrophobicContact CG-CB 3.94Å; Y1206-D1324 PolarHBondContact OH-OD2 3.43Å; E1320-D1324 PolarHBondContact O-N 3Å; E1320-D1324 VanDerWaalsContact O-N 3.09Å; R1321-D1324 IonicContact NH1-OD2 3.69Å; R1321-D1324 PolarHBondContact O-N 3.46Å; D1324-F1328 PolarHBondContact O-N 3.29Å
1325	I	95.1	Very high	93.5	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-74.1	-41.6	176.2	-62.5	165.5	0	0	0	110.7	T1204 M1259 I1295 Y1313 D1315 R1321 V1322 L1323 E1327 F1328 E1329	T1204-I1325 HydrophobicContact CG2-CD1 4.19Å; T1204-I1325 HydrophobicContact CG2-CG1 3.99Å; M1259-I1325 HydrophobicContact CE-CB 4.26Å; M1259-I1325 HydrophobicContact CE-CG2 3.64Å; I1295-I1325 HydrophobicContact CD1-CB 4.07Å; I1295-I1325 HydrophobicContact CD1-CD1 3.7Å; I1295-I1325 HydrophobicContact CD1-CG1 4.49Å; I1295-I1325 HydrophobicContact CD1-CG2 4.07Å; I1295-I1325 HydrophobicContact CG1-CD1 4.06Å; I1295-I1325 HydrophobicContact CG1-CG2 4.48Å; I1295-I1325 HydrophobicContact CG2-CD1 4.34Å; Y1313-I1325 HydrophobicContact CD1-CD1 3.66Å; Y1313-I1325 HydrophobicContact CD1-CG1 3.89Å; Y1313-I1325 HydrophobicContact CD1-CG2 4.14Å; Y1313-I1325 HydrophobicContact CD2-CG2 3.76Å; Y1313-I1325 HydrophobicContact CE1-CD1 4.36Å; Y1313-I1325 HydrophobicContact CE1-CG1 4.09Å; Y1313-I1325 HydrophobicContact CE1-CG2 4Å; Y1313-I1325 HydrophobicContact CE2-CG2 3.62Å; Y1313-I1325 HydrophobicContact CG-CD1 3.75Å; Y1313-I1325 HydrophobicContact CG-CG1 4.29Å; Y1313-I1325 HydrophobicContact CG-CG2 4.02Å; D1315-I1325 HydrophobicContact CB-CD1 4.43Å; R1321-I1325 HydrophobicContact CG-CD1 3.92Å; R1321-I1325 WeakPolarHBondContact O-CG1 3.43Å; R1321-I1325 PolarHBondContact O-N 3.32Å; V1322-I1325 PolarHBondContact O-N 3.24Å; L1323-I1325 VanDerWaalsContact C-N 3.32Å; L1323-I1325 PolarHBondContact O-N 2.97Å; I1325-E1327 VanDerWaalsContact C-N 3.35Å; I1325-E1327 PolarHBondContact O-N 3.48Å; I1325-F1328 PolarHBondContact O-N 2.92Å; I1325-E1329 HydrophobicContact CG2-CG 4.04Å; I1325-E1329 WeakPolarHBondContact O-CB 3.45Å; I1325-E1329 PolarHBondContact O-N 3.18Å
1326	Y	94.7	Very high	93.6	Very high	41 Å²	41	19.8 Å²	19.8	16%	0.161	10%	0.104	C	C	.	.	H	α-helix	trans	-60	-43.8	178.1	176.5	-91.5	0	0	0	111.7	V1322 L1323 F1328 S1330 P1331 V1334 V1355 P1356	V1322-Y1326 WeakPolarHBondContact O-CB 3.32Å; V1322-Y1326 PolarHBondContact O-N 2.88Å; L1323-Y1326 PolarHBondContact O-N 3.34Å; Y1326-F1328 VanDerWaalsContact C-N 3.34Å; Y1326-F1328 PolarHBondContact O-N 3.16Å; Y1326-S1330 VanDerWaalsContact O-CA 3.28Å; Y1326-S1330 WeakPolarHBondContact O-CA 3.38Å; Y1326-S1330 PolarHBondContact O-N 2.97Å; Y1326-P1331 HydrophobicContact CD2-CG 3.43Å; Y1326-P1331 VanDerWaalsContact CD2-CG 3.43Å; Y1326-P1331 HydrophobicContact CE2-CG 3.56Å; Y1326-P1331 HydrophobicContact CG-CG 4.42Å; Y1326-P1331 VanDerWaalsContact O-CD 3.3Å; Y1326-P1331 WeakPolarHBondContact O-CD 3.47Å; Y1326-V1334 HydrophobicContact CD2-CG2 3.75Å; Y1326-V1334 HydrophobicContact CE2-CG2 4.08Å; Y1326-V1355 HydrophobicContact CD1-CG2 4.06Å; Y1326-V1355 HydrophobicContact CD2-CG1 3.96Å; Y1326-V1355 HydrophobicContact CE1-CG1 4.41Å; Y1326-V1355 HydrophobicContact CE1-CG2 4.12Å; Y1326-V1355 HydrophobicContact CE2-CG1 3.83Å; Y1326-V1355 HydrophobicContact CG-CG1 4.34Å; Y1326-V1355 HydrophobicContact CG-CG2 4.46Å; Y1326-P1356 WeakPolarHBondContact OH-CD 3.45Å
1327	E	92	Very high	93.6	Very high	87 Å²	87	20 Å²	20	41%	0.407	11%	0.106	S	C	.	.	H	α-helix	trans	-64.9	-38.3	176.7	-74.1	169.9	-165.6	0	0	112.2	R1173 K1177 L1323 I1325 S1330	R1173-E1327 IonicContact CZ-OE1 3.03Å; R1173-E1327 IonicContact NE-OE1 3.95Å; R1173-E1327 IonicContact NH2-OE1 2.81Å; R1173-E1327 PolarHBondContact NH2-OE1 2.89Å; R1173-E1327 IonicContact NH2-OE2 3.73Å; R1173-E1327 PolarHBondContact NH2-OE2 3.28Å; K1177-E1327 VanDerWaalsContact CE-OE2 3.24Å; K1177-E1327 WeakPolarHBondContact CE-OE2 3.46Å; K1177-E1327 IonicContact NZ-OE2 2.91Å; K1177-E1327 PolarHBondContact NZ-OE2 2.94Å; L1323-E1327 WeakPolarHBondContact O-CB 3.42Å; L1323-E1327 VanDerWaalsContact O-CG 3.25Å; L1323-E1327 WeakPolarHBondContact O-CG 3.47Å; L1323-E1327 PolarHBondContact O-N 3.37Å; I1325-E1327 VanDerWaalsContact C-N 3.35Å; I1325-E1327 PolarHBondContact O-N 3.48Å; E1327-S1330 PolarHBondContact O-OG 2.93Å
1328	F	92.3	Very high	93.8	Very high	29 Å²	29	19 Å²	19	13%	0.127	10%	0.102	C	C	.	.	H	α-helix	trans	-68.5	-52.1	176.6	173.9	-98.6	0	0	0	111.9	I1185 H1248 V1250 P1252 Y1313 D1324 I1325 Y1326	I1185-F1328 HydrophobicContact CD1-CB 3.82Å; I1185-F1328 HydrophobicContact CD1-CD1 3.07Å; I1185-F1328 HydrophobicContact CD1-CD2 3.61Å; I1185-F1328 HydrophobicContact CD1-CE1 3.36Å; I1185-F1328 HydrophobicContact CD1-CE2 3.87Å; I1185-F1328 HydrophobicContact CD1-CG 3.19Å; I1185-F1328 HydrophobicContact CD1-CZ 3.74Å; H1248-F1328 HydrophobicContact CB-CE2 4.18Å; H1248-F1328 HydrophobicContact CB-CZ 4.35Å; H1248-F1328 AromaticContact CD2-CE2 3.79Å; H1248-F1328 AromaticContact CG-CE2 3.69Å; H1248-F1328 AromaticContact ND1-CE2 3.85Å; V1250-F1328 HydrophobicContact CG2-CE1 4.28Å; V1250-F1328 HydrophobicContact CG2-CZ 4.24Å; V1250-F1328 WeakPolarHBondContact O-CZ 3.4Å; P1252-F1328 VanDerWaalsContact CB-O 3.25Å; P1252-F1328 WeakPolarHBondContact CB-O 3.46Å; P1252-F1328 HydrophobicContact CG-CD2 4.14Å; P1252-F1328 HydrophobicContact CG-CE1 4.37Å; P1252-F1328 HydrophobicContact CG-CE2 3.8Å; P1252-F1328 HydrophobicContact CG-CZ 3.94Å; P1252-F1328 WeakPolarHBondContact CG-O 3.33Å; Y1313-F1328 WeakPolarHBondContact OH-CD1 3.42Å; D1324-F1328 PolarHBondContact O-N 3.29Å; I1325-F1328 PolarHBondContact O-N 2.92Å; Y1326-F1328 VanDerWaalsContact C-N 3.34Å; Y1326-F1328 PolarHBondContact O-N 3.16Å
1329	E	93	Very high	93.5	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-75	-25.2	-176.6	-68.3	-63.8	177.8	0	0	113	E1253 V1293 R1311 Y1313 I1325 P1331	E1253-E1329 VanDerWaalsContact CB-OE2 3.24Å; E1253-E1329 WeakPolarHBondContact CB-OE2 3.37Å; E1253-E1329 PolarHBondContact N-OE2 3.39Å; V1293-E1329 HydrophobicContact CG1-CG 4.38Å; V1293-E1329 HydrophobicContact CG2-CG 4.37Å; R1311-E1329 WeakPolarHBondContact CD-OE1 3.49Å; R1311-E1329 IonicContact CZ-OE1 3.25Å; R1311-E1329 IonicContact CZ-OE2 3.44Å; R1311-E1329 IonicContact NE-OE1 3.82Å; R1311-E1329 IonicContact NE-OE2 3.63Å; R1311-E1329 IonicContact NH1-OE1 3.59Å; R1311-E1329 PolarHBondContact NH1-OE1 3.02Å; R1311-E1329 IonicContact NH1-OE2 2.77Å; R1311-E1329 PolarHBondContact NH1-OE2 3.05Å; Y1313-E1329 HydrophobicContact CE2-CG 4.1Å; Y1313-E1329 WeakPolarHBondContact CE2-OE1 3.45Å; Y1313-E1329 VanDerWaalsContact CZ-OE1 3.31Å; Y1313-E1329 PolarHBondContact OH-OE1 3.21Å; I1325-E1329 HydrophobicContact CG2-CG 4.04Å; I1325-E1329 WeakPolarHBondContact O-CB 3.45Å; I1325-E1329 PolarHBondContact O-N 3.18Å; E1329-P1331 VanDerWaalsContact C-CD 3.49Å; E1329-P1331 VanDerWaalsContact C-N 3.32Å
1330	S	90.7	Very high	93.2	Very high	59 Å²	59	14.9 Å²	14.9	41%	0.413	8%	0.077	S	C	.	.			trans	45.2	49.2	-174	-63.9	0	0	0	0	113.5	Y1326 E1327	Y1326-S1330 VanDerWaalsContact O-CA 3.28Å; Y1326-S1330 WeakPolarHBondContact O-CA 3.38Å; Y1326-S1330 PolarHBondContact O-N 2.97Å; E1327-S1330 PolarHBondContact O-OG 2.93Å
1331	P	92.6	Very high	92.8	Very high	3 Å²	3	14.3 Å²	14.3	2%	0.019	7%	0.074	C	C	.	.			trans	-68.9	161.8	-179	34.1	-36	0	0	0	110.2	S1257 M1259 Y1326 E1329 G1333	S1257-P1331 CarbonylContact O-C 3.56Å; S1257-P1331 WeakPolarHBondContact O-CA 3.33Å; S1257-P1331 VanDerWaalsContact O-CB 3.23Å; S1257-P1331 WeakPolarHBondContact O-CB 3.49Å; M1259-P1331 HydrophobicContact CB-CB 4.29Å; M1259-P1331 HydrophobicContact CB-CG 3.99Å; M1259-P1331 HydrophobicContact CE-CG 4.21Å; Y1326-P1331 HydrophobicContact CD2-CG 3.43Å; Y1326-P1331 VanDerWaalsContact CD2-CG 3.43Å; Y1326-P1331 HydrophobicContact CE2-CG 3.56Å; Y1326-P1331 HydrophobicContact CG-CG 4.42Å; Y1326-P1331 VanDerWaalsContact O-CD 3.3Å; Y1326-P1331 WeakPolarHBondContact O-CD 3.47Å; E1329-P1331 VanDerWaalsContact C-CD 3.49Å; E1329-P1331 VanDerWaalsContact C-N 3.32Å; P1331-G1333 PolarHBondContact O-N 2.84Å; P1331-G1333 VanDerWaalsContact O-N 3.17Å
1332	I	89.2	Confident	92.4	Very high	37 Å²	37	15 Å²	15	19%	0.19	8%	0.079	C	C	.	.	S	Bend	trans	-64.2	-22.9	-179.4	59.6	161.6	0	0	0	113.1	K1255 S1257 I1258 W1290 L1358 I1573	K1255-I1332 WeakPolarHBondContact O-CG2 3.48Å; S1257-I1332 WeakPolarHBondContact O-CG1 3.47Å; S1257-I1332 PolarHBondContact O-N 2.78Å; I1258-I1332 HydrophobicContact CD1-CD1 3.89Å; I1258-I1332 HydrophobicContact CD1-CG1 4.49Å; I1258-I1332 HydrophobicContact CG1-CD1 3.5Å; I1258-I1332 VanDerWaalsContact CG1-CD1 3.5Å; I1258-I1332 HydrophobicContact CG1-CG1 3.57Å; W1290-I1332 HydrophobicContact CE3-CD1 3.99Å; W1290-I1332 HydrophobicContact CH2-CD1 3.63Å; W1290-I1332 HydrophobicContact CZ2-CD1 4.26Å; W1290-I1332 HydrophobicContact CZ3-CD1 3.46Å; W1290-I1332 VanDerWaalsContact CZ3-CD1 3.46Å; W1290-I1332 HydrophobicContact CZ3-CG1 4.31Å; W1290-I1332 HydrophobicContact CZ3-CG2 4.4Å; I1332-L1358 HydrophobicContact CD1-CD1 4.47Å; I1332-L1358 HydrophobicContact CG1-CD1 4.46Å; I1332-I1573 HydrophobicContact CB-CD1 4.33Å; I1332-I1573 HydrophobicContact CD1-CD1 3.6Å; I1332-I1573 HydrophobicContact CD1-CG2 4.12Å; I1332-I1573 HydrophobicContact CG1-CD1 4.41Å
1333	G	91.4	Very high	92.2	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	8%	0.078	C	C	.	.			trans	171	178.6	178.6	0	0	0	0	0	111.9	M1259 P1331 P1356	M1259-G1333 PolarHBondContact N-O 2.83Å; P1331-G1333 PolarHBondContact O-N 2.84Å; P1331-G1333 VanDerWaalsContact O-N 3.17Å; G1333-P1356 CarbonylContact C-O 3.57Å; G1333-P1356 VanDerWaalsContact CA-O 3.26Å; G1333-P1356 WeakPolarHBondContact CA-O 3.3Å
1334	V	95.6	Very high	91.9	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	8%	0.077	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	130.6	-173.5	-174	0	0	0	0	110.5	M1259 L1261 Y1326 V1336 V1355 P1356 L1358	M1259-V1334 HydrophobicContact CB-CG2 4.24Å; M1259-V1334 HydrophobicContact CG-CG1 4.38Å; M1259-V1334 CarbonylContact O-C 3.59Å; M1259-V1334 WeakPolarHBondContact O-CA 3.47Å; M1259-V1334 HydrophobicContact SD-CG1 4.4Å; M1259-V1334 HydrophobicContact SD-CG2 4.04Å; L1261-V1334 HydrophobicContact CD1-CG1 3.95Å; L1261-V1334 HydrophobicContact CD2-CG1 4.1Å; L1261-V1334 HydrophobicContact CG-CG1 3.67Å; Y1326-V1334 HydrophobicContact CD2-CG2 3.75Å; Y1326-V1334 HydrophobicContact CE2-CG2 4.08Å; V1334-V1336 HydrophobicContact CG1-CG1 4.2Å; V1334-V1355 HydrophobicContact CB-CG1 4.4Å; V1334-V1355 HydrophobicContact CG2-CG1 3.59Å; V1334-P1356 PolarHBondContact N-O 3.01Å; V1334-L1358 PolarHBondContact O-N 2.95Å
1335	I	97	Very high	91.5	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	117.9	170.9	-62.7	176.3	0	0	0	108.8	I1258 M1259 V1260 L1261 L1285 M1338 L1358 I1565	I1258-I1335 HydrophobicContact CG2-CD1 3.86Å; I1258-I1335 HydrophobicContact CG2-CG1 4.11Å; M1259-I1335 PolarHBondContact O-N 2.72Å; V1260-I1335 HydrophobicContact CG2-CB 4.42Å; V1260-I1335 HydrophobicContact CG2-CD1 4.42Å; L1261-I1335 PolarHBondContact N-O 2.73Å; L1261-I1335 VanDerWaalsContact N-O 3.08Å; L1285-I1335 HydrophobicContact CD1-CD1 4.1Å; L1285-I1335 HydrophobicContact CD2-CD1 4.47Å; I1335-M1338 HydrophobicContact CG2-CG 3.87Å; I1335-L1358 HydrophobicContact CG1-CB 3.93Å; I1335-L1358 HydrophobicContact CG1-CD1 4.27Å; I1335-I1565 HydrophobicContact CD1-CG2 4Å; I1335-I1565 HydrophobicContact CG1-CG2 4.11Å; I1335-I1565 HydrophobicContact CG2-CD1 4.31Å
1336	V	95	Very high	91.3	Very high	3 Å²	3	17.7 Å²	17.7	2%	0.018	9%	0.093	C	C	.	.			trans	-102.7	-24.9	178.3	-58.5	0	0	0	0	113.1	L1261 V1334 M1338 G1339 P1343 A1347 M1350 I1357 I1365	L1261-V1336 HydrophobicContact CD1-CG1 4.11Å; V1334-V1336 HydrophobicContact CG1-CG1 4.2Å; V1336-M1338 PolarHBondContact O-N 3.36Å; V1336-G1339 PolarHBondContact O-N 2.81Å; V1336-P1343 HydrophobicContact CB-CB 3.89Å; V1336-P1343 HydrophobicContact CG1-CB 4.34Å; V1336-A1347 HydrophobicContact CG2-CB 4.2Å; V1336-M1350 HydrophobicContact CG1-CE 3.65Å; V1336-I1357 HydrophobicContact CG1-CD1 4.45Å; V1336-I1357 HydrophobicContact CG2-CG2 4.06Å; V1336-I1365 HydrophobicContact CG2-CD1 4.22Å
1337	S	94.4	Very high	91.3	Very high	9 Å²	9	15.8 Å²	15.8	6%	0.063	9%	0.086	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69	-2.7	-168	66.1	0	0	0	0	115.4	R1541 V1542	S1337-R1541 WeakPolarHBondContact O-CB 3.37Å; S1337-V1542 WeakPolarHBondContact O-CG2 3.49Å; S1337-V1542 PolarHBondContact O-N 2.7Å
1338	M	94.7	Very high	91.3	Very high	0 Å²	0	13.6 Å²	13.6	0%	0	8%	0.076	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.9	-27.5	-177.8	-58.9	-60.3	165.4	0	0	113.3	C1277 A1278 C1281 I1335 V1336 P1521 V1542 I1558 A1561 I1565	C1277-M1338 HydrophobicContact CB-SD 4.36Å; A1278-M1338 HydrophobicContact CB-CB 4.48Å; C1281-M1338 HydrophobicContact CB-CE 4.15Å; C1281-M1338 HydrophobicContact CB-CG 3.82Å; C1281-M1338 HydrophobicContact CB-SD 4.05Å; I1335-M1338 HydrophobicContact CG2-CG 3.87Å; V1336-M1338 PolarHBondContact O-N 3.36Å; M1338-P1521 HydrophobicContact CE-CG 4.17Å; M1338-V1542 WeakPolarHBondContact O-CG2 3.09Å; M1338-V1542 HydrophobicContact SD-CG1 3.65Å; M1338-I1558 HydrophobicContact SD-CG2 4.37Å; M1338-A1561 HydrophobicContact CE-CB 4.29Å; M1338-I1565 HydrophobicContact CE-CD1 3.53Å
1339	G	86.5	Confident	91.4	Very high	0 Å²	0	14.3 Å²	14.3	0%	0	8%	0.083	C	C	.	.	S	Bend	trans	-94.9	11.8	-172.9	0	0	0	0	0	115.1	S1263 V1336 P1343	S1263-G1339 VanDerWaalsContact CA-O 3.26Å; S1263-G1339 WeakPolarHBondContact CA-O 3.33Å; V1336-G1339 PolarHBondContact O-N 2.81Å; G1339-P1343 VanDerWaalsContact O-CD 3.27Å; G1339-P1343 WeakPolarHBondContact O-CD 3.35Å
1340	G	87.8	Confident	91.4	Very high	0 Å²	0	14.3 Å²	14.3	0%	0	8%	0.083	C	C	.	.			trans	82	-144.7	176.1	0	0	0	0	0	113.7	R1541	G1340-R1541 VanDerWaalsContact CA-NH1 3.27Å; G1340-R1541 VanDerWaalsContact O-CD 3.29Å; G1340-R1541 WeakPolarHBondContact O-CD 3.39Å
1341	Q	85.7	Confident	91.6	Very high	8 Å²	8	14.7 Å²	14.7	4%	0.037	8%	0.079	C	C	.	.	H	α-helix	trans	-78.5	-34.2	-172.2	-163.7	60.1	29.3	0	0	113.7	N1344 N1345 E1369 R1541	Q1341-N1344 PolarHBondContact O-N 3.49Å; Q1341-N1344 VanDerWaalsContact O-N 3.11Å; Q1341-N1345 WeakPolarHBondContact CG-OD1 3.5Å; Q1341-N1345 PolarHBondContact NE2-OD1 3.4Å; Q1341-N1345 VanDerWaalsContact O-CG 3.29Å; Q1341-N1345 PolarHBondContact O-N 3.4Å; Q1341-N1345 PolarHBondContact O-OD1 3.41Å; Q1341-E1369 PolarHBondContact NE2-OE1 2.93Å; Q1341-E1369 PolarHBondContact NE2-OE2 3.5Å; Q1341-R1541 VanDerWaalsContact OE1-CZ 3.29Å; Q1341-R1541 VanDerWaalsContact OE1-NE 3.13Å
1342	T	86.9	Confident	91.6	Very high	17 Å²	17	23.1 Å²	23.1	10%	0.104	11%	0.11	C	C	.	.	H	α-helix	trans	-57.2	-47.5	-176.8	-40.1	0	0	0	0	111.4	E1045 R1267 L1317	E1045-T1342 HydrophobicContact CG-CG2 4.13Å; R1267-T1342 PolarHBondContact NH2-OG1 2.97Å; L1317-T1342 HydrophobicContact CB-CG2 4.2Å; L1317-T1342 HydrophobicContact CD1-CG2 4.48Å
1343	P	91	Very high	91.6	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-69.4	-35.6	174.3	-23.3	38.7	0	0	0	113.9	L1261 G1262 V1336 G1339 N1345 I1346 A1347	L1261-P1343 HydrophobicContact CB-CB 3.84Å; L1261-P1343 HydrophobicContact CB-CG 3.9Å; L1261-P1343 HydrophobicContact CD1-CB 4.06Å; G1262-P1343 VanDerWaalsContact O-CG 3.26Å; G1262-P1343 WeakPolarHBondContact O-CG 3.45Å; V1336-P1343 HydrophobicContact CB-CB 3.89Å; V1336-P1343 HydrophobicContact CG1-CB 4.34Å; G1339-P1343 VanDerWaalsContact O-CD 3.27Å; G1339-P1343 WeakPolarHBondContact O-CD 3.35Å; P1343-N1345 VanDerWaalsContact C-N 3.33Å; P1343-N1345 PolarHBondContact O-N 3.35Å; P1343-I1346 VanDerWaalsContact O-CG1 3.23Å; P1343-I1346 WeakPolarHBondContact O-CG1 3.3Å; P1343-I1346 PolarHBondContact O-N 3.11Å; P1343-A1347 PolarHBondContact O-N 3.25Å
1344	N	89.1	Confident	91.5	Very high	4 Å²	4	28.8 Å²	28.8	2%	0.021	15%	0.154	C	C	.	.	H	α-helix	trans	-61.4	-41	177.7	-95.2	31.9	0	0	0	111.9	Q1341 I1346 A1347 E1369	Q1341-N1344 PolarHBondContact O-N 3.49Å; Q1341-N1344 VanDerWaalsContact O-N 3.11Å; N1344-I1346 PolarHBondContact O-N 3.15Å; N1344-I1346 VanDerWaalsContact O-N 3.11Å; N1344-A1347 VanDerWaalsContact O-CB 3.24Å; N1344-A1347 WeakPolarHBondContact O-CB 3.42Å; N1344-A1347 PolarHBondContact O-N 2.54Å; N1344-E1369 PolarHBondContact ND2-OE1 2.62Å
1345	N	87.5	Confident	91.4	Very high	53 Å²	53	29 Å²	29	28%	0.283	16%	0.156	S	C	.	.	H	α-helix	trans	-58.1	-27.7	180	-74.1	-9.7	0	0	0	113	E1045 Q1341 P1343	E1045-N1345 PolarHBondContact OE2-ND2 3.2Å; Q1341-N1345 WeakPolarHBondContact CG-OD1 3.5Å; Q1341-N1345 PolarHBondContact NE2-OD1 3.4Å; Q1341-N1345 VanDerWaalsContact O-CG 3.29Å; Q1341-N1345 PolarHBondContact O-N 3.4Å; Q1341-N1345 PolarHBondContact O-OD1 3.41Å; P1343-N1345 VanDerWaalsContact C-N 3.33Å; P1343-N1345 PolarHBondContact O-N 3.35Å
1346	I	91.1	Very high	91.1	Very high	21 Å²	21	31.6 Å²	31.6	11%	0.108	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.4	-0.2	178.1	60.5	165.6	0	0	0	113.8	L1261 L1319 V1322 P1343 N1344 P1349 M1350	L1261-I1346 HydrophobicContact CD1-CD1 4Å; L1319-I1346 HydrophobicContact CB-CG2 4.38Å; V1322-I1346 HydrophobicContact CG2-CD1 4.03Å; P1343-I1346 VanDerWaalsContact O-CG1 3.23Å; P1343-I1346 WeakPolarHBondContact O-CG1 3.3Å; P1343-I1346 PolarHBondContact O-N 3.11Å; N1344-I1346 PolarHBondContact O-N 3.15Å; N1344-I1346 VanDerWaalsContact O-N 3.11Å; I1346-P1349 WeakPolarHBondContact O-CD 3.35Å; I1346-M1350 HydrophobicContact CD1-CE 4.12Å; I1346-M1350 HydrophobicContact CD1-SD 4.17Å; I1346-M1350 HydrophobicContact CG1-CE 3.89Å; I1346-M1350 HydrophobicContact CG1-SD 4.47Å; I1346-M1350 WeakPolarHBondContact O-CB 3.17Å; I1346-M1350 VanDerWaalsContact O-CG 3.25Å; I1346-M1350 WeakPolarHBondContact O-CG 3.48Å; I1346-M1350 PolarHBondContact O-N 2.96Å
1347	A	93.8	Very high	91.1	Very high	1 Å²	1	32.5 Å²	32.5	1%	0.008	18%	0.177	C	C	.	.	H	α-helix	trans	-61.2	-50.2	-178.9	0	0	0	0	0	112.6	V1336 P1343 N1344 M1350 H1351 A1362 I1365	V1336-A1347 HydrophobicContact CG2-CB 4.2Å; P1343-A1347 PolarHBondContact O-N 3.25Å; N1344-A1347 VanDerWaalsContact O-CB 3.24Å; N1344-A1347 WeakPolarHBondContact O-CB 3.42Å; N1344-A1347 PolarHBondContact O-N 2.54Å; A1347-M1350 PolarHBondContact O-N 2.88Å; A1347-H1351 WeakPolarHBondContact O-CB 3.29Å; A1347-H1351 PolarHBondContact O-N 3.34Å; A1347-A1362 HydrophobicContact CB-CB 4.48Å; A1347-I1365 HydrophobicContact CB-CD1 4.34Å
1348	M	93	Very high	91	Very high	42 Å²	42	32.7 Å²	32.7	21%	0.207	18%	0.177	C	C	.	.	H	α-helix	trans	-68.2	-42.8	179.2	-168.8	65.3	-174.8	0	0	112.9	M1350 H1351 R1352 A1362 E1363	M1348-M1350 PolarHBondContact O-N 3.02Å; M1348-H1351 PolarHBondContact O-N 2.69Å; M1348-R1352 HydrophobicContact CE-CG 4.22Å; M1348-R1352 WeakPolarHBondContact O-CG 3.35Å; M1348-R1352 PolarHBondContact O-N 2.85Å; M1348-A1362 HydrophobicContact SD-CB 3.96Å; M1348-E1363 HydrophobicContact CE-CG 4.31Å
1349	P	92.7	Very high	91	Very high	43 Å²	43	33.4 Å²	33.4	28%	0.279	19%	0.185	S	C	.	.	H	α-helix	trans	-55.8	-44.4	169.3	-28.2	34.8	0	0	0	114.3	L1319 I1346 R1352 L1353	L1319-P1349 HydrophobicContact CD1-CB 4Å; L1319-P1349 HydrophobicContact CD2-CB 3.73Å; L1319-P1349 HydrophobicContact CG-CB 4.47Å; I1346-P1349 WeakPolarHBondContact O-CD 3.35Å; P1349-R1352 PolarHBondContact O-N 2.94Å; P1349-L1353 WeakPolarHBondContact O-CG 3.24Å; P1349-L1353 PolarHBondContact O-N 3.03Å
1350	M	94.7	Very high	91.3	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-62.9	-45.2	176.3	-78.1	-171.1	-59.7	0	0	111.9	L1261 L1319 V1322 V1336 I1346 A1347 M1348 R1352 L1353 G1354 V1355 I1357	L1261-M1350 HydrophobicContact CD1-CE 4.1Å; L1261-M1350 HydrophobicContact CD1-SD 4.48Å; L1319-M1350 HydrophobicContact CD1-CB 4.46Å; L1319-M1350 HydrophobicContact CD1-CG 3.56Å; V1322-M1350 HydrophobicContact CG1-SD 3.63Å; V1336-M1350 HydrophobicContact CG1-CE 3.65Å; I1346-M1350 HydrophobicContact CD1-CE 4.12Å; I1346-M1350 HydrophobicContact CD1-SD 4.17Å; I1346-M1350 HydrophobicContact CG1-CE 3.89Å; I1346-M1350 HydrophobicContact CG1-SD 4.47Å; I1346-M1350 WeakPolarHBondContact O-CB 3.17Å; I1346-M1350 VanDerWaalsContact O-CG 3.25Å; I1346-M1350 WeakPolarHBondContact O-CG 3.48Å; I1346-M1350 PolarHBondContact O-N 2.96Å; A1347-M1350 PolarHBondContact O-N 2.88Å; M1348-M1350 PolarHBondContact O-N 3.02Å; M1350-R1352 PolarHBondContact O-N 3.29Å; M1350-L1353 CarbonylContact O-C 3.59Å; M1350-L1353 PolarHBondContact O-N 3.21Å; M1350-L1353 VanDerWaalsContact O-N 3.08Å; M1350-G1354 PolarHBondContact O-N 3.15Å; M1350-V1355 HydrophobicContact CB-CB 4.03Å; M1350-V1355 HydrophobicContact CB-CG1 4.44Å; M1350-V1355 HydrophobicContact CB-CG2 4.37Å; M1350-V1355 WeakPolarHBondContact O-CB 3.44Å; M1350-V1355 PolarHBondContact O-N 3.29Å; M1350-V1355 VanDerWaalsContact O-N 3.1Å; M1350-I1357 HydrophobicContact CB-CD1 4.11Å; M1350-I1357 HydrophobicContact CE-CD1 3.84Å
1351	H	94.3	Very high	91.6	Very high	67 Å²	67	36 Å²	36	31%	0.31	20%	0.203	S	C	.	.	H	α-helix	trans	-60.3	-44.5	178.6	179.4	77.1	0	0	0	112.2	A1347 M1348 L1353 G1354 I1357 A1362 E1363	A1347-H1351 WeakPolarHBondContact O-CB 3.29Å; A1347-H1351 PolarHBondContact O-N 3.34Å; M1348-H1351 PolarHBondContact O-N 2.69Å; H1351-L1353 PolarHBondContact O-N 3.29Å; H1351-L1353 VanDerWaalsContact O-N 3.16Å; H1351-G1354 PolarHBondContact O-N 3.37Å; H1351-I1357 HydrophobicContact CB-CG1 4.32Å; H1351-A1362 HydrophobicContact CB-CB 3.64Å; H1351-E1363 IonicContact CD2-OE1 3.67Å; H1351-E1363 IonicContact CE1-OE1 2.82Å; H1351-E1363 IonicContact CE1-OE2 2.8Å; H1351-E1363 IonicContact NE2-OE1 2.69Å; H1351-E1363 PolarHBondContact NE2-OE1 3.04Å; H1351-E1363 VanDerWaalsContact NE2-OE1 3.12Å; H1351-E1363 IonicContact NE2-OE2 3.05Å
1352	R	92.9	Very high	92	Very high	180 Å²	180	35.7 Å²	35.7	68%	0.679	20%	0.202	S	C	*	.	H	α-helix	trans	-61.7	-22.4	175.9	-71.5	175.4	-173.9	164.1	6	113.6	M1348 P1349 M1350	M1348-R1352 HydrophobicContact CE-CG 4.22Å; M1348-R1352 WeakPolarHBondContact O-CG 3.35Å; M1348-R1352 PolarHBondContact O-N 2.85Å; P1349-R1352 PolarHBondContact O-N 2.94Å; M1350-R1352 PolarHBondContact O-N 3.29Å
1353	L	89.5	Confident	92.3	Very high	96 Å²	96	38.6 Å²	38.6	50%	0.503	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.2	8.1	176.2	-66.4	172.1	0	0	0	112.9	L1319 L1323 P1349 M1350 H1351	L1319-L1353 HydrophobicContact CD1-CD1 4.37Å; L1319-L1353 HydrophobicContact CD2-CD1 4.23Å; L1323-L1353 HydrophobicContact CD1-CD1 3.57Å; P1349-L1353 WeakPolarHBondContact O-CG 3.24Å; P1349-L1353 PolarHBondContact O-N 3.03Å; M1350-L1353 CarbonylContact O-C 3.59Å; M1350-L1353 PolarHBondContact O-N 3.21Å; M1350-L1353 VanDerWaalsContact O-N 3.08Å; H1351-L1353 PolarHBondContact O-N 3.29Å; H1351-L1353 VanDerWaalsContact O-N 3.16Å
1354	G	89.3	Confident	92.4	Very high	60 Å²	60	39.1 Å²	39.1	62%	0.619	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	85.1	12.9	174	0	0	0	0	0	115.2	M1350 H1351 P1356	M1350-G1354 PolarHBondContact O-N 3.15Å; H1351-G1354 PolarHBondContact O-N 3.37Å; G1354-P1356 WeakPolarHBondContact O-CD 3.19Å
1355	V	92.8	Very high	92.5	Very high	5 Å²	5	39.2 Å²	39.2	3%	0.03	22%	0.218	C	C	.	.	P	Polyproline II helix	trans	-78.8	122.2	174.3	179.4	0	0	0	0	109.6	L1323 Y1326 V1334 M1350 I1357	L1323-V1355 HydrophobicContact CD2-CG2 3.52Å; Y1326-V1355 HydrophobicContact CD1-CG2 4.06Å; Y1326-V1355 HydrophobicContact CD2-CG1 3.96Å; Y1326-V1355 HydrophobicContact CE1-CG1 4.41Å; Y1326-V1355 HydrophobicContact CE1-CG2 4.12Å; Y1326-V1355 HydrophobicContact CE2-CG1 3.83Å; Y1326-V1355 HydrophobicContact CG-CG1 4.34Å; Y1326-V1355 HydrophobicContact CG-CG2 4.46Å; V1334-V1355 HydrophobicContact CB-CG1 4.4Å; V1334-V1355 HydrophobicContact CG2-CG1 3.59Å; M1350-V1355 HydrophobicContact CB-CB 4.03Å; M1350-V1355 HydrophobicContact CB-CG1 4.44Å; M1350-V1355 HydrophobicContact CB-CG2 4.37Å; M1350-V1355 WeakPolarHBondContact O-CB 3.44Å; M1350-V1355 PolarHBondContact O-N 3.29Å; M1350-V1355 VanDerWaalsContact O-N 3.1Å; V1355-I1357 PolarHBondContact O-N 3.3Å
1356	P	90.9	Very high	92.7	Very high	55 Å²	55	37.7 Å²	37.7	36%	0.357	21%	0.21	S	C	.	.	P	Polyproline II helix	trans	-67.9	117.3	177.4	-18.4	32.3	0	0	0	111.4	Y1326 G1333 V1334 G1354	Y1326-P1356 WeakPolarHBondContact OH-CD 3.45Å; G1333-P1356 CarbonylContact C-O 3.57Å; G1333-P1356 VanDerWaalsContact CA-O 3.26Å; G1333-P1356 WeakPolarHBondContact CA-O 3.3Å; V1334-P1356 PolarHBondContact N-O 3.01Å; G1354-P1356 WeakPolarHBondContact O-CD 3.19Å
1357	I	94.6	Very high	92.7	Very high	21 Å²	21	39.4 Å²	39.4	11%	0.108	22%	0.219	C	C	.	.	B	Isolated β-bridge	trans	-87.2	121	171.5	-53.1	-54.8	0	0	0	108.1	V1336 M1350 H1351 V1355 A1362	V1336-I1357 HydrophobicContact CG1-CD1 4.45Å; V1336-I1357 HydrophobicContact CG2-CG2 4.06Å; M1350-I1357 HydrophobicContact CB-CD1 4.11Å; M1350-I1357 HydrophobicContact CE-CD1 3.84Å; H1351-I1357 HydrophobicContact CB-CG1 4.32Å; V1355-I1357 PolarHBondContact O-N 3.3Å; I1357-A1362 HydrophobicContact CG1-CB 4.42Å
1358	L	93.1	Very high	92.5	Very high	13 Å²	13	39.4 Å²	39.4	7%	0.068	22%	0.219	C	C	.	.	P	Polyproline II helix	trans	-88.7	132.6	-179.9	-57.1	-177.7	0	0	0	110.2	I1258 I1332 V1334 I1335 I1565 A1569	I1258-L1358 HydrophobicContact CG1-CD1 4.32Å; I1258-L1358 HydrophobicContact CG2-CD1 4.02Å; I1332-L1358 HydrophobicContact CD1-CD1 4.47Å; I1332-L1358 HydrophobicContact CG1-CD1 4.46Å; V1334-L1358 PolarHBondContact O-N 2.95Å; I1335-L1358 HydrophobicContact CG1-CB 3.93Å; I1335-L1358 HydrophobicContact CG1-CD1 4.27Å; L1358-I1565 HydrophobicContact CB-CG2 3.94Å; L1358-A1569 HydrophobicContact CD2-CB 3.95Å
1359	G	93.4	Very high	92.2	Very high	16 Å²	16	38 Å²	38	17%	0.165	21%	0.212	C	C	.	.	S	Bend	trans	103.6	-140.3	-177.4	0	0	0	0	0	111.4	S1519	G1359-S1519 CarbonylContact C-O 3.53Å; G1359-S1519 VanDerWaalsContact C-O 3.27Å; G1359-S1519 WeakPolarHBondContact CA-O 3.36Å
1360	T	94.3	Very high	91.8	Very high	10 Å²	10	37 Å²	37	6%	0.061	21%	0.205	C	C	.	.	S	Bend	trans	-60.9	135	175.3	-51.2	0	0	0	0	110.8	S1519 L1540	T1360-S1519 PolarHBondContact N-O 3.01Å; T1360-S1519 PolarHBondContact OG1-N 3.47Å; T1360-L1540 HydrophobicContact CG2-CB 4.42Å; T1360-L1540 HydrophobicContact CG2-CD1 3.89Å
1361	S	93.6	Very high	91.3	Very high	44 Å²	44	37.1 Å²	37.1	31%	0.308	21%	0.205	S	C	.	.			trans	-63.7	153.5	-176.3	66.7	0	0	0	0	112.4	E1363 S1364 I1365	S1361-E1363 PolarHBondContact O-N 3.14Å; S1361-S1364 PolarHBondContact O-N 2.89Å; S1361-S1364 WeakPolarHBondContact OG-CB 3.4Å; S1361-S1364 PolarHBondContact OG-N 2.81Å; S1361-S1364 PolarHBondContact OG-OG 3.14Å; S1361-S1364 VanDerWaalsContact OG-OG 3.14Å; S1361-I1365 WeakPolarHBondContact O-CG1 3.16Å; S1361-I1365 PolarHBondContact O-N 3.11Å
1362	A	93.2	Very high	90.6	Very high	2 Å²	2	38.3 Å²	38.3	2%	0.017	21%	0.209	C	C	.	.	H	α-helix	trans	-63.3	-32.3	178.1	0	0	0	0	0	112	A1347 M1348 H1351 I1357 I1365 D1366	A1347-A1362 HydrophobicContact CB-CB 4.48Å; M1348-A1362 HydrophobicContact SD-CB 3.96Å; H1351-A1362 HydrophobicContact CB-CB 3.64Å; I1357-A1362 HydrophobicContact CG1-CB 4.42Å; A1362-I1365 PolarHBondContact O-N 3.11Å; A1362-D1366 PolarHBondContact O-N 2.99Å
1363	E	93.1	Very high	90.4	Very high	77 Å²	77	33.7 Å²	33.7	36%	0.36	19%	0.194	S	C	.	.	H	α-helix	trans	-67.4	-41.5	175.4	-59.8	94.6	143.1	0	0	112	M1348 H1351 S1361 I1365 D1366 N1367	M1348-E1363 HydrophobicContact CE-CG 4.31Å; H1351-E1363 IonicContact CD2-OE1 3.67Å; H1351-E1363 IonicContact CE1-OE1 2.82Å; H1351-E1363 IonicContact CE1-OE2 2.8Å; H1351-E1363 IonicContact NE2-OE1 2.69Å; H1351-E1363 PolarHBondContact NE2-OE1 3.04Å; H1351-E1363 VanDerWaalsContact NE2-OE1 3.12Å; H1351-E1363 IonicContact NE2-OE2 3.05Å; S1361-E1363 PolarHBondContact O-N 3.14Å; E1363-I1365 VanDerWaalsContact C-N 3.35Å; E1363-D1366 PolarHBondContact O-N 3.2Å; E1363-N1367 WeakPolarHBondContact O-CB 3.27Å; E1363-N1367 PolarHBondContact O-N 3.3Å; E1363-N1367 PolarHBondContact O-ND2 3.3Å
1364	S	93.9	Very high	90.4	Very high	11 Å²	11	29.1 Å²	29.1	8%	0.077	17%	0.17	C	C	.	.	H	α-helix	trans	-65	-40.1	174	-72.8	0	0	0	0	111.4	S1361 N1367 A1368 L1516 L1540	S1361-S1364 PolarHBondContact O-N 2.89Å; S1361-S1364 WeakPolarHBondContact OG-CB 3.4Å; S1361-S1364 PolarHBondContact OG-N 2.81Å; S1361-S1364 PolarHBondContact OG-OG 3.14Å; S1361-S1364 VanDerWaalsContact OG-OG 3.14Å; S1364-N1367 PolarHBondContact O-N 2.83Å; S1364-A1368 PolarHBondContact O-N 2.85Å; S1364-L1516 WeakPolarHBondContact CB-O 3.32Å; S1364-L1516 PolarHBondContact OG-O 3.29Å; S1364-L1540 VanDerWaalsContact C-CD1 3.47Å; S1364-L1540 WeakPolarHBondContact O-CD1 3.23Å
1365	I	91.9	Very high	90.2	Very high	7 Å²	7	26.3 Å²	26.3	4%	0.036	14%	0.141	C	C	.	.	H	α-helix	trans	-56.2	-51.2	172.4	-65.3	168.2	0	0	0	110.4	V1336 A1347 S1361 A1362 E1363 N1367 A1368 E1369 L1540	V1336-I1365 HydrophobicContact CG2-CD1 4.22Å; A1347-I1365 HydrophobicContact CB-CD1 4.34Å; S1361-I1365 WeakPolarHBondContact O-CG1 3.16Å; S1361-I1365 PolarHBondContact O-N 3.11Å; A1362-I1365 PolarHBondContact O-N 3.11Å; E1363-I1365 VanDerWaalsContact C-N 3.35Å; I1365-N1367 PolarHBondContact O-N 3.48Å; I1365-A1368 PolarHBondContact O-N 2.95Å; I1365-E1369 HydrophobicContact CG2-CG 4.41Å; I1365-E1369 WeakPolarHBondContact O-CG 3.41Å; I1365-E1369 PolarHBondContact O-N 2.92Å; I1365-L1540 HydrophobicContact CG1-CB 4.19Å
1366	D	90.6	Very high	89.9	Confident	21 Å²	21	33.5 Å²	33.5	11%	0.112	17%	0.168	C	C	.	.	H	α-helix	trans	-64.7	-36.1	178.3	179.5	69.8	0	0	0	112.7	A1362 E1363 A1368 E1369 N1370 K1373 Y1414	A1362-D1366 PolarHBondContact O-N 2.99Å; E1363-D1366 PolarHBondContact O-N 3.2Å; D1366-A1368 VanDerWaalsContact C-N 3.3Å; D1366-A1368 PolarHBondContact O-N 3.12Å; D1366-E1369 PolarHBondContact O-N 3.24Å; D1366-N1370 WeakPolarHBondContact O-CB 3.49Å; D1366-N1370 PolarHBondContact O-N 3.38Å; D1366-K1373 IonicContact OD2-NZ 3.41Å; D1366-K1373 PolarHBondContact OD2-NZ 3.31Å; D1366-Y1414 PolarHBondContact OD1-OH 3.35Å; D1366-Y1414 VanDerWaalsContact OD1-OH 3.13Å
1367	N	91	Very high	89.8	Confident	56 Å²	56	31.7 Å²	31.7	30%	0.299	16%	0.155	S	C	.	.	H	α-helix	trans	-63.9	-32.9	174.2	-74.7	-24.7	0	0	0	112.7	E1363 S1364 I1365 K1373 F1374 L1516	E1363-N1367 WeakPolarHBondContact O-CB 3.27Å; E1363-N1367 PolarHBondContact O-N 3.3Å; E1363-N1367 PolarHBondContact O-ND2 3.3Å; S1364-N1367 PolarHBondContact O-N 2.83Å; I1365-N1367 PolarHBondContact O-N 3.48Å; N1367-K1373 WeakPolarHBondContact OD1-CD 3.35Å; N1367-F1374 WeakPolarHBondContact O-CA 3.38Å; N1367-F1374 VanDerWaalsContact O-CB 3.31Å; N1367-F1374 WeakPolarHBondContact O-CB 3.48Å; N1367-F1374 PolarHBondContact O-N 3.33Å; N1367-F1374 VanDerWaalsContact O-N 3.08Å; N1367-L1516 HydrophobicContact CB-CD2 4.25Å
1368	A	90.3	Very high	89.7	Confident	1 Å²	1	30.7 Å²	30.7	1%	0.008	15%	0.15	C	C	.	.	H	α-helix	trans	-80.2	-39.2	177	0	0	0	0	0	113.1	S1364 I1365 D1366 F1374 L1516 L1540	S1364-A1368 PolarHBondContact O-N 2.85Å; I1365-A1368 PolarHBondContact O-N 2.95Å; D1366-A1368 VanDerWaalsContact C-N 3.3Å; D1366-A1368 PolarHBondContact O-N 3.12Å; A1368-F1374 HydrophobicContact CB-CD2 4.43Å; A1368-L1516 HydrophobicContact CB-CD1 4.3Å; A1368-L1516 HydrophobicContact CB-CD2 4.46Å; A1368-L1540 HydrophobicContact CB-CD1 3.59Å; A1368-L1540 HydrophobicContact CB-CG 3.78Å
1369	E	86.6	Confident	89.3	Confident	14 Å²	14	35.3 Å²	35.3	7%	0.065	17%	0.174	C	C	.	.	H	α-helix	trans	-81.2	-31.5	-176.2	-69.3	-175.6	-178.6	0	0	113.3	Q1341 N1344 I1365 D1366 R1371 Y1414 V1415	Q1341-E1369 PolarHBondContact NE2-OE1 2.93Å; Q1341-E1369 PolarHBondContact NE2-OE2 3.5Å; N1344-E1369 PolarHBondContact ND2-OE1 2.62Å; I1365-E1369 HydrophobicContact CG2-CG 4.41Å; I1365-E1369 WeakPolarHBondContact O-CG 3.41Å; I1365-E1369 PolarHBondContact O-N 2.92Å; D1366-E1369 PolarHBondContact O-N 3.24Å; E1369-R1371 PolarHBondContact O-N 3.35Å; E1369-Y1414 HydrophobicContact CB-CD1 4.36Å; E1369-V1415 WeakPolarHBondContact O-CG2 3.5Å; E1369-V1415 PolarHBondContact O-N 3.13Å; E1369-V1415 VanDerWaalsContact O-N 3.08Å
1370	N	84.9	Confident	88.9	Confident	21 Å²	21	39.6 Å²	39.6	11%	0.112	20%	0.201	C	C	.	.	B	Isolated β-bridge	trans	-80.3	116.2	177.1	-177	-56	0	0	0	110.8	D1366 F1372 K1373 F1374 Y1414	D1366-N1370 WeakPolarHBondContact O-CB 3.49Å; D1366-N1370 PolarHBondContact O-N 3.38Å; N1370-F1372 VanDerWaalsContact C-N 3.34Å; N1370-F1372 PolarHBondContact O-N 3.47Å; N1370-F1372 PolarHBondContact OD1-N 3.47Å; N1370-K1373 HydrophobicContact CB-CB 4.13Å; N1370-K1373 HydrophobicContact CB-CD 4.07Å; N1370-K1373 HydrophobicContact CB-CG 4.09Å; N1370-K1373 PolarHBondContact O-N 2.97Å; N1370-K1373 PolarHBondContact OD1-N 3.3Å; N1370-F1374 WeakPolarHBondContact O-CB 3.23Å; N1370-F1374 PolarHBondContact O-N 3.27Å; N1370-Y1414 HydrophobicContact CB-CE1 3.98Å; N1370-Y1414 PolarHBondContact ND2-OH 3.08Å; N1370-Y1414 VanDerWaalsContact ND2-OH 3.14Å
1371	R	83.3	Confident	88.6	Confident	3 Å²	3	41.2 Å²	41.2	1%	0.011	21%	0.209	C	C	.	.	H	α-helix	trans	-60.5	-36.5	-174.2	-72.1	-48.7	-52.1	-167	-2.5	115.1	E1369 S1375 S1413 V1447 I1536	E1369-R1371 PolarHBondContact O-N 3.35Å; R1371-S1375 WeakPolarHBondContact O-CB 3.46Å; R1371-S1375 PolarHBondContact O-N 3.41Å; R1371-S1375 PolarHBondContact O-OG 2.8Å; R1371-S1413 WeakPolarHBondContact CB-O 3.45Å; R1371-S1413 VanDerWaalsContact CG-O 3.26Å; R1371-S1413 WeakPolarHBondContact CG-O 3.41Å; R1371-S1413 PolarHBondContact N-O 3.44Å; R1371-V1447 HydrophobicContact CB-CG2 4.37Å; R1371-I1536 PolarHBondContact NH1-O 3.07Å
1372	F	80.4	Confident	88.3	Confident	92 Å²	92	42.1 Å²	42.1	40%	0.404	23%	0.225	S	C	.	.	H	α-helix	trans	-66.9	-46.2	177.8	176.8	-95.2	0	0	0	110.8	N1370 R1376 W1388	N1370-F1372 VanDerWaalsContact C-N 3.34Å; N1370-F1372 PolarHBondContact O-N 3.47Å; N1370-F1372 PolarHBondContact OD1-N 3.47Å; F1372-R1376 PolarHBondContact O-N 3.5Å; F1372-W1388 HydrophobicContact CD2-CH2 4.29Å
1373	K	87.3	Confident	88.1	Confident	83 Å²	83	43.4 Å²	43.4	36%	0.361	23%	0.231	S	C	.	.	H	α-helix	trans	-65.1	-48.9	178	-63.1	-174	177.3	-172.1	0	111.6	D1366 N1367 N1370 S1375 R1376 L1377	D1366-K1373 IonicContact OD2-NZ 3.41Å; D1366-K1373 PolarHBondContact OD2-NZ 3.31Å; N1367-K1373 WeakPolarHBondContact OD1-CD 3.35Å; N1370-K1373 HydrophobicContact CB-CB 4.13Å; N1370-K1373 HydrophobicContact CB-CD 4.07Å; N1370-K1373 HydrophobicContact CB-CG 4.09Å; N1370-K1373 PolarHBondContact O-N 2.97Å; N1370-K1373 PolarHBondContact OD1-N 3.3Å; K1373-S1375 VanDerWaalsContact C-N 3.28Å; K1373-S1375 PolarHBondContact O-N 2.82Å; K1373-R1376 PolarHBondContact O-N 2.74Å; K1373-L1377 PolarHBondContact O-N 3.34Å
1374	F	90.3	Very high	88	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-59.8	-41.3	-179.9	-171.3	-120.3	0	0	0	111.7	N1367 A1368 N1370 L1377 L1378 L1512 I1535 A1538	N1367-F1374 WeakPolarHBondContact O-CA 3.38Å; N1367-F1374 VanDerWaalsContact O-CB 3.31Å; N1367-F1374 WeakPolarHBondContact O-CB 3.48Å; N1367-F1374 PolarHBondContact O-N 3.33Å; N1367-F1374 VanDerWaalsContact O-N 3.08Å; A1368-F1374 HydrophobicContact CB-CD2 4.43Å; N1370-F1374 WeakPolarHBondContact O-CB 3.23Å; N1370-F1374 PolarHBondContact O-N 3.27Å; F1374-L1377 WeakPolarHBondContact O-CB 3.34Å; F1374-L1377 PolarHBondContact O-N 2.82Å; F1374-L1378 HydrophobicContact CD1-CD1 4.05Å; F1374-L1378 HydrophobicContact CD1-CG 4.37Å; F1374-L1378 HydrophobicContact CE1-CD1 3.64Å; F1374-L1378 HydrophobicContact CE1-CD2 4.4Å; F1374-L1378 HydrophobicContact CE1-CG 4.11Å; F1374-L1378 HydrophobicContact CE2-CD2 4.25Å; F1374-L1378 HydrophobicContact CE2-CG 4.5Å; F1374-L1378 HydrophobicContact CZ-CD1 4.08Å; F1374-L1378 HydrophobicContact CZ-CD2 3.99Å; F1374-L1378 HydrophobicContact CZ-CG 4.18Å; F1374-L1378 WeakPolarHBondContact O-CG 3.04Å; F1374-L1378 PolarHBondContact O-N 2.66Å; F1374-L1512 HydrophobicContact CE2-CD1 4.12Å; F1374-L1512 HydrophobicContact CZ-CD2 4.45Å; F1374-I1535 HydrophobicContact CE1-CG2 3.9Å; F1374-I1535 HydrophobicContact CZ-CG2 3.92Å; F1374-A1538 HydrophobicContact CE1-CB 4.49Å; F1374-A1538 HydrophobicContact CE2-CB 3.69Å; F1374-A1538 HydrophobicContact CZ-CB 3.52Å
1375	S	85.5	Confident	87.8	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-67.7	-42.6	-179.8	-64.4	0	0	0	0	113.2	R1371 K1373 L1377 L1378 D1379 Q1385 W1388	R1371-S1375 WeakPolarHBondContact O-CB 3.46Å; R1371-S1375 PolarHBondContact O-N 3.41Å; R1371-S1375 PolarHBondContact O-OG 2.8Å; K1373-S1375 VanDerWaalsContact C-N 3.28Å; K1373-S1375 PolarHBondContact O-N 2.82Å; S1375-L1377 PolarHBondContact O-N 2.74Å; S1375-L1378 PolarHBondContact O-N 3.4Å; S1375-D1379 VanDerWaalsContact O-CG 3.29Å; S1375-D1379 PolarHBondContact O-N 2.72Å; S1375-Q1385 VanDerWaalsContact CA-NE2 3.33Å; S1375-Q1385 PolarHBondContact OG-NE2 3.27Å; S1375-Q1385 VanDerWaalsContact OG-NE2 3.09Å; S1375-Q1385 PolarHBondContact OG-OE1 3.42Å; S1375-W1388 WeakPolarHBondContact OG-CZ2 3.5Å; S1375-W1388 PolarHBondContact OG-NE1 2.9Å; S1375-W1388 VanDerWaalsContact OG-NE1 3.13Å
1376	R	84.9	Confident	87.7	Confident	156 Å²	156	44.2 Å²	44.2	59%	0.589	24%	0.243	S	C	*	.	H	α-helix	trans	-61.1	-38.4	173.4	-73	-175.9	81.3	166.1	5.5	111.2	F1372 K1373 D1379 C1380	F1372-R1376 PolarHBondContact O-N 3.5Å; K1373-R1376 PolarHBondContact O-N 2.74Å; R1376-D1379 PolarHBondContact O-N 2.87Å; R1376-C1380 PolarHBondContact O-N 2.97Å; R1376-C1380 PolarHBondContact O-SG 3.4Å
1377	L	90.1	Very high	87.6	Confident	18 Å²	18	49.2 Å²	49.2	9%	0.094	26%	0.261	C	S	.	.	H	α-helix	trans	-59.7	-51.5	174.8	-177.8	155.9	0	0	0	110.8	K1373 F1374 S1375 D1379 C1380 I1381 L1512 E1515 L1516	K1373-L1377 PolarHBondContact O-N 3.34Å; F1374-L1377 WeakPolarHBondContact O-CB 3.34Å; F1374-L1377 PolarHBondContact O-N 2.82Å; S1375-L1377 PolarHBondContact O-N 2.74Å; L1377-D1379 VanDerWaalsContact C-N 3.34Å; L1377-D1379 PolarHBondContact O-N 3.02Å; L1377-C1380 WeakPolarHBondContact O-CB 3.49Å; L1377-C1380 PolarHBondContact O-N 2.78Å; L1377-C1380 VanDerWaalsContact O-N 3.16Å; L1377-I1381 HydrophobicContact CD2-CD1 3.83Å; L1377-I1381 WeakPolarHBondContact O-CG1 3.42Å; L1377-I1381 PolarHBondContact O-N 3.06Å; L1377-L1512 HydrophobicContact CD2-CD1 3.73Å; L1377-E1515 HydrophobicContact CD1-CG 3.9Å; L1377-E1515 HydrophobicContact CD2-CB 4.46Å; L1377-E1515 HydrophobicContact CD2-CG 3.75Å; L1377-E1515 HydrophobicContact CG-CG 3.63Å; L1377-L1516 HydrophobicContact CD1-CD2 3.47Å; L1377-L1516 VanDerWaalsContact CD1-CD2 3.47Å; L1377-L1516 HydrophobicContact CD1-CG 4.04Å
1378	L	91.6	Very high	87.4	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-59	-42.5	178.5	-66.4	-173.1	0	0	0	113	F1374 S1375 C1380 I1381 G1382 L1383 Q1385 L1512 I1535	F1374-L1378 HydrophobicContact CD1-CD1 4.05Å; F1374-L1378 HydrophobicContact CD1-CG 4.37Å; F1374-L1378 HydrophobicContact CE1-CD1 3.64Å; F1374-L1378 HydrophobicContact CE1-CD2 4.4Å; F1374-L1378 HydrophobicContact CE1-CG 4.11Å; F1374-L1378 HydrophobicContact CE2-CD2 4.25Å; F1374-L1378 HydrophobicContact CE2-CG 4.5Å; F1374-L1378 HydrophobicContact CZ-CD1 4.08Å; F1374-L1378 HydrophobicContact CZ-CD2 3.99Å; F1374-L1378 HydrophobicContact CZ-CG 4.18Å; F1374-L1378 WeakPolarHBondContact O-CG 3.04Å; F1374-L1378 PolarHBondContact O-N 2.66Å; S1375-L1378 PolarHBondContact O-N 3.4Å; L1378-C1380 VanDerWaalsContact C-N 3.33Å; L1378-C1380 PolarHBondContact O-N 2.73Å; L1378-I1381 HydrophobicContact CD2-CD1 4.38Å; L1378-I1381 WeakPolarHBondContact O-CG1 3.32Å; L1378-I1381 PolarHBondContact O-N 2.95Å; L1378-G1382 PolarHBondContact O-N 3Å; L1378-L1383 HydrophobicContact CD2-CB 4.16Å; L1378-L1383 HydrophobicContact CD2-CD1 4.34Å; L1378-L1383 PolarHBondContact O-N 3.11Å; L1378-Q1385 HydrophobicContact CD1-CB 3.93Å; L1378-Q1385 HydrophobicContact CD1-CG 4.13Å; L1378-L1512 HydrophobicContact CD2-CD1 3.91Å; L1378-I1535 HydrophobicContact CD1-CB 4.04Å; L1378-I1535 HydrophobicContact CD1-CD1 4.2Å; L1378-I1535 HydrophobicContact CD1-CG2 4.15Å; L1378-I1535 HydrophobicContact CD2-CD1 3.59Å
1379	D	86.4	Confident	86.9	Confident	109 Å²	109	53.9 Å²	53.9	58%	0.583	28%	0.276	S	S	*	.	H	α-helix	trans	-63.1	-38.6	177.6	-68.2	-22.3	0	0	0	111.6	S1375 R1376 L1377 G1382	S1375-D1379 VanDerWaalsContact O-CG 3.29Å; S1375-D1379 PolarHBondContact O-N 2.72Å; R1376-D1379 PolarHBondContact O-N 2.87Å; L1377-D1379 VanDerWaalsContact C-N 3.34Å; L1377-D1379 PolarHBondContact O-N 3.02Å; D1379-G1382 PolarHBondContact O-N 2.9Å
1380	C	84.3	Confident	86.5	Confident	106 Å²	106	56.6 Å²	56.6	72%	0.716	29%	0.289	S	S	*	.	H	α-helix	trans	-64.7	-39.2	177.5	-74.5	0	0	0	0	113	R1376 L1377 L1378	R1376-C1380 PolarHBondContact O-N 2.97Å; R1376-C1380 PolarHBondContact O-SG 3.4Å; L1377-C1380 WeakPolarHBondContact O-CB 3.49Å; L1377-C1380 PolarHBondContact O-N 2.78Å; L1377-C1380 VanDerWaalsContact O-N 3.16Å; L1378-C1380 VanDerWaalsContact C-N 3.33Å; L1378-C1380 PolarHBondContact O-N 2.73Å
1381	I	88.5	Confident	86	Confident	45 Å²	45	56.2 Å²	56.2	23%	0.231	29%	0.287	C	S	.	.	H	α-helix	trans	-90.6	2	179.7	62.3	178.9	0	0	0	113.7	L1377 L1378 L1383 L1512 E1515	L1377-I1381 HydrophobicContact CD2-CD1 3.83Å; L1377-I1381 WeakPolarHBondContact O-CG1 3.42Å; L1377-I1381 PolarHBondContact O-N 3.06Å; L1378-I1381 HydrophobicContact CD2-CD1 4.38Å; L1378-I1381 WeakPolarHBondContact O-CG1 3.32Å; L1378-I1381 PolarHBondContact O-N 2.95Å; I1381-L1383 VanDerWaalsContact C-N 3.34Å; I1381-L1383 HydrophobicContact CD1-CD1 3.41Å; I1381-L1383 VanDerWaalsContact CD1-CD1 3.41Å; I1381-L1383 HydrophobicContact CD1-CG 3.92Å; I1381-L1383 HydrophobicContact CG1-CB 4.23Å; I1381-L1383 HydrophobicContact CG1-CD1 3.94Å; I1381-L1383 HydrophobicContact CG1-CG 3.85Å; I1381-L1383 PolarHBondContact O-N 3.25Å; I1381-L1512 HydrophobicContact CD1-CD1 4.12Å; I1381-E1515 HydrophobicContact CD1-CB 4.28Å; I1381-E1515 HydrophobicContact CD1-CG 4.36Å; I1381-E1515 HydrophobicContact CG2-CB 4.08Å; I1381-E1515 HydrophobicContact CG2-CG 3.71Å; I1381-E1515 WeakPolarHBondContact CG2-OE2 3.44Å
1382	G	85.4	Confident	85.3	Confident	63 Å²	63	62.3 Å²	62.3	65%	0.649	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.5	22.4	176.8	0	0	0	0	0	114.7	L1378 D1379	L1378-G1382 PolarHBondContact O-N 3Å; D1379-G1382 PolarHBondContact O-N 2.9Å
1383	L	90.7	Very high	85	Confident	28 Å²	28	61.2 Å²	61.2	15%	0.147	32%	0.323	C	S	.	.			trans	-91.4	137.3	176.1	-65.4	-178.9	0	0	0	110.5	L1378 I1381 L1508 A1511 L1512 I1535	L1378-L1383 HydrophobicContact CD2-CB 4.16Å; L1378-L1383 HydrophobicContact CD2-CD1 4.34Å; L1378-L1383 PolarHBondContact O-N 3.11Å; I1381-L1383 VanDerWaalsContact C-N 3.34Å; I1381-L1383 HydrophobicContact CD1-CD1 3.41Å; I1381-L1383 VanDerWaalsContact CD1-CD1 3.41Å; I1381-L1383 HydrophobicContact CD1-CG 3.92Å; I1381-L1383 HydrophobicContact CG1-CB 4.23Å; I1381-L1383 HydrophobicContact CG1-CD1 3.94Å; I1381-L1383 HydrophobicContact CG1-CG 3.85Å; I1381-L1383 PolarHBondContact O-N 3.25Å; L1383-L1508 HydrophobicContact CD1-CG 4.1Å; L1383-L1508 HydrophobicContact CD2-CB 4.35Å; L1383-L1508 HydrophobicContact CD2-CD1 4.42Å; L1383-L1508 HydrophobicContact CD2-CG 3.97Å; L1383-A1511 HydrophobicContact CD1-CB 4.44Å; L1383-L1512 HydrophobicContact CD1-CB 4.3Å; L1383-I1535 HydrophobicContact CB-CD1 3.87Å; L1383-I1535 HydrophobicContact CD1-CD1 3.78Å; L1383-I1535 HydrophobicContact CG-CD1 4.4Å
1384	S	89.5	Confident	84.4	Confident	73 Å²	73	60.4 Å²	60.4	51%	0.51	32%	0.322	S	S	.	.			trans	-88.4	148.8	-175.4	-62.9	0	0	0	0	112.3	L1534 I1535	S1384-L1534 VanDerWaalsContact CB-CD2 3.44Å; S1384-L1534 CarbonylContact O-C 3.57Å; S1384-L1534 WeakPolarHBondContact O-CA 3.38Å; S1384-I1535 PolarHBondContact O-N 2.99Å
1385	Q	90.5	Very high	83.7	Confident	22 Å²	22	65.2 Å²	65.2	10%	0.103	35%	0.348	C	S	.	.			trans	-141.1	164.5	173.9	56.7	172.7	-21.7	0	0	110	S1375 L1378 I1535	S1375-Q1385 VanDerWaalsContact CA-NE2 3.33Å; S1375-Q1385 PolarHBondContact OG-NE2 3.27Å; S1375-Q1385 VanDerWaalsContact OG-NE2 3.09Å; S1375-Q1385 PolarHBondContact OG-OE1 3.42Å; L1378-Q1385 HydrophobicContact CD1-CB 3.93Å; L1378-Q1385 HydrophobicContact CD1-CG 4.13Å; Q1385-I1535 VanDerWaalsContact CB-O 3.31Å; Q1385-I1535 WeakPolarHBondContact CB-O 3.27Å
1386	P	89.4	Confident	83.3	Confident	18 Å²	18	67.3 Å²	67.3	12%	0.117	36%	0.362	C	S	.	.			trans	-56.7	143.7	172	-24.2	35.3	0	0	0	111.7	W1388 I1452 L1527 I1535	P1386-W1388 PolarHBondContact O-N 3.11Å; P1386-I1452 HydrophobicContact CB-CD1 4.47Å; P1386-I1452 HydrophobicContact CG-CD1 4.41Å; P1386-L1527 HydrophobicContact CG-CD1 4.19Å; P1386-I1535 WeakPolarHBondContact CD-O 3.49Å
1387	R	88.2	Confident	83.1	Confident	125 Å²	125	59.9 Å²	59.9	47%	0.472	33%	0.334	S	S	.	.			trans	-57.8	133.9	176.7	-62.7	-166.9	73.4	-161.8	-3.1	109.5	E1403 V1404 S1449 Q1450	R1387-E1403 IonicContact CZ-OE1 3.53Å; R1387-E1403 IonicContact NH1-OE1 3.26Å; R1387-E1403 PolarHBondContact NH1-OE1 2.84Å; R1387-E1403 IonicContact NH2-OE1 2.86Å; R1387-E1403 PolarHBondContact NH2-OE1 2.84Å; R1387-V1404 HydrophobicContact CB-CG1 4.15Å; R1387-S1449 CarbonylContact O-C 3.57Å; R1387-S1449 WeakPolarHBondContact O-CA 3.47Å; R1387-Q1450 HydrophobicContact CB-CB 4.25Å; R1387-Q1450 PolarHBondContact O-N 3.24Å
1388	W	87.4	Confident	82.6	Confident	57 Å²	57	61.8 Å²	61.8	22%	0.216	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	162.1	-176.5	71.2	-80.7	0	0	0	111.3	F1372 S1375 P1386 E1390 V1447 I1448 S1449	F1372-W1388 HydrophobicContact CD2-CH2 4.29Å; S1375-W1388 WeakPolarHBondContact OG-CZ2 3.5Å; S1375-W1388 PolarHBondContact OG-NE1 2.9Å; S1375-W1388 VanDerWaalsContact OG-NE1 3.13Å; P1386-W1388 PolarHBondContact O-N 3.11Å; W1388-E1390 HydrophobicContact CZ3-CB 4.05Å; W1388-V1447 HydrophobicContact CE3-CG1 3.77Å; W1388-V1447 HydrophobicContact CZ3-CG1 4.46Å; W1388-I1448 CarbonylContact C-O 3.57Å; W1388-I1448 WeakPolarHBondContact CA-O 3.42Å; W1388-I1448 WeakPolarHBondContact CB-O 3.48Å; W1388-S1449 WeakPolarHBondContact CB-OG 3.14Å
1389	K	79.9	Confident	82.2	Confident	98 Å²	98	64.4 Å²	64.4	43%	0.426	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	133.9	172.9	-162.1	168.3	176.6	-175.3	0	110.2	L1391 F1400 I1448	K1389-L1391 HydrophobicContact CB-CD1 4.16Å; K1389-L1391 HydrophobicContact CB-CD2 4.42Å; K1389-L1391 HydrophobicContact CB-CG 4.13Å; K1389-L1391 HydrophobicContact CD-CD2 3.85Å; K1389-L1391 HydrophobicContact CD-CG 4.46Å; K1389-L1391 HydrophobicContact CG-CD1 4.5Å; K1389-L1391 HydrophobicContact CG-CD2 3.87Å; K1389-L1391 HydrophobicContact CG-CG 4.01Å; K1389-F1400 HydrophobicContact CB-CD1 4.2Å; K1389-F1400 HydrophobicContact CB-CD2 3.73Å; K1389-F1400 HydrophobicContact CB-CE1 4.31Å; K1389-F1400 HydrophobicContact CB-CE2 3.85Å; K1389-F1400 HydrophobicContact CB-CG 3.91Å; K1389-F1400 HydrophobicContact CB-CZ 4.15Å; K1389-F1400 HydrophobicContact CD-CB 4.32Å; K1389-F1400 HydrophobicContact CD-CD2 3.95Å; K1389-F1400 HydrophobicContact CD-CG 4.28Å; K1389-I1448 PolarHBondContact N-O 2.82Å; K1389-I1448 PolarHBondContact O-N 2.76Å
1390	E	78.9	Confident	82.1	Confident	71 Å²	71	59.5 Å²	59.5	33%	0.332	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	129.7	168.3	-173.6	-179.2	154.2	0	0	109.1	W1388 P1445 V1447	W1388-E1390 HydrophobicContact CZ3-CB 4.05Å; E1390-P1445 HydrophobicContact CG-CB 4.18Å; E1390-P1445 HydrophobicContact CG-CG 4.21Å; E1390-P1445 WeakPolarHBondContact OE1-CG 3.23Å; E1390-V1447 HydrophobicContact CB-CG2 4.31Å; E1390-V1447 HydrophobicContact CG-CG2 4.25Å
1391	L	73.1	Confident	82.1	Confident	13 Å²	13	54.4 Å²	54.4	7%	0.068	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	129.2	-165.2	-67.2	159.4	0	0	0	110	K1389 S1396 A1397 F1400 V1446 I1448	K1389-L1391 HydrophobicContact CB-CD1 4.16Å; K1389-L1391 HydrophobicContact CB-CD2 4.42Å; K1389-L1391 HydrophobicContact CB-CG 4.13Å; K1389-L1391 HydrophobicContact CD-CD2 3.85Å; K1389-L1391 HydrophobicContact CD-CG 4.46Å; K1389-L1391 HydrophobicContact CG-CD1 4.5Å; K1389-L1391 HydrophobicContact CG-CD2 3.87Å; K1389-L1391 HydrophobicContact CG-CG 4.01Å; L1391-S1396 VanDerWaalsContact CD2-CB 3.44Å; L1391-A1397 HydrophobicContact CD1-CB 3.91Å; L1391-F1400 HydrophobicContact CD1-CB 4.21Å; L1391-F1400 HydrophobicContact CD1-CD1 4.36Å; L1391-F1400 HydrophobicContact CD1-CG 4.49Å; L1391-V1446 PolarHBondContact N-O 3.37Å; L1391-I1448 HydrophobicContact CD1-CB 4.02Å; L1391-I1448 HydrophobicContact CD1-CD1 3.65Å; L1391-I1448 HydrophobicContact CD1-CG1 3.87Å
1392	T	70	Confident	81.9	Confident	131 Å²	131	58.5 Å²	58.5	80%	0.804	32%	0.321	S	S	*	.	S	Bend	trans	-103.6	-15.2	-178.3	52.3	0	0	0	0	113.2
1393	D	73.9	Confident	81.8	Confident	69 Å²	69	60.9 Å²	60.9	37%	0.369	32%	0.315	S	S	.	.	S	Bend	trans	-127.3	157.5	178.6	79.2	87.9	0	0	0	112.8	D1395 S1396 A1397	D1393-D1395 PolarHBondContact OD1-N 2.87Å; D1393-S1396 PolarHBondContact OD1-N 3.01Å; D1393-S1396 PolarHBondContact OD1-OG 3.17Å; D1393-S1396 WeakPolarHBondContact OD2-CB 3.2Å; D1393-S1396 PolarHBondContact OD2-OG 3.46Å; D1393-A1397 PolarHBondContact O-N 3.32Å
1394	I	74.7	Confident	81.6	Confident	67 Å²	67	60.3 Å²	60.3	34%	0.344	31%	0.313	S	S	.	.	H	α-helix	trans	-70.9	-33.1	-173.9	-64.6	175	0	0	0	111.9	A1397 K1398 I1431 L1434	I1394-A1397 WeakPolarHBondContact O-CB 3.4Å; I1394-A1397 PolarHBondContact O-N 2.77Å; I1394-K1398 WeakPolarHBondContact O-CG 3.28Å; I1394-K1398 PolarHBondContact O-N 3.17Å; I1394-I1431 HydrophobicContact CG2-CG1 4.07Å; I1394-L1434 HydrophobicContact CG1-CD1 4.29Å
1395	D	75.7	Confident	81.2	Confident	100 Å²	100	58.4 Å²	58.4	54%	0.535	30%	0.304	S	S	.	.	H	α-helix	trans	-78	-39.9	-173.5	-68	-36.1	0	0	0	111.5	D1393 A1397 K1398 A1399	D1393-D1395 PolarHBondContact OD1-N 2.87Å; D1395-A1397 PolarHBondContact O-N 2.89Å; D1395-K1398 PolarHBondContact O-N 2.94Å; D1395-K1398 IonicContact OD1-NZ 2.89Å; D1395-K1398 PolarHBondContact OD1-NZ 3.27Å; D1395-A1399 PolarHBondContact O-N 2.9Å
1396	S	76.8	Confident	80.8	Confident	44 Å²	44	60.2 Å²	60.2	31%	0.308	31%	0.311	S	S	.	.	H	α-helix	trans	-58.9	-35	169	-62.1	0	0	0	0	111.7	L1391 D1393 F1400	L1391-S1396 VanDerWaalsContact CD2-CB 3.44Å; D1393-S1396 PolarHBondContact OD1-N 3.01Å; D1393-S1396 PolarHBondContact OD1-OG 3.17Å; D1393-S1396 WeakPolarHBondContact OD2-CB 3.2Å; D1393-S1396 PolarHBondContact OD2-OG 3.46Å; S1396-F1400 PolarHBondContact O-N 3.34Å; S1396-F1400 VanDerWaalsContact O-N 3.11Å
1397	A	79.4	Confident	80.7	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-67.1	-43	174.7	0	0	0	0	0	113.3	L1391 D1393 I1394 D1395 F1400 C1401 L1430 L1434 I1448	L1391-A1397 HydrophobicContact CD1-CB 3.91Å; D1393-A1397 PolarHBondContact O-N 3.32Å; I1394-A1397 WeakPolarHBondContact O-CB 3.4Å; I1394-A1397 PolarHBondContact O-N 2.77Å; D1395-A1397 PolarHBondContact O-N 2.89Å; A1397-F1400 PolarHBondContact O-N 3.41Å; A1397-C1401 PolarHBondContact O-N 3.19Å; A1397-C1401 PolarHBondContact O-SG 2.92Å; A1397-C1401 VanDerWaalsContact O-SG 3.37Å; A1397-L1430 HydrophobicContact CB-CD2 4.31Å; A1397-L1434 HydrophobicContact CB-CD1 3.72Å; A1397-I1448 HydrophobicContact CB-CD1 3.45Å; A1397-I1448 VanDerWaalsContact CB-CD1 3.45Å
1398	K	81.1	Confident	80.6	Confident	59 Å²	59	53.7 Å²	53.7	26%	0.257	29%	0.285	S	S	.	.	H	α-helix	trans	-60.2	-50.5	173.5	-66.2	173.4	-171.5	149.4	0	111.2	I1394 D1395 F1400 C1401 E1402 L1430	I1394-K1398 WeakPolarHBondContact O-CG 3.28Å; I1394-K1398 PolarHBondContact O-N 3.17Å; D1395-K1398 PolarHBondContact O-N 2.94Å; D1395-K1398 IonicContact OD1-NZ 2.89Å; D1395-K1398 PolarHBondContact OD1-NZ 3.27Å; K1398-F1400 VanDerWaalsContact C-N 3.28Å; K1398-F1400 PolarHBondContact O-N 2.98Å; K1398-C1401 PolarHBondContact O-N 3.4Å; K1398-E1402 WeakPolarHBondContact O-CG 3.46Å; K1398-E1402 PolarHBondContact O-N 3.49Å; K1398-L1430 HydrophobicContact CG-CD2 4.46Å
1399	A	81.5	Confident	80.6	Confident	54 Å²	54	52 Å²	52	45%	0.446	28%	0.279	S	S	.	.	H	α-helix	trans	-57.8	-41.4	-178.7	0	0	0	0	0	112	D1395 E1402 E1403	D1395-A1399 PolarHBondContact O-N 2.9Å; A1399-E1402 PolarHBondContact O-N 3.44Å; A1399-E1403 WeakPolarHBondContact O-CB 3.43Å; A1399-E1403 PolarHBondContact O-N 2.76Å
1400	F	84.6	Confident	80.7	Confident	6 Å²	6	47.4 Å²	47.4	3%	0.026	26%	0.26	C	S	.	.	H	α-helix	trans	-64.8	-44.6	174.9	179.1	-107.8	0	0	0	112.3	K1389 L1391 S1396 A1397 K1398 E1402 E1403 V1404 I1448	K1389-F1400 HydrophobicContact CB-CD1 4.2Å; K1389-F1400 HydrophobicContact CB-CD2 3.73Å; K1389-F1400 HydrophobicContact CB-CE1 4.31Å; K1389-F1400 HydrophobicContact CB-CE2 3.85Å; K1389-F1400 HydrophobicContact CB-CG 3.91Å; K1389-F1400 HydrophobicContact CB-CZ 4.15Å; K1389-F1400 HydrophobicContact CD-CB 4.32Å; K1389-F1400 HydrophobicContact CD-CD2 3.95Å; K1389-F1400 HydrophobicContact CD-CG 4.28Å; L1391-F1400 HydrophobicContact CD1-CB 4.21Å; L1391-F1400 HydrophobicContact CD1-CD1 4.36Å; L1391-F1400 HydrophobicContact CD1-CG 4.49Å; S1396-F1400 PolarHBondContact O-N 3.34Å; S1396-F1400 VanDerWaalsContact O-N 3.11Å; A1397-F1400 PolarHBondContact O-N 3.41Å; K1398-F1400 VanDerWaalsContact C-N 3.28Å; K1398-F1400 PolarHBondContact O-N 2.98Å; F1400-E1402 VanDerWaalsContact C-N 3.34Å; F1400-E1402 PolarHBondContact O-N 2.95Å; F1400-E1403 WeakPolarHBondContact O-CB 3.4Å; F1400-E1403 PolarHBondContact O-N 3.39Å; F1400-V1404 HydrophobicContact CD2-CG1 4.14Å; F1400-V1404 HydrophobicContact CE1-CG1 4.29Å; F1400-V1404 HydrophobicContact CE1-CG2 4.22Å; F1400-V1404 HydrophobicContact CE2-CG1 3.58Å; F1400-V1404 HydrophobicContact CZ-CG1 3.66Å; F1400-V1404 HydrophobicContact CZ-CG2 4.38Å; F1400-V1404 WeakPolarHBondContact O-CG2 3.33Å; F1400-V1404 PolarHBondContact O-N 3.17Å; F1400-I1448 HydrophobicContact CD1-CB 4.02Å; F1400-I1448 HydrophobicContact CD1-CG2 3.82Å; F1400-I1448 HydrophobicContact CE1-CB 4.14Å; F1400-I1448 HydrophobicContact CE1-CG2 3.89Å; F1400-I1448 WeakPolarHBondContact CE1-O 3.41Å
1401	C	85	Confident	80.7	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-64.1	-35.6	176.8	-72.7	0	0	0	0	113.3	A1397 K1398 G1405 Y1406 C1408 L1430	A1397-C1401 PolarHBondContact O-N 3.19Å; A1397-C1401 PolarHBondContact O-SG 2.92Å; A1397-C1401 VanDerWaalsContact O-SG 3.37Å; K1398-C1401 PolarHBondContact O-N 3.4Å; C1401-G1405 CarbonylContact O-C 3.52Å; C1401-G1405 VanDerWaalsContact O-CA 3.25Å; C1401-G1405 WeakPolarHBondContact O-CA 3.34Å; C1401-G1405 PolarHBondContact O-N 2.9Å; C1401-Y1406 HydrophobicContact CB-CE1 3.94Å; C1401-Y1406 HydrophobicContact CB-CE2 3.93Å; C1401-Y1406 WeakPolarHBondContact CB-OH 3.49Å; C1401-C1408 PolarHBondContact SG-SG 3.29Å; C1401-L1430 HydrophobicContact CB-CD2 4.18Å
1402	E	83.5	Confident	80.7	Confident	131 Å²	131	45.3 Å²	45.3	61%	0.612	25%	0.251	S	S	*	.	H	α-helix	trans	-65.7	-40.3	172.5	-73.3	-178.4	158.7	0	0	111.8	K1398 A1399 F1400 H1427	K1398-E1402 WeakPolarHBondContact O-CG 3.46Å; K1398-E1402 PolarHBondContact O-N 3.49Å; A1399-E1402 PolarHBondContact O-N 3.44Å; F1400-E1402 VanDerWaalsContact C-N 3.34Å; F1400-E1402 PolarHBondContact O-N 2.95Å; E1402-H1427 VanDerWaalsContact CG-CE1 3.5Å; E1402-H1427 WeakPolarHBondContact CG-CE1 3.38Å; E1402-H1427 WeakPolarHBondContact CG-NE2 3.39Å; E1402-H1427 IonicContact OE1-CE1 2.96Å; E1402-H1427 IonicContact OE1-NE2 3.96Å; E1402-H1427 PolarHBondContact OE1-NE2 2.98Å
1403	E	84.9	Confident	80.6	Confident	113 Å²	113	39.4 Å²	39.4	53%	0.528	22%	0.215	S	C	.	.	H	α-helix	trans	-65.6	-47.6	178.5	-168.8	-160.2	149.1	0	0	112.5	R1387 A1399 F1400	R1387-E1403 IonicContact CZ-OE1 3.53Å; R1387-E1403 IonicContact NH1-OE1 3.26Å; R1387-E1403 PolarHBondContact NH1-OE1 2.84Å; R1387-E1403 IonicContact NH2-OE1 2.86Å; R1387-E1403 PolarHBondContact NH2-OE1 2.84Å; A1399-E1403 WeakPolarHBondContact O-CB 3.43Å; A1399-E1403 PolarHBondContact O-N 2.76Å; F1400-E1403 WeakPolarHBondContact O-CB 3.4Å; F1400-E1403 PolarHBondContact O-N 3.39Å
1404	V	85.2	Confident	80.4	Confident	16 Å²	16	39 Å²	39	10%	0.097	21%	0.209	C	C	.	.	H	α-helix	trans	-86.9	-17.3	-176.5	-55.8	0	0	0	0	113.7	R1387 F1400 Q1450	R1387-V1404 HydrophobicContact CB-CG1 4.15Å; F1400-V1404 HydrophobicContact CD2-CG1 4.14Å; F1400-V1404 HydrophobicContact CE1-CG1 4.29Å; F1400-V1404 HydrophobicContact CE1-CG2 4.22Å; F1400-V1404 HydrophobicContact CE2-CG1 3.58Å; F1400-V1404 HydrophobicContact CZ-CG1 3.66Å; F1400-V1404 HydrophobicContact CZ-CG2 4.38Å; F1400-V1404 WeakPolarHBondContact O-CG2 3.33Å; F1400-V1404 PolarHBondContact O-N 3.17Å; V1404-Q1450 HydrophobicContact CB-CB 4.18Å; V1404-Q1450 HydrophobicContact CB-CG 4.13Å; V1404-Q1450 HydrophobicContact CG2-CB 4.2Å; V1404-Q1450 HydrophobicContact CG2-CG 4.34Å; V1404-Q1450 PolarHBondContact O-NE2 3.07Å
1405	G	82.4	Confident	79.5	Confident	32 Å²	32	36.2 Å²	36.2	33%	0.33	20%	0.195	S	C	.	.			trans	77	150.5	-174.4	0	0	0	0	0	113.7	C1401 C1408	C1401-G1405 CarbonylContact O-C 3.52Å; C1401-G1405 VanDerWaalsContact O-CA 3.25Å; C1401-G1405 WeakPolarHBondContact O-CA 3.34Å; C1401-G1405 PolarHBondContact O-N 2.9Å; G1405-C1408 PolarHBondContact O-SG 3.2Å; G1405-C1408 VanDerWaalsContact O-SG 3.33Å
1406	Y	81.1	Confident	78.3	Confident	61 Å²	61	34.4 Å²	34.4	24%	0.239	19%	0.185	C	C	.	.	S	Bend	trans	-80.2	150.2	174.9	-73.9	-79.3	0	0	0	112.7	C1401 C1408 A1424 N1425 D1426 H1427 L1430	C1401-Y1406 HydrophobicContact CB-CE1 3.94Å; C1401-Y1406 HydrophobicContact CB-CE2 3.93Å; C1401-Y1406 WeakPolarHBondContact CB-OH 3.49Å; Y1406-C1408 HydrophobicContact CD1-CB 4.43Å; Y1406-A1424 HydrophobicContact CD1-CB 4.5Å; Y1406-A1424 WeakPolarHBondContact CD1-O 3.49Å; Y1406-A1424 HydrophobicContact CE1-CB 4.07Å; Y1406-N1425 WeakPolarHBondContact CB-O 3.47Å; Y1406-D1426 WeakPolarHBondContact CE1-O 3.12Å; Y1406-H1427 AromaticContact CE2-CE1 3.63Å; Y1406-H1427 AromaticContact CE2-ND1 3.56Å; Y1406-H1427 WeakPolarHBondContact OH-CA 3.43Å; Y1406-L1430 WeakPolarHBondContact OH-CD2 3.28Å
1407	P	86.4	Confident	77.2	Confident	6 Å²	6	34.8 Å²	34.8	4%	0.039	19%	0.187	C	C	.	.			cis	-76.2	158.5	3.3	27.4	-30.9	0	0	0	114.6	V1423 A1424 F1451 L1453	P1407-V1423 HydrophobicContact CB-CG1 3.74Å; P1407-A1424 CarbonylContact C-O 3.59Å; P1407-A1424 VanDerWaalsContact CA-O 3.25Å; P1407-A1424 WeakPolarHBondContact CA-O 3.31Å; P1407-A1424 WeakPolarHBondContact CB-O 3.46Å; P1407-F1451 HydrophobicContact CB-CB 4.15Å; P1407-F1451 HydrophobicContact CB-CD1 4.41Å; P1407-F1451 HydrophobicContact CB-CG 4.42Å; P1407-F1451 HydrophobicContact CG-CB 4.03Å; P1407-F1451 HydrophobicContact CG-CD1 3.7Å; P1407-F1451 HydrophobicContact CG-CG 4.14Å; P1407-F1451 VanDerWaalsContact O-CB 3.27Å; P1407-F1451 WeakPolarHBondContact O-CB 3.46Å; P1407-F1451 PolarHBondContact O-N 2.8Å; P1407-L1453 HydrophobicContact CG-CD1 4.28Å; P1407-L1453 HydrophobicContact CG-CD2 4.05Å; P1407-L1453 HydrophobicContact CG-CG 4.13Å
1408	C	87.5	Confident	76	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	144.1	175.5	-54.5	0	0	0	0	110.3	C1401 G1405 Y1406 V1423 A1424 I1448 S1449	C1401-C1408 PolarHBondContact SG-SG 3.29Å; G1405-C1408 PolarHBondContact O-SG 3.2Å; G1405-C1408 VanDerWaalsContact O-SG 3.33Å; Y1406-C1408 HydrophobicContact CD1-CB 4.43Å; C1408-V1423 CarbonylContact O-C 3.57Å; C1408-V1423 WeakPolarHBondContact O-CA 3.27Å; C1408-A1424 PolarHBondContact N-O 3.42Å; C1408-A1424 PolarHBondContact O-N 2.83Å; C1408-I1448 HydrophobicContact CB-CG2 3.92Å; C1408-S1449 CarbonylContact C-O 3.27Å; C1408-S1449 WeakPolarHBondContact CA-O 3.43Å
1409	L	86.1	Confident	75	Confident	20 Å²	20	34.5 Å²	34.5	11%	0.105	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	125.1	178.3	-178.7	65.2	0	0	0	110	M1421 V1423 I1448 S1449 F1451 V1629	L1409-M1421 HydrophobicContact CD1-CE 3.85Å; L1409-M1421 HydrophobicContact CD2-CE 3.67Å; L1409-M1421 HydrophobicContact CG-CE 4.09Å; L1409-V1423 HydrophobicContact CD1-CG2 4.09Å; L1409-I1448 CarbonylContact O-C 3.52Å; L1409-I1448 VanDerWaalsContact O-CA 3.28Å; L1409-I1448 WeakPolarHBondContact O-CA 3.19Å; L1409-S1449 PolarHBondContact N-O 3.44Å; L1409-S1449 PolarHBondContact O-N 3.17Å; L1409-F1451 HydrophobicContact CB-CD2 4.41Å; L1409-V1629 HydrophobicContact CD1-CB 4.35Å; L1409-V1629 HydrophobicContact CD1-CG1 4.08Å; L1409-V1629 HydrophobicContact CD1-CG2 4.03Å
1410	V	82	Confident	74.1	Confident	2 Å²	2	33.4 Å²	33.4	1%	0.012	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	125.1	175.9	-174.6	0	0	0	0	108.1	M1421 N1422 A1424 L1430 F1433 L1434 V1446	V1410-M1421 CarbonylContact O-C 3.51Å; V1410-M1421 WeakPolarHBondContact O-CA 3.42Å; V1410-N1422 PolarHBondContact N-O 3.43Å; V1410-N1422 PolarHBondContact O-N 2.83Å; V1410-A1424 HydrophobicContact CG2-CB 4.28Å; V1410-L1430 HydrophobicContact CG2-CD1 3.66Å; V1410-F1433 HydrophobicContact CG1-CB 4.49Å; V1410-L1434 HydrophobicContact CG1-CD2 4.14Å; V1410-V1446 HydrophobicContact CG1-CG1 3.45Å; V1410-V1446 VanDerWaalsContact CG1-CG1 3.45Å
1411	R	79.8	Confident	73.7	Confident	15 Å²	15	34.4 Å²	34.4	6%	0.057	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	162.2	-178.5	61.1	175.2	174.7	172.1	-3.4	113.2	M1421 V1447	R1411-M1421 HydrophobicContact CB-CB 4.4Å; R1411-M1421 HydrophobicContact CB-CE 4.21Å; R1411-M1421 HydrophobicContact CB-CG 3.64Å; R1411-M1421 HydrophobicContact CB-SD 4.22Å; R1411-V1447 PolarHBondContact N-O 2.87Å; R1411-V1447 PolarHBondContact O-N 2.81Å
1412	P	72.5	Confident	73.3	Confident	26 Å²	26	36.7 Å²	36.7	17%	0.169	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	157.5	171.6	-21.6	33.7	0	0	0	113.2	Y1414 L1416 A1420	P1412-Y1414 VanDerWaalsContact C-N 3.32Å; P1412-Y1414 PolarHBondContact O-N 3.4Å; P1412-L1416 HydrophobicContact CB-CD1 4.25Å; P1412-A1420 HydrophobicContact CG-CB 4.05Å
1413	S	69	Low	73.2	Confident	6 Å²	6	30.7 Å²	30.7	4%	0.042	18%	0.178	C	C	.	.	S	Bend	trans	-69.8	-22.1	177.7	-174.7	0	0	0	0	115.1	R1371 P1445	R1371-S1413 WeakPolarHBondContact CB-O 3.45Å; R1371-S1413 VanDerWaalsContact CG-O 3.26Å; R1371-S1413 WeakPolarHBondContact CG-O 3.41Å; R1371-S1413 PolarHBondContact N-O 3.44Å; S1413-P1445 VanDerWaalsContact CB-O 3.28Å; S1413-P1445 WeakPolarHBondContact CB-O 3.38Å; S1413-P1445 PolarHBondContact N-O 2.85Å; S1413-P1445 VanDerWaalsContact N-O 3.09Å
1414	Y	68.5	Low	73	Confident	61 Å²	61	25.3 Å²	25.3	24%	0.239	15%	0.152	C	C	.	.	B	Isolated β-bridge	trans	-100.2	142.3	172.2	-85.2	-93.9	0	0	0	109.7	D1366 E1369 N1370 P1412 L1416 H1444	D1366-Y1414 PolarHBondContact OD1-OH 3.35Å; D1366-Y1414 VanDerWaalsContact OD1-OH 3.13Å; E1369-Y1414 HydrophobicContact CB-CD1 4.36Å; N1370-Y1414 HydrophobicContact CB-CE1 3.98Å; N1370-Y1414 PolarHBondContact ND2-OH 3.08Å; N1370-Y1414 VanDerWaalsContact ND2-OH 3.14Å; P1412-Y1414 VanDerWaalsContact C-N 3.32Å; P1412-Y1414 PolarHBondContact O-N 3.4Å; Y1414-L1416 PolarHBondContact O-N 3.48Å; Y1414-H1444 AromaticContact CD2-CE1 3.83Å; Y1414-H1444 AromaticContact CD2-ND1 3.71Å
1415	V	55.6	Low	72.6	Confident	9 Å²	9	26.3 Å²	26.3	6%	0.055	16%	0.157	C	C	.	.			trans	-71.4	93.4	177.3	179.3	0	0	0	0	109.6	E1369 E1537	E1369-V1415 WeakPolarHBondContact O-CG2 3.5Å; E1369-V1415 PolarHBondContact O-N 3.13Å; E1369-V1415 VanDerWaalsContact O-N 3.08Å; V1415-E1537 WeakPolarHBondContact CG1-OE2 3.44Å
1416	L	52.3	Low	72.4	Confident	61 Å²	61	26.5 Å²	26.5	32%	0.319	15%	0.15	S	C	.	.			trans	-105.1	56.1	-173.9	-68	171.7	0	0	0	112.9	P1412 Y1414 G1418 A1419	P1412-L1416 HydrophobicContact CB-CD1 4.25Å; Y1414-L1416 PolarHBondContact O-N 3.48Å; L1416-G1418 PolarHBondContact O-N 3.38Å; L1416-A1419 WeakPolarHBondContact O-CB 3.3Å; L1416-A1419 PolarHBondContact O-N 3.5Å
1417	S	53.9	Low	72.3	Confident	52 Å²	52	26.4 Å²	26.4	36%	0.364	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.5	31.6	173.2	-49.8	0	0	0	0	114.9	A1419	S1417-A1419 PolarHBondContact O-N 3.1Å
1418	G	53.1	Low	71.7	Confident	8 Å²	8	31.4 Å²	31.4	8%	0.082	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	83.1	-3	-179	0	0	0	0	0	116.4	L1416 M1421	L1416-G1418 PolarHBondContact O-N 3.38Å; G1418-M1421 WeakPolarHBondContact O-CG 3.44Å
1419	A	59.3	Low	71	Confident	46 Å²	46	32.1 Å²	32.1	38%	0.38	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	139.3	-179.2	0	0	0	0	0	111.9	L1416 S1417 M1421	L1416-A1419 WeakPolarHBondContact O-CB 3.3Å; L1416-A1419 PolarHBondContact O-N 3.5Å; S1417-A1419 PolarHBondContact O-N 3.1Å; A1419-M1421 VanDerWaalsContact C-N 3.27Å; A1419-M1421 PolarHBondContact O-N 2.71Å
1420	A	63	Low	70.7	Confident	30 Å²	30	31.1 Å²	31.1	25%	0.248	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.3	21.9	179.8	0	0	0	0	0	116	P1412 I1440	P1412-A1420 HydrophobicContact CG-CB 4.05Å; A1420-I1440 HydrophobicContact CB-CD1 4.26Å
1421	M	76.8	Confident	70.4	Confident	27 Å²	27	33.8 Å²	33.8	13%	0.133	19%	0.19	C	C	.	.			trans	-86.6	132.2	174.9	-61.9	-170.2	49.3	0	0	112.2	L1409 V1410 R1411 G1418 A1419 V1629	L1409-M1421 HydrophobicContact CD1-CE 3.85Å; L1409-M1421 HydrophobicContact CD2-CE 3.67Å; L1409-M1421 HydrophobicContact CG-CE 4.09Å; V1410-M1421 CarbonylContact O-C 3.51Å; V1410-M1421 WeakPolarHBondContact O-CA 3.42Å; R1411-M1421 HydrophobicContact CB-CB 4.4Å; R1411-M1421 HydrophobicContact CB-CE 4.21Å; R1411-M1421 HydrophobicContact CB-CG 3.64Å; R1411-M1421 HydrophobicContact CB-SD 4.22Å; G1418-M1421 WeakPolarHBondContact O-CG 3.44Å; A1419-M1421 VanDerWaalsContact C-N 3.27Å; A1419-M1421 PolarHBondContact O-N 2.71Å; M1421-V1629 HydrophobicContact CB-CG2 3.86Å
1422	N	77	Confident	70	Confident	49 Å²	49	37.3 Å²	37.3	26%	0.262	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	144.9	-179.9	-73.2	-80.3	0	0	0	112.5	V1410 F1433	V1410-N1422 PolarHBondContact N-O 3.43Å; V1410-N1422 PolarHBondContact O-N 2.83Å; N1422-F1433 HydrophobicContact CB-CB 4.22Å; N1422-F1433 HydrophobicContact CB-CD1 3.76Å; N1422-F1433 HydrophobicContact CB-CD2 3.6Å; N1422-F1433 HydrophobicContact CB-CE1 3.95Å; N1422-F1433 HydrophobicContact CB-CE2 3.78Å; N1422-F1433 HydrophobicContact CB-CG 3.6Å; N1422-F1433 HydrophobicContact CB-CZ 3.96Å; N1422-F1433 WeakPolarHBondContact OD1-CE1 3.41Å
1423	V	80.7	Confident	70.1	Confident	5 Å²	5	37.5 Å²	37.5	3%	0.03	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	104.9	176.3	-176.3	0	0	0	0	109.9	P1407 C1408 L1409 N1425 F1451 V1629	P1407-V1423 HydrophobicContact CB-CG1 3.74Å; C1408-V1423 CarbonylContact O-C 3.57Å; C1408-V1423 WeakPolarHBondContact O-CA 3.27Å; L1409-V1423 HydrophobicContact CD1-CG2 4.09Å; V1423-N1425 PolarHBondContact O-ND2 3Å; V1423-N1425 VanDerWaalsContact O-ND2 3.17Å; V1423-F1451 HydrophobicContact CG1-CD2 4.03Å; V1423-F1451 HydrophobicContact CG1-CE2 4.27Å; V1423-F1451 HydrophobicContact CG1-CG 4.27Å; V1423-F1451 HydrophobicContact CG2-CD2 3.89Å; V1423-F1451 HydrophobicContact CG2-CE2 3.67Å; V1423-F1451 HydrophobicContact CG2-CZ 4.49Å; V1423-V1629 HydrophobicContact CG2-CG1 3.77Å; V1423-V1629 HydrophobicContact CG2-CG2 4.05Å
1424	A	80.8	Confident	70.3	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	124.5	172	0	0	0	0	0	109.6	Y1406 P1407 C1408 V1410 Q1429 L1430 F1433	Y1406-A1424 HydrophobicContact CD1-CB 4.5Å; Y1406-A1424 WeakPolarHBondContact CD1-O 3.49Å; Y1406-A1424 HydrophobicContact CE1-CB 4.07Å; P1407-A1424 CarbonylContact C-O 3.59Å; P1407-A1424 VanDerWaalsContact CA-O 3.25Å; P1407-A1424 WeakPolarHBondContact CA-O 3.31Å; P1407-A1424 WeakPolarHBondContact CB-O 3.46Å; C1408-A1424 PolarHBondContact N-O 3.42Å; C1408-A1424 PolarHBondContact O-N 2.83Å; V1410-A1424 HydrophobicContact CG2-CB 4.28Å; A1424-Q1429 HydrophobicContact CB-CB 4.38Å; A1424-L1430 HydrophobicContact CB-CB 3.93Å; A1424-L1430 HydrophobicContact CB-CD1 4.32Å; A1424-F1433 HydrophobicContact CB-CD2 4.18Å; A1424-F1433 HydrophobicContact CB-CE2 4.38Å
1425	N	77.5	Confident	70.2	Confident	36 Å²	36	38.9 Å²	38.9	19%	0.193	23%	0.226	C	C	.	.			trans	-102	-13.6	177.3	-68.3	-91.8	0	0	0	113.1	Y1406 V1423 Q1429 S1768	Y1406-N1425 WeakPolarHBondContact CB-O 3.47Å; V1423-N1425 PolarHBondContact O-ND2 3Å; V1423-N1425 VanDerWaalsContact O-ND2 3.17Å; N1425-Q1429 VanDerWaalsContact N-OE1 3.15Å; N1425-Q1429 PolarHBondContact ND2-OE1 2.83Å; N1425-S1768 WeakPolarHBondContact ND2-CB 3.43Å; N1425-S1768 PolarHBondContact ND2-OG 3.07Å
1426	D	77.9	Confident	70.6	Confident	36 Å²	36	40.8 Å²	40.8	19%	0.193	24%	0.242	C	C	.	.	S	Bend	trans	-153.5	171.5	-177.7	55.6	43.1	0	0	0	109.4	Y1406 D1428 Q1429 L1430 R1770	Y1406-D1426 WeakPolarHBondContact CE1-O 3.12Å; D1426-D1428 PolarHBondContact O-N 3.07Å; D1426-D1428 PolarHBondContact OD1-N 3.28Å; D1426-Q1429 PolarHBondContact O-N 2.98Å; D1426-Q1429 VanDerWaalsContact OD1-CB 3.28Å; D1426-Q1429 WeakPolarHBondContact OD1-CB 3.26Å; D1426-Q1429 WeakPolarHBondContact OD1-CG 3.35Å; D1426-Q1429 PolarHBondContact OD1-N 2.87Å; D1426-Q1429 PolarHBondContact OD1-NE2 3.03Å; D1426-Q1429 PolarHBondContact OD2-NE2 2.95Å; D1426-L1430 PolarHBondContact O-N 3.37Å; D1426-R1770 IonicContact OD2-CZ 2.72Å; D1426-R1770 IonicContact OD2-NE 3.7Å; D1426-R1770 IonicContact OD2-NH2 3.28Å; D1426-R1770 PolarHBondContact OD2-NH2 3.37Å
1427	H	78.1	Confident	71.1	Confident	60 Å²	60	38.8 Å²	38.8	28%	0.278	24%	0.235	S	C	.	.	H	α-helix	trans	-61.2	-39.6	-179.1	-82.5	92.5	0	0	0	113.4	E1402 Y1406 L1430 I1431	E1402-H1427 VanDerWaalsContact CG-CE1 3.5Å; E1402-H1427 WeakPolarHBondContact CG-CE1 3.38Å; E1402-H1427 WeakPolarHBondContact CG-NE2 3.39Å; E1402-H1427 IonicContact OE1-CE1 2.96Å; E1402-H1427 IonicContact OE1-NE2 3.96Å; E1402-H1427 PolarHBondContact OE1-NE2 2.98Å; Y1406-H1427 AromaticContact CE2-CE1 3.63Å; Y1406-H1427 AromaticContact CE2-ND1 3.56Å; Y1406-H1427 WeakPolarHBondContact OH-CA 3.43Å; H1427-L1430 WeakPolarHBondContact O-CB 3Å; H1427-L1430 PolarHBondContact O-N 3.43Å; H1427-I1431 WeakPolarHBondContact O-CG1 3.4Å; H1427-I1431 PolarHBondContact O-N 3.33Å
1428	D	74.3	Confident	71.1	Confident	110 Å²	110	44.4 Å²	44.4	59%	0.588	25%	0.253	S	S	*	.	H	α-helix	trans	-67.3	-40.3	-178	-62.8	-30.6	0	0	0	111.6	D1426 I1431 T1432	D1426-D1428 PolarHBondContact O-N 3.07Å; D1426-D1428 PolarHBondContact OD1-N 3.28Å; D1428-I1431 PolarHBondContact O-N 3.2Å; D1428-T1432 PolarHBondContact O-N 3.36Å; D1428-T1432 VanDerWaalsContact O-N 3.1Å; D1428-T1432 PolarHBondContact O-OG1 3.17Å
1429	Q	73.4	Confident	70.9	Confident	15 Å²	15	50.7 Å²	50.7	7%	0.07	28%	0.284	C	S	.	.	H	α-helix	trans	-64	-42.1	175.3	-76.5	171.1	43.1	0	0	111.6	A1424 N1425 D1426 I1431 T1432 F1433 S1768	A1424-Q1429 HydrophobicContact CB-CB 4.38Å; N1425-Q1429 VanDerWaalsContact N-OE1 3.15Å; N1425-Q1429 PolarHBondContact ND2-OE1 2.83Å; D1426-Q1429 PolarHBondContact O-N 2.98Å; D1426-Q1429 VanDerWaalsContact OD1-CB 3.28Å; D1426-Q1429 WeakPolarHBondContact OD1-CB 3.26Å; D1426-Q1429 WeakPolarHBondContact OD1-CG 3.35Å; D1426-Q1429 PolarHBondContact OD1-N 2.87Å; D1426-Q1429 PolarHBondContact OD1-NE2 3.03Å; D1426-Q1429 PolarHBondContact OD2-NE2 2.95Å; Q1429-I1431 PolarHBondContact O-N 3.06Å; Q1429-T1432 WeakPolarHBondContact O-CB 3.29Å; Q1429-T1432 PolarHBondContact O-N 3.28Å; Q1429-F1433 HydrophobicContact CB-CD2 4.37Å; Q1429-F1433 HydrophobicContact CB-CE2 3.89Å; Q1429-F1433 HydrophobicContact CB-CZ 4.47Å; Q1429-F1433 WeakPolarHBondContact O-CD2 3.32Å; Q1429-F1433 VanDerWaalsContact O-CG 3.28Å; Q1429-F1433 WeakPolarHBondContact O-CG 3.43Å; Q1429-F1433 PolarHBondContact O-N 2.81Å; Q1429-S1768 PolarHBondContact NE2-OG 3.09Å; Q1429-S1768 PolarHBondContact OE1-OG 3.4Å
1430	L	79.4	Confident	70.4	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-56.8	-49.7	177.5	176.3	64.6	0	0	0	111.3	A1397 K1398 C1401 Y1406 V1410 A1424 D1426 H1427 T1432 F1433 L1434 I1448	A1397-L1430 HydrophobicContact CB-CD2 4.31Å; K1398-L1430 HydrophobicContact CG-CD2 4.46Å; C1401-L1430 HydrophobicContact CB-CD2 4.18Å; Y1406-L1430 WeakPolarHBondContact OH-CD2 3.28Å; V1410-L1430 HydrophobicContact CG2-CD1 3.66Å; A1424-L1430 HydrophobicContact CB-CB 3.93Å; A1424-L1430 HydrophobicContact CB-CD1 4.32Å; D1426-L1430 PolarHBondContact O-N 3.37Å; H1427-L1430 WeakPolarHBondContact O-CB 3Å; H1427-L1430 PolarHBondContact O-N 3.43Å; L1430-T1432 VanDerWaalsContact C-N 3.32Å; L1430-T1432 PolarHBondContact O-N 3.32Å; L1430-F1433 PolarHBondContact O-N 3.02Å; L1430-L1434 HydrophobicContact CD1-CD1 3.91Å; L1430-L1434 HydrophobicContact CD1-CG 4.12Å; L1430-L1434 HydrophobicContact CG-CD1 3.91Å; L1430-L1434 HydrophobicContact CG-CG 4.48Å; L1430-L1434 WeakPolarHBondContact O-CG 3.23Å; L1430-L1434 PolarHBondContact O-N 3.14Å; L1430-I1448 HydrophobicContact CD1-CD1 3.67Å
1431	I	76	Confident	69.7	Low	57 Å²	57	54.5 Å²	54.5	29%	0.292	30%	0.295	S	S	.	.	H	α-helix	trans	-60.1	-43.7	178.7	-65	169.6	0	0	0	110.9	I1394 H1427 D1428 Q1429 F1433 L1434 T1435	I1394-I1431 HydrophobicContact CG2-CG1 4.07Å; H1427-I1431 WeakPolarHBondContact O-CG1 3.4Å; H1427-I1431 PolarHBondContact O-N 3.33Å; D1428-I1431 PolarHBondContact O-N 3.2Å; Q1429-I1431 PolarHBondContact O-N 3.06Å; I1431-F1433 PolarHBondContact O-N 3.47Å; I1431-L1434 PolarHBondContact O-N 3.48Å; I1431-T1435 WeakPolarHBondContact O-CB 3.45Å; I1431-T1435 PolarHBondContact O-N 3.49Å; I1431-T1435 PolarHBondContact O-OG1 3.28Å
1432	T	70.5	Confident	68.2	Low	89 Å²	89	59.1 Å²	59.1	55%	0.546	33%	0.327	S	S	.	.	H	α-helix	trans	-58.9	-47.7	178.5	-53.3	0	0	0	0	111.5	D1428 Q1429 L1430 T1435 A1436	D1428-T1432 PolarHBondContact O-N 3.36Å; D1428-T1432 VanDerWaalsContact O-N 3.1Å; D1428-T1432 PolarHBondContact O-OG1 3.17Å; Q1429-T1432 WeakPolarHBondContact O-CB 3.29Å; Q1429-T1432 PolarHBondContact O-N 3.28Å; L1430-T1432 VanDerWaalsContact C-N 3.32Å; L1430-T1432 PolarHBondContact O-N 3.32Å; T1432-T1435 PolarHBondContact O-N 2.8Å; T1432-A1436 PolarHBondContact O-N 2.73Å; T1432-A1436 VanDerWaalsContact O-N 3.09Å
1433	F	74.6	Confident	66.9	Low	30 Å²	30	64.6 Å²	64.6	13%	0.132	35%	0.352	C	S	.	.	H	α-helix	trans	-69.6	-39.3	-178.4	-61.5	-39.6	0	0	0	113	V1410 N1422 A1424 Q1429 L1430 I1431 T1435 A1436 A1437	V1410-F1433 HydrophobicContact CG1-CB 4.49Å; N1422-F1433 HydrophobicContact CB-CB 4.22Å; N1422-F1433 HydrophobicContact CB-CD1 3.76Å; N1422-F1433 HydrophobicContact CB-CD2 3.6Å; N1422-F1433 HydrophobicContact CB-CE1 3.95Å; N1422-F1433 HydrophobicContact CB-CE2 3.78Å; N1422-F1433 HydrophobicContact CB-CG 3.6Å; N1422-F1433 HydrophobicContact CB-CZ 3.96Å; N1422-F1433 WeakPolarHBondContact OD1-CE1 3.41Å; A1424-F1433 HydrophobicContact CB-CD2 4.18Å; A1424-F1433 HydrophobicContact CB-CE2 4.38Å; Q1429-F1433 HydrophobicContact CB-CD2 4.37Å; Q1429-F1433 HydrophobicContact CB-CE2 3.89Å; Q1429-F1433 HydrophobicContact CB-CZ 4.47Å; Q1429-F1433 WeakPolarHBondContact O-CD2 3.32Å; Q1429-F1433 VanDerWaalsContact O-CG 3.28Å; Q1429-F1433 WeakPolarHBondContact O-CG 3.43Å; Q1429-F1433 PolarHBondContact O-N 2.81Å; L1430-F1433 PolarHBondContact O-N 3.02Å; I1431-F1433 PolarHBondContact O-N 3.47Å; F1433-T1435 VanDerWaalsContact C-N 3.32Å; F1433-T1435 PolarHBondContact O-N 3.23Å; F1433-A1436 PolarHBondContact O-N 2.69Å; F1433-A1437 WeakPolarHBondContact O-CB 3.46Å; F1433-A1437 PolarHBondContact O-N 3.3Å
1434	L	73.4	Confident	65.7	Low	20 Å²	20	67.3 Å²	67.3	11%	0.105	36%	0.364	C	S	.	.	H	α-helix	trans	-63.7	-39.1	175.3	-70.5	173.3	0	0	0	111.9	I1394 A1397 V1410 L1430 I1431 A1437 K1438 V1446	I1394-L1434 HydrophobicContact CG1-CD1 4.29Å; A1397-L1434 HydrophobicContact CB-CD1 3.72Å; V1410-L1434 HydrophobicContact CG1-CD2 4.14Å; L1430-L1434 HydrophobicContact CD1-CD1 3.91Å; L1430-L1434 HydrophobicContact CD1-CG 4.12Å; L1430-L1434 HydrophobicContact CG-CD1 3.91Å; L1430-L1434 HydrophobicContact CG-CG 4.48Å; L1430-L1434 WeakPolarHBondContact O-CG 3.23Å; L1430-L1434 PolarHBondContact O-N 3.14Å; I1431-L1434 PolarHBondContact O-N 3.48Å; L1434-A1437 PolarHBondContact O-N 3.41Å; L1434-K1438 PolarHBondContact O-N 3.04Å; L1434-K1438 VanDerWaalsContact O-N 3.12Å; L1434-V1446 HydrophobicContact CD2-CB 4.12Å; L1434-V1446 HydrophobicContact CD2-CG1 3.76Å; L1434-V1446 HydrophobicContact CD2-CG2 4.44Å
1435	T	67.2	Low	64.9	Low	77 Å²	77	69.4 Å²	69.4	47%	0.472	38%	0.377	S	S	.	.	H	α-helix	trans	-64.9	-41.6	176.7	-52.5	0	0	0	0	111.2	I1431 T1432 F1433	I1431-T1435 WeakPolarHBondContact O-CB 3.45Å; I1431-T1435 PolarHBondContact O-N 3.49Å; I1431-T1435 PolarHBondContact O-OG1 3.28Å; T1432-T1435 PolarHBondContact O-N 2.8Å; F1433-T1435 VanDerWaalsContact C-N 3.32Å; F1433-T1435 PolarHBondContact O-N 3.23Å
1436	A	63.2	Low	64.7	Low	48 Å²	48	68.7 Å²	68.7	40%	0.397	37%	0.374	S	S	.	.	H	α-helix	trans	-68.2	-42.4	176	0	0	0	0	0	112.6	T1432 F1433 K1438 N1439	T1432-A1436 PolarHBondContact O-N 2.73Å; T1432-A1436 VanDerWaalsContact O-N 3.09Å; F1433-A1436 PolarHBondContact O-N 2.69Å; A1436-K1438 VanDerWaalsContact C-N 3.32Å; A1436-K1438 PolarHBondContact O-N 3.06Å; A1436-N1439 PolarHBondContact O-N 3.33Å
1437	A	62.6	Low	64.8	Low	20 Å²	20	67 Å²	67	17%	0.165	37%	0.365	C	S	.	.	H	α-helix	trans	-63.2	-36.7	-179.7	0	0	0	0	0	112.6	F1433 L1434 N1439 I1440 V1446	F1433-A1437 WeakPolarHBondContact O-CB 3.46Å; F1433-A1437 PolarHBondContact O-N 3.3Å; L1434-A1437 PolarHBondContact O-N 3.41Å; A1437-N1439 PolarHBondContact O-N 2.93Å; A1437-N1439 VanDerWaalsContact O-N 3.14Å; A1437-I1440 PolarHBondContact O-N 2.92Å; A1437-V1446 HydrophobicContact CB-CG2 3.8Å
1438	K	55.3	Low	65.2	Low	170 Å²	170	64.1 Å²	64.1	74%	0.739	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-24.5	176.8	-160.1	175.9	-175.8	178.3	0	113.3	L1434 A1436	L1434-K1438 PolarHBondContact O-N 3.04Å; L1434-K1438 VanDerWaalsContact O-N 3.12Å; A1436-K1438 VanDerWaalsContact C-N 3.32Å; A1436-K1438 PolarHBondContact O-N 3.06Å
1439	N	49.1	Very low	65.8	Low	139 Å²	139	59.1 Å²	59.1	74%	0.743	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	-18.3	176.7	-65.2	-20.3	0	0	0	113.5	A1436 A1437	A1436-N1439 PolarHBondContact O-N 3.33Å; A1437-N1439 PolarHBondContact O-N 2.93Å; A1437-N1439 VanDerWaalsContact O-N 3.14Å
1440	I	47.8	Very low	66.5	Low	120 Å²	120	61.3 Å²	61.3	62%	0.615	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	-39.4	-170	-65.7	169.6	0	0	0	112.1	A1420 A1437	A1420-I1440 HydrophobicContact CB-CD1 4.26Å; A1437-I1440 PolarHBondContact O-N 2.92Å
1441	S	47.8	Very low	66.8	Low	36 Å²	36	62.5 Å²	62.5	25%	0.252	34%	0.341	S	S	.	.			trans	-147.5	105.8	174.5	-177	0	0	0	0	110.1	E1443 H1444	S1441-E1443 PolarHBondContact O-N 2.96Å; S1441-H1444 PolarHBondContact OG-CD2 2.97Å; S1441-H1444 VanDerWaalsContact OG-CD2 3.29Å; S1441-H1444 PolarHBondContact OG-N 2.86Å
1442	P	46.3	Very low	67.2	Low	124 Å²	124	61.4 Å²	61.4	81%	0.805	34%	0.336	S	S	*	.	S	Bend	trans	-65.3	-25.3	170.3	-17.6	30.1	0	0	0	112.4
1443	E	49.9	Very low	67.7	Low	164 Å²	164	59.8 Å²	59.8	77%	0.766	32%	0.323	S	S	*	.	S	Bend	trans	-80.9	-19.3	-171.4	-63	179.4	175.5	0	0	113.4	S1441	S1441-E1443 PolarHBondContact O-N 2.96Å
1444	H	55.5	Low	68	Low	62 Å²	62	61.8 Å²	61.8	29%	0.287	34%	0.335	S	S	.	.	S	Bend	trans	-121.5	120.3	-176.2	-60.4	-44.9	0	0	0	112.1	Y1414 S1441	Y1414-H1444 AromaticContact CD2-CE1 3.83Å; Y1414-H1444 AromaticContact CD2-ND1 3.71Å; S1441-H1444 PolarHBondContact OG-CD2 2.97Å; S1441-H1444 VanDerWaalsContact OG-CD2 3.29Å; S1441-H1444 PolarHBondContact OG-N 2.86Å
1445	P	62.6	Low	68.7	Low	44 Å²	44	61 Å²	61	29%	0.286	33%	0.331	S	S	.	.			trans	-63.2	157.3	173.5	23.6	-29.3	0	0	0	111.8	E1390 S1413	E1390-P1445 HydrophobicContact CG-CB 4.18Å; E1390-P1445 HydrophobicContact CG-CG 4.21Å; E1390-P1445 WeakPolarHBondContact OE1-CG 3.23Å; S1413-P1445 VanDerWaalsContact CB-O 3.28Å; S1413-P1445 WeakPolarHBondContact CB-O 3.38Å; S1413-P1445 PolarHBondContact N-O 2.85Å; S1413-P1445 VanDerWaalsContact N-O 3.09Å
1446	V	73	Confident	69.7	Low	21 Å²	21	59.5 Å²	59.5	13%	0.127	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	137.3	178.7	-176.7	0	0	0	0	109.7	L1391 V1410 L1434 A1437	L1391-V1446 PolarHBondContact N-O 3.37Å; V1410-V1446 HydrophobicContact CG1-CG1 3.45Å; V1410-V1446 VanDerWaalsContact CG1-CG1 3.45Å; L1434-V1446 HydrophobicContact CD2-CB 4.12Å; L1434-V1446 HydrophobicContact CD2-CG1 3.76Å; L1434-V1446 HydrophobicContact CD2-CG2 4.44Å; A1437-V1446 HydrophobicContact CB-CG2 3.8Å
1447	V	79.8	Confident	71.1	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	133.6	177.2	176.7	0	0	0	0	109.5	R1371 W1388 E1390 R1411	R1371-V1447 HydrophobicContact CB-CG2 4.37Å; W1388-V1447 HydrophobicContact CE3-CG1 3.77Å; W1388-V1447 HydrophobicContact CZ3-CG1 4.46Å; E1390-V1447 HydrophobicContact CB-CG2 4.31Å; E1390-V1447 HydrophobicContact CG-CG2 4.25Å; R1411-V1447 PolarHBondContact N-O 2.87Å; R1411-V1447 PolarHBondContact O-N 2.81Å
1448	I	86.8	Confident	72.6	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	135.4	174.6	-54.3	-176.3	0	0	0	109.4	W1388 K1389 L1391 A1397 F1400 C1408 L1409 L1430	W1388-I1448 CarbonylContact C-O 3.57Å; W1388-I1448 WeakPolarHBondContact CA-O 3.42Å; W1388-I1448 WeakPolarHBondContact CB-O 3.48Å; K1389-I1448 PolarHBondContact N-O 2.82Å; K1389-I1448 PolarHBondContact O-N 2.76Å; L1391-I1448 HydrophobicContact CD1-CB 4.02Å; L1391-I1448 HydrophobicContact CD1-CD1 3.65Å; L1391-I1448 HydrophobicContact CD1-CG1 3.87Å; A1397-I1448 HydrophobicContact CB-CD1 3.45Å; A1397-I1448 VanDerWaalsContact CB-CD1 3.45Å; F1400-I1448 HydrophobicContact CD1-CB 4.02Å; F1400-I1448 HydrophobicContact CD1-CG2 3.82Å; F1400-I1448 HydrophobicContact CE1-CB 4.14Å; F1400-I1448 HydrophobicContact CE1-CG2 3.89Å; F1400-I1448 WeakPolarHBondContact CE1-O 3.41Å; C1408-I1448 HydrophobicContact CB-CG2 3.92Å; L1409-I1448 CarbonylContact O-C 3.52Å; L1409-I1448 VanDerWaalsContact O-CA 3.28Å; L1409-I1448 WeakPolarHBondContact O-CA 3.19Å; L1430-I1448 HydrophobicContact CD1-CD1 3.67Å
1449	S	86.8	Confident	74.5	Confident	5 Å²	5	49 Å²	49	4%	0.035	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	149.4	177	-51.5	0	0	0	0	111.6	R1387 W1388 C1408 L1409 F1451	R1387-S1449 CarbonylContact O-C 3.57Å; R1387-S1449 WeakPolarHBondContact O-CA 3.47Å; W1388-S1449 WeakPolarHBondContact CB-OG 3.14Å; C1408-S1449 CarbonylContact C-O 3.27Å; C1408-S1449 WeakPolarHBondContact CA-O 3.43Å; L1409-S1449 PolarHBondContact N-O 3.44Å; L1409-S1449 PolarHBondContact O-N 3.17Å; S1449-F1451 PolarHBondContact O-N 2.86Å
1450	Q	88.5	Confident	76.7	Confident	62 Å²	62	42.3 Å²	42.3	29%	0.29	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	128.9	174.1	-175.3	-179.5	27.1	0	0	110	R1387 V1404	R1387-Q1450 HydrophobicContact CB-CB 4.25Å; R1387-Q1450 PolarHBondContact O-N 3.24Å; V1404-Q1450 HydrophobicContact CB-CB 4.18Å; V1404-Q1450 HydrophobicContact CB-CG 4.13Å; V1404-Q1450 HydrophobicContact CG2-CB 4.2Å; V1404-Q1450 HydrophobicContact CG2-CG 4.34Å; V1404-Q1450 PolarHBondContact O-NE2 3.07Å
1451	F	85.4	Confident	79	Confident	25 Å²	25	36.6 Å²	36.6	11%	0.11	20%	0.195	C	C	.	.			trans	-94.2	117.5	177.4	-171.2	-78.5	0	0	0	110.3	P1407 L1409 V1423 S1449 L1453 V1629	P1407-F1451 HydrophobicContact CB-CB 4.15Å; P1407-F1451 HydrophobicContact CB-CD1 4.41Å; P1407-F1451 HydrophobicContact CB-CG 4.42Å; P1407-F1451 HydrophobicContact CG-CB 4.03Å; P1407-F1451 HydrophobicContact CG-CD1 3.7Å; P1407-F1451 HydrophobicContact CG-CG 4.14Å; P1407-F1451 VanDerWaalsContact O-CB 3.27Å; P1407-F1451 WeakPolarHBondContact O-CB 3.46Å; P1407-F1451 PolarHBondContact O-N 2.8Å; L1409-F1451 HydrophobicContact CB-CD2 4.41Å; V1423-F1451 HydrophobicContact CG1-CD2 4.03Å; V1423-F1451 HydrophobicContact CG1-CE2 4.27Å; V1423-F1451 HydrophobicContact CG1-CG 4.27Å; V1423-F1451 HydrophobicContact CG2-CD2 3.89Å; V1423-F1451 HydrophobicContact CG2-CE2 3.67Å; V1423-F1451 HydrophobicContact CG2-CZ 4.49Å; S1449-F1451 PolarHBondContact O-N 2.86Å; F1451-L1453 HydrophobicContact CD1-CD2 4.1Å; F1451-L1453 HydrophobicContact CE1-CD2 3.94Å; F1451-V1629 HydrophobicContact CE2-CG1 4.05Å
1452	I	84.7	Confident	81.2	Confident	34 Å²	34	34.9 Å²	34.9	17%	0.174	18%	0.183	C	C	.	.			trans	-92.6	112.1	-173.9	-56.3	178	0	0	0	110.3	P1386 A1455 L1527 K1529 L1534	P1386-I1452 HydrophobicContact CB-CD1 4.47Å; P1386-I1452 HydrophobicContact CG-CD1 4.41Å; I1452-A1455 HydrophobicContact CG2-CB 3.95Å; I1452-L1527 HydrophobicContact CB-CD1 4.23Å; I1452-L1527 HydrophobicContact CD1-CD1 4.01Å; I1452-L1527 HydrophobicContact CG1-CD1 4.41Å; I1452-K1529 HydrophobicContact CG2-CD 4.33Å; I1452-L1534 HydrophobicContact CD1-CD1 3.16Å
1453	L	82.5	Confident	83.5	Confident	54 Å²	54	29 Å²	29	28%	0.283	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.8	151.1	177.2	-65.8	170.8	0	0	0	112.5	P1407 F1451 A1455 K1529 K1765	P1407-L1453 HydrophobicContact CG-CD1 4.28Å; P1407-L1453 HydrophobicContact CG-CD2 4.05Å; P1407-L1453 HydrophobicContact CG-CG 4.13Å; F1451-L1453 HydrophobicContact CD1-CD2 4.1Å; F1451-L1453 HydrophobicContact CE1-CD2 3.94Å; L1453-A1455 PolarHBondContact O-N 2.91Å; L1453-K1529 PolarHBondContact O-NZ 3.47Å; L1453-K1765 HydrophobicContact CD1-CD 4.35Å
1454	D	80.7	Confident	85.5	Confident	73 Å²	73	21.2 Å²	21.2	39%	0.39	11%	0.109	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.7	29	175.8	-62.5	-38.8	0	0	0	113.6	R1678	D1454-R1678 VanDerWaalsContact CG-NH2 3.31Å; D1454-R1678 IonicContact OD1-NH2 2.94Å; D1454-R1678 PolarHBondContact OD1-NH2 3.09Å; D1454-R1678 IonicContact OD2-CZ 3.88Å; D1454-R1678 IonicContact OD2-NH1 3.1Å; D1454-R1678 PolarHBondContact OD2-NH1 3.37Å; D1454-R1678 IonicContact OD2-NH2 3.31Å; D1454-R1678 PolarHBondContact OD2-NH2 3.28Å
1455	A	86.5	Confident	87.1	Confident	2 Å²	2	20.5 Å²	20.5	2%	0.017	11%	0.105	C	C	.	.	P	Polyproline II helix	trans	-93.4	152.3	170	0	0	0	0	0	110.3	I1452 L1453 A1481 L1527 K1529	I1452-A1455 HydrophobicContact CG2-CB 3.95Å; L1453-A1455 PolarHBondContact O-N 2.91Å; A1455-A1481 HydrophobicContact CB-CB 4.24Å; A1455-A1481 WeakPolarHBondContact O-CB 3.4Å; A1455-A1481 PolarHBondContact O-N 3.07Å; A1455-L1527 HydrophobicContact CB-CB 4.4Å; A1455-L1527 HydrophobicContact CB-CD2 4.23Å; A1455-K1529 HydrophobicContact CB-CB 4.29Å; A1455-K1529 HydrophobicContact CB-CD 4.31Å
1456	K	89	Confident	88.3	Confident	46 Å²	46	22.1 Å²	22.1	20%	0.2	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	134.1	172.7	-173.7	144.2	171.6	163.8	0	108.9	E1476 H1477 D1496 A1528	K1456-E1476 WeakPolarHBondContact CE-OE2 3.39Å; K1456-E1476 IonicContact NZ-OE1 2.72Å; K1456-E1476 IonicContact NZ-OE2 3.56Å; K1456-E1476 PolarHBondContact NZ-OE2 3.17Å; K1456-H1477 WeakPolarHBondContact CE-O 3.42Å; K1456-D1496 IonicContact NZ-OD2 2.73Å; K1456-D1496 PolarHBondContact NZ-OD2 2.86Å; K1456-A1528 PolarHBondContact N-O 3.32Å; K1456-A1528 PolarHBondContact O-N 3.5Å
1457	E	92.9	Very high	89	Confident	12 Å²	12	21.2 Å²	21.2	6%	0.056	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	139.3	178.4	-166.9	169.8	152.2	0	0	109.6	H1477 A1481 L1526 L1527 I1536	E1457-H1477 HydrophobicContact CB-CB 4.18Å; E1457-H1477 WeakPolarHBondContact O-CB 3.47Å; E1457-H1477 PolarHBondContact O-N 3.49Å; E1457-H1477 IonicContact OE1-CE1 3.31Å; E1457-H1477 PolarHBondContact OE1-CE1 3.21Å; E1457-H1477 VanDerWaalsContact OE1-CE1 3.25Å; E1457-H1477 IonicContact OE1-ND1 2.61Å; E1457-H1477 IonicContact OE2-ND1 2.65Å; E1457-A1481 HydrophobicContact CB-CB 4.25Å; E1457-L1526 CarbonylContact C-O 3.46Å; E1457-L1526 WeakPolarHBondContact CA-O 3.42Å; E1457-L1527 HydrophobicContact CB-CD2 4.43Å; E1457-L1527 HydrophobicContact CG-CD2 4.49Å; E1457-I1536 HydrophobicContact CG-CD1 4.21Å
1458	I	94.1	Very high	89.4	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	128.7	-176.2	-55.7	178.5	0	0	0	107.4	V1460 V1474 S1475 L1497 T1501 I1505 L1526 A1528 L1533	I1458-V1460 HydrophobicContact CG2-CG2 4.05Å; I1458-V1474 HydrophobicContact CG2-CG1 3.63Å; I1458-S1475 WeakPolarHBondContact CG2-O 3.33Å; I1458-L1497 HydrophobicContact CD1-CD1 3.68Å; I1458-L1497 HydrophobicContact CD1-CD2 3.78Å; I1458-L1497 HydrophobicContact CD1-CG 4.41Å; I1458-L1497 HydrophobicContact CG1-CD1 4.24Å; I1458-L1497 HydrophobicContact CG1-CD2 4.43Å; I1458-L1497 HydrophobicContact CG2-CD1 4.41Å; I1458-T1501 HydrophobicContact CD1-CG2 4.42Å; I1458-I1505 HydrophobicContact CD1-CD1 3.74Å; I1458-I1505 HydrophobicContact CG2-CD1 4.08Å; I1458-L1526 HydrophobicContact CB-CB 4.31Å; I1458-L1526 PolarHBondContact N-O 2.97Å; I1458-L1526 PolarHBondContact O-N 2.9Å; I1458-A1528 HydrophobicContact CD1-CB 3.49Å; I1458-A1528 VanDerWaalsContact CD1-CB 3.49Å; I1458-A1528 HydrophobicContact CG1-CB 4.21Å; I1458-L1533 HydrophobicContact CD1-CD2 4.49Å
1459	D	94.5	Very high	89.5	Confident	5 Å²	5	30.1 Å²	30.1	3%	0.027	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	132	177.1	-154.1	-20.5	0	0	0	108.8	S1475 N1523	D1459-S1475 PolarHBondContact N-O 3.32Å; D1459-S1475 PolarHBondContact O-N 3Å; D1459-N1523 PolarHBondContact OD1-ND2 2.83Å
1460	V	95.3	Very high	89.4	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	111.8	-176.6	-173.8	0	0	0	0	109.6	I1458 M1472 A1473 V1474 I1505 V1509 N1523 L1524 L1526	I1458-V1460 HydrophobicContact CG2-CG2 4.05Å; V1460-M1472 HydrophobicContact CG1-CG 3.61Å; V1460-M1472 HydrophobicContact CG1-SD 3.9Å; V1460-A1473 WeakPolarHBondContact CA-O 3.23Å; V1460-A1473 WeakPolarHBondContact CG1-O 2.95Å; V1460-V1474 HydrophobicContact CG1-CG2 4.45Å; V1460-V1474 HydrophobicContact CG2-CG1 4.5Å; V1460-V1474 HydrophobicContact CG2-CG2 4.48Å; V1460-I1505 HydrophobicContact CG2-CG2 3.81Å; V1460-V1509 HydrophobicContact CG1-CG2 3.81Å; V1460-N1523 CarbonylContact O-C 3.44Å; V1460-N1523 WeakPolarHBondContact O-CA 3.49Å; V1460-L1524 HydrophobicContact CB-CB 4.27Å; V1460-L1524 PolarHBondContact N-O 2.95Å; V1460-L1524 PolarHBondContact O-N 3.3Å; V1460-L1526 HydrophobicContact CG2-CD1 3.98Å
1461	D	95.8	Very high	89.4	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	128.4	173.3	-67.4	-50.7	0	0	0	109.9	M1472 A1473 N1523 S1543 S1545 F1546 V1549	D1461-M1472 CarbonylContact O-C 3.6Å; D1461-M1472 WeakPolarHBondContact O-CA 3.47Å; D1461-A1473 HydrophobicContact CB-CB 4.44Å; D1461-A1473 PolarHBondContact N-O 3.2Å; D1461-A1473 PolarHBondContact O-N 3.16Å; D1461-N1523 PolarHBondContact OD1-ND2 3.44Å; D1461-S1543 WeakPolarHBondContact OD1-CB 3.22Å; D1461-S1543 PolarHBondContact OD1-OG 3.44Å; D1461-S1545 VanDerWaalsContact CG-OG 3.26Å; D1461-S1545 PolarHBondContact OD1-OG 2.83Å; D1461-S1545 WeakPolarHBondContact OD2-CB 3.44Å; D1461-S1545 PolarHBondContact OD2-OG 3Å; D1461-F1546 HydrophobicContact CB-CD2 4.07Å; D1461-F1546 HydrophobicContact CB-CE1 4.45Å; D1461-F1546 HydrophobicContact CB-CE2 3.75Å; D1461-F1546 HydrophobicContact CB-CZ 3.95Å; D1461-F1546 WeakPolarHBondContact OD1-CD2 3.33Å; D1461-F1546 VanDerWaalsContact OD1-CE2 3.29Å; D1461-F1546 WeakPolarHBondContact OD1-CE2 2.93Å; D1461-V1549 HydrophobicContact CB-CG2 4.14Å
1462	A	94.8	Very high	89.6	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	157.8	-173.5	0	0	0	0	0	112.7	L1469 A1471 M1472 V1509 P1521 F1522	A1462-L1469 HydrophobicContact CB-CD1 3.87Å; A1462-A1471 WeakPolarHBondContact CA-O 3.42Å; A1462-M1472 HydrophobicContact CB-CB 4.47Å; A1462-M1472 HydrophobicContact CB-CG 4.38Å; A1462-V1509 HydrophobicContact CB-CG1 4.11Å; A1462-P1521 WeakPolarHBondContact O-CA 3.49Å; A1462-F1522 HydrophobicContact CB-CD1 3.95Å; A1462-F1522 HydrophobicContact CB-CD2 4.43Å; A1462-F1522 HydrophobicContact CB-CE1 3.36Å; A1462-F1522 HydrophobicContact CB-CE2 3.91Å; A1462-F1522 HydrophobicContact CB-CG 4.47Å; A1462-F1522 HydrophobicContact CB-CZ 3.34Å; A1462-F1522 PolarHBondContact N-O 3.3Å; A1462-F1522 WeakPolarHBondContact O-CD1 3.43Å; A1462-F1522 PolarHBondContact O-N 3.15Å; A1462-F1522 VanDerWaalsContact O-O 3.09Å
1463	V	93.8	Very high	89.9	Confident	0 Å²	0	26 Å²	26	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	129.8	173.7	175.4	0	0	0	0	107.9	V1470 A1471 G1520 F1546 F1557 A1560 A1561 A1564	V1463-V1470 HydrophobicContact CG1-CB 4.32Å; V1463-V1470 WeakPolarHBondContact O-CA 3.37Å; V1463-V1470 WeakPolarHBondContact O-CB 3.39Å; V1463-V1470 PolarHBondContact O-N 3.48Å; V1463-A1471 HydrophobicContact CB-CB 4.45Å; V1463-A1471 PolarHBondContact N-O 3.26Å; V1463-A1471 PolarHBondContact O-N 3.43Å; V1463-G1520 WeakPolarHBondContact CA-O 3.16Å; V1463-F1546 HydrophobicContact CG2-CE1 4.21Å; V1463-F1557 HydrophobicContact CG2-CB 4.42Å; V1463-F1557 HydrophobicContact CG2-CD1 4.01Å; V1463-A1560 HydrophobicContact CG1-CB 4.41Å; V1463-A1561 HydrophobicContact CG1-CB 4.21Å; V1463-A1561 HydrophobicContact CG2-CB 3.94Å; V1463-A1564 HydrophobicContact CG1-CB 4.1Å
1464	A	92.2	Very high	90.4	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	158.1	175.7	0	0	0	0	0	110.8	R1468 A1513 V1518 S1519 G1520 F1522 A1564	A1464-R1468 CarbonylContact C-O 3.43Å; A1464-R1468 VanDerWaalsContact CA-O 3.26Å; A1464-R1468 WeakPolarHBondContact CA-O 3.42Å; A1464-A1513 HydrophobicContact CB-CB 4.01Å; A1464-V1518 CarbonylContact C-O 3.59Å; A1464-V1518 VanDerWaalsContact C-O 3.31Å; A1464-V1518 HydrophobicContact CB-CB 4.02Å; A1464-V1518 HydrophobicContact CB-CG1 4.16Å; A1464-S1519 CarbonylContact O-C 3.59Å; A1464-S1519 WeakPolarHBondContact O-CA 3.38Å; A1464-G1520 PolarHBondContact N-O 2.92Å; A1464-G1520 VanDerWaalsContact N-O 3.07Å; A1464-G1520 PolarHBondContact O-N 3.14Å; A1464-F1522 HydrophobicContact CB-CD1 4.46Å; A1464-F1522 HydrophobicContact CB-CE1 3.78Å; A1464-A1564 WeakPolarHBondContact O-CB 3.44Å
1465	Q	89.5	Confident	91.1	Very high	47 Å²	47	20 Å²	20	22%	0.22	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	119.2	173.7	-174.2	-178.4	-9.6	0	0	108.7	G1467 R1468 V1470 V1518 A1564	Q1465-G1467 PolarHBondContact O-N 3.39Å; Q1465-R1468 PolarHBondContact N-O 3.36Å; Q1465-R1468 WeakPolarHBondContact O-CB 3.46Å; Q1465-R1468 PolarHBondContact O-N 3Å; Q1465-V1470 HydrophobicContact CB-CG2 4.14Å; Q1465-V1518 CarbonylContact C-O 3.57Å; Q1465-V1518 PolarHBondContact N-O 2.76Å; Q1465-A1564 HydrophobicContact CB-CB 3.87Å; Q1465-A1564 HydrophobicContact CG-CB 4.23Å
1466	S	87.7	Confident	91.4	Very high	78 Å²	78	20 Å²	20	55%	0.545	10%	0.097	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.3	47	-174.9	-51.2	0	0	0	0	111.4	R1468 V1518 S1519	S1466-R1468 PolarHBondContact O-N 3.17Å; S1466-R1468 VanDerWaalsContact O-N 3.08Å; S1466-V1518 PolarHBondContact N-O 2.72Å; S1466-V1518 VanDerWaalsContact N-O 3.12Å; S1466-S1519 WeakPolarHBondContact CA-OG 3.49Å; S1466-S1519 PolarHBondContact N-OG 3.46Å
1467	G	87.8	Confident	91.7	Very high	2 Å²	2	17.8 Å²	17.8	2%	0.021	9%	0.088	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.3	-14.2	-178.4	0	0	0	0	0	116.2	Q1465 L1469 A1513 D1514 V1518	Q1465-G1467 PolarHBondContact O-N 3.39Å; G1467-L1469 PolarHBondContact O-N 3.4Å; G1467-A1513 WeakPolarHBondContact CA-O 3.34Å; G1467-A1513 CarbonylContact O-C 3.54Å; G1467-A1513 WeakPolarHBondContact O-CB 3.48Å; G1467-D1514 PolarHBondContact O-N 3.42Å; G1467-V1518 PolarHBondContact N-O 3.47Å
1468	R	88.5	Confident	91.7	Very high	168 Å²	168	18.4 Å²	18.4	63%	0.634	9%	0.092	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-78.9	117.1	176.4	-173.4	177.7	179.2	164	0.7	111.3	A1464 Q1465 S1466 V1470	A1464-R1468 CarbonylContact C-O 3.43Å; A1464-R1468 VanDerWaalsContact CA-O 3.26Å; A1464-R1468 WeakPolarHBondContact CA-O 3.42Å; Q1465-R1468 PolarHBondContact N-O 3.36Å; Q1465-R1468 WeakPolarHBondContact O-CB 3.46Å; Q1465-R1468 PolarHBondContact O-N 3Å; S1466-R1468 PolarHBondContact O-N 3.17Å; S1466-R1468 VanDerWaalsContact O-N 3.08Å; R1468-V1470 PolarHBondContact O-N 2.78Å
1469	L	88.5	Confident	91.5	Very high	19 Å²	19	18.5 Å²	18.5	10%	0.099	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.4	123.3	175.2	-172.9	66.3	0	0	0	112.2	A1462 G1467 A1471 M1472 V1509 R1510 F1522	A1462-L1469 HydrophobicContact CB-CD1 3.87Å; G1467-L1469 PolarHBondContact O-N 3.4Å; L1469-A1471 WeakPolarHBondContact CD1-O 3.24Å; L1469-M1472 HydrophobicContact CD1-CB 4.41Å; L1469-M1472 HydrophobicContact CD2-CB 4.35Å; L1469-M1472 HydrophobicContact CD2-SD 4.4Å; L1469-V1509 HydrophobicContact CD1-CG1 3.89Å; L1469-V1509 HydrophobicContact CD2-CG1 4.16Å; L1469-R1510 HydrophobicContact CB-CG 4.04Å; L1469-R1510 HydrophobicContact CD2-CG 3.81Å; L1469-F1522 HydrophobicContact CD1-CE1 4.37Å; L1469-F1522 HydrophobicContact CD1-CZ 4.23Å
1470	V	84.6	Confident	91.1	Very high	18 Å²	18	20.2 Å²	20.2	11%	0.109	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	-50.7	178.8	178.3	0	0	0	0	110.7	V1463 Q1465 R1468 L1594 S1597 V1598	V1463-V1470 HydrophobicContact CG1-CB 4.32Å; V1463-V1470 WeakPolarHBondContact O-CA 3.37Å; V1463-V1470 WeakPolarHBondContact O-CB 3.39Å; V1463-V1470 PolarHBondContact O-N 3.48Å; Q1465-V1470 HydrophobicContact CB-CG2 4.14Å; R1468-V1470 PolarHBondContact O-N 2.78Å; V1470-L1594 HydrophobicContact CG2-CD2 4.46Å; V1470-S1597 WeakPolarHBondContact O-CA 3.37Å; V1470-V1598 PolarHBondContact O-N 2.94Å
1471	A	87.8	Confident	90.6	Very high	2 Å²	2	20.7 Å²	20.7	2%	0.017	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	151.1	-176	0	0	0	0	0	110.9	A1462 V1463 L1469 Y1555 F1557 I1600	A1462-A1471 WeakPolarHBondContact CA-O 3.42Å; V1463-A1471 HydrophobicContact CB-CB 4.45Å; V1463-A1471 PolarHBondContact N-O 3.26Å; V1463-A1471 PolarHBondContact O-N 3.43Å; L1469-A1471 WeakPolarHBondContact CD1-O 3.24Å; A1471-Y1555 HydrophobicContact CB-CD1 4.28Å; A1471-Y1555 HydrophobicContact CB-CE1 3.54Å; A1471-F1557 HydrophobicContact CB-CD1 4.16Å; A1471-F1557 HydrophobicContact CB-CE1 3.78Å; A1471-I1600 HydrophobicContact CB-CD1 3.71Å
1472	M	90.7	Very high	89.8	Confident	20 Å²	20	21.1 Å²	21.1	10%	0.099	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	134.6	179.9	-174.5	-178	78.2	0	0	110.6	V1460 D1461 A1462 L1469 V1474 K1506 V1509	V1460-M1472 HydrophobicContact CG1-CG 3.61Å; V1460-M1472 HydrophobicContact CG1-SD 3.9Å; D1461-M1472 CarbonylContact O-C 3.6Å; D1461-M1472 WeakPolarHBondContact O-CA 3.47Å; A1462-M1472 HydrophobicContact CB-CB 4.47Å; A1462-M1472 HydrophobicContact CB-CG 4.38Å; L1469-M1472 HydrophobicContact CD1-CB 4.41Å; L1469-M1472 HydrophobicContact CD2-CB 4.35Å; L1469-M1472 HydrophobicContact CD2-SD 4.4Å; M1472-V1474 HydrophobicContact CE-CG2 3.79Å; M1472-V1474 HydrophobicContact CG-CG2 4.44Å; M1472-V1474 HydrophobicContact SD-CG2 4.45Å; M1472-K1506 HydrophobicContact CE-CB 4.09Å; M1472-K1506 HydrophobicContact CE-CG 4.12Å; M1472-V1509 HydrophobicContact SD-CB 4Å; M1472-V1509 HydrophobicContact SD-CG1 3.97Å; M1472-V1509 HydrophobicContact SD-CG2 3.79Å
1473	A	91.6	Very high	89.3	Confident	0 Å²	0	21.6 Å²	21.6	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	141.8	167.6	0	0	0	0	0	109.1	V1460 D1461 V1549 L1553 F1557	V1460-A1473 WeakPolarHBondContact CA-O 3.23Å; V1460-A1473 WeakPolarHBondContact CG1-O 2.95Å; D1461-A1473 HydrophobicContact CB-CB 4.44Å; D1461-A1473 PolarHBondContact N-O 3.2Å; D1461-A1473 PolarHBondContact O-N 3.16Å; A1473-V1549 HydrophobicContact CB-CB 3.66Å; A1473-V1549 HydrophobicContact CB-CG1 3.93Å; A1473-V1549 HydrophobicContact CB-CG2 3.87Å; A1473-L1553 HydrophobicContact CB-CD1 3.53Å; A1473-F1557 HydrophobicContact CB-CE1 4.31Å; A1473-F1557 HydrophobicContact CB-CE2 4.26Å; A1473-F1557 HydrophobicContact CB-CZ 3.7Å
1474	V	93.1	Very high	89	Confident	1 Å²	1	23.3 Å²	23.3	1%	0.006	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	132.3	176.3	-177	0	0	0	0	107.6	I1458 V1460 M1472 P1494 L1497 L1502 I1505 L1601	I1458-V1474 HydrophobicContact CG2-CG1 3.63Å; V1460-V1474 HydrophobicContact CG1-CG2 4.45Å; V1460-V1474 HydrophobicContact CG2-CG1 4.5Å; V1460-V1474 HydrophobicContact CG2-CG2 4.48Å; M1472-V1474 HydrophobicContact CE-CG2 3.79Å; M1472-V1474 HydrophobicContact CG-CG2 4.44Å; M1472-V1474 HydrophobicContact SD-CG2 4.45Å; V1474-P1494 HydrophobicContact CB-CG 4.42Å; V1474-P1494 HydrophobicContact CG1-CG 4.18Å; V1474-P1494 WeakPolarHBondContact O-CD 3.32Å; V1474-L1497 HydrophobicContact CG1-CD1 4.25Å; V1474-L1502 HydrophobicContact CG1-CD2 4.17Å; V1474-I1505 HydrophobicContact CG1-CD1 4.33Å; V1474-I1505 HydrophobicContact CG2-CG2 4.28Å; V1474-L1601 HydrophobicContact CG2-CD1 4.34Å
1475	S	94.1	Very high	88.6	Confident	0 Å²	0	24.1 Å²	24.1	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	140.4	177.4	-56	0	0	0	0	109.2	I1458 D1459 V1491 T1492	I1458-S1475 WeakPolarHBondContact CG2-O 3.33Å; D1459-S1475 PolarHBondContact N-O 3.32Å; D1459-S1475 PolarHBondContact O-N 3Å; S1475-V1491 WeakPolarHBondContact CA-O 3.23Å; S1475-T1492 VanDerWaalsContact CB-OG1 3.3Å; S1475-T1492 WeakPolarHBondContact CB-OG1 3.47Å; S1475-T1492 PolarHBondContact OG-OG1 3.41Å
1476	E	93.7	Very high	88.3	Confident	1 Å²	1	21.9 Å²	21.9	1%	0.005	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	140.9	176.1	65	176.2	174.7	0	0	111.5	K1456 L1490 V1491 P1494 Q1495 D1496	K1456-E1476 WeakPolarHBondContact CE-OE2 3.39Å; K1456-E1476 IonicContact NZ-OE1 2.72Å; K1456-E1476 IonicContact NZ-OE2 3.56Å; K1456-E1476 PolarHBondContact NZ-OE2 3.17Å; E1476-L1490 WeakPolarHBondContact O-CA 3.37Å; E1476-V1491 HydrophobicContact CG-CB 3.85Å; E1476-V1491 HydrophobicContact CG-CG2 4.46Å; E1476-V1491 PolarHBondContact N-O 3.01Å; E1476-V1491 VanDerWaalsContact N-O 3.15Å; E1476-V1491 PolarHBondContact O-N 3.34Å; E1476-P1494 HydrophobicContact CB-CB 4.13Å; E1476-P1494 HydrophobicContact CG-CB 4.02Å; E1476-Q1495 WeakPolarHBondContact OE1-CA 3.34Å; E1476-Q1495 PolarHBondContact OE1-N 2.97Å; E1476-D1496 PolarHBondContact OE1-N 3.27Å; E1476-D1496 WeakPolarHBondContact OE2-CB 3.47Å; E1476-D1496 PolarHBondContact OE2-N 3.36Å
1477	H	94.5	Very high	88.4	Confident	1 Å²	1	18.2 Å²	18.2	1%	0.005	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75	142.2	168.8	-69.1	-154.7	0	0	0	109.9	K1456 E1457 A1488 L1490	K1456-H1477 WeakPolarHBondContact CE-O 3.42Å; E1457-H1477 HydrophobicContact CB-CB 4.18Å; E1457-H1477 WeakPolarHBondContact O-CB 3.47Å; E1457-H1477 PolarHBondContact O-N 3.49Å; E1457-H1477 IonicContact OE1-CE1 3.31Å; E1457-H1477 PolarHBondContact OE1-CE1 3.21Å; E1457-H1477 VanDerWaalsContact OE1-CE1 3.25Å; E1457-H1477 IonicContact OE1-ND1 2.61Å; E1457-H1477 IonicContact OE2-ND1 2.65Å; H1477-A1488 HydrophobicContact CB-CB 4.42Å; H1477-A1488 VanDerWaalsContact ND1-CB 3.33Å; H1477-A1488 WeakPolarHBondContact ND1-CB 3.34Å; H1477-L1490 WeakPolarHBondContact CD2-CD2 3.49Å
1478	V	93	Very high	88.6	Confident	24 Å²	24	18.1 Å²	18.1	15%	0.145	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	-42.4	170.4	177.8	0	0	0	0	110.6	T1489 V1491 K1797 L1798 L1801	V1478-T1489 HydrophobicContact CB-CG2 4.31Å; V1478-T1489 HydrophobicContact CG2-CG2 3.71Å; V1478-T1489 PolarHBondContact N-O 3.33Å; V1478-V1491 HydrophobicContact CG2-CG2 3.76Å; V1478-K1797 HydrophobicContact CG1-CB 4.15Å; V1478-K1797 VanDerWaalsContact O-CB 3.24Å; V1478-K1797 WeakPolarHBondContact O-CB 3.48Å; V1478-K1797 WeakPolarHBondContact O-CG 3.47Å; V1478-L1798 HydrophobicContact CB-CD2 4.15Å; V1478-L1798 HydrophobicContact CG1-CD2 3.84Å; V1478-L1801 HydrophobicContact CG1-CB 4.46Å; V1478-L1801 HydrophobicContact CG1-CD2 3.8Å; V1478-L1801 HydrophobicContact CG2-CD2 3.94Å
1479	E	90.5	Very high	88.9	Confident	2 Å²	2	10.2 Å²	10.2	1%	0.009	6%	0.06	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	155.8	174.9	-57.7	85.4	167.8	0	0	110.9	V1483 T1489 L1798	E1479-V1483 HydrophobicContact CB-CB 4.37Å; E1479-V1483 HydrophobicContact CB-CG2 4.07Å; E1479-V1483 HydrophobicContact CG-CG2 4.37Å; E1479-T1489 PolarHBondContact OE1-N 2.81Å; E1479-T1489 VanDerWaalsContact OE1-N 3.07Å; E1479-T1489 PolarHBondContact OE1-OG1 2.77Å; E1479-T1489 PolarHBondContact OE2-N 2.94Å; E1479-L1798 HydrophobicContact CG-CD1 4.19Å; E1479-L1798 HydrophobicContact CG-CD2 4.3Å; E1479-L1798 HydrophobicContact CG-CG 4.07Å; E1479-L1798 WeakPolarHBondContact OE1-CD1 3.49Å; E1479-L1798 WeakPolarHBondContact OE1-CD2 3.44Å
1480	N	85.3	Confident	89.1	Confident	41 Å²	41	9.3 Å²	9.3	22%	0.219	6%	0.055	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	155.6	168.9	-70.5	-22.1	0	0	0	110.1	G1482 K1797	N1480-G1482 PolarHBondContact O-N 3.1Å; N1480-K1797 VanDerWaalsContact OD1-CE 3.27Å; N1480-K1797 WeakPolarHBondContact OD1-CE 3.5Å
1481	A	84.3	Confident	89.6	Confident	10 Å²	10	8.5 Å²	8.5	8%	0.083	5%	0.05	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.1	138.5	175.3	0	0	0	0	0	112.6	A1455 E1457 L1527	A1455-A1481 HydrophobicContact CB-CB 4.24Å; A1455-A1481 WeakPolarHBondContact O-CB 3.4Å; A1455-A1481 PolarHBondContact O-N 3.07Å; E1457-A1481 HydrophobicContact CB-CB 4.25Å; A1481-L1527 HydrophobicContact CB-CD2 3.35Å
1482	G	79.2	Confident	89.8	Confident	9 Å²	9	8.4 Å²	8.4	9%	0.093	5%	0.05	C	C	.	.	T	Hydrogen-bonded Turn	trans	119.6	-5	-173.7	0	0	0	0	0	115.4	N1480 G1628 V1629	N1480-G1482 PolarHBondContact O-N 3.1Å; G1482-G1628 CarbonylContact O-C 3.47Å; G1482-G1628 WeakPolarHBondContact O-CA 3.29Å; G1482-V1629 PolarHBondContact O-N 3.28Å
1483	V	85.8	Confident	89.8	Confident	10 Å²	10	8.5 Å²	8.5	6%	0.061	5%	0.052	C	C	.	.	S	Bend	trans	-102.3	127.1	167.3	177.8	0	0	0	0	107.1	E1479 D1487 A1488 L1627 G1628	E1479-V1483 HydrophobicContact CB-CB 4.37Å; E1479-V1483 HydrophobicContact CB-CG2 4.07Å; E1479-V1483 HydrophobicContact CG-CG2 4.37Å; V1483-D1487 HydrophobicContact CG1-CB 3.73Å; V1483-A1488 HydrophobicContact CG1-CB 4.42Å; V1483-L1627 HydrophobicContact CG1-CB 4.18Å; V1483-L1627 HydrophobicContact CG1-CD1 4.02Å; V1483-L1627 HydrophobicContact CG2-CB 4.22Å; V1483-G1628 WeakPolarHBondContact CA-O 3.4Å
1484	H	86.3	Confident	89.6	Confident	36 Å²	36	9.4 Å²	9.4	17%	0.167	6%	0.057	C	C	.	.			trans	-54.3	139.7	177.7	-172.8	-83.7	0	0	0	110.9	G1486 D1487 A1488 G1628 V1629 M1631	H1484-G1486 PolarHBondContact ND1-N 2.94Å; H1484-G1486 VanDerWaalsContact ND1-N 3.1Å; H1484-G1486 PolarHBondContact O-N 3.42Å; H1484-G1486 VanDerWaalsContact O-N 3.13Å; H1484-D1487 CarbonylContact O-C 3.56Å; H1484-D1487 WeakPolarHBondContact O-CA 3.49Å; H1484-D1487 WeakPolarHBondContact O-CB 3.42Å; H1484-D1487 PolarHBondContact O-N 3.16Å; H1484-A1488 PolarHBondContact O-N 2.82Å; H1484-A1488 VanDerWaalsContact O-N 3.1Å; H1484-G1628 PolarHBondContact N-O 3.05Å; H1484-V1629 PolarHBondContact CD2-O 2.92Å; H1484-M1631 HydrophobicContact CB-CB 4.29Å
1485	S	84	Confident	89.3	Confident	17 Å²	17	13.5 Å²	13.5	12%	0.119	8%	0.076	C	C	.	.	G	3₁₀ helix	trans	-55.1	-34.4	-177	59.1	0	0	0	0	114.2	D1487 A1488 Q1525	S1485-D1487 VanDerWaalsContact C-N 3.26Å; S1485-D1487 PolarHBondContact O-N 3.08Å; S1485-A1488 PolarHBondContact O-N 2.9Å; S1485-Q1525 PolarHBondContact OG-NE2 3.38Å; S1485-Q1525 VanDerWaalsContact OG-NE2 3.11Å
1486	G	83.8	Confident	88.8	Confident	1 Å²	1	17.8 Å²	17.8	1%	0.01	10%	0.099	C	C	.	.	G	3₁₀ helix	trans	-63.6	-24.6	171.1	0	0	0	0	0	115.1	H1484 S1633	H1484-G1486 PolarHBondContact ND1-N 2.94Å; H1484-G1486 VanDerWaalsContact ND1-N 3.1Å; H1484-G1486 PolarHBondContact O-N 3.42Å; H1484-G1486 VanDerWaalsContact O-N 3.13Å; G1486-S1633 PolarHBondContact O-OG 3.31Å
1487	D	89.5	Confident	88.5	Confident	0 Å²	0	19.1 Å²	19.1	0%	0	11%	0.107	C	C	.	.	G	3₁₀ helix	trans	-101.1	-1.4	177.1	-64.3	-14.6	0	0	0	112.5	V1483 H1484 S1485 P1613 F1615 L1627 M1631 V1632 S1633	V1483-D1487 HydrophobicContact CG1-CB 3.73Å; H1484-D1487 CarbonylContact O-C 3.56Å; H1484-D1487 WeakPolarHBondContact O-CA 3.49Å; H1484-D1487 WeakPolarHBondContact O-CB 3.42Å; H1484-D1487 PolarHBondContact O-N 3.16Å; S1485-D1487 VanDerWaalsContact C-N 3.26Å; S1485-D1487 PolarHBondContact O-N 3.08Å; D1487-P1613 WeakPolarHBondContact O-CG 3.31Å; D1487-F1615 HydrophobicContact CB-CE1 4.26Å; D1487-F1615 HydrophobicContact CB-CZ 4.25Å; D1487-L1627 HydrophobicContact CB-CD1 4.43Å; D1487-M1631 WeakPolarHBondContact OD1-CG 3.28Å; D1487-M1631 WeakPolarHBondContact OD2-CA 3.38Å; D1487-V1632 PolarHBondContact OD1-N 3.17Å; D1487-V1632 VanDerWaalsContact OD1-N 3.14Å; D1487-V1632 WeakPolarHBondContact OD2-CG2 3.26Å; D1487-V1632 PolarHBondContact OD2-N 3.24Å; D1487-S1633 WeakPolarHBondContact OD1-CA 3.35Å; D1487-S1633 WeakPolarHBondContact OD1-CB 3.47Å; D1487-S1633 PolarHBondContact OD1-N 3.35Å; D1487-S1633 PolarHBondContact OD1-OG 3.1Å
1488	A	90.8	Very high	88	Confident	0 Å²	0	22.5 Å²	22.5	0%	0	12%	0.124	C	C	.	.	S	Bend	trans	-89.5	147.3	-177.2	0	0	0	0	0	111.7	H1477 V1483 H1484 S1485 L1490 K1611	H1477-A1488 HydrophobicContact CB-CB 4.42Å; H1477-A1488 VanDerWaalsContact ND1-CB 3.33Å; H1477-A1488 WeakPolarHBondContact ND1-CB 3.34Å; V1483-A1488 HydrophobicContact CG1-CB 4.42Å; H1484-A1488 PolarHBondContact O-N 2.82Å; H1484-A1488 VanDerWaalsContact O-N 3.1Å; S1485-A1488 PolarHBondContact O-N 2.9Å; A1488-L1490 HydrophobicContact CB-CD2 4.3Å; A1488-K1611 WeakPolarHBondContact O-CE 3.31Å
1489	T	94.9	Very high	87.5	Confident	2 Å²	2	29.5 Å²	29.5	1%	0.012	16%	0.156	C	C	.	.	P	Polyproline II helix	trans	-79.4	118.4	167.8	-56.8	0	0	0	0	108.4	V1478 E1479 V1610 K1611 V1612 Y1648 L1798	V1478-T1489 HydrophobicContact CB-CG2 4.31Å; V1478-T1489 HydrophobicContact CG2-CG2 3.71Å; V1478-T1489 PolarHBondContact N-O 3.33Å; E1479-T1489 PolarHBondContact OE1-N 2.81Å; E1479-T1489 VanDerWaalsContact OE1-N 3.07Å; E1479-T1489 PolarHBondContact OE1-OG1 2.77Å; E1479-T1489 PolarHBondContact OE2-N 2.94Å; T1489-V1610 HydrophobicContact CG2-CG1 3.88Å; T1489-K1611 CarbonylContact C-O 3.57Å; T1489-K1611 VanDerWaalsContact CA-O 3.25Å; T1489-K1611 WeakPolarHBondContact CA-O 3.5Å; T1489-K1611 VanDerWaalsContact CG2-O 3.31Å; T1489-K1611 WeakPolarHBondContact CG2-O 3.38Å; T1489-V1612 HydrophobicContact CG2-CG2 4.14Å; T1489-Y1648 HydrophobicContact CG2-CD2 3.91Å; T1489-Y1648 HydrophobicContact CG2-CE2 3.77Å; T1489-L1798 WeakPolarHBondContact OG1-CD2 3.47Å
1490	L	94.4	Very high	87.3	Confident	1 Å²	1	34.9 Å²	34.9	1%	0.005	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	138.6	-177.6	-57.8	-178.2	0	0	0	111.4	E1476 H1477 A1488 F1548 V1610 K1611	E1476-L1490 WeakPolarHBondContact O-CA 3.37Å; H1477-L1490 WeakPolarHBondContact CD2-CD2 3.49Å; A1488-L1490 HydrophobicContact CB-CD2 4.3Å; L1490-F1548 HydrophobicContact CB-CE1 4.22Å; L1490-V1610 WeakPolarHBondContact O-CA 3.09Å; L1490-K1611 HydrophobicContact CB-CB 4.1Å; L1490-K1611 HydrophobicContact CD1-CD 4.09Å; L1490-K1611 HydrophobicContact CG-CD 4.38Å; L1490-K1611 PolarHBondContact N-O 2.84Å; L1490-K1611 PolarHBondContact O-N 3.46Å
1491	V	94.7	Very high	87.4	Confident	1 Å²	1	33.2 Å²	33.2	1%	0.006	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	130.8	173.7	-173.7	0	0	0	0	109.6	S1475 E1476 V1478 Q1495 V1608 V1610 R1644	S1475-V1491 WeakPolarHBondContact CA-O 3.23Å; E1476-V1491 HydrophobicContact CG-CB 3.85Å; E1476-V1491 HydrophobicContact CG-CG2 4.46Å; E1476-V1491 PolarHBondContact N-O 3.01Å; E1476-V1491 VanDerWaalsContact N-O 3.15Å; E1476-V1491 PolarHBondContact O-N 3.34Å; V1478-V1491 HydrophobicContact CG2-CG2 3.76Å; V1491-Q1495 HydrophobicContact CG1-CG 3.73Å; V1491-V1608 HydrophobicContact CG1-CG1 3.57Å; V1491-V1610 HydrophobicContact CG1-CG2 4.3Å; V1491-V1610 HydrophobicContact CG2-CG2 4.22Å; V1491-R1644 HydrophobicContact CG1-CB 4.09Å
1492	T	92.5	Very high	87.6	Confident	0 Å²	0	35 Å²	35	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	131.5	179.9	-61.4	0	0	0	0	111.6	S1475 F1548 V1549 T1552 L1553 G1609	S1475-T1492 VanDerWaalsContact CB-OG1 3.3Å; S1475-T1492 WeakPolarHBondContact CB-OG1 3.47Å; S1475-T1492 PolarHBondContact OG-OG1 3.41Å; T1492-F1548 WeakPolarHBondContact OG1-CE1 3.3Å; T1492-V1549 HydrophobicContact CG2-CG1 4.37Å; T1492-T1552 HydrophobicContact CG2-CG2 4.11Å; T1492-T1552 WeakPolarHBondContact O-CG2 3.24Å; T1492-L1553 HydrophobicContact CG2-CD1 4.32Å; T1492-L1553 HydrophobicContact CG2-CD2 4Å; T1492-L1553 HydrophobicContact CG2-CG 4.13Å; T1492-G1609 PolarHBondContact N-O 3.02Å; T1492-G1609 PolarHBondContact O-N 2.87Å
1493	P	89	Confident	88	Confident	22 Å²	22	41 Å²	41	14%	0.143	20%	0.204	C	C	.	.	S	Bend	cis	-63.1	161.1	-12.5	29.1	-35	0	0	0	111.7	Q1495 L1601	P1493-Q1495 PolarHBondContact O-NE2 3.26Å; P1493-Q1495 VanDerWaalsContact O-NE2 3.11Å; P1493-L1601 HydrophobicContact CB-CD2 3.97Å
1494	P	89.1	Confident	88.2	Confident	18 Å²	18	43.4 Å²	43.4	12%	0.117	22%	0.216	C	C	.	.			trans	-64.6	144.6	-174.5	27.9	-33.9	0	0	0	111.3	V1474 E1476 L1497 L1502	V1474-P1494 HydrophobicContact CB-CG 4.42Å; V1474-P1494 HydrophobicContact CG1-CG 4.18Å; V1474-P1494 WeakPolarHBondContact O-CD 3.32Å; E1476-P1494 HydrophobicContact CB-CB 4.13Å; E1476-P1494 HydrophobicContact CG-CB 4.02Å; P1494-L1497 HydrophobicContact CB-CB 4.3Å; P1494-L1497 HydrophobicContact CB-CD1 3.73Å; P1494-L1497 HydrophobicContact CB-CG 3.96Å; P1494-L1497 HydrophobicContact CG-CD1 4.04Å; P1494-L1502 HydrophobicContact CG-CD2 3.9Å
1495	Q	85.8	Confident	88.5	Confident	87 Å²	87	41.7 Å²	41.7	41%	0.407	21%	0.208	S	C	.	.	S	Bend	trans	-113.1	-22.9	-174.1	-59.9	-66.9	-67.2	0	0	113.4	E1476 V1491 P1493 V1608 R1644	E1476-Q1495 WeakPolarHBondContact OE1-CA 3.34Å; E1476-Q1495 PolarHBondContact OE1-N 2.97Å; V1491-Q1495 HydrophobicContact CG1-CG 3.73Å; P1493-Q1495 PolarHBondContact O-NE2 3.26Å; P1493-Q1495 VanDerWaalsContact O-NE2 3.11Å; Q1495-V1608 HydrophobicContact CG-CG1 4.35Å; Q1495-R1644 HydrophobicContact CG-CB 4.26Å
1496	D	84.8	Confident	88.8	Confident	90 Å²	90	43.9 Å²	43.9	48%	0.481	22%	0.215	S	C	.	.	S	Bend	trans	-106.3	2.8	178.8	-59.2	-42.8	0	0	0	114.5	K1456 E1476 R1644	K1456-D1496 IonicContact NZ-OD2 2.73Å; K1456-D1496 PolarHBondContact NZ-OD2 2.86Å; E1476-D1496 PolarHBondContact OE1-N 3.27Å; E1476-D1496 WeakPolarHBondContact OE2-CB 3.47Å; E1476-D1496 PolarHBondContact OE2-N 3.36Å; D1496-R1644 IonicContact OD1-CZ 2.68Å; D1496-R1644 VanDerWaalsContact OD1-CZ 3.31Å; D1496-R1644 IonicContact OD1-NH1 3.67Å; D1496-R1644 PolarHBondContact OD1-NH1 3.08Å; D1496-R1644 IonicContact OD1-NH2 3.9Å; D1496-R1644 PolarHBondContact OD1-NH2 3.36Å; D1496-R1644 IonicContact OD2-CZ 2.71Å; D1496-R1644 IonicContact OD2-NH1 3.49Å; D1496-R1644 PolarHBondContact OD2-NH1 3.36Å; D1496-R1644 IonicContact OD2-NH2 2.78Å
1497	L	85.6	Confident	89.1	Confident	30 Å²	30	48.2 Å²	48.2	16%	0.157	24%	0.235	C	C	.	.			trans	-89	138	177.9	-60.3	-177.8	0	0	0	111.4	I1458 V1474 P1494 L1502 I1505	I1458-L1497 HydrophobicContact CD1-CD1 3.68Å; I1458-L1497 HydrophobicContact CD1-CD2 3.78Å; I1458-L1497 HydrophobicContact CD1-CG 4.41Å; I1458-L1497 HydrophobicContact CG1-CD1 4.24Å; I1458-L1497 HydrophobicContact CG1-CD2 4.43Å; I1458-L1497 HydrophobicContact CG2-CD1 4.41Å; V1474-L1497 HydrophobicContact CG1-CD1 4.25Å; P1494-L1497 HydrophobicContact CB-CB 4.3Å; P1494-L1497 HydrophobicContact CB-CD1 3.73Å; P1494-L1497 HydrophobicContact CB-CG 3.96Å; P1494-L1497 HydrophobicContact CG-CD1 4.04Å; L1497-L1502 HydrophobicContact CB-CD2 4.35Å; L1497-L1502 HydrophobicContact CB-CG 4.29Å; L1497-L1502 HydrophobicContact CD1-CD2 4.06Å; L1497-I1505 HydrophobicContact CD1-CD1 4.34Å
1498	N	85.3	Confident	89.3	Confident	71 Å²	71	48.8 Å²	48.8	38%	0.38	24%	0.238	S	C	.	.			trans	-82.9	161	174	65.6	33	0	0	0	111.7	E1500 T1501 L1502 N1531	N1498-E1500 VanDerWaalsContact C-N 3.27Å; N1498-E1500 PolarHBondContact O-N 3.22Å; N1498-E1500 PolarHBondContact OD1-N 3.44Å; N1498-T1501 PolarHBondContact O-N 3.08Å; N1498-T1501 VanDerWaalsContact OD1-CB 3.23Å; N1498-T1501 WeakPolarHBondContact OD1-CB 3.29Å; N1498-T1501 PolarHBondContact OD1-N 2.9Å; N1498-T1501 PolarHBondContact OD1-OG1 3.3Å; N1498-L1502 PolarHBondContact O-N 2.71Å; N1498-L1502 VanDerWaalsContact O-N 3.15Å; N1498-N1531 PolarHBondContact ND2-OD1 2.89Å
1499	E	82.2	Confident	89.5	Confident	172 Å²	172	48.8 Å²	48.8	80%	0.804	24%	0.238	S	C	*	.	H	α-helix	trans	-60.6	-34.3	-178.8	-70.7	-177	172.4	0	0	113.4	L1502 K1503	E1499-L1502 PolarHBondContact O-N 2.72Å; E1499-K1503 WeakPolarHBondContact O-CB 3.31Å; E1499-K1503 PolarHBondContact O-N 2.96Å
1500	E	86.8	Confident	89.3	Confident	114 Å²	114	53.9 Å²	53.9	53%	0.533	26%	0.257	S	S	.	.	H	α-helix	trans	-62.6	-45.9	178.1	-172.5	-177.7	-178.3	0	0	111.3	N1498 K1503 L1504 N1531	N1498-E1500 VanDerWaalsContact C-N 3.27Å; N1498-E1500 PolarHBondContact O-N 3.22Å; N1498-E1500 PolarHBondContact OD1-N 3.44Å; E1500-K1503 PolarHBondContact O-N 2.75Å; E1500-L1504 WeakPolarHBondContact O-CG 3.34Å; E1500-L1504 PolarHBondContact O-N 3.41Å; E1500-N1531 PolarHBondContact OE2-ND2 3.25Å
1501	T	87.6	Confident	89.2	Confident	7 Å²	7	55.7 Å²	55.7	4%	0.043	27%	0.272	C	S	.	.	H	α-helix	trans	-64.2	-43.2	177.3	-56.5	0	0	0	0	110.7	I1458 N1498 K1503 L1504 I1505 A1528 N1531 L1533	I1458-T1501 HydrophobicContact CD1-CG2 4.42Å; N1498-T1501 PolarHBondContact O-N 3.08Å; N1498-T1501 VanDerWaalsContact OD1-CB 3.23Å; N1498-T1501 WeakPolarHBondContact OD1-CB 3.29Å; N1498-T1501 PolarHBondContact OD1-N 2.9Å; N1498-T1501 PolarHBondContact OD1-OG1 3.3Å; T1501-K1503 VanDerWaalsContact C-N 3.32Å; T1501-K1503 PolarHBondContact O-N 3.37Å; T1501-L1504 PolarHBondContact O-N 3.06Å; T1501-I1505 HydrophobicContact CG2-CD1 4.1Å; T1501-I1505 VanDerWaalsContact O-CG1 3.27Å; T1501-I1505 WeakPolarHBondContact O-CG1 3.48Å; T1501-I1505 PolarHBondContact O-N 2.96Å; T1501-A1528 HydrophobicContact CG2-CB 4.45Å; T1501-N1531 PolarHBondContact OG1-OD1 2.8Å; T1501-L1533 HydrophobicContact CG2-CD2 4Å
1502	L	87.2	Confident	89.2	Confident	47 Å²	47	55.7 Å²	55.7	25%	0.246	27%	0.272	C	S	.	.	H	α-helix	trans	-61.9	-39	176.5	-70.9	172.1	0	0	0	112.4	V1474 P1494 L1497 N1498 E1499 I1505 K1506	V1474-L1502 HydrophobicContact CG1-CD2 4.17Å; P1494-L1502 HydrophobicContact CG-CD2 3.9Å; L1497-L1502 HydrophobicContact CB-CD2 4.35Å; L1497-L1502 HydrophobicContact CB-CG 4.29Å; L1497-L1502 HydrophobicContact CD1-CD2 4.06Å; N1498-L1502 PolarHBondContact O-N 2.71Å; N1498-L1502 VanDerWaalsContact O-N 3.15Å; E1499-L1502 PolarHBondContact O-N 2.72Å; L1502-I1505 HydrophobicContact CD2-CD1 4.46Å; L1502-I1505 PolarHBondContact O-N 2.68Å; L1502-K1506 PolarHBondContact O-N 2.97Å; L1502-K1506 VanDerWaalsContact O-N 3.1Å
1503	K	87.7	Confident	89.2	Confident	136 Å²	136	55.7 Å²	55.7	59%	0.591	27%	0.272	S	S	*	.	H	α-helix	trans	-64.1	-45.6	175	-175	-178.6	174.1	-173.3	0	111.5	E1499 E1500 T1501 I1505 K1506 E1507	E1499-K1503 WeakPolarHBondContact O-CB 3.31Å; E1499-K1503 PolarHBondContact O-N 2.96Å; E1500-K1503 PolarHBondContact O-N 2.75Å; T1501-K1503 VanDerWaalsContact C-N 3.32Å; T1501-K1503 PolarHBondContact O-N 3.37Å; K1503-I1505 PolarHBondContact O-N 3.34Å; K1503-K1506 WeakPolarHBondContact O-CB 3.32Å; K1503-K1506 PolarHBondContact O-N 3.46Å; K1503-E1507 WeakPolarHBondContact CE-OE1 3.35Å; K1503-E1507 PolarHBondContact O-N 3.17Å
1504	L	90.7	Very high	89.3	Confident	60 Å²	60	60 Å²	60	31%	0.314	29%	0.294	S	S	.	.	H	α-helix	trans	-61.7	-41.3	176.8	-71.5	171.1	0	0	0	112	E1500 T1501 K1506 E1507 L1508 L1533	E1500-L1504 WeakPolarHBondContact O-CG 3.34Å; E1500-L1504 PolarHBondContact O-N 3.41Å; T1501-L1504 PolarHBondContact O-N 3.06Å; L1504-K1506 VanDerWaalsContact C-N 3.32Å; L1504-K1506 PolarHBondContact O-N 3.46Å; L1504-E1507 PolarHBondContact O-N 3.41Å; L1504-L1508 VanDerWaalsContact O-CB 3.29Å; L1504-L1508 WeakPolarHBondContact O-CB 3.28Å; L1504-L1508 PolarHBondContact O-N 3.47Å; L1504-L1533 HydrophobicContact CB-CD1 3.6Å
1505	I	92.5	Very high	89.6	Confident	0 Å²	0	63.6 Å²	63.6	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-57.5	-47.3	174	-69.2	162.8	0	0	0	110.1	I1458 V1460 V1474 L1497 T1501 L1502 K1503 E1507 L1508 V1509 L1526 L1533	I1458-I1505 HydrophobicContact CD1-CD1 3.74Å; I1458-I1505 HydrophobicContact CG2-CD1 4.08Å; V1460-I1505 HydrophobicContact CG2-CG2 3.81Å; V1474-I1505 HydrophobicContact CG1-CD1 4.33Å; V1474-I1505 HydrophobicContact CG2-CG2 4.28Å; L1497-I1505 HydrophobicContact CD1-CD1 4.34Å; T1501-I1505 HydrophobicContact CG2-CD1 4.1Å; T1501-I1505 VanDerWaalsContact O-CG1 3.27Å; T1501-I1505 WeakPolarHBondContact O-CG1 3.48Å; T1501-I1505 PolarHBondContact O-N 2.96Å; L1502-I1505 HydrophobicContact CD2-CD1 4.46Å; L1502-I1505 PolarHBondContact O-N 2.68Å; K1503-I1505 PolarHBondContact O-N 3.34Å; I1505-E1507 PolarHBondContact O-N 2.9Å; I1505-L1508 WeakPolarHBondContact O-CB 3.42Å; I1505-L1508 PolarHBondContact O-N 2.97Å; I1505-V1509 HydrophobicContact CG2-CG2 3.99Å; I1505-V1509 WeakPolarHBondContact O-CB 3.04Å; I1505-V1509 WeakPolarHBondContact O-CG2 3.42Å; I1505-V1509 PolarHBondContact O-N 3.26Å; I1505-L1526 HydrophobicContact CG1-CD1 3.98Å; I1505-L1526 HydrophobicContact CG2-CD1 4.07Å; I1505-L1533 HydrophobicContact CB-CD1 4.37Å; I1505-L1533 HydrophobicContact CG1-CD1 3.6Å; I1505-L1533 HydrophobicContact CG1-CD2 4.1Å
1506	K	89.9	Confident	89.9	Confident	62 Å²	62	59.5 Å²	59.5	27%	0.27	29%	0.29	S	S	.	.	H	α-helix	trans	-62.4	-40.8	-179.2	-165.9	-179.9	-165.1	173.7	0	112.9	M1472 L1502 K1503 L1504 R1510	M1472-K1506 HydrophobicContact CE-CB 4.09Å; M1472-K1506 HydrophobicContact CE-CG 4.12Å; L1502-K1506 PolarHBondContact O-N 2.97Å; L1502-K1506 VanDerWaalsContact O-N 3.1Å; K1503-K1506 WeakPolarHBondContact O-CB 3.32Å; K1503-K1506 PolarHBondContact O-N 3.46Å; L1504-K1506 VanDerWaalsContact C-N 3.32Å; L1504-K1506 PolarHBondContact O-N 3.46Å; K1506-R1510 WeakPolarHBondContact O-CG 3.48Å; K1506-R1510 PolarHBondContact O-N 3.12Å
1507	E	90.9	Very high	90.3	Very high	92 Å²	92	61.9 Å²	61.9	43%	0.43	30%	0.298	S	S	.	.	H	α-helix	trans	-66.8	-43.2	176.9	-71.7	173.4	-175.8	0	0	111.3	K1503 L1504 I1505 R1510 A1511	K1503-E1507 WeakPolarHBondContact CE-OE1 3.35Å; K1503-E1507 PolarHBondContact O-N 3.17Å; L1504-E1507 PolarHBondContact O-N 3.41Å; I1505-E1507 PolarHBondContact O-N 2.9Å; E1507-R1510 PolarHBondContact O-N 3.38Å; E1507-A1511 PolarHBondContact O-N 3.26Å
1508	L	93.9	Very high	90.7	Very high	12 Å²	12	60.4 Å²	60.4	6%	0.063	29%	0.291	C	S	.	.	H	α-helix	trans	-59.7	-50.2	175.4	-178.8	160.2	0	0	0	111.9	L1383 L1504 I1505 R1510 A1511 L1512 L1524 L1526 L1533 I1535	L1383-L1508 HydrophobicContact CD1-CG 4.1Å; L1383-L1508 HydrophobicContact CD2-CB 4.35Å; L1383-L1508 HydrophobicContact CD2-CD1 4.42Å; L1383-L1508 HydrophobicContact CD2-CG 3.97Å; L1504-L1508 VanDerWaalsContact O-CB 3.29Å; L1504-L1508 WeakPolarHBondContact O-CB 3.28Å; L1504-L1508 PolarHBondContact O-N 3.47Å; I1505-L1508 WeakPolarHBondContact O-CB 3.42Å; I1505-L1508 PolarHBondContact O-N 2.97Å; L1508-R1510 VanDerWaalsContact C-N 3.29Å; L1508-R1510 PolarHBondContact O-N 2.93Å; L1508-A1511 PolarHBondContact O-N 3.46Å; L1508-L1512 PolarHBondContact O-N 3.23Å; L1508-L1524 HydrophobicContact CD2-CD1 4.33Å; L1508-L1526 HydrophobicContact CD1-CD2 4.19Å; L1508-L1526 HydrophobicContact CD2-CD2 3.98Å; L1508-L1533 HydrophobicContact CD1-CB 4.15Å; L1508-L1533 HydrophobicContact CD1-CD1 4.33Å; L1508-I1535 HydrophobicContact CD1-CD1 4.13Å; L1508-I1535 HydrophobicContact CD1-CG1 3.96Å; L1508-I1535 HydrophobicContact CD2-CD1 3.87Å; L1508-I1535 HydrophobicContact CD2-CG1 4.08Å; L1508-I1535 HydrophobicContact CG-CD1 4.12Å; L1508-I1535 HydrophobicContact CG-CG1 4.41Å
1509	V	93.6	Very high	91.1	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-61.1	-39.9	-178.7	174.4	0	0	0	0	110.9	V1460 A1462 L1469 M1472 I1505 A1513 F1522 L1524	V1460-V1509 HydrophobicContact CG1-CG2 3.81Å; A1462-V1509 HydrophobicContact CB-CG1 4.11Å; L1469-V1509 HydrophobicContact CD1-CG1 3.89Å; L1469-V1509 HydrophobicContact CD2-CG1 4.16Å; M1472-V1509 HydrophobicContact SD-CB 4Å; M1472-V1509 HydrophobicContact SD-CG1 3.97Å; M1472-V1509 HydrophobicContact SD-CG2 3.79Å; I1505-V1509 HydrophobicContact CG2-CG2 3.99Å; I1505-V1509 WeakPolarHBondContact O-CB 3.04Å; I1505-V1509 WeakPolarHBondContact O-CG2 3.42Å; I1505-V1509 PolarHBondContact O-N 3.26Å; V1509-A1513 VanDerWaalsContact O-CB 3.27Å; V1509-A1513 WeakPolarHBondContact O-CB 3.38Å; V1509-A1513 PolarHBondContact O-N 3.14Å; V1509-F1522 HydrophobicContact CG1-CE2 3.98Å; V1509-F1522 HydrophobicContact CG1-CZ 3.72Å; V1509-L1524 HydrophobicContact CB-CD1 4.3Å; V1509-L1524 HydrophobicContact CG1-CD1 4.3Å; V1509-L1524 HydrophobicContact CG2-CD1 3.81Å
1510	R	91.5	Very high	91.7	Very high	109 Å²	109	49.2 Å²	49.2	41%	0.411	24%	0.237	S	C	.	.	H	α-helix	trans	-64.7	-47.1	175.8	-75.2	-178.8	-168.2	133.3	-15.4	112.2	L1469 K1506 E1507 L1508 L1512 A1513 D1514	L1469-R1510 HydrophobicContact CB-CG 4.04Å; L1469-R1510 HydrophobicContact CD2-CG 3.81Å; K1506-R1510 WeakPolarHBondContact O-CG 3.48Å; K1506-R1510 PolarHBondContact O-N 3.12Å; E1507-R1510 PolarHBondContact O-N 3.38Å; L1508-R1510 VanDerWaalsContact C-N 3.29Å; L1508-R1510 PolarHBondContact O-N 2.93Å; R1510-L1512 VanDerWaalsContact C-N 3.3Å; R1510-L1512 PolarHBondContact O-N 2.93Å; R1510-A1513 PolarHBondContact O-N 2.7Å; R1510-D1514 WeakPolarHBondContact O-CB 3.39Å; R1510-D1514 PolarHBondContact O-N 2.56Å
1511	A	92.3	Very high	92.1	Very high	39 Å²	39	43.9 Å²	43.9	32%	0.322	21%	0.212	S	C	.	.	H	α-helix	trans	-61.1	-42	-179.6	0	0	0	0	0	111.4	L1383 E1507 L1508 E1515	L1383-A1511 HydrophobicContact CD1-CB 4.44Å; E1507-A1511 PolarHBondContact O-N 3.26Å; L1508-A1511 PolarHBondContact O-N 3.46Å; A1511-E1515 WeakPolarHBondContact O-CB 3.4Å; A1511-E1515 PolarHBondContact O-N 3.36Å; A1511-E1515 VanDerWaalsContact O-N 3.11Å
1512	L	93.4	Very high	92.5	Very high	2 Å²	2	43.6 Å²	43.6	1%	0.01	21%	0.211	C	C	.	.	H	α-helix	trans	-71.6	-38.3	179.2	-171.6	63.1	0	0	0	112.8	F1374 L1377 L1378 I1381 L1383 L1508 R1510 D1514 L1516 L1524 I1535 A1538	F1374-L1512 HydrophobicContact CE2-CD1 4.12Å; F1374-L1512 HydrophobicContact CZ-CD2 4.45Å; L1377-L1512 HydrophobicContact CD2-CD1 3.73Å; L1378-L1512 HydrophobicContact CD2-CD1 3.91Å; I1381-L1512 HydrophobicContact CD1-CD1 4.12Å; L1383-L1512 HydrophobicContact CD1-CB 4.3Å; L1508-L1512 PolarHBondContact O-N 3.23Å; R1510-L1512 VanDerWaalsContact C-N 3.3Å; R1510-L1512 PolarHBondContact O-N 2.93Å; L1512-D1514 VanDerWaalsContact C-N 3.35Å; L1512-L1516 HydrophobicContact CD1-CD1 3.82Å; L1512-L1516 HydrophobicContact CD1-CG 4.37Å; L1512-L1516 HydrophobicContact CG-CD1 3.95Å; L1512-L1516 WeakPolarHBondContact O-CB 3.47Å; L1512-L1516 PolarHBondContact O-N 2.93Å; L1512-L1516 VanDerWaalsContact O-N 3.1Å; L1512-L1524 HydrophobicContact CD2-CD1 3.92Å; L1512-L1524 HydrophobicContact CD2-CD2 3.3Å; L1512-L1524 HydrophobicContact CD2-CG 4.27Å; L1512-I1535 HydrophobicContact CD2-CD1 4.5Å; L1512-A1538 HydrophobicContact CD2-CB 4.11Å
1513	A	93	Very high	92.9	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-62	-44.2	175.5	0	0	0	0	0	111.4	A1464 G1467 V1509 R1510 E1517 V1518 F1522	A1464-A1513 HydrophobicContact CB-CB 4.01Å; G1467-A1513 WeakPolarHBondContact CA-O 3.34Å; G1467-A1513 CarbonylContact O-C 3.54Å; G1467-A1513 WeakPolarHBondContact O-CB 3.48Å; V1509-A1513 VanDerWaalsContact O-CB 3.27Å; V1509-A1513 WeakPolarHBondContact O-CB 3.38Å; V1509-A1513 PolarHBondContact O-N 3.14Å; R1510-A1513 PolarHBondContact O-N 2.7Å; A1513-E1517 PolarHBondContact O-N 3.09Å; A1513-E1517 VanDerWaalsContact O-N 3.11Å; A1513-V1518 PolarHBondContact O-N 2.99Å; A1513-V1518 VanDerWaalsContact O-N 3.08Å; A1513-F1522 HydrophobicContact CB-CE1 4.3Å; A1513-F1522 HydrophobicContact CB-CZ 3.83Å
1514	D	92.6	Very high	93.2	Very high	111 Å²	111	35.1 Å²	35.1	59%	0.594	17%	0.172	S	C	*	.	H	α-helix	trans	-59.9	-51.1	177.8	-162.4	49.2	0	0	0	111.2	G1467 R1510 L1512 L1516 E1517	G1467-D1514 PolarHBondContact O-N 3.42Å; R1510-D1514 WeakPolarHBondContact O-CB 3.39Å; R1510-D1514 PolarHBondContact O-N 2.56Å; L1512-D1514 VanDerWaalsContact C-N 3.35Å; D1514-L1516 PolarHBondContact O-N 2.69Å; D1514-E1517 PolarHBondContact O-N 3.47Å; D1514-E1517 VanDerWaalsContact O-N 3.11Å
1515	E	93.7	Very high	93.3	Very high	94 Å²	94	33 Å²	33	44%	0.439	16%	0.161	S	C	.	.	H	α-helix	trans	-64.5	-35.7	-178.5	-174.2	65.3	-159.5	0	0	113.7	L1377 I1381 A1511 E1517	L1377-E1515 HydrophobicContact CD1-CG 3.9Å; L1377-E1515 HydrophobicContact CD2-CB 4.46Å; L1377-E1515 HydrophobicContact CD2-CG 3.75Å; L1377-E1515 HydrophobicContact CG-CG 3.63Å; I1381-E1515 HydrophobicContact CD1-CB 4.28Å; I1381-E1515 HydrophobicContact CD1-CG 4.36Å; I1381-E1515 HydrophobicContact CG2-CB 4.08Å; I1381-E1515 HydrophobicContact CG2-CG 3.71Å; I1381-E1515 WeakPolarHBondContact CG2-OE2 3.44Å; A1511-E1515 WeakPolarHBondContact O-CB 3.4Å; A1511-E1515 PolarHBondContact O-N 3.36Å; A1511-E1515 VanDerWaalsContact O-N 3.11Å; E1515-E1517 VanDerWaalsContact C-N 3.31Å
1516	L	93.7	Very high	93.4	Very high	2 Å²	2	33 Å²	33	1%	0.01	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.5	0.9	177.4	-72.4	168.8	0	0	0	113.2	S1364 N1367 A1368 L1377 L1512 D1514 V1518 L1540	S1364-L1516 WeakPolarHBondContact CB-O 3.32Å; S1364-L1516 PolarHBondContact OG-O 3.29Å; N1367-L1516 HydrophobicContact CB-CD2 4.25Å; A1368-L1516 HydrophobicContact CB-CD1 4.3Å; A1368-L1516 HydrophobicContact CB-CD2 4.46Å; L1377-L1516 HydrophobicContact CD1-CD2 3.47Å; L1377-L1516 VanDerWaalsContact CD1-CD2 3.47Å; L1377-L1516 HydrophobicContact CD1-CG 4.04Å; L1512-L1516 HydrophobicContact CD1-CD1 3.82Å; L1512-L1516 HydrophobicContact CD1-CG 4.37Å; L1512-L1516 HydrophobicContact CG-CD1 3.95Å; L1512-L1516 WeakPolarHBondContact O-CB 3.47Å; L1512-L1516 PolarHBondContact O-N 2.93Å; L1512-L1516 VanDerWaalsContact O-N 3.1Å; D1514-L1516 PolarHBondContact O-N 2.69Å; L1516-V1518 HydrophobicContact CB-CG2 3.63Å; L1516-V1518 PolarHBondContact O-N 3.23Å; L1516-L1540 HydrophobicContact CB-CD1 4.44Å; L1516-L1540 HydrophobicContact CD1-CD1 4.18Å; L1516-L1540 HydrophobicContact CD1-CD2 4.04Å; L1516-L1540 HydrophobicContact CD1-CG 4.47Å; L1516-L1540 HydrophobicContact CD2-CD1 4.35Å
1517	E	91.9	Very high	93.5	Very high	139 Å²	139	30.7 Å²	30.7	65%	0.65	15%	0.151	S	C	*	.	T	Hydrogen-bonded Turn	trans	50	38.3	-176.4	-60.3	-174.7	172	0	0	113.2	A1513 D1514 E1515 S1519	A1513-E1517 PolarHBondContact O-N 3.09Å; A1513-E1517 VanDerWaalsContact O-N 3.11Å; D1514-E1517 PolarHBondContact O-N 3.47Å; D1514-E1517 VanDerWaalsContact O-N 3.11Å; E1515-E1517 VanDerWaalsContact C-N 3.31Å; E1517-S1519 PolarHBondContact O-N 3.3Å; E1517-S1519 PolarHBondContact O-OG 2.87Å
1518	V	94	Very high	93.5	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.136	C	C	.	.			trans	-60.4	130.1	-168.2	-177.1	0	0	0	0	111.5	A1464 Q1465 S1466 G1467 A1513 L1516 F1522 L1540	A1464-V1518 CarbonylContact C-O 3.59Å; A1464-V1518 VanDerWaalsContact C-O 3.31Å; A1464-V1518 HydrophobicContact CB-CB 4.02Å; A1464-V1518 HydrophobicContact CB-CG1 4.16Å; Q1465-V1518 CarbonylContact C-O 3.57Å; Q1465-V1518 PolarHBondContact N-O 2.76Å; S1466-V1518 PolarHBondContact N-O 2.72Å; S1466-V1518 VanDerWaalsContact N-O 3.12Å; G1467-V1518 PolarHBondContact N-O 3.47Å; A1513-V1518 PolarHBondContact O-N 2.99Å; A1513-V1518 VanDerWaalsContact O-N 3.08Å; L1516-V1518 HydrophobicContact CB-CG2 3.63Å; L1516-V1518 PolarHBondContact O-N 3.23Å; V1518-F1522 HydrophobicContact CB-CD1 4.43Å; V1518-F1522 HydrophobicContact CG1-CB 4.15Å; V1518-F1522 HydrophobicContact CG1-CD1 3.59Å; V1518-F1522 HydrophobicContact CG1-CE1 4.22Å; V1518-F1522 HydrophobicContact CG1-CG 4.04Å; V1518-L1540 HydrophobicContact CG1-CD2 4.32Å; V1518-L1540 HydrophobicContact CG2-CD2 3.56Å
1519	S	94	Very high	93.1	Very high	8 Å²	8	30.4 Å²	30.4	6%	0.056	15%	0.15	C	C	.	.			trans	-132.6	82.2	178.5	-65	0	0	0	0	110.4	G1359 T1360 A1464 S1466 E1517 I1565	G1359-S1519 CarbonylContact C-O 3.53Å; G1359-S1519 VanDerWaalsContact C-O 3.27Å; G1359-S1519 WeakPolarHBondContact CA-O 3.36Å; T1360-S1519 PolarHBondContact N-O 3.01Å; T1360-S1519 PolarHBondContact OG1-N 3.47Å; A1464-S1519 CarbonylContact O-C 3.59Å; A1464-S1519 WeakPolarHBondContact O-CA 3.38Å; S1466-S1519 WeakPolarHBondContact CA-OG 3.49Å; S1466-S1519 PolarHBondContact N-OG 3.46Å; E1517-S1519 PolarHBondContact O-N 3.3Å; E1517-S1519 PolarHBondContact O-OG 2.87Å; S1519-I1565 WeakPolarHBondContact O-CG1 3.44Å
1520	G	94.4	Very high	92.6	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	140.9	-158	-173.5	0	0	0	0	0	112.1	V1463 A1464	V1463-G1520 WeakPolarHBondContact CA-O 3.16Å; A1464-G1520 PolarHBondContact N-O 2.92Å; A1464-G1520 VanDerWaalsContact N-O 3.07Å; A1464-G1520 PolarHBondContact O-N 3.14Å
1521	P	96.1	Very high	92.1	Very high	1 Å²	1	34.4 Å²	34.4	1%	0.006	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	146.3	179.6	32.2	-26	0	0	0	110.8	M1338 A1462 L1540 R1541 V1542 F1546 A1561	M1338-P1521 HydrophobicContact CE-CG 4.17Å; A1462-P1521 WeakPolarHBondContact O-CA 3.49Å; P1521-L1540 CarbonylContact O-C 3.5Å; P1521-R1541 PolarHBondContact O-N 3.39Å; P1521-V1542 HydrophobicContact CB-CG1 3.73Å; P1521-V1542 HydrophobicContact CG-CG1 3.47Å; P1521-V1542 VanDerWaalsContact CG-CG1 3.47Å; P1521-F1546 HydrophobicContact CB-CE1 3.93Å; P1521-F1546 HydrophobicContact CB-CE2 4.41Å; P1521-F1546 HydrophobicContact CB-CZ 3.68Å; P1521-A1561 HydrophobicContact CB-CB 3.93Å; P1521-A1561 HydrophobicContact CG-CB 3.98Å
1522	F	95.9	Very high	91.9	Very high	2 Å²	2	41.8 Å²	41.8	1%	0.009	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	157.6	169.2	68.7	-72.8	0	0	0	110.7	A1462 A1464 L1469 V1509 A1513 V1518 L1524 N1539 L1540 R1541	A1462-F1522 HydrophobicContact CB-CD1 3.95Å; A1462-F1522 HydrophobicContact CB-CD2 4.43Å; A1462-F1522 HydrophobicContact CB-CE1 3.36Å; A1462-F1522 HydrophobicContact CB-CE2 3.91Å; A1462-F1522 HydrophobicContact CB-CG 4.47Å; A1462-F1522 HydrophobicContact CB-CZ 3.34Å; A1462-F1522 PolarHBondContact N-O 3.3Å; A1462-F1522 WeakPolarHBondContact O-CD1 3.43Å; A1462-F1522 PolarHBondContact O-N 3.15Å; A1462-F1522 VanDerWaalsContact O-O 3.09Å; A1464-F1522 HydrophobicContact CB-CD1 4.46Å; A1464-F1522 HydrophobicContact CB-CE1 3.78Å; L1469-F1522 HydrophobicContact CD1-CE1 4.37Å; L1469-F1522 HydrophobicContact CD1-CZ 4.23Å; V1509-F1522 HydrophobicContact CG1-CE2 3.98Å; V1509-F1522 HydrophobicContact CG1-CZ 3.72Å; A1513-F1522 HydrophobicContact CB-CE1 4.3Å; A1513-F1522 HydrophobicContact CB-CZ 3.83Å; V1518-F1522 HydrophobicContact CB-CD1 4.43Å; V1518-F1522 HydrophobicContact CG1-CB 4.15Å; V1518-F1522 HydrophobicContact CG1-CD1 3.59Å; V1518-F1522 HydrophobicContact CG1-CE1 4.22Å; V1518-F1522 HydrophobicContact CG1-CG 4.04Å; F1522-L1524 HydrophobicContact CD2-CD1 4.32Å; F1522-L1524 HydrophobicContact CD2-CD2 4.19Å; F1522-L1524 HydrophobicContact CD2-CG 3.99Å; F1522-L1524 HydrophobicContact CE2-CD1 3.82Å; F1522-L1524 HydrophobicContact CE2-CD2 4.46Å; F1522-L1524 HydrophobicContact CE2-CG 4.01Å; F1522-N1539 CarbonylContact C-O 3.5Å; F1522-N1539 VanDerWaalsContact CA-O 3.27Å; F1522-N1539 WeakPolarHBondContact CA-O 3.48Å; F1522-L1540 HydrophobicContact CB-CD2 3.81Å; F1522-L1540 HydrophobicContact CG-CD2 4.48Å; F1522-R1541 WeakPolarHBondContact CA-O 3.39Å
1523	N	95.4	Very high	91.8	Very high	4 Å²	4	42.8 Å²	42.8	2%	0.021	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	139.6	-177.9	169.7	-94.9	0	0	0	110.5	D1459 V1460 D1461 A1538 N1539	D1459-N1523 PolarHBondContact OD1-ND2 2.83Å; V1460-N1523 CarbonylContact O-C 3.44Å; V1460-N1523 WeakPolarHBondContact O-CA 3.49Å; D1461-N1523 PolarHBondContact OD1-ND2 3.44Å; N1523-A1538 WeakPolarHBondContact O-CA 3.26Å; N1523-N1539 HydrophobicContact CB-CB 4.37Å; N1523-N1539 PolarHBondContact N-O 3.24Å; N1523-N1539 PolarHBondContact O-N 2.91Å
1524	L	94.3	Very high	91.8	Very high	1 Å²	1	44.7 Å²	44.7	1%	0.005	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	137	-179.4	-58.7	176.5	0	0	0	111.1	V1460 L1508 V1509 L1512 F1522 A1538	V1460-L1524 HydrophobicContact CB-CB 4.27Å; V1460-L1524 PolarHBondContact N-O 2.95Å; V1460-L1524 PolarHBondContact O-N 3.3Å; L1508-L1524 HydrophobicContact CD2-CD1 4.33Å; V1509-L1524 HydrophobicContact CB-CD1 4.3Å; V1509-L1524 HydrophobicContact CG1-CD1 4.3Å; V1509-L1524 HydrophobicContact CG2-CD1 3.81Å; L1512-L1524 HydrophobicContact CD2-CD1 3.92Å; L1512-L1524 HydrophobicContact CD2-CD2 3.3Å; L1512-L1524 HydrophobicContact CD2-CG 4.27Å; F1522-L1524 HydrophobicContact CD2-CD1 4.32Å; F1522-L1524 HydrophobicContact CD2-CD2 4.19Å; F1522-L1524 HydrophobicContact CD2-CG 3.99Å; F1522-L1524 HydrophobicContact CE2-CD1 3.82Å; F1522-L1524 HydrophobicContact CE2-CD2 4.46Å; F1522-L1524 HydrophobicContact CE2-CG 4.01Å; L1524-A1538 HydrophobicContact CD2-CB 3.29Å
1525	Q	92.8	Very high	91.8	Very high	16 Å²	16	39.4 Å²	39.4	8%	0.075	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	125.3	174.4	-66.4	177.4	-9.4	0	0	110.2	S1485 I1536 E1537	S1485-Q1525 PolarHBondContact OG-NE2 3.38Å; S1485-Q1525 VanDerWaalsContact OG-NE2 3.11Å; Q1525-I1536 HydrophobicContact CB-CB 4.1Å; Q1525-I1536 HydrophobicContact CB-CD1 4.27Å; Q1525-I1536 WeakPolarHBondContact O-CB 3.36Å; Q1525-I1536 PolarHBondContact O-N 3.27Å; Q1525-E1537 HydrophobicContact CB-CG 4.17Å; Q1525-E1537 HydrophobicContact CG-CG 4.3Å; Q1525-E1537 PolarHBondContact N-O 2.84Å; Q1525-E1537 PolarHBondContact OE1-OE1 2.88Å
1526	L	94.6	Very high	91.5	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	146.5	-173.7	-50.7	175.7	0	0	0	111.2	E1457 I1458 V1460 I1505 L1508 L1534 I1535	E1457-L1526 CarbonylContact C-O 3.46Å; E1457-L1526 WeakPolarHBondContact CA-O 3.42Å; I1458-L1526 HydrophobicContact CB-CB 4.31Å; I1458-L1526 PolarHBondContact N-O 2.97Å; I1458-L1526 PolarHBondContact O-N 2.9Å; V1460-L1526 HydrophobicContact CG2-CD1 3.98Å; I1505-L1526 HydrophobicContact CG1-CD1 3.98Å; I1505-L1526 HydrophobicContact CG2-CD1 4.07Å; L1508-L1526 HydrophobicContact CD1-CD2 4.19Å; L1508-L1526 HydrophobicContact CD2-CD2 3.98Å; L1526-L1534 CarbonylContact C-O 3.54Å; L1526-L1534 WeakPolarHBondContact CA-O 3.39Å; L1526-I1535 HydrophobicContact CD2-CB 4.29Å; L1526-I1535 HydrophobicContact CD2-CG1 3.67Å
1527	L	92.4	Very high	91.3	Very high	13 Å²	13	37 Å²	37	7%	0.068	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	125.9	164.8	-62.2	174.5	0	0	0	109.7	P1386 I1452 A1455 E1457 A1481 L1533 L1534 I1536	P1386-L1527 HydrophobicContact CG-CD1 4.19Å; I1452-L1527 HydrophobicContact CB-CD1 4.23Å; I1452-L1527 HydrophobicContact CD1-CD1 4.01Å; I1452-L1527 HydrophobicContact CG1-CD1 4.41Å; A1455-L1527 HydrophobicContact CB-CB 4.4Å; A1455-L1527 HydrophobicContact CB-CD2 4.23Å; E1457-L1527 HydrophobicContact CB-CD2 4.43Å; E1457-L1527 HydrophobicContact CG-CD2 4.49Å; A1481-L1527 HydrophobicContact CB-CD2 3.35Å; L1527-L1533 CarbonylContact O-C 3.5Å; L1527-L1533 VanDerWaalsContact O-CA 3.32Å; L1527-L1533 WeakPolarHBondContact O-CA 3.43Å; L1527-L1534 HydrophobicContact CB-CB 4.29Å; L1527-L1534 PolarHBondContact N-O 2.97Å; L1527-L1534 PolarHBondContact O-N 3.39Å; L1527-I1536 HydrophobicContact CD1-CD1 4.38Å; L1527-I1536 HydrophobicContact CD1-CG1 4.25Å; L1527-I1536 HydrophobicContact CD2-CD1 3.71Å; L1527-I1536 HydrophobicContact CD2-CG1 4.37Å; L1527-I1536 HydrophobicContact CG-CD1 3.7Å; L1527-I1536 HydrophobicContact CG-CG1 3.79Å
1528	A	90.3	Very high	91.3	Very high	13 Å²	13	30.4 Å²	30.4	11%	0.107	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	124.7	171.5	0	0	0	0	0	110.8	K1456 I1458 T1501 R1532 L1533	K1456-A1528 PolarHBondContact N-O 3.32Å; K1456-A1528 PolarHBondContact O-N 3.5Å; I1458-A1528 HydrophobicContact CD1-CB 3.49Å; I1458-A1528 VanDerWaalsContact CD1-CB 3.49Å; I1458-A1528 HydrophobicContact CG1-CB 4.21Å; T1501-A1528 HydrophobicContact CG2-CB 4.45Å; A1528-R1532 WeakPolarHBondContact CA-O 3.24Å; A1528-L1533 HydrophobicContact CB-CD2 3.85Å
1529	K	85.9	Confident	91.2	Very high	84 Å²	84	31.1 Å²	31.1	37%	0.365	15%	0.149	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	127.6	172.5	-168.5	172.7	-177.1	176.1	0	109.7	I1452 L1453 A1455 N1531 R1532	I1452-K1529 HydrophobicContact CG2-CD 4.33Å; L1453-K1529 PolarHBondContact O-NZ 3.47Å; A1455-K1529 HydrophobicContact CB-CB 4.29Å; A1455-K1529 HydrophobicContact CB-CD 4.31Å; K1529-N1531 VanDerWaalsContact C-N 3.33Å; K1529-N1531 PolarHBondContact O-N 3.28Å; K1529-R1532 PolarHBondContact N-O 2.74Å; K1529-R1532 WeakPolarHBondContact O-CB 3.31Å; K1529-R1532 PolarHBondContact O-N 2.9Å
1530	D	83.1	Confident	91.2	Very high	130 Å²	130	30.9 Å²	30.9	70%	0.695	15%	0.147	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.2	46.2	178.9	-52.5	-40.5	0	0	0	113.4	R1532	D1530-R1532 PolarHBondContact O-N 2.98Å; D1530-R1532 VanDerWaalsContact O-N 3.08Å
1531	N	81.2	Confident	91.3	Very high	64 Å²	64	31.8 Å²	31.8	34%	0.342	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.8	14.1	-173.7	-68.8	-7.8	0	0	0	115.3	N1498 E1500 T1501 K1529	N1498-N1531 PolarHBondContact ND2-OD1 2.89Å; E1500-N1531 PolarHBondContact OE2-ND2 3.25Å; T1501-N1531 PolarHBondContact OG1-OD1 2.8Å; K1529-N1531 VanDerWaalsContact C-N 3.33Å; K1529-N1531 PolarHBondContact O-N 3.28Å
1532	R	86.8	Confident	91.2	Very high	194 Å²	194	31.8 Å²	31.8	73%	0.732	15%	0.15	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-98	135.3	170.1	-62.5	-177.9	177.1	-174.5	-2.2	110.1	A1528 K1529 D1530	A1528-R1532 WeakPolarHBondContact CA-O 3.24Å; K1529-R1532 PolarHBondContact N-O 2.74Å; K1529-R1532 WeakPolarHBondContact O-CB 3.31Å; K1529-R1532 PolarHBondContact O-N 2.9Å; D1530-R1532 PolarHBondContact O-N 2.98Å; D1530-R1532 VanDerWaalsContact O-N 3.08Å
1533	L	91.7	Very high	91	Very high	22 Å²	22	32.2 Å²	32.2	12%	0.115	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	134.5	176.3	-63.8	175.4	0	0	0	109.9	I1458 T1501 L1504 I1505 L1508 L1527 A1528	I1458-L1533 HydrophobicContact CD1-CD2 4.49Å; T1501-L1533 HydrophobicContact CG2-CD2 4Å; L1504-L1533 HydrophobicContact CB-CD1 3.6Å; I1505-L1533 HydrophobicContact CB-CD1 4.37Å; I1505-L1533 HydrophobicContact CG1-CD1 3.6Å; I1505-L1533 HydrophobicContact CG1-CD2 4.1Å; L1508-L1533 HydrophobicContact CD1-CB 4.15Å; L1508-L1533 HydrophobicContact CD1-CD1 4.33Å; L1527-L1533 CarbonylContact O-C 3.5Å; L1527-L1533 VanDerWaalsContact O-CA 3.32Å; L1527-L1533 WeakPolarHBondContact O-CA 3.43Å; A1528-L1533 HydrophobicContact CB-CD2 3.85Å
1534	L	93	Very high	90.6	Very high	40 Å²	40	33.1 Å²	33.1	21%	0.209	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	129.8	174.3	-56	171.4	0	0	0	109.2	S1384 I1452 L1526 L1527	S1384-L1534 VanDerWaalsContact CB-CD2 3.44Å; S1384-L1534 CarbonylContact O-C 3.57Å; S1384-L1534 WeakPolarHBondContact O-CA 3.38Å; I1452-L1534 HydrophobicContact CD1-CD1 3.16Å; L1526-L1534 CarbonylContact C-O 3.54Å; L1526-L1534 WeakPolarHBondContact CA-O 3.39Å; L1527-L1534 HydrophobicContact CB-CB 4.29Å; L1527-L1534 PolarHBondContact N-O 2.97Å; L1527-L1534 PolarHBondContact O-N 3.39Å
1535	I	92.7	Very high	90.5	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	128.8	178.5	-61	169.6	0	0	0	109.5	F1374 L1378 L1383 S1384 Q1385 P1386 L1508 L1512 L1526	F1374-I1535 HydrophobicContact CE1-CG2 3.9Å; F1374-I1535 HydrophobicContact CZ-CG2 3.92Å; L1378-I1535 HydrophobicContact CD1-CB 4.04Å; L1378-I1535 HydrophobicContact CD1-CD1 4.2Å; L1378-I1535 HydrophobicContact CD1-CG2 4.15Å; L1378-I1535 HydrophobicContact CD2-CD1 3.59Å; L1383-I1535 HydrophobicContact CB-CD1 3.87Å; L1383-I1535 HydrophobicContact CD1-CD1 3.78Å; L1383-I1535 HydrophobicContact CG-CD1 4.4Å; S1384-I1535 PolarHBondContact O-N 2.99Å; Q1385-I1535 VanDerWaalsContact CB-O 3.31Å; Q1385-I1535 WeakPolarHBondContact CB-O 3.27Å; P1386-I1535 WeakPolarHBondContact CD-O 3.49Å; L1508-I1535 HydrophobicContact CD1-CD1 4.13Å; L1508-I1535 HydrophobicContact CD1-CG1 3.96Å; L1508-I1535 HydrophobicContact CD2-CD1 3.87Å; L1508-I1535 HydrophobicContact CD2-CG1 4.08Å; L1508-I1535 HydrophobicContact CG-CD1 4.12Å; L1508-I1535 HydrophobicContact CG-CG1 4.41Å; L1512-I1535 HydrophobicContact CD2-CD1 4.5Å; L1526-I1535 HydrophobicContact CD2-CB 4.29Å; L1526-I1535 HydrophobicContact CD2-CG1 3.67Å
1536	I	87.6	Confident	90.6	Very high	26 Å²	26	32.4 Å²	32.4	13%	0.133	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	-57.3	173.3	-54.2	178.6	0	0	0	109.2	R1371 E1457 Q1525 L1527	R1371-I1536 PolarHBondContact NH1-O 3.07Å; E1457-I1536 HydrophobicContact CG-CD1 4.21Å; Q1525-I1536 HydrophobicContact CB-CB 4.1Å; Q1525-I1536 HydrophobicContact CB-CD1 4.27Å; Q1525-I1536 WeakPolarHBondContact O-CB 3.36Å; Q1525-I1536 PolarHBondContact O-N 3.27Å; L1527-I1536 HydrophobicContact CD1-CD1 4.38Å; L1527-I1536 HydrophobicContact CD1-CG1 4.25Å; L1527-I1536 HydrophobicContact CD2-CD1 3.71Å; L1527-I1536 HydrophobicContact CD2-CG1 4.37Å; L1527-I1536 HydrophobicContact CG-CD1 3.7Å; L1527-I1536 HydrophobicContact CG-CG1 3.79Å
1537	E	89.2	Confident	90.5	Very high	20 Å²	20	32.4 Å²	32.4	9%	0.093	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.7	164.6	-177.7	61.6	177.3	-137.2	0	0	111.9	V1415 Q1525 N1539	V1415-E1537 WeakPolarHBondContact CG1-OE2 3.44Å; Q1525-E1537 HydrophobicContact CB-CG 4.17Å; Q1525-E1537 HydrophobicContact CG-CG 4.3Å; Q1525-E1537 PolarHBondContact N-O 2.84Å; Q1525-E1537 PolarHBondContact OE1-OE1 2.88Å; E1537-N1539 PolarHBondContact OE1-ND2 3.34Å
1538	A	91.6	Very high	90.6	Very high	1 Å²	1	31.8 Å²	31.8	1%	0.008	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	124.7	174.3	0	0	0	0	0	109.9	F1374 L1512 N1523 L1524	F1374-A1538 HydrophobicContact CE1-CB 4.49Å; F1374-A1538 HydrophobicContact CE2-CB 3.69Å; F1374-A1538 HydrophobicContact CZ-CB 3.52Å; L1512-A1538 HydrophobicContact CD2-CB 4.11Å; N1523-A1538 WeakPolarHBondContact O-CA 3.26Å; L1524-A1538 HydrophobicContact CD2-CB 3.29Å
1539	N	92.7	Very high	90.7	Very high	15 Å²	15	31.2 Å²	31.2	8%	0.08	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	111	178.6	-65.4	-61.4	0	0	0	108.3	F1522 N1523 E1537 R1541	F1522-N1539 CarbonylContact C-O 3.5Å; F1522-N1539 VanDerWaalsContact CA-O 3.27Å; F1522-N1539 WeakPolarHBondContact CA-O 3.48Å; N1523-N1539 HydrophobicContact CB-CB 4.37Å; N1523-N1539 PolarHBondContact N-O 3.24Å; N1523-N1539 PolarHBondContact O-N 2.91Å; E1537-N1539 PolarHBondContact OE1-ND2 3.34Å; N1539-R1541 HydrophobicContact CB-CG 4.32Å; N1539-R1541 PolarHBondContact O-N 3.04Å
1540	L	94.8	Very high	90.9	Very high	2 Å²	2	27.5 Å²	27.5	1%	0.01	13%	0.13	C	C	.	.	S	Bend	trans	-81.9	53.6	-178.2	-65.6	-179.8	0	0	0	112.4	T1360 S1364 I1365 A1368 L1516 V1518 P1521 F1522	T1360-L1540 HydrophobicContact CG2-CB 4.42Å; T1360-L1540 HydrophobicContact CG2-CD1 3.89Å; S1364-L1540 VanDerWaalsContact C-CD1 3.47Å; S1364-L1540 WeakPolarHBondContact O-CD1 3.23Å; I1365-L1540 HydrophobicContact CG1-CB 4.19Å; A1368-L1540 HydrophobicContact CB-CD1 3.59Å; A1368-L1540 HydrophobicContact CB-CG 3.78Å; L1516-L1540 HydrophobicContact CB-CD1 4.44Å; L1516-L1540 HydrophobicContact CD1-CD1 4.18Å; L1516-L1540 HydrophobicContact CD1-CD2 4.04Å; L1516-L1540 HydrophobicContact CD1-CG 4.47Å; L1516-L1540 HydrophobicContact CD2-CD1 4.35Å; V1518-L1540 HydrophobicContact CG1-CD2 4.32Å; V1518-L1540 HydrophobicContact CG2-CD2 3.56Å; P1521-L1540 CarbonylContact O-C 3.5Å; F1522-L1540 HydrophobicContact CB-CD2 3.81Å; F1522-L1540 HydrophobicContact CG-CD2 4.48Å
1541	R	94.5	Very high	91.2	Very high	19 Å²	19	22.1 Å²	22.1	7%	0.072	10%	0.1	C	C	.	.	S	Bend	trans	-159.3	176.6	-178.9	54.3	175.6	173.8	102.8	-5.3	110.1	S1337 G1340 Q1341 P1521 F1522 N1539	S1337-R1541 WeakPolarHBondContact O-CB 3.37Å; G1340-R1541 VanDerWaalsContact CA-NH1 3.27Å; G1340-R1541 VanDerWaalsContact O-CD 3.29Å; G1340-R1541 WeakPolarHBondContact O-CD 3.39Å; Q1341-R1541 VanDerWaalsContact OE1-CZ 3.29Å; Q1341-R1541 VanDerWaalsContact OE1-NE 3.13Å; P1521-R1541 PolarHBondContact O-N 3.39Å; F1522-R1541 WeakPolarHBondContact CA-O 3.39Å; N1539-R1541 HydrophobicContact CB-CG 4.32Å; N1539-R1541 PolarHBondContact O-N 3.04Å
1542	V	94.1	Very high	91.5	Very high	1 Å²	1	19 Å²	19	1%	0.006	8%	0.084	C	C	.	.			trans	-62.3	154.5	168.5	-58.2	0	0	0	0	111.3	F1274 C1277 S1337 M1338 P1521 F1546 I1558	F1274-V1542 HydrophobicContact CD1-CG2 3.64Å; F1274-V1542 HydrophobicContact CE1-CG2 3.87Å; F1274-V1542 WeakPolarHBondContact CE1-O 3.17Å; C1277-V1542 HydrophobicContact CB-CB 4.24Å; C1277-V1542 HydrophobicContact CB-CG1 4.08Å; C1277-V1542 HydrophobicContact CB-CG2 3.82Å; S1337-V1542 WeakPolarHBondContact O-CG2 3.49Å; S1337-V1542 PolarHBondContact O-N 2.7Å; M1338-V1542 WeakPolarHBondContact O-CG2 3.09Å; M1338-V1542 HydrophobicContact SD-CG1 3.65Å; P1521-V1542 HydrophobicContact CB-CG1 3.73Å; P1521-V1542 HydrophobicContact CG-CG1 3.47Å; P1521-V1542 VanDerWaalsContact CG-CG1 3.47Å; V1542-F1546 HydrophobicContact CB-CD2 4.21Å; V1542-F1546 HydrophobicContact CB-CG 4.43Å; V1542-I1558 HydrophobicContact CG1-CD1 3.6Å
1543	S	92	Very high	91.4	Very high	11 Å²	11	10.4 Å²	10.4	8%	0.077	5%	0.052	C	C	.	.			trans	-115.2	176.1	175.4	81.8	0	0	0	0	110.9	D1461 S1545 F1546	D1461-S1543 WeakPolarHBondContact OD1-CB 3.22Å; D1461-S1543 PolarHBondContact OD1-OG 3.44Å; S1543-S1545 VanDerWaalsContact C-N 3.27Å; S1543-S1545 PolarHBondContact O-N 3.26Å; S1543-S1545 PolarHBondContact OG-N 3.2Å; S1543-S1545 VanDerWaalsContact OG-N 3.16Å; S1543-S1545 PolarHBondContact OG-OG 3.04Å; S1543-F1546 VanDerWaalsContact OG-CD2 3.31Å; S1543-F1546 WeakPolarHBondContact OG-CD2 3.26Å
1544	R	87.7	Confident	90.9	Very high	24 Å²	24	15.5 Å²	15.5	9%	0.091	7%	0.073	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-26.2	174.1	-73.9	175.2	155.4	-106.8	-8.8	113.3	G1269 E1273 F1274 P1547 M1631	G1269-R1544 VanDerWaalsContact C-NE 3.31Å; G1269-R1544 PolarHBondContact O-NE 2.97Å; G1269-R1544 PolarHBondContact O-NH2 3.02Å; E1273-R1544 HydrophobicContact CB-CB 4.42Å; E1273-R1544 HydrophobicContact CB-CG 4.33Å; E1273-R1544 HydrophobicContact CG-CB 3.91Å; E1273-R1544 HydrophobicContact CG-CG 3.94Å; E1273-R1544 IonicContact OE1-CZ 2.73Å; E1273-R1544 IonicContact OE1-NE 3.44Å; E1273-R1544 IonicContact OE1-NH1 3.88Å; E1273-R1544 PolarHBondContact OE1-NH1 3.19Å; E1273-R1544 IonicContact OE1-NH2 2.8Å; E1273-R1544 IonicContact OE2-CZ 2.74Å; E1273-R1544 IonicContact OE2-NH2 2.68Å; F1274-R1544 HydrophobicContact CE2-CG 4.09Å; F1274-R1544 HydrophobicContact CZ-CG 4.23Å; R1544-P1547 WeakPolarHBondContact O-CD 3.29Å; R1544-M1631 VanDerWaalsContact NH1-CE 3.27Å
1545	S	91.8	Very high	90.4	Very high	2 Å²	2	15.2 Å²	15.2	1%	0.014	7%	0.07	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84	-14.3	-177.8	44.2	0	0	0	0	113.2	D1461 S1543 F1548 V1549	D1461-S1545 VanDerWaalsContact CG-OG 3.26Å; D1461-S1545 PolarHBondContact OD1-OG 2.83Å; D1461-S1545 WeakPolarHBondContact OD2-CB 3.44Å; D1461-S1545 PolarHBondContact OD2-OG 3Å; S1543-S1545 VanDerWaalsContact C-N 3.27Å; S1543-S1545 PolarHBondContact O-N 3.26Å; S1543-S1545 PolarHBondContact OG-N 3.2Å; S1543-S1545 VanDerWaalsContact OG-N 3.16Å; S1543-S1545 PolarHBondContact OG-OG 3.04Å; S1545-F1548 CarbonylContact O-C 3.57Å; S1545-F1548 WeakPolarHBondContact O-CA 3.04Å; S1545-F1548 WeakPolarHBondContact O-CB 3.32Å; S1545-F1548 PolarHBondContact O-N 2.95Å; S1545-V1549 WeakPolarHBondContact O-CG2 3.46Å; S1545-V1549 PolarHBondContact O-N 2.72Å
1546	F	94.4	Very high	90.2	Very high	0 Å²	0	19 Å²	19	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-50.5	-48.6	176.9	-92.5	-96.2	0	0	0	114	D1461 V1463 P1521 V1542 S1543 F1548 V1549 S1550 F1557 I1558	D1461-F1546 HydrophobicContact CB-CD2 4.07Å; D1461-F1546 HydrophobicContact CB-CE1 4.45Å; D1461-F1546 HydrophobicContact CB-CE2 3.75Å; D1461-F1546 HydrophobicContact CB-CZ 3.95Å; D1461-F1546 WeakPolarHBondContact OD1-CD2 3.33Å; D1461-F1546 VanDerWaalsContact OD1-CE2 3.29Å; D1461-F1546 WeakPolarHBondContact OD1-CE2 2.93Å; V1463-F1546 HydrophobicContact CG2-CE1 4.21Å; P1521-F1546 HydrophobicContact CB-CE1 3.93Å; P1521-F1546 HydrophobicContact CB-CE2 4.41Å; P1521-F1546 HydrophobicContact CB-CZ 3.68Å; V1542-F1546 HydrophobicContact CB-CD2 4.21Å; V1542-F1546 HydrophobicContact CB-CG 4.43Å; S1543-F1546 VanDerWaalsContact OG-CD2 3.31Å; S1543-F1546 WeakPolarHBondContact OG-CD2 3.26Å; F1546-F1548 PolarHBondContact O-N 3.48Å; F1546-V1549 WeakPolarHBondContact O-CG2 3.23Å; F1546-S1550 WeakPolarHBondContact O-CB 3.48Å; F1546-S1550 PolarHBondContact O-N 3.09Å; F1546-S1550 PolarHBondContact O-OG 2.79Å; F1546-F1557 HydrophobicContact CD1-CB 3.59Å; F1546-F1557 HydrophobicContact CD1-CG 4.29Å; F1546-F1557 HydrophobicContact CE1-CB 3.77Å; F1546-F1557 HydrophobicContact CE1-CD1 4.21Å; F1546-F1557 HydrophobicContact CE1-CG 4.29Å; F1546-I1558 HydrophobicContact CB-CD1 4.35Å; F1546-I1558 HydrophobicContact CD1-CD1 3.92Å; F1546-I1558 HydrophobicContact CG-CD1 4.35Å
1547	P	93.2	Very high	90.5	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-58.3	-44.8	173.7	-21.4	28.4	0	0	0	113.1	E1273 W1276 R1544 K1551	E1273-P1547 HydrophobicContact CB-CG 4.04Å; W1276-P1547 HydrophobicContact CB-CG 4.3Å; W1276-P1547 HydrophobicContact CD2-CB 3.98Å; W1276-P1547 HydrophobicContact CD2-CG 4.04Å; W1276-P1547 HydrophobicContact CE3-CB 3.85Å; W1276-P1547 HydrophobicContact CE3-CG 3.63Å; W1276-P1547 HydrophobicContact CG-CB 4.34Å; W1276-P1547 HydrophobicContact CG-CG 4.3Å; W1276-P1547 HydrophobicContact CZ3-CB 4.27Å; W1276-P1547 HydrophobicContact CZ3-CG 4.29Å; R1544-P1547 WeakPolarHBondContact O-CD 3.29Å; P1547-K1551 WeakPolarHBondContact O-CB 3.25Å; P1547-K1551 WeakPolarHBondContact O-CD 3.17Å; P1547-K1551 VanDerWaalsContact O-CG 3.28Å; P1547-K1551 WeakPolarHBondContact O-CG 3.43Å; P1547-K1551 PolarHBondContact O-N 3.01Å; P1547-K1551 VanDerWaalsContact O-N 3.14Å
1548	F	93.5	Very high	90.7	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-62.9	-54.7	-180	168.1	-115.3	0	0	0	111.4	I678 L1490 T1492 S1545 F1546 S1550 K1551 T1552 K1611 A1638	I678-F1548 HydrophobicContact CG1-CB 4.35Å; I678-F1548 HydrophobicContact CG1-CD2 4.19Å; I678-F1548 HydrophobicContact CG2-CB 4.12Å; I678-F1548 HydrophobicContact CG2-CD2 4.31Å; L1490-F1548 HydrophobicContact CB-CE1 4.22Å; T1492-F1548 WeakPolarHBondContact OG1-CE1 3.3Å; S1545-F1548 CarbonylContact O-C 3.57Å; S1545-F1548 WeakPolarHBondContact O-CA 3.04Å; S1545-F1548 WeakPolarHBondContact O-CB 3.32Å; S1545-F1548 PolarHBondContact O-N 2.95Å; F1546-F1548 PolarHBondContact O-N 3.48Å; F1548-S1550 VanDerWaalsContact C-N 3.32Å; F1548-S1550 PolarHBondContact O-N 3.06Å; F1548-K1551 PolarHBondContact O-N 3.19Å; F1548-T1552 WeakPolarHBondContact CE2-OG1 3.41Å; F1548-T1552 WeakPolarHBondContact O-CB 3.34Å; F1548-T1552 PolarHBondContact O-N 2.7Å; F1548-T1552 PolarHBondContact O-OG1 2.85Å; F1548-T1552 VanDerWaalsContact O-OG1 3.11Å; F1548-K1611 HydrophobicContact CD1-CB 4.31Å; F1548-K1611 HydrophobicContact CD2-CB 4.23Å; F1548-K1611 HydrophobicContact CE1-CB 4.14Å; F1548-K1611 HydrophobicContact CE2-CB 4.07Å; F1548-K1611 HydrophobicContact CG-CB 4.35Å; F1548-K1611 HydrophobicContact CZ-CB 4.02Å; F1548-A1638 HydrophobicContact CD2-CB 3.69Å; F1548-A1638 HydrophobicContact CE2-CB 3.76Å
1549	V	92.3	Very high	90.6	Very high	0 Å²	0	17 Å²	17	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-65.5	-35.6	-179.1	-56.8	0	0	0	0	111.8	D1461 A1473 T1492 S1545 F1546 K1551 L1553 F1557	D1461-V1549 HydrophobicContact CB-CG2 4.14Å; A1473-V1549 HydrophobicContact CB-CB 3.66Å; A1473-V1549 HydrophobicContact CB-CG1 3.93Å; A1473-V1549 HydrophobicContact CB-CG2 3.87Å; T1492-V1549 HydrophobicContact CG2-CG1 4.37Å; S1545-V1549 WeakPolarHBondContact O-CG2 3.46Å; S1545-V1549 PolarHBondContact O-N 2.72Å; F1546-V1549 WeakPolarHBondContact O-CG2 3.23Å; V1549-K1551 VanDerWaalsContact C-N 3.35Å; V1549-K1551 PolarHBondContact O-N 3.16Å; V1549-L1553 HydrophobicContact CB-CD1 4.49Å; V1549-L1553 VanDerWaalsContact O-CB 3.23Å; V1549-L1553 WeakPolarHBondContact O-CB 3.49Å; V1549-L1553 WeakPolarHBondContact O-CG 3.38Å; V1549-L1553 PolarHBondContact O-N 3.04Å; V1549-F1557 HydrophobicContact CG2-CD2 4.2Å; V1549-F1557 HydrophobicContact CG2-CE2 4.18Å
1550	S	91.3	Very high	90.4	Very high	7 Å²	7	16.6 Å²	16.6	5%	0.049	8%	0.079	C	C	.	.	H	α-helix	trans	-62.7	-42.9	177.6	-60.7	0	0	0	0	111.8	F1546 F1548 K1554 Y1555 F1557	F1546-S1550 WeakPolarHBondContact O-CB 3.48Å; F1546-S1550 PolarHBondContact O-N 3.09Å; F1546-S1550 PolarHBondContact O-OG 2.79Å; F1548-S1550 VanDerWaalsContact C-N 3.32Å; F1548-S1550 PolarHBondContact O-N 3.06Å; S1550-K1554 WeakPolarHBondContact O-CA 3.31Å; S1550-K1554 PolarHBondContact O-N 2.83Å; S1550-Y1555 WeakPolarHBondContact CA-O 3.14Å; S1550-Y1555 VanDerWaalsContact CB-O 3.24Å; S1550-Y1555 WeakPolarHBondContact CB-O 3.39Å; S1550-Y1555 PolarHBondContact O-N 3.12Å; S1550-F1557 WeakPolarHBondContact OG-CD2 3.16Å
1551	K	89.5	Confident	90.3	Very high	16 Å²	16	16.5 Å²	16.5	7%	0.07	8%	0.079	C	C	.	.	H	α-helix	trans	-78.8	-37.3	-178.5	-67.9	170.9	-173.9	173.3	0	112.3	I678 T680 T683 P1547 F1548 V1549 I1844	I678-K1551 HydrophobicContact CD1-CB 3.8Å; I678-K1551 HydrophobicContact CD1-CD 3.43Å; I678-K1551 VanDerWaalsContact CD1-CD 3.43Å; I678-K1551 HydrophobicContact CD1-CG 4.24Å; I678-K1551 HydrophobicContact CG1-CB 4.45Å; I678-K1551 HydrophobicContact CG1-CD 4.01Å; I678-K1551 PolarHBondContact O-NZ 2.73Å; T680-K1551 PolarHBondContact O-NZ 3.07Å; T683-K1551 WeakPolarHBondContact O-CE 3.46Å; T683-K1551 PolarHBondContact OG1-NZ 2.75Å; P1547-K1551 WeakPolarHBondContact O-CB 3.25Å; P1547-K1551 WeakPolarHBondContact O-CD 3.17Å; P1547-K1551 VanDerWaalsContact O-CG 3.28Å; P1547-K1551 WeakPolarHBondContact O-CG 3.43Å; P1547-K1551 PolarHBondContact O-N 3.01Å; P1547-K1551 VanDerWaalsContact O-N 3.14Å; F1548-K1551 PolarHBondContact O-N 3.19Å; V1549-K1551 VanDerWaalsContact C-N 3.35Å; V1549-K1551 PolarHBondContact O-N 3.16Å; K1551-I1844 HydrophobicContact CB-CD1 4.14Å; K1551-I1844 HydrophobicContact CG-CD1 4.4Å
1552	T	86.8	Confident	90.3	Very high	0 Å²	0	15.6 Å²	15.6	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-68.8	-41.2	176.5	-65.8	0	0	0	0	112.1	T1492 F1548 Y1607 F1640	T1492-T1552 HydrophobicContact CG2-CG2 4.11Å; T1492-T1552 WeakPolarHBondContact O-CG2 3.24Å; F1548-T1552 WeakPolarHBondContact CE2-OG1 3.41Å; F1548-T1552 WeakPolarHBondContact O-CB 3.34Å; F1548-T1552 PolarHBondContact O-N 2.7Å; F1548-T1552 PolarHBondContact O-OG1 2.85Å; F1548-T1552 VanDerWaalsContact O-OG1 3.11Å; T1552-Y1607 WeakPolarHBondContact O-CE2 3.38Å; T1552-Y1607 PolarHBondContact O-OH 2.93Å; T1552-F1640 VanDerWaalsContact OG1-CE1 3.25Å; T1552-F1640 WeakPolarHBondContact OG1-CE1 3.13Å
1553	L	86.1	Confident	90.1	Very high	13 Å²	13	18.2 Å²	18.2	7%	0.068	9%	0.085	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.1	-2	-178.9	-58	178	0	0	0	113.4	A1473 T1492 V1549 Y1555 F1557 I1600 T1604	A1473-L1553 HydrophobicContact CB-CD1 3.53Å; T1492-L1553 HydrophobicContact CG2-CD1 4.32Å; T1492-L1553 HydrophobicContact CG2-CD2 4Å; T1492-L1553 HydrophobicContact CG2-CG 4.13Å; V1549-L1553 HydrophobicContact CB-CD1 4.49Å; V1549-L1553 VanDerWaalsContact O-CB 3.23Å; V1549-L1553 WeakPolarHBondContact O-CB 3.49Å; V1549-L1553 WeakPolarHBondContact O-CG 3.38Å; V1549-L1553 PolarHBondContact O-N 3.04Å; L1553-Y1555 VanDerWaalsContact C-N 3.27Å; L1553-Y1555 PolarHBondContact O-N 3.12Å; L1553-F1557 HydrophobicContact CD1-CE2 4.34Å; L1553-F1557 HydrophobicContact CD1-CZ 4.43Å; L1553-I1600 HydrophobicContact CB-CG2 3.6Å; L1553-I1600 HydrophobicContact CD1-CG2 3.78Å; L1553-I1600 HydrophobicContact CD2-CG2 4.5Å; L1553-I1600 HydrophobicContact CG-CG2 4.15Å; L1553-T1604 HydrophobicContact CD2-CG2 3.63Å
1554	K	79.2	Confident	90	Very high	129 Å²	129	17.8 Å²	17.8	56%	0.561	8%	0.082	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.6	45	-175.8	-65.4	-177.9	171.9	-176.8	0	112.7	S1550 Y1607	S1550-K1554 WeakPolarHBondContact O-CA 3.31Å; S1550-K1554 PolarHBondContact O-N 2.83Å; K1554-Y1607 WeakPolarHBondContact CD-OH 3.46Å; K1554-Y1607 WeakPolarHBondContact CE-OH 3.15Å; K1554-Y1607 WeakPolarHBondContact CG-OH 3.41Å
1555	Y	84.4	Confident	90.2	Very high	33 Å²	33	16.7 Å²	16.7	13%	0.129	8%	0.078	C	C	.	.			trans	-133.3	123.1	176.4	-173.4	-98.2	0	0	0	109.4	A1471 S1550 L1553 F1557 A1560 E1595 V1598 I1600	A1471-Y1555 HydrophobicContact CB-CD1 4.28Å; A1471-Y1555 HydrophobicContact CB-CE1 3.54Å; S1550-Y1555 WeakPolarHBondContact CA-O 3.14Å; S1550-Y1555 VanDerWaalsContact CB-O 3.24Å; S1550-Y1555 WeakPolarHBondContact CB-O 3.39Å; S1550-Y1555 PolarHBondContact O-N 3.12Å; L1553-Y1555 VanDerWaalsContact C-N 3.27Å; L1553-Y1555 PolarHBondContact O-N 3.12Å; Y1555-F1557 HydrophobicContact CD1-CD1 4.3Å; Y1555-F1557 AromaticContact CD1-CD2 3.74Å; Y1555-F1557 HydrophobicContact CD1-CD2 3.74Å; Y1555-F1557 HydrophobicContact CD1-CE1 4.35Å; Y1555-F1557 AromaticContact CD1-CE2 3.78Å; Y1555-F1557 HydrophobicContact CD1-CE2 3.78Å; Y1555-F1557 AromaticContact CD1-CG 4Å; Y1555-F1557 HydrophobicContact CD1-CG 4Å; Y1555-F1557 HydrophobicContact CD1-CZ 4.08Å; Y1555-F1557 HydrophobicContact CG-CE2 4.41Å; Y1555-F1557 VanDerWaalsContact O-CD2 3.28Å; Y1555-F1557 WeakPolarHBondContact O-CD2 3.23Å; Y1555-F1557 PolarHBondContact O-N 2.76Å; Y1555-A1560 HydrophobicContact CE1-CB 3.91Å; Y1555-E1595 PolarHBondContact OH-OE2 3.25Å; Y1555-E1595 VanDerWaalsContact OH-OE2 3.12Å; Y1555-V1598 HydrophobicContact CE2-CG2 4.39Å; Y1555-I1600 HydrophobicContact CD1-CD1 3.52Å; Y1555-I1600 HydrophobicContact CD2-CD1 4.21Å; Y1555-I1600 HydrophobicContact CD2-CG1 4.42Å; Y1555-I1600 HydrophobicContact CE1-CD1 3.92Å; Y1555-I1600 HydrophobicContact CG-CD1 3.68Å; Y1555-I1600 HydrophobicContact CG-CG1 4.24Å
1556	D	87.6	Confident	89.9	Confident	81 Å²	81	17.6 Å²	17.6	43%	0.433	8%	0.083	S	C	.	.			trans	-79	88.4	179.9	-170.3	-19	0	0	0	110.8	I1558 A1559 A1560	D1556-I1558 PolarHBondContact O-N 2.88Å; D1556-I1558 PolarHBondContact OD1-N 2.81Å; D1556-I1558 VanDerWaalsContact OD1-N 3.09Å; D1556-A1559 HydrophobicContact CB-CB 4.01Å; D1556-A1559 VanDerWaalsContact CG-CB 3.42Å; D1556-A1559 PolarHBondContact O-N 2.72Å; D1556-A1559 PolarHBondContact OD1-N 3.47Å; D1556-A1559 WeakPolarHBondContact OD2-CB 3.4Å; D1556-A1560 PolarHBondContact O-N 3.43Å; D1556-A1560 VanDerWaalsContact O-N 3.11Å
1557	F	92.7	Very high	89.1	Confident	0 Å²	0	18.5 Å²	18.5	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-62.6	-28.7	178.4	-78.7	-97.1	0	0	0	112.5	V1463 A1471 A1473 F1546 V1549 S1550 L1553 Y1555 A1561 I1600	V1463-F1557 HydrophobicContact CG2-CB 4.42Å; V1463-F1557 HydrophobicContact CG2-CD1 4.01Å; A1471-F1557 HydrophobicContact CB-CD1 4.16Å; A1471-F1557 HydrophobicContact CB-CE1 3.78Å; A1473-F1557 HydrophobicContact CB-CE1 4.31Å; A1473-F1557 HydrophobicContact CB-CE2 4.26Å; A1473-F1557 HydrophobicContact CB-CZ 3.7Å; F1546-F1557 HydrophobicContact CD1-CB 3.59Å; F1546-F1557 HydrophobicContact CD1-CG 4.29Å; F1546-F1557 HydrophobicContact CE1-CB 3.77Å; F1546-F1557 HydrophobicContact CE1-CD1 4.21Å; F1546-F1557 HydrophobicContact CE1-CG 4.29Å; V1549-F1557 HydrophobicContact CG2-CD2 4.2Å; V1549-F1557 HydrophobicContact CG2-CE2 4.18Å; S1550-F1557 WeakPolarHBondContact OG-CD2 3.16Å; L1553-F1557 HydrophobicContact CD1-CE2 4.34Å; L1553-F1557 HydrophobicContact CD1-CZ 4.43Å; Y1555-F1557 HydrophobicContact CD1-CD1 4.3Å; Y1555-F1557 AromaticContact CD1-CD2 3.74Å; Y1555-F1557 HydrophobicContact CD1-CD2 3.74Å; Y1555-F1557 HydrophobicContact CD1-CE1 4.35Å; Y1555-F1557 AromaticContact CD1-CE2 3.78Å; Y1555-F1557 HydrophobicContact CD1-CE2 3.78Å; Y1555-F1557 AromaticContact CD1-CG 4Å; Y1555-F1557 HydrophobicContact CD1-CG 4Å; Y1555-F1557 HydrophobicContact CD1-CZ 4.08Å; Y1555-F1557 HydrophobicContact CG-CE2 4.41Å; Y1555-F1557 VanDerWaalsContact O-CD2 3.28Å; Y1555-F1557 WeakPolarHBondContact O-CD2 3.23Å; Y1555-F1557 PolarHBondContact O-N 2.76Å; F1557-A1561 WeakPolarHBondContact O-CB 3.32Å; F1557-A1561 PolarHBondContact O-N 3.49Å; F1557-I1600 HydrophobicContact CE1-CD1 4.12Å; F1557-I1600 HydrophobicContact CE2-CD1 4.17Å; F1557-I1600 HydrophobicContact CZ-CD1 3.55Å
1558	I	94	Very high	87.5	Confident	0 Å²	0	20.2 Å²	20.2	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-76.8	-39.7	-178.1	-60	-57.6	0	0	0	110.9	W1276 C1277 C1281 M1338 V1542 F1546 D1556 A1560 A1561 T1562	W1276-I1558 HydrophobicContact CE3-CG1 3.92Å; W1276-I1558 HydrophobicContact CH2-CG1 3.99Å; W1276-I1558 HydrophobicContact CZ3-CB 4.34Å; W1276-I1558 HydrophobicContact CZ3-CD1 4.26Å; W1276-I1558 HydrophobicContact CZ3-CG1 3.29Å; C1277-I1558 HydrophobicContact CB-CD1 3.91Å; C1277-I1558 HydrophobicContact CB-CG1 4.43Å; C1277-I1558 WeakPolarHBondContact O-CG2 3.38Å; C1281-I1558 HydrophobicContact CB-CG2 4.23Å; M1338-I1558 HydrophobicContact SD-CG2 4.37Å; V1542-I1558 HydrophobicContact CG1-CD1 3.6Å; F1546-I1558 HydrophobicContact CB-CD1 4.35Å; F1546-I1558 HydrophobicContact CD1-CD1 3.92Å; F1546-I1558 HydrophobicContact CG-CD1 4.35Å; D1556-I1558 PolarHBondContact O-N 2.88Å; D1556-I1558 PolarHBondContact OD1-N 2.81Å; D1556-I1558 VanDerWaalsContact OD1-N 3.09Å; I1558-A1560 VanDerWaalsContact C-N 3.34Å; I1558-A1561 PolarHBondContact O-N 2.86Å; I1558-T1562 WeakPolarHBondContact O-CB 3.45Å; I1558-T1562 PolarHBondContact O-N 3.38Å; I1558-T1562 PolarHBondContact O-OG1 3.2Å
1559	A	90.5	Very high	85.7	Confident	5 Å²	5	20.7 Å²	20.7	4%	0.041	11%	0.11	C	C	.	.	H	α-helix	trans	-63.8	-42.3	172.1	0	0	0	0	0	110.9	E1284 D1556 T1562 R1563	E1284-A1559 HydrophobicContact CB-CB 4.39Å; E1284-A1559 HydrophobicContact CG-CB 4.12Å; D1556-A1559 HydrophobicContact CB-CB 4.01Å; D1556-A1559 VanDerWaalsContact CG-CB 3.42Å; D1556-A1559 PolarHBondContact O-N 2.72Å; D1556-A1559 PolarHBondContact OD1-N 3.47Å; D1556-A1559 WeakPolarHBondContact OD2-CB 3.4Å; A1559-T1562 PolarHBondContact O-N 3.49Å; A1559-R1563 WeakPolarHBondContact O-CG 3.32Å; A1559-R1563 PolarHBondContact O-N 3Å; A1559-R1563 PolarHBondContact O-NH1 3.11Å
1560	A	88.3	Confident	83.9	Confident	5 Å²	5	27.2 Å²	27.2	4%	0.041	14%	0.135	C	C	.	.	H	α-helix	trans	-61	-45.8	173.6	0	0	0	0	0	112.1	V1463 Y1555 D1556 I1558 T1562 R1563 A1564	V1463-A1560 HydrophobicContact CG1-CB 4.41Å; Y1555-A1560 HydrophobicContact CE1-CB 3.91Å; D1556-A1560 PolarHBondContact O-N 3.43Å; D1556-A1560 VanDerWaalsContact O-N 3.11Å; I1558-A1560 VanDerWaalsContact C-N 3.34Å; A1560-T1562 PolarHBondContact O-N 2.81Å; A1560-R1563 PolarHBondContact O-N 2.87Å; A1560-A1564 PolarHBondContact O-N 3.15Å
1561	A	93	Very high	82	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-60.6	-43.6	176.8	0	0	0	0	0	112.2	M1338 V1463 P1521 F1557 I1558 R1563 A1564 I1565	M1338-A1561 HydrophobicContact CE-CB 4.29Å; V1463-A1561 HydrophobicContact CG1-CB 4.21Å; V1463-A1561 HydrophobicContact CG2-CB 3.94Å; P1521-A1561 HydrophobicContact CB-CB 3.93Å; P1521-A1561 HydrophobicContact CG-CB 3.98Å; F1557-A1561 WeakPolarHBondContact O-CB 3.32Å; F1557-A1561 PolarHBondContact O-N 3.49Å; I1558-A1561 PolarHBondContact O-N 2.86Å; A1561-R1563 PolarHBondContact O-N 3.47Å; A1561-A1564 WeakPolarHBondContact O-CB 3.47Å; A1561-A1564 PolarHBondContact O-N 3.43Å; A1561-I1565 WeakPolarHBondContact O-CB 3.4Å; A1561-I1565 VanDerWaalsContact O-CG1 3.26Å; A1561-I1565 WeakPolarHBondContact O-CG1 3.3Å; A1561-I1565 PolarHBondContact O-N 3.33Å
1562	T	93.7	Very high	80	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-64.1	-41.3	178.6	-57.9	0	0	0	0	111.3	C1281 E1284 L1285 I1558 A1559 A1560 I1565 L1566	C1281-T1562 WeakPolarHBondContact CA-OG1 3.27Å; C1281-T1562 PolarHBondContact SG-OG1 2.81Å; C1281-T1562 VanDerWaalsContact SG-OG1 3.37Å; E1284-T1562 HydrophobicContact CB-CG2 4.02Å; E1284-T1562 HydrophobicContact CG-CG2 3.85Å; L1285-T1562 HydrophobicContact CD2-CG2 3.61Å; L1285-T1562 HydrophobicContact CG-CG2 3.85Å; I1558-T1562 WeakPolarHBondContact O-CB 3.45Å; I1558-T1562 PolarHBondContact O-N 3.38Å; I1558-T1562 PolarHBondContact O-OG1 3.2Å; A1559-T1562 PolarHBondContact O-N 3.49Å; A1560-T1562 PolarHBondContact O-N 2.81Å; T1562-I1565 PolarHBondContact O-N 3.26Å; T1562-L1566 WeakPolarHBondContact O-CG 3.44Å; T1562-L1566 PolarHBondContact O-N 2.87Å
1563	R	89.7	Confident	78.1	Confident	57 Å²	57	40.1 Å²	40.1	22%	0.215	21%	0.212	C	C	.	.	H	α-helix	trans	-64.8	-39.3	173.3	-70.8	-172.5	-62.8	-88.1	4.8	112.4	E1284 L1288 A1559 A1560 A1561 L1566 G1567	E1284-R1563 HydrophobicContact CG-CG 4.5Å; E1284-R1563 WeakPolarHBondContact OE1-CD 3.4Å; E1284-R1563 WeakPolarHBondContact OE1-CG 3.49Å; E1284-R1563 IonicContact OE1-CZ 3.31Å; E1284-R1563 IonicContact OE1-NH1 2.98Å; E1284-R1563 PolarHBondContact OE1-NH1 3.13Å; L1288-R1563 HydrophobicContact CD1-CG 4.13Å; A1559-R1563 WeakPolarHBondContact O-CG 3.32Å; A1559-R1563 PolarHBondContact O-N 3Å; A1559-R1563 PolarHBondContact O-NH1 3.11Å; A1560-R1563 PolarHBondContact O-N 2.87Å; A1561-R1563 PolarHBondContact O-N 3.47Å; R1563-L1566 PolarHBondContact O-N 2.85Å; R1563-G1567 PolarHBondContact O-N 2.83Å
1564	A	89.2	Confident	75.9	Confident	2 Å²	2	47.7 Å²	47.7	2%	0.017	25%	0.247	C	C	.	.	H	α-helix	trans	-63.6	-45.2	175.9	0	0	0	0	0	111.9	V1463 A1464 Q1465 A1560 A1561 L1566 G1567 A1568	V1463-A1564 HydrophobicContact CG1-CB 4.1Å; A1464-A1564 WeakPolarHBondContact O-CB 3.44Å; Q1465-A1564 HydrophobicContact CB-CB 3.87Å; Q1465-A1564 HydrophobicContact CG-CB 4.23Å; A1560-A1564 PolarHBondContact O-N 3.15Å; A1561-A1564 WeakPolarHBondContact O-CB 3.47Å; A1561-A1564 PolarHBondContact O-N 3.43Å; A1564-L1566 PolarHBondContact O-N 3.31Å; A1564-G1567 PolarHBondContact O-N 2.63Å; A1564-A1568 PolarHBondContact O-N 2.79Å; A1564-A1568 VanDerWaalsContact O-N 3.11Å
1565	I	92.2	Very high	74.1	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-56.1	-50.7	174.3	-73	164.5	0	0	0	110.7	I1335 M1338 L1358 S1519 A1561 T1562 G1567 A1568 A1569	I1335-I1565 HydrophobicContact CD1-CG2 4Å; I1335-I1565 HydrophobicContact CG1-CG2 4.11Å; I1335-I1565 HydrophobicContact CG2-CD1 4.31Å; M1338-I1565 HydrophobicContact CE-CD1 3.53Å; L1358-I1565 HydrophobicContact CB-CG2 3.94Å; S1519-I1565 WeakPolarHBondContact O-CG1 3.44Å; A1561-I1565 WeakPolarHBondContact O-CB 3.4Å; A1561-I1565 VanDerWaalsContact O-CG1 3.26Å; A1561-I1565 WeakPolarHBondContact O-CG1 3.3Å; A1561-I1565 PolarHBondContact O-N 3.33Å; T1562-I1565 PolarHBondContact O-N 3.26Å; I1565-G1567 VanDerWaalsContact C-N 3.33Å; I1565-G1567 PolarHBondContact O-N 3.14Å; I1565-A1568 PolarHBondContact O-N 2.54Å; I1565-A1569 PolarHBondContact O-N 3.07Å
1566	L	86.7	Confident	72	Confident	21 Å²	21	47.1 Å²	47.1	11%	0.11	26%	0.26	C	S	.	.	H	α-helix	trans	-66.7	-35.3	179.2	-73	-180	0	0	0	112.6	I1258 L1285 L1288 T1562 R1563 A1564 A1568 A1569 R1570	I1258-L1566 HydrophobicContact CD1-CD2 3.62Å; L1285-L1566 HydrophobicContact CD2-CD1 3.72Å; L1285-L1566 HydrophobicContact CD2-CD2 4.02Å; L1285-L1566 HydrophobicContact CD2-CG 4.03Å; L1288-L1566 HydrophobicContact CD1-CD1 3.42Å; L1288-L1566 VanDerWaalsContact CD1-CD1 3.42Å; T1562-L1566 WeakPolarHBondContact O-CG 3.44Å; T1562-L1566 PolarHBondContact O-N 2.87Å; R1563-L1566 PolarHBondContact O-N 2.85Å; A1564-L1566 PolarHBondContact O-N 3.31Å; L1566-A1568 VanDerWaalsContact C-N 3.32Å; L1566-A1568 PolarHBondContact O-N 3.31Å; L1566-A1569 CarbonylContact O-C 3.49Å; L1566-A1569 PolarHBondContact O-N 3.2Å; L1566-A1569 VanDerWaalsContact O-N 3.08Å; L1566-R1570 WeakPolarHBondContact O-CB 3.49Å; L1566-R1570 PolarHBondContact O-N 2.73Å
1567	G	76.1	Confident	69.7	Low	20 Å²	20	50.7 Å²	50.7	21%	0.206	27%	0.272	C	S	.	.	H	α-helix	trans	-61.4	-39.8	177	0	0	0	0	0	112.5	R1563 A1564 I1565 A1569 R1570	R1563-G1567 PolarHBondContact O-N 2.83Å; A1564-G1567 PolarHBondContact O-N 2.63Å; I1565-G1567 VanDerWaalsContact C-N 3.33Å; I1565-G1567 PolarHBondContact O-N 3.14Å; G1567-A1569 VanDerWaalsContact C-N 3.26Å; G1567-A1569 PolarHBondContact O-N 3.35Å; G1567-R1570 PolarHBondContact O-N 3.42Å
1568	A	61.1	Low	67.1	Low	35 Å²	35	58.4 Å²	58.4	29%	0.289	31%	0.313	S	S	.	.	H	α-helix	trans	-65.3	-29.5	172.4	0	0	0	0	0	112.8	A1564 I1565 L1566	A1564-A1568 PolarHBondContact O-N 2.79Å; A1564-A1568 VanDerWaalsContact O-N 3.11Å; I1565-A1568 PolarHBondContact O-N 2.54Å; L1566-A1568 VanDerWaalsContact C-N 3.32Å; L1566-A1568 PolarHBondContact O-N 3.31Å
1569	A	55.5	Low	64.2	Low	10 Å²	10	62.5 Å²	62.5	8%	0.083	34%	0.339	C	S	.	.	H	α-helix	trans	-87.2	-23.5	178.6	0	0	0	0	0	113.9	L1358 I1565 L1566 G1567 D1571 S1572 I1573	L1358-A1569 HydrophobicContact CD2-CB 3.95Å; I1565-A1569 PolarHBondContact O-N 3.07Å; L1566-A1569 CarbonylContact O-C 3.49Å; L1566-A1569 PolarHBondContact O-N 3.2Å; L1566-A1569 VanDerWaalsContact O-N 3.08Å; G1567-A1569 VanDerWaalsContact C-N 3.26Å; G1567-A1569 PolarHBondContact O-N 3.35Å; A1569-D1571 PolarHBondContact O-N 3.1Å; A1569-S1572 WeakPolarHBondContact O-CB 3.49Å; A1569-S1572 PolarHBondContact O-N 2.78Å; A1569-I1573 HydrophobicContact CB-CD1 3.73Å; A1569-I1573 VanDerWaalsContact O-CG1 3.27Å; A1569-I1573 WeakPolarHBondContact O-CG1 3.35Å; A1569-I1573 PolarHBondContact O-N 3.01Å
1570	R	54.9	Low	61.7	Low	138 Å²	138	68.5 Å²	68.5	52%	0.521	38%	0.377	S	S	.	.	H	α-helix	trans	-65.9	-33.1	-166.6	-162.2	176.1	179	167.3	1	114.2	L1566 G1567 S1572 I1573	L1566-R1570 WeakPolarHBondContact O-CB 3.49Å; L1566-R1570 PolarHBondContact O-N 2.73Å; G1567-R1570 PolarHBondContact O-N 3.42Å; R1570-S1572 PolarHBondContact O-N 2.99Å; R1570-S1572 VanDerWaalsContact O-N 3.17Å; R1570-I1573 PolarHBondContact O-N 3.35Å; R1570-I1573 VanDerWaalsContact O-N 3.1Å
1571	D	50.6	Low	59.3	Low	158 Å²	158	76.1 Å²	76.1	85%	0.845	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-17.7	176	-71.2	-22.9	0	0	0	112.3	A1569	A1569-D1571 PolarHBondContact O-N 3.1Å
1572	S	47.8	Very low	56.3	Low	106 Å²	106	79.8 Å²	79.8	74%	0.741	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.6	-6.9	176.8	-45.9	0	0	0	0	113.3	A1569 R1570	A1569-S1572 WeakPolarHBondContact O-CB 3.49Å; A1569-S1572 PolarHBondContact O-N 2.78Å; R1570-S1572 PolarHBondContact O-N 2.99Å; R1570-S1572 VanDerWaalsContact O-N 3.17Å
1573	I	45.8	Very low	53.4	Low	29 Å²	29	89.5 Å²	89.5	15%	0.149	49%	0.485	C	S	.	.			trans	-137.2	110.9	-164	-56.7	177.2	0	0	0	110.6	W1290 I1332 A1569 R1570	W1290-I1573 HydrophobicContact CH2-CG2 3.56Å; W1290-I1573 HydrophobicContact CZ2-CG2 4.21Å; I1332-I1573 HydrophobicContact CB-CD1 4.33Å; I1332-I1573 HydrophobicContact CD1-CD1 3.6Å; I1332-I1573 HydrophobicContact CD1-CG2 4.12Å; I1332-I1573 HydrophobicContact CG1-CD1 4.41Å; A1569-I1573 HydrophobicContact CB-CD1 3.73Å; A1569-I1573 VanDerWaalsContact O-CG1 3.27Å; A1569-I1573 WeakPolarHBondContact O-CG1 3.35Å; A1569-I1573 PolarHBondContact O-N 3.01Å; R1570-I1573 PolarHBondContact O-N 3.35Å; R1570-I1573 VanDerWaalsContact O-N 3.1Å
1574	H	41.1	Very low	50.6	Low	172 Å²	172	93.9 Å²	93.9	80%	0.796	51%	0.512	S	S	*	.			trans	-89	126.9	169.5	-64	-58.3	0	0	0	110.4
1575	P	41	Very low	47.8	Very low	57 Å²	57	102.2 Å²	102.2	37%	0.37	55%	0.551	S	S	.	*			trans	-65.3	137.5	170.3	25.1	-30.4	0	0	0	110	F1577	P1575-F1577 HydrophobicContact CB-CD2 4.11Å; P1575-F1577 HydrophobicContact CB-CE2 3.98Å; P1575-F1577 HydrophobicContact CG-CD2 4.15Å; P1575-F1577 HydrophobicContact CG-CE2 4.09Å; P1575-F1577 PolarHBondContact O-N 3.49Å
1576	P	40	Very low	44.7	Very low	94 Å²	94	111.5 Å²	111.5	61%	0.61	59%	0.591	S	S	*	*			trans	-80.4	86.8	-179.7	31.7	-30.9	0	0	0	109.4	D1578	P1576-D1578 PolarHBondContact O-N 2.91Å
1577	F	38.8	Very low	41.9	Very low	155 Å²	155	117.2 Å²	117.2	68%	0.68	62%	0.621	S	S	*	*			trans	-89	83.6	165	-76.9	-78.7	0	0	0	109.5	P1575 T1579	P1575-F1577 HydrophobicContact CB-CD2 4.11Å; P1575-F1577 HydrophobicContact CB-CE2 3.98Å; P1575-F1577 HydrophobicContact CG-CD2 4.15Å; P1575-F1577 HydrophobicContact CG-CE2 4.09Å; P1575-F1577 PolarHBondContact O-N 3.49Å; F1577-T1579 PolarHBondContact O-N 2.78Å
1578	D	38	Very low	39.7	Very low	162 Å²	162	121.6 Å²	121.6	87%	0.866	65%	0.649	S	S	*	*			trans	-78.1	71	162.4	-100.6	-14.4	0	0	0	109.3	P1576	P1576-D1578 PolarHBondContact O-N 2.91Å
1579	T	33.9	Very low	38.2	Very low	87 Å²	87	123.4 Å²	123.4	53%	0.534	65%	0.653	S	S	.	*			trans	-133.5	101.7	160.8	32.4	0	0	0	0	109.5	F1577 N1581	F1577-T1579 PolarHBondContact O-N 2.78Å; T1579-N1581 PolarHBondContact O-N 2.56Å
1580	P	38.3	Very low	37.2	Very low	130 Å²	130	127.9 Å²	127.9	84%	0.844	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.8	10.7	-176.9	-21.6	32.4	0	0	0	116.4
1581	N	37.1	Very low	36.1	Very low	166 Å²	166	130.7 Å²	130.7	89%	0.888	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-137.1	16.3	-166.4	-94.6	-19.1	0	0	0	117.2	T1579	T1579-N1581 PolarHBondContact O-N 2.56Å
1582	S	30	Very low	35.4	Very low	77 Å²	77	127.1 Å²	127.1	54%	0.538	69%	0.687	S	S	.	*	S	Bend	trans	-115	122.2	164.9	74.8	0	0	0	0	110.3	L1584	S1582-L1584 VanDerWaalsContact C-N 3.32Å; S1582-L1584 PolarHBondContact O-N 2.99Å
1583	K	33.9	Very low	35.2	Very low	203 Å²	203	127 Å²	127	88%	0.883	67%	0.673	S	S	*	*			trans	-52.4	92.9	173.9	-74.9	172.1	171	174.9	0	109.6	E1585	K1583-E1585 PolarHBondContact O-N 3.44Å
1584	L	30.5	Very low	34.9	Very low	150 Å²	150	129.5 Å²	129.5	79%	0.785	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.4	34.3	-179.6	-153.5	81.5	0	0	0	112.4	S1582	S1582-L1584 VanDerWaalsContact C-N 3.32Å; S1582-L1584 PolarHBondContact O-N 2.99Å
1585	E	29.7	Very low	34.9	Very low	177 Å²	177	125.7 Å²	125.7	83%	0.827	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.7	10.1	179.1	-97	-173.4	161.3	0	0	113.2	K1583	K1583-E1585 PolarHBondContact O-N 3.44Å
1586	K	28.4	Very low	35.1	Very low	194 Å²	194	128.2 Å²	128.2	84%	0.843	69%	0.685	S	S	*	*	S	Bend	trans	-124	12	-179.2	-80.3	-167.7	176.3	-176.1	0	117.5
1587	L	28	Very low	35.3	Very low	142 Å²	142	127.2 Å²	127.2	74%	0.743	68%	0.68	S	S	*	*			trans	-127.6	59	166.4	-94	103.3	0	0	0	111.6	L1589	L1587-L1589 HydrophobicContact CD2-CB 4.36Å; L1587-L1589 HydrophobicContact CD2-CD1 3.45Å; L1587-L1589 VanDerWaalsContact CD2-CD1 3.45Å; L1587-L1589 HydrophobicContact CG-CD1 3.96Å; L1587-L1589 PolarHBondContact O-N 3.35Å
1588	S	30	Very low	36	Very low	112 Å²	112	121.9 Å²	121.9	78%	0.783	66%	0.661	S	S	*	*			trans	-67.7	47.6	155.6	-61.8	0	0	0	0	111.5	S1590	S1588-S1590 PolarHBondContact O-N 2.89Å
1589	L	29.6	Very low	36.8	Very low	73 Å²	73	116.7 Å²	116.7	38%	0.382	63%	0.633	S	S	.	*			trans	-81.2	15.3	175.9	-112.8	153.9	0	0	0	111.7	L1587 K1591 S1592	L1587-L1589 HydrophobicContact CD2-CB 4.36Å; L1587-L1589 HydrophobicContact CD2-CD1 3.45Å; L1587-L1589 VanDerWaalsContact CD2-CD1 3.45Å; L1587-L1589 HydrophobicContact CG-CD1 3.96Å; L1587-L1589 PolarHBondContact O-N 3.35Å; L1589-K1591 PolarHBondContact O-N 2.78Å; L1589-S1592 WeakPolarHBondContact CD2-OG 3.31Å
1590	S	34.3	Very low	38	Very low	103 Å²	103	113 Å²	113	72%	0.72	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.3	0.2	-178.2	63.8	0	0	0	0	114.6	S1588	S1588-S1590 PolarHBondContact O-N 2.89Å
1591	K	32.1	Very low	38.8	Very low	197 Å²	197	109 Å²	109	86%	0.857	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.1	-5.4	174.6	-81	-174.4	175.9	179.6	0	116.1	L1589	L1589-K1591 PolarHBondContact O-N 2.78Å
1592	S	35.7	Very low	39.5	Very low	84 Å²	84	108.5 Å²	108.5	59%	0.587	57%	0.573	S	S	*	*			trans	-117	15.9	-175.9	101.5	0	0	0	0	115.5	L1589 L1594	L1589-S1592 WeakPolarHBondContact CD2-OG 3.31Å; S1592-L1594 PolarHBondContact O-N 2.94Å
1593	F	42.7	Very low	40.2	Very low	104 Å²	104	110.7 Å²	110.7	46%	0.456	58%	0.579	S	S	.	*			trans	-73.5	-15.6	172	-110	-85.4	0	0	0	113.5	L1288 E1595	L1288-F1593 HydrophobicContact CD2-CE1 4.47Å; F1593-E1595 PolarHBondContact O-N 3.23Å
1594	L	40.5	Very low	41	Very low	81 Å²	81	102.6 Å²	102.6	42%	0.424	55%	0.547	S	S	.	.	S	Bend	trans	-80.6	105.7	172.8	-80.3	156.7	0	0	0	108.7	V1470 S1592	V1470-L1594 HydrophobicContact CG2-CD2 4.46Å; S1592-L1594 PolarHBondContact O-N 2.94Å
1595	E	40.7	Very low	42	Very low	92 Å²	92	101.7 Å²	101.7	43%	0.43	54%	0.541	S	S	.	.			trans	-52.3	131.2	153.9	-69.7	-179.2	174.9	0	0	107	Y1555 F1593 S1597 V1598	Y1555-E1595 PolarHBondContact OH-OE2 3.25Å; Y1555-E1595 VanDerWaalsContact OH-OE2 3.12Å; F1593-E1595 PolarHBondContact O-N 3.23Å; E1595-S1597 PolarHBondContact O-N 2.87Å; E1595-V1598 HydrophobicContact CB-CG2 4.11Å
1596	P	44	Very low	43.4	Very low	109 Å²	109	96.3 Å²	96.3	71%	0.708	53%	0.533	S	S	*	.			trans	-51.1	143.4	167.3	22.8	-31.3	0	0	0	108	V1598	P1596-V1598 VanDerWaalsContact O-CG2 3.26Å; P1596-V1598 WeakPolarHBondContact O-CG2 3.4Å; P1596-V1598 PolarHBondContact O-N 2.67Å
1597	S	45.8	Very low	45.6	Very low	73 Å²	73	88.2 Å²	88.2	51%	0.51	50%	0.497	S	S	.	.			trans	-44.6	107.6	-179.1	58.6	0	0	0	0	109.7	V1470 E1595 N1599	V1470-S1597 WeakPolarHBondContact O-CA 3.37Å; E1595-S1597 PolarHBondContact O-N 2.87Å; S1597-N1599 PolarHBondContact O-N 3.05Å
1598	V	52.4	Low	48.2	Very low	44 Å²	44	81.8 Å²	81.8	27%	0.267	46%	0.464	S	S	.	.			trans	-76.9	123.1	-169.2	-178.4	0	0	0	0	106.6	V1470 Y1555 E1595 P1596 I1600	V1470-V1598 PolarHBondContact O-N 2.94Å; Y1555-V1598 HydrophobicContact CE2-CG2 4.39Å; E1595-V1598 HydrophobicContact CB-CG2 4.11Å; P1596-V1598 VanDerWaalsContact O-CG2 3.26Å; P1596-V1598 WeakPolarHBondContact O-CG2 3.4Å; P1596-V1598 PolarHBondContact O-N 2.67Å; V1598-I1600 HydrophobicContact CB-CG1 4.12Å; V1598-I1600 HydrophobicContact CG1-CG1 3.89Å; V1598-I1600 PolarHBondContact O-N 3.33Å
1599	N	54.9	Low	51.1	Low	53 Å²	53	76.5 Å²	76.5	28%	0.283	43%	0.427	S	S	.	.			trans	-79.1	80	173.2	-157.7	-1.2	0	0	0	109.1	S1597 L1601 E1602	S1597-N1599 PolarHBondContact O-N 3.05Å; N1599-L1601 PolarHBondContact O-N 3.29Å; N1599-E1602 HydrophobicContact CB-CB 4.46Å; N1599-E1602 PolarHBondContact ND2-OE1 3.49Å; N1599-E1602 PolarHBondContact ND2-OE2 2.64Å; N1599-E1602 PolarHBondContact O-N 2.92Å
1600	I	59.6	Low	54.2	Low	9 Å²	9	73 Å²	73	5%	0.046	41%	0.409	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-33.5	-173.2	-59.7	167.2	0	0	0	111.2	A1471 L1553 Y1555 F1557 V1598 N1603 T1604	A1471-I1600 HydrophobicContact CB-CD1 3.71Å; L1553-I1600 HydrophobicContact CB-CG2 3.6Å; L1553-I1600 HydrophobicContact CD1-CG2 3.78Å; L1553-I1600 HydrophobicContact CD2-CG2 4.5Å; L1553-I1600 HydrophobicContact CG-CG2 4.15Å; Y1555-I1600 HydrophobicContact CD1-CD1 3.52Å; Y1555-I1600 HydrophobicContact CD2-CD1 4.21Å; Y1555-I1600 HydrophobicContact CD2-CG1 4.42Å; Y1555-I1600 HydrophobicContact CE1-CD1 3.92Å; Y1555-I1600 HydrophobicContact CG-CD1 3.68Å; Y1555-I1600 HydrophobicContact CG-CG1 4.24Å; F1557-I1600 HydrophobicContact CE1-CD1 4.12Å; F1557-I1600 HydrophobicContact CE2-CD1 4.17Å; F1557-I1600 HydrophobicContact CZ-CD1 3.55Å; V1598-I1600 HydrophobicContact CB-CG1 4.12Å; V1598-I1600 HydrophobicContact CG1-CG1 3.89Å; V1598-I1600 PolarHBondContact O-N 3.33Å; I1600-N1603 PolarHBondContact O-N 2.74Å; I1600-T1604 PolarHBondContact O-N 3.05Å; I1600-T1604 PolarHBondContact O-OG1 2.94Å
1601	L	55.7	Low	57.1	Low	47 Å²	47	68.3 Å²	68.3	25%	0.246	38%	0.375	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-31.4	-178.3	-66.8	172.3	0	0	0	113.7	V1474 P1493 N1599 T1604	V1474-L1601 HydrophobicContact CG2-CD1 4.34Å; P1493-L1601 HydrophobicContact CB-CD2 3.97Å; N1599-L1601 PolarHBondContact O-N 3.29Å; L1601-T1604 PolarHBondContact O-OG1 3.5Å
1602	E	51.6	Low	60	Low	154 Å²	154	59.1 Å²	59.1	72%	0.72	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-25.7	178.2	-81.7	173.5	-166.8	0	0	112.4	N1599	N1599-E1602 HydrophobicContact CB-CB 4.46Å; N1599-E1602 PolarHBondContact ND2-OE1 3.49Å; N1599-E1602 PolarHBondContact ND2-OE2 2.64Å; N1599-E1602 PolarHBondContact O-N 2.92Å
1603	N	44.9	Very low	62.7	Low	123 Å²	123	55.5 Å²	55.5	66%	0.658	31%	0.311	S	S	*	.	S	Bend	trans	-91.4	5.1	-179.9	-76.5	-15.3	0	0	0	113.5	I1600 I1605	I1600-N1603 PolarHBondContact O-N 2.74Å; N1603-I1605 PolarHBondContact O-N 3.19Å
1604	T	49.2	Very low	64.9	Low	33 Å²	33	50.7 Å²	50.7	20%	0.202	29%	0.29	C	S	.	.			trans	-77.3	115.9	-176.4	-28.2	0	0	0	0	111.1	L1553 I1600 L1601 G1606	L1553-T1604 HydrophobicContact CD2-CG2 3.63Å; I1600-T1604 PolarHBondContact O-N 3.05Å; I1600-T1604 PolarHBondContact O-OG1 2.94Å; L1601-T1604 PolarHBondContact O-OG1 3.5Å; T1604-G1606 PolarHBondContact O-N 3.05Å
1605	I	51.5	Low	67.2	Low	132 Å²	132	49.3 Å²	49.3	68%	0.677	28%	0.28	S	S	*	.			trans	-82.7	113	-174	-57.7	169.2	0	0	0	110	N1603 Y1607	N1603-I1605 PolarHBondContact O-N 3.19Å; I1605-Y1607 VanDerWaalsContact C-N 3.32Å; I1605-Y1607 WeakPolarHBondContact O-CD1 3.23Å; I1605-Y1607 WeakPolarHBondContact O-CE1 3.35Å; I1605-Y1607 PolarHBondContact O-N 3.3Å
1606	G	59.6	Low	69.4	Low	63 Å²	63	45.4 Å²	45.4	65%	0.649	26%	0.263	S	S	*	.	S	Bend	trans	62.7	-2.3	144.9	0	0	0	0	0	121.8	T1604	T1604-G1606 PolarHBondContact O-N 3.05Å
1607	Y	73.9	Confident	71.3	Confident	24 Å²	24	41.1 Å²	41.1	9%	0.094	23%	0.234	C	C	.	.			trans	-140.5	162	177.3	59.4	-88.5	0	0	0	112.7	T1552 K1554 I1605 F1640 G1641	T1552-Y1607 WeakPolarHBondContact O-CE2 3.38Å; T1552-Y1607 PolarHBondContact O-OH 2.93Å; K1554-Y1607 WeakPolarHBondContact CD-OH 3.46Å; K1554-Y1607 WeakPolarHBondContact CE-OH 3.15Å; K1554-Y1607 WeakPolarHBondContact CG-OH 3.41Å; I1605-Y1607 VanDerWaalsContact C-N 3.32Å; I1605-Y1607 WeakPolarHBondContact O-CD1 3.23Å; I1605-Y1607 WeakPolarHBondContact O-CE1 3.35Å; I1605-Y1607 PolarHBondContact O-N 3.3Å; Y1607-F1640 HydrophobicContact CD2-CB 4.1Å; Y1607-F1640 HydrophobicContact CD2-CD2 4.06Å; Y1607-F1640 HydrophobicContact CD2-CG 4.03Å; Y1607-F1640 AromaticContact CE2-CD2 3.89Å; Y1607-F1640 HydrophobicContact CE2-CD2 3.89Å; Y1607-F1640 HydrophobicContact CE2-CE2 4.09Å; Y1607-F1640 HydrophobicContact CE2-CG 4.23Å; Y1607-G1641 CarbonylContact C-O 3.45Å; Y1607-G1641 VanDerWaalsContact CA-O 3.31Å; Y1607-G1641 WeakPolarHBondContact CA-O 3.44Å; Y1607-G1641 VanDerWaalsContact CB-O 3.27Å; Y1607-G1641 WeakPolarHBondContact CB-O 3.46Å
1608	V	84	Confident	72.8	Confident	8 Å²	8	38.8 Å²	38.8	5%	0.048	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	134.4	177.5	-177.5	0	0	0	0	108.6	V1491 Q1495 V1610 F1640 G1641 R1644 A1647	V1491-V1608 HydrophobicContact CG1-CG1 3.57Å; Q1495-V1608 HydrophobicContact CG-CG1 4.35Å; V1608-V1610 HydrophobicContact CG1-CG2 4.38Å; V1608-F1640 WeakPolarHBondContact O-CA 3.42Å; V1608-G1641 PolarHBondContact N-O 3.42Å; V1608-G1641 PolarHBondContact O-N 3.09Å; V1608-R1644 HydrophobicContact CG1-CB 4.19Å; V1608-A1647 WeakPolarHBondContact O-CB 3.49Å
1609	G	90.1	Very high	73.9	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	136.3	168.4	0	0	0	0	0	110.6	T1492	T1492-G1609 PolarHBondContact N-O 3.02Å; T1492-G1609 PolarHBondContact O-N 2.87Å
1610	V	94.6	Very high	75.1	Confident	1 Å²	1	35.2 Å²	35.2	1%	0.006	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	124.5	171	178.3	0	0	0	0	109.7	T1489 L1490 V1491 V1608 V1612 A1638 C1639 R1644 A1647 Y1648	T1489-V1610 HydrophobicContact CG2-CG1 3.88Å; L1490-V1610 WeakPolarHBondContact O-CA 3.09Å; V1491-V1610 HydrophobicContact CG1-CG2 4.3Å; V1491-V1610 HydrophobicContact CG2-CG2 4.22Å; V1608-V1610 HydrophobicContact CG1-CG2 4.38Å; V1610-V1612 HydrophobicContact CG1-CG2 4.39Å; V1610-A1638 VanDerWaalsContact O-CA 3.25Å; V1610-A1638 WeakPolarHBondContact O-CA 3.36Å; V1610-A1638 WeakPolarHBondContact O-CB 3.11Å; V1610-C1639 PolarHBondContact N-O 3Å; V1610-C1639 VanDerWaalsContact N-O 3.13Å; V1610-C1639 PolarHBondContact O-N 2.84Å; V1610-R1644 HydrophobicContact CG2-CB 4.27Å; V1610-A1647 HydrophobicContact CB-CB 3.84Å; V1610-A1647 HydrophobicContact CG2-CB 3.51Å; V1610-Y1648 HydrophobicContact CG1-CD2 3.85Å; V1610-Y1648 HydrophobicContact CG1-CG 4.46Å
1611	K	95.1	Very high	75.8	Confident	3 Å²	3	38.8 Å²	38.8	1%	0.013	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	132.9	175.9	-169.7	-157.6	94.6	157.4	0	109.6	A1488 T1489 L1490 F1548 E1636 V1637 A1638	A1488-K1611 WeakPolarHBondContact O-CE 3.31Å; T1489-K1611 CarbonylContact C-O 3.57Å; T1489-K1611 VanDerWaalsContact CA-O 3.25Å; T1489-K1611 WeakPolarHBondContact CA-O 3.5Å; T1489-K1611 VanDerWaalsContact CG2-O 3.31Å; T1489-K1611 WeakPolarHBondContact CG2-O 3.38Å; L1490-K1611 HydrophobicContact CB-CB 4.1Å; L1490-K1611 HydrophobicContact CD1-CD 4.09Å; L1490-K1611 HydrophobicContact CG-CD 4.38Å; L1490-K1611 PolarHBondContact N-O 2.84Å; L1490-K1611 PolarHBondContact O-N 3.46Å; F1548-K1611 HydrophobicContact CD1-CB 4.31Å; F1548-K1611 HydrophobicContact CD2-CB 4.23Å; F1548-K1611 HydrophobicContact CE1-CB 4.14Å; F1548-K1611 HydrophobicContact CE2-CB 4.07Å; F1548-K1611 HydrophobicContact CG-CB 4.35Å; F1548-K1611 HydrophobicContact CZ-CB 4.02Å; K1611-E1636 HydrophobicContact CD-CB 4.29Å; K1611-E1636 HydrophobicContact CD-CG 4.46Å; K1611-E1636 WeakPolarHBondContact CD-OE2 3.28Å; K1611-E1636 WeakPolarHBondContact CE-OE2 3.27Å; K1611-E1636 HydrophobicContact CG-CB 4.13Å; K1611-E1636 IonicContact NZ-OE2 3.77Å; K1611-E1636 PolarHBondContact NZ-OE2 2.78Å; K1611-V1637 CarbonylContact C-O 3.54Å; K1611-V1637 WeakPolarHBondContact CA-O 3.48Å; K1611-A1638 HydrophobicContact CB-CB 4.38Å
1612	V	93.7	Very high	76.6	Confident	4 Å²	4	37.6 Å²	37.6	2%	0.024	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	133.9	175.7	171.9	0	0	0	0	109.3	T1489 V1610 E1636 V1637 Y1648 A1651 Q1652 A1655	T1489-V1612 HydrophobicContact CG2-CG2 4.14Å; V1610-V1612 HydrophobicContact CG1-CG2 4.39Å; V1612-E1636 WeakPolarHBondContact O-CA 3.47Å; V1612-V1637 HydrophobicContact CB-CG2 4.13Å; V1612-V1637 PolarHBondContact N-O 2.75Å; V1612-V1637 PolarHBondContact O-N 2.82Å; V1612-Y1648 HydrophobicContact CG2-CD2 3.98Å; V1612-Y1648 HydrophobicContact CG2-CE2 4Å; V1612-A1651 HydrophobicContact CB-CB 4.11Å; V1612-A1651 HydrophobicContact CG2-CB 3.54Å; V1612-Q1652 VanDerWaalsContact CG1-OE1 3.28Å; V1612-Q1652 HydrophobicContact CG2-CG 4.41Å; V1612-A1655 HydrophobicContact CG1-CB 3.93Å
1613	P	92	Very high	77.8	Confident	9 Å²	9	30.3 Å²	30.3	6%	0.058	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	149.7	175.8	33.2	-41	0	0	0	112.5	D1487 F1615	D1487-P1613 WeakPolarHBondContact O-CG 3.31Å; P1613-F1615 HydrophobicContact CB-CE1 4.36Å; P1613-F1615 HydrophobicContact CB-CE2 3.88Å; P1613-F1615 HydrophobicContact CB-CZ 3.68Å; P1613-F1615 HydrophobicContact CG-CE2 3.53Å; P1613-F1615 HydrophobicContact CG-CZ 3.57Å
1614	V	89.8	Confident	79.3	Confident	3 Å²	3	25.1 Å²	25.1	2%	0.018	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	133	172.8	178.7	0	0	0	0	109	L645 S1633 T1634 G1635 V1637 A1655 N1658	L645-V1614 WeakPolarHBondContact O-CG1 3.44Å; V1614-S1633 WeakPolarHBondContact O-CA 3.33Å; V1614-S1633 WeakPolarHBondContact O-CB 3.47Å; V1614-T1634 PolarHBondContact O-N 3.32Å; V1614-T1634 PolarHBondContact O-OG1 3.46Å; V1614-G1635 PolarHBondContact N-O 3.34Å; V1614-G1635 PolarHBondContact O-N 3.37Å; V1614-V1637 HydrophobicContact CG2-CG1 3.98Å; V1614-V1637 HydrophobicContact CG2-CG2 4.4Å; V1614-A1655 HydrophobicContact CG2-CB 4.45Å; V1614-N1658 HydrophobicContact CG1-CB 4.5Å
1615	F	88.7	Confident	80.7	Confident	51 Å²	51	23.9 Å²	23.9	22%	0.224	15%	0.145	C	C	.	.			trans	-121.5	149.2	-178.2	-56.8	-79.1	0	0	0	111.7	D1487 P1613 F1617 L1627 V1632	D1487-F1615 HydrophobicContact CB-CE1 4.26Å; D1487-F1615 HydrophobicContact CB-CZ 4.25Å; P1613-F1615 HydrophobicContact CB-CE1 4.36Å; P1613-F1615 HydrophobicContact CB-CE2 3.88Å; P1613-F1615 HydrophobicContact CB-CZ 3.68Å; P1613-F1615 HydrophobicContact CG-CE2 3.53Å; P1613-F1615 HydrophobicContact CG-CZ 3.57Å; F1615-F1617 HydrophobicContact CB-CD2 3.63Å; F1615-F1617 HydrophobicContact CB-CE2 3.71Å; F1615-F1617 AromaticContact CD1-CE2 3.8Å; F1615-F1617 HydrophobicContact CD1-CE2 3.8Å; F1615-F1617 HydrophobicContact CD1-CZ 4.24Å; F1615-F1617 HydrophobicContact CD2-CE2 4.48Å; F1615-F1617 HydrophobicContact CG-CD2 4.19Å; F1615-F1617 AromaticContact CG-CE2 3.75Å; F1615-F1617 HydrophobicContact CG-CE2 3.75Å; F1615-L1627 HydrophobicContact CD1-CD2 4.37Å; F1615-L1627 HydrophobicContact CE1-CD2 3.56Å; F1615-L1627 HydrophobicContact CE2-CD2 4.44Å; F1615-L1627 HydrophobicContact CZ-CD1 3.95Å; F1615-L1627 HydrophobicContact CZ-CD2 3.61Å; F1615-L1627 HydrophobicContact CZ-CG 4.43Å; F1615-V1632 HydrophobicContact CD1-CG2 4.03Å; F1615-V1632 HydrophobicContact CE1-CG2 3.81Å
1616	S	85.5	Confident	82.2	Confident	11 Å²	11	19.7 Å²	19.7	8%	0.077	12%	0.124	C	C	.	.			trans	-115.4	32.3	-179.5	-55.8	0	0	0	0	113.7	I647 A1618 R1619 L1620 T1634	I647-S1616 PolarHBondContact N-OG 3.4Å; S1616-A1618 PolarHBondContact O-N 3.46Å; S1616-A1618 VanDerWaalsContact O-N 3.09Å; S1616-R1619 PolarHBondContact O-N 3.39Å; S1616-L1620 PolarHBondContact O-N 3.04Å; S1616-T1634 PolarHBondContact OG-OG1 3.22Å; S1616-T1634 VanDerWaalsContact OG-OG1 3.1Å
1617	F	84.6	Confident	83.3	Confident	19 Å²	19	18.2 Å²	18.2	8%	0.083	10%	0.101	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-23.5	-176.9	-69.6	-62.6	0	0	0	115.3	F1008 F1615 R1619 L1620 A1623 D1624 V1625 L1627 V1632 R1783 V1786	F1008-F1617 HydrophobicContact CE1-CE1 4.29Å; F1615-F1617 HydrophobicContact CB-CD2 3.63Å; F1615-F1617 HydrophobicContact CB-CE2 3.71Å; F1615-F1617 AromaticContact CD1-CE2 3.8Å; F1615-F1617 HydrophobicContact CD1-CE2 3.8Å; F1615-F1617 HydrophobicContact CD1-CZ 4.24Å; F1615-F1617 HydrophobicContact CD2-CE2 4.48Å; F1615-F1617 HydrophobicContact CG-CD2 4.19Å; F1615-F1617 AromaticContact CG-CE2 3.75Å; F1615-F1617 HydrophobicContact CG-CE2 3.75Å; F1617-R1619 VanDerWaalsContact C-N 3.26Å; F1617-R1619 PolarHBondContact O-N 3.41Å; F1617-L1620 PolarHBondContact O-N 2.97Å; F1617-A1623 HydrophobicContact CD1-CB 4.36Å; F1617-D1624 WeakPolarHBondContact CE1-O 3.3Å; F1617-V1625 HydrophobicContact CB-CG1 4Å; F1617-V1625 HydrophobicContact CD1-CG1 4.06Å; F1617-V1625 HydrophobicContact CD2-CB 4.24Å; F1617-V1625 HydrophobicContact CD2-CG1 4.18Å; F1617-V1625 HydrophobicContact CE2-CB 4.34Å; F1617-V1625 HydrophobicContact CG-CB 4.35Å; F1617-V1625 HydrophobicContact CG-CG1 3.85Å; F1617-L1627 HydrophobicContact CZ-CD2 4.47Å; F1617-V1632 HydrophobicContact CE1-CG2 4.45Å; F1617-V1632 HydrophobicContact CZ-CB 4.33Å; F1617-V1632 HydrophobicContact CZ-CG2 3.77Å; F1617-R1783 PolarHBondContact O-NH1 3.5Å; F1617-R1783 PolarHBondContact O-NH2 3.24Å; F1617-V1786 HydrophobicContact CB-CG1 3.73Å
1618	A	76.6	Confident	83.6	Confident	24 Å²	24	17.6 Å²	17.6	20%	0.198	10%	0.102	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-29.6	175.2	0	0	0	0	0	112.5	S1616 V1786	S1616-A1618 PolarHBondContact O-N 3.46Å; S1616-A1618 VanDerWaalsContact O-N 3.09Å; A1618-V1786 HydrophobicContact CB-CG1 4.13Å
1619	R	76.8	Confident	83.4	Confident	18 Å²	18	18.3 Å²	18.3	7%	0.068	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-27	176.3	-65.2	-178.2	178.6	-91.2	2.9	113.1	I647 L818 G819 M821 S1616 F1617 L1621	I647-R1619 WeakPolarHBondContact O-CD 3.27Å; I647-R1619 PolarHBondContact O-NE 3.43Å; L818-R1619 PolarHBondContact O-NH1 2.89Å; L818-R1619 PolarHBondContact O-NH2 2.74Å; G819-R1619 PolarHBondContact O-NH1 3.36Å; M821-R1619 HydrophobicContact CG-CG 3.96Å; M821-R1619 VanDerWaalsContact CG-NH1 3.31Å; M821-R1619 HydrophobicContact SD-CG 3.75Å; S1616-R1619 PolarHBondContact O-N 3.39Å; F1617-R1619 VanDerWaalsContact C-N 3.26Å; F1617-R1619 PolarHBondContact O-N 3.41Å; R1619-L1621 PolarHBondContact O-N 2.91Å
1620	L	78.8	Confident	82.8	Confident	4 Å²	4	19.7 Å²	19.7	2%	0.021	11%	0.113	C	C	.	.	S	Bend	trans	-90.8	72.7	-178.7	-58.6	175.3	0	0	0	110.8	I647 L1005 F1008 V1011 S1616 F1617 G1622 A1623 R1783	I647-L1620 HydrophobicContact CD1-CD1 4.26Å; I647-L1620 HydrophobicContact CD1-CD2 4.06Å; I647-L1620 HydrophobicContact CD1-CG 4.23Å; L1005-L1620 HydrophobicContact CD2-CD2 3.83Å; F1008-L1620 HydrophobicContact CD1-CD1 3.9Å; F1008-L1620 HydrophobicContact CD2-CD1 3.92Å; F1008-L1620 HydrophobicContact CE1-CD1 3.5Å; F1008-L1620 VanDerWaalsContact CE1-CD1 3.5Å; F1008-L1620 HydrophobicContact CE2-CD1 3.53Å; F1008-L1620 HydrophobicContact CG-CD1 4.09Å; F1008-L1620 HydrophobicContact CZ-CD1 3.3Å; V1011-L1620 HydrophobicContact CG2-CB 4.02Å; V1011-L1620 HydrophobicContact CG2-CD2 4.16Å; S1616-L1620 PolarHBondContact O-N 3.04Å; F1617-L1620 PolarHBondContact O-N 2.97Å; L1620-G1622 PolarHBondContact O-N 3.04Å; L1620-A1623 HydrophobicContact CB-CB 3.98Å; L1620-A1623 VanDerWaalsContact O-CB 3.25Å; L1620-A1623 WeakPolarHBondContact O-CB 3.23Å; L1620-A1623 PolarHBondContact O-N 3.33Å; L1620-A1623 VanDerWaalsContact O-N 3.14Å; L1620-R1783 PolarHBondContact O-NH1 2.94Å
1621	L	75.1	Confident	82.3	Confident	83 Å²	83	19.8 Å²	19.8	44%	0.435	11%	0.114	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	127.9	-178.3	-65.2	176.6	0	0	0	111.7	V1011 S1012 R1619 A1623	V1011-L1621 WeakPolarHBondContact CA-O 3.35Å; S1012-L1621 PolarHBondContact N-O 3.5Å; R1619-L1621 PolarHBondContact O-N 2.91Å; L1621-A1623 VanDerWaalsContact C-N 3.34Å
1622	G	72.2	Confident	81.8	Confident	23 Å²	23	19.9 Å²	19.9	24%	0.237	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	90.3	-13.5	-180	0	0	0	0	0	114.9	L1620 Y1779	L1620-G1622 PolarHBondContact O-N 3.04Å; G1622-Y1779 PolarHBondContact O-OH 3.45Å
1623	A	77.1	Confident	81.6	Confident	0 Å²	0	19.7 Å²	19.7	0%	0	11%	0.113	C	C	.	.			trans	-65.4	138.6	177	0	0	0	0	0	111.6	F1008 F1617 L1620 L1621 R1783	F1008-A1623 HydrophobicContact CB-CB 4.07Å; F1008-A1623 HydrophobicContact CD1-CB 3.93Å; F1008-A1623 HydrophobicContact CG-CB 4.34Å; F1617-A1623 HydrophobicContact CD1-CB 4.36Å; L1620-A1623 HydrophobicContact CB-CB 3.98Å; L1620-A1623 VanDerWaalsContact O-CB 3.25Å; L1620-A1623 WeakPolarHBondContact O-CB 3.23Å; L1620-A1623 PolarHBondContact O-N 3.33Å; L1620-A1623 VanDerWaalsContact O-N 3.14Å; L1621-A1623 VanDerWaalsContact C-N 3.34Å; A1623-R1783 VanDerWaalsContact O-CD 3.22Å; A1623-R1783 WeakPolarHBondContact O-CD 3.33Å; A1623-R1783 PolarHBondContact O-NH1 3.41Å
1624	D	75.7	Confident	81.2	Confident	14 Å²	14	20.1 Å²	20.1	8%	0.075	12%	0.116	C	C	.	.			trans	-72.7	144.1	169.8	-162.4	0.1	0	0	0	109.9	F1617 F1774 R1782	F1617-D1624 WeakPolarHBondContact CE1-O 3.3Å; D1624-F1774 HydrophobicContact CB-CE1 4.3Å; D1624-R1782 IonicContact OD1-NH2 3.52Å
1625	V	80.2	Confident	81.2	Confident	7 Å²	7	20 Å²	20	4%	0.042	12%	0.115	C	C	.	.			trans	-102.3	12.1	-172.7	-54.1	0	0	0	0	112.4	F1617 R1782 V1786 L1792	F1617-V1625 HydrophobicContact CB-CG1 4Å; F1617-V1625 HydrophobicContact CD1-CG1 4.06Å; F1617-V1625 HydrophobicContact CD2-CB 4.24Å; F1617-V1625 HydrophobicContact CD2-CG1 4.18Å; F1617-V1625 HydrophobicContact CE2-CB 4.34Å; F1617-V1625 HydrophobicContact CG-CB 4.35Å; F1617-V1625 HydrophobicContact CG-CG1 3.85Å; V1625-R1782 HydrophobicContact CG2-CB 3.6Å; V1625-R1782 HydrophobicContact CG2-CG 4.25Å; V1625-V1786 HydrophobicContact CG1-CG2 4Å; V1625-L1792 HydrophobicContact CG2-CD2 3.8Å
1626	L	81.9	Confident	81.3	Confident	45 Å²	45	17.6 Å²	17.6	24%	0.236	10%	0.104	C	C	.	.			trans	-87.3	132.2	173.2	-67.3	177.3	0	0	0	109.9	T1794	L1626-T1794 HydrophobicContact CD2-CG2 4.12Å
1627	L	83.7	Confident	81.6	Confident	31 Å²	31	17 Å²	17	16%	0.162	10%	0.1	C	C	.	.			trans	-77.6	158.9	177.7	-53.1	-179.2	0	0	0	111.4	V1483 D1487 F1615 F1617 V1632	V1483-L1627 HydrophobicContact CG1-CB 4.18Å; V1483-L1627 HydrophobicContact CG1-CD1 4.02Å; V1483-L1627 HydrophobicContact CG2-CB 4.22Å; D1487-L1627 HydrophobicContact CB-CD1 4.43Å; F1615-L1627 HydrophobicContact CD1-CD2 4.37Å; F1615-L1627 HydrophobicContact CE1-CD2 3.56Å; F1615-L1627 HydrophobicContact CE2-CD2 4.44Å; F1615-L1627 HydrophobicContact CZ-CD1 3.95Å; F1615-L1627 HydrophobicContact CZ-CD2 3.61Å; F1615-L1627 HydrophobicContact CZ-CG 4.43Å; F1617-L1627 HydrophobicContact CZ-CD2 4.47Å; L1627-V1632 HydrophobicContact CD2-CG2 3.57Å
1628	G	80	Confident	82	Confident	12 Å²	12	16.1 Å²	16.1	12%	0.124	10%	0.097	C	C	.	.			trans	-160.7	-158.5	179	0	0	0	0	0	112.1	G1482 V1483 H1484 E1630	G1482-G1628 CarbonylContact O-C 3.47Å; G1482-G1628 WeakPolarHBondContact O-CA 3.29Å; V1483-G1628 WeakPolarHBondContact CA-O 3.4Å; H1484-G1628 PolarHBondContact N-O 3.05Å; G1628-E1630 VanDerWaalsContact C-N 3.3Å; G1628-E1630 PolarHBondContact O-N 3.39Å
1629	V	78.6	Confident	82.7	Confident	22 Å²	22	15 Å²	15	13%	0.133	9%	0.087	C	C	.	.	S	Bend	trans	-76.6	-16.6	-177.8	-62.3	0	0	0	0	113.7	L1409 M1421 V1423 F1451 G1482 H1484	L1409-V1629 HydrophobicContact CD1-CB 4.35Å; L1409-V1629 HydrophobicContact CD1-CG1 4.08Å; L1409-V1629 HydrophobicContact CD1-CG2 4.03Å; M1421-V1629 HydrophobicContact CB-CG2 3.86Å; V1423-V1629 HydrophobicContact CG2-CG1 3.77Å; V1423-V1629 HydrophobicContact CG2-CG2 4.05Å; F1451-V1629 HydrophobicContact CE2-CG1 4.05Å; G1482-V1629 PolarHBondContact O-N 3.28Å; H1484-V1629 PolarHBondContact CD2-O 2.92Å
1630	E	77.7	Confident	83.1	Confident	29 Å²	29	15.1 Å²	15.1	14%	0.136	9%	0.088	C	C	.	.	S	Bend	trans	-93.5	128.1	172.9	-176.2	-179.2	-152	0	0	108.8	G1628 R1769	G1628-E1630 VanDerWaalsContact C-N 3.3Å; G1628-E1630 PolarHBondContact O-N 3.39Å; E1630-R1769 IonicContact OE2-CZ 3.85Å; E1630-R1769 IonicContact OE2-NH1 3.97Å; E1630-R1769 PolarHBondContact OE2-NH1 2.94Å; E1630-R1769 VanDerWaalsContact OE2-NH1 3.08Å; E1630-R1769 IonicContact OE2-NH2 2.88Å
1631	M	84.6	Confident	83	Confident	4 Å²	4	15 Å²	15	2%	0.02	9%	0.088	C	C	.	.			trans	-67.1	135.8	-177.8	-168	-178.6	153.2	0	0	112.3	I1268 G1269 H1484 D1487 R1544 S1633	I1268-M1631 HydrophobicContact CG2-CB 4.26Å; I1268-M1631 HydrophobicContact CG2-CE 4.35Å; I1268-M1631 HydrophobicContact CG2-CG 4.11Å; I1268-M1631 VanDerWaalsContact CG2-O 3.27Å; I1268-M1631 WeakPolarHBondContact CG2-O 3.27Å; I1268-M1631 HydrophobicContact CG2-SD 4.48Å; G1269-M1631 WeakPolarHBondContact CA-SD 3.23Å; H1484-M1631 HydrophobicContact CB-CB 4.29Å; D1487-M1631 WeakPolarHBondContact OD1-CG 3.28Å; D1487-M1631 WeakPolarHBondContact OD2-CA 3.38Å; R1544-M1631 VanDerWaalsContact NH1-CE 3.27Å; M1631-S1633 WeakPolarHBondContact CE-O 3.49Å; M1631-S1633 WeakPolarHBondContact CE-OG 3.5Å
1632	V	85.8	Confident	82.9	Confident	5 Å²	5	15.3 Å²	15.3	3%	0.03	9%	0.093	C	C	.	.			trans	-129.7	-9.8	178.9	-62.4	0	0	0	0	114.8	F1008 D1487 F1615 F1617 L1627	F1008-V1632 HydrophobicContact CD1-CG1 4.5Å; F1008-V1632 HydrophobicContact CE1-CB 3.9Å; F1008-V1632 HydrophobicContact CE1-CG1 3.86Å; F1008-V1632 HydrophobicContact CZ-CB 4.34Å; F1008-V1632 HydrophobicContact CZ-CG1 4.45Å; D1487-V1632 PolarHBondContact OD1-N 3.17Å; D1487-V1632 VanDerWaalsContact OD1-N 3.14Å; D1487-V1632 WeakPolarHBondContact OD2-CG2 3.26Å; D1487-V1632 PolarHBondContact OD2-N 3.24Å; F1615-V1632 HydrophobicContact CD1-CG2 4.03Å; F1615-V1632 HydrophobicContact CE1-CG2 3.81Å; F1617-V1632 HydrophobicContact CE1-CG2 4.45Å; F1617-V1632 HydrophobicContact CZ-CB 4.33Å; F1617-V1632 HydrophobicContact CZ-CG2 3.77Å; L1627-V1632 HydrophobicContact CD2-CG2 3.57Å
1633	S	87.6	Confident	83	Confident	0 Å²	0	16.7 Å²	16.7	0%	0	10%	0.095	C	C	.	.			trans	-67.9	147.2	175	71.2	0	0	0	0	111.7	G1486 D1487 V1614 M1631	G1486-S1633 PolarHBondContact O-OG 3.31Å; D1487-S1633 WeakPolarHBondContact OD1-CA 3.35Å; D1487-S1633 WeakPolarHBondContact OD1-CB 3.47Å; D1487-S1633 PolarHBondContact OD1-N 3.35Å; D1487-S1633 PolarHBondContact OD1-OG 3.1Å; V1614-S1633 WeakPolarHBondContact O-CA 3.33Å; V1614-S1633 WeakPolarHBondContact O-CB 3.47Å; M1631-S1633 WeakPolarHBondContact CE-O 3.49Å; M1631-S1633 WeakPolarHBondContact CE-OG 3.5Å
1634	T	85	Confident	83.5	Confident	18 Å²	18	18.6 Å²	18.6	11%	0.11	10%	0.102	C	C	.	.			trans	-101.2	-22.9	-179.4	44.5	0	0	0	0	112	L645 I647 V1614 S1616	L645-T1634 PolarHBondContact O-OG1 3.41Å; I647-T1634 HydrophobicContact CD1-CG2 4.16Å; I647-T1634 HydrophobicContact CG1-CG2 3.89Å; V1614-T1634 PolarHBondContact O-N 3.32Å; V1614-T1634 PolarHBondContact O-OG1 3.46Å; S1616-T1634 PolarHBondContact OG-OG1 3.22Å; S1616-T1634 VanDerWaalsContact OG-OG1 3.1Å
1635	G	88.8	Confident	84.1	Confident	0 Å²	0	19.7 Å²	19.7	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.4	-167.4	178.7	0	0	0	0	0	111.6	L645 V1614	L645-G1635 PolarHBondContact O-N 2.85Å; V1614-G1635 PolarHBondContact N-O 3.34Å; V1614-G1635 PolarHBondContact O-N 3.37Å
1636	E	91.2	Very high	84.2	Confident	0 Å²	0	21.2 Å²	21.2	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	158.7	-179.9	53.5	-173.2	-132.5	0	0	111.2	G644 A679 K1611 V1612	G644-E1636 WeakPolarHBondContact CA-O 3.49Å; A679-E1636 HydrophobicContact CB-CG 4.46Å; K1611-E1636 HydrophobicContact CD-CB 4.29Å; K1611-E1636 HydrophobicContact CD-CG 4.46Å; K1611-E1636 WeakPolarHBondContact CD-OE2 3.28Å; K1611-E1636 WeakPolarHBondContact CE-OE2 3.27Å; K1611-E1636 HydrophobicContact CG-CB 4.13Å; K1611-E1636 IonicContact NZ-OE2 3.77Å; K1611-E1636 PolarHBondContact NZ-OE2 2.78Å; V1612-E1636 WeakPolarHBondContact O-CA 3.47Å
1637	V	92.1	Very high	84.4	Confident	0 Å²	0	19 Å²	19	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	149.9	172	-67.6	0	0	0	0	108.8	S676 K1611 V1612 V1614 A1651 A1654 A1655	S676-V1637 WeakPolarHBondContact O-CA 3.48Å; K1611-V1637 CarbonylContact C-O 3.54Å; K1611-V1637 WeakPolarHBondContact CA-O 3.48Å; V1612-V1637 HydrophobicContact CB-CG2 4.13Å; V1612-V1637 PolarHBondContact N-O 2.75Å; V1612-V1637 PolarHBondContact O-N 2.82Å; V1614-V1637 HydrophobicContact CG2-CG1 3.98Å; V1614-V1637 HydrophobicContact CG2-CG2 4.4Å; V1637-A1651 WeakPolarHBondContact CG2-O 3.29Å; V1637-A1654 HydrophobicContact CB-CB 4.08Å; V1637-A1654 HydrophobicContact CG1-CB 4.24Å; V1637-A1654 HydrophobicContact CG2-CB 4.02Å; V1637-A1655 HydrophobicContact CG2-CB 3.92Å
1638	A	92.7	Very high	84.9	Confident	0 Å²	0	17.6 Å²	17.6	0%	0	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	146.9	168.5	0	0	0	0	0	111.5	S676 I678 F1548 V1610 K1611	S676-A1638 PolarHBondContact O-N 2.79Å; I678-A1638 HydrophobicContact CB-CB 3.74Å; I678-A1638 HydrophobicContact CG1-CB 4.14Å; I678-A1638 HydrophobicContact CG2-CB 3.61Å; F1548-A1638 HydrophobicContact CD2-CB 3.69Å; F1548-A1638 HydrophobicContact CE2-CB 3.76Å; V1610-A1638 VanDerWaalsContact O-CA 3.25Å; V1610-A1638 WeakPolarHBondContact O-CA 3.36Å; V1610-A1638 WeakPolarHBondContact O-CB 3.11Å; K1611-A1638 HydrophobicContact CB-CB 4.38Å
1639	C	90.4	Very high	85.1	Confident	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	154.8	174.5	-66.9	0	0	0	0	109.4	L693 V1610 L1650 A1651	L693-C1639 PolarHBondContact O-SG 3.37Å; V1610-C1639 PolarHBondContact N-O 3Å; V1610-C1639 VanDerWaalsContact N-O 3.13Å; V1610-C1639 PolarHBondContact O-N 2.84Å; C1639-L1650 HydrophobicContact CB-CB 3.42Å; C1639-L1650 VanDerWaalsContact CB-CB 3.42Å; C1639-L1650 HydrophobicContact CB-CD1 4.4Å; C1639-L1650 VanDerWaalsContact SG-C 3.57Å; C1639-A1651 HydrophobicContact CB-CB 4.29Å
1640	F	86.6	Confident	85.5	Confident	21 Å²	21	18.1 Å²	18.1	9%	0.092	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	146.2	175.3	-58	-15.6	0	0	0	109.6	L693 T1552 Y1607 V1608 I1844	L693-F1640 HydrophobicContact CD1-CD1 4.07Å; L693-F1640 HydrophobicContact CD1-CD2 4.04Å; L693-F1640 HydrophobicContact CD1-CE1 3.52Å; L693-F1640 HydrophobicContact CD1-CE2 3.52Å; L693-F1640 HydrophobicContact CD1-CG 4.31Å; L693-F1640 HydrophobicContact CD1-CZ 3.22Å; T1552-F1640 VanDerWaalsContact OG1-CE1 3.25Å; T1552-F1640 WeakPolarHBondContact OG1-CE1 3.13Å; Y1607-F1640 HydrophobicContact CD2-CB 4.1Å; Y1607-F1640 HydrophobicContact CD2-CD2 4.06Å; Y1607-F1640 HydrophobicContact CD2-CG 4.03Å; Y1607-F1640 AromaticContact CE2-CD2 3.89Å; Y1607-F1640 HydrophobicContact CE2-CD2 3.89Å; Y1607-F1640 HydrophobicContact CE2-CE2 4.09Å; Y1607-F1640 HydrophobicContact CE2-CG 4.23Å; V1608-F1640 WeakPolarHBondContact O-CA 3.42Å; F1640-I1844 HydrophobicContact CE2-CD1 4.35Å; F1640-I1844 HydrophobicContact CE2-CG1 4.21Å; F1640-I1844 HydrophobicContact CZ-CD1 4.5Å
1641	G	76.9	Confident	86	Confident	2 Å²	2	16.7 Å²	16.7	2%	0.021	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	165	175.2	0	0	0	0	0	111	Y1607 V1608 D1643 E1646	Y1607-G1641 CarbonylContact C-O 3.45Å; Y1607-G1641 VanDerWaalsContact CA-O 3.31Å; Y1607-G1641 WeakPolarHBondContact CA-O 3.44Å; Y1607-G1641 VanDerWaalsContact CB-O 3.27Å; Y1607-G1641 WeakPolarHBondContact CB-O 3.46Å; V1608-G1641 PolarHBondContact N-O 3.42Å; V1608-G1641 PolarHBondContact O-N 3.09Å; G1641-D1643 PolarHBondContact O-N 2.92Å; G1641-E1646 WeakPolarHBondContact CA-OE2 3.37Å
1642	V	72	Confident	86.2	Confident	88 Å²	88	17.9 Å²	17.9	53%	0.533	9%	0.091	S	C	.	.	S	Bend	trans	-66.4	-22.7	177.7	-59.6	0	0	0	0	112.2	E1646	V1642-E1646 WeakPolarHBondContact CG2-OE2 3.43Å; V1642-E1646 PolarHBondContact N-OE2 3.15Å
1643	D	75	Confident	86.1	Confident	52 Å²	52	18.5 Å²	18.5	28%	0.278	10%	0.097	S	C	.	.	S	Bend	trans	-141.5	173.9	169.4	71.2	26.6	0	0	0	111	G1641 Y1645 E1646 A1647 R1808	G1641-D1643 PolarHBondContact O-N 2.92Å; D1643-Y1645 PolarHBondContact O-N 2.75Å; D1643-Y1645 WeakPolarHBondContact OD1-CA 3.36Å; D1643-Y1645 WeakPolarHBondContact OD1-CB 3.4Å; D1643-Y1645 PolarHBondContact OD1-N 3.41Å; D1643-E1646 PolarHBondContact OD1-N 3.47Å; D1643-A1647 WeakPolarHBondContact O-CB 3.49Å; D1643-A1647 PolarHBondContact O-N 3.25Å; D1643-R1808 IonicContact OD2-NH1 3.35Å
1644	R	88	Confident	86	Confident	41 Å²	41	18.5 Å²	18.5	16%	0.155	10%	0.097	C	C	.	.	H	α-helix	trans	-63.7	-24.2	179.5	69.8	174.8	179.8	-169.2	-7	114.3	V1491 Q1495 D1496 V1608 V1610 Y1648	V1491-R1644 HydrophobicContact CG1-CB 4.09Å; Q1495-R1644 HydrophobicContact CG-CB 4.26Å; D1496-R1644 IonicContact OD1-CZ 2.68Å; D1496-R1644 VanDerWaalsContact OD1-CZ 3.31Å; D1496-R1644 IonicContact OD1-NH1 3.67Å; D1496-R1644 PolarHBondContact OD1-NH1 3.08Å; D1496-R1644 IonicContact OD1-NH2 3.9Å; D1496-R1644 PolarHBondContact OD1-NH2 3.36Å; D1496-R1644 IonicContact OD2-CZ 2.71Å; D1496-R1644 IonicContact OD2-NH1 3.49Å; D1496-R1644 PolarHBondContact OD2-NH1 3.36Å; D1496-R1644 IonicContact OD2-NH2 2.78Å; V1608-R1644 HydrophobicContact CG1-CB 4.19Å; V1610-R1644 HydrophobicContact CG2-CB 4.27Å; R1644-Y1648 WeakPolarHBondContact O-CB 3.45Å; R1644-Y1648 PolarHBondContact O-N 3.12Å
1645	Y	87.7	Confident	86	Confident	36 Å²	36	18.3 Å²	18.3	14%	0.141	10%	0.097	C	C	.	.	H	α-helix	trans	-78.1	-43.4	-174.9	-57.2	-79.3	0	0	0	110.1	D1643 L1649 L1801 E1804 A1805	D1643-Y1645 PolarHBondContact O-N 2.75Å; D1643-Y1645 WeakPolarHBondContact OD1-CA 3.36Å; D1643-Y1645 WeakPolarHBondContact OD1-CB 3.4Å; D1643-Y1645 PolarHBondContact OD1-N 3.41Å; Y1645-L1649 PolarHBondContact O-N 3.27Å; Y1645-L1801 HydrophobicContact CD1-CD1 3.66Å; Y1645-L1801 HydrophobicContact CE1-CD1 3.72Å; Y1645-E1804 HydrophobicContact CD1-CB 4.37Å; Y1645-E1804 HydrophobicContact CD1-CG 3.83Å; Y1645-E1804 HydrophobicContact CE1-CB 4.18Å; Y1645-E1804 HydrophobicContact CE1-CG 3.45Å; Y1645-E1804 VanDerWaalsContact CE1-CG 3.45Å; Y1645-A1805 HydrophobicContact CD1-CB 4.3Å
1646	E	82	Confident	85.7	Confident	39 Å²	39	19.7 Å²	19.7	18%	0.182	10%	0.104	C	C	.	.	H	α-helix	trans	-63.2	-51	172.1	-176.5	-174.3	-158.8	0	0	111.1	G1641 V1642 D1643 Y1648 L1649 L1650 L1838	G1641-E1646 WeakPolarHBondContact CA-OE2 3.37Å; V1642-E1646 WeakPolarHBondContact CG2-OE2 3.43Å; V1642-E1646 PolarHBondContact N-OE2 3.15Å; D1643-E1646 PolarHBondContact OD1-N 3.47Å; E1646-Y1648 VanDerWaalsContact C-N 3.25Å; E1646-Y1648 PolarHBondContact O-N 2.85Å; E1646-L1649 PolarHBondContact O-N 3.42Å; E1646-L1649 VanDerWaalsContact O-N 3.11Å; E1646-L1650 HydrophobicContact CG-CD1 4.18Å; E1646-L1650 PolarHBondContact O-N 3.18Å; E1646-L1838 WeakPolarHBondContact OE1-CD1 3.4Å; E1646-L1838 WeakPolarHBondContact OE1-CD2 3.41Å
1647	A	86.8	Confident	84.9	Confident	0 Å²	0	20.6 Å²	20.6	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-56	-42.6	179.2	0	0	0	0	0	111.4	V1608 V1610 D1643 A1651	V1608-A1647 WeakPolarHBondContact O-CB 3.49Å; V1610-A1647 HydrophobicContact CB-CB 3.84Å; V1610-A1647 HydrophobicContact CG2-CB 3.51Å; D1643-A1647 WeakPolarHBondContact O-CB 3.49Å; D1643-A1647 PolarHBondContact O-N 3.25Å; A1647-A1651 VanDerWaalsContact O-CB 3.32Å; A1647-A1651 WeakPolarHBondContact O-CB 3.33Å; A1647-A1651 PolarHBondContact O-N 3.35Å
1648	Y	92.7	Very high	83.8	Confident	1 Å²	1	21.2 Å²	21.2	0%	0.004	11%	0.113	C	C	.	.	H	α-helix	trans	-66.5	-41	176.4	-177.8	-110	0	0	0	113.2	T1489 V1610 V1612 R1644 E1646 A1651 Q1652 L1798 L1801 L1802	T1489-Y1648 HydrophobicContact CG2-CD2 3.91Å; T1489-Y1648 HydrophobicContact CG2-CE2 3.77Å; V1610-Y1648 HydrophobicContact CG1-CD2 3.85Å; V1610-Y1648 HydrophobicContact CG1-CG 4.46Å; V1612-Y1648 HydrophobicContact CG2-CD2 3.98Å; V1612-Y1648 HydrophobicContact CG2-CE2 4Å; R1644-Y1648 WeakPolarHBondContact O-CB 3.45Å; R1644-Y1648 PolarHBondContact O-N 3.12Å; E1646-Y1648 VanDerWaalsContact C-N 3.25Å; E1646-Y1648 PolarHBondContact O-N 2.85Å; Y1648-A1651 PolarHBondContact O-N 3.02Å; Y1648-Q1652 HydrophobicContact CD1-CG 4.08Å; Y1648-Q1652 HydrophobicContact CD2-CG 4.05Å; Y1648-Q1652 HydrophobicContact CE1-CG 3.74Å; Y1648-Q1652 HydrophobicContact CE2-CG 3.71Å; Y1648-Q1652 HydrophobicContact CG-CG 4.25Å; Y1648-Q1652 VanDerWaalsContact O-CB 3.29Å; Y1648-Q1652 WeakPolarHBondContact O-CB 3.45Å; Y1648-Q1652 WeakPolarHBondContact O-CG 3.39Å; Y1648-Q1652 PolarHBondContact O-N 2.92Å; Y1648-Q1652 PolarHBondContact OH-NE2 2.77Å; Y1648-L1798 HydrophobicContact CE2-CD2 4.35Å; Y1648-L1801 HydrophobicContact CD1-CB 4.44Å; Y1648-L1801 HydrophobicContact CD1-CD2 3.73Å; Y1648-L1801 HydrophobicContact CD1-CG 3.57Å; Y1648-L1801 HydrophobicContact CD2-CD2 3.67Å; Y1648-L1801 HydrophobicContact CD2-CG 4.44Å; Y1648-L1801 HydrophobicContact CE1-CB 4.14Å; Y1648-L1801 HydrophobicContact CE1-CD2 3.89Å; Y1648-L1801 HydrophobicContact CE1-CG 3.74Å; Y1648-L1801 HydrophobicContact CE2-CD2 3.84Å; Y1648-L1801 HydrophobicContact CG-CD2 3.59Å; Y1648-L1801 HydrophobicContact CG-CG 3.93Å; Y1648-L1802 HydrophobicContact CE1-CB 3.9Å; Y1648-L1802 HydrophobicContact CE1-CD1 4.16Å
1649	L	85.6	Confident	82.5	Confident	15 Å²	15	23.9 Å²	23.9	8%	0.079	13%	0.13	C	C	.	.	H	α-helix	trans	-62.9	-42.9	176.2	-82	172.2	0	0	0	112.3	Y1645 E1646 Q1652 A1653 L1663 L1802 A1805 L1806 Y1809	Y1645-L1649 PolarHBondContact O-N 3.27Å; E1646-L1649 PolarHBondContact O-N 3.42Å; E1646-L1649 VanDerWaalsContact O-N 3.11Å; L1649-Q1652 PolarHBondContact O-N 2.99Å; L1649-A1653 WeakPolarHBondContact O-CB 3.36Å; L1649-A1653 PolarHBondContact O-N 3.11Å; L1649-L1663 HydrophobicContact CD2-CD1 4.4Å; L1649-L1802 HydrophobicContact CD2-CD1 4.05Å; L1649-A1805 HydrophobicContact CD1-CB 3.79Å; L1649-A1805 WeakPolarHBondContact CD1-O 3.39Å; L1649-A1805 HydrophobicContact CD2-CB 4.04Å; L1649-A1805 HydrophobicContact CG-CB 3.56Å; L1649-L1806 HydrophobicContact CD2-CD2 3.86Å; L1649-L1806 HydrophobicContact CD2-CG 4.13Å; L1649-Y1809 HydrophobicContact CD1-CD2 4.26Å; L1649-Y1809 HydrophobicContact CD1-CG 4.08Å
1650	L	85.8	Confident	81.3	Confident	29 Å²	29	29.2 Å²	29.2	15%	0.152	16%	0.158	C	C	.	.	H	α-helix	trans	-64.6	-46.7	176.3	-67.6	174.1	0	0	0	110.6	L694 P695 C1639 E1646 Q1652 A1653 A1654	L694-L1650 HydrophobicContact CD2-CD1 4.28Å; P695-L1650 VanDerWaalsContact CG-O 3.28Å; P695-L1650 WeakPolarHBondContact CG-O 3.48Å; C1639-L1650 HydrophobicContact CB-CB 3.42Å; C1639-L1650 VanDerWaalsContact CB-CB 3.42Å; C1639-L1650 HydrophobicContact CB-CD1 4.4Å; C1639-L1650 VanDerWaalsContact SG-C 3.57Å; E1646-L1650 HydrophobicContact CG-CD1 4.18Å; E1646-L1650 PolarHBondContact O-N 3.18Å; L1650-Q1652 VanDerWaalsContact C-N 3.32Å; L1650-Q1652 PolarHBondContact O-N 3.12Å; L1650-A1653 WeakPolarHBondContact O-CB 3.35Å; L1650-A1653 PolarHBondContact O-N 3.5Å; L1650-A1654 PolarHBondContact O-N 2.85Å
1651	A	89.6	Confident	80.4	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-62.2	-39.7	177.7	0	0	0	0	0	112	V1612 V1637 C1639 A1647 Y1648 A1654 A1655	V1612-A1651 HydrophobicContact CB-CB 4.11Å; V1612-A1651 HydrophobicContact CG2-CB 3.54Å; V1637-A1651 WeakPolarHBondContact CG2-O 3.29Å; C1639-A1651 HydrophobicContact CB-CB 4.29Å; A1647-A1651 VanDerWaalsContact O-CB 3.32Å; A1647-A1651 WeakPolarHBondContact O-CB 3.33Å; A1647-A1651 PolarHBondContact O-N 3.35Å; Y1648-A1651 PolarHBondContact O-N 3.02Å; A1651-A1654 WeakPolarHBondContact O-CB 3.33Å; A1651-A1654 PolarHBondContact O-N 2.94Å; A1651-A1655 PolarHBondContact O-N 2.87Å
1652	Q	88.5	Confident	80.2	Confident	28 Å²	28	34.8 Å²	34.8	13%	0.131	19%	0.19	C	C	.	.	H	α-helix	trans	-67	-40.6	175.1	-74.7	-73.3	54.2	0	0	112.6	V1612 Y1648 L1649 L1650 A1654 A1655 L1656 L1663	V1612-Q1652 VanDerWaalsContact CG1-OE1 3.28Å; V1612-Q1652 HydrophobicContact CG2-CG 4.41Å; Y1648-Q1652 HydrophobicContact CD1-CG 4.08Å; Y1648-Q1652 HydrophobicContact CD2-CG 4.05Å; Y1648-Q1652 HydrophobicContact CE1-CG 3.74Å; Y1648-Q1652 HydrophobicContact CE2-CG 3.71Å; Y1648-Q1652 HydrophobicContact CG-CG 4.25Å; Y1648-Q1652 VanDerWaalsContact O-CB 3.29Å; Y1648-Q1652 WeakPolarHBondContact O-CB 3.45Å; Y1648-Q1652 WeakPolarHBondContact O-CG 3.39Å; Y1648-Q1652 PolarHBondContact O-N 2.92Å; Y1648-Q1652 PolarHBondContact OH-NE2 2.77Å; L1649-Q1652 PolarHBondContact O-N 2.99Å; L1650-Q1652 VanDerWaalsContact C-N 3.32Å; L1650-Q1652 PolarHBondContact O-N 3.12Å; Q1652-A1654 VanDerWaalsContact C-N 3.3Å; Q1652-A1654 PolarHBondContact O-N 3.22Å; Q1652-A1655 PolarHBondContact O-N 3.25Å; Q1652-L1656 WeakPolarHBondContact O-CB 3.25Å; Q1652-L1656 WeakPolarHBondContact O-CG 3.43Å; Q1652-L1656 PolarHBondContact O-N 3.02Å; Q1652-L1663 HydrophobicContact CB-CD2 4.36Å
1653	A	83.8	Confident	80.5	Confident	18 Å²	18	32.9 Å²	32.9	15%	0.149	18%	0.177	C	C	.	.	H	α-helix	trans	-58.8	-45.7	171.9	0	0	0	0	0	110.6	P695 L1649 L1650 A1655 L1656 C1657 L1663	P695-A1653 HydrophobicContact CB-CB 4.19Å; P695-A1653 HydrophobicContact CG-CB 3.73Å; L1649-A1653 WeakPolarHBondContact O-CB 3.36Å; L1649-A1653 PolarHBondContact O-N 3.11Å; L1650-A1653 WeakPolarHBondContact O-CB 3.35Å; L1650-A1653 PolarHBondContact O-N 3.5Å; A1653-A1655 PolarHBondContact O-N 3.43Å; A1653-L1656 PolarHBondContact O-N 2.79Å; A1653-C1657 PolarHBondContact O-N 3Å; A1653-C1657 PolarHBondContact O-SG 2.64Å; A1653-L1663 HydrophobicContact CB-CD1 3.79Å; A1653-L1663 HydrophobicContact CB-CG 4.28Å
1654	A	85	Confident	80.8	Confident	1 Å²	1	30.6 Å²	30.6	1%	0.008	17%	0.165	C	C	.	.	H	α-helix	trans	-59.6	-45.7	177	0	0	0	0	0	112.4	P695 V1637 L1650 A1651 Q1652 L1656 C1657 N1658	P695-A1654 HydrophobicContact CB-CB 4.14Å; P695-A1654 HydrophobicContact CG-CB 4.06Å; V1637-A1654 HydrophobicContact CB-CB 4.08Å; V1637-A1654 HydrophobicContact CG1-CB 4.24Å; V1637-A1654 HydrophobicContact CG2-CB 4.02Å; L1650-A1654 PolarHBondContact O-N 2.85Å; A1651-A1654 WeakPolarHBondContact O-CB 3.33Å; A1651-A1654 PolarHBondContact O-N 2.94Å; Q1652-A1654 VanDerWaalsContact C-N 3.3Å; Q1652-A1654 PolarHBondContact O-N 3.22Å; A1654-L1656 VanDerWaalsContact C-N 3.35Å; A1654-L1656 PolarHBondContact O-N 2.89Å; A1654-C1657 PolarHBondContact O-N 3Å; A1654-N1658 PolarHBondContact O-N 3.48Å
1655	A	85.8	Confident	80.4	Confident	13 Å²	13	34.9 Å²	34.9	11%	0.107	18%	0.184	C	C	.	.	H	α-helix	trans	-62.8	-40.5	178.3	0	0	0	0	0	112.2	V1612 V1614 V1637 A1651 Q1652 A1653	V1612-A1655 HydrophobicContact CG1-CB 3.93Å; V1614-A1655 HydrophobicContact CG2-CB 4.45Å; V1637-A1655 HydrophobicContact CG2-CB 3.92Å; A1651-A1655 PolarHBondContact O-N 2.87Å; Q1652-A1655 PolarHBondContact O-N 3.25Å; A1653-A1655 PolarHBondContact O-N 3.43Å
1656	L	81.8	Confident	79.8	Confident	30 Å²	30	35.5 Å²	35.5	16%	0.157	19%	0.192	C	C	.	.	H	α-helix	trans	-68.3	-36.5	176.4	-72.6	172.2	0	0	0	112.6	Q1652 A1653 A1654 N1658 T1659 N1660 G1661 L1663 P1791	Q1652-L1656 WeakPolarHBondContact O-CB 3.25Å; Q1652-L1656 WeakPolarHBondContact O-CG 3.43Å; Q1652-L1656 PolarHBondContact O-N 3.02Å; A1653-L1656 PolarHBondContact O-N 2.79Å; A1654-L1656 VanDerWaalsContact C-N 3.35Å; A1654-L1656 PolarHBondContact O-N 2.89Å; L1656-N1658 VanDerWaalsContact C-N 3.27Å; L1656-N1658 PolarHBondContact O-N 3.18Å; L1656-T1659 CarbonylContact O-C 3.59Å; L1656-T1659 PolarHBondContact O-N 3.32Å; L1656-T1659 PolarHBondContact O-OG1 2.66Å; L1656-T1659 VanDerWaalsContact O-OG1 3.07Å; L1656-N1660 PolarHBondContact O-N 2.86Å; L1656-G1661 WeakPolarHBondContact O-CA 3.31Å; L1656-G1661 PolarHBondContact O-N 3.24Å; L1656-L1663 HydrophobicContact CD1-CD2 3.69Å; L1656-L1663 HydrophobicContact CD1-CG 4.08Å; L1656-P1791 HydrophobicContact CD2-CB 4.15Å; L1656-P1791 HydrophobicContact CD2-CG 3.96Å
1657	C	73.3	Confident	79.6	Confident	19 Å²	19	35.4 Å²	35.4	13%	0.128	20%	0.202	C	C	.	.	H	α-helix	trans	-61.2	-37.6	179.2	-68.4	0	0	0	0	112.2	T697 A1653 A1654 T1659 N1660	T697-C1657 WeakPolarHBondContact CG2-SG 3.45Å; A1653-C1657 PolarHBondContact O-N 3Å; A1653-C1657 PolarHBondContact O-SG 2.64Å; A1654-C1657 PolarHBondContact O-N 3Å; C1657-T1659 PolarHBondContact O-N 2.96Å; C1657-T1659 VanDerWaalsContact O-N 3.15Å; C1657-N1660 PolarHBondContact O-N 2.76Å; C1657-N1660 VanDerWaalsContact O-N 3.08Å
1658	N	70.3	Confident	79.5	Confident	12 Å²	12	38.3 Å²	38.3	6%	0.064	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-25.6	175.2	-73.7	5.2	0	0	0	113.2	G644 V1614 A1654 L1656	G644-N1658 VanDerWaalsContact C-ND2 3.32Å; G644-N1658 VanDerWaalsContact CA-ND2 3.28Å; G644-N1658 WeakPolarHBondContact CA-ND2 3.43Å; G644-N1658 PolarHBondContact N-ND2 3.13Å; G644-N1658 PolarHBondContact O-ND2 2.97Å; V1614-N1658 HydrophobicContact CG1-CB 4.5Å; A1654-N1658 PolarHBondContact O-N 3.48Å; L1656-N1658 VanDerWaalsContact C-N 3.27Å; L1656-N1658 PolarHBondContact O-N 3.18Å
1659	T	64.9	Low	79.4	Confident	56 Å²	56	39.7 Å²	39.7	34%	0.344	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109	17	179.2	63.1	0	0	0	0	112.8	L1656 C1657 G1661	L1656-T1659 CarbonylContact O-C 3.59Å; L1656-T1659 PolarHBondContact O-N 3.32Å; L1656-T1659 PolarHBondContact O-OG1 2.66Å; L1656-T1659 VanDerWaalsContact O-OG1 3.07Å; C1657-T1659 PolarHBondContact O-N 2.96Å; C1657-T1659 VanDerWaalsContact O-N 3.15Å; T1659-G1661 PolarHBondContact O-N 3.31Å
1660	N	64.8	Low	79.7	Confident	112 Å²	112	39 Å²	39	60%	0.599	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.4	26.9	-174.1	-63.6	-24.6	0	0	0	114.4	L1656 C1657	L1656-N1660 PolarHBondContact O-N 2.86Å; C1657-N1660 PolarHBondContact O-N 2.76Å; C1657-N1660 VanDerWaalsContact O-N 3.08Å
1661	G	69	Low	80	Confident	8 Å²	8	37.6 Å²	37.6	8%	0.082	21%	0.214	C	C	.	.			trans	-89.8	163.7	174.7	0	0	0	0	0	112.6	L1656 T1659	L1656-G1661 WeakPolarHBondContact O-CA 3.31Å; L1656-G1661 PolarHBondContact O-N 3.24Å; T1659-G1661 PolarHBondContact O-N 3.31Å
1662	L	72.2	Confident	80.1	Confident	133 Å²	133	37.6 Å²	37.6	70%	0.696	21%	0.214	S	C	*	.			trans	-130.4	148.9	177.2	-67.1	170.9	0	0	0	110.4
1663	L	78.2	Confident	80.1	Confident	48 Å²	48	37.5 Å²	37.5	25%	0.251	22%	0.217	S	C	.	.			trans	-66.1	142.3	170.8	-75.7	174.7	0	0	0	110.6	L1649 Q1652 A1653 L1656 L1802	L1649-L1663 HydrophobicContact CD2-CD1 4.4Å; Q1652-L1663 HydrophobicContact CB-CD2 4.36Å; A1653-L1663 HydrophobicContact CB-CD1 3.79Å; A1653-L1663 HydrophobicContact CB-CG 4.28Å; L1656-L1663 HydrophobicContact CD1-CD2 3.69Å; L1656-L1663 HydrophobicContact CD1-CG 4.08Å; L1663-L1802 HydrophobicContact CD2-CD1 4.43Å
1664	P	81.2	Confident	80.2	Confident	4 Å²	4	36.8 Å²	36.8	3%	0.026	21%	0.21	C	C	.	.			trans	-66.7	144.2	178.7	29.6	-36.2	0	0	0	111.1	Y1695 L1757 L1806	P1664-Y1695 HydrophobicContact CB-CE1 4.06Å; P1664-Y1695 PolarHBondContact O-OH 3.48Å; P1664-Y1695 VanDerWaalsContact O-OH 3.13Å; P1664-L1757 HydrophobicContact CB-CB 4.31Å; P1664-L1757 HydrophobicContact CG-CB 4.3Å; P1664-L1757 HydrophobicContact CG-CD2 4.3Å; P1664-L1806 HydrophobicContact CG-CD1 4.03Å
1665	K	79.3	Confident	79.5	Confident	131 Å²	131	37.9 Å²	37.9	57%	0.57	22%	0.222	S	C	*	.			trans	-111.2	148.2	-179.9	-63.8	179.8	-176.2	177	0	111.2	G1667 D1668 Y1695	K1665-G1667 PolarHBondContact O-N 2.93Å; K1665-D1668 PolarHBondContact N-OD2 3.44Å; K1665-D1668 WeakPolarHBondContact O-CB 3.18Å; K1665-D1668 PolarHBondContact O-N 3.42Å; K1665-Y1695 VanDerWaalsContact C-CE1 3.41Å; K1665-Y1695 WeakPolarHBondContact O-CE1 3.47Å
1666	P	75.8	Confident	78.9	Confident	48 Å²	48	38.5 Å²	38.5	31%	0.312	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.2	125.2	175.1	-28.4	35.5	0	0	0	112.7	F1810	P1666-F1810 HydrophobicContact CG-CB 3.91Å; P1666-F1810 HydrophobicContact CG-CD1 3.69Å; P1666-F1810 HydrophobicContact CG-CD2 3.94Å; P1666-F1810 HydrophobicContact CG-CE1 4.16Å; P1666-F1810 HydrophobicContact CG-CE2 4.38Å; P1666-F1810 HydrophobicContact CG-CG 3.58Å; P1666-F1810 HydrophobicContact CG-CZ 4.48Å
1667	G	76.4	Confident	78.5	Confident	38 Å²	38	39.5 Å²	39.5	39%	0.392	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	105.2	-15.9	-176.1	0	0	0	0	0	114.8	K1665 G1694	K1665-G1667 PolarHBondContact O-N 2.93Å; G1667-G1694 WeakPolarHBondContact CA-O 3.3Å
1668	D	86.4	Confident	78.5	Confident	60 Å²	60	45 Å²	45	32%	0.321	25%	0.246	S	C	.	.	S	Bend	trans	-69.9	166.6	175.6	-62.7	-17.8	0	0	0	112.2	K1665 Y1695 K1696 S1756	K1665-D1668 PolarHBondContact N-OD2 3.44Å; K1665-D1668 WeakPolarHBondContact O-CB 3.18Å; K1665-D1668 PolarHBondContact O-N 3.42Å; D1668-Y1695 HydrophobicContact CB-CD1 4.4Å; D1668-Y1695 HydrophobicContact CB-CE1 4.42Å; D1668-K1696 PolarHBondContact O-N 3.13Å; D1668-S1756 WeakPolarHBondContact CB-OG 3.29Å; D1668-S1756 PolarHBondContact OD2-OG 3.39Å
1669	N	90.4	Very high	79.1	Confident	30 Å²	30	46.8 Å²	46.8	16%	0.16	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	129.3	177.7	-52.6	-49.1	0	0	0	111.3	K1696 Y1698 L1754 F1755 S1756	N1669-K1696 WeakPolarHBondContact CA-O 3.23Å; N1669-K1696 WeakPolarHBondContact OD1-CB 3.43Å; N1669-K1696 WeakPolarHBondContact OD1-CD 3.47Å; N1669-Y1698 HydrophobicContact CB-CD2 4.08Å; N1669-Y1698 HydrophobicContact CB-CE2 3.7Å; N1669-L1754 WeakPolarHBondContact CB-O 3.38Å; N1669-L1754 PolarHBondContact ND2-O 2.96Å; N1669-F1755 HydrophobicContact CB-CD1 3.83Å; N1669-F1755 HydrophobicContact CB-CE1 4.29Å; N1669-S1756 PolarHBondContact O-N 3.39Å; N1669-S1756 PolarHBondContact O-OG 2.82Å
1670	V	91.5	Very high	80	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	131.3	177.5	179.7	0	0	0	0	109.6	L1672 L1690 Y1695 K1696 L1697 Y1698 L1757	V1670-L1672 HydrophobicContact CG1-CD2 4.01Å; V1670-L1690 HydrophobicContact CG1-CD1 4.36Å; V1670-Y1695 HydrophobicContact CG2-CD1 3.63Å; V1670-Y1695 HydrophobicContact CG2-CE1 4.28Å; V1670-Y1695 HydrophobicContact CG2-CG 4.04Å; V1670-K1696 PolarHBondContact N-O 3.01Å; V1670-L1697 HydrophobicContact CB-CD2 4.07Å; V1670-Y1698 PolarHBondContact O-N 2.83Å; V1670-L1757 WeakPolarHBondContact CA-O 3.46Å; V1670-L1757 HydrophobicContact CG1-CB 4.22Å; V1670-L1757 HydrophobicContact CG1-CD2 4.23Å; V1670-L1757 HydrophobicContact CG1-CG 4.33Å; V1670-L1757 HydrophobicContact CG2-CB 4.25Å
1671	F	92.6	Very high	80.8	Confident	1 Å²	1	42.7 Å²	42.7	0%	0.004	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	130	178	179.2	-100.9	0	0	0	112.3	Y1698 V1717 I1746 F1755 L1757 I1758 V1759 T1781	F1671-Y1698 CarbonylContact C-O 3.52Å; F1671-Y1698 WeakPolarHBondContact CA-O 3.38Å; F1671-V1717 HydrophobicContact CE2-CB 4.17Å; F1671-V1717 HydrophobicContact CE2-CG2 4.35Å; F1671-I1746 HydrophobicContact CE1-CD1 4.31Å; F1671-I1746 HydrophobicContact CE2-CD1 4Å; F1671-I1746 HydrophobicContact CE2-CG1 4.1Å; F1671-I1746 HydrophobicContact CZ-CD1 3.51Å; F1671-I1746 HydrophobicContact CZ-CG1 4.02Å; F1671-F1755 HydrophobicContact CB-CD1 3.93Å; F1671-F1755 HydrophobicContact CB-CD2 4.15Å; F1671-F1755 HydrophobicContact CB-CE1 3.84Å; F1671-F1755 HydrophobicContact CB-CE2 4.02Å; F1671-F1755 HydrophobicContact CB-CG 4.11Å; F1671-F1755 HydrophobicContact CB-CZ 3.89Å; F1671-F1755 HydrophobicContact CD2-CE2 4.36Å; F1671-F1755 HydrophobicContact CD2-CZ 4Å; F1671-F1755 HydrophobicContact CG-CE2 4.25Å; F1671-F1755 HydrophobicContact CG-CZ 4.2Å; F1671-L1757 PolarHBondContact N-O 3.13Å; F1671-I1758 HydrophobicContact CB-CG1 4.22Å; F1671-I1758 HydrophobicContact CD1-CG2 4.17Å; F1671-I1758 WeakPolarHBondContact O-CA 3.36Å; F1671-V1759 PolarHBondContact O-N 2.89Å; F1671-T1781 HydrophobicContact CE1-CG2 4.17Å
1672	L	90.9	Very high	81.5	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	116	-176.4	-55.7	179.3	0	0	0	111.1	V1670 V1687 Y1698 G1699 S1700 T1703 I1714 V1759	V1670-L1672 HydrophobicContact CG1-CD2 4.01Å; L1672-V1687 HydrophobicContact CD1-CG1 3.98Å; L1672-V1687 HydrophobicContact CD1-CG2 3.89Å; L1672-Y1698 PolarHBondContact N-O 2.81Å; L1672-G1699 WeakPolarHBondContact O-CA 3.4Å; L1672-S1700 PolarHBondContact O-N 3.38Å; L1672-T1703 HydrophobicContact CB-CG2 4.14Å; L1672-I1714 HydrophobicContact CD1-CD1 4.12Å; L1672-V1759 HydrophobicContact CD2-CB 3.72Å; L1672-V1759 HydrophobicContact CD2-CG2 3.8Å
1673	S	88.5	Confident	82.4	Confident	26 Å²	26	38.2 Å²	38.2	18%	0.182	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	96.3	171	-171.6	0	0	0	0	109.3	V1759 S1760 L1761	S1673-V1759 PolarHBondContact N-O 3.22Å; S1673-S1760 CarbonylContact O-C 3.59Å; S1673-S1760 WeakPolarHBondContact O-CA 3.21Å; S1673-L1761 PolarHBondContact O-N 3.47Å
1674	I	86.2	Confident	83	Confident	3 Å²	3	37.1 Å²	37.1	2%	0.015	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	110.8	-174.2	-56.4	178.8	0	0	0	108.7	H1679 K1680 M1683 T1703 Y1707 L1761	I1674-H1679 HydrophobicContact CG2-CB 3.59Å; I1674-K1680 HydrophobicContact CB-CG 3.96Å; I1674-K1680 HydrophobicContact CG2-CB 4.33Å; I1674-K1680 HydrophobicContact CG2-CG 3.55Å; I1674-K1680 WeakPolarHBondContact O-CE 3.2Å; I1674-M1683 HydrophobicContact CD1-CB 3.99Å; I1674-M1683 HydrophobicContact CD1-CG 4.04Å; I1674-T1703 HydrophobicContact CB-CG2 4.19Å; I1674-T1703 HydrophobicContact CG1-CG2 4.28Å; I1674-T1703 PolarHBondContact N-OG1 2.72Å; I1674-T1703 PolarHBondContact O-OG1 3.08Å; I1674-Y1707 HydrophobicContact CD1-CE2 4.01Å; I1674-Y1707 WeakPolarHBondContact CD1-OH 3.45Å; I1674-L1761 HydrophobicContact CD1-CD1 4.42Å; I1674-L1761 HydrophobicContact CG1-CD1 4.21Å; I1674-L1761 HydrophobicContact CG1-CG 4.45Å; I1674-L1761 HydrophobicContact CG2-CB 4.33Å; I1674-L1761 HydrophobicContact CG2-CD1 4.16Å
1675	G	71.1	Confident	83.5	Confident	24 Å²	24	40.7 Å²	40.7	25%	0.247	22%	0.219	C	C	.	.			trans	-67.9	-68.1	-173.9	0	0	0	0	0	114	L1761	G1675-L1761 PolarHBondContact N-O 3.36Å
1676	S	72.7	Confident	84.1	Confident	26 Å²	26	34.8 Å²	34.8	18%	0.182	19%	0.193	C	C	.	.	S	Bend	trans	-77.8	143.9	-170.3	80.6	0	0	0	0	112.8	R1678 H1679 K1680	S1676-R1678 VanDerWaalsContact C-N 3.25Å; S1676-R1678 PolarHBondContact O-N 3.49Å; S1676-H1679 PolarHBondContact O-N 2.8Å; S1676-H1679 WeakPolarHBondContact OG-CB 3.18Å; S1676-H1679 PolarHBondContact OG-N 2.91Å; S1676-H1679 VanDerWaalsContact OG-N 3.09Å; S1676-H1679 PolarHBondContact OG-ND1 3.26Å; S1676-K1680 WeakPolarHBondContact O-CG 3.46Å; S1676-K1680 PolarHBondContact O-N 2.85Å
1677	Y	72.8	Confident	84.9	Confident	51 Å²	51	32.5 Å²	32.5	20%	0.2	18%	0.179	C	C	.	.	H	α-helix	trans	-57.6	-38.5	174.3	-175.7	-98.3	0	0	0	112.3	H1679 K1680 L1681 F1706 H2345	Y1677-H1679 PolarHBondContact O-N 2.74Å; Y1677-K1680 WeakPolarHBondContact O-CB 3.17Å; Y1677-K1680 PolarHBondContact O-N 3.09Å; Y1677-L1681 HydrophobicContact CD1-CD1 3.79Å; Y1677-L1681 HydrophobicContact CD1-CG 4.31Å; Y1677-L1681 HydrophobicContact CE1-CD1 3.24Å; Y1677-L1681 HydrophobicContact CE1-CG 3.87Å; Y1677-L1681 PolarHBondContact O-N 3.08Å; Y1677-F1706 HydrophobicContact CD2-CD2 4.2Å; Y1677-F1706 AromaticContact CD2-CE2 3.94Å; Y1677-F1706 HydrophobicContact CD2-CE2 3.94Å; Y1677-F1706 AromaticContact CE2-CD2 3.88Å; Y1677-F1706 HydrophobicContact CE2-CD2 3.88Å; Y1677-F1706 AromaticContact CE2-CE2 3.37Å; Y1677-F1706 HydrophobicContact CE2-CE2 3.37Å; Y1677-F1706 HydrophobicContact CE2-CZ 4.4Å; Y1677-H2345 AromaticContact CE1-CE1 3.56Å
1678	R	74.5	Confident	85.5	Confident	135 Å²	135	35.2 Å²	35.2	51%	0.509	18%	0.18	S	C	.	.	H	α-helix	trans	-58.4	-46.8	175.3	179.6	176.1	170	169.6	-9.1	111.9	D1454 S1676 L1681 E1682	D1454-R1678 VanDerWaalsContact CG-NH2 3.31Å; D1454-R1678 IonicContact OD1-NH2 2.94Å; D1454-R1678 PolarHBondContact OD1-NH2 3.09Å; D1454-R1678 IonicContact OD2-CZ 3.88Å; D1454-R1678 IonicContact OD2-NH1 3.1Å; D1454-R1678 PolarHBondContact OD2-NH1 3.37Å; D1454-R1678 IonicContact OD2-NH2 3.31Å; D1454-R1678 PolarHBondContact OD2-NH2 3.28Å; S1676-R1678 VanDerWaalsContact C-N 3.25Å; S1676-R1678 PolarHBondContact O-N 3.49Å; R1678-L1681 PolarHBondContact O-N 2.94Å; R1678-E1682 WeakPolarHBondContact O-CB 2.94Å; R1678-E1682 PolarHBondContact O-N 3.44Å
1679	H	82.7	Confident	85.7	Confident	48 Å²	48	33.6 Å²	33.6	22%	0.222	17%	0.17	C	C	.	.	H	α-helix	trans	-66.5	-37.3	176.8	-66.5	159.9	0	0	0	111.8	I1674 S1676 Y1677 L1681 E1682 M1683 L1761	I1674-H1679 HydrophobicContact CG2-CB 3.59Å; S1676-H1679 PolarHBondContact O-N 2.8Å; S1676-H1679 WeakPolarHBondContact OG-CB 3.18Å; S1676-H1679 PolarHBondContact OG-N 2.91Å; S1676-H1679 VanDerWaalsContact OG-N 3.09Å; S1676-H1679 PolarHBondContact OG-ND1 3.26Å; Y1677-H1679 PolarHBondContact O-N 2.74Å; H1679-L1681 VanDerWaalsContact C-N 3.33Å; H1679-L1681 PolarHBondContact O-N 3.28Å; H1679-E1682 PolarHBondContact O-N 3.11Å; H1679-M1683 VanDerWaalsContact O-CB 3.26Å; H1679-M1683 WeakPolarHBondContact O-CB 3.03Å; H1679-M1683 VanDerWaalsContact O-CG 3.3Å; H1679-M1683 WeakPolarHBondContact O-CG 3.46Å; H1679-M1683 PolarHBondContact O-N 3.38Å; H1679-L1761 HydrophobicContact CB-CD1 4.18Å
1680	K	84	Confident	85.6	Confident	29 Å²	29	32.2 Å²	32.2	13%	0.126	16%	0.163	C	C	.	.	H	α-helix	trans	-61.2	-41.4	175.4	-65.7	179.6	-170.4	175.3	0	112.1	I1674 S1676 Y1677 L1684 G1702 F1706 Y1707	I1674-K1680 HydrophobicContact CB-CG 3.96Å; I1674-K1680 HydrophobicContact CG2-CB 4.33Å; I1674-K1680 HydrophobicContact CG2-CG 3.55Å; I1674-K1680 WeakPolarHBondContact O-CE 3.2Å; S1676-K1680 WeakPolarHBondContact O-CG 3.46Å; S1676-K1680 PolarHBondContact O-N 2.85Å; Y1677-K1680 WeakPolarHBondContact O-CB 3.17Å; Y1677-K1680 PolarHBondContact O-N 3.09Å; K1680-L1684 PolarHBondContact O-N 3.19Å; K1680-G1702 PolarHBondContact NZ-O 3.41Å; K1680-F1706 HydrophobicContact CB-CD1 3.66Å; K1680-F1706 HydrophobicContact CB-CE1 3.52Å; K1680-F1706 HydrophobicContact CB-CE2 4.44Å; K1680-F1706 HydrophobicContact CB-CG 4.19Å; K1680-F1706 HydrophobicContact CB-CZ 3.93Å; K1680-F1706 HydrophobicContact CD-CB 3.83Å; K1680-F1706 HydrophobicContact CD-CD1 3.89Å; K1680-F1706 HydrophobicContact CD-CD2 4.19Å; K1680-F1706 HydrophobicContact CD-CG 3.68Å; K1680-F1706 HydrophobicContact CG-CD1 4.2Å; K1680-F1706 HydrophobicContact CG-CG 4.47Å; K1680-Y1707 WeakPolarHBondContact CA-OH 3.48Å; K1680-Y1707 PolarHBondContact O-OH 3.47Å
1681	L	80.8	Confident	85.5	Confident	53 Å²	53	36.3 Å²	36.3	28%	0.277	18%	0.182	S	C	.	.	H	α-helix	trans	-67.5	-44.3	173.8	-79.1	175	0	0	0	112.6	Y1677 R1678 H1679 M1683 L1684 F1706 H2345	Y1677-L1681 HydrophobicContact CD1-CD1 3.79Å; Y1677-L1681 HydrophobicContact CD1-CG 4.31Å; Y1677-L1681 HydrophobicContact CE1-CD1 3.24Å; Y1677-L1681 HydrophobicContact CE1-CG 3.87Å; Y1677-L1681 PolarHBondContact O-N 3.08Å; R1678-L1681 PolarHBondContact O-N 2.94Å; H1679-L1681 VanDerWaalsContact C-N 3.33Å; H1679-L1681 PolarHBondContact O-N 3.28Å; L1681-M1683 VanDerWaalsContact C-N 3.29Å; L1681-M1683 PolarHBondContact O-N 3.2Å; L1681-L1684 WeakPolarHBondContact O-CB 3.19Å; L1681-L1684 PolarHBondContact O-N 3.06Å; L1681-F1706 HydrophobicContact CD2-CZ 4.03Å; L1681-F1706 HydrophobicContact CG-CZ 4.27Å; L1681-H2345 WeakPolarHBondContact CD1-NE2 3.08Å
1682	E	83.2	Confident	85.1	Confident	47 Å²	47	41.8 Å²	41.8	22%	0.22	21%	0.207	C	C	.	.	H	α-helix	trans	-65.1	-33.7	-179.7	-176.6	168.1	179.6	0	0	112.5	R1678 H1679 V1796 K1797 K1800	R1678-E1682 WeakPolarHBondContact O-CB 2.94Å; R1678-E1682 PolarHBondContact O-N 3.44Å; H1679-E1682 PolarHBondContact O-N 3.11Å; E1682-V1796 HydrophobicContact CG-CG2 4.28Å; E1682-K1797 IonicContact OE1-NZ 2.76Å; E1682-K1797 PolarHBondContact OE1-NZ 3.44Å; E1682-K1800 HydrophobicContact CG-CD 4Å; E1682-K1800 IonicContact OE1-NZ 3.25Å; E1682-K1800 PolarHBondContact OE1-NZ 2.93Å
1683	M	91.7	Very high	84.7	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-82.4	-12.2	178.3	-74.4	-66.3	-65.4	0	0	114	I1674 H1679 L1681 P1685 S1686 V1687 Y1707 V1759 L1761 V1796 A1799 K1800 I1803	I1674-M1683 HydrophobicContact CD1-CB 3.99Å; I1674-M1683 HydrophobicContact CD1-CG 4.04Å; H1679-M1683 VanDerWaalsContact O-CB 3.26Å; H1679-M1683 WeakPolarHBondContact O-CB 3.03Å; H1679-M1683 VanDerWaalsContact O-CG 3.3Å; H1679-M1683 WeakPolarHBondContact O-CG 3.46Å; H1679-M1683 PolarHBondContact O-N 3.38Å; L1681-M1683 VanDerWaalsContact C-N 3.29Å; L1681-M1683 PolarHBondContact O-N 3.2Å; M1683-P1685 VanDerWaalsContact C-CD 3.5Å; M1683-S1686 PolarHBondContact O-N 2.92Å; M1683-V1687 HydrophobicContact CB-CG2 4.29Å; M1683-V1687 WeakPolarHBondContact O-CG2 3.43Å; M1683-V1687 PolarHBondContact O-N 3.06Å; M1683-Y1707 WeakPolarHBondContact CB-OH 3.46Å; M1683-V1759 HydrophobicContact CE-CG1 4.42Å; M1683-L1761 HydrophobicContact CG-CD1 3.89Å; M1683-L1761 HydrophobicContact SD-CD1 4.38Å; M1683-V1796 HydrophobicContact CG-CG2 3.96Å; M1683-V1796 HydrophobicContact SD-CG2 3.94Å; M1683-A1799 HydrophobicContact CE-CB 3.72Å; M1683-A1799 HydrophobicContact SD-CB 3.99Å; M1683-K1800 HydrophobicContact SD-CD 4.46Å; M1683-K1800 HydrophobicContact SD-CG 3.75Å; M1683-I1803 HydrophobicContact CE-CD1 3.82Å
1684	L	90.6	Very high	84.5	Confident	26 Å²	26	42.4 Å²	42.4	14%	0.136	22%	0.218	C	C	.	.	H	α-helix	trans	-52.4	-44.3	-174.8	-178.4	66.9	0	0	0	114.2	K1680 L1681 K1688 Y1707 Q1710 I1712	K1680-L1684 PolarHBondContact O-N 3.19Å; L1681-L1684 WeakPolarHBondContact O-CB 3.19Å; L1681-L1684 PolarHBondContact O-N 3.06Å; L1684-K1688 WeakPolarHBondContact O-CG 3.49Å; L1684-K1688 PolarHBondContact O-N 3.46Å; L1684-K1688 VanDerWaalsContact O-N 3.13Å; L1684-Y1707 HydrophobicContact CB-CE1 4.28Å; L1684-Y1707 HydrophobicContact CD1-CD1 3.69Å; L1684-Y1707 HydrophobicContact CD1-CE1 3.73Å; L1684-Q1710 HydrophobicContact CD1-CB 3.9Å; L1684-Q1710 HydrophobicContact CD1-CG 3.97Å; L1684-I1712 HydrophobicContact CD1-CD1 3.83Å
1685	P	90.6	Very high	84.6	Confident	79 Å²	79	42.7 Å²	42.7	51%	0.513	22%	0.218	S	C	.	.	H	α-helix	trans	-61.9	-44.2	175.8	-21.9	34.7	0	0	0	112.6	M1683 K1688 Q1689	M1683-P1685 VanDerWaalsContact C-CD 3.5Å; P1685-K1688 WeakPolarHBondContact O-CB 3.38Å; P1685-K1688 PolarHBondContact O-N 3.17Å; P1685-Q1689 WeakPolarHBondContact O-CG 3.25Å; P1685-Q1689 PolarHBondContact O-N 3.03Å; P1685-Q1689 VanDerWaalsContact O-N 3.09Å
1686	S	92.5	Very high	85.5	Confident	6 Å²	6	47.4 Å²	47.4	4%	0.042	23%	0.232	C	C	.	.	H	α-helix	trans	-66.6	-40.9	179.9	-56.2	0	0	0	0	112	M1683 K1688 Q1689 L1690 I1803	M1683-S1686 PolarHBondContact O-N 2.92Å; S1686-K1688 VanDerWaalsContact C-N 3.27Å; S1686-K1688 PolarHBondContact O-N 2.82Å; S1686-Q1689 WeakPolarHBondContact O-CB 3.45Å; S1686-Q1689 PolarHBondContact O-N 2.98Å; S1686-Q1689 VanDerWaalsContact O-N 3.08Å; S1686-L1690 PolarHBondContact O-N 3.12Å; S1686-I1803 VanDerWaalsContact O-CG2 3.29Å; S1686-I1803 WeakPolarHBondContact O-CG2 3.49Å
1687	V	92.3	Very high	86.5	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-63.5	-35.3	175.8	177.6	0	0	0	0	111.4	L1672 M1683 L1690 H1691 L1697 Y1707 I1712 I1714	L1672-V1687 HydrophobicContact CD1-CG1 3.98Å; L1672-V1687 HydrophobicContact CD1-CG2 3.89Å; M1683-V1687 HydrophobicContact CB-CG2 4.29Å; M1683-V1687 WeakPolarHBondContact O-CG2 3.43Å; M1683-V1687 PolarHBondContact O-N 3.06Å; V1687-L1690 PolarHBondContact O-N 3.33Å; V1687-H1691 PolarHBondContact O-N 2.84Å; V1687-H1691 VanDerWaalsContact O-N 3.11Å; V1687-L1697 HydrophobicContact CG1-CD1 4.03Å; V1687-Y1707 HydrophobicContact CB-CE1 4.15Å; V1687-Y1707 HydrophobicContact CG1-CD1 4.2Å; V1687-Y1707 HydrophobicContact CG1-CD2 4.48Å; V1687-Y1707 HydrophobicContact CG1-CE1 4.29Å; V1687-Y1707 HydrophobicContact CG1-CG 4.3Å; V1687-Y1707 HydrophobicContact CG2-CE1 4.11Å; V1687-Y1707 HydrophobicContact CG2-CE2 4.17Å; V1687-I1712 HydrophobicContact CB-CD1 4.43Å; V1687-I1712 HydrophobicContact CG1-CD1 3.99Å; V1687-I1712 HydrophobicContact CG1-CG2 4.18Å; V1687-I1714 HydrophobicContact CG1-CD1 4.11Å
1688	K	90.6	Very high	87.4	Confident	96 Å²	96	45.1 Å²	45.1	42%	0.417	22%	0.22	S	C	.	.	H	α-helix	trans	-63.4	-41.2	171.3	-71.9	178.6	179.5	-177.4	0	112.3	L1684 P1685 S1686 H1691 Q1692 I1712	L1684-K1688 WeakPolarHBondContact O-CG 3.49Å; L1684-K1688 PolarHBondContact O-N 3.46Å; L1684-K1688 VanDerWaalsContact O-N 3.13Å; P1685-K1688 WeakPolarHBondContact O-CB 3.38Å; P1685-K1688 PolarHBondContact O-N 3.17Å; S1686-K1688 VanDerWaalsContact C-N 3.27Å; S1686-K1688 PolarHBondContact O-N 2.82Å; K1688-H1691 PolarHBondContact O-N 3.07Å; K1688-Q1692 WeakPolarHBondContact O-CG 3.21Å; K1688-Q1692 PolarHBondContact O-N 2.64Å; K1688-I1712 HydrophobicContact CB-CD1 4.49Å; K1688-I1712 HydrophobicContact CG-CD1 3.47Å; K1688-I1712 VanDerWaalsContact CG-CD1 3.47Å; K1688-I1712 HydrophobicContact CG-CG1 4.13Å
1689	Q	89.8	Confident	88	Confident	26 Å²	26	38.7 Å²	38.7	12%	0.121	20%	0.196	C	C	.	.	H	α-helix	trans	-62.3	-44	177.1	-71	169.5	-36.5	0	0	111.6	P1685 S1686 H1691 Q1692 L1693 I1803 E1804 Y1807	P1685-Q1689 WeakPolarHBondContact O-CG 3.25Å; P1685-Q1689 PolarHBondContact O-N 3.03Å; P1685-Q1689 VanDerWaalsContact O-N 3.09Å; S1686-Q1689 WeakPolarHBondContact O-CB 3.45Å; S1686-Q1689 PolarHBondContact O-N 2.98Å; S1686-Q1689 VanDerWaalsContact O-N 3.08Å; Q1689-H1691 VanDerWaalsContact C-N 3.33Å; Q1689-H1691 PolarHBondContact O-N 3.34Å; Q1689-Q1692 PolarHBondContact O-N 2.71Å; Q1689-L1693 WeakPolarHBondContact O-CG 3.19Å; Q1689-L1693 PolarHBondContact O-N 3.3Å; Q1689-I1803 HydrophobicContact CB-CG2 3.91Å; Q1689-E1804 PolarHBondContact NE2-OE2 2.68Å; Q1689-Y1807 HydrophobicContact CB-CD2 3.71Å; Q1689-Y1807 HydrophobicContact CB-CE2 4.23Å; Q1689-Y1807 HydrophobicContact CB-CG 4.08Å; Q1689-Y1807 HydrophobicContact CG-CD1 4.35Å; Q1689-Y1807 HydrophobicContact CG-CD2 3.86Å; Q1689-Y1807 HydrophobicContact CG-CE2 4.1Å; Q1689-Y1807 HydrophobicContact CG-CG 3.97Å
1690	L	89.1	Confident	88.1	Confident	1 Å²	1	37.8 Å²	37.8	1%	0.005	20%	0.195	C	C	.	.	H	α-helix	trans	-58.4	-45.4	174.3	-72.2	177.1	0	0	0	111.8	V1670 S1686 V1687 Q1692 L1693 G1694 Y1695 L1697 I1803	V1670-L1690 HydrophobicContact CG1-CD1 4.36Å; S1686-L1690 PolarHBondContact O-N 3.12Å; V1687-L1690 PolarHBondContact O-N 3.33Å; L1690-Q1692 VanDerWaalsContact C-N 3.34Å; L1690-Q1692 PolarHBondContact O-N 2.78Å; L1690-L1693 PolarHBondContact O-N 3.15Å; L1690-G1694 PolarHBondContact O-N 3.03Å; L1690-Y1695 HydrophobicContact CB-CD2 4.32Å; L1690-Y1695 HydrophobicContact CD2-CD2 3.69Å; L1690-Y1695 HydrophobicContact CD2-CE2 3.9Å; L1690-Y1695 HydrophobicContact CD2-CG 4.35Å; L1690-Y1695 WeakPolarHBondContact O-CD2 3.4Å; L1690-Y1695 PolarHBondContact O-N 3.04Å; L1690-L1697 HydrophobicContact CB-CD2 4.02Å; L1690-L1697 HydrophobicContact CD1-CD2 4.32Å; L1690-I1803 HydrophobicContact CD1-CD1 3.67Å; L1690-I1803 HydrophobicContact CD1-CG1 4.08Å; L1690-I1803 HydrophobicContact CD2-CG1 4.02Å; L1690-I1803 HydrophobicContact CD2-CG2 4.11Å; L1690-I1803 HydrophobicContact CG-CD1 4.02Å; L1690-I1803 HydrophobicContact CG-CG1 4Å; L1690-I1803 HydrophobicContact CG-CG2 3.86Å
1691	H	87.6	Confident	87.7	Confident	85 Å²	85	39.2 Å²	39.2	39%	0.394	21%	0.207	S	C	.	.	H	α-helix	trans	-62.1	-40.7	176.5	-174.7	-95	0	0	0	112	V1687 K1688 Q1689 L1693 G1694 L1697 I1712	V1687-H1691 PolarHBondContact O-N 2.84Å; V1687-H1691 VanDerWaalsContact O-N 3.11Å; K1688-H1691 PolarHBondContact O-N 3.07Å; Q1689-H1691 VanDerWaalsContact C-N 3.33Å; Q1689-H1691 PolarHBondContact O-N 3.34Å; H1691-L1693 VanDerWaalsContact C-N 3.35Å; H1691-L1693 PolarHBondContact O-N 3.25Å; H1691-G1694 PolarHBondContact O-N 3.49Å; H1691-G1694 VanDerWaalsContact O-N 3.15Å; H1691-L1697 HydrophobicContact CB-CD1 4.09Å; H1691-I1712 HydrophobicContact CB-CG2 3.99Å
1692	Q	84.5	Confident	87.3	Confident	116 Å²	116	38.7 Å²	38.7	54%	0.542	22%	0.215	S	C	.	.	H	α-helix	trans	-66.4	-31.7	177	-75.4	176.3	-4.8	0	0	113.7	K1688 Q1689 L1690 G1694 Y1807	K1688-Q1692 WeakPolarHBondContact O-CG 3.21Å; K1688-Q1692 PolarHBondContact O-N 2.64Å; Q1689-Q1692 PolarHBondContact O-N 2.71Å; L1690-Q1692 VanDerWaalsContact C-N 3.34Å; L1690-Q1692 PolarHBondContact O-N 2.78Å; Q1692-G1694 PolarHBondContact O-N 2.73Å; Q1692-Y1807 HydrophobicContact CB-CE2 4.31Å; Q1692-Y1807 PolarHBondContact OE1-OH 2.96Å
1693	L	82.9	Confident	87.3	Confident	2 Å²	2	36.5 Å²	36.5	1%	0.01	21%	0.205	C	C	.	.	H	α-helix	trans	-72.5	-16.3	174.6	-69.1	172.1	0	0	0	112.5	Q1689 L1690 H1691 Y1695 L1806 Y1807 F1810 S1814	Q1689-L1693 WeakPolarHBondContact O-CG 3.19Å; Q1689-L1693 PolarHBondContact O-N 3.3Å; L1690-L1693 PolarHBondContact O-N 3.15Å; H1691-L1693 VanDerWaalsContact C-N 3.35Å; H1691-L1693 PolarHBondContact O-N 3.25Å; L1693-Y1695 HydrophobicContact CB-CD2 3.8Å; L1693-Y1695 HydrophobicContact CB-CE2 3.8Å; L1693-Y1695 HydrophobicContact CD1-CD2 4.36Å; L1693-Y1695 HydrophobicContact CD1-CE2 3.77Å; L1693-Y1695 HydrophobicContact CG-CE2 4.47Å; L1693-L1806 HydrophobicContact CD1-CB 4.49Å; L1693-Y1807 HydrophobicContact CD1-CD2 4.28Å; L1693-Y1807 HydrophobicContact CD2-CD2 4.05Å; L1693-Y1807 HydrophobicContact CG-CD2 3.97Å; L1693-F1810 HydrophobicContact CD2-CB 3.77Å; L1693-S1814 PolarHBondContact O-OG 3.48Å
1694	G	84	Confident	86.9	Confident	38 Å²	38	36.6 Å²	36.6	39%	0.392	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	94.3	18.1	178.9	0	0	0	0	0	114.6	G1667 L1690 H1691 Q1692	G1667-G1694 WeakPolarHBondContact CA-O 3.3Å; L1690-G1694 PolarHBondContact O-N 3.03Å; H1691-G1694 PolarHBondContact O-N 3.49Å; H1691-G1694 VanDerWaalsContact O-N 3.15Å; Q1692-G1694 PolarHBondContact O-N 2.73Å
1695	Y	88.8	Confident	86.2	Confident	8 Å²	8	39.1 Å²	39.1	3%	0.031	22%	0.219	C	C	.	.			trans	-65.7	141.2	171.7	-72.1	-80.5	0	0	0	111.3	P1664 K1665 D1668 V1670 L1690 L1693 L1697	P1664-Y1695 HydrophobicContact CB-CE1 4.06Å; P1664-Y1695 PolarHBondContact O-OH 3.48Å; P1664-Y1695 VanDerWaalsContact O-OH 3.13Å; K1665-Y1695 VanDerWaalsContact C-CE1 3.41Å; K1665-Y1695 WeakPolarHBondContact O-CE1 3.47Å; D1668-Y1695 HydrophobicContact CB-CD1 4.4Å; D1668-Y1695 HydrophobicContact CB-CE1 4.42Å; V1670-Y1695 HydrophobicContact CG2-CD1 3.63Å; V1670-Y1695 HydrophobicContact CG2-CE1 4.28Å; V1670-Y1695 HydrophobicContact CG2-CG 4.04Å; L1690-Y1695 HydrophobicContact CB-CD2 4.32Å; L1690-Y1695 HydrophobicContact CD2-CD2 3.69Å; L1690-Y1695 HydrophobicContact CD2-CE2 3.9Å; L1690-Y1695 HydrophobicContact CD2-CG 4.35Å; L1690-Y1695 WeakPolarHBondContact O-CD2 3.4Å; L1690-Y1695 PolarHBondContact O-N 3.04Å; L1693-Y1695 HydrophobicContact CB-CD2 3.8Å; L1693-Y1695 HydrophobicContact CB-CE2 3.8Å; L1693-Y1695 HydrophobicContact CD1-CD2 4.36Å; L1693-Y1695 HydrophobicContact CD1-CE2 3.77Å; L1693-Y1695 HydrophobicContact CG-CE2 4.47Å; Y1695-L1697 PolarHBondContact O-N 3.09Å
1696	K	89.9	Confident	85.8	Confident	124 Å²	124	36 Å²	36	54%	0.539	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	110.5	172.1	-70.6	-179.5	-178.7	177.7	0	109.2	D1668 N1669 V1670 Y1698	D1668-K1696 PolarHBondContact O-N 3.13Å; N1669-K1696 WeakPolarHBondContact CA-O 3.23Å; N1669-K1696 WeakPolarHBondContact OD1-CB 3.43Å; N1669-K1696 WeakPolarHBondContact OD1-CD 3.47Å; V1670-K1696 PolarHBondContact N-O 3.01Å; K1696-Y1698 HydrophobicContact CB-CE2 4.1Å; K1696-Y1698 WeakPolarHBondContact O-CD2 3.32Å
1697	L	93	Very high	85.6	Confident	6 Å²	6	35.7 Å²	35.7	3%	0.031	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	127.4	-173.5	-57.2	-176	0	0	0	111.6	V1670 V1687 L1690 H1691 Y1695 I1712 I1714 I1715	V1670-L1697 HydrophobicContact CB-CD2 4.07Å; V1687-L1697 HydrophobicContact CG1-CD1 4.03Å; L1690-L1697 HydrophobicContact CB-CD2 4.02Å; L1690-L1697 HydrophobicContact CD1-CD2 4.32Å; H1691-L1697 HydrophobicContact CB-CD1 4.09Å; Y1695-L1697 PolarHBondContact O-N 3.09Å; L1697-I1712 HydrophobicContact CD1-CG2 4.05Å; L1697-I1714 HydrophobicContact CB-CB 4.44Å; L1697-I1714 HydrophobicContact CB-CD1 4.48Å; L1697-I1714 HydrophobicContact CB-CG1 3.95Å; L1697-I1714 HydrophobicContact CB-CG2 4.36Å; L1697-I1714 HydrophobicContact CD1-CD1 4.41Å; L1697-I1714 HydrophobicContact CD1-CG1 4.24Å; L1697-I1714 WeakPolarHBondContact O-CA 3.48Å; L1697-I1715 PolarHBondContact O-N 2.66Å
1698	Y	91.8	Very high	85.1	Confident	23 Å²	23	40.2 Å²	40.2	9%	0.09	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	154.4	171.6	-64.7	-100.8	0	0	0	109.1	N1669 V1670 F1671 L1672 K1696 I1714 I1715 V1717 Y1749 F1755	N1669-Y1698 HydrophobicContact CB-CD2 4.08Å; N1669-Y1698 HydrophobicContact CB-CE2 3.7Å; V1670-Y1698 PolarHBondContact O-N 2.83Å; F1671-Y1698 CarbonylContact C-O 3.52Å; F1671-Y1698 WeakPolarHBondContact CA-O 3.38Å; L1672-Y1698 PolarHBondContact N-O 2.81Å; K1696-Y1698 HydrophobicContact CB-CE2 4.1Å; K1696-Y1698 WeakPolarHBondContact O-CD2 3.32Å; Y1698-I1714 VanDerWaalsContact C-CG2 3.46Å; Y1698-I1715 CarbonylContact C-O 3.59Å; Y1698-I1715 VanDerWaalsContact CA-O 3.28Å; Y1698-I1715 WeakPolarHBondContact CA-O 3.17Å; Y1698-I1715 HydrophobicContact CD1-CB 3.75Å; Y1698-I1715 HydrophobicContact CD1-CD1 4.34Å; Y1698-I1715 HydrophobicContact CD1-CG2 3.91Å; Y1698-I1715 HydrophobicContact CE1-CB 4.01Å; Y1698-I1715 HydrophobicContact CE1-CD1 3.81Å; Y1698-I1715 HydrophobicContact CE1-CG2 3.97Å; Y1698-I1715 HydrophobicContact CG-CB 4.38Å; Y1698-V1717 HydrophobicContact CD1-CG2 3.56Å; Y1698-V1717 HydrophobicContact CG-CG2 4.21Å; Y1698-Y1749 HydrophobicContact CE1-CE1 4.2Å; Y1698-F1755 HydrophobicContact CD1-CE1 4.37Å; Y1698-F1755 HydrophobicContact CD2-CD1 4.48Å; Y1698-F1755 AromaticContact CD2-CE1 3.68Å; Y1698-F1755 HydrophobicContact CD2-CE1 3.68Å; Y1698-F1755 HydrophobicContact CE2-CE1 4.29Å; Y1698-F1755 AromaticContact CG-CE1 3.72Å; Y1698-F1755 HydrophobicContact CG-CE1 3.72Å; Y1698-F1755 HydrophobicContact CG-CZ 4.25Å
1699	G	87.1	Confident	84.3	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.6	159.3	174.8	0	0	0	0	0	114.1	L1672 I1715 P1716 V1717	L1672-G1699 WeakPolarHBondContact O-CA 3.4Å; G1699-I1715 PolarHBondContact N-O 3.21Å; G1699-P1716 CarbonylContact O-C 3.51Å; G1699-P1716 VanDerWaalsContact O-CA 3.31Å; G1699-P1716 WeakPolarHBondContact O-CA 3.2Å; G1699-V1717 PolarHBondContact O-N 2.87Å
1700	S	84.5	Confident	83.7	Confident	29 Å²	29	42.4 Å²	42.4	20%	0.203	23%	0.234	C	C	.	.			trans	-56.4	148.7	168.4	57.1	0	0	0	0	110.5	L1672 G1702 T1703 A1704	L1672-S1700 PolarHBondContact O-N 3.38Å; S1700-G1702 VanDerWaalsContact C-N 3.3Å; S1700-G1702 PolarHBondContact O-N 3.23Å; S1700-G1702 VanDerWaalsContact O-N 3.1Å; S1700-T1703 WeakPolarHBondContact O-CA 3.36Å; S1700-T1703 WeakPolarHBondContact O-CB 3.18Å; S1700-T1703 PolarHBondContact O-N 3.5Å; S1700-T1703 WeakPolarHBondContact OG-CB 3.45Å; S1700-T1703 PolarHBondContact OG-OG1 2.93Å; S1700-A1704 PolarHBondContact O-N 3.46Å
1701	C	76.6	Confident	83.2	Confident	58 Å²	58	45.6 Å²	45.6	39%	0.392	27%	0.268	S	S	.	.	H	α-helix	trans	-48.9	-46.8	-171.3	-51.5	0	0	0	0	113.5	T1703 A1704 D1705	C1701-T1703 VanDerWaalsContact C-N 3.32Å; C1701-T1703 PolarHBondContact O-N 3.38Å; C1701-A1704 PolarHBondContact O-N 3.34Å; C1701-D1705 WeakPolarHBondContact O-CB 3.31Å; C1701-D1705 PolarHBondContact O-N 3.15Å
1702	G	71.7	Confident	83.1	Confident	43 Å²	43	41.9 Å²	41.9	44%	0.443	25%	0.251	S	S	.	.	H	α-helix	trans	-71.4	-19.2	178.1	0	0	0	0	0	115.4	K1680 S1700	K1680-G1702 PolarHBondContact NZ-O 3.41Å; S1700-G1702 VanDerWaalsContact C-N 3.3Å; S1700-G1702 PolarHBondContact O-N 3.23Å; S1700-G1702 VanDerWaalsContact O-N 3.1Å
1703	T	84.4	Confident	83.1	Confident	1 Å²	1	40.3 Å²	40.3	1%	0.006	25%	0.252	C	S	.	.	H	α-helix	trans	-83.2	-44.5	172.4	-58.6	0	0	0	0	110.6	L1672 I1674 S1700 C1701 F1706 Y1707	L1672-T1703 HydrophobicContact CB-CG2 4.14Å; I1674-T1703 HydrophobicContact CB-CG2 4.19Å; I1674-T1703 HydrophobicContact CG1-CG2 4.28Å; I1674-T1703 PolarHBondContact N-OG1 2.72Å; I1674-T1703 PolarHBondContact O-OG1 3.08Å; S1700-T1703 WeakPolarHBondContact O-CA 3.36Å; S1700-T1703 WeakPolarHBondContact O-CB 3.18Å; S1700-T1703 PolarHBondContact O-N 3.5Å; S1700-T1703 WeakPolarHBondContact OG-CB 3.45Å; S1700-T1703 PolarHBondContact OG-OG1 2.93Å; C1701-T1703 VanDerWaalsContact C-N 3.32Å; C1701-T1703 PolarHBondContact O-N 3.38Å; T1703-F1706 PolarHBondContact O-N 3.15Å; T1703-Y1707 HydrophobicContact CG2-CD2 3.79Å; T1703-Y1707 HydrophobicContact CG2-CE2 3.67Å; T1703-Y1707 VanDerWaalsContact O-CD2 3.27Å; T1703-Y1707 WeakPolarHBondContact O-CD2 3.39Å; T1703-Y1707 PolarHBondContact O-N 3.44Å
1704	A	83.5	Confident	83.4	Confident	1 Å²	1	40.2 Å²	40.2	1%	0.008	25%	0.252	C	S	.	.	H	α-helix	trans	-60	-49.2	177.4	0	0	0	0	0	111.2	S1700 C1701 F1706 Y1707 Q1708 I1714 P1716	S1700-A1704 PolarHBondContact O-N 3.46Å; C1701-A1704 PolarHBondContact O-N 3.34Å; A1704-F1706 PolarHBondContact O-N 2.98Å; A1704-Y1707 PolarHBondContact O-N 3.33Å; A1704-Q1708 WeakPolarHBondContact O-CB 3.22Å; A1704-Q1708 VanDerWaalsContact O-CG 3.28Å; A1704-Q1708 WeakPolarHBondContact O-CG 3.36Å; A1704-Q1708 PolarHBondContact O-N 3Å; A1704-I1714 HydrophobicContact CB-CB 4.27Å; A1704-I1714 HydrophobicContact CB-CG2 3.94Å; A1704-P1716 HydrophobicContact CB-CB 3.97Å
1705	D	76	Confident	83.6	Confident	80 Å²	80	42.2 Å²	42.2	43%	0.428	25%	0.253	S	S	.	.	H	α-helix	trans	-54.3	-51.5	177.6	-179.7	56.7	0	0	0	111.7	C1701 Y1707 Q1708 T1709	C1701-D1705 WeakPolarHBondContact O-CB 3.31Å; C1701-D1705 PolarHBondContact O-N 3.15Å; D1705-Y1707 PolarHBondContact O-N 3.29Å; D1705-Q1708 PolarHBondContact O-N 3.29Å; D1705-T1709 WeakPolarHBondContact O-CG2 3.49Å; D1705-T1709 PolarHBondContact O-N 3.4Å
1706	F	82.3	Confident	83.3	Confident	13 Å²	13	45.3 Å²	45.3	6%	0.057	27%	0.273	C	S	.	.	H	α-helix	trans	-55.4	-50	179.2	173.9	-93.4	0	0	0	112.7	Y1677 K1680 L1681 T1703 A1704 T1709 Q1710	Y1677-F1706 HydrophobicContact CD2-CD2 4.2Å; Y1677-F1706 AromaticContact CD2-CE2 3.94Å; Y1677-F1706 HydrophobicContact CD2-CE2 3.94Å; Y1677-F1706 AromaticContact CE2-CD2 3.88Å; Y1677-F1706 HydrophobicContact CE2-CD2 3.88Å; Y1677-F1706 AromaticContact CE2-CE2 3.37Å; Y1677-F1706 HydrophobicContact CE2-CE2 3.37Å; Y1677-F1706 HydrophobicContact CE2-CZ 4.4Å; K1680-F1706 HydrophobicContact CB-CD1 3.66Å; K1680-F1706 HydrophobicContact CB-CE1 3.52Å; K1680-F1706 HydrophobicContact CB-CE2 4.44Å; K1680-F1706 HydrophobicContact CB-CG 4.19Å; K1680-F1706 HydrophobicContact CB-CZ 3.93Å; K1680-F1706 HydrophobicContact CD-CB 3.83Å; K1680-F1706 HydrophobicContact CD-CD1 3.89Å; K1680-F1706 HydrophobicContact CD-CD2 4.19Å; K1680-F1706 HydrophobicContact CD-CG 3.68Å; K1680-F1706 HydrophobicContact CG-CD1 4.2Å; K1680-F1706 HydrophobicContact CG-CG 4.47Å; L1681-F1706 HydrophobicContact CD2-CZ 4.03Å; L1681-F1706 HydrophobicContact CG-CZ 4.27Å; T1703-F1706 PolarHBondContact O-N 3.15Å; A1704-F1706 PolarHBondContact O-N 2.98Å; F1706-T1709 PolarHBondContact O-N 3.35Å; F1706-T1709 PolarHBondContact O-OG1 3.21Å; F1706-Q1710 HydrophobicContact CE1-CG 4.33Å; F1706-Q1710 HydrophobicContact CZ-CG 4.42Å; F1706-Q1710 PolarHBondContact O-N 3.42Å
1707	Y	86.7	Confident	82.8	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-77.5	-29.1	-176.3	-72.6	-63	0	0	0	113.6	I1674 K1680 M1683 L1684 V1687 T1703 A1704 D1705 T1709 Q1710 G1711 I1712 I1714	I1674-Y1707 HydrophobicContact CD1-CE2 4.01Å; I1674-Y1707 WeakPolarHBondContact CD1-OH 3.45Å; K1680-Y1707 WeakPolarHBondContact CA-OH 3.48Å; K1680-Y1707 PolarHBondContact O-OH 3.47Å; M1683-Y1707 WeakPolarHBondContact CB-OH 3.46Å; L1684-Y1707 HydrophobicContact CB-CE1 4.28Å; L1684-Y1707 HydrophobicContact CD1-CD1 3.69Å; L1684-Y1707 HydrophobicContact CD1-CE1 3.73Å; V1687-Y1707 HydrophobicContact CB-CE1 4.15Å; V1687-Y1707 HydrophobicContact CG1-CD1 4.2Å; V1687-Y1707 HydrophobicContact CG1-CD2 4.48Å; V1687-Y1707 HydrophobicContact CG1-CE1 4.29Å; V1687-Y1707 HydrophobicContact CG1-CG 4.3Å; V1687-Y1707 HydrophobicContact CG2-CE1 4.11Å; V1687-Y1707 HydrophobicContact CG2-CE2 4.17Å; T1703-Y1707 HydrophobicContact CG2-CD2 3.79Å; T1703-Y1707 HydrophobicContact CG2-CE2 3.67Å; T1703-Y1707 VanDerWaalsContact O-CD2 3.27Å; T1703-Y1707 WeakPolarHBondContact O-CD2 3.39Å; T1703-Y1707 PolarHBondContact O-N 3.44Å; A1704-Y1707 PolarHBondContact O-N 3.33Å; D1705-Y1707 PolarHBondContact O-N 3.29Å; Y1707-T1709 VanDerWaalsContact C-N 3.26Å; Y1707-T1709 PolarHBondContact O-N 3.18Å; Y1707-Q1710 CarbonylContact O-C 3.59Å; Y1707-Q1710 WeakPolarHBondContact O-CA 3.5Å; Y1707-Q1710 WeakPolarHBondContact O-CB 3.36Å; Y1707-Q1710 PolarHBondContact O-N 3.46Å; Y1707-G1711 PolarHBondContact O-N 3.35Å; Y1707-I1712 CarbonylContact C-O 3.21Å; Y1707-I1712 HydrophobicContact CD1-CD1 4.14Å; Y1707-I1712 PolarHBondContact O-N 2.92Å; Y1707-I1714 VanDerWaalsContact CB-CD1 3.45Å; Y1707-I1714 HydrophobicContact CD2-CD1 3.58Å; Y1707-I1714 HydrophobicContact CG-CD1 3.78Å
1708	Q	82.9	Confident	81.8	Confident	94 Å²	94	45 Å²	45	44%	0.439	28%	0.275	S	S	.	.	H	α-helix	trans	-59.5	-40	168.9	-77	-178.7	0.2	0	0	110.7	A1704 D1705 Q1710 G1711 I1712 I1714	A1704-Q1708 WeakPolarHBondContact O-CB 3.22Å; A1704-Q1708 VanDerWaalsContact O-CG 3.28Å; A1704-Q1708 WeakPolarHBondContact O-CG 3.36Å; A1704-Q1708 PolarHBondContact O-N 3Å; D1705-Q1708 PolarHBondContact O-N 3.29Å; Q1708-Q1710 PolarHBondContact O-N 3.02Å; Q1708-G1711 PolarHBondContact O-N 3.07Å; Q1708-I1712 WeakPolarHBondContact CA-O 3.47Å; Q1708-I1712 PolarHBondContact N-O 3.22Å; Q1708-I1714 PolarHBondContact NE2-O 3.24Å
1709	T	74.1	Confident	80.6	Confident	84 Å²	84	45.6 Å²	45.6	52%	0.515	28%	0.277	S	S	.	.	H	α-helix	trans	-62.9	-21.6	173.3	76.7	0	0	0	0	113.7	D1705 F1706 Y1707 G1711	D1705-T1709 WeakPolarHBondContact O-CG2 3.49Å; D1705-T1709 PolarHBondContact O-N 3.4Å; F1706-T1709 PolarHBondContact O-N 3.35Å; F1706-T1709 PolarHBondContact O-OG1 3.21Å; Y1707-T1709 VanDerWaalsContact C-N 3.26Å; Y1707-T1709 PolarHBondContact O-N 3.18Å; T1709-G1711 VanDerWaalsContact C-N 3.35Å
1710	Q	76	Confident	79	Confident	85 Å²	85	48.2 Å²	48.2	40%	0.397	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.4	7.2	175.4	-56.3	-54.7	-60.7	0	0	113	L1684 F1706 Y1707 Q1708	L1684-Q1710 HydrophobicContact CD1-CB 3.9Å; L1684-Q1710 HydrophobicContact CD1-CG 3.97Å; F1706-Q1710 HydrophobicContact CE1-CG 4.33Å; F1706-Q1710 HydrophobicContact CZ-CG 4.42Å; F1706-Q1710 PolarHBondContact O-N 3.42Å; Y1707-Q1710 CarbonylContact O-C 3.59Å; Y1707-Q1710 WeakPolarHBondContact O-CA 3.5Å; Y1707-Q1710 WeakPolarHBondContact O-CB 3.36Å; Y1707-Q1710 PolarHBondContact O-N 3.46Å; Q1708-Q1710 PolarHBondContact O-N 3.02Å
1711	G	78.5	Confident	77.2	Confident	68 Å²	68	55.6 Å²	55.6	70%	0.701	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.4	18.4	178.4	0	0	0	0	0	114.9	Y1707 Q1708 T1709	Y1707-G1711 PolarHBondContact O-N 3.35Å; Q1708-G1711 PolarHBondContact O-N 3.07Å; T1709-G1711 VanDerWaalsContact C-N 3.35Å
1712	I	86.2	Confident	75.2	Confident	7 Å²	7	61.9 Å²	61.9	4%	0.036	34%	0.342	C	S	.	.			trans	-106	120.5	176.6	-52	171.3	0	0	0	108.4	L1684 V1687 K1688 H1691 L1697 Y1707 Q1708 I1714	L1684-I1712 HydrophobicContact CD1-CD1 3.83Å; V1687-I1712 HydrophobicContact CB-CD1 4.43Å; V1687-I1712 HydrophobicContact CG1-CD1 3.99Å; V1687-I1712 HydrophobicContact CG1-CG2 4.18Å; K1688-I1712 HydrophobicContact CB-CD1 4.49Å; K1688-I1712 HydrophobicContact CG-CD1 3.47Å; K1688-I1712 VanDerWaalsContact CG-CD1 3.47Å; K1688-I1712 HydrophobicContact CG-CG1 4.13Å; H1691-I1712 HydrophobicContact CB-CG2 3.99Å; L1697-I1712 HydrophobicContact CD1-CG2 4.05Å; Y1707-I1712 CarbonylContact C-O 3.21Å; Y1707-I1712 HydrophobicContact CD1-CD1 4.14Å; Y1707-I1712 PolarHBondContact O-N 2.92Å; Q1708-I1712 WeakPolarHBondContact CA-O 3.47Å; Q1708-I1712 PolarHBondContact N-O 3.22Å; I1712-I1714 HydrophobicContact CG2-CG1 4.2Å; I1712-I1714 PolarHBondContact O-N 3.05Å
1713	S	84.3	Confident	73.2	Confident	82 Å²	82	68.5 Å²	68.5	57%	0.573	36%	0.361	S	S	*	.			trans	-72.1	117.9	178.8	-169	0	0	0	0	110.4
1714	I	89	Confident	70.5	Confident	0 Å²	0	73.1 Å²	73.1	0%	0	39%	0.394	C	S	.	.			trans	-132.9	129.1	175.2	-57.1	-167.5	0	0	0	108	L1672 V1687 L1697 Y1698 A1704 Y1707 Q1708 I1712	L1672-I1714 HydrophobicContact CD1-CD1 4.12Å; V1687-I1714 HydrophobicContact CG1-CD1 4.11Å; L1697-I1714 HydrophobicContact CB-CB 4.44Å; L1697-I1714 HydrophobicContact CB-CD1 4.48Å; L1697-I1714 HydrophobicContact CB-CG1 3.95Å; L1697-I1714 HydrophobicContact CB-CG2 4.36Å; L1697-I1714 HydrophobicContact CD1-CD1 4.41Å; L1697-I1714 HydrophobicContact CD1-CG1 4.24Å; L1697-I1714 WeakPolarHBondContact O-CA 3.48Å; Y1698-I1714 VanDerWaalsContact C-CG2 3.46Å; A1704-I1714 HydrophobicContact CB-CB 4.27Å; A1704-I1714 HydrophobicContact CB-CG2 3.94Å; Y1707-I1714 VanDerWaalsContact CB-CD1 3.45Å; Y1707-I1714 HydrophobicContact CD2-CD1 3.58Å; Y1707-I1714 HydrophobicContact CG-CD1 3.78Å; Q1708-I1714 PolarHBondContact NE2-O 3.24Å; I1712-I1714 HydrophobicContact CG2-CG1 4.2Å; I1712-I1714 PolarHBondContact O-N 3.05Å
1715	I	87.7	Confident	67.7	Low	81 Å²	81	80.6 Å²	80.6	42%	0.415	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	121.4	-179.9	-58.3	168.4	0	0	0	108.9	L1697 Y1698 G1699	L1697-I1715 PolarHBondContact O-N 2.66Å; Y1698-I1715 CarbonylContact C-O 3.59Å; Y1698-I1715 VanDerWaalsContact CA-O 3.28Å; Y1698-I1715 WeakPolarHBondContact CA-O 3.17Å; Y1698-I1715 HydrophobicContact CD1-CB 3.75Å; Y1698-I1715 HydrophobicContact CD1-CD1 4.34Å; Y1698-I1715 HydrophobicContact CD1-CG2 3.91Å; Y1698-I1715 HydrophobicContact CE1-CB 4.01Å; Y1698-I1715 HydrophobicContact CE1-CD1 3.81Å; Y1698-I1715 HydrophobicContact CE1-CG2 3.97Å; Y1698-I1715 HydrophobicContact CG-CB 4.38Å; G1699-I1715 PolarHBondContact N-O 3.21Å
1716	P	83.7	Confident	65.3	Low	72 Å²	72	83.4 Å²	83.4	47%	0.468	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	138.5	176.3	29	-33.1	0	0	0	111	G1699 A1704	G1699-P1716 CarbonylContact O-C 3.51Å; G1699-P1716 VanDerWaalsContact O-CA 3.31Å; G1699-P1716 WeakPolarHBondContact O-CA 3.2Å; A1704-P1716 HydrophobicContact CB-CB 3.97Å
1717	V	79	Confident	62.6	Low	9 Å²	9	87.9 Å²	87.9	6%	0.055	48%	0.479	C	S	.	.			trans	-130	134.8	175.2	-164.2	0	0	0	0	110.4	F1671 Y1698 G1699 G1744 I1746 Y1749	F1671-V1717 HydrophobicContact CE2-CB 4.17Å; F1671-V1717 HydrophobicContact CE2-CG2 4.35Å; Y1698-V1717 HydrophobicContact CD1-CG2 3.56Å; Y1698-V1717 HydrophobicContact CG-CG2 4.21Å; G1699-V1717 PolarHBondContact O-N 2.87Å; V1717-G1744 WeakPolarHBondContact CG1-O 3.43Å; V1717-I1746 HydrophobicContact CB-CG1 4.01Å; V1717-I1746 HydrophobicContact CG1-CG1 3.6Å; V1717-Y1749 HydrophobicContact CG1-CD2 4.49Å
1718	E	71.5	Confident	59.6	Low	116 Å²	116	96.6 Å²	96.6	54%	0.542	52%	0.523	S	S	.	.	P	Polyproline II helix	trans	-98.8	157	-178.1	-63.5	-164.9	166.2	0	0	113.6	I1746	E1718-I1746 PolarHBondContact O-N 3.29Å
1719	W	65.9	Low	57	Low	35 Å²	35	96.1 Å²	96.1	13%	0.133	53%	0.531	C	S	.	.	P	Polyproline II helix	trans	-89.6	137.6	163.3	-92.7	93.5	0	0	0	108.1	I1746 R1777 Q1780 T1781	W1719-I1746 HydrophobicContact CG-CD1 4.29Å; W1719-I1746 HydrophobicContact CZ2-CG2 4.34Å; W1719-R1777 HydrophobicContact CB-CG 4.34Å; W1719-R1777 HydrophobicContact CD2-CG 4.39Å; W1719-R1777 HydrophobicContact CG-CB 4.22Å; W1719-R1777 HydrophobicContact CG-CG 3.96Å; W1719-Q1780 HydrophobicContact CH2-CB 3.63Å; W1719-Q1780 HydrophobicContact CZ2-CB 3.81Å; W1719-Q1780 HydrophobicContact CZ3-CB 4.38Å; W1719-T1781 WeakPolarHBondContact CZ2-OG1 3.36Å; W1719-T1781 PolarHBondContact NE1-OG1 2.85Å; W1719-T1781 VanDerWaalsContact NE1-OG1 3.08Å
1720	P	54.5	Low	54.9	Low	55 Å²	55	99.7 Å²	99.7	36%	0.357	55%	0.547	S	S	.	.	P	Polyproline II helix	trans	-56.4	143.5	178.4	20.6	-30	0	0	0	111.4	T1745	P1720-T1745 HydrophobicContact CB-CG2 4.12Å; P1720-T1745 HydrophobicContact CG-CG2 4.23Å
1721	Y	46.2	Very low	52.5	Low	184 Å²	184	103.6 Å²	103.6	72%	0.722	57%	0.57	S	S	*	*	P	Polyproline II helix	trans	-68.7	134.1	164.6	-76.7	-93.2	0	0	0	107.8	E1723	Y1721-E1723 PolarHBondContact O-N 3.15Å; Y1721-E1723 VanDerWaalsContact O-N 3.1Å
1722	E	35.1	Very low	50.2	Low	190 Å²	190	109.7 Å²	109.7	89%	0.888	58%	0.577	S	S	*	*	P	Polyproline II helix	trans	-57.7	116.2	166.7	-74.9	174.4	168.9	0	0	107	S1724	E1722-S1724 PolarHBondContact O-N 2.94Å; E1722-S1724 VanDerWaalsContact O-N 3.11Å
1723	E	29.9	Very low	47.3	Very low	182 Å²	182	117.7 Å²	117.7	85%	0.85	62%	0.618	S	S	*	*			trans	-56.5	114.6	178.5	-76.1	174.3	154.6	0	0	109.4	Y1721	Y1721-E1723 PolarHBondContact O-N 3.15Å; Y1721-E1723 VanDerWaalsContact O-N 3.1Å
1724	S	27.6	Very low	44.4	Very low	98 Å²	98	122.1 Å²	122.1	69%	0.685	63%	0.63	S	S	*	*			trans	-80.3	113.5	150.5	52.4	0	0	0	0	107.3	E1722 I1726	E1722-S1724 PolarHBondContact O-N 2.94Å; E1722-S1724 VanDerWaalsContact O-N 3.11Å; S1724-I1726 PolarHBondContact O-N 2.87Å
1725	D	24.6	Very low	41.4	Very low	157 Å²	157	129.3 Å²	129.3	84%	0.84	67%	0.668	S	S	*	*			trans	-49.9	85.7	177.9	-72	-47.8	0	0	0	113.7
1726	I	26.1	Very low	38.4	Very low	140 Å²	140	133.3 Å²	133.3	72%	0.718	69%	0.691	S	S	*	*			trans	-143.9	111.1	172.3	-63.1	-174	0	0	0	111.2	S1724	S1724-I1726 PolarHBondContact O-N 2.87Å
1727	C	25.4	Very low	35.5	Very low	106 Å²	106	137.9 Å²	137.9	72%	0.716	71%	0.708	S	S	*	*			trans	78	86.6	151.8	-58.9	0	0	0	0	120.2	S1729	C1727-S1729 PolarHBondContact O-N 3.13Å; C1727-S1729 VanDerWaalsContact O-N 3.14Å
1728	I	23.5	Very low	33	Very low	183 Å²	183	143.8 Å²	143.8	94%	0.938	74%	0.739	S	S	*	*			trans	-71.1	88.8	148.9	-58.1	168.4	0	0	0	108.2
1729	S	27.7	Very low	30.9	Very low	85 Å²	85	143.5 Å²	143.5	59%	0.594	76%	0.756	S	S	*	*			trans	-167.3	96.7	158.9	58	0	0	0	0	110.5	C1727	C1727-S1729 PolarHBondContact O-N 3.13Å; C1727-S1729 VanDerWaalsContact O-N 3.14Å
1730	D	30.1	Very low	29.4	Very low	159 Å²	159	147 Å²	147	85%	0.85	79%	0.786	S	S	*	*				171.2	100.4	124.4	-88.7	-20.1	0	0	0	110.9	K1732	D1730-K1732 PolarHBondContact O-N 3.49Å; D1730-K1732 VanDerWaalsContact O-N 3.08Å
1731	N	26.9	Very low	28.5	Very low	166 Å²	166	147.1 Å²	147.1	89%	0.888	79%	0.789	S	S	*	*			trans	-63.8	96.6	164.9	-83.5	-33	0	0	0	109.7
1732	K	28.6	Very low	28.2	Very low	197 Å²	197	145.9 Å²	145.9	86%	0.857	79%	0.787	S	S	*	*			trans	-170.8	59.2	164.2	-112.7	172.6	-158.9	-178.2	0	115.7	D1730	D1730-K1732 PolarHBondContact O-N 3.49Å; D1730-K1732 VanDerWaalsContact O-N 3.08Å
1733	I	26.6	Very low	28.9	Very low	175 Å²	175	144 Å²	144	90%	0.897	78%	0.783	S	S	*	*			trans	-135.2	111.4	154.1	-58.3	-177.5	0	0	0	110.1
1734	Q	23.7	Very low	30.1	Very low	174 Å²	174	136.3 Å²	136.3	81%	0.813	75%	0.752	S	S	*	*			trans	-80	130.5	178.1	-119.6	169	-12.5	0	0	110.3	N1736	Q1734-N1736 PolarHBondContact O-N 3.18Å
1735	N	24.5	Very low	32	Very low	151 Å²	151	133.8 Å²	133.8	81%	0.807	73%	0.733	S	S	*	*	S	Bend	trans	30.2	85.9	139.9	-61.8	-13.4	0	0	0	118.1
1736	N	25.2	Very low	34.2	Very low	165 Å²	165	126.5 Å²	126.5	88%	0.882	69%	0.694	S	S	*	*			trans	-169.6	66.4	146.3	-122.4	-0.3	0	0	0	113	Q1734	Q1734-N1736 PolarHBondContact O-N 3.18Å
1737	M	23.3	Very low	36.3	Very low	169 Å²	169	123.1 Å²	123.1	83%	0.833	68%	0.675	S	S	*	*	S	Bend	trans	-149.8	127.9	159	-97.1	177.4	-158.1	0	0	108.6	A1739	M1737-A1739 PolarHBondContact O-N 3.26Å
1738	D	25.8	Very low	38.4	Very low	132 Å²	132	122.2 Å²	122.2	71%	0.706	66%	0.66	S	S	*	*			trans	-50.3	135.2	180	-75.4	-45.6	0	0	0	111.7	S1740 S1741	D1738-S1740 PolarHBondContact O-N 3.25Å; D1738-S1741 PolarHBondContact O-N 3.27Å; D1738-S1741 PolarHBondContact O-OG 3.01Å
1739	A	26.8	Very low	40.9	Very low	110 Å²	110	115 Å²	115	91%	0.909	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.3	10.7	176.2	0	0	0	0	0	114.8	M1737	M1737-A1739 PolarHBondContact O-N 3.26Å
1740	S	35.7	Very low	43.1	Very low	108 Å²	108	111 Å²	111	76%	0.755	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.2	-6.4	175.8	58.7	0	0	0	0	113.9	D1738	D1738-S1740 PolarHBondContact O-N 3.25Å
1741	S	35.3	Very low	44.9	Very low	59 Å²	59	108.5 Å²	108.5	41%	0.413	58%	0.575	S	S	.	*			trans	-101.5	74.1	169.8	54.6	0	0	0	0	110.4	D1738 D1743	D1738-S1741 PolarHBondContact O-N 3.27Å; D1738-S1741 PolarHBondContact O-OG 3.01Å; S1741-D1743 VanDerWaalsContact C-N 3.25Å; S1741-D1743 PolarHBondContact O-N 2.93Å
1742	K	40.3	Very low	47	Very low	157 Å²	157	104 Å²	104	68%	0.683	55%	0.551	S	S	*	*			trans	-67.5	97.8	157.1	-80.5	-171.3	176.8	-174.6	0	105.7	G1744 Y1749	K1742-G1744 PolarHBondContact O-N 2.84Å; K1742-Y1749 PolarHBondContact O-OH 3.37Å
1743	D	49.4	Very low	49	Very low	151 Å²	151	99.4 Å²	99.4	81%	0.807	53%	0.531	S	S	*	.			trans	-66.2	59.1	165.8	-71.5	-28	0	0	0	109.5	S1741	S1741-D1743 VanDerWaalsContact C-N 3.25Å; S1741-D1743 PolarHBondContact O-N 2.93Å
1744	G	55.6	Low	51.6	Low	20 Å²	20	94.5 Å²	94.5	21%	0.206	51%	0.506	C	S	.	.			trans	-76	141.9	-176.5	0	0	0	0	0	110.7	V1717 K1742 Y1749	V1717-G1744 WeakPolarHBondContact CG1-O 3.43Å; K1742-G1744 PolarHBondContact O-N 2.84Å; G1744-Y1749 WeakPolarHBondContact O-CE2 3.25Å
1745	T	67.7	Low	54.6	Low	46 Å²	46	86.5 Å²	86.5	28%	0.282	47%	0.469	S	S	.	.			trans	-73.3	158.3	171.2	62.2	0	0	0	0	111.2	P1720 Q1747 Q1748 Y1749	P1720-T1745 HydrophobicContact CB-CG2 4.12Å; P1720-T1745 HydrophobicContact CG-CG2 4.23Å; T1745-Q1747 PolarHBondContact O-N 2.79Å; T1745-Q1747 VanDerWaalsContact O-N 3.11Å; T1745-Q1748 PolarHBondContact O-N 2.95Å; T1745-Q1748 PolarHBondContact OG1-N 3.19Å; T1745-Y1749 WeakPolarHBondContact O-CD2 3.31Å; T1745-Y1749 PolarHBondContact O-N 2.78Å; T1745-Y1749 VanDerWaalsContact O-N 3.11Å
1746	I	70	Confident	57.6	Low	4 Å²	4	80.5 Å²	80.5	2%	0.021	44%	0.438	C	S	.	.	H	α-helix	trans	-51.4	-38.2	174.7	-67.6	166.5	0	0	0	111.6	F1671 V1717 E1718 W1719 Y1749 L1750 T1781	F1671-I1746 HydrophobicContact CE1-CD1 4.31Å; F1671-I1746 HydrophobicContact CE2-CD1 4Å; F1671-I1746 HydrophobicContact CE2-CG1 4.1Å; F1671-I1746 HydrophobicContact CZ-CD1 3.51Å; F1671-I1746 HydrophobicContact CZ-CG1 4.02Å; V1717-I1746 HydrophobicContact CB-CG1 4.01Å; V1717-I1746 HydrophobicContact CG1-CG1 3.6Å; E1718-I1746 PolarHBondContact O-N 3.29Å; W1719-I1746 HydrophobicContact CG-CD1 4.29Å; W1719-I1746 HydrophobicContact CZ2-CG2 4.34Å; I1746-Y1749 PolarHBondContact O-N 3.06Å; I1746-L1750 HydrophobicContact CG2-CD1 4Å; I1746-L1750 PolarHBondContact O-N 2.91Å; I1746-L1750 VanDerWaalsContact O-N 3.12Å; I1746-T1781 HydrophobicContact CG2-CG2 4.27Å
1747	Q	70.1	Confident	60.7	Low	69 Å²	69	72.8 Å²	72.8	32%	0.322	40%	0.397	S	S	.	.	H	α-helix	trans	-64.2	-40.3	179.2	-171.9	177.9	8.6	0	0	112.2	T1745 K1751 L1784	T1745-Q1747 PolarHBondContact O-N 2.79Å; T1745-Q1747 VanDerWaalsContact O-N 3.11Å; Q1747-K1751 HydrophobicContact CG-CD 4.34Å; Q1747-K1751 WeakPolarHBondContact O-CB 3.5Å; Q1747-K1751 WeakPolarHBondContact O-CG 3.47Å; Q1747-K1751 PolarHBondContact O-N 3.34Å; Q1747-L1784 HydrophobicContact CB-CD2 4.23Å; Q1747-L1784 HydrophobicContact CG-CD2 3.9Å
1748	Q	70.5	Confident	63.9	Low	86 Å²	86	64.8 Å²	64.8	40%	0.402	36%	0.358	S	S	.	.	H	α-helix	trans	-68.3	-45.7	178	-169.5	60.9	31.3	0	0	111.4	T1745 L1750 K1751 D1752	T1745-Q1748 PolarHBondContact O-N 2.95Å; T1745-Q1748 PolarHBondContact OG1-N 3.19Å; Q1748-L1750 VanDerWaalsContact C-N 3.28Å; Q1748-L1750 PolarHBondContact O-N 3.25Å; Q1748-K1751 PolarHBondContact O-N 3.13Å; Q1748-D1752 PolarHBondContact NE2-OD1 3.05Å; Q1748-D1752 PolarHBondContact NE2-OD2 3.24Å; Q1748-D1752 WeakPolarHBondContact O-CB 3.28Å; Q1748-D1752 PolarHBondContact O-N 3.09Å
1749	Y	75.4	Confident	67	Low	32 Å²	32	58.5 Å²	58.5	13%	0.125	32%	0.324	C	S	.	.	H	α-helix	trans	-59.2	-37.9	177.6	-84.8	-90	0	0	0	113.1	Y1698 V1717 K1742 G1744 T1745 I1746 K1753 L1754 F1755	Y1698-Y1749 HydrophobicContact CE1-CE1 4.2Å; V1717-Y1749 HydrophobicContact CG1-CD2 4.49Å; K1742-Y1749 PolarHBondContact O-OH 3.37Å; G1744-Y1749 WeakPolarHBondContact O-CE2 3.25Å; T1745-Y1749 WeakPolarHBondContact O-CD2 3.31Å; T1745-Y1749 PolarHBondContact O-N 2.78Å; T1745-Y1749 VanDerWaalsContact O-N 3.11Å; I1746-Y1749 PolarHBondContact O-N 3.06Å; Y1749-K1753 PolarHBondContact O-N 2.8Å; Y1749-L1754 HydrophobicContact CD1-CB 3.69Å; Y1749-L1754 HydrophobicContact CD1-CD1 3.62Å; Y1749-L1754 HydrophobicContact CD1-CG 4.31Å; Y1749-L1754 HydrophobicContact CE1-CB 4.44Å; Y1749-L1754 HydrophobicContact CE1-CD1 3.92Å; Y1749-L1754 HydrophobicContact CG-CD1 4.33Å; Y1749-L1754 PolarHBondContact O-N 3.17Å; Y1749-F1755 HydrophobicContact CD1-CE1 4.15Å; Y1749-F1755 HydrophobicContact CD1-CE2 4.31Å; Y1749-F1755 AromaticContact CD1-CZ 3.88Å; Y1749-F1755 HydrophobicContact CD1-CZ 3.88Å; Y1749-F1755 HydrophobicContact CD2-CZ 4.45Å; Y1749-F1755 AromaticContact CG-CE2 3.92Å; Y1749-F1755 HydrophobicContact CG-CE2 3.92Å; Y1749-F1755 AromaticContact CG-CZ 3.79Å; Y1749-F1755 HydrophobicContact CG-CZ 3.79Å
1750	L	73.5	Confident	69.9	Low	0 Å²	0	53.4 Å²	53.4	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-71.6	-44.2	176.8	-85.6	169.7	0	0	0	112.5	I1746 Q1748 D1752 K1753 F1755 I1758 L1784 A1785 V1790	I1746-L1750 HydrophobicContact CG2-CD1 4Å; I1746-L1750 PolarHBondContact O-N 2.91Å; I1746-L1750 VanDerWaalsContact O-N 3.12Å; Q1748-L1750 VanDerWaalsContact C-N 3.28Å; Q1748-L1750 PolarHBondContact O-N 3.25Å; L1750-D1752 VanDerWaalsContact C-N 3.32Å; L1750-D1752 PolarHBondContact O-N 2.86Å; L1750-K1753 PolarHBondContact O-N 2.97Å; L1750-K1753 VanDerWaalsContact O-N 3.1Å; L1750-F1755 HydrophobicContact CD2-CD2 4.46Å; L1750-F1755 HydrophobicContact CG-CD2 4.32Å; L1750-I1758 HydrophobicContact CD1-CD1 4.14Å; L1750-I1758 HydrophobicContact CD2-CD1 3.36Å; L1750-I1758 HydrophobicContact CG-CD1 4.1Å; L1750-L1784 HydrophobicContact CB-CD2 3.78Å; L1750-L1784 HydrophobicContact CB-CG 3.94Å; L1750-L1784 HydrophobicContact CD1-CB 3.95Å; L1750-L1784 HydrophobicContact CD1-CD2 3.65Å; L1750-L1784 HydrophobicContact CD1-CG 3.77Å; L1750-L1784 HydrophobicContact CG-CD2 4.35Å; L1750-L1784 HydrophobicContact CG-CG 4.43Å; L1750-A1785 HydrophobicContact CD2-CB 4.33Å; L1750-V1790 HydrophobicContact CD2-CB 4.14Å; L1750-V1790 HydrophobicContact CD2-CG1 4.36Å; L1750-V1790 HydrophobicContact CD2-CG2 3.9Å
1751	K	68.9	Low	72.3	Confident	107 Å²	107	48.5 Å²	48.5	47%	0.465	25%	0.247	S	C	.	.	H	α-helix	trans	-62.5	-39.5	176.1	-77.4	-180	176.2	-179.3	0	112.3	Q1747 Q1748 K1753	Q1747-K1751 HydrophobicContact CG-CD 4.34Å; Q1747-K1751 WeakPolarHBondContact O-CB 3.5Å; Q1747-K1751 WeakPolarHBondContact O-CG 3.47Å; Q1747-K1751 PolarHBondContact O-N 3.34Å; Q1748-K1751 PolarHBondContact O-N 3.13Å; K1751-K1753 PolarHBondContact O-N 3.38Å
1752	D	70.4	Confident	74	Confident	71 Å²	71	47.8 Å²	47.8	38%	0.38	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.9	3.5	177.1	-65.2	-13.7	0	0	0	112.8	Q1748 L1750 L1754	Q1748-D1752 PolarHBondContact NE2-OD1 3.05Å; Q1748-D1752 PolarHBondContact NE2-OD2 3.24Å; Q1748-D1752 WeakPolarHBondContact O-CB 3.28Å; Q1748-D1752 PolarHBondContact O-N 3.09Å; L1750-D1752 VanDerWaalsContact C-N 3.32Å; L1750-D1752 PolarHBondContact O-N 2.86Å; D1752-L1754 HydrophobicContact CB-CD1 4.02Å; D1752-L1754 HydrophobicContact CB-CG 3.81Å; D1752-L1754 PolarHBondContact O-N 3.4Å
1753	K	70.8	Confident	74.9	Confident	102 Å²	102	46.7 Å²	46.7	44%	0.443	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	51	38.4	-178.7	-61.3	-176.3	179.6	174.2	0	113.8	A841 Q842 Y1749 L1750 K1751	A841-K1753 WeakPolarHBondContact O-CE 3.4Å; A841-K1753 PolarHBondContact O-NZ 3.46Å; Q842-K1753 PolarHBondContact O-NZ 3.35Å; Y1749-K1753 PolarHBondContact O-N 2.8Å; L1750-K1753 PolarHBondContact O-N 2.97Å; L1750-K1753 VanDerWaalsContact O-N 3.1Å; K1751-K1753 PolarHBondContact O-N 3.38Å
1754	L	81.3	Confident	75.1	Confident	71 Å²	71	44.4 Å²	44.4	37%	0.372	23%	0.226	S	C	.	.			trans	-82.8	-18	-176.9	-67.4	177.8	0	0	0	113.6	N1669 Y1749 D1752	N1669-L1754 WeakPolarHBondContact CB-O 3.38Å; N1669-L1754 PolarHBondContact ND2-O 2.96Å; Y1749-L1754 HydrophobicContact CD1-CB 3.69Å; Y1749-L1754 HydrophobicContact CD1-CD1 3.62Å; Y1749-L1754 HydrophobicContact CD1-CG 4.31Å; Y1749-L1754 HydrophobicContact CE1-CB 4.44Å; Y1749-L1754 HydrophobicContact CE1-CD1 3.92Å; Y1749-L1754 HydrophobicContact CG-CD1 4.33Å; Y1749-L1754 PolarHBondContact O-N 3.17Å; D1752-L1754 HydrophobicContact CB-CD1 4.02Å; D1752-L1754 HydrophobicContact CB-CG 3.81Å; D1752-L1754 PolarHBondContact O-N 3.4Å
1755	F	86.5	Confident	74.8	Confident	7 Å²	7	50.4 Å²	50.4	3%	0.031	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	134.1	173.3	-65.6	-51	0	0	0	110.9	N1669 F1671 Y1698 Y1749 L1750 I1758 V1790	N1669-F1755 HydrophobicContact CB-CD1 3.83Å; N1669-F1755 HydrophobicContact CB-CE1 4.29Å; F1671-F1755 HydrophobicContact CB-CD1 3.93Å; F1671-F1755 HydrophobicContact CB-CD2 4.15Å; F1671-F1755 HydrophobicContact CB-CE1 3.84Å; F1671-F1755 HydrophobicContact CB-CE2 4.02Å; F1671-F1755 HydrophobicContact CB-CG 4.11Å; F1671-F1755 HydrophobicContact CB-CZ 3.89Å; F1671-F1755 HydrophobicContact CD2-CE2 4.36Å; F1671-F1755 HydrophobicContact CD2-CZ 4Å; F1671-F1755 HydrophobicContact CG-CE2 4.25Å; F1671-F1755 HydrophobicContact CG-CZ 4.2Å; Y1698-F1755 HydrophobicContact CD1-CE1 4.37Å; Y1698-F1755 HydrophobicContact CD2-CD1 4.48Å; Y1698-F1755 AromaticContact CD2-CE1 3.68Å; Y1698-F1755 HydrophobicContact CD2-CE1 3.68Å; Y1698-F1755 HydrophobicContact CE2-CE1 4.29Å; Y1698-F1755 AromaticContact CG-CE1 3.72Å; Y1698-F1755 HydrophobicContact CG-CE1 3.72Å; Y1698-F1755 HydrophobicContact CG-CZ 4.25Å; Y1749-F1755 HydrophobicContact CD1-CE1 4.15Å; Y1749-F1755 HydrophobicContact CD1-CE2 4.31Å; Y1749-F1755 AromaticContact CD1-CZ 3.88Å; Y1749-F1755 HydrophobicContact CD1-CZ 3.88Å; Y1749-F1755 HydrophobicContact CD2-CZ 4.45Å; Y1749-F1755 AromaticContact CG-CE2 3.92Å; Y1749-F1755 HydrophobicContact CG-CE2 3.92Å; Y1749-F1755 AromaticContact CG-CZ 3.79Å; Y1749-F1755 HydrophobicContact CG-CZ 3.79Å; L1750-F1755 HydrophobicContact CD2-CD2 4.46Å; L1750-F1755 HydrophobicContact CG-CD2 4.32Å; F1755-I1758 HydrophobicContact CB-CG1 4.36Å; F1755-I1758 HydrophobicContact CD2-CD1 4.41Å; F1755-V1790 HydrophobicContact CB-CG1 4.33Å; F1755-V1790 WeakPolarHBondContact O-CG1 3.34Å
1756	S	86.5	Confident	73.7	Confident	24 Å²	24	51.4 Å²	51.4	17%	0.168	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	-17.4	174	65.2	0	0	0	0	113.4	D1668 N1669 P1791	D1668-S1756 WeakPolarHBondContact CB-OG 3.29Å; D1668-S1756 PolarHBondContact OD2-OG 3.39Å; N1669-S1756 PolarHBondContact O-N 3.39Å; N1669-S1756 PolarHBondContact O-OG 2.82Å; S1756-P1791 WeakPolarHBondContact O-CD 3.5Å; S1756-P1791 WeakPolarHBondContact O-CG 3.46Å
1757	L	90	Very high	72.6	Confident	4 Å²	4	52.6 Å²	52.6	2%	0.021	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	138.4	176.2	178.7	66.2	0	0	0	111.1	P1664 V1670 F1671 V1759 P1791 L1793 L1802	P1664-L1757 HydrophobicContact CB-CB 4.31Å; P1664-L1757 HydrophobicContact CG-CB 4.3Å; P1664-L1757 HydrophobicContact CG-CD2 4.3Å; V1670-L1757 WeakPolarHBondContact CA-O 3.46Å; V1670-L1757 HydrophobicContact CG1-CB 4.22Å; V1670-L1757 HydrophobicContact CG1-CD2 4.23Å; V1670-L1757 HydrophobicContact CG1-CG 4.33Å; V1670-L1757 HydrophobicContact CG2-CB 4.25Å; F1671-L1757 PolarHBondContact N-O 3.13Å; L1757-V1759 HydrophobicContact CD2-CG2 4.39Å; L1757-V1759 HydrophobicContact CG-CG2 4.43Å; L1757-P1791 HydrophobicContact CD1-CB 4Å; L1757-L1793 HydrophobicContact CD1-CD1 4.2Å; L1757-L1793 HydrophobicContact CD1-CG 4.28Å; L1757-L1802 HydrophobicContact CD1-CD2 4.43Å; L1757-L1802 HydrophobicContact CD2-CD2 4.28Å
1758	I	91	Very high	71.3	Confident	1 Å²	1	50.5 Å²	50.5	1%	0.005	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	128.7	172.8	-66	178.2	0	0	0	110	F1671 L1750 F1755 T1781 A1785 V1790 P1791 L1792 L1793	F1671-I1758 HydrophobicContact CB-CG1 4.22Å; F1671-I1758 HydrophobicContact CD1-CG2 4.17Å; F1671-I1758 WeakPolarHBondContact O-CA 3.36Å; L1750-I1758 HydrophobicContact CD1-CD1 4.14Å; L1750-I1758 HydrophobicContact CD2-CD1 3.36Å; L1750-I1758 HydrophobicContact CG-CD1 4.1Å; F1755-I1758 HydrophobicContact CB-CG1 4.36Å; F1755-I1758 HydrophobicContact CD2-CD1 4.41Å; I1758-T1781 HydrophobicContact CG2-CG2 4.47Å; I1758-A1785 HydrophobicContact CD1-CB 3.73Å; I1758-V1790 HydrophobicContact CD1-CG1 3.93Å; I1758-V1790 HydrophobicContact CG1-CG1 3.99Å; I1758-P1791 PolarHBondContact N-O 3.15Å; I1758-L1792 HydrophobicContact CB-CD1 4.12Å; I1758-L1792 HydrophobicContact CG2-CD1 3.68Å; I1758-L1792 WeakPolarHBondContact O-CA 3.44Å; I1758-L1793 PolarHBondContact O-N 2.8Å
1759	V	90.9	Very high	70.2	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	109.3	170.8	-175.5	0	0	0	0	108.4	F1671 L1672 S1673 M1683 L1757 L1761 L1793 A1799	F1671-V1759 PolarHBondContact O-N 2.89Å; L1672-V1759 HydrophobicContact CD2-CB 3.72Å; L1672-V1759 HydrophobicContact CD2-CG2 3.8Å; S1673-V1759 PolarHBondContact N-O 3.22Å; M1683-V1759 HydrophobicContact CE-CG1 4.42Å; L1757-V1759 HydrophobicContact CD2-CG2 4.39Å; L1757-V1759 HydrophobicContact CG-CG2 4.43Å; V1759-L1761 HydrophobicContact CG1-CD1 4.41Å; V1759-L1761 HydrophobicContact CG1-CD2 4.25Å; V1759-L1761 HydrophobicContact CG1-CG 4.03Å; V1759-L1793 HydrophobicContact CG2-CB 4.42Å; V1759-L1793 HydrophobicContact CG2-CD1 4.3Å; V1759-A1799 HydrophobicContact CG1-CB 4.08Å
1760	S	88.9	Confident	68.6	Low	3 Å²	3	53.8 Å²	53.8	2%	0.021	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	94.1	-177.9	-171.2	0	0	0	0	110.8	S1673 L1793	S1673-S1760 CarbonylContact O-C 3.59Å; S1673-S1760 WeakPolarHBondContact O-CA 3.21Å; S1760-L1793 PolarHBondContact N-O 2.92Å
1761	L	85.1	Confident	67.1	Low	5 Å²	5	61.1 Å²	61.1	3%	0.026	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	115	-179.8	-54.6	-178.7	0	0	0	110.1	S1673 I1674 G1675 H1679 M1683 V1759 T1794 V1796	S1673-L1761 PolarHBondContact O-N 3.47Å; I1674-L1761 HydrophobicContact CD1-CD1 4.42Å; I1674-L1761 HydrophobicContact CG1-CD1 4.21Å; I1674-L1761 HydrophobicContact CG1-CG 4.45Å; I1674-L1761 HydrophobicContact CG2-CB 4.33Å; I1674-L1761 HydrophobicContact CG2-CD1 4.16Å; G1675-L1761 PolarHBondContact N-O 3.36Å; H1679-L1761 HydrophobicContact CB-CD1 4.18Å; M1683-L1761 HydrophobicContact CG-CD1 3.89Å; M1683-L1761 HydrophobicContact SD-CD1 4.38Å; V1759-L1761 HydrophobicContact CG1-CD1 4.41Å; V1759-L1761 HydrophobicContact CG1-CD2 4.25Å; V1759-L1761 HydrophobicContact CG1-CG 4.03Å; L1761-T1794 WeakPolarHBondContact CD2-O 3.24Å; L1761-V1796 HydrophobicContact CD1-CB 4.06Å; L1761-V1796 HydrophobicContact CD1-CG2 4.04Å; L1761-V1796 HydrophobicContact CD2-CB 4.47Å
1762	S	70.5	Confident	65.7	Low	44 Å²	44	59.7 Å²	59.7	31%	0.308	31%	0.309	S	S	.	.			trans	-62.5	153.5	-177.1	-171.9	0	0	0	0	113.3	K1764	S1762-K1764 VanDerWaalsContact C-N 3.32Å; S1762-K1764 PolarHBondContact OG-N 3.21Å
1763	L	59.9	Low	64.5	Low	133 Å²	133	57.2 Å²	57.2	70%	0.696	30%	0.298	S	S	*	.	S	Bend	trans	-68.1	-29.4	171.5	-88.9	156.4	0	0	0	112.7
1764	K	54.9	Low	63.5	Low	103 Å²	103	53.4 Å²	53.4	45%	0.448	28%	0.281	S	S	.	.	S	Bend	trans	-89.9	147.8	-169.9	-69.1	-172.3	178	-176.4	0	112.1	S1762	S1762-K1764 VanDerWaalsContact C-N 3.32Å; S1762-K1764 PolarHBondContact OG-N 3.21Å
1765	K	48.7	Very low	62.1	Low	147 Å²	147	55.6 Å²	55.6	64%	0.639	30%	0.297	S	S	*	.	P	Polyproline II helix	trans	-58	139.7	171	-62.6	179	-179.7	179	0	109.1	L1453	L1453-K1765 HydrophobicContact CD1-CD 4.35Å
1766	V	44.4	Very low	61	Low	67 Å²	67	57.8 Å²	57.8	41%	0.406	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47	139.9	-173.9	-179.8	0	0	0	0	112
1767	G	46	Very low	60.1	Low	28 Å²	28	63 Å²	63	29%	0.289	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	102.7	3.3	167.5	0	0	0	0	0	118.5
1768	S	44.1	Very low	59.2	Low	26 Å²	26	63.8 Å²	63.8	18%	0.182	34%	0.336	C	S	.	.			trans	-103.7	109.7	-170.3	-139.9	0	0	0	0	114.3	N1425 Q1429	N1425-S1768 WeakPolarHBondContact ND2-CB 3.43Å; N1425-S1768 PolarHBondContact ND2-OG 3.07Å; Q1429-S1768 PolarHBondContact NE2-OG 3.09Å; Q1429-S1768 PolarHBondContact OE1-OG 3.4Å
1769	R	46.7	Very low	58.5	Low	84 Å²	84	64.7 Å²	64.7	32%	0.317	34%	0.34	S	S	.	.			trans	-98	81.2	171.7	-68.7	-180	179.7	162.9	-1.1	111.1	E1630	E1630-R1769 IonicContact OE2-CZ 3.85Å; E1630-R1769 IonicContact OE2-NH1 3.97Å; E1630-R1769 PolarHBondContact OE2-NH1 2.94Å; E1630-R1769 VanDerWaalsContact OE2-NH1 3.08Å; E1630-R1769 IonicContact OE2-NH2 2.88Å
1770	R	42.2	Very low	57.8	Low	102 Å²	102	68.4 Å²	68.4	39%	0.385	36%	0.357	S	S	.	.			trans	-87.4	143.3	171.2	-90.3	-165.2	-174.4	-172.8	-0.4	111.4	D1426 S1772 A1773 F1774	D1426-R1770 IonicContact OD2-CZ 2.72Å; D1426-R1770 IonicContact OD2-NE 3.7Å; D1426-R1770 IonicContact OD2-NH2 3.28Å; D1426-R1770 PolarHBondContact OD2-NH2 3.37Å; R1770-S1772 PolarHBondContact O-N 2.87Å; R1770-A1773 HydrophobicContact CB-CB 4.4Å; R1770-A1773 WeakPolarHBondContact O-CB 3.3Å; R1770-A1773 PolarHBondContact O-N 3.11Å; R1770-F1774 WeakPolarHBondContact O-CD2 3.37Å; R1770-F1774 VanDerWaalsContact O-CE2 3.25Å; R1770-F1774 WeakPolarHBondContact O-CE2 3.28Å
1771	L	41.2	Very low	57.4	Low	155 Å²	155	68.4 Å²	68.4	81%	0.812	36%	0.357	S	S	*	.	G	3₁₀ helix	trans	-52.6	-36.8	169.2	-83.7	157.9	0	0	0	113.5	A1773 F1774	L1771-A1773 VanDerWaalsContact C-N 3.32Å; L1771-A1773 PolarHBondContact O-N 3.06Å; L1771-F1774 VanDerWaalsContact CA-CD2 3.48Å; L1771-F1774 HydrophobicContact CD2-CD2 4.42Å; L1771-F1774 HydrophobicContact CD2-CE2 4.41Å; L1771-F1774 WeakPolarHBondContact O-CD2 3.45Å; L1771-F1774 PolarHBondContact O-N 3.36Å
1772	S	40.5	Very low	57.5	Low	76 Å²	76	68.7 Å²	68.7	53%	0.531	36%	0.358	S	S	.	.	G	3₁₀ helix	trans	-77	-11.7	176.6	58.3	0	0	0	0	114.7	R1770 F1774	R1770-S1772 PolarHBondContact O-N 2.87Å; S1772-F1774 PolarHBondContact O-N 3.42Å
1773	A	45.6	Very low	58.1	Low	19 Å²	19	67.2 Å²	67.2	16%	0.157	35%	0.345	C	S	.	.	G	3₁₀ helix	trans	-70.2	-23.8	173.9	0	0	0	0	0	112	R1770 L1771 V1775 T1776	R1770-A1773 HydrophobicContact CB-CB 4.4Å; R1770-A1773 WeakPolarHBondContact O-CB 3.3Å; R1770-A1773 PolarHBondContact O-N 3.11Å; L1771-A1773 VanDerWaalsContact C-N 3.32Å; L1771-A1773 PolarHBondContact O-N 3.06Å; A1773-V1775 VanDerWaalsContact C-N 3.27Å; A1773-V1775 PolarHBondContact O-N 3.03Å; A1773-T1776 WeakPolarHBondContact O-CB 3.29Å; A1773-T1776 WeakPolarHBondContact O-CG2 3.46Å; A1773-T1776 PolarHBondContact O-N 3.21Å; A1773-T1776 PolarHBondContact O-OG1 2.81Å
1774	F	49.3	Very low	59	Low	22 Å²	22	62.4 Å²	62.4	10%	0.096	32%	0.32	C	S	.	.	G	3₁₀ helix	trans	-78.1	-4.8	-175.2	-53.2	-57.7	0	0	0	114.7	D1624 R1770 L1771 S1772 Y1779	D1624-F1774 HydrophobicContact CB-CE1 4.3Å; R1770-F1774 WeakPolarHBondContact O-CD2 3.37Å; R1770-F1774 VanDerWaalsContact O-CE2 3.25Å; R1770-F1774 WeakPolarHBondContact O-CE2 3.28Å; L1771-F1774 VanDerWaalsContact CA-CD2 3.48Å; L1771-F1774 HydrophobicContact CD2-CD2 4.42Å; L1771-F1774 HydrophobicContact CD2-CE2 4.41Å; L1771-F1774 WeakPolarHBondContact O-CD2 3.45Å; L1771-F1774 PolarHBondContact O-N 3.36Å; S1772-F1774 PolarHBondContact O-N 3.42Å; F1774-Y1779 HydrophobicContact CD1-CD2 4.16Å; F1774-Y1779 HydrophobicContact CD1-CE2 4.09Å; F1774-Y1779 VanDerWaalsContact O-CD1 3.27Å; F1774-Y1779 WeakPolarHBondContact O-CD1 3.33Å
1775	V	51.6	Low	60.4	Low	117 Å²	117	57.5 Å²	57.5	71%	0.709	30%	0.299	S	S	*	.	G	3₁₀ helix	trans	-103.2	5.7	172.6	-158.9	0	0	0	0	111	A1773	A1773-V1775 VanDerWaalsContact C-N 3.27Å; A1773-V1775 PolarHBondContact O-N 3.03Å
1776	T	62.7	Low	62	Low	53 Å²	53	51.5 Å²	51.5	33%	0.325	28%	0.275	S	S	.	.	S	Bend	trans	-79.1	139.7	-179.9	65.5	0	0	0	0	111.2	A1773 G1778 Y1779 Q1780	A1773-T1776 WeakPolarHBondContact O-CB 3.29Å; A1773-T1776 WeakPolarHBondContact O-CG2 3.46Å; A1773-T1776 PolarHBondContact O-N 3.21Å; A1773-T1776 PolarHBondContact O-OG1 2.81Å; T1776-G1778 PolarHBondContact O-N 2.7Å; T1776-G1778 VanDerWaalsContact O-N 3.08Å; T1776-Y1779 WeakPolarHBondContact O-CB 3.35Å; T1776-Y1779 PolarHBondContact O-N 2.92Å; T1776-Y1779 PolarHBondContact OG1-N 3.18Å; T1776-Q1780 PolarHBondContact O-N 3Å
1777	R	68	Low	63.5	Low	134 Å²	134	50.7 Å²	50.7	51%	0.506	27%	0.268	S	S	.	.	H	α-helix	trans	-49.5	-34.3	170.7	-70.3	178.6	179.2	-176.1	-1.8	112.5	W1719 Q1780 T1781	W1719-R1777 HydrophobicContact CB-CG 4.34Å; W1719-R1777 HydrophobicContact CD2-CG 4.39Å; W1719-R1777 HydrophobicContact CG-CB 4.22Å; W1719-R1777 HydrophobicContact CG-CG 3.96Å; R1777-Q1780 PolarHBondContact O-N 2.81Å; R1777-T1781 PolarHBondContact O-N 3.22Å; R1777-T1781 PolarHBondContact O-OG1 3.21Å
1778	G	71.3	Confident	64.8	Low	20 Å²	20	49.7 Å²	49.7	21%	0.206	26%	0.256	C	S	.	.	H	α-helix	trans	-65.7	-41.1	176.2	0	0	0	0	0	114.2	T1776 R1782	T1776-G1778 PolarHBondContact O-N 2.7Å; T1776-G1778 VanDerWaalsContact O-N 3.08Å; G1778-R1782 WeakPolarHBondContact O-CG 3.46Å; G1778-R1782 PolarHBondContact O-N 2.93Å; G1778-R1782 VanDerWaalsContact O-N 3.1Å; G1778-R1782 PolarHBondContact O-NH1 3.21Å
1779	Y	76.1	Confident	66.3	Low	21 Å²	21	51.1 Å²	51.1	8%	0.082	26%	0.262	C	S	.	.	H	α-helix	trans	-62.7	-46.4	173.3	165	-94.1	0	0	0	110.9	G1622 F1774 T1776 T1781 R1782 R1783	G1622-Y1779 PolarHBondContact O-OH 3.45Å; F1774-Y1779 HydrophobicContact CD1-CD2 4.16Å; F1774-Y1779 HydrophobicContact CD1-CE2 4.09Å; F1774-Y1779 VanDerWaalsContact O-CD1 3.27Å; F1774-Y1779 WeakPolarHBondContact O-CD1 3.33Å; T1776-Y1779 WeakPolarHBondContact O-CB 3.35Å; T1776-Y1779 PolarHBondContact O-N 2.92Å; T1776-Y1779 PolarHBondContact OG1-N 3.18Å; Y1779-T1781 PolarHBondContact O-N 3.45Å; Y1779-R1782 PolarHBondContact O-N 2.71Å; Y1779-R1783 HydrophobicContact CD2-CG 4.28Å; Y1779-R1783 HydrophobicContact CE1-CG 4.06Å; Y1779-R1783 HydrophobicContact CE2-CG 3.73Å; Y1779-R1783 PolarHBondContact O-N 3.21Å
1780	Q	76.7	Confident	68	Low	78 Å²	78	47.7 Å²	47.7	36%	0.364	25%	0.25	S	S	.	.	H	α-helix	trans	-60.2	-43.3	178.4	-67.8	173.3	-30.7	0	0	111.9	W1719 T1776 R1777 L1784	W1719-Q1780 HydrophobicContact CH2-CB 3.63Å; W1719-Q1780 HydrophobicContact CZ2-CB 3.81Å; W1719-Q1780 HydrophobicContact CZ3-CB 4.38Å; T1776-Q1780 PolarHBondContact O-N 3Å; R1777-Q1780 PolarHBondContact O-N 2.81Å; Q1780-L1784 VanDerWaalsContact O-CB 3.28Å; Q1780-L1784 WeakPolarHBondContact O-CB 3.34Å; Q1780-L1784 PolarHBondContact O-N 2.9Å
1781	T	80.3	Confident	70.2	Confident	2 Å²	2	43.9 Å²	43.9	1%	0.012	24%	0.239	C	C	.	.	H	α-helix	trans	-61.4	-46.5	176	-58.7	0	0	0	0	111.6	F1671 W1719 I1746 I1758 R1777 Y1779 L1784 A1785	F1671-T1781 HydrophobicContact CE1-CG2 4.17Å; W1719-T1781 WeakPolarHBondContact CZ2-OG1 3.36Å; W1719-T1781 PolarHBondContact NE1-OG1 2.85Å; W1719-T1781 VanDerWaalsContact NE1-OG1 3.08Å; I1746-T1781 HydrophobicContact CG2-CG2 4.27Å; I1758-T1781 HydrophobicContact CG2-CG2 4.47Å; R1777-T1781 PolarHBondContact O-N 3.22Å; R1777-T1781 PolarHBondContact O-OG1 3.21Å; Y1779-T1781 PolarHBondContact O-N 3.45Å; T1781-L1784 PolarHBondContact O-N 3.33Å; T1781-A1785 WeakPolarHBondContact O-CB 3.37Å; T1781-A1785 PolarHBondContact O-N 3.18Å
1782	R	86.2	Confident	72.5	Confident	12 Å²	12	38.4 Å²	38.4	5%	0.045	21%	0.21	C	C	.	.	H	α-helix	trans	-64.9	-43.3	-179	-74.2	-164.2	-55.8	-80.5	0.5	112.6	D1624 V1625 G1778 Y1779 A1785 V1786 L1792	D1624-R1782 IonicContact OD1-NH2 3.52Å; V1625-R1782 HydrophobicContact CG2-CB 3.6Å; V1625-R1782 HydrophobicContact CG2-CG 4.25Å; G1778-R1782 WeakPolarHBondContact O-CG 3.46Å; G1778-R1782 PolarHBondContact O-N 2.93Å; G1778-R1782 VanDerWaalsContact O-N 3.1Å; G1778-R1782 PolarHBondContact O-NH1 3.21Å; Y1779-R1782 PolarHBondContact O-N 2.71Å; R1782-A1785 PolarHBondContact O-N 3.11Å; R1782-V1786 PolarHBondContact O-N 3.32Å; R1782-L1792 HydrophobicContact CB-CD2 3.78Å; R1782-L1792 HydrophobicContact CG-CD1 4.1Å; R1782-L1792 HydrophobicContact CG-CD2 3.87Å
1783	R	83.6	Confident	74.8	Confident	12 Å²	12	35.4 Å²	35.4	5%	0.045	19%	0.188	C	C	.	.	H	α-helix	trans	-62.4	-48.3	175.1	-80.3	-50.7	-44	-173.8	5.5	111.6	F1617 L1620 A1623 Y1779 A1785 V1786 D1787	F1617-R1783 PolarHBondContact O-NH1 3.5Å; F1617-R1783 PolarHBondContact O-NH2 3.24Å; L1620-R1783 PolarHBondContact O-NH1 2.94Å; A1623-R1783 VanDerWaalsContact O-CD 3.22Å; A1623-R1783 WeakPolarHBondContact O-CD 3.33Å; A1623-R1783 PolarHBondContact O-NH1 3.41Å; Y1779-R1783 HydrophobicContact CD2-CG 4.28Å; Y1779-R1783 HydrophobicContact CE1-CG 4.06Å; Y1779-R1783 HydrophobicContact CE2-CG 3.73Å; Y1779-R1783 PolarHBondContact O-N 3.21Å; R1783-A1785 VanDerWaalsContact C-N 3.28Å; R1783-A1785 PolarHBondContact O-N 2.85Å; R1783-V1786 PolarHBondContact O-N 3.09Å; R1783-D1787 IonicContact CZ-OD1 3.3Å; R1783-D1787 IonicContact NE-OD1 3.01Å; R1783-D1787 IonicContact NH2-OD1 3.01Å; R1783-D1787 PolarHBondContact NH2-OD1 2.87Å; R1783-D1787 WeakPolarHBondContact O-CB 3.47Å; R1783-D1787 PolarHBondContact O-N 3.08Å
1784	L	79.7	Confident	76.8	Confident	32 Å²	32	36.2 Å²	36.2	17%	0.168	19%	0.191	C	C	.	.	H	α-helix	trans	-61.1	-40	-179.5	-171.9	62.6	0	0	0	111.2	Q1747 L1750 Q1780 T1781 D1787 T1788	Q1747-L1784 HydrophobicContact CB-CD2 4.23Å; Q1747-L1784 HydrophobicContact CG-CD2 3.9Å; L1750-L1784 HydrophobicContact CB-CD2 3.78Å; L1750-L1784 HydrophobicContact CB-CG 3.94Å; L1750-L1784 HydrophobicContact CD1-CB 3.95Å; L1750-L1784 HydrophobicContact CD1-CD2 3.65Å; L1750-L1784 HydrophobicContact CD1-CG 3.77Å; L1750-L1784 HydrophobicContact CG-CD2 4.35Å; L1750-L1784 HydrophobicContact CG-CG 4.43Å; Q1780-L1784 VanDerWaalsContact O-CB 3.28Å; Q1780-L1784 WeakPolarHBondContact O-CB 3.34Å; Q1780-L1784 PolarHBondContact O-N 2.9Å; T1781-L1784 PolarHBondContact O-N 3.33Å; L1784-D1787 PolarHBondContact O-N 3.34Å; L1784-T1788 HydrophobicContact CD1-CG2 4.15Å; L1784-T1788 HydrophobicContact CG-CG2 4.47Å; L1784-T1788 WeakPolarHBondContact O-CB 3.45Å; L1784-T1788 WeakPolarHBondContact O-CG2 3.21Å; L1784-T1788 PolarHBondContact O-N 2.99Å; L1784-T1788 PolarHBondContact O-OG1 2.88Å
1785	A	83.7	Confident	78.8	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-57.1	-50.3	174.5	0	0	0	0	0	112.6	L1750 I1758 T1781 R1782 R1783 T1788 N1789 V1790 L1792	L1750-A1785 HydrophobicContact CD2-CB 4.33Å; I1758-A1785 HydrophobicContact CD1-CB 3.73Å; T1781-A1785 WeakPolarHBondContact O-CB 3.37Å; T1781-A1785 PolarHBondContact O-N 3.18Å; R1782-A1785 PolarHBondContact O-N 3.11Å; R1783-A1785 VanDerWaalsContact C-N 3.28Å; R1783-A1785 PolarHBondContact O-N 2.85Å; A1785-T1788 PolarHBondContact O-N 3.44Å; A1785-T1788 PolarHBondContact O-OG1 2.76Å; A1785-N1789 PolarHBondContact O-N 3.26Å; A1785-V1790 HydrophobicContact CB-CB 4.49Å; A1785-V1790 PolarHBondContact O-N 3.35Å; A1785-L1792 HydrophobicContact CB-CB 4.43Å
1786	V	82.3	Confident	80.5	Confident	22 Å²	22	31.3 Å²	31.3	13%	0.133	16%	0.162	C	C	.	.	H	α-helix	trans	-63.6	-43.9	177.2	169.6	0	0	0	0	111.6	F1617 A1618 V1625 R1782 R1783 T1788 N1789 L1792	F1617-V1786 HydrophobicContact CB-CG1 3.73Å; A1618-V1786 HydrophobicContact CB-CG1 4.13Å; V1625-V1786 HydrophobicContact CG1-CG2 4Å; R1782-V1786 PolarHBondContact O-N 3.32Å; R1783-V1786 PolarHBondContact O-N 3.09Å; V1786-T1788 PolarHBondContact O-N 3.09Å; V1786-N1789 PolarHBondContact O-N 3.31Å; V1786-N1789 VanDerWaalsContact O-N 3.1Å; V1786-L1792 HydrophobicContact CG2-CD2 4.04Å
1787	D	76	Confident	81.9	Confident	50 Å²	50	31.4 Å²	31.4	27%	0.267	16%	0.158	S	C	.	.	H	α-helix	trans	-65.4	-28	-178.4	-64.3	-20.8	0	0	0	112.1	Q842 R1783 L1784	Q842-D1787 PolarHBondContact NE2-O 3.28Å; R1783-D1787 IonicContact CZ-OD1 3.3Å; R1783-D1787 IonicContact NE-OD1 3.01Å; R1783-D1787 IonicContact NH2-OD1 3.01Å; R1783-D1787 PolarHBondContact NH2-OD1 2.87Å; R1783-D1787 WeakPolarHBondContact O-CB 3.47Å; R1783-D1787 PolarHBondContact O-N 3.08Å; L1784-D1787 PolarHBondContact O-N 3.34Å
1788	T	73.8	Confident	83	Confident	6 Å²	6	25.9 Å²	25.9	4%	0.037	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.8	7.5	175.7	59.6	0	0	0	0	114.3	L1784 A1785 V1786 V1790	L1784-T1788 HydrophobicContact CD1-CG2 4.15Å; L1784-T1788 HydrophobicContact CG-CG2 4.47Å; L1784-T1788 WeakPolarHBondContact O-CB 3.45Å; L1784-T1788 WeakPolarHBondContact O-CG2 3.21Å; L1784-T1788 PolarHBondContact O-N 2.99Å; L1784-T1788 PolarHBondContact O-OG1 2.88Å; A1785-T1788 PolarHBondContact O-N 3.44Å; A1785-T1788 PolarHBondContact O-OG1 2.76Å; V1786-T1788 PolarHBondContact O-N 3.09Å; T1788-V1790 VanDerWaalsContact C-N 3.29Å; T1788-V1790 PolarHBondContact O-N 3.38Å; T1788-V1790 WeakPolarHBondContact OG1-CG2 3.19Å
1789	N	75.8	Confident	84	Confident	57 Å²	57	24.9 Å²	24.9	31%	0.305	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.1	36.9	-175.8	-70.3	-21.8	0	0	0	114.5	A1785 V1786	A1785-N1789 PolarHBondContact O-N 3.26Å; V1786-N1789 PolarHBondContact O-N 3.31Å; V1786-N1789 VanDerWaalsContact O-N 3.1Å
1790	V	82.6	Confident	84.8	Confident	11 Å²	11	27 Å²	27	7%	0.067	14%	0.138	C	C	.	.			trans	-93	126.6	172.9	176.8	0	0	0	0	109.2	L1750 F1755 I1758 A1785 T1788 L1792	L1750-V1790 HydrophobicContact CD2-CB 4.14Å; L1750-V1790 HydrophobicContact CD2-CG1 4.36Å; L1750-V1790 HydrophobicContact CD2-CG2 3.9Å; F1755-V1790 HydrophobicContact CB-CG1 4.33Å; F1755-V1790 WeakPolarHBondContact O-CG1 3.34Å; I1758-V1790 HydrophobicContact CD1-CG1 3.93Å; I1758-V1790 HydrophobicContact CG1-CG1 3.99Å; A1785-V1790 HydrophobicContact CB-CB 4.49Å; A1785-V1790 PolarHBondContact O-N 3.35Å; T1788-V1790 VanDerWaalsContact C-N 3.29Å; T1788-V1790 PolarHBondContact O-N 3.38Å; T1788-V1790 WeakPolarHBondContact OG1-CG2 3.19Å; V1790-L1792 PolarHBondContact O-N 3.07Å
1791	P	87	Confident	85.6	Confident	22 Å²	22	24 Å²	24	14%	0.143	12%	0.124	C	C	.	.			trans	-52.1	130	177.8	-28.4	34.7	0	0	0	113	L1656 S1756 L1757 I1758	L1656-P1791 HydrophobicContact CD2-CB 4.15Å; L1656-P1791 HydrophobicContact CD2-CG 3.96Å; S1756-P1791 WeakPolarHBondContact O-CD 3.5Å; S1756-P1791 WeakPolarHBondContact O-CG 3.46Å; L1757-P1791 HydrophobicContact CD1-CB 4Å; I1758-P1791 PolarHBondContact N-O 3.15Å
1792	L	89.1	Confident	86.2	Confident	40 Å²	40	24.1 Å²	24.1	21%	0.209	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	129.7	-174.6	173.7	65.7	0	0	0	111.1	V1625 I1758 R1782 A1785 V1786 V1790 T1794	V1625-L1792 HydrophobicContact CG2-CD2 3.8Å; I1758-L1792 HydrophobicContact CB-CD1 4.12Å; I1758-L1792 HydrophobicContact CG2-CD1 3.68Å; I1758-L1792 WeakPolarHBondContact O-CA 3.44Å; R1782-L1792 HydrophobicContact CB-CD2 3.78Å; R1782-L1792 HydrophobicContact CG-CD1 4.1Å; R1782-L1792 HydrophobicContact CG-CD2 3.87Å; A1785-L1792 HydrophobicContact CB-CB 4.43Å; V1786-L1792 HydrophobicContact CG2-CD2 4.04Å; V1790-L1792 PolarHBondContact O-N 3.07Å; L1792-T1794 HydrophobicContact CD1-CG2 4.34Å; L1792-T1794 HydrophobicContact CD2-CG2 4.03Å; L1792-T1794 HydrophobicContact CG-CG2 3.99Å
1793	L	90.4	Very high	86.4	Confident	13 Å²	13	23.5 Å²	23.5	7%	0.068	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	127.1	170.6	-68.1	173.1	0	0	0	111	L1757 I1758 V1759 S1760 L1798 A1799 L1802	L1757-L1793 HydrophobicContact CD1-CD1 4.2Å; L1757-L1793 HydrophobicContact CD1-CG 4.28Å; I1758-L1793 PolarHBondContact O-N 2.8Å; V1759-L1793 HydrophobicContact CG2-CB 4.42Å; V1759-L1793 HydrophobicContact CG2-CD1 4.3Å; S1760-L1793 PolarHBondContact N-O 2.92Å; L1793-L1798 HydrophobicContact CD2-CB 4.31Å; L1793-A1799 HydrophobicContact CD1-CB 4.05Å; L1793-L1802 HydrophobicContact CD1-CB 4.33Å; L1793-L1802 HydrophobicContact CD1-CD2 3.57Å; L1793-L1802 HydrophobicContact CG-CD2 4.43Å
1794	T	87.7	Confident	86.7	Confident	36 Å²	36	25.1 Å²	25.1	22%	0.221	13%	0.131	C	C	.	.			trans	-114.4	-11.9	-178.2	55.5	0	0	0	0	113.8	L1626 L1761 L1792	L1626-T1794 HydrophobicContact CD2-CG2 4.12Å; L1761-T1794 WeakPolarHBondContact CD2-O 3.24Å; L1792-T1794 HydrophobicContact CD1-CG2 4.34Å; L1792-T1794 HydrophobicContact CD2-CG2 4.03Å; L1792-T1794 HydrophobicContact CG-CG2 3.99Å
1795	D	89.8	Confident	87.1	Confident	28 Å²	28	23.6 Å²	23.6	15%	0.15	12%	0.123	C	C	.	.			trans	-108.5	140.7	178.3	-177.6	-94.1	0	0	0	112.4	K1797 L1798 A1799	D1795-K1797 WeakPolarHBondContact OD1-CA 3.4Å; D1795-K1797 VanDerWaalsContact OD1-CB 3.26Å; D1795-K1797 WeakPolarHBondContact OD1-CB 3.3Å; D1795-K1797 PolarHBondContact OD1-N 3.02Å; D1795-L1798 HydrophobicContact CB-CB 4.31Å; D1795-L1798 HydrophobicContact CB-CD1 4.1Å; D1795-L1798 HydrophobicContact CB-CG 4.12Å; D1795-L1798 PolarHBondContact OD1-N 2.83Å; D1795-L1798 VanDerWaalsContact OD1-N 3.1Å; D1795-A1799 WeakPolarHBondContact O-CB 3.4Å; D1795-A1799 PolarHBondContact O-N 3.35Å; D1795-A1799 VanDerWaalsContact O-N 3.14Å
1796	V	88.6	Confident	87.2	Confident	8 Å²	8	23.7 Å²	23.7	5%	0.048	12%	0.123	C	C	.	.	H	α-helix	trans	-72.9	-33.3	-175.8	66.9	0	0	0	0	112.7	E1682 M1683 L1761 K1800	E1682-V1796 HydrophobicContact CG-CG2 4.28Å; M1683-V1796 HydrophobicContact CG-CG2 3.96Å; M1683-V1796 HydrophobicContact SD-CG2 3.94Å; L1761-V1796 HydrophobicContact CD1-CB 4.06Å; L1761-V1796 HydrophobicContact CD1-CG2 4.04Å; L1761-V1796 HydrophobicContact CD2-CB 4.47Å; V1796-K1800 HydrophobicContact CG2-CD 4.39Å; V1796-K1800 WeakPolarHBondContact O-CD 3.5Å; V1796-K1800 VanDerWaalsContact O-CG 3.28Å; V1796-K1800 WeakPolarHBondContact O-CG 3.34Å; V1796-K1800 PolarHBondContact O-N 2.79Å
1797	K	91	Very high	87.2	Confident	55 Å²	55	24.6 Å²	24.6	24%	0.239	12%	0.124	C	C	.	.	H	α-helix	trans	-73.2	-44.5	179.7	-57.4	-59.8	-175.6	-173.2	0	110.6	V1478 N1480 E1682 D1795 A1799 K1800 L1801	V1478-K1797 HydrophobicContact CG1-CB 4.15Å; V1478-K1797 VanDerWaalsContact O-CB 3.24Å; V1478-K1797 WeakPolarHBondContact O-CB 3.48Å; V1478-K1797 WeakPolarHBondContact O-CG 3.47Å; N1480-K1797 VanDerWaalsContact OD1-CE 3.27Å; N1480-K1797 WeakPolarHBondContact OD1-CE 3.5Å; E1682-K1797 IonicContact OE1-NZ 2.76Å; E1682-K1797 PolarHBondContact OE1-NZ 3.44Å; D1795-K1797 WeakPolarHBondContact OD1-CA 3.4Å; D1795-K1797 VanDerWaalsContact OD1-CB 3.26Å; D1795-K1797 WeakPolarHBondContact OD1-CB 3.3Å; D1795-K1797 PolarHBondContact OD1-N 3.02Å; K1797-A1799 VanDerWaalsContact C-N 3.33Å; K1797-A1799 PolarHBondContact O-N 2.91Å; K1797-K1800 PolarHBondContact O-N 3.12Å; K1797-L1801 PolarHBondContact O-N 2.97Å
1798	L	92.2	Very high	87.3	Confident	18 Å²	18	27.5 Å²	27.5	9%	0.094	13%	0.132	C	C	.	.	H	α-helix	trans	-60.6	-42.7	174.4	-63.7	-177.4	0	0	0	112.1	V1478 E1479 T1489 Y1648 L1793 D1795 K1800 L1801 L1802	V1478-L1798 HydrophobicContact CB-CD2 4.15Å; V1478-L1798 HydrophobicContact CG1-CD2 3.84Å; E1479-L1798 HydrophobicContact CG-CD1 4.19Å; E1479-L1798 HydrophobicContact CG-CD2 4.3Å; E1479-L1798 HydrophobicContact CG-CG 4.07Å; E1479-L1798 WeakPolarHBondContact OE1-CD1 3.49Å; E1479-L1798 WeakPolarHBondContact OE1-CD2 3.44Å; T1489-L1798 WeakPolarHBondContact OG1-CD2 3.47Å; Y1648-L1798 HydrophobicContact CE2-CD2 4.35Å; L1793-L1798 HydrophobicContact CD2-CB 4.31Å; D1795-L1798 HydrophobicContact CB-CB 4.31Å; D1795-L1798 HydrophobicContact CB-CD1 4.1Å; D1795-L1798 HydrophobicContact CB-CG 4.12Å; D1795-L1798 PolarHBondContact OD1-N 2.83Å; D1795-L1798 VanDerWaalsContact OD1-N 3.1Å; L1798-K1800 VanDerWaalsContact C-N 3.32Å; L1798-K1800 PolarHBondContact O-N 3.17Å; L1798-L1801 PolarHBondContact O-N 3.2Å; L1798-L1802 WeakPolarHBondContact O-CB 3.35Å; L1798-L1802 PolarHBondContact O-N 3Å
1799	A	91.5	Very high	87.2	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-60.9	-42	177.4	0	0	0	0	0	112.4	M1683 V1759 L1793 D1795 K1797 I1803	M1683-A1799 HydrophobicContact CE-CB 3.72Å; M1683-A1799 HydrophobicContact SD-CB 3.99Å; V1759-A1799 HydrophobicContact CG1-CB 4.08Å; L1793-A1799 HydrophobicContact CD1-CB 4.05Å; D1795-A1799 WeakPolarHBondContact O-CB 3.4Å; D1795-A1799 PolarHBondContact O-N 3.35Å; D1795-A1799 VanDerWaalsContact O-N 3.14Å; K1797-A1799 VanDerWaalsContact C-N 3.33Å; K1797-A1799 PolarHBondContact O-N 2.91Å; A1799-I1803 WeakPolarHBondContact O-CB 3.37Å; A1799-I1803 VanDerWaalsContact O-CD1 3.3Å; A1799-I1803 WeakPolarHBondContact O-CD1 3.47Å; A1799-I1803 WeakPolarHBondContact O-CG1 3.36Å; A1799-I1803 PolarHBondContact O-N 3.48Å; A1799-I1803 VanDerWaalsContact O-N 3.08Å
1800	K	93.6	Very high	86.8	Confident	64 Å²	64	30.5 Å²	30.5	28%	0.278	14%	0.14	S	C	.	.	H	α-helix	trans	-65.2	-44.8	175.4	-70	165.7	65.4	-172.6	0	112	E1682 M1683 V1796 K1797 L1798 I1803 E1804	E1682-K1800 HydrophobicContact CG-CD 4Å; E1682-K1800 IonicContact OE1-NZ 3.25Å; E1682-K1800 PolarHBondContact OE1-NZ 2.93Å; M1683-K1800 HydrophobicContact SD-CD 4.46Å; M1683-K1800 HydrophobicContact SD-CG 3.75Å; V1796-K1800 HydrophobicContact CG2-CD 4.39Å; V1796-K1800 WeakPolarHBondContact O-CD 3.5Å; V1796-K1800 VanDerWaalsContact O-CG 3.28Å; V1796-K1800 WeakPolarHBondContact O-CG 3.34Å; V1796-K1800 PolarHBondContact O-N 2.79Å; K1797-K1800 PolarHBondContact O-N 3.12Å; L1798-K1800 VanDerWaalsContact C-N 3.32Å; L1798-K1800 PolarHBondContact O-N 3.17Å; K1800-I1803 PolarHBondContact O-N 2.86Å; K1800-E1804 VanDerWaalsContact O-CB 3.27Å; K1800-E1804 WeakPolarHBondContact O-CB 3.43Å; K1800-E1804 PolarHBondContact O-N 3.26Å
1801	L	92.4	Very high	85.5	Confident	15 Å²	15	35.4 Å²	35.4	8%	0.079	16%	0.161	C	C	.	.	H	α-helix	trans	-62.5	-46.2	-179.8	-177.8	61.9	0	0	0	111.2	V1478 Y1645 Y1648 K1797 L1798 E1804 A1805	V1478-L1801 HydrophobicContact CG1-CB 4.46Å; V1478-L1801 HydrophobicContact CG1-CD2 3.8Å; V1478-L1801 HydrophobicContact CG2-CD2 3.94Å; Y1645-L1801 HydrophobicContact CD1-CD1 3.66Å; Y1645-L1801 HydrophobicContact CE1-CD1 3.72Å; Y1648-L1801 HydrophobicContact CD1-CB 4.44Å; Y1648-L1801 HydrophobicContact CD1-CD2 3.73Å; Y1648-L1801 HydrophobicContact CD1-CG 3.57Å; Y1648-L1801 HydrophobicContact CD2-CD2 3.67Å; Y1648-L1801 HydrophobicContact CD2-CG 4.44Å; Y1648-L1801 HydrophobicContact CE1-CB 4.14Å; Y1648-L1801 HydrophobicContact CE1-CD2 3.89Å; Y1648-L1801 HydrophobicContact CE1-CG 3.74Å; Y1648-L1801 HydrophobicContact CE2-CD2 3.84Å; Y1648-L1801 HydrophobicContact CG-CD2 3.59Å; Y1648-L1801 HydrophobicContact CG-CG 3.93Å; K1797-L1801 PolarHBondContact O-N 2.97Å; L1798-L1801 PolarHBondContact O-N 3.2Å; L1801-E1804 PolarHBondContact O-N 3.37Å; L1801-A1805 VanDerWaalsContact O-CB 3.28Å; L1801-A1805 WeakPolarHBondContact O-CB 3.39Å; L1801-A1805 PolarHBondContact O-N 3.35Å
1802	L	92.5	Very high	83.8	Confident	5 Å²	5	37.1 Å²	37.1	3%	0.026	18%	0.184	C	C	.	.	H	α-helix	trans	-61	-48.2	177.7	-177	64.5	0	0	0	111.4	Y1648 L1649 L1663 L1757 L1793 L1798 A1805 L1806	Y1648-L1802 HydrophobicContact CE1-CB 3.9Å; Y1648-L1802 HydrophobicContact CE1-CD1 4.16Å; L1649-L1802 HydrophobicContact CD2-CD1 4.05Å; L1663-L1802 HydrophobicContact CD2-CD1 4.43Å; L1757-L1802 HydrophobicContact CD1-CD2 4.43Å; L1757-L1802 HydrophobicContact CD2-CD2 4.28Å; L1793-L1802 HydrophobicContact CD1-CB 4.33Å; L1793-L1802 HydrophobicContact CD1-CD2 3.57Å; L1793-L1802 HydrophobicContact CG-CD2 4.43Å; L1798-L1802 WeakPolarHBondContact O-CB 3.35Å; L1798-L1802 PolarHBondContact O-N 3Å; L1802-A1805 PolarHBondContact O-N 3.27Å; L1802-L1806 HydrophobicContact CD1-CD1 4.32Å; L1802-L1806 HydrophobicContact CD1-CG 4.28Å; L1802-L1806 HydrophobicContact CD2-CD1 4.45Å; L1802-L1806 HydrophobicContact CG-CD1 3.93Å; L1802-L1806 HydrophobicContact CG-CG 4.31Å; L1802-L1806 WeakPolarHBondContact O-CB 3.49Å; L1802-L1806 VanDerWaalsContact O-CG 3.26Å; L1802-L1806 WeakPolarHBondContact O-CG 3.28Å; L1802-L1806 PolarHBondContact O-N 2.91Å
1803	I	92.2	Very high	81.7	Confident	0 Å²	0	41 Å²	41	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-65.9	-42.5	-177.1	-67.1	166.3	0	0	0	111.2	M1683 S1686 Q1689 L1690 A1799 K1800 A1805 L1806 Y1807	M1683-I1803 HydrophobicContact CE-CD1 3.82Å; S1686-I1803 VanDerWaalsContact O-CG2 3.29Å; S1686-I1803 WeakPolarHBondContact O-CG2 3.49Å; Q1689-I1803 HydrophobicContact CB-CG2 3.91Å; L1690-I1803 HydrophobicContact CD1-CD1 3.67Å; L1690-I1803 HydrophobicContact CD1-CG1 4.08Å; L1690-I1803 HydrophobicContact CD2-CG1 4.02Å; L1690-I1803 HydrophobicContact CD2-CG2 4.11Å; L1690-I1803 HydrophobicContact CG-CD1 4.02Å; L1690-I1803 HydrophobicContact CG-CG1 4Å; L1690-I1803 HydrophobicContact CG-CG2 3.86Å; A1799-I1803 WeakPolarHBondContact O-CB 3.37Å; A1799-I1803 VanDerWaalsContact O-CD1 3.3Å; A1799-I1803 WeakPolarHBondContact O-CD1 3.47Å; A1799-I1803 WeakPolarHBondContact O-CG1 3.36Å; A1799-I1803 PolarHBondContact O-N 3.48Å; A1799-I1803 VanDerWaalsContact O-N 3.08Å; K1800-I1803 PolarHBondContact O-N 2.86Å; I1803-A1805 VanDerWaalsContact C-N 3.31Å; I1803-A1805 PolarHBondContact O-N 3.24Å; I1803-L1806 PolarHBondContact O-N 3.47Å; I1803-Y1807 VanDerWaalsContact O-CB 3.28Å; I1803-Y1807 WeakPolarHBondContact O-CB 3.39Å; I1803-Y1807 PolarHBondContact O-N 3.46Å
1804	E	89.8	Confident	79.1	Confident	46 Å²	46	43.5 Å²	43.5	22%	0.215	22%	0.219	C	C	.	.	H	α-helix	trans	-61.4	-42.3	175.3	178.3	65.4	-161.7	0	0	110.9	Y1645 Q1689 K1800 L1801 Y1807 R1808	Y1645-E1804 HydrophobicContact CD1-CB 4.37Å; Y1645-E1804 HydrophobicContact CD1-CG 3.83Å; Y1645-E1804 HydrophobicContact CE1-CB 4.18Å; Y1645-E1804 HydrophobicContact CE1-CG 3.45Å; Y1645-E1804 VanDerWaalsContact CE1-CG 3.45Å; Q1689-E1804 PolarHBondContact NE2-OE2 2.68Å; K1800-E1804 VanDerWaalsContact O-CB 3.27Å; K1800-E1804 WeakPolarHBondContact O-CB 3.43Å; K1800-E1804 PolarHBondContact O-N 3.26Å; L1801-E1804 PolarHBondContact O-N 3.37Å; E1804-Y1807 WeakPolarHBondContact O-CB 3.33Å; E1804-Y1807 PolarHBondContact O-N 2.88Å; E1804-R1808 WeakPolarHBondContact O-CG 3.41Å; E1804-R1808 PolarHBondContact O-N 3.26Å; E1804-R1808 IonicContact OE1-CZ 3.35Å; E1804-R1808 IonicContact OE1-NE 3Å; E1804-R1808 PolarHBondContact OE1-NE 2.76Å; E1804-R1808 IonicContact OE1-NH2 2.66Å; E1804-R1808 PolarHBondContact OE1-NH2 2.8Å
1805	A	87.4	Confident	76.4	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-67.2	-46.1	178.6	0	0	0	0	0	111.8	Y1645 L1649 L1801 L1802 I1803 Y1807 R1808 Y1809	Y1645-A1805 HydrophobicContact CD1-CB 4.3Å; L1649-A1805 HydrophobicContact CD1-CB 3.79Å; L1649-A1805 WeakPolarHBondContact CD1-O 3.39Å; L1649-A1805 HydrophobicContact CD2-CB 4.04Å; L1649-A1805 HydrophobicContact CG-CB 3.56Å; L1801-A1805 VanDerWaalsContact O-CB 3.28Å; L1801-A1805 WeakPolarHBondContact O-CB 3.39Å; L1801-A1805 PolarHBondContact O-N 3.35Å; L1802-A1805 PolarHBondContact O-N 3.27Å; I1803-A1805 VanDerWaalsContact C-N 3.31Å; I1803-A1805 PolarHBondContact O-N 3.24Å; A1805-Y1807 VanDerWaalsContact C-N 3.26Å; A1805-Y1807 PolarHBondContact O-N 2.88Å; A1805-R1808 PolarHBondContact O-N 3.02Å; A1805-Y1809 WeakPolarHBondContact O-CB 3.37Å; A1805-Y1809 PolarHBondContact O-N 3.45Å
1806	L	85.2	Confident	73.5	Confident	1 Å²	1	49.5 Å²	49.5	1%	0.005	26%	0.261	C	S	.	.	H	α-helix	trans	-57.7	-41	173	-71.3	171.1	0	0	0	111.3	L1649 P1664 L1693 L1802 I1803 Y1809 F1810	L1649-L1806 HydrophobicContact CD2-CD2 3.86Å; L1649-L1806 HydrophobicContact CD2-CG 4.13Å; P1664-L1806 HydrophobicContact CG-CD1 4.03Å; L1693-L1806 HydrophobicContact CD1-CB 4.49Å; L1802-L1806 HydrophobicContact CD1-CD1 4.32Å; L1802-L1806 HydrophobicContact CD1-CG 4.28Å; L1802-L1806 HydrophobicContact CD2-CD1 4.45Å; L1802-L1806 HydrophobicContact CG-CD1 3.93Å; L1802-L1806 HydrophobicContact CG-CG 4.31Å; L1802-L1806 WeakPolarHBondContact O-CB 3.49Å; L1802-L1806 VanDerWaalsContact O-CG 3.26Å; L1802-L1806 WeakPolarHBondContact O-CG 3.28Å; L1802-L1806 PolarHBondContact O-N 2.91Å; I1803-L1806 PolarHBondContact O-N 3.47Å; L1806-Y1809 PolarHBondContact O-N 2.65Å; L1806-F1810 HydrophobicContact CB-CD2 4.38Å; L1806-F1810 HydrophobicContact CD2-CD2 4.19Å; L1806-F1810 HydrophobicContact CD2-CE2 3.73Å; L1806-F1810 WeakPolarHBondContact O-CB 3.32Å; L1806-F1810 VanDerWaalsContact O-CD2 3.31Å; L1806-F1810 WeakPolarHBondContact O-CD2 3.42Å; L1806-F1810 PolarHBondContact O-N 2.93Å
1807	Y	83.5	Confident	70.7	Confident	41 Å²	41	59 Å²	59	16%	0.161	30%	0.302	C	S	.	.	H	α-helix	trans	-61.5	-51.4	175.9	-174.1	-102.9	0	0	0	111.1	Q1689 Q1692 L1693 I1803 E1804 A1805 Y1809 F1810 H1811	Q1689-Y1807 HydrophobicContact CB-CD2 3.71Å; Q1689-Y1807 HydrophobicContact CB-CE2 4.23Å; Q1689-Y1807 HydrophobicContact CB-CG 4.08Å; Q1689-Y1807 HydrophobicContact CG-CD1 4.35Å; Q1689-Y1807 HydrophobicContact CG-CD2 3.86Å; Q1689-Y1807 HydrophobicContact CG-CE2 4.1Å; Q1689-Y1807 HydrophobicContact CG-CG 3.97Å; Q1692-Y1807 HydrophobicContact CB-CE2 4.31Å; Q1692-Y1807 PolarHBondContact OE1-OH 2.96Å; L1693-Y1807 HydrophobicContact CD1-CD2 4.28Å; L1693-Y1807 HydrophobicContact CD2-CD2 4.05Å; L1693-Y1807 HydrophobicContact CG-CD2 3.97Å; I1803-Y1807 VanDerWaalsContact O-CB 3.28Å; I1803-Y1807 WeakPolarHBondContact O-CB 3.39Å; I1803-Y1807 PolarHBondContact O-N 3.46Å; E1804-Y1807 WeakPolarHBondContact O-CB 3.33Å; E1804-Y1807 PolarHBondContact O-N 2.88Å; A1805-Y1807 VanDerWaalsContact C-N 3.26Å; A1805-Y1807 PolarHBondContact O-N 2.88Å; Y1807-Y1809 PolarHBondContact O-N 2.95Å; Y1807-F1810 PolarHBondContact O-N 2.82Å; Y1807-H1811 HydrophobicContact CD1-CB 4.39Å; Y1807-H1811 HydrophobicContact CD2-CB 4.36Å; Y1807-H1811 HydrophobicContact CE1-CB 4.36Å; Y1807-H1811 AromaticContact CE1-CD2 3.3Å; Y1807-H1811 WeakPolarHBondContact CE1-CD2 3.27Å; Y1807-H1811 HydrophobicContact CE2-CB 4.33Å; Y1807-H1811 AromaticContact CE2-CD2 3.87Å; Y1807-H1811 HydrophobicContact CG-CB 4.41Å; Y1807-H1811 AromaticContact CZ-CD2 3.17Å; Y1807-H1811 AromaticContact CZ-CG 3.81Å; Y1807-H1811 AromaticContact CZ-NE2 3.56Å; Y1807-H1811 WeakPolarHBondContact O-CA 3.45Å; Y1807-H1811 WeakPolarHBondContact O-CB 3.31Å; Y1807-H1811 PolarHBondContact O-N 2.87Å; Y1807-H1811 PolarHBondContact OH-CD2 2.98Å; Y1807-H1811 VanDerWaalsContact OH-CD2 3.25Å; Y1807-H1811 PolarHBondContact OH-NE2 3.31Å; Y1807-H1811 VanDerWaalsContact OH-NE2 3.09Å
1808	R	76.4	Confident	67.8	Low	111 Å²	111	62.3 Å²	62.3	42%	0.419	33%	0.327	S	S	.	.	H	α-helix	trans	-59.3	-35.8	176.9	-70.1	174.5	-176.2	-134.6	-3	113.1	D1643 E1804 A1805	D1643-R1808 IonicContact OD2-NH1 3.35Å; E1804-R1808 WeakPolarHBondContact O-CG 3.41Å; E1804-R1808 PolarHBondContact O-N 3.26Å; E1804-R1808 IonicContact OE1-CZ 3.35Å; E1804-R1808 IonicContact OE1-NE 3Å; E1804-R1808 PolarHBondContact OE1-NE 2.76Å; E1804-R1808 IonicContact OE1-NH2 2.66Å; E1804-R1808 PolarHBondContact OE1-NH2 2.8Å; A1805-R1808 PolarHBondContact O-N 3.02Å
1809	Y	71.8	Confident	64.6	Low	96 Å²	96	68 Å²	68	38%	0.376	36%	0.356	S	S	.	.	H	α-helix	trans	-74.8	-41.9	-178.9	-171.6	-97.6	0	0	0	113.2	L1649 A1805 L1806 Y1807	L1649-Y1809 HydrophobicContact CD1-CD2 4.26Å; L1649-Y1809 HydrophobicContact CD1-CG 4.08Å; A1805-Y1809 WeakPolarHBondContact O-CB 3.37Å; A1805-Y1809 PolarHBondContact O-N 3.45Å; L1806-Y1809 PolarHBondContact O-N 2.65Å; Y1807-Y1809 PolarHBondContact O-N 2.95Å
1810	F	68.8	Low	61.5	Low	30 Å²	30	74 Å²	74	13%	0.132	39%	0.387	C	S	.	.	H	α-helix	trans	-100.1	-15.9	-175.3	-69.6	-65	0	0	0	114.7	P1666 L1693 L1806 Y1807 G1812 Q1813	P1666-F1810 HydrophobicContact CG-CB 3.91Å; P1666-F1810 HydrophobicContact CG-CD1 3.69Å; P1666-F1810 HydrophobicContact CG-CD2 3.94Å; P1666-F1810 HydrophobicContact CG-CE1 4.16Å; P1666-F1810 HydrophobicContact CG-CE2 4.38Å; P1666-F1810 HydrophobicContact CG-CG 3.58Å; P1666-F1810 HydrophobicContact CG-CZ 4.48Å; L1693-F1810 HydrophobicContact CD2-CB 3.77Å; L1806-F1810 HydrophobicContact CB-CD2 4.38Å; L1806-F1810 HydrophobicContact CD2-CD2 4.19Å; L1806-F1810 HydrophobicContact CD2-CE2 3.73Å; L1806-F1810 WeakPolarHBondContact O-CB 3.32Å; L1806-F1810 VanDerWaalsContact O-CD2 3.31Å; L1806-F1810 WeakPolarHBondContact O-CD2 3.42Å; L1806-F1810 PolarHBondContact O-N 2.93Å; Y1807-F1810 PolarHBondContact O-N 2.82Å; F1810-G1812 PolarHBondContact O-N 3.2Å; F1810-Q1813 PolarHBondContact O-N 3.31Å; F1810-Q1813 VanDerWaalsContact O-N 3.09Å
1811	H	54.8	Low	58.3	Low	114 Å²	114	81.5 Å²	81.5	53%	0.528	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	121.9	-178.2	-172.3	15.3	0	0	0	110.3	Y1807	Y1807-H1811 HydrophobicContact CD1-CB 4.39Å; Y1807-H1811 HydrophobicContact CD2-CB 4.36Å; Y1807-H1811 HydrophobicContact CE1-CB 4.36Å; Y1807-H1811 AromaticContact CE1-CD2 3.3Å; Y1807-H1811 WeakPolarHBondContact CE1-CD2 3.27Å; Y1807-H1811 HydrophobicContact CE2-CB 4.33Å; Y1807-H1811 AromaticContact CE2-CD2 3.87Å; Y1807-H1811 HydrophobicContact CG-CB 4.41Å; Y1807-H1811 AromaticContact CZ-CD2 3.17Å; Y1807-H1811 AromaticContact CZ-CG 3.81Å; Y1807-H1811 AromaticContact CZ-NE2 3.56Å; Y1807-H1811 WeakPolarHBondContact O-CA 3.45Å; Y1807-H1811 WeakPolarHBondContact O-CB 3.31Å; Y1807-H1811 PolarHBondContact O-N 2.87Å; Y1807-H1811 PolarHBondContact OH-CD2 2.98Å; Y1807-H1811 VanDerWaalsContact OH-CD2 3.25Å; Y1807-H1811 PolarHBondContact OH-NE2 3.31Å; Y1807-H1811 VanDerWaalsContact OH-NE2 3.09Å
1812	G	49.9	Very low	55.2	Low	59 Å²	59	84.1 Å²	84.1	61%	0.608	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	117.3	-26.5	-172.9	0	0	0	0	0	112.7	F1810	F1810-G1812 PolarHBondContact O-N 3.2Å
1813	Q	45.5	Very low	52.3	Low	121 Å²	121	93.3 Å²	93.3	57%	0.565	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	-30.4	178	-64.4	-169.1	0	0	0	113.7	F1810 A1815	F1810-Q1813 PolarHBondContact O-N 3.31Å; F1810-Q1813 VanDerWaalsContact O-N 3.09Å; Q1813-A1815 PolarHBondContact O-N 3.45Å
1814	S	35.4	Very low	49.4	Very low	65 Å²	65	99.7 Å²	99.7	46%	0.455	52%	0.516	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-6.4	-172.4	-143.1	0	0	0	0	114.4	L1693 N1816	L1693-S1814 PolarHBondContact O-OG 3.48Å; S1814-N1816 PolarHBondContact O-N 3.09Å
1815	A	32.5	Very low	46.4	Very low	81 Å²	81	105 Å²	105	67%	0.669	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74	-12.5	-171.5	0	0	0	0	0	115.7	Q1813	Q1813-A1815 PolarHBondContact O-N 3.45Å
1816	N	29.1	Very low	43.6	Very low	109 Å²	109	113.4 Å²	113.4	58%	0.583	59%	0.586	S	S	*	*			trans	-145.8	85.8	-176	-84.6	-32.7	0	0	0	113	S1814	S1814-N1816 PolarHBondContact O-N 3.09Å
1817	K	29.7	Very low	40.7	Very low	207 Å²	207	122.3 Å²	122.3	90%	0.9	62%	0.621	S	S	*	*	S	Bend	trans	-106.3	-1.6	159.3	-105.3	-176.7	180	176.6	0	113.5
1818	T	28.6	Very low	37.9	Very low	125 Å²	125	125.7 Å²	125.7	77%	0.767	64%	0.642	S	S	*	*	S	Bend	trans	-134.9	63	-175.2	23.9	0	0	0	0	110.3
1819	L	24.9	Very low	35.5	Very low	137 Å²	137	124.9 Å²	124.9	72%	0.717	65%	0.649	S	S	*	*	S	Bend	trans	-167.6	123.3	155.3	-99.7	135.3	0	0	0	111.2
1820	I	27.2	Very low	33.3	Very low	127 Å²	127	129.1 Å²	129.1	65%	0.651	67%	0.665	S	S	*	*			trans	79	96.5	153.1	-45	168.8	0	0	0	117	S1822	I1820-S1822 VanDerWaalsContact C-N 3.33Å; I1820-S1822 VanDerWaalsContact CG2-CB 3.46Å; I1820-S1822 WeakPolarHBondContact CG2-OG 3.41Å; I1820-S1822 PolarHBondContact O-N 2.9Å
1821	K	26.7	Very low	31.2	Very low	221 Å²	221	136 Å²	136	96%	0.961	70%	0.695	S	S	*	*			trans	-66.5	91.7	145.4	-69.5	177.1	175.9	-179.1	0	107.6
1822	S	28.1	Very low	30	Very low	71 Å²	71	135.3 Å²	135.3	50%	0.497	69%	0.692	S	S	.	*			trans	-129.3	127.1	165	54.6	0	0	0	0	107.6	I1820 D1824	I1820-S1822 VanDerWaalsContact C-N 3.33Å; I1820-S1822 VanDerWaalsContact CG2-CB 3.46Å; I1820-S1822 WeakPolarHBondContact CG2-OG 3.41Å; I1820-S1822 PolarHBondContact O-N 2.9Å; S1822-D1824 PolarHBondContact O-N 3.38Å
1823	E	30.3	Very low	29.1	Very low	198 Å²	198	134.2 Å²	134.2	93%	0.925	68%	0.675	S	S	*	*			trans	-73.1	27.1	-174.1	-68.2	177.1	145.5	0	0	113.7
1824	D	31.8	Very low	28.6	Very low	133 Å²	133	132 Å²	132	71%	0.711	66%	0.663	S	S	*	*			trans	-101.7	118.2	-173.8	-65.4	-39.8	0	0	0	111.9	S1822 E1826	S1822-D1824 PolarHBondContact O-N 3.38Å; D1824-E1826 VanDerWaalsContact C-N 3.26Å; D1824-E1826 PolarHBondContact O-N 2.78Å
1825	N	27.2	Very low	28.6	Very low	159 Å²	159	133.3 Å²	133.3	85%	0.85	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.7	18.7	-160.4	-104.4	-28.2	0	0	0	117.7
1826	E	29.1	Very low	28.7	Very low	176 Å²	176	132.6 Å²	132.6	82%	0.822	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.2	-6.6	-171.8	-78.5	-174.4	159.3	0	0	116.2	D1824	D1824-E1826 VanDerWaalsContact C-N 3.26Å; D1824-E1826 PolarHBondContact O-N 2.78Å
1827	Y	23.9	Very low	29.2	Very low	188 Å²	188	134.4 Å²	134.4	74%	0.737	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.7	1.1	-177.7	-128.8	-95	0	0	0	115.7	V1829	Y1827-V1829 VanDerWaalsContact C-N 3.34Å
1828	N	24.4	Very low	29.7	Very low	112 Å²	112	126.9 Å²	126.9	60%	0.599	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.7	-10.8	178.8	-92.5	-32.8	0	0	0	114.6	Y1830 K1831	N1828-Y1830 VanDerWaalsContact C-N 3.32Å; N1828-Y1830 PolarHBondContact O-N 2.84Å; N1828-K1831 PolarHBondContact O-N 3.5Å
1829	V	26.5	Very low	30.5	Very low	94 Å²	94	124 Å²	124	57%	0.57	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.4	-29.7	-176.8	-177	0	0	0	0	112.2	Y1827 Q1832	Y1827-V1829 VanDerWaalsContact C-N 3.34Å; V1829-Q1832 PolarHBondContact O-N 3.22Å
1830	Y	24.4	Very low	31.9	Very low	185 Å²	185	119.1 Å²	119.1	73%	0.725	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.6	-23.1	-179.5	-82	-78.6	0	0	0	114.5	N1828 Q1832	N1828-Y1830 VanDerWaalsContact C-N 3.32Å; N1828-Y1830 PolarHBondContact O-N 2.84Å; Y1830-Q1832 VanDerWaalsContact C-N 3.29Å
1831	K	26.1	Very low	33.6	Very low	175 Å²	175	113.6 Å²	113.6	76%	0.761	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	-21.8	168.7	-90.5	-174.6	177.5	175	0	112.5	N1828 S1833	N1828-K1831 PolarHBondContact O-N 3.5Å; K1831-S1833 VanDerWaalsContact C-N 3.34Å
1832	Q	29.4	Very low	35.6	Very low	99 Å²	99	106.9 Å²	106.9	46%	0.463	52%	0.516	S	S	.	.	S	Bend	trans	-81.3	-9.8	177.9	-71.6	174.7	-42.3	0	0	113.5	D740 V1829 Y1830 F1834	D740-Q1832 PolarHBondContact OD1-NE2 3.45Å; D740-Q1832 VanDerWaalsContact OD1-NE2 3.15Å; V1829-Q1832 PolarHBondContact O-N 3.22Å; Y1830-Q1832 VanDerWaalsContact C-N 3.29Å; Q1832-F1834 PolarHBondContact O-N 2.81Å
1833	S	31.4	Very low	37.8	Very low	35 Å²	35	104.6 Å²	104.6	25%	0.245	50%	0.5	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84	-7.6	-160.1	172.1	0	0	0	0	117.9	K1831 R1837	K1831-S1833 VanDerWaalsContact C-N 3.34Å; S1833-R1837 PolarHBondContact O-NE 3.09Å; S1833-R1837 PolarHBondContact OG-NH2 3.33Å
1834	F	35.1	Very low	40	Very low	74 Å²	74	95.7 Å²	95.7	33%	0.325	46%	0.458	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.7	-36.3	-179.7	-124.5	-81.4	0	0	0	114.6	Q1832 H1836 R1837	Q1832-F1834 PolarHBondContact O-N 2.81Å; F1834-H1836 PolarHBondContact O-N 3.48Å; F1834-R1837 VanDerWaalsContact CE2-CZ 3.42Å; F1834-R1837 VanDerWaalsContact CE2-NH2 3.28Å; F1834-R1837 PolarHBondContact O-N 2.66Å; F1834-R1837 VanDerWaalsContact O-N 3.09Å
1835	L	33.5	Very low	42.1	Very low	94 Å²	94	90.5 Å²	90.5	49%	0.492	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-25.7	176.2	-85.8	160.7	0	0	0	112.7
1836	H	35.2	Very low	43.9	Very low	66 Å²	66	85.8 Å²	85.8	31%	0.306	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-15.7	175	-91.1	-132.4	0	0	0	114.5	F1834 L1838 G2204	F1834-H1836 PolarHBondContact O-N 3.48Å; H1836-L1838 VanDerWaalsContact C-N 3.28Å; H1836-L1838 PolarHBondContact O-N 3.3Å; H1836-G2204 PolarHBondContact CE1-O 3.17Å; H1836-G2204 PolarHBondContact ND1-O 2.63Å
1837	R	39.7	Very low	45.8	Very low	147 Å²	147	79 Å²	79	56%	0.555	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-5.6	-175.7	-100.2	-170.5	-76.6	-172.1	-8.9	115.1	S1833 F1834	S1833-R1837 PolarHBondContact O-NE 3.09Å; S1833-R1837 PolarHBondContact OG-NH2 3.33Å; F1834-R1837 VanDerWaalsContact CE2-CZ 3.42Å; F1834-R1837 VanDerWaalsContact CE2-NH2 3.28Å; F1834-R1837 PolarHBondContact O-N 2.66Å; F1834-R1837 VanDerWaalsContact O-N 3.09Å
1838	L	39.8	Very low	48.2	Very low	49 Å²	49	76.1 Å²	76.1	26%	0.257	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.8	31.3	-172	-63.4	174.8	0	0	0	113.6	E1646 H1836	E1646-L1838 WeakPolarHBondContact OE1-CD1 3.4Å; E1646-L1838 WeakPolarHBondContact OE1-CD2 3.41Å; H1836-L1838 VanDerWaalsContact C-N 3.28Å; H1836-L1838 PolarHBondContact O-N 3.3Å
1839	L	46	Very low	50.7	Low	64 Å²	64	72.7 Å²	72.7	34%	0.335	36%	0.357	S	S	.	.			trans	-115.3	139.7	169.4	-80.5	162.4	0	0	0	109.2	L1841	L1839-L1841 HydrophobicContact CD2-CB 4.04Å; L1839-L1841 HydrophobicContact CD2-CD1 3.73Å; L1839-L1841 HydrophobicContact CD2-CG 3.47Å; L1839-L1841 VanDerWaalsContact CD2-CG 3.47Å
1840	P	53.6	Low	53.1	Low	34 Å²	34	70 Å²	70	22%	0.221	34%	0.339	C	S	.	.	S	Bend	cis	-78.6	143.3	19.2	10.7	-1.5	0	0	0	113.9	H1842 Y1851	P1840-H1842 PolarHBondContact O-CD2 3.02Å; P1840-H1842 VanDerWaalsContact O-CD2 3.29Å; P1840-H1842 PolarHBondContact O-N 3.39Å; P1840-Y1851 HydrophobicContact CB-CE1 3.68Å; P1840-Y1851 HydrophobicContact CB-CE2 4.28Å; P1840-Y1851 WeakPolarHBondContact CB-OH 3.43Å; P1840-Y1851 HydrophobicContact CG-CD1 4.06Å; P1840-Y1851 HydrophobicContact CG-CD2 4.34Å; P1840-Y1851 HydrophobicContact CG-CE1 3.68Å; P1840-Y1851 HydrophobicContact CG-CE2 3.98Å; P1840-Y1851 HydrophobicContact CG-CG 4.39Å
1841	L	63.7	Low	55.7	Low	11 Å²	11	64 Å²	64	6%	0.058	32%	0.316	C	S	.	.			trans	-66.4	108.4	173.8	-81.6	155.9	0	0	0	105.6	F692 L694 V704 A707 L1839 S1843	F692-L1841 HydrophobicContact CD1-CB 4.14Å; F692-L1841 HydrophobicContact CE1-CB 3.82Å; L694-L1841 HydrophobicContact CD1-CD2 3.71Å; V704-L1841 HydrophobicContact CG2-CD1 4.22Å; A707-L1841 HydrophobicContact CB-CD1 3.88Å; L1839-L1841 HydrophobicContact CD2-CB 4.04Å; L1839-L1841 HydrophobicContact CD2-CD1 3.73Å; L1839-L1841 HydrophobicContact CD2-CG 3.47Å; L1839-L1841 VanDerWaalsContact CD2-CG 3.47Å; L1841-S1843 PolarHBondContact O-N 2.61Å
1842	H	67.9	Low	58.5	Low	81 Å²	81	55.6 Å²	55.6	38%	0.375	28%	0.279	S	S	.	.			trans	-61.1	128.5	178.8	-69.7	177.9	0	0	0	109.6	P1840	P1840-H1842 PolarHBondContact O-CD2 3.02Å; P1840-H1842 VanDerWaalsContact O-CD2 3.29Å; P1840-H1842 PolarHBondContact O-N 3.39Å
1843	S	74.9	Confident	61.2	Low	23 Å²	23	50.9 Å²	50.9	16%	0.161	26%	0.257	C	S	.	.			trans	-132	153.5	175.3	63.2	0	0	0	0	110.8	I691 L1841	I691-S1843 CarbonylContact O-C 3.51Å; I691-S1843 WeakPolarHBondContact O-CA 3.45Å; I691-S1843 VanDerWaalsContact O-CB 3.24Å; I691-S1843 WeakPolarHBondContact O-CB 3.36Å; L1841-S1843 PolarHBondContact O-N 2.61Å
1844	I	77.4	Confident	63.7	Low	10 Å²	10	49.4 Å²	49.4	5%	0.051	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	127.9	163.2	-56.1	170.5	0	0	0	106.2	E685 K690 I691 L693 K1551 F1640	E685-I1844 HydrophobicContact CB-CG2 4Å; E685-I1844 HydrophobicContact CG-CG2 4.21Å; K690-I1844 WeakPolarHBondContact CA-O 3.27Å; I691-I1844 HydrophobicContact CB-CB 4.19Å; I691-I1844 PolarHBondContact N-O 2.88Å; I691-I1844 PolarHBondContact O-N 3.2Å; L693-I1844 HydrophobicContact CD1-CD1 3.85Å; L693-I1844 HydrophobicContact CG-CD1 4.3Å; K1551-I1844 HydrophobicContact CB-CD1 4.14Å; K1551-I1844 HydrophobicContact CG-CD1 4.4Å; F1640-I1844 HydrophobicContact CE2-CD1 4.35Å; F1640-I1844 HydrophobicContact CE2-CG1 4.21Å; F1640-I1844 HydrophobicContact CZ-CD1 4.5Å
1845	T	74.4	Confident	66.4	Low	25 Å²	25	45.9 Å²	45.9	15%	0.153	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	143.7	-178.2	179.8	0	0	0	0	109.3	D689 S1847 I1849	D689-T1845 WeakPolarHBondContact O-CB 3.34Å; D689-T1845 PolarHBondContact O-OG1 2.64Å; T1845-S1847 PolarHBondContact OG1-N 2.95Å; T1845-I1849 HydrophobicContact CG2-CG1 3.85Å
1846	S	66.1	Low	69.4	Low	60 Å²	60	41.4 Å²	41.4	42%	0.42	21%	0.208	S	C	.	.	S	Bend	trans	-76.4	-11.5	173.6	52.1	0	0	0	0	113.2	E685	E685-S1846 WeakPolarHBondContact OE1-CA 3.38Å
1847	S	69.8	Low	72.3	Confident	33 Å²	33	38.2 Å²	38.2	23%	0.231	19%	0.194	C	C	.	.	S	Bend	trans	-85.3	145.6	177.9	-70.1	0	0	0	0	111.6	T1845 I1849 D2157 S2159	T1845-S1847 PolarHBondContact OG1-N 2.95Å; S1847-I1849 PolarHBondContact O-N 2.99Å; S1847-D2157 WeakPolarHBondContact CB-OD2 3.44Å; S1847-D2157 PolarHBondContact OG-OD2 3.3Å; S1847-S2159 WeakPolarHBondContact CA-OG 3.18Å; S1847-S2159 VanDerWaalsContact CB-OG 3.29Å; S1847-S2159 WeakPolarHBondContact CB-OG 3.18Å
1848	Q	73.3	Confident	75	Confident	127 Å²	127	31.2 Å²	31.2	59%	0.593	17%	0.167	S	C	*	.			trans	-78.6	87.3	170.4	-72.3	-171.7	-11.9	0	0	110.1	M2158 S2159	Q1848-M2158 HydrophobicContact CB-CB 4Å; Q1848-M2158 VanDerWaalsContact O-CB 3.32Å; Q1848-M2158 WeakPolarHBondContact O-CB 3.26Å; Q1848-M2158 PolarHBondContact O-N 3.28Å; Q1848-S2159 PolarHBondContact N-OG 2.82Å
1849	I	77.4	Confident	77.7	Confident	40 Å²	40	28.9 Å²	28.9	21%	0.205	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	131.2	178.5	-56.6	-55.6	0	0	0	110.6	T1845 S1847 Y1851 E2155 V2156 D2157	T1845-I1849 HydrophobicContact CG2-CG1 3.85Å; S1847-I1849 PolarHBondContact O-N 2.99Å; I1849-Y1851 HydrophobicContact CG2-CE2 4.11Å; I1849-E2155 HydrophobicContact CG2-CG 3.55Å; I1849-V2156 WeakPolarHBondContact CA-O 3.35Å; I1849-D2157 HydrophobicContact CD1-CB 3.73Å
1850	I	76.4	Confident	80.1	Confident	38 Å²	38	25.9 Å²	25.9	20%	0.195	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	147	168.4	65.8	173.4	0	0	0	110.3	L1852 L2104 M2107 L2114 V2156 M2158	I1850-L1852 HydrophobicContact CD1-CD2 4.21Å; I1850-L1852 HydrophobicContact CD1-CG 4.36Å; I1850-L2104 HydrophobicContact CD1-CD2 3.8Å; I1850-M2107 HydrophobicContact CD1-CE 4.36Å; I1850-L2114 HydrophobicContact CD1-CD1 4.49Å; I1850-V2156 HydrophobicContact CG1-CB 3.94Å; I1850-V2156 PolarHBondContact N-O 3.22Å; I1850-V2156 PolarHBondContact O-N 3.46Å; I1850-M2158 HydrophobicContact CD1-CG 3.88Å; I1850-M2158 HydrophobicContact CD1-SD 3.76Å; I1850-M2158 HydrophobicContact CG1-CG 4Å; I1850-M2158 HydrophobicContact CG1-SD 4.4Å; I1850-M2158 HydrophobicContact CG2-CG 4.08Å
1851	Y	78	Confident	82	Confident	58 Å²	58	24.9 Å²	24.9	23%	0.227	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	131.9	170.5	-66.4	-82.4	0	0	0	109.2	P1840 I1849 Y2149 W2153 V2154 E2155	P1840-Y1851 HydrophobicContact CB-CE1 3.68Å; P1840-Y1851 HydrophobicContact CB-CE2 4.28Å; P1840-Y1851 WeakPolarHBondContact CB-OH 3.43Å; P1840-Y1851 HydrophobicContact CG-CD1 4.06Å; P1840-Y1851 HydrophobicContact CG-CD2 4.34Å; P1840-Y1851 HydrophobicContact CG-CE1 3.68Å; P1840-Y1851 HydrophobicContact CG-CE2 3.98Å; P1840-Y1851 HydrophobicContact CG-CG 4.39Å; I1849-Y1851 HydrophobicContact CG2-CE2 4.11Å; Y1851-Y2149 WeakPolarHBondContact O-CE2 3.25Å; Y1851-W2153 HydrophobicContact CD1-CD2 4.46Å; Y1851-W2153 AromaticContact CD1-CE3 3.87Å; Y1851-W2153 HydrophobicContact CD1-CE3 3.87Å; Y1851-W2153 HydrophobicContact CD1-CZ3 4.17Å; Y1851-W2153 HydrophobicContact CE1-CE3 4.08Å; Y1851-W2153 HydrophobicContact CE1-CH2 4.42Å; Y1851-W2153 AromaticContact CE1-CZ3 3.89Å; Y1851-W2153 HydrophobicContact CE1-CZ3 3.89Å; Y1851-V2154 WeakPolarHBondContact CA-O 3.41Å; Y1851-E2155 HydrophobicContact CD1-CB 4.14Å; Y1851-E2155 HydrophobicContact CD1-CG 4.46Å; Y1851-E2155 HydrophobicContact CE1-CB 3.83Å; Y1851-E2155 HydrophobicContact CE1-CG 3.86Å; Y1851-E2155 WeakPolarHBondContact CE1-OE2 3.16Å; Y1851-E2155 VanDerWaalsContact CZ-OE2 3.27Å; Y1851-E2155 PolarHBondContact OH-OE2 2.92Å
1852	L	85.9	Confident	83.5	Confident	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	152.9	175.2	-61.8	176.6	0	0	0	109.1	I1850 L1855 L2100 L2114 I2118 W2153 V2154 V2156	I1850-L1852 HydrophobicContact CD1-CD2 4.21Å; I1850-L1852 HydrophobicContact CD1-CG 4.36Å; L1852-L1855 HydrophobicContact CB-CD2 4.31Å; L1852-L1855 HydrophobicContact CD1-CD1 4.12Å; L1852-L2100 HydrophobicContact CD1-CD1 3.76Å; L1852-L2100 HydrophobicContact CD1-CD2 4.1Å; L1852-L2100 HydrophobicContact CD1-CG 4.46Å; L1852-L2114 HydrophobicContact CD2-CD1 3.62Å; L1852-I2118 HydrophobicContact CD2-CD1 4.45Å; L1852-I2118 HydrophobicContact CD2-CG1 4.31Å; L1852-W2153 CarbonylContact O-C 3.34Å; L1852-W2153 WeakPolarHBondContact O-CA 3.35Å; L1852-W2153 WeakPolarHBondContact O-CB 3.4Å; L1852-V2154 HydrophobicContact CB-CB 4.3Å; L1852-V2154 PolarHBondContact N-O 3.31Å; L1852-V2154 PolarHBondContact O-N 3.16Å; L1852-V2156 HydrophobicContact CD1-CG2 3.95Å
1853	P	84.9	Confident	84.6	Confident	0 Å²	0	21.2 Å²	21.2	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	172.8	171.8	26.9	-30.9	0	0	0	111.1	L1855 I2118 Y2122 Y2149	P1853-L1855 HydrophobicContact CG-CD2 4.17Å; P1853-L1855 WeakPolarHBondContact O-CD2 3.44Å; P1853-L1855 WeakPolarHBondContact O-CG 3.4Å; P1853-L1855 PolarHBondContact O-N 3.24Å; P1853-I2118 HydrophobicContact CG-CG1 4.39Å; P1853-I2118 HydrophobicContact CG-CG2 3.9Å; P1853-Y2122 HydrophobicContact CB-CD1 3.74Å; P1853-Y2122 HydrophobicContact CB-CD2 3.66Å; P1853-Y2122 HydrophobicContact CB-CE1 3.81Å; P1853-Y2122 HydrophobicContact CB-CE2 3.66Å; P1853-Y2122 HydrophobicContact CB-CG 3.68Å; P1853-Y2122 HydrophobicContact CG-CD1 3.63Å; P1853-Y2122 HydrophobicContact CG-CD2 3.96Å; P1853-Y2122 HydrophobicContact CG-CE1 4.19Å; P1853-Y2122 HydrophobicContact CG-CE2 4.43Å; P1853-Y2122 HydrophobicContact CG-CG 3.52Å; P1853-Y2149 HydrophobicContact CB-CD1 3.52Å; P1853-Y2149 HydrophobicContact CB-CE1 3.99Å; P1853-Y2149 HydrophobicContact CB-CG 3.82Å; P1853-Y2149 HydrophobicContact CG-CD1 4.05Å; P1853-Y2149 HydrophobicContact CG-CE1 3.99Å
1854	G	83.9	Confident	85.5	Confident	3 Å²	3	20.1 Å²	20.1	3%	0.031	11%	0.106	C	C	.	.			trans	-58.9	94.7	169.4	0	0	0	0	0	113.1	Y2122 T2152	G1854-Y2122 WeakPolarHBondContact O-CD2 3.33Å; G1854-T2152 PolarHBondContact N-O 3.02Å
1855	L	93.7	Very high	86.2	Confident	0 Å²	0	20.2 Å²	20.2	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	145.8	-174.4	-51.4	178.5	0	0	0	112.1	L1852 P1853 G1884 I1885 V1886 T1887 L2100 L2121	L1852-L1855 HydrophobicContact CB-CD2 4.31Å; L1852-L1855 HydrophobicContact CD1-CD1 4.12Å; P1853-L1855 HydrophobicContact CG-CD2 4.17Å; P1853-L1855 WeakPolarHBondContact O-CD2 3.44Å; P1853-L1855 WeakPolarHBondContact O-CG 3.4Å; P1853-L1855 PolarHBondContact O-N 3.24Å; L1855-G1884 WeakPolarHBondContact CB-O 3.35Å; L1855-I1885 HydrophobicContact CB-CD1 3.85Å; L1855-V1886 PolarHBondContact O-N 3.02Å; L1855-T1887 PolarHBondContact O-N 3.5Å; L1855-L2100 HydrophobicContact CD1-CD1 3.7Å; L1855-L2100 HydrophobicContact CD1-CD2 3.78Å; L1855-L2100 HydrophobicContact CD1-CG 4.3Å; L1855-L2121 HydrophobicContact CB-CB 4.35Å; L1855-L2121 HydrophobicContact CD1-CD1 4.15Å; L1855-L2121 HydrophobicContact CD2-CB 3.9Å
1856	I	94.7	Very high	86.9	Confident	0 Å²	0	20.6 Å²	20.6	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	130.5	-175.9	-53.8	177.4	0	0	0	109.1	I1858 T1887 L2121 P2125 Y2126 I2131	I1856-I1858 HydrophobicContact CG2-CG2 3.85Å; I1856-T1887 WeakPolarHBondContact CA-O 3.38Å; I1856-T1887 HydrophobicContact CG2-CG2 4.42Å; I1856-L2121 PolarHBondContact N-O 2.83Å; I1856-P2125 HydrophobicContact CB-CB 3.9Å; I1856-P2125 HydrophobicContact CB-CG 4.36Å; I1856-P2125 HydrophobicContact CD1-CB 3.94Å; I1856-P2125 HydrophobicContact CG1-CB 4.45Å; I1856-P2125 HydrophobicContact CG2-CB 4.02Å; I1856-Y2126 HydrophobicContact CD1-CD1 4.25Å; I1856-Y2126 HydrophobicContact CD1-CD2 3.56Å; I1856-Y2126 HydrophobicContact CD1-CE1 4.14Å; I1856-Y2126 HydrophobicContact CD1-CE2 3.37Å; I1856-Y2126 HydrophobicContact CD1-CG 4Å; I1856-Y2126 HydrophobicContact CG1-CE2 4.36Å; I1856-I2131 HydrophobicContact CD1-CD1 4.15Å; I1856-I2131 HydrophobicContact CG2-CD1 4.43Å
1857	D	97.2	Very high	88.1	Confident	0 Å²	0	19.4 Å²	19.4	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	113.6	164.9	-166.4	-24.1	0	0	0	109.7	H1859 V1860 I1885 T1887 I1888 L1889 A2072 T2073 L2096 M2099	D1857-H1859 VanDerWaalsContact C-N 3.27Å; D1857-H1859 PolarHBondContact O-N 3.41Å; D1857-H1859 PolarHBondContact OD1-N 3.32Å; D1857-H1859 VanDerWaalsContact OD1-N 3.14Å; D1857-V1860 HydrophobicContact CB-CG2 3.94Å; D1857-I1885 HydrophobicContact CB-CD1 4.49Å; D1857-I1885 HydrophobicContact CB-CG1 4.38Å; D1857-I1885 HydrophobicContact CB-CG2 3.73Å; D1857-T1887 PolarHBondContact N-O 3Å; D1857-I1888 CarbonylContact O-C 3.54Å; D1857-I1888 WeakPolarHBondContact O-CA 3.46Å; D1857-L1889 PolarHBondContact O-N 3.33Å; D1857-A2072 WeakPolarHBondContact OD1-CA 3.4Å; D1857-T2073 PolarHBondContact OD1-N 3.06Å; D1857-T2073 VanDerWaalsContact OD1-N 3.11Å; D1857-T2073 WeakPolarHBondContact OD2-CB 3.46Å; D1857-T2073 WeakPolarHBondContact OD2-CG2 3.46Å; D1857-T2073 PolarHBondContact OD2-N 2.78Å; D1857-T2073 PolarHBondContact OD2-OG1 3.22Å; D1857-L2096 HydrophobicContact CB-CD2 4.27Å; D1857-L2096 WeakPolarHBondContact OD2-CD2 3.41Å; D1857-M2099 HydrophobicContact CB-CE 4.45Å
1858	I	95.3	Very high	89.2	Confident	0 Å²	0	21 Å²	21	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	0.9	-172.1	59.9	169.5	0	0	0	113.8	I1856 L1889 Y1922 H2000 E2026 C2070 A2072 P2125 F2129	I1856-I1858 HydrophobicContact CG2-CG2 3.85Å; I1858-L1889 HydrophobicContact CB-CD1 3.84Å; I1858-L1889 HydrophobicContact CB-CG 4.38Å; I1858-L1889 HydrophobicContact CG2-CD1 3.78Å; I1858-L1889 HydrophobicContact CG2-CG 4.38Å; I1858-L1889 WeakPolarHBondContact O-CB 3.3Å; I1858-Y1922 WeakPolarHBondContact O-CE2 3.34Å; I1858-Y1922 PolarHBondContact O-OH 2.91Å; I1858-Y1922 VanDerWaalsContact O-OH 3.08Å; I1858-H2000 WeakPolarHBondContact CD1-NE2 3.47Å; I1858-E2026 HydrophobicContact CD1-CB 4.21Å; I1858-E2026 WeakPolarHBondContact CD1-OE2 3.32Å; I1858-E2026 WeakPolarHBondContact CG1-OE2 3.21Å; I1858-C2070 HydrophobicContact CD1-CB 3.42Å; I1858-C2070 VanDerWaalsContact CD1-CB 3.42Å; I1858-C2070 HydrophobicContact CG1-CB 4.38Å; I1858-A2072 HydrophobicContact CD1-CB 4.4Å; I1858-A2072 HydrophobicContact CG1-CB 3.64Å; I1858-P2125 HydrophobicContact CG2-CB 3.67Å; I1858-P2125 HydrophobicContact CG2-CG 4.06Å; I1858-F2129 HydrophobicContact CB-CD2 4.38Å; I1858-F2129 HydrophobicContact CB-CE2 3.85Å; I1858-F2129 HydrophobicContact CB-CZ 4.3Å; I1858-F2129 HydrophobicContact CD1-CE2 3.57Å; I1858-F2129 HydrophobicContact CD1-CZ 4.01Å; I1858-F2129 HydrophobicContact CG1-CE2 4.32Å; I1858-F2129 HydrophobicContact CG2-CD2 3.88Å; I1858-F2129 HydrophobicContact CG2-CE2 3.75Å
1859	H	96.3	Very high	90	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	90.2	-175.3	-155.6	145.5	0	0	0	113.1	D1857 M1891 K1944 H2003 E2026 A2072 D2074 H2075	D1857-H1859 VanDerWaalsContact C-N 3.27Å; D1857-H1859 PolarHBondContact O-N 3.41Å; D1857-H1859 PolarHBondContact OD1-N 3.32Å; D1857-H1859 VanDerWaalsContact OD1-N 3.14Å; H1859-M1891 HydrophobicContact CB-CE 3.99Å; H1859-M1891 WeakPolarHBondContact CD2-CE 3.36Å; H1859-M1891 WeakPolarHBondContact CD2-CG 3.45Å; H1859-M1891 VanDerWaalsContact CG-CE 3.42Å; H1859-K1944 PolarHBondContact CE1-NZ 2.95Å; H1859-K1944 PolarHBondContact NE2-NZ 2.9Å; H1859-H2003 AromaticContact CE1-CD2 3.77Å; H1859-E2026 IonicContact CE1-OE1 2.79Å; H1859-E2026 IonicContact CG-OE1 3.13Å; H1859-E2026 IonicContact ND1-OE1 2.77Å; H1859-E2026 PolarHBondContact ND1-OE1 2.76Å; H1859-A2072 HydrophobicContact CB-CB 3.63Å; H1859-D2074 IonicContact CD2-OD1 2.8Å; H1859-D2074 PolarHBondContact CD2-OD1 3.16Å; H1859-D2074 IonicContact NE2-OD1 3.79Å; H1859-D2074 PolarHBondContact NE2-OD1 3.13Å; H1859-D2074 WeakPolarHBondContact O-CA 3.26Å; H1859-D2074 PolarHBondContact O-N 2.6Å; H1859-H2075 PolarHBondContact O-N 2.98Å
1860	V	97	Very high	90.6	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	130	-177.3	179.5	0	0	0	0	111.6	D1857 T1862 V1876 I1888 L1889 A1890 M1891 H2075 L2096	D1857-V1860 HydrophobicContact CB-CG2 3.94Å; V1860-T1862 HydrophobicContact CG1-CG2 4.38Å; V1860-V1876 HydrophobicContact CG1-CG2 3.62Å; V1860-I1888 HydrophobicContact CB-CB 4.23Å; V1860-I1888 HydrophobicContact CG1-CD1 4.17Å; V1860-I1888 HydrophobicContact CG2-CB 3.92Å; V1860-I1888 HydrophobicContact CG2-CG2 3.98Å; V1860-L1889 PolarHBondContact N-O 3.25Å; V1860-A1890 CarbonylContact O-C 3.56Å; V1860-A1890 WeakPolarHBondContact O-CA 3.42Å; V1860-M1891 PolarHBondContact O-N 3.39Å; V1860-H2075 HydrophobicContact CG1-CB 4.35Å; V1860-L2096 HydrophobicContact CG1-CD1 3.99Å; V1860-L2096 HydrophobicContact CG2-CD2 3.98Å
1861	H	94.8	Very high	91.5	Very high	14 Å²	14	18.3 Å²	18.3	7%	0.065	9%	0.089	C	C	.	.			trans	-92.8	106	171.3	-67.6	-81.7	0	0	0	111	D2074 H2075 P2077	H1861-D2074 IonicContact CD2-OD1 3.3Å; H1861-D2074 IonicContact NE2-OD1 2.75Å; H1861-D2074 PolarHBondContact NE2-OD1 3.24Å; H1861-H2075 VanDerWaalsContact CB-O 3.29Å; H1861-H2075 WeakPolarHBondContact CB-O 3.46Å; H1861-H2075 PolarHBondContact N-O 3.46Å; H1861-P2077 WeakPolarHBondContact O-CD 3.31Å
1862	T	93.8	Very high	92.2	Very high	1 Å²	1	16.5 Å²	16.5	1%	0.006	8%	0.083	C	C	.	.			trans	-82.2	-17.2	-177.1	58.6	0	0	0	0	114.4	V1860 D1864 E1871 W1873 V1876 I1888 A1890	V1860-T1862 HydrophobicContact CG1-CG2 4.38Å; T1862-D1864 PolarHBondContact O-N 3.23Å; T1862-E1871 CarbonylContact O-C 3.5Å; T1862-W1873 HydrophobicContact CG2-CD2 4.38Å; T1862-W1873 HydrophobicContact CG2-CE3 4.17Å; T1862-W1873 HydrophobicContact CG2-CH2 3.93Å; T1862-W1873 HydrophobicContact CG2-CZ2 4.11Å; T1862-W1873 HydrophobicContact CG2-CZ3 3.95Å; T1862-V1876 HydrophobicContact CG2-CG1 3.96Å; T1862-I1888 HydrophobicContact CG2-CD1 4.04Å; T1862-A1890 HydrophobicContact CG2-CB 3.7Å
1863	R	92.4	Very high	92.7	Very high	14 Å²	14	16.5 Å²	16.5	5%	0.053	8%	0.083	C	C	.	.			trans	59.9	4.9	177.1	-55.2	-61.4	-173.7	-165.2	-4.2	116.4	P1865 M1867 K1870 E1871 P2077	R1863-P1865 CarbonylContact O-C 3.56Å; R1863-M1867 HydrophobicContact CB-CB 3.88Å; R1863-M1867 CarbonylContact O-C 3.07Å; R1863-M1867 VanDerWaalsContact O-CA 3.28Å; R1863-M1867 WeakPolarHBondContact O-CA 3.41Å; R1863-M1867 WeakPolarHBondContact O-CB 3.47Å; R1863-M1867 PolarHBondContact O-N 3.46Å; R1863-K1870 HydrophobicContact CB-CB 4.45Å; R1863-K1870 HydrophobicContact CG-CB 4.18Å; R1863-E1871 HydrophobicContact CB-CB 4.14Å; R1863-E1871 WeakPolarHBondContact CB-O 3.25Å; R1863-E1871 HydrophobicContact CG-CB 4.11Å; R1863-P2077 HydrophobicContact CG-CG 4.02Å
1864	D	93	Very high	93.2	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.092	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.9	114.6	176.6	-178.2	-16.6	0	0	0	109.2	T1862 E1868 W1873 N1910 K1914	T1862-D1864 PolarHBondContact O-N 3.23Å; D1864-E1868 HydrophobicContact CB-CG 4.01Å; D1864-W1873 HydrophobicContact CB-CG 4.48Å; D1864-W1873 VanDerWaalsContact CG-CD1 3.47Å; D1864-W1873 PolarHBondContact O-NE1 2.84Å; D1864-W1873 VanDerWaalsContact O-NE1 3.13Å; D1864-N1910 PolarHBondContact OD1-ND2 2.78Å; D1864-K1914 IonicContact OD1-NZ 2.88Å; D1864-K1914 IonicContact OD2-NZ 3.26Å; D1864-K1914 PolarHBondContact OD2-NZ 3.48Å
1865	P	91.2	Very high	93.7	Very high	11 Å²	11	18.2 Å²	18.2	7%	0.071	9%	0.094	C	C	.	.	T	Hydrogen-bonded Turn	cis	-89.5	159.1	17.9	34.8	-37.9	0	0	0	116.5	R1863 E1868 T1894 D1895 I1906	R1863-P1865 CarbonylContact O-C 3.56Å; P1865-E1868 WeakPolarHBondContact CA-OE1 3.46Å; P1865-T1894 WeakPolarHBondContact O-CB 3.38Å; P1865-D1895 CarbonylContact C-O 3.58Å; P1865-D1895 PolarHBondContact O-N 2.78Å; P1865-I1906 HydrophobicContact CB-CG2 4.22Å; P1865-I1906 HydrophobicContact CG-CG2 3.93Å
1866	G	89.5	Confident	93.8	Very high	34 Å²	34	18.2 Å²	18.2	35%	0.351	9%	0.094	S	C	.	.	T	Hydrogen-bonded Turn	trans	98.6	-15.7	160.5	0	0	0	0	0	116.7	E1868 D1895	G1866-E1868 VanDerWaalsContact N-CD 3.33Å; G1866-E1868 PolarHBondContact N-OE1 2.93Å; G1866-E1868 PolarHBondContact N-OE2 3.14Å; G1866-D1895 WeakPolarHBondContact CA-O 3.28Å
1867	M	91.4	Very high	94	Very high	35 Å²	35	18.2 Å²	18.2	17%	0.172	9%	0.094	C	C	.	.			trans	-135.7	34.7	179.8	-70	178.1	-81.7	0	0	111.6	R1863 Y1869 K1870	R1863-M1867 HydrophobicContact CB-CB 3.88Å; R1863-M1867 CarbonylContact O-C 3.07Å; R1863-M1867 VanDerWaalsContact O-CA 3.28Å; R1863-M1867 WeakPolarHBondContact O-CA 3.41Å; R1863-M1867 WeakPolarHBondContact O-CB 3.47Å; R1863-M1867 PolarHBondContact O-N 3.46Å; M1867-Y1869 PolarHBondContact O-N 2.51Å; M1867-K1870 HydrophobicContact CB-CD 4.39Å; M1867-K1870 HydrophobicContact CB-CG 4.5Å; M1867-K1870 WeakPolarHBondContact O-CB 3.43Å; M1867-K1870 PolarHBondContact O-N 3.2Å; M1867-K1870 HydrophobicContact SD-CD 4.49Å
1868	E	92.7	Very high	93.8	Very high	67 Å²	67	21 Å²	21	31%	0.313	11%	0.106	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-24.2	-173.5	-60.3	84.4	171.8	0	0	113	D1864 P1865 G1866 K1870 E1871 D1872 R2182	D1864-E1868 HydrophobicContact CB-CG 4.01Å; P1865-E1868 WeakPolarHBondContact CA-OE1 3.46Å; G1866-E1868 VanDerWaalsContact N-CD 3.33Å; G1866-E1868 PolarHBondContact N-OE1 2.93Å; G1866-E1868 PolarHBondContact N-OE2 3.14Å; E1868-K1870 PolarHBondContact O-N 2.92Å; E1868-E1871 CarbonylContact C-O 3.55Å; E1868-E1871 VanDerWaalsContact CA-O 3.23Å; E1868-E1871 WeakPolarHBondContact CA-O 3.33Å; E1868-E1871 CarbonylContact O-C 3.55Å; E1868-E1871 PolarHBondContact O-N 3.06Å; E1868-D1872 HydrophobicContact CB-CB 4.31Å; E1868-R2182 PolarHBondContact O-NH1 3.15Å
1869	Y	90.5	Very high	93.8	Very high	133 Å²	133	21 Å²	21	52%	0.522	11%	0.106	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65	-24.6	174.8	77	-89.8	0	0	0	112.9	M1867 T2079 E2082	M1867-Y1869 PolarHBondContact O-N 2.51Å; Y1869-T2079 HydrophobicContact CD2-CG2 4.18Å; Y1869-T2079 HydrophobicContact CE2-CG2 4.26Å; Y1869-E2082 PolarHBondContact OH-OE1 3.08Å
1870	K	90.6	Very high	93.8	Very high	15 Å²	15	21 Å²	21	7%	0.065	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-42.9	175.3	-59.9	-170.4	-178.2	-142.5	0	111.8	R1863 M1867 E1868 H2078 E2082 R2182	R1863-K1870 HydrophobicContact CB-CB 4.45Å; R1863-K1870 HydrophobicContact CG-CB 4.18Å; M1867-K1870 HydrophobicContact CB-CD 4.39Å; M1867-K1870 HydrophobicContact CB-CG 4.5Å; M1867-K1870 WeakPolarHBondContact O-CB 3.43Å; M1867-K1870 PolarHBondContact O-N 3.2Å; M1867-K1870 HydrophobicContact SD-CD 4.49Å; E1868-K1870 PolarHBondContact O-N 2.92Å; K1870-H2078 PolarHBondContact NZ-ND1 3.16Å; K1870-H2078 VanDerWaalsContact NZ-ND1 3.1Å; K1870-E2082 WeakPolarHBondContact CE-OE1 3.48Å; K1870-E2082 WeakPolarHBondContact CE-OE2 3.48Å; K1870-E2082 IonicContact NZ-OE1 3.93Å; K1870-E2082 PolarHBondContact NZ-OE1 3.26Å; K1870-E2082 IonicContact NZ-OE2 3.08Å; K1870-E2082 PolarHBondContact NZ-OE2 3.06Å; K1870-R2182 WeakPolarHBondContact O-CB 3.29Å
1871	E	94.1	Very high	93.8	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.106	C	C	.	.			trans	-168.1	146.6	178.9	-160.1	75	-72.2	0	0	109	T1862 R1863 E1868 S1875 V1876 H2075 P2077 T2181 R2182	T1862-E1871 CarbonylContact O-C 3.5Å; R1863-E1871 HydrophobicContact CB-CB 4.14Å; R1863-E1871 WeakPolarHBondContact CB-O 3.25Å; R1863-E1871 HydrophobicContact CG-CB 4.11Å; E1868-E1871 CarbonylContact C-O 3.55Å; E1868-E1871 VanDerWaalsContact CA-O 3.23Å; E1868-E1871 WeakPolarHBondContact CA-O 3.33Å; E1868-E1871 CarbonylContact O-C 3.55Å; E1868-E1871 PolarHBondContact O-N 3.06Å; E1871-S1875 VanDerWaalsContact OE1-CB 3.26Å; E1871-S1875 WeakPolarHBondContact OE1-CB 3.39Å; E1871-S1875 PolarHBondContact OE1-OG 3.02Å; E1871-V1876 HydrophobicContact CG-CB 3.65Å; E1871-V1876 HydrophobicContact CG-CG2 4.19Å; E1871-H2075 IonicContact OE2-CE1 3.94Å; E1871-H2075 IonicContact OE2-NE2 2.96Å; E1871-H2075 PolarHBondContact OE2-NE2 3.04Å; E1871-P2077 HydrophobicContact CB-CB 4.12Å; E1871-P2077 HydrophobicContact CB-CG 3.44Å; E1871-P2077 VanDerWaalsContact CB-CG 3.44Å; E1871-P2077 HydrophobicContact CG-CB 4.48Å; E1871-P2077 HydrophobicContact CG-CG 3.86Å; E1871-T2181 WeakPolarHBondContact OE2-CA 3.23Å; E1871-T2181 WeakPolarHBondContact OE2-CB 3.28Å; E1871-T2181 PolarHBondContact OE2-OG1 3.1Å; E1871-R2182 WeakPolarHBondContact OE1-CB 3.25Å; E1871-R2182 WeakPolarHBondContact OE1-CG 3.41Å; E1871-R2182 PolarHBondContact OE1-N 2.83Å
1872	D	94	Very high	93.6	Very high	19 Å²	19	21 Å²	21	10%	0.102	11%	0.109	C	C	.	.			trans	-125.8	171.3	169.8	71.2	6.4	0	0	0	111.5	E1868 T1874 S1875 V1876 R2182	E1868-D1872 HydrophobicContact CB-CB 4.31Å; D1872-T1874 PolarHBondContact O-N 2.81Å; D1872-T1874 VanDerWaalsContact O-N 3.17Å; D1872-T1874 PolarHBondContact OD1-N 3.42Å; D1872-S1875 PolarHBondContact N-OG 3.13Å; D1872-S1875 PolarHBondContact O-N 2.79Å; D1872-S1875 PolarHBondContact O-OG 2.92Å; D1872-S1875 VanDerWaalsContact O-OG 3.07Å; D1872-S1875 WeakPolarHBondContact OD1-CB 3.34Å; D1872-S1875 PolarHBondContact OD1-N 3.27Å; D1872-S1875 PolarHBondContact OD1-OG 3.3Å; D1872-V1876 WeakPolarHBondContact O-CB 3.43Å; D1872-V1876 VanDerWaalsContact O-CG1 3.27Å; D1872-V1876 WeakPolarHBondContact O-CG1 3.36Å; D1872-V1876 PolarHBondContact O-N 3.37Å; D1872-R2182 IonicContact OD1-NE 3.86Å; D1872-R2182 IonicContact OD1-NH2 3Å; D1872-R2182 IonicContact OD2-CZ 3.31Å; D1872-R2182 IonicContact OD2-NE 3.59Å; D1872-R2182 IonicContact OD2-NH2 3.96Å; D1872-R2182 PolarHBondContact OD2-NH2 3.46Å
1873	W	96.6	Very high	93.6	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-55.8	-33.3	-179.9	-82.3	102.2	0	0	0	114.1	T1862 D1864 T1877 I1888 A1890 M1907 A1911 K1914 A1915 Y1919 L1921	T1862-W1873 HydrophobicContact CG2-CD2 4.38Å; T1862-W1873 HydrophobicContact CG2-CE3 4.17Å; T1862-W1873 HydrophobicContact CG2-CH2 3.93Å; T1862-W1873 HydrophobicContact CG2-CZ2 4.11Å; T1862-W1873 HydrophobicContact CG2-CZ3 3.95Å; D1864-W1873 HydrophobicContact CB-CG 4.48Å; D1864-W1873 VanDerWaalsContact CG-CD1 3.47Å; D1864-W1873 PolarHBondContact O-NE1 2.84Å; D1864-W1873 VanDerWaalsContact O-NE1 3.13Å; W1873-T1877 HydrophobicContact CE3-CG2 4.27Å; W1873-T1877 WeakPolarHBondContact O-CB 3.46Å; W1873-T1877 VanDerWaalsContact O-CG2 3.23Å; W1873-T1877 WeakPolarHBondContact O-CG2 3.14Å; W1873-T1877 PolarHBondContact O-N 3.27Å; W1873-T1877 PolarHBondContact O-OG1 2.82Å; W1873-I1888 HydrophobicContact CZ3-CD1 4.22Å; W1873-A1890 HydrophobicContact CH2-CB 3.58Å; W1873-A1890 HydrophobicContact CZ2-CB 4.16Å; W1873-A1890 HydrophobicContact CZ3-CB 4.41Å; W1873-M1907 HydrophobicContact CH2-CE 4.17Å; W1873-M1907 HydrophobicContact CZ2-CE 3.57Å; W1873-M1907 HydrophobicContact CZ2-CG 3.74Å; W1873-M1907 HydrophobicContact CZ2-SD 4.43Å; W1873-A1911 HydrophobicContact CD2-CB 3.77Å; W1873-A1911 HydrophobicContact CE3-CB 3.85Å; W1873-A1911 HydrophobicContact CH2-CB 3.59Å; W1873-A1911 HydrophobicContact CZ2-CB 3.53Å; W1873-A1911 HydrophobicContact CZ3-CB 3.76Å; W1873-K1914 HydrophobicContact CB-CB 3.5Å; W1873-K1914 HydrophobicContact CB-CD 4.13Å; W1873-K1914 HydrophobicContact CB-CG 4.5Å; W1873-A1915 HydrophobicContact CE3-CB 4.17Å; W1873-Y1919 HydrophobicContact CH2-CD2 4.19Å; W1873-Y1919 HydrophobicContact CH2-CG 4.27Å; W1873-Y1919 HydrophobicContact CZ3-CD1 4.39Å; W1873-Y1919 HydrophobicContact CZ3-CD2 4.3Å; W1873-Y1919 AromaticContact CZ3-CG 3.93Å; W1873-Y1919 HydrophobicContact CZ3-CG 3.93Å; W1873-L1921 HydrophobicContact CH2-CD2 3.78Å; W1873-L1921 HydrophobicContact CZ2-CD2 4.09Å
1874	T	95	Very high	93.6	Very high	28 Å²	28	20.4 Å²	20.4	17%	0.172	11%	0.106	C	C	.	.	H	α-helix	trans	-71.4	-52.2	179.3	-55	0	0	0	0	110.9	D1872 T1877 K1878 K1914 P2217	D1872-T1874 PolarHBondContact O-N 2.81Å; D1872-T1874 VanDerWaalsContact O-N 3.17Å; D1872-T1874 PolarHBondContact OD1-N 3.42Å; T1874-T1877 PolarHBondContact O-OG1 3.5Å; T1874-K1878 HydrophobicContact CG2-CD 4.18Å; T1874-K1878 WeakPolarHBondContact O-CB 3.41Å; T1874-K1878 VanDerWaalsContact O-CG 3.23Å; T1874-K1878 WeakPolarHBondContact O-CG 3.3Å; T1874-K1878 PolarHBondContact O-N 3.41Å; T1874-K1914 PolarHBondContact OG1-O 3.39Å; T1874-P2217 HydrophobicContact CG2-CB 4.31Å; T1874-P2217 HydrophobicContact CG2-CG 3.8Å
1875	S	94.2	Very high	93.8	Very high	11 Å²	11	20.4 Å²	20.4	8%	0.077	11%	0.106	C	C	.	.	H	α-helix	trans	-64.5	-45.2	-178	43.8	0	0	0	0	112.4	E1871 D1872 T1877 K1878 A1879 F2180	E1871-S1875 VanDerWaalsContact OE1-CB 3.26Å; E1871-S1875 WeakPolarHBondContact OE1-CB 3.39Å; E1871-S1875 PolarHBondContact OE1-OG 3.02Å; D1872-S1875 PolarHBondContact N-OG 3.13Å; D1872-S1875 PolarHBondContact O-N 2.79Å; D1872-S1875 PolarHBondContact O-OG 2.92Å; D1872-S1875 VanDerWaalsContact O-OG 3.07Å; D1872-S1875 WeakPolarHBondContact OD1-CB 3.34Å; D1872-S1875 PolarHBondContact OD1-N 3.27Å; D1872-S1875 PolarHBondContact OD1-OG 3.3Å; S1875-T1877 PolarHBondContact O-N 3.48Å; S1875-K1878 PolarHBondContact O-N 3.4Å; S1875-A1879 WeakPolarHBondContact O-CB 3.46Å; S1875-A1879 PolarHBondContact O-N 2.76Å; S1875-F2180 WeakPolarHBondContact CB-O 3.12Å
1876	V	96.3	Very high	93.9	Very high	0 Å²	0	20 Å²	20	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-63.5	-40	179.4	73.3	0	0	0	0	112.7	V1860 T1862 E1871 D1872 A1879 A1880 I1888 L2096	V1860-V1876 HydrophobicContact CG1-CG2 3.62Å; T1862-V1876 HydrophobicContact CG2-CG1 3.96Å; E1871-V1876 HydrophobicContact CG-CB 3.65Å; E1871-V1876 HydrophobicContact CG-CG2 4.19Å; D1872-V1876 WeakPolarHBondContact O-CB 3.43Å; D1872-V1876 VanDerWaalsContact O-CG1 3.27Å; D1872-V1876 WeakPolarHBondContact O-CG1 3.36Å; D1872-V1876 PolarHBondContact O-N 3.37Å; V1876-A1879 WeakPolarHBondContact O-CB 3.49Å; V1876-A1879 PolarHBondContact O-N 3.16Å; V1876-A1880 WeakPolarHBondContact O-CB 3.42Å; V1876-A1880 PolarHBondContact O-N 3.21Å; V1876-I1888 HydrophobicContact CG1-CD1 4.17Å; V1876-I1888 HydrophobicContact CG2-CD1 4.47Å; V1876-L2096 HydrophobicContact CG2-CD1 3.55Å
1877	T	97.5	Very high	94.2	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-79.1	-28.4	-178.6	57	0	0	0	0	112.3	W1873 T1874 S1875 A1880 L1881 I1888 A1915 C1916 C1917	W1873-T1877 HydrophobicContact CE3-CG2 4.27Å; W1873-T1877 WeakPolarHBondContact O-CB 3.46Å; W1873-T1877 VanDerWaalsContact O-CG2 3.23Å; W1873-T1877 WeakPolarHBondContact O-CG2 3.14Å; W1873-T1877 PolarHBondContact O-N 3.27Å; W1873-T1877 PolarHBondContact O-OG1 2.82Å; T1874-T1877 PolarHBondContact O-OG1 3.5Å; S1875-T1877 PolarHBondContact O-N 3.48Å; T1877-A1880 PolarHBondContact O-N 2.91Å; T1877-L1881 WeakPolarHBondContact O-CG 3.35Å; T1877-L1881 PolarHBondContact O-N 3.44Å; T1877-I1888 HydrophobicContact CG2-CD1 3.86Å; T1877-A1915 HydrophobicContact CG2-CB 4.04Å; T1877-C1916 WeakPolarHBondContact OG1-CB 3.27Å; T1877-C1916 PolarHBondContact OG1-N 2.95Å; T1877-C1917 VanDerWaalsContact CG2-SG 3.57Å
1878	K	94.7	Very high	94.5	Very high	59 Å²	59	16.8 Å²	16.8	26%	0.257	8%	0.079	S	C	.	.	H	α-helix	trans	-64.3	-43.8	166.8	-74.3	-174.7	175.5	-176	0	111.6	T1874 S1875 A1880 L1881 A1882 F2180 V2213	T1874-K1878 HydrophobicContact CG2-CD 4.18Å; T1874-K1878 WeakPolarHBondContact O-CB 3.41Å; T1874-K1878 VanDerWaalsContact O-CG 3.23Å; T1874-K1878 WeakPolarHBondContact O-CG 3.3Å; T1874-K1878 PolarHBondContact O-N 3.41Å; S1875-K1878 PolarHBondContact O-N 3.4Å; K1878-A1880 VanDerWaalsContact C-N 3.33Å; K1878-A1880 PolarHBondContact O-N 2.87Å; K1878-L1881 PolarHBondContact O-N 3.19Å; K1878-A1882 WeakPolarHBondContact O-CB 3.47Å; K1878-A1882 PolarHBondContact O-N 2.9Å; K1878-F2180 HydrophobicContact CB-CB 3.85Å; K1878-F2180 HydrophobicContact CB-CD1 3.74Å; K1878-F2180 HydrophobicContact CB-CE1 4.48Å; K1878-F2180 HydrophobicContact CB-CG 3.86Å; K1878-F2180 HydrophobicContact CD-CD1 4.06Å; K1878-F2180 HydrophobicContact CD-CE1 4.41Å; K1878-F2180 HydrophobicContact CG-CD1 4.45Å; K1878-V2213 HydrophobicContact CB-CG2 4.02Å; K1878-V2213 HydrophobicContact CD-CB 4.43Å; K1878-V2213 HydrophobicContact CD-CG2 4.45Å; K1878-V2213 HydrophobicContact CG-CB 4.19Å; K1878-V2213 HydrophobicContact CG-CG1 4.07Å; K1878-V2213 HydrophobicContact CG-CG2 3.93Å
1879	A	94.2	Very high	94.6	Very high	0 Å²	0	13.6 Å²	13.6	0%	0	6%	0.064	C	C	.	.	H	α-helix	trans	-61.3	-40.9	174.2	0	0	0	0	0	111.8	S1875 V1876 A1882 G1883 L2096 E2097 F2180	S1875-A1879 WeakPolarHBondContact O-CB 3.46Å; S1875-A1879 PolarHBondContact O-N 2.76Å; V1876-A1879 WeakPolarHBondContact O-CB 3.49Å; V1876-A1879 PolarHBondContact O-N 3.16Å; A1879-A1882 PolarHBondContact O-N 3.46Å; A1879-G1883 PolarHBondContact O-N 3.49Å; A1879-L2096 HydrophobicContact CB-CB 4.37Å; A1879-L2096 HydrophobicContact CB-CD1 4.45Å; A1879-E2097 HydrophobicContact CB-CG 3.86Å; A1879-E2097 VanDerWaalsContact CB-OE1 3.3Å; A1879-E2097 WeakPolarHBondContact CB-OE1 3.44Å; A1879-E2097 WeakPolarHBondContact O-CG 3.03Å; A1879-F2180 HydrophobicContact CB-CB 4.05Å
1880	A	96.9	Very high	94.9	Very high	0 Å²	0	7.2 Å²	7.2	0%	0	4%	0.04	C	C	.	.	H	α-helix	trans	-58	-52.3	173.7	0	0	0	0	0	111.5	V1876 T1877 K1878 A1882 G1883 G1884 I1885 I1888 L2096	V1876-A1880 WeakPolarHBondContact O-CB 3.42Å; V1876-A1880 PolarHBondContact O-N 3.21Å; T1877-A1880 PolarHBondContact O-N 2.91Å; K1878-A1880 VanDerWaalsContact C-N 3.33Å; K1878-A1880 PolarHBondContact O-N 2.87Å; A1880-A1882 VanDerWaalsContact C-N 3.34Å; A1880-A1882 PolarHBondContact O-N 3.05Å; A1880-G1883 CarbonylContact O-C 3.59Å; A1880-G1883 WeakPolarHBondContact O-CA 3.22Å; A1880-G1883 PolarHBondContact O-N 3.43Å; A1880-G1884 PolarHBondContact O-N 3.22Å; A1880-G1884 VanDerWaalsContact O-N 3.11Å; A1880-I1885 CarbonylContact C-O 3.54Å; A1880-I1885 HydrophobicContact CB-CB 4.03Å; A1880-I1885 HydrophobicContact CB-CG2 4.28Å; A1880-I1885 WeakPolarHBondContact O-CA 3.27Å; A1880-I1885 PolarHBondContact O-N 3.31Å; A1880-I1885 VanDerWaalsContact O-O 3.13Å; A1880-I1888 HydrophobicContact CB-CG2 3.75Å; A1880-L2096 HydrophobicContact CB-CD1 4.43Å; A1880-L2096 HydrophobicContact CB-CD2 4.22Å
1881	L	96	Very high	95	Very high	0 Å²	0	6.6 Å²	6.6	0%	0	4%	0.037	C	C	.	.	H	α-helix	trans	-59.7	-42.4	178.6	-69.2	174.3	0	0	0	112.3	T1877 K1878 G1883 G1884 I1885 C1916 C1917 V2200 A2207 F2208 V2213 V2215	T1877-L1881 WeakPolarHBondContact O-CG 3.35Å; T1877-L1881 PolarHBondContact O-N 3.44Å; K1878-L1881 PolarHBondContact O-N 3.19Å; L1881-G1883 VanDerWaalsContact C-N 3.27Å; L1881-G1883 PolarHBondContact O-N 2.92Å; L1881-G1884 PolarHBondContact O-N 2.84Å; L1881-G1884 VanDerWaalsContact O-N 3.07Å; L1881-I1885 PolarHBondContact N-O 3.26Å; L1881-C1916 HydrophobicContact CD1-CB 3.99Å; L1881-C1917 HydrophobicContact CD2-CB 3.84Å; L1881-C1917 HydrophobicContact CG-CB 3.98Å; L1881-V2200 HydrophobicContact CD2-CB 4.43Å; L1881-V2200 HydrophobicContact CD2-CG1 3.83Å; L1881-V2200 VanDerWaalsContact O-CG2 3.26Å; L1881-V2200 WeakPolarHBondContact O-CG2 3.25Å; L1881-A2207 HydrophobicContact CD1-CB 4.02Å; L1881-A2207 HydrophobicContact CD2-CB 4.04Å; L1881-F2208 HydrophobicContact CB-CB 4.24Å; L1881-V2213 HydrophobicContact CD1-CG1 3.92Å; L1881-V2215 HydrophobicContact CD1-CG2 3.83Å
1882	A	91.7	Very high	95	Very high	15 Å²	15	6.6 Å²	6.6	12%	0.124	4%	0.037	C	C	.	.	H	α-helix	trans	-64.3	-32.1	176.4	0	0	0	0	0	112.8	K1878 A1879 A1880 G1884 E2097 F2180 V2197 F2208	K1878-A1882 WeakPolarHBondContact O-CB 3.47Å; K1878-A1882 PolarHBondContact O-N 2.9Å; A1879-A1882 PolarHBondContact O-N 3.46Å; A1880-A1882 VanDerWaalsContact C-N 3.34Å; A1880-A1882 PolarHBondContact O-N 3.05Å; A1882-G1884 VanDerWaalsContact C-N 3.3Å; A1882-E2097 HydrophobicContact CB-CG 4.07Å; A1882-F2180 HydrophobicContact CB-CD2 3.57Å; A1882-F2180 HydrophobicContact CB-CE2 3.75Å; A1882-V2197 WeakPolarHBondContact O-CB 3.48Å; A1882-F2208 HydrophobicContact CB-CD2 4.34Å; A1882-F2208 HydrophobicContact CB-CE2 3.69Å; A1882-F2208 HydrophobicContact CB-CZ 4.05Å
1883	G	92.7	Very high	94.7	Very high	1 Å²	1	6.6 Å²	6.6	1%	0.01	4%	0.037	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-1.8	172.4	0	0	0	0	0	115.3	A1879 A1880 L1881 L2100	A1879-G1883 PolarHBondContact O-N 3.49Å; A1880-G1883 CarbonylContact O-C 3.59Å; A1880-G1883 WeakPolarHBondContact O-CA 3.22Å; A1880-G1883 PolarHBondContact O-N 3.43Å; L1881-G1883 VanDerWaalsContact C-N 3.27Å; L1881-G1883 PolarHBondContact O-N 2.92Å; G1883-L2100 WeakPolarHBondContact O-CB 3.36Å
1884	G	93.4	Very high	94.5	Very high	0 Å²	0	6.9 Å²	6.9	0%	0	4%	0.039	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.5	16.1	-176.7	0	0	0	0	0	114	L1855 A1880 L1881 A1882 V2154	L1855-G1884 WeakPolarHBondContact CB-O 3.35Å; A1880-G1884 PolarHBondContact O-N 3.22Å; A1880-G1884 VanDerWaalsContact O-N 3.11Å; L1881-G1884 PolarHBondContact O-N 2.84Å; L1881-G1884 VanDerWaalsContact O-N 3.07Å; A1882-G1884 VanDerWaalsContact C-N 3.3Å; G1884-V2154 WeakPolarHBondContact O-CG2 3.4Å
1885	I	96.6	Very high	94.1	Very high	0 Å²	0	10.9 Å²	10.9	0%	0	6%	0.059	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	123.5	174.9	-55.1	-55	0	0	0	109	L1855 D1857 A1880 L1881 T1887 I1888 L2096 M2099	L1855-I1885 HydrophobicContact CB-CD1 3.85Å; D1857-I1885 HydrophobicContact CB-CD1 4.49Å; D1857-I1885 HydrophobicContact CB-CG1 4.38Å; D1857-I1885 HydrophobicContact CB-CG2 3.73Å; A1880-I1885 CarbonylContact C-O 3.54Å; A1880-I1885 HydrophobicContact CB-CB 4.03Å; A1880-I1885 HydrophobicContact CB-CG2 4.28Å; A1880-I1885 WeakPolarHBondContact O-CA 3.27Å; A1880-I1885 PolarHBondContact O-N 3.31Å; A1880-I1885 VanDerWaalsContact O-O 3.13Å; L1881-I1885 PolarHBondContact N-O 3.26Å; I1885-T1887 VanDerWaalsContact CG2-O 3.26Å; I1885-T1887 WeakPolarHBondContact CG2-O 3.41Å; I1885-I1888 HydrophobicContact CG2-CG2 3.82Å; I1885-L2096 HydrophobicContact CG1-CD2 4.36Å; I1885-M2099 HydrophobicContact CD1-CE 3.59Å; I1885-M2099 HydrophobicContact CG1-CE 4.26Å
1886	V	94.2	Very high	93.9	Very high	2 Å²	2	13.2 Å²	13.2	1%	0.012	7%	0.074	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	-17.7	-177.3	-50	0	0	0	0	113.2	L1855 C1917 D1918 T2152 V2154 V2200 L2202	L1855-V1886 PolarHBondContact O-N 3.02Å; V1886-C1917 WeakPolarHBondContact O-CB 3.4Å; V1886-D1918 PolarHBondContact O-N 2.97Å; V1886-T2152 HydrophobicContact CB-CG2 4.16Å; V1886-T2152 HydrophobicContact CG1-CG2 4.16Å; V1886-T2152 HydrophobicContact CG2-CG2 3.75Å; V1886-V2154 HydrophobicContact CG1-CG2 4.06Å; V1886-V2200 HydrophobicContact CG1-CG1 3.51Å; V1886-L2202 HydrophobicContact CB-CD1 4.14Å
1887	T	95.1	Very high	93.6	Very high	2 Å²	2	14 Å²	14	1%	0.012	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	129.4	175.9	-53.3	0	0	0	0	110.1	L1855 I1856 D1857 I1885 D1918 V2223	L1855-T1887 PolarHBondContact O-N 3.5Å; I1856-T1887 WeakPolarHBondContact CA-O 3.38Å; I1856-T1887 HydrophobicContact CG2-CG2 4.42Å; D1857-T1887 PolarHBondContact N-O 3Å; I1885-T1887 VanDerWaalsContact CG2-O 3.26Å; I1885-T1887 WeakPolarHBondContact CG2-O 3.41Å; T1887-D1918 VanDerWaalsContact CA-O 3.25Å; T1887-D1918 WeakPolarHBondContact CA-O 3.49Å; T1887-D1918 HydrophobicContact CG2-CB 4.23Å; T1887-V2223 HydrophobicContact CG2-CG1 4.24Å; T1887-V2223 HydrophobicContact CG2-CG2 4.14Å
1888	I	96.8	Very high	93.4	Very high	0 Å²	0	14 Å²	14	0%	0	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	140.9	174.9	62.6	168.8	0	0	0	111	D1857 V1860 T1862 W1873 V1876 T1877 A1880 I1885 D1918 Y1919 G1920 L2096	D1857-I1888 CarbonylContact O-C 3.54Å; D1857-I1888 WeakPolarHBondContact O-CA 3.46Å; V1860-I1888 HydrophobicContact CB-CB 4.23Å; V1860-I1888 HydrophobicContact CG1-CD1 4.17Å; V1860-I1888 HydrophobicContact CG2-CB 3.92Å; V1860-I1888 HydrophobicContact CG2-CG2 3.98Å; T1862-I1888 HydrophobicContact CG2-CD1 4.04Å; W1873-I1888 HydrophobicContact CZ3-CD1 4.22Å; V1876-I1888 HydrophobicContact CG1-CD1 4.17Å; V1876-I1888 HydrophobicContact CG2-CD1 4.47Å; T1877-I1888 HydrophobicContact CG2-CD1 3.86Å; A1880-I1888 HydrophobicContact CB-CG2 3.75Å; I1885-I1888 HydrophobicContact CG2-CG2 3.82Å; I1888-D1918 PolarHBondContact N-O 2.98Å; I1888-Y1919 CarbonylContact O-C 3.54Å; I1888-Y1919 WeakPolarHBondContact O-CA 3.49Å; I1888-G1920 PolarHBondContact O-N 3.49Å; I1888-L2096 HydrophobicContact CG2-CD2 4.32Å
1889	L	96.1	Very high	93.4	Very high	0 Å²	0	12.6 Å²	12.6	0%	0	8%	0.076	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	112.5	170	-53.1	-173.6	0	0	0	109.7	D1857 I1858 V1860 G1920 Y1922 V1941 F2129 I2131	D1857-L1889 PolarHBondContact O-N 3.33Å; I1858-L1889 HydrophobicContact CB-CD1 3.84Å; I1858-L1889 HydrophobicContact CB-CG 4.38Å; I1858-L1889 HydrophobicContact CG2-CD1 3.78Å; I1858-L1889 HydrophobicContact CG2-CG 4.38Å; I1858-L1889 WeakPolarHBondContact O-CB 3.3Å; V1860-L1889 PolarHBondContact N-O 3.25Å; L1889-G1920 CarbonylContact C-O 3.49Å; L1889-G1920 WeakPolarHBondContact CA-O 3.37Å; L1889-Y1922 HydrophobicContact CB-CD2 4.17Å; L1889-Y1922 HydrophobicContact CB-CE2 3.5Å; L1889-Y1922 VanDerWaalsContact CB-CE2 3.5Å; L1889-Y1922 HydrophobicContact CD1-CE2 4.29Å; L1889-V1941 HydrophobicContact CB-CG2 4.38Å; L1889-V1941 HydrophobicContact CD1-CB 4.44Å; L1889-V1941 HydrophobicContact CD1-CG2 4.07Å; L1889-V1941 HydrophobicContact CD2-CG1 4.06Å; L1889-V1941 HydrophobicContact CD2-CG2 4.27Å; L1889-V1941 HydrophobicContact CG-CG2 4.48Å; L1889-F2129 HydrophobicContact CD1-CB 4.2Å; L1889-F2129 HydrophobicContact CD1-CD1 4.05Å; L1889-F2129 HydrophobicContact CD1-CD2 4.04Å; L1889-F2129 HydrophobicContact CD1-CG 3.8Å; L1889-I2131 HydrophobicContact CD1-CD1 4.32Å; L1889-I2131 HydrophobicContact CD2-CD1 4.09Å
1890	A	95.6	Very high	93.3	Very high	0 Å²	0	16 Å²	16	0%	0	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	123.6	-167.6	0	0	0	0	0	111.8	V1860 T1862 W1873 M1907 G1920 L1921 Y1922	V1860-A1890 CarbonylContact O-C 3.56Å; V1860-A1890 WeakPolarHBondContact O-CA 3.42Å; T1862-A1890 HydrophobicContact CG2-CB 3.7Å; W1873-A1890 HydrophobicContact CH2-CB 3.58Å; W1873-A1890 HydrophobicContact CZ2-CB 4.16Å; W1873-A1890 HydrophobicContact CZ3-CB 4.41Å; A1890-M1907 HydrophobicContact CB-CE 3.36Å; A1890-G1920 PolarHBondContact N-O 3.37Å; A1890-L1921 HydrophobicContact CB-CD2 4.11Å; A1890-Y1922 WeakPolarHBondContact O-CD2 3.24Å; A1890-Y1922 PolarHBondContact O-N 3.35Å; A1890-Y1922 VanDerWaalsContact O-N 3.1Å
1891	M	94.1	Very high	93	Very high	1 Å²	1	20.8 Å²	20.8	1%	0.005	12%	0.117	C	C	.	.			trans	-73.3	146.5	-177.2	-75.5	-66.3	149.4	0	0	112.7	H1859 V1860 N1893 Y1922 K1944	H1859-M1891 HydrophobicContact CB-CE 3.99Å; H1859-M1891 WeakPolarHBondContact CD2-CE 3.36Å; H1859-M1891 WeakPolarHBondContact CD2-CG 3.45Å; H1859-M1891 VanDerWaalsContact CG-CE 3.42Å; V1860-M1891 PolarHBondContact O-N 3.39Å; M1891-N1893 VanDerWaalsContact C-N 3.26Å; M1891-N1893 PolarHBondContact O-N 3.48Å; M1891-Y1922 HydrophobicContact CE-CD2 3.61Å; M1891-Y1922 HydrophobicContact CE-CE1 4.41Å; M1891-Y1922 HydrophobicContact CE-CE2 3.23Å; M1891-Y1922 HydrophobicContact CE-CG 4.3Å; M1891-Y1922 HydrophobicContact SD-CD2 4.03Å; M1891-Y1922 HydrophobicContact SD-CE2 4.26Å; M1891-Y1922 HydrophobicContact SD-CG 4.41Å; M1891-K1944 HydrophobicContact CE-CD 4.44Å; M1891-K1944 HydrophobicContact SD-CD 3.83Å; M1891-K1944 HydrophobicContact SD-CG 4.02Å
1892	P	93.2	Very high	92.8	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	14%	0.143	C	C	.	.	S	Bend	trans	-82.4	2.9	-169.6	33.8	-33.9	0	0	0	114.4	T1894 A1897 I1898 K1944 Y1946 L1954	P1892-T1894 VanDerWaalsContact C-N 3.29Å; P1892-T1894 PolarHBondContact O-N 2.95Å; P1892-A1897 WeakPolarHBondContact O-CA 3.42Å; P1892-I1898 HydrophobicContact CB-CB 3.74Å; P1892-I1898 HydrophobicContact CB-CG1 4.29Å; P1892-I1898 PolarHBondContact O-N 3.24Å; P1892-K1944 HydrophobicContact CG-CB 3.86Å; P1892-K1944 HydrophobicContact CG-CG 4.31Å; P1892-Y1946 HydrophobicContact CG-CE2 4.36Å; P1892-L1954 HydrophobicContact CG-CD1 4.41Å
1893	N	88.4	Confident	92.8	Very high	19 Å²	19	25.4 Å²	25.4	10%	0.102	14%	0.14	C	C	.	.			trans	-82.1	70.7	-179.2	-176.9	38.9	0	0	0	112.2	M1891 T1952	M1891-N1893 VanDerWaalsContact C-N 3.26Å; M1891-N1893 PolarHBondContact O-N 3.48Å; N1893-T1952 HydrophobicContact CB-CG2 3.79Å; N1893-T1952 WeakPolarHBondContact ND2-CG2 3.42Å; N1893-T1952 WeakPolarHBondContact OD1-CB 3.28Å; N1893-T1952 WeakPolarHBondContact OD1-CG2 3.47Å
1894	T	91.3	Very high	92.9	Very high	7 Å²	7	25.5 Å²	25.5	4%	0.043	14%	0.14	C	C	.	.	S	Bend	trans	-112.2	-179.7	174.2	51.2	0	0	0	0	110.2	P1865 P1892 P1896 A1897 I1898	P1865-T1894 WeakPolarHBondContact O-CB 3.38Å; P1892-T1894 VanDerWaalsContact C-N 3.29Å; P1892-T1894 PolarHBondContact O-N 2.95Å; T1894-P1896 VanDerWaalsContact C-C 3.44Å; T1894-P1896 CarbonylContact C-O 3.53Å; T1894-P1896 VanDerWaalsContact C-O 3.24Å; T1894-P1896 CarbonylContact O-C 3.55Å; T1894-P1896 PolarHBondContact OG1-O 3.5Å; T1894-A1897 VanDerWaalsContact O-CA 3.29Å; T1894-A1897 WeakPolarHBondContact O-CA 3.34Å; T1894-A1897 PolarHBondContact O-N 3.44Å; T1894-A1897 VanDerWaalsContact O-N 3.07Å; T1894-I1898 VanDerWaalsContact OG1-CD1 3.3Å; T1894-I1898 WeakPolarHBondContact OG1-CD1 3.29Å; T1894-I1898 WeakPolarHBondContact OG1-CG1 3.32Å
1895	D	87.8	Confident	92.8	Very high	111 Å²	111	27.9 Å²	27.9	59%	0.594	15%	0.153	S	C	*	.	S	Bend	trans	-124	104.5	172.9	-171.8	11.9	0	0	0	110.6	P1865 G1866	P1865-D1895 CarbonylContact C-O 3.58Å; P1865-D1895 PolarHBondContact O-N 2.78Å; G1866-D1895 WeakPolarHBondContact CA-O 3.28Å
1896	P	89.9	Confident	92.6	Very high	61 Å²	61	30.2 Å²	30.2	40%	0.396	17%	0.165	S	C	.	.	S	Bend	cis	-70	157.5	1.2	31.2	-36.7	0	0	0	112.5	T1894 T1903	T1894-P1896 VanDerWaalsContact C-C 3.44Å; T1894-P1896 CarbonylContact C-O 3.53Å; T1894-P1896 VanDerWaalsContact C-O 3.24Å; T1894-P1896 CarbonylContact O-C 3.55Å; T1894-P1896 PolarHBondContact OG1-O 3.5Å; P1896-T1903 HydrophobicContact CB-CG2 4.05Å; P1896-T1903 HydrophobicContact CG-CG2 3.87Å
1897	A	90.3	Very high	92.6	Very high	16 Å²	16	30.1 Å²	30.1	13%	0.132	16%	0.164	C	C	.	.			trans	-71.7	148.7	176	0	0	0	0	0	111.7	P1892 T1894 V1899 T1903 L1954	P1892-A1897 WeakPolarHBondContact O-CA 3.42Å; T1894-A1897 VanDerWaalsContact O-CA 3.29Å; T1894-A1897 WeakPolarHBondContact O-CA 3.34Å; T1894-A1897 PolarHBondContact O-N 3.44Å; T1894-A1897 VanDerWaalsContact O-N 3.07Å; A1897-V1899 HydrophobicContact CB-CG1 4.41Å; A1897-V1899 PolarHBondContact O-N 3.07Å; A1897-T1903 WeakPolarHBondContact O-CB 3.18Å; A1897-T1903 WeakPolarHBondContact O-CG2 3.25Å; A1897-T1903 PolarHBondContact O-OG1 3.04Å; A1897-L1954 HydrophobicContact CB-CD1 4.01Å; A1897-L1954 HydrophobicContact CB-CD2 3.8Å; A1897-L1954 HydrophobicContact CB-CG 3.93Å
1898	I	93.7	Very high	92.5	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.174	C	C	.	.	S	Bend	trans	-85.7	94.3	-174.7	-47.3	-55.7	0	0	0	110.5	P1892 T1894 T1903 F1904 M1907 G1924	P1892-I1898 HydrophobicContact CB-CB 3.74Å; P1892-I1898 HydrophobicContact CB-CG1 4.29Å; P1892-I1898 PolarHBondContact O-N 3.24Å; T1894-I1898 VanDerWaalsContact OG1-CD1 3.3Å; T1894-I1898 WeakPolarHBondContact OG1-CD1 3.29Å; T1894-I1898 WeakPolarHBondContact OG1-CG1 3.32Å; I1898-T1903 WeakPolarHBondContact CD1-O 3.36Å; I1898-F1904 HydrophobicContact CG2-CB 3.93Å; I1898-F1904 HydrophobicContact CG2-CD2 3.93Å; I1898-F1904 HydrophobicContact CG2-CG 4.4Å; I1898-M1907 HydrophobicContact CD1-CB 3.79Å; I1898-M1907 HydrophobicContact CD1-CG 4.47Å; I1898-M1907 HydrophobicContact CD1-SD 4.1Å; I1898-M1907 HydrophobicContact CG1-CB 4.35Å; I1898-M1907 HydrophobicContact CG1-SD 3.64Å; I1898-G1924 PolarHBondContact O-N 3.09Å
1899	V	93.2	Very high	92.3	Very high	29 Å²	29	39.1 Å²	39.1	18%	0.176	20%	0.203	C	C	.	.			trans	-131.4	-9.6	-172.3	-65.4	0	0	0	0	114.4	A1897 T1903 N1929 L1954	A1897-V1899 HydrophobicContact CB-CG1 4.41Å; A1897-V1899 PolarHBondContact O-N 3.07Å; V1899-T1903 PolarHBondContact N-OG1 3.46Å; V1899-T1903 VanDerWaalsContact N-OG1 3.11Å; V1899-N1929 PolarHBondContact O-ND2 2.9Å; V1899-L1954 HydrophobicContact CG1-CD2 3.29Å
1900	D	92.4	Very high	92.1	Very high	73 Å²	73	40.8 Å²	40.8	39%	0.39	21%	0.212	S	C	.	.	S	Bend	trans	-144	175.2	-177.7	64.2	29.1	0	0	0	111	N1902 T1903 F1904	D1900-N1902 VanDerWaalsContact C-N 3.28Å; D1900-N1902 PolarHBondContact O-N 3.02Å; D1900-N1902 PolarHBondContact OD1-N 3.41Å; D1900-N1902 VanDerWaalsContact OD1-N 3.11Å; D1900-T1903 PolarHBondContact N-OG1 3.31Å; D1900-T1903 PolarHBondContact O-OG1 2.69Å; D1900-T1903 VanDerWaalsContact O-OG1 3.07Å; D1900-T1903 WeakPolarHBondContact OD1-CB 3.4Å; D1900-T1903 WeakPolarHBondContact OD1-CG2 3.26Å; D1900-T1903 PolarHBondContact OD1-N 3.04Å; D1900-T1903 PolarHBondContact OD1-OG1 3.46Å; D1900-F1904 VanDerWaalsContact O-CB 3.22Å; D1900-F1904 WeakPolarHBondContact O-CB 3.43Å; D1900-F1904 PolarHBondContact O-N 2.95Å
1901	E	89.7	Confident	92	Very high	99 Å²	99	40.8 Å²	40.8	46%	0.463	21%	0.212	S	C	.	.	H	α-helix	trans	-65.7	-31.2	-176.5	-174.2	160.4	-148.4	0	0	112.8	N1905 L1936 K1939	E1901-N1905 VanDerWaalsContact O-CB 3.3Å; E1901-N1905 WeakPolarHBondContact O-CB 3.24Å; E1901-N1905 PolarHBondContact O-N 3.38Å; E1901-N1905 PolarHBondContact O-ND2 3.44Å; E1901-L1936 HydrophobicContact CB-CD2 3.94Å; E1901-L1936 HydrophobicContact CG-CD2 4.14Å; E1901-K1939 IonicContact OE1-NZ 2.65Å; E1901-K1939 PolarHBondContact OE1-NZ 2.9Å
1902	N	92	Very high	91.9	Very high	102 Å²	102	43.2 Å²	43.2	55%	0.545	23%	0.232	S	C	.	.	H	α-helix	trans	-69.8	-51.1	-178.9	-175	39.8	0	0	0	111.1	D1900 N1905 I1906	D1900-N1902 VanDerWaalsContact C-N 3.28Å; D1900-N1902 PolarHBondContact O-N 3.02Å; D1900-N1902 PolarHBondContact OD1-N 3.41Å; D1900-N1902 VanDerWaalsContact OD1-N 3.11Å; N1902-N1905 PolarHBondContact O-N 3.03Å; N1902-I1906 WeakPolarHBondContact O-CG1 3.32Å; N1902-I1906 PolarHBondContact O-N 2.96Å; N1902-I1906 VanDerWaalsContact O-N 3.11Å
1903	T	93.1	Very high	91.9	Very high	10 Å²	10	46.5 Å²	46.5	6%	0.061	26%	0.255	C	S	.	.	H	α-helix	trans	-62.2	-42.8	176.8	51.7	0	0	0	0	111.3	P1896 A1897 I1898 V1899 D1900 N1905 I1906 M1907	P1896-T1903 HydrophobicContact CB-CG2 4.05Å; P1896-T1903 HydrophobicContact CG-CG2 3.87Å; A1897-T1903 WeakPolarHBondContact O-CB 3.18Å; A1897-T1903 WeakPolarHBondContact O-CG2 3.25Å; A1897-T1903 PolarHBondContact O-OG1 3.04Å; I1898-T1903 WeakPolarHBondContact CD1-O 3.36Å; V1899-T1903 PolarHBondContact N-OG1 3.46Å; V1899-T1903 VanDerWaalsContact N-OG1 3.11Å; D1900-T1903 PolarHBondContact N-OG1 3.31Å; D1900-T1903 PolarHBondContact O-OG1 2.69Å; D1900-T1903 VanDerWaalsContact O-OG1 3.07Å; D1900-T1903 WeakPolarHBondContact OD1-CB 3.4Å; D1900-T1903 WeakPolarHBondContact OD1-CG2 3.26Å; D1900-T1903 PolarHBondContact OD1-N 3.04Å; D1900-T1903 PolarHBondContact OD1-OG1 3.46Å; T1903-N1905 VanDerWaalsContact C-N 3.35Å; T1903-N1905 PolarHBondContact O-N 3.35Å; T1903-I1906 PolarHBondContact O-N 2.72Å; T1903-I1906 VanDerWaalsContact O-N 3.17Å; T1903-M1907 PolarHBondContact O-N 3.45Å; T1903-M1907 VanDerWaalsContact O-N 3.16Å
1904	F	93.2	Very high	92.3	Very high	4 Å²	4	48.4 Å²	48.4	2%	0.018	26%	0.262	C	S	.	.	H	α-helix	trans	-57.5	-44.8	174.2	-172.6	-87.8	0	0	0	112.5	I1898 D1900 I1906 M1907 S1908 L1921 V1923 L1936 K1939 A1940	I1898-F1904 HydrophobicContact CG2-CB 3.93Å; I1898-F1904 HydrophobicContact CG2-CD2 3.93Å; I1898-F1904 HydrophobicContact CG2-CG 4.4Å; D1900-F1904 VanDerWaalsContact O-CB 3.22Å; D1900-F1904 WeakPolarHBondContact O-CB 3.43Å; D1900-F1904 PolarHBondContact O-N 2.95Å; F1904-I1906 VanDerWaalsContact C-N 3.33Å; F1904-I1906 PolarHBondContact O-N 3.23Å; F1904-M1907 PolarHBondContact O-N 3.49Å; F1904-S1908 WeakPolarHBondContact O-CB 3.5Å; F1904-S1908 PolarHBondContact O-N 3.45Å; F1904-L1921 HydrophobicContact CD2-CB 4.44Å; F1904-L1921 HydrophobicContact CE1-CD1 4.18Å; F1904-L1921 HydrophobicContact CE2-CB 3.56Å; F1904-L1921 HydrophobicContact CE2-CD1 4.03Å; F1904-L1921 HydrophobicContact CE2-CG 4.44Å; F1904-L1921 HydrophobicContact CZ-CB 3.87Å; F1904-L1921 HydrophobicContact CZ-CD1 3.79Å; F1904-L1921 HydrophobicContact CZ-CG 4.38Å; F1904-V1923 HydrophobicContact CD2-CG2 3.63Å; F1904-V1923 HydrophobicContact CE2-CG2 3.9Å; F1904-L1936 HydrophobicContact CB-CD1 4.46Å; F1904-K1939 HydrophobicContact CD1-CD 4.45Å; F1904-K1939 HydrophobicContact CE1-CB 3.7Å; F1904-K1939 HydrophobicContact CE1-CD 4.05Å; F1904-K1939 HydrophobicContact CE1-CG 4.5Å; F1904-K1939 HydrophobicContact CZ-CB 3.65Å; F1904-K1939 WeakPolarHBondContact CZ-O 3.27Å; F1904-A1940 HydrophobicContact CE2-CB 4.39Å
1905	N	92.6	Very high	92.5	Very high	49 Å²	49	48 Å²	48	26%	0.262	26%	0.26	S	S	.	.	H	α-helix	trans	-65.9	-32.6	178.1	-73.5	-30	0	0	0	113	E1901 N1902 T1903 R1909	E1901-N1905 VanDerWaalsContact O-CB 3.3Å; E1901-N1905 WeakPolarHBondContact O-CB 3.24Å; E1901-N1905 PolarHBondContact O-N 3.38Å; E1901-N1905 PolarHBondContact O-ND2 3.44Å; N1902-N1905 PolarHBondContact O-N 3.03Å; T1903-N1905 VanDerWaalsContact C-N 3.35Å; T1903-N1905 PolarHBondContact O-N 3.35Å; N1905-R1909 VanDerWaalsContact O-CG 3.29Å; N1905-R1909 WeakPolarHBondContact O-CG 3.02Å; N1905-R1909 PolarHBondContact O-N 3.12Å
1906	I	92.4	Very high	92.9	Very high	49 Å²	49	42.8 Å²	42.8	25%	0.251	23%	0.232	S	C	.	.	H	α-helix	trans	-63.6	-51	174.3	-66.6	166.7	0	0	0	109.9	P1865 N1902 T1903 F1904 S1908 R1909 N1910	P1865-I1906 HydrophobicContact CB-CG2 4.22Å; P1865-I1906 HydrophobicContact CG-CG2 3.93Å; N1902-I1906 WeakPolarHBondContact O-CG1 3.32Å; N1902-I1906 PolarHBondContact O-N 2.96Å; N1902-I1906 VanDerWaalsContact O-N 3.11Å; T1903-I1906 PolarHBondContact O-N 2.72Å; T1903-I1906 VanDerWaalsContact O-N 3.17Å; F1904-I1906 VanDerWaalsContact C-N 3.33Å; F1904-I1906 PolarHBondContact O-N 3.23Å; I1906-S1908 VanDerWaalsContact C-N 3.33Å; I1906-S1908 PolarHBondContact O-N 2.76Å; I1906-R1909 PolarHBondContact O-N 3.08Å; I1906-N1910 PolarHBondContact O-N 3.19Å
1907	M	93.7	Very high	93.1	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-60.4	-44	178.5	-172.9	177.9	-162.1	0	0	111.6	W1873 A1890 I1898 T1903 F1904 R1909 N1910 A1911 L1921	W1873-M1907 HydrophobicContact CH2-CE 4.17Å; W1873-M1907 HydrophobicContact CZ2-CE 3.57Å; W1873-M1907 HydrophobicContact CZ2-CG 3.74Å; W1873-M1907 HydrophobicContact CZ2-SD 4.43Å; A1890-M1907 HydrophobicContact CB-CE 3.36Å; I1898-M1907 HydrophobicContact CD1-CB 3.79Å; I1898-M1907 HydrophobicContact CD1-CG 4.47Å; I1898-M1907 HydrophobicContact CD1-SD 4.1Å; I1898-M1907 HydrophobicContact CG1-CB 4.35Å; I1898-M1907 HydrophobicContact CG1-SD 3.64Å; T1903-M1907 PolarHBondContact O-N 3.45Å; T1903-M1907 VanDerWaalsContact O-N 3.16Å; F1904-M1907 PolarHBondContact O-N 3.49Å; M1907-R1909 PolarHBondContact O-N 2.8Å; M1907-N1910 PolarHBondContact O-N 3.49Å; M1907-A1911 WeakPolarHBondContact O-CB 3.41Å; M1907-A1911 PolarHBondContact O-N 3.32Å; M1907-L1921 HydrophobicContact CE-CD2 4.1Å; M1907-L1921 HydrophobicContact CG-CD1 4.49Å; M1907-L1921 HydrophobicContact CG-CD2 4.08Å; M1907-L1921 HydrophobicContact SD-CD2 3.92Å
1908	S	92	Very high	93.3	Very high	30 Å²	30	39.8 Å²	39.8	21%	0.21	21%	0.21	C	C	.	.	H	α-helix	trans	-59.2	-42.8	177.5	-177.3	0	0	0	0	112.5	F1904 I1906 A1912	F1904-S1908 WeakPolarHBondContact O-CB 3.5Å; F1904-S1908 PolarHBondContact O-N 3.45Å; I1906-S1908 VanDerWaalsContact C-N 3.33Å; I1906-S1908 PolarHBondContact O-N 2.76Å; S1908-A1912 VanDerWaalsContact O-CB 3.25Å; S1908-A1912 WeakPolarHBondContact O-CB 3.42Å; S1908-A1912 PolarHBondContact O-N 2.73Å
1909	R	93	Very high	93.4	Very high	161 Å²	161	40 Å²	40	61%	0.608	21%	0.211	S	C	*	.	H	α-helix	trans	-66	-40.9	175.3	-71.9	176.1	-157.8	151.5	5.9	112.8	N1905 I1906 M1907 A1912 S1913	N1905-R1909 VanDerWaalsContact O-CG 3.29Å; N1905-R1909 WeakPolarHBondContact O-CG 3.02Å; N1905-R1909 PolarHBondContact O-N 3.12Å; I1906-R1909 PolarHBondContact O-N 3.08Å; M1907-R1909 PolarHBondContact O-N 2.8Å; R1909-A1912 PolarHBondContact O-N 3.25Å; R1909-S1913 PolarHBondContact O-N 3.05Å; R1909-S1913 VanDerWaalsContact O-N 3.14Å; R1909-S1913 PolarHBondContact O-OG 2.94Å
1910	N	92.7	Very high	93.4	Very high	36 Å²	36	38.7 Å²	38.7	19%	0.193	20%	0.203	C	C	.	.	H	α-helix	trans	-66.7	-43.3	178.9	-69.5	-2.5	0	0	0	110.7	D1864 I1906 M1907 S1913 K1914	D1864-N1910 PolarHBondContact OD1-ND2 2.78Å; I1906-N1910 PolarHBondContact O-N 3.19Å; M1907-N1910 PolarHBondContact O-N 3.49Å; N1910-S1913 PolarHBondContact O-N 3.36Å; N1910-S1913 PolarHBondContact O-OG 3.22Å; N1910-K1914 VanDerWaalsContact O-CB 3.3Å; N1910-K1914 WeakPolarHBondContact O-CB 3.43Å; N1910-K1914 PolarHBondContact O-N 3.05Å; N1910-K1914 VanDerWaalsContact O-N 3.14Å
1911	A	93.3	Very high	93.5	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-60.5	-50.5	173.9	0	0	0	0	0	111.6	W1873 M1907 S1913 K1914 A1915 Y1919	W1873-A1911 HydrophobicContact CD2-CB 3.77Å; W1873-A1911 HydrophobicContact CE3-CB 3.85Å; W1873-A1911 HydrophobicContact CH2-CB 3.59Å; W1873-A1911 HydrophobicContact CZ2-CB 3.53Å; W1873-A1911 HydrophobicContact CZ3-CB 3.76Å; M1907-A1911 WeakPolarHBondContact O-CB 3.41Å; M1907-A1911 PolarHBondContact O-N 3.32Å; A1911-S1913 PolarHBondContact O-N 2.85Å; A1911-S1913 VanDerWaalsContact O-N 3.15Å; A1911-K1914 PolarHBondContact O-N 2.76Å; A1911-K1914 VanDerWaalsContact O-N 3.17Å; A1911-A1915 WeakPolarHBondContact O-CB 3.48Å; A1911-A1915 PolarHBondContact O-N 3.34Å; A1911-Y1919 HydrophobicContact CB-CD1 4.22Å; A1911-Y1919 HydrophobicContact CB-CD2 3.84Å; A1911-Y1919 HydrophobicContact CB-CE1 3.77Å; A1911-Y1919 HydrophobicContact CB-CE2 3.36Å; A1911-Y1919 HydrophobicContact CB-CG 4.25Å
1912	A	92.1	Very high	93.8	Very high	52 Å²	52	30.5 Å²	30.5	43%	0.43	16%	0.162	S	C	.	.	H	α-helix	trans	-60.8	-28.3	-177.9	0	0	0	0	0	113.6	S1908 R1909 Y1919 G2218	S1908-A1912 VanDerWaalsContact O-CB 3.25Å; S1908-A1912 WeakPolarHBondContact O-CB 3.42Å; S1908-A1912 PolarHBondContact O-N 2.73Å; R1909-A1912 PolarHBondContact O-N 3.25Å; A1912-Y1919 WeakPolarHBondContact CA-OH 3.35Å; A1912-Y1919 PolarHBondContact N-OH 3.22Å; A1912-G2218 WeakPolarHBondContact O-CA 3.38Å
1913	S	93.5	Very high	93.9	Very high	68 Å²	68	25.7 Å²	25.7	48%	0.476	14%	0.136	S	C	.	.	H	α-helix	trans	-93	-16.7	-179.9	54.6	0	0	0	0	114.5	R1909 N1910 A1911 P2217	R1909-S1913 PolarHBondContact O-N 3.05Å; R1909-S1913 VanDerWaalsContact O-N 3.14Å; R1909-S1913 PolarHBondContact O-OG 2.94Å; N1910-S1913 PolarHBondContact O-N 3.36Å; N1910-S1913 PolarHBondContact O-OG 3.22Å; A1911-S1913 PolarHBondContact O-N 2.85Å; A1911-S1913 VanDerWaalsContact O-N 3.15Å; S1913-P2217 CarbonylContact O-C 3.55Å
1914	K	95.9	Very high	93.9	Very high	59 Å²	59	25.2 Å²	25.2	26%	0.257	13%	0.134	S	C	.	.	H	α-helix	trans	-128.2	-23.2	-169.5	-65.8	171.4	177	170.3	0	114.9	D1864 W1873 T1874 N1910 A1911 C1916 P2217	D1864-K1914 IonicContact OD1-NZ 2.88Å; D1864-K1914 IonicContact OD2-NZ 3.26Å; D1864-K1914 PolarHBondContact OD2-NZ 3.48Å; W1873-K1914 HydrophobicContact CB-CB 3.5Å; W1873-K1914 HydrophobicContact CB-CD 4.13Å; W1873-K1914 HydrophobicContact CB-CG 4.5Å; T1874-K1914 PolarHBondContact OG1-O 3.39Å; N1910-K1914 VanDerWaalsContact O-CB 3.3Å; N1910-K1914 WeakPolarHBondContact O-CB 3.43Å; N1910-K1914 PolarHBondContact O-N 3.05Å; N1910-K1914 VanDerWaalsContact O-N 3.14Å; A1911-K1914 PolarHBondContact O-N 2.76Å; A1911-K1914 VanDerWaalsContact O-N 3.17Å; K1914-C1916 PolarHBondContact O-N 3.23Å; K1914-P2217 WeakPolarHBondContact O-CA 3.33Å; K1914-P2217 WeakPolarHBondContact O-CB 3.3Å
1915	A	96.7	Very high	93.8	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.133	C	C	.	.			trans	-66.1	134.5	-175.1	0	0	0	0	0	111.8	W1873 T1877 A1911 Y1919 G2218 F2219 G2220	W1873-A1915 HydrophobicContact CE3-CB 4.17Å; T1877-A1915 HydrophobicContact CG2-CB 4.04Å; A1911-A1915 WeakPolarHBondContact O-CB 3.48Å; A1911-A1915 PolarHBondContact O-N 3.34Å; A1915-Y1919 HydrophobicContact CB-CD1 3.63Å; A1915-Y1919 HydrophobicContact CB-CE1 3.76Å; A1915-G2218 CarbonylContact O-C 3.59Å; A1915-G2218 WeakPolarHBondContact O-CA 3.24Å; A1915-G2218 PolarHBondContact O-N 2.84Å; A1915-F2219 PolarHBondContact O-N 2.89Å; A1915-G2220 PolarHBondContact O-N 2.91Å
1916	C	95.8	Very high	93.7	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	13%	0.128	C	C	.	.	S	Bend	trans	-96.1	-24.4	174	-65.8	0	0	0	0	112.7	T1877 L1881 K1914 V2215	T1877-C1916 WeakPolarHBondContact OG1-CB 3.27Å; T1877-C1916 PolarHBondContact OG1-N 2.95Å; L1881-C1916 HydrophobicContact CD1-CB 3.99Å; K1914-C1916 PolarHBondContact O-N 3.23Å; C1916-V2215 HydrophobicContact CB-CG2 3.92Å
1917	C	94.5	Very high	93.3	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	14%	0.137	C	C	.	.	S	Bend	trans	-116.2	169.8	175.1	77.8	0	0	0	0	110.7	T1877 L1881 V1886 L2202 G2220	T1877-C1917 VanDerWaalsContact CG2-SG 3.57Å; L1881-C1917 HydrophobicContact CD2-CB 3.84Å; L1881-C1917 HydrophobicContact CG-CB 3.98Å; V1886-C1917 WeakPolarHBondContact O-CB 3.4Å; C1917-L2202 HydrophobicContact CB-CD2 4.4Å; C1917-G2220 WeakPolarHBondContact O-CA 3.45Å
1918	D	94.6	Very high	92.9	Very high	14 Å²	14	32.4 Å²	32.4	8%	0.075	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	156.7	178	-74	-18.6	0	0	0	112	V1886 T1887 I1888 R2203 K2221 V2223	V1886-D1918 PolarHBondContact O-N 2.97Å; T1887-D1918 VanDerWaalsContact CA-O 3.25Å; T1887-D1918 WeakPolarHBondContact CA-O 3.49Å; T1887-D1918 HydrophobicContact CG2-CB 4.23Å; I1888-D1918 PolarHBondContact N-O 2.98Å; D1918-R2203 IonicContact OD1-CZ 3.65Å; D1918-R2203 IonicContact OD1-NH1 3.28Å; D1918-R2203 PolarHBondContact OD1-NH1 2.81Å; D1918-R2203 IonicContact OD1-NH2 2.8Å; D1918-R2203 IonicContact OD2-CZ 2.69Å; D1918-R2203 IonicContact OD2-NH1 3.95Å; D1918-R2203 PolarHBondContact OD2-NH1 3.41Å; D1918-K2221 WeakPolarHBondContact CA-O 3.39Å; D1918-K2221 WeakPolarHBondContact OD1-CA 3.49Å; D1918-K2221 WeakPolarHBondContact OD1-CB 3.28Å; D1918-K2221 PolarHBondContact OD1-N 3.4Å; D1918-V2223 HydrophobicContact CB-CG1 3.81Å
1919	Y	95.3	Very high	93	Very high	6 Å²	6	31.3 Å²	31.3	2%	0.024	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	154.4	-175.1	62.9	-90.9	0	0	0	113	W1873 I1888 A1911 A1912 A1915 L1921 K2221 D2222 V2223	W1873-Y1919 HydrophobicContact CH2-CD2 4.19Å; W1873-Y1919 HydrophobicContact CH2-CG 4.27Å; W1873-Y1919 HydrophobicContact CZ3-CD1 4.39Å; W1873-Y1919 HydrophobicContact CZ3-CD2 4.3Å; W1873-Y1919 AromaticContact CZ3-CG 3.93Å; W1873-Y1919 HydrophobicContact CZ3-CG 3.93Å; I1888-Y1919 CarbonylContact O-C 3.54Å; I1888-Y1919 WeakPolarHBondContact O-CA 3.49Å; A1911-Y1919 HydrophobicContact CB-CD1 4.22Å; A1911-Y1919 HydrophobicContact CB-CD2 3.84Å; A1911-Y1919 HydrophobicContact CB-CE1 3.77Å; A1911-Y1919 HydrophobicContact CB-CE2 3.36Å; A1911-Y1919 HydrophobicContact CB-CG 4.25Å; A1912-Y1919 WeakPolarHBondContact CA-OH 3.35Å; A1912-Y1919 PolarHBondContact N-OH 3.22Å; A1915-Y1919 HydrophobicContact CB-CD1 3.63Å; A1915-Y1919 HydrophobicContact CB-CE1 3.76Å; Y1919-L1921 HydrophobicContact CD2-CD2 3.86Å; Y1919-L1921 HydrophobicContact CD2-CG 4.28Å; Y1919-L1921 HydrophobicContact CE2-CD2 4.28Å; Y1919-L1921 HydrophobicContact CE2-CG 4.44Å; Y1919-K2221 PolarHBondContact N-O 3.42Å; Y1919-D2222 HydrophobicContact CD2-CB 4.36Å; Y1919-D2222 HydrophobicContact CE2-CB 3.62Å; Y1919-D2222 CarbonylContact O-C 3.54Å; Y1919-D2222 WeakPolarHBondContact O-CA 3.41Å; Y1919-V2223 WeakPolarHBondContact O-CG2 3.4Å; Y1919-V2223 PolarHBondContact O-N 3.44Å
1920	G	93.3	Very high	92.8	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	153.4	166.7	0	0	0	0	0	110.5	I1888 L1889 A1890	I1888-G1920 PolarHBondContact O-N 3.49Å; L1889-G1920 CarbonylContact C-O 3.49Å; L1889-G1920 WeakPolarHBondContact CA-O 3.37Å; A1890-G1920 PolarHBondContact N-O 3.37Å
1921	L	94.8	Very high	92.6	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	128.9	-171.4	-54.9	-177.5	0	0	0	111.3	W1873 A1890 F1904 M1907 Y1919 A1940 V1941	W1873-L1921 HydrophobicContact CH2-CD2 3.78Å; W1873-L1921 HydrophobicContact CZ2-CD2 4.09Å; A1890-L1921 HydrophobicContact CB-CD2 4.11Å; F1904-L1921 HydrophobicContact CD2-CB 4.44Å; F1904-L1921 HydrophobicContact CE1-CD1 4.18Å; F1904-L1921 HydrophobicContact CE2-CB 3.56Å; F1904-L1921 HydrophobicContact CE2-CD1 4.03Å; F1904-L1921 HydrophobicContact CE2-CG 4.44Å; F1904-L1921 HydrophobicContact CZ-CB 3.87Å; F1904-L1921 HydrophobicContact CZ-CD1 3.79Å; F1904-L1921 HydrophobicContact CZ-CG 4.38Å; M1907-L1921 HydrophobicContact CE-CD2 4.1Å; M1907-L1921 HydrophobicContact CG-CD1 4.49Å; M1907-L1921 HydrophobicContact CG-CD2 4.08Å; M1907-L1921 HydrophobicContact SD-CD2 3.92Å; Y1919-L1921 HydrophobicContact CD2-CD2 3.86Å; Y1919-L1921 HydrophobicContact CD2-CG 4.28Å; Y1919-L1921 HydrophobicContact CE2-CD2 4.28Å; Y1919-L1921 HydrophobicContact CE2-CG 4.44Å; L1921-A1940 VanDerWaalsContact O-CA 3.28Å; L1921-A1940 WeakPolarHBondContact O-CA 3.43Å; L1921-V1941 PolarHBondContact O-N 2.95Å
1922	Y	94.4	Very high	92.4	Very high	1 Å²	1	32.6 Å²	32.6	0%	0.004	18%	0.182	C	C	.	.			trans	-83.3	155.8	166.9	-77.5	-82.9	0	0	0	111.1	I1858 L1889 A1890 M1891 V1941 G1942 C1977 F2129	I1858-Y1922 WeakPolarHBondContact O-CE2 3.34Å; I1858-Y1922 PolarHBondContact O-OH 2.91Å; I1858-Y1922 VanDerWaalsContact O-OH 3.08Å; L1889-Y1922 HydrophobicContact CB-CD2 4.17Å; L1889-Y1922 HydrophobicContact CB-CE2 3.5Å; L1889-Y1922 VanDerWaalsContact CB-CE2 3.5Å; L1889-Y1922 HydrophobicContact CD1-CE2 4.29Å; A1890-Y1922 WeakPolarHBondContact O-CD2 3.24Å; A1890-Y1922 PolarHBondContact O-N 3.35Å; A1890-Y1922 VanDerWaalsContact O-N 3.1Å; M1891-Y1922 HydrophobicContact CE-CD2 3.61Å; M1891-Y1922 HydrophobicContact CE-CE1 4.41Å; M1891-Y1922 HydrophobicContact CE-CE2 3.23Å; M1891-Y1922 HydrophobicContact CE-CG 4.3Å; M1891-Y1922 HydrophobicContact SD-CD2 4.03Å; M1891-Y1922 HydrophobicContact SD-CE2 4.26Å; M1891-Y1922 HydrophobicContact SD-CG 4.41Å; Y1922-V1941 HydrophobicContact CD1-CG2 4Å; Y1922-V1941 HydrophobicContact CD2-CG2 3.95Å; Y1922-V1941 HydrophobicContact CE1-CG2 3.96Å; Y1922-V1941 HydrophobicContact CE2-CG2 3.94Å; Y1922-V1941 HydrophobicContact CG-CG2 4Å; Y1922-G1942 WeakPolarHBondContact CD1-O 2.93Å; Y1922-C1977 HydrophobicContact CE1-CB 4.39Å; Y1922-F2129 HydrophobicContact CE1-CD1 4.44Å; Y1922-F2129 AromaticContact CE1-CE1 3.96Å; Y1922-F2129 HydrophobicContact CE1-CE1 3.96Å; Y1922-F2129 AromaticContact CZ-CE1 3.78Å; Y1922-F2129 WeakPolarHBondContact OH-CE1 3.05Å; Y1922-F2129 VanDerWaalsContact OH-CZ 3.24Å; Y1922-F2129 WeakPolarHBondContact OH-CZ 3.28Å
1923	V	94.2	Very high	92.4	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	140.8	164.6	-175.8	0	0	0	0	108.8	F1904 V1933 L1936 A1940 G1942 L1943 K1944	F1904-V1923 HydrophobicContact CD2-CG2 3.63Å; F1904-V1923 HydrophobicContact CE2-CG2 3.9Å; V1923-V1933 HydrophobicContact CB-CG2 4.15Å; V1923-V1933 HydrophobicContact CG1-CG2 3.31Å; V1923-L1936 HydrophobicContact CG1-CD1 4.09Å; V1923-L1936 HydrophobicContact CG2-CB 4.08Å; V1923-L1936 HydrophobicContact CG2-CD1 4.06Å; V1923-A1940 HydrophobicContact CB-CB 4.42Å; V1923-A1940 HydrophobicContact CG2-CB 3.63Å; V1923-G1942 PolarHBondContact N-O 2.78Å; V1923-L1943 WeakPolarHBondContact O-CA 2.99Å; V1923-K1944 PolarHBondContact O-N 3.07Å
1924	G	93.1	Very high	92	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	139.8	179.2	0	0	0	0	0	112.5	I1898 N1929	I1898-G1924 PolarHBondContact O-N 3.09Å; G1924-N1929 PolarHBondContact O-ND2 3.38Å
1925	A	92.3	Very high	91.5	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	16%	0.163	C	C	.	.			trans	-79.4	134.2	166.4	0	0	0	0	0	110.4	L1943 K1944 M1945 L1956	A1925-L1943 HydrophobicContact CB-CD1 4.03Å; A1925-L1943 HydrophobicContact CB-CD2 4.44Å; A1925-L1943 HydrophobicContact CB-CG 4.26Å; A1925-K1944 PolarHBondContact N-O 3.39Å; A1925-M1945 HydrophobicContact CB-CB 4.35Å; A1925-M1945 HydrophobicContact CB-CG 3.55Å; A1925-L1956 HydrophobicContact CB-CD1 4.03Å
1926	S	89.3	Confident	91.2	Very high	23 Å²	23	29.4 Å²	29.4	16%	0.161	16%	0.164	C	C	.	.			trans	-120.9	173.6	170.6	81.6	0	0	0	0	110.3	E1928 N1929 L1956 H1966	S1926-E1928 PolarHBondContact O-N 2.93Å; S1926-E1928 PolarHBondContact OG-N 3.48Å; S1926-N1929 PolarHBondContact N-OD1 2.8Å; S1926-N1929 PolarHBondContact O-OD1 3.17Å; S1926-N1929 PolarHBondContact OG-N 3.12Å; S1926-N1929 PolarHBondContact OG-OD1 2.8Å; S1926-L1956 WeakPolarHBondContact O-CD2 3.04Å; S1926-H1966 PolarHBondContact O-NE2 3.48Å
1927	S	83.8	Confident	90.7	Very high	63 Å²	63	30.2 Å²	30.2	44%	0.441	17%	0.17	S	C	.	.	S	Bend	trans	-66.1	-11.5	176.2	48	0	0	0	0	114.3
1928	E	86.7	Confident	90.1	Very high	167 Å²	167	35.6 Å²	35.6	78%	0.78	20%	0.195	S	C	*	.	S	Bend	trans	-123.2	-17.1	-168.5	-63.9	176.8	-172	0	0	113.6	S1926	S1926-E1928 PolarHBondContact O-N 2.93Å; S1926-E1928 PolarHBondContact OG-N 3.48Å
1929	N	93.2	Very high	89.7	Confident	8 Å²	8	37.7 Å²	37.7	4%	0.043	20%	0.203	C	C	.	.			trans	-98.1	7	-171.4	76	-16	0	0	0	115.5	V1899 G1924 S1926 F1931 T1932 V1933 H1966	V1899-N1929 PolarHBondContact O-ND2 2.9Å; G1924-N1929 PolarHBondContact O-ND2 3.38Å; S1926-N1929 PolarHBondContact N-OD1 2.8Å; S1926-N1929 PolarHBondContact O-OD1 3.17Å; S1926-N1929 PolarHBondContact OG-N 3.12Å; S1926-N1929 PolarHBondContact OG-OD1 2.8Å; N1929-F1931 PolarHBondContact O-N 3.35Å; N1929-T1932 WeakPolarHBondContact CA-OG1 3.33Å; N1929-T1932 PolarHBondContact O-N 3.01Å; N1929-T1932 PolarHBondContact O-OG1 3.04Å; N1929-V1933 HydrophobicContact CB-CB 4.33Å; N1929-V1933 VanDerWaalsContact O-CB 3.25Å; N1929-V1933 WeakPolarHBondContact O-CB 3.18Å; N1929-V1933 VanDerWaalsContact O-CG1 3.3Å; N1929-V1933 WeakPolarHBondContact O-CG1 3.33Å; N1929-V1933 PolarHBondContact O-N 2.91Å; N1929-H1966 PolarHBondContact OD1-CE1 3.46Å
1930	A	88.7	Confident	89.5	Confident	3 Å²	3	37.4 Å²	37.4	3%	0.025	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.4	-32.1	-176.9	0	0	0	0	0	114.5	Q1965 H1966 N1969	A1930-Q1965 HydrophobicContact CB-CB 3.86Å; A1930-H1966 WeakPolarHBondContact CA-CE1 3.34Å; A1930-H1966 PolarHBondContact N-CE1 3.34Å; A1930-N1969 VanDerWaalsContact O-CB 3.23Å; A1930-N1969 WeakPolarHBondContact O-CB 3.36Å
1931	F	88.8	Confident	89.4	Confident	135 Å²	135	37.4 Å²	37.4	59%	0.592	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.5	-15.8	179.7	-60.5	-79.2	0	0	0	114.2	N1929 Q1965 N1969	N1929-F1931 PolarHBondContact O-N 3.35Å; F1931-Q1965 HydrophobicContact CZ-CG 4.24Å; F1931-N1969 WeakPolarHBondContact CD1-ND2 3.4Å; F1931-N1969 WeakPolarHBondContact CE1-ND2 3.46Å
1932	T	89	Confident	89.2	Confident	85 Å²	85	37.4 Å²	37.4	52%	0.521	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.9	-32.3	-176.7	54	0	0	0	0	112.4	N1929 S1934 S1935	N1929-T1932 WeakPolarHBondContact CA-OG1 3.33Å; N1929-T1932 PolarHBondContact O-N 3.01Å; N1929-T1932 PolarHBondContact O-OG1 3.04Å; T1932-S1934 VanDerWaalsContact C-N 3.27Å; T1932-S1934 PolarHBondContact O-N 3.03Å; T1932-S1935 WeakPolarHBondContact O-CB 3.14Å; T1932-S1935 PolarHBondContact O-N 3.44Å; T1932-S1935 VanDerWaalsContact O-N 3.15Å; T1932-S1935 PolarHBondContact O-OG 3.08Å
1933	V	91.8	Very high	89.3	Confident	3 Å²	3	37.3 Å²	37.3	2%	0.018	20%	0.202	C	C	.	.	G	3₁₀ helix	trans	-63.5	-31.8	-173.7	75.7	0	0	0	0	112.8	V1923 N1929 S1935 L1936 L1943 W1970	V1923-V1933 HydrophobicContact CB-CG2 4.15Å; V1923-V1933 HydrophobicContact CG1-CG2 3.31Å; N1929-V1933 HydrophobicContact CB-CB 4.33Å; N1929-V1933 VanDerWaalsContact O-CB 3.25Å; N1929-V1933 WeakPolarHBondContact O-CB 3.18Å; N1929-V1933 VanDerWaalsContact O-CG1 3.3Å; N1929-V1933 WeakPolarHBondContact O-CG1 3.33Å; N1929-V1933 PolarHBondContact O-N 2.91Å; V1933-S1935 PolarHBondContact O-N 2.96Å; V1933-S1935 VanDerWaalsContact O-N 3.1Å; V1933-L1936 WeakPolarHBondContact O-CB 3.18Å; V1933-L1936 PolarHBondContact O-N 3.43Å; V1933-L1943 HydrophobicContact CG1-CD1 4.13Å; V1933-L1943 HydrophobicContact CG2-CD1 3.83Å; V1933-W1970 HydrophobicContact CB-CZ3 4.41Å; V1933-W1970 HydrophobicContact CG1-CE3 4Å; V1933-W1970 HydrophobicContact CG1-CZ3 3.98Å; V1933-W1970 HydrophobicContact CG2-CZ3 4.03Å; V1933-W1970 WeakPolarHBondContact O-CZ3 3.3Å
1934	S	85.9	Confident	89.3	Confident	36 Å²	36	37.3 Å²	37.3	25%	0.252	20%	0.202	S	C	.	.	G	3₁₀ helix	trans	-58.6	-24.4	177.8	59.1	0	0	0	0	112.9	T1932 L1936 S1937 N1969	T1932-S1934 VanDerWaalsContact C-N 3.27Å; T1932-S1934 PolarHBondContact O-N 3.03Å; S1934-L1936 PolarHBondContact O-N 3.48Å; S1934-S1937 VanDerWaalsContact O-CB 3.26Å; S1934-S1937 WeakPolarHBondContact O-CB 3.33Å; S1934-S1937 PolarHBondContact O-N 3.22Å; S1934-S1937 PolarHBondContact O-OG 3.13Å; S1934-N1969 WeakPolarHBondContact CB-O 3.42Å
1935	S	86.1	Confident	89.2	Confident	70 Å²	70	37.4 Å²	37.4	49%	0.49	20%	0.202	S	C	.	.	G	3₁₀ helix	trans	-62.6	-26.5	173	67.9	0	0	0	0	113.2	T1932 V1933 H1938	T1932-S1935 WeakPolarHBondContact O-CB 3.14Å; T1932-S1935 PolarHBondContact O-N 3.44Å; T1932-S1935 VanDerWaalsContact O-N 3.15Å; T1932-S1935 PolarHBondContact O-OG 3.08Å; V1933-S1935 PolarHBondContact O-N 2.96Å; V1933-S1935 VanDerWaalsContact O-N 3.1Å; S1935-H1938 PolarHBondContact O-CE1 3.25Å; S1935-H1938 PolarHBondContact O-ND1 3.45Å
1936	L	88.8	Confident	88.9	Confident	3 Å²	3	37.5 Å²	37.5	2%	0.016	20%	0.202	C	C	.	.	G	3₁₀ helix	trans	-89.4	-7.7	178.8	-64.4	171.3	0	0	0	113.7	E1901 F1904 V1923 V1933 S1934 H1938 K1939 A1940	E1901-L1936 HydrophobicContact CB-CD2 3.94Å; E1901-L1936 HydrophobicContact CG-CD2 4.14Å; F1904-L1936 HydrophobicContact CB-CD1 4.46Å; V1923-L1936 HydrophobicContact CG1-CD1 4.09Å; V1923-L1936 HydrophobicContact CG2-CB 4.08Å; V1923-L1936 HydrophobicContact CG2-CD1 4.06Å; V1933-L1936 WeakPolarHBondContact O-CB 3.18Å; V1933-L1936 PolarHBondContact O-N 3.43Å; S1934-L1936 PolarHBondContact O-N 3.48Å; L1936-H1938 PolarHBondContact O-N 3.16Å; L1936-K1939 CarbonylContact O-C 3.6Å; L1936-K1939 WeakPolarHBondContact O-CA 3.01Å; L1936-K1939 PolarHBondContact O-N 3.14Å; L1936-A1940 PolarHBondContact O-N 2.82Å
1937	S	85.8	Confident	88.5	Confident	18 Å²	18	36.4 Å²	36.4	13%	0.126	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-24.6	-175.3	61.1	0	0	0	0	115	S1934 P1971 R1974	S1934-S1937 VanDerWaalsContact O-CB 3.26Å; S1934-S1937 WeakPolarHBondContact O-CB 3.33Å; S1934-S1937 PolarHBondContact O-N 3.22Å; S1934-S1937 PolarHBondContact O-OG 3.13Å; S1937-P1971 WeakPolarHBondContact OG-CG 3.28Å; S1937-R1974 PolarHBondContact O-NE 2.84Å
1938	H	82.4	Confident	87.8	Confident	113 Å²	113	35.7 Å²	35.7	52%	0.523	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-21.1	175.1	68.6	-81.2	0	0	0	113.3	S1935 L1936	S1935-H1938 PolarHBondContact O-CE1 3.25Å; S1935-H1938 PolarHBondContact O-ND1 3.45Å; L1936-H1938 PolarHBondContact O-N 3.16Å
1939	K	86.4	Confident	86.4	Confident	57 Å²	57	36.6 Å²	36.6	25%	0.248	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.7	-16.9	175.2	-55.3	180	-178.3	172.9	0	112.6	E1901 F1904 L1936 S2224	E1901-K1939 IonicContact OE1-NZ 2.65Å; E1901-K1939 PolarHBondContact OE1-NZ 2.9Å; F1904-K1939 HydrophobicContact CD1-CD 4.45Å; F1904-K1939 HydrophobicContact CE1-CB 3.7Å; F1904-K1939 HydrophobicContact CE1-CD 4.05Å; F1904-K1939 HydrophobicContact CE1-CG 4.5Å; F1904-K1939 HydrophobicContact CZ-CB 3.65Å; F1904-K1939 WeakPolarHBondContact CZ-O 3.27Å; L1936-K1939 CarbonylContact O-C 3.6Å; L1936-K1939 WeakPolarHBondContact O-CA 3.01Å; L1936-K1939 PolarHBondContact O-N 3.14Å; K1939-S2224 WeakPolarHBondContact O-CB 3.4Å; K1939-S2224 PolarHBondContact O-OG 3.15Å
1940	A	90.4	Very high	84.6	Confident	0 Å²	0	38 Å²	38	0%	0	20%	0.199	C	C	.	.			trans	-102.2	146.6	-175.6	0	0	0	0	0	111.9	F1904 L1921 V1923 L1936 G1942 W1970	F1904-A1940 HydrophobicContact CE2-CB 4.39Å; L1921-A1940 VanDerWaalsContact O-CA 3.28Å; L1921-A1940 WeakPolarHBondContact O-CA 3.43Å; V1923-A1940 HydrophobicContact CB-CB 4.42Å; V1923-A1940 HydrophobicContact CG2-CB 3.63Å; L1936-A1940 PolarHBondContact O-N 2.82Å; A1940-G1942 VanDerWaalsContact C-N 3.31Å; A1940-W1970 HydrophobicContact CB-CH2 4.43Å
1941	V	90.5	Very high	83.1	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	23%	0.229	C	C	.	.	S	Bend	trans	-75.7	-21.3	174.8	-63.4	0	0	0	0	112.9	L1889 L1921 Y1922 F2129	L1889-V1941 HydrophobicContact CB-CG2 4.38Å; L1889-V1941 HydrophobicContact CD1-CB 4.44Å; L1889-V1941 HydrophobicContact CD1-CG2 4.07Å; L1889-V1941 HydrophobicContact CD2-CG1 4.06Å; L1889-V1941 HydrophobicContact CD2-CG2 4.27Å; L1889-V1941 HydrophobicContact CG-CG2 4.48Å; L1921-V1941 PolarHBondContact O-N 2.95Å; Y1922-V1941 HydrophobicContact CD1-CG2 4Å; Y1922-V1941 HydrophobicContact CD2-CG2 3.95Å; Y1922-V1941 HydrophobicContact CE1-CG2 3.96Å; Y1922-V1941 HydrophobicContact CE2-CG2 3.94Å; Y1922-V1941 HydrophobicContact CG-CG2 4Å; V1941-F2129 HydrophobicContact CB-CD1 4.49Å
1942	G	92.6	Very high	81.8	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.205	C	C	.	.			trans	179.1	173.1	177.9	0	0	0	0	0	112.6	Y1922 V1923 A1940 P1975	Y1922-G1942 WeakPolarHBondContact CD1-O 2.93Å; V1923-G1942 PolarHBondContact N-O 2.78Å; A1940-G1942 VanDerWaalsContact C-N 3.31Å; G1942-P1975 WeakPolarHBondContact CA-O 3.31Å
1943	L	95.1	Very high	80.6	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	122.8	174.2	179.2	70	0	0	0	109.7	V1923 A1925 V1933 M1945 H1966 W1970 P1975 C1977	V1923-L1943 WeakPolarHBondContact O-CA 2.99Å; A1925-L1943 HydrophobicContact CB-CD1 4.03Å; A1925-L1943 HydrophobicContact CB-CD2 4.44Å; A1925-L1943 HydrophobicContact CB-CG 4.26Å; V1933-L1943 HydrophobicContact CG1-CD1 4.13Å; V1933-L1943 HydrophobicContact CG2-CD1 3.83Å; L1943-M1945 HydrophobicContact CD2-CG 4.4Å; L1943-M1945 HydrophobicContact CG-CG 4.44Å; L1943-H1966 HydrophobicContact CD2-CB 4.11Å; L1943-W1970 HydrophobicContact CB-CD2 3.63Å; L1943-W1970 VanDerWaalsContact CB-CE2 3.48Å; L1943-W1970 HydrophobicContact CB-CE3 3.98Å; L1943-W1970 HydrophobicContact CB-CG 4.14Å; L1943-W1970 HydrophobicContact CB-CH2 4.05Å; L1943-W1970 HydrophobicContact CB-CZ2 3.73Å; L1943-W1970 HydrophobicContact CB-CZ3 4.17Å; L1943-W1970 HydrophobicContact CD1-CE3 4.27Å; L1943-W1970 HydrophobicContact CD1-CZ3 4.15Å; L1943-W1970 HydrophobicContact CD2-CB 4.28Å; L1943-W1970 HydrophobicContact CD2-CD2 4Å; L1943-W1970 HydrophobicContact CD2-CE3 4Å; L1943-W1970 HydrophobicContact CD2-CG 4.12Å; L1943-W1970 HydrophobicContact CG-CD2 4.33Å; L1943-W1970 HydrophobicContact CG-CE3 4.32Å; L1943-P1975 PolarHBondContact N-O 3.4Å; L1943-C1977 PolarHBondContact O-N 3.46Å
1944	K	94.3	Very high	80	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	121	176.1	-177.2	70.2	-179.5	-147.3	0	110.9	H1859 M1891 P1892 V1923 A1925 Y1946 C1977 H1979 C2002	H1859-K1944 PolarHBondContact CE1-NZ 2.95Å; H1859-K1944 PolarHBondContact NE2-NZ 2.9Å; M1891-K1944 HydrophobicContact CE-CD 4.44Å; M1891-K1944 HydrophobicContact SD-CD 3.83Å; M1891-K1944 HydrophobicContact SD-CG 4.02Å; P1892-K1944 HydrophobicContact CG-CB 3.86Å; P1892-K1944 HydrophobicContact CG-CG 4.31Å; V1923-K1944 PolarHBondContact O-N 3.07Å; A1925-K1944 PolarHBondContact N-O 3.39Å; K1944-Y1946 HydrophobicContact CB-CE2 4.44Å; K1944-Y1946 HydrophobicContact CG-CD2 4.23Å; K1944-Y1946 HydrophobicContact CG-CE1 4.31Å; K1944-Y1946 HydrophobicContact CG-CE2 3.58Å; K1944-C1977 HydrophobicContact CD-CB 3.96Å; K1944-H1979 WeakPolarHBondContact CE-NE2 3.02Å; K1944-H1979 PolarHBondContact NZ-CD2 2.85Å; K1944-H1979 VanDerWaalsContact NZ-CD2 3.34Å; K1944-H1979 PolarHBondContact NZ-NE2 2.87Å; K1944-C2002 PolarHBondContact NZ-SG 3Å
1945	M	91.3	Very high	79.7	Confident	1 Å²	1	42.2 Å²	42.2	1%	0.005	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	128.1	175.9	-67.5	174.2	66.2	0	0	111.1	A1925 L1943 L1947 L1956 W1963 H1966 F1967 I1976 C1977	A1925-M1945 HydrophobicContact CB-CB 4.35Å; A1925-M1945 HydrophobicContact CB-CG 3.55Å; L1943-M1945 HydrophobicContact CD2-CG 4.4Å; L1943-M1945 HydrophobicContact CG-CG 4.44Å; M1945-L1947 HydrophobicContact CB-CD2 3.99Å; M1945-L1947 HydrophobicContact CE-CD2 3.96Å; M1945-L1956 HydrophobicContact CB-CD1 4.12Å; M1945-L1956 HydrophobicContact CE-CD1 3.64Å; M1945-L1956 HydrophobicContact CG-CD1 4.13Å; M1945-W1963 HydrophobicContact CE-CB 3.8Å; M1945-W1963 HydrophobicContact CE-CG 3.96Å; M1945-H1966 HydrophobicContact CE-CB 4.22Å; M1945-H1966 HydrophobicContact SD-CB 4.06Å; M1945-F1967 HydrophobicContact CE-CD2 4.32Å; M1945-F1967 HydrophobicContact CE-CE2 4.07Å; M1945-F1967 HydrophobicContact SD-CD2 4.11Å; M1945-F1967 HydrophobicContact SD-CE2 3.78Å; M1945-I1976 HydrophobicContact CG-CG2 4.12Å; M1945-I1976 HydrophobicContact SD-CG2 3.4Å; M1945-I1976 WeakPolarHBondContact SD-CG2 3.42Å; M1945-C1977 PolarHBondContact N-O 3.2Å
1946	Y	86.5	Confident	79.6	Confident	2 Å²	2	39.1 Å²	39.1	1%	0.008	21%	0.206	C	C	.	.	B	Isolated β-bridge	trans	-104.7	105.3	177.5	-67.6	-80.2	0	0	0	109	P1892 K1944 T1950 T1952 L1954 S1955 L1956 H1979	P1892-Y1946 HydrophobicContact CG-CE2 4.36Å; K1944-Y1946 HydrophobicContact CB-CE2 4.44Å; K1944-Y1946 HydrophobicContact CG-CD2 4.23Å; K1944-Y1946 HydrophobicContact CG-CE1 4.31Å; K1944-Y1946 HydrophobicContact CG-CE2 3.58Å; Y1946-T1950 HydrophobicContact CD1-CG2 3.89Å; Y1946-T1950 HydrophobicContact CG-CG2 4.2Å; Y1946-T1952 HydrophobicContact CD1-CG2 3.98Å; Y1946-T1952 HydrophobicContact CE1-CG2 3.8Å; Y1946-T1952 HydrophobicContact CE2-CG2 4.34Å; Y1946-T1952 HydrophobicContact CG-CG2 4.32Å; Y1946-L1954 HydrophobicContact CD2-CB 3.6Å; Y1946-L1954 HydrophobicContact CD2-CD1 3.96Å; Y1946-L1954 HydrophobicContact CD2-CG 4.45Å; Y1946-L1954 HydrophobicContact CE2-CB 4.17Å; Y1946-L1954 HydrophobicContact CE2-CD1 3.68Å; Y1946-L1954 HydrophobicContact CG-CB 4.38Å; Y1946-S1955 WeakPolarHBondContact O-CA 3.36Å; Y1946-L1956 PolarHBondContact O-N 3.09Å; Y1946-H1979 AromaticContact CD1-CE1 3.66Å; Y1946-H1979 AromaticContact CD1-NE2 3.96Å; Y1946-H1979 AromaticContact CE1-CE1 3.8Å; Y1946-H1979 AromaticContact CE1-NE2 3.79Å
1947	L	80.7	Confident	78.8	Confident	1 Å²	1	40 Å²	40	1%	0.005	22%	0.216	C	C	.	.			trans	-88.7	-37.4	-163.6	-56.1	-178.1	0	0	0	114.8	M1945 L1956 G1957 W1963 C1978 V1988	M1945-L1947 HydrophobicContact CB-CD2 3.99Å; M1945-L1947 HydrophobicContact CE-CD2 3.96Å; L1947-L1956 HydrophobicContact CD2-CD1 4.47Å; L1947-G1957 CarbonylContact O-C 3.6Å; L1947-G1957 WeakPolarHBondContact O-CA 3.4Å; L1947-G1957 PolarHBondContact O-N 2.92Å; L1947-W1963 HydrophobicContact CB-CH2 4Å; L1947-W1963 HydrophobicContact CB-CZ2 3.71Å; L1947-W1963 HydrophobicContact CD1-CH2 4.14Å; L1947-W1963 HydrophobicContact CD1-CZ2 4.44Å; L1947-W1963 HydrophobicContact CD1-CZ3 4.24Å; L1947-W1963 HydrophobicContact CD2-CD2 3.88Å; L1947-W1963 HydrophobicContact CD2-CE3 4.33Å; L1947-W1963 HydrophobicContact CD2-CG 4.3Å; L1947-W1963 HydrophobicContact CD2-CH2 4.29Å; L1947-W1963 HydrophobicContact CD2-CZ2 3.82Å; L1947-W1963 HydrophobicContact CG-CH2 4.36Å; L1947-W1963 HydrophobicContact CG-CZ2 4.18Å; L1947-C1978 HydrophobicContact CD1-CB 4.09Å; L1947-V1988 HydrophobicContact CD1-CG2 3.38Å
1948	N	68.4	Low	78.1	Confident	47 Å²	47	45 Å²	45	25%	0.251	24%	0.241	S	C	.	.	S	Bend	trans	-111.2	-166.6	174.7	-68.9	-55.2	0	0	0	112.7	T1950 S1955 E1981 T1984	N1948-T1950 WeakPolarHBondContact O-CG2 3.21Å; N1948-T1950 PolarHBondContact O-N 3.02Å; N1948-T1950 VanDerWaalsContact O-N 3.17Å; N1948-S1955 WeakPolarHBondContact O-CB 3.19Å; N1948-S1955 PolarHBondContact O-OG 3.48Å; N1948-E1981 WeakPolarHBondContact CB-OE2 3.43Å; N1948-E1981 PolarHBondContact ND2-OE2 2.78Å; N1948-T1984 WeakPolarHBondContact ND2-CG2 3.47Å
1949	E	58	Low	77.8	Confident	187 Å²	187	45.4 Å²	45.4	87%	0.874	24%	0.241	S	C	*	.			trans	-58.9	113.4	172.2	-74.3	-172.4	175.7	0	0	110.9
1950	T	56.1	Low	77.5	Confident	37 Å²	37	47 Å²	47	23%	0.227	25%	0.252	C	S	.	.			trans	-129.7	163.1	172.8	127.1	0	0	0	0	108	Y1946 N1948 T1952	Y1946-T1950 HydrophobicContact CD1-CG2 3.89Å; Y1946-T1950 HydrophobicContact CG-CG2 4.2Å; N1948-T1950 WeakPolarHBondContact O-CG2 3.21Å; N1948-T1950 PolarHBondContact O-N 3.02Å; N1948-T1950 VanDerWaalsContact O-N 3.17Å; T1950-T1952 PolarHBondContact O-N 3.1Å; T1950-T1952 WeakPolarHBondContact OG1-CG2 3.42Å; T1950-T1952 PolarHBondContact OG1-N 2.71Å; T1950-T1952 PolarHBondContact OG1-OG1 3.23Å
1951	F	56.9	Low	77.2	Confident	147 Å²	147	53.1 Å²	53.1	65%	0.645	29%	0.285	S	S	*	.	S	Bend	trans	-70.8	21.4	177.2	-120.8	-95.2	0	0	0	113.6	P2090 P2091	F1951-P2090 HydrophobicContact CE1-CB 4.4Å; F1951-P2091 HydrophobicContact CB-CG 4.32Å; F1951-P2091 VanDerWaalsContact CD2-CD 3.41Å; F1951-P2091 HydrophobicContact CD2-CG 3.98Å; F1951-P2091 HydrophobicContact CG-CG 4.41Å
1952	T	60.1	Low	77	Confident	16 Å²	16	54.3 Å²	54.3	10%	0.098	29%	0.291	C	S	.	.	S	Bend	trans	-110.5	154.6	-178.2	79.1	0	0	0	0	110.8	N1893 Y1946 T1950 L1954	N1893-T1952 HydrophobicContact CB-CG2 3.79Å; N1893-T1952 WeakPolarHBondContact ND2-CG2 3.42Å; N1893-T1952 WeakPolarHBondContact OD1-CB 3.28Å; N1893-T1952 WeakPolarHBondContact OD1-CG2 3.47Å; Y1946-T1952 HydrophobicContact CD1-CG2 3.98Å; Y1946-T1952 HydrophobicContact CE1-CG2 3.8Å; Y1946-T1952 HydrophobicContact CE2-CG2 4.34Å; Y1946-T1952 HydrophobicContact CG-CG2 4.32Å; T1950-T1952 PolarHBondContact O-N 3.1Å; T1950-T1952 WeakPolarHBondContact OG1-CG2 3.42Å; T1950-T1952 PolarHBondContact OG1-N 2.71Å; T1950-T1952 PolarHBondContact OG1-OG1 3.23Å; T1952-L1954 PolarHBondContact O-N 2.9Å; T1952-L1954 PolarHBondContact OG1-N 3.46Å
1953	C	64.4	Low	76.8	Confident	131 Å²	131	54.4 Å²	54.4	89%	0.885	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	5.8	166.1	-61.4	0	0	0	0	113.4
1954	L	79.1	Confident	76.5	Confident	7 Å²	7	60.2 Å²	60.2	4%	0.037	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.6	6.7	-171.2	-62.4	178.6	0	0	0	114.1	P1892 A1897 V1899 Y1946 T1952 L1956	P1892-L1954 HydrophobicContact CG-CD1 4.41Å; A1897-L1954 HydrophobicContact CB-CD1 4.01Å; A1897-L1954 HydrophobicContact CB-CD2 3.8Å; A1897-L1954 HydrophobicContact CB-CG 3.93Å; V1899-L1954 HydrophobicContact CG1-CD2 3.29Å; Y1946-L1954 HydrophobicContact CD2-CB 3.6Å; Y1946-L1954 HydrophobicContact CD2-CD1 3.96Å; Y1946-L1954 HydrophobicContact CD2-CG 4.45Å; Y1946-L1954 HydrophobicContact CE2-CB 4.17Å; Y1946-L1954 HydrophobicContact CE2-CD1 3.68Å; Y1946-L1954 HydrophobicContact CG-CB 4.38Å; T1952-L1954 PolarHBondContact O-N 2.9Å; T1952-L1954 PolarHBondContact OG1-N 3.46Å; L1954-L1956 PolarHBondContact O-N 2.85Å
1955	S	80.1	Confident	76.3	Confident	50 Å²	50	63.5 Å²	63.5	35%	0.35	33%	0.329	S	S	.	.	B	Isolated β-bridge	trans	-60.6	123	179.2	-176.4	0	0	0	0	111.1	Y1946 N1948	Y1946-S1955 WeakPolarHBondContact O-CA 3.36Å; N1948-S1955 WeakPolarHBondContact O-CB 3.19Å; N1948-S1955 PolarHBondContact O-OG 3.48Å
1956	L	83.1	Confident	76.4	Confident	4 Å²	4	63.4 Å²	63.4	2%	0.021	33%	0.328	C	S	.	.			trans	-82.9	-17.6	176.8	-60.7	177.8	0	0	0	112.1	A1925 S1926 M1945 Y1946 L1947 L1954 I1962	A1925-L1956 HydrophobicContact CB-CD1 4.03Å; S1926-L1956 WeakPolarHBondContact O-CD2 3.04Å; M1945-L1956 HydrophobicContact CB-CD1 4.12Å; M1945-L1956 HydrophobicContact CE-CD1 3.64Å; M1945-L1956 HydrophobicContact CG-CD1 4.13Å; Y1946-L1956 PolarHBondContact O-N 3.09Å; L1947-L1956 HydrophobicContact CD2-CD1 4.47Å; L1954-L1956 PolarHBondContact O-N 2.85Å; L1956-I1962 HydrophobicContact CD2-CG2 4.19Å
1957	G	72.8	Confident	76.6	Confident	23 Å²	23	63.4 Å²	63.4	24%	0.237	33%	0.328	C	S	.	.			trans	57.3	-173.7	-169.2	0	0	0	0	0	112.9	L1947 K1959 W1963	L1947-G1957 CarbonylContact O-C 3.6Å; L1947-G1957 WeakPolarHBondContact O-CA 3.4Å; L1947-G1957 PolarHBondContact O-N 2.92Å; G1957-K1959 PolarHBondContact O-N 2.9Å; G1957-W1963 WeakPolarHBondContact O-CZ2 3.13Å; G1957-W1963 PolarHBondContact O-NE1 3.25Å
1958	N	70.6	Confident	77	Confident	122 Å²	122	67.4 Å²	67.4	65%	0.652	35%	0.347	S	S	*	.	S	Bend	trans	-74	49.4	178.5	-75.1	-25.7	0	0	0	113.8
1959	K	75.8	Confident	78.1	Confident	121 Å²	121	67.9 Å²	67.9	53%	0.526	35%	0.35	S	S	.	.			trans	-102.7	76.9	179.9	-65.1	179.5	-176.4	171.5	0	110.5	G1957 N1961 I1962 W1963	G1957-K1959 PolarHBondContact O-N 2.9Å; K1959-N1961 PolarHBondContact O-N 3.01Å; K1959-I1962 HydrophobicContact CB-CB 4.27Å; K1959-I1962 HydrophobicContact CB-CD1 3.94Å; K1959-I1962 HydrophobicContact CB-CG1 4.08Å; K1959-I1962 HydrophobicContact CD-CD1 3.53Å; K1959-I1962 HydrophobicContact CD-CG1 4.49Å; K1959-I1962 HydrophobicContact CG-CD1 4.39Å; K1959-I1962 PolarHBondContact O-N 3.34Å; K1959-W1963 PolarHBondContact O-N 3.38Å
1960	L	81.6	Confident	79.7	Confident	90 Å²	90	59.1 Å²	59.1	47%	0.471	31%	0.308	S	S	.	.	H	α-helix	trans	-51.7	-32.6	-176.6	-121.2	116.2	0	0	0	114.2	W1963 R1964	L1960-W1963 HydrophobicContact CG-CE3 4.36Å; L1960-W1963 PolarHBondContact O-N 3.2Å; L1960-R1964 WeakPolarHBondContact O-CB 3.28Å; L1960-R1964 PolarHBondContact O-N 3.48Å
1961	N	83.1	Confident	81.1	Confident	130 Å²	130	58.8 Å²	58.8	70%	0.695	31%	0.307	S	S	*	.	H	α-helix	trans	-63.4	-40.2	176	-70.3	-17.7	0	0	0	112.8	K1959 Q1965	K1959-N1961 PolarHBondContact O-N 3.01Å; N1961-Q1965 WeakPolarHBondContact O-CG 3.37Å; N1961-Q1965 PolarHBondContact O-N 2.7Å
1962	I	85.7	Confident	82.2	Confident	24 Å²	24	54.5 Å²	54.5	12%	0.123	30%	0.295	C	S	.	.	H	α-helix	trans	-70.1	-40.5	177.6	-62	-178	0	0	0	109.5	L1956 K1959 R1964 Q1965 H1966	L1956-I1962 HydrophobicContact CD2-CG2 4.19Å; K1959-I1962 HydrophobicContact CB-CB 4.27Å; K1959-I1962 HydrophobicContact CB-CD1 3.94Å; K1959-I1962 HydrophobicContact CB-CG1 4.08Å; K1959-I1962 HydrophobicContact CD-CD1 3.53Å; K1959-I1962 HydrophobicContact CD-CG1 4.49Å; K1959-I1962 HydrophobicContact CG-CD1 4.39Å; K1959-I1962 PolarHBondContact O-N 3.34Å; I1962-R1964 VanDerWaalsContact C-N 3.34Å; I1962-R1964 PolarHBondContact O-N 2.96Å; I1962-Q1965 PolarHBondContact O-N 3.31Å; I1962-H1966 PolarHBondContact O-CD2 3.19Å; I1962-H1966 PolarHBondContact O-N 3.32Å; I1962-H1966 VanDerWaalsContact O-N 3.1Å
1963	W	89.3	Confident	83.1	Confident	3 Å²	3	58.2 Å²	58.2	1%	0.011	32%	0.315	C	S	.	.	H	α-helix	trans	-60.5	-47.8	176.7	-56.7	0.9	0	0	0	110.3	M1945 L1947 G1957 K1959 L1960 Q1965 H1966 F1967 T1984 A1987 L1991	M1945-W1963 HydrophobicContact CE-CB 3.8Å; M1945-W1963 HydrophobicContact CE-CG 3.96Å; L1947-W1963 HydrophobicContact CB-CH2 4Å; L1947-W1963 HydrophobicContact CB-CZ2 3.71Å; L1947-W1963 HydrophobicContact CD1-CH2 4.14Å; L1947-W1963 HydrophobicContact CD1-CZ2 4.44Å; L1947-W1963 HydrophobicContact CD1-CZ3 4.24Å; L1947-W1963 HydrophobicContact CD2-CD2 3.88Å; L1947-W1963 HydrophobicContact CD2-CE3 4.33Å; L1947-W1963 HydrophobicContact CD2-CG 4.3Å; L1947-W1963 HydrophobicContact CD2-CH2 4.29Å; L1947-W1963 HydrophobicContact CD2-CZ2 3.82Å; L1947-W1963 HydrophobicContact CG-CH2 4.36Å; L1947-W1963 HydrophobicContact CG-CZ2 4.18Å; G1957-W1963 WeakPolarHBondContact O-CZ2 3.13Å; G1957-W1963 PolarHBondContact O-NE1 3.25Å; K1959-W1963 PolarHBondContact O-N 3.38Å; L1960-W1963 HydrophobicContact CG-CE3 4.36Å; L1960-W1963 PolarHBondContact O-N 3.2Å; W1963-Q1965 VanDerWaalsContact C-N 3.32Å; W1963-Q1965 PolarHBondContact O-N 3.09Å; W1963-H1966 PolarHBondContact O-N 2.79Å; W1963-H1966 VanDerWaalsContact O-N 3.16Å; W1963-F1967 VanDerWaalsContact O-CD2 3.24Å; W1963-F1967 WeakPolarHBondContact O-CD2 3.41Å; W1963-F1967 PolarHBondContact O-N 3.09Å; W1963-T1984 HydrophobicContact CH2-CG2 4.29Å; W1963-A1987 HydrophobicContact CZ3-CB 4.17Å; W1963-L1991 HydrophobicContact CB-CD1 3.82Å; W1963-L1991 HydrophobicContact CE3-CD1 4.22Å
1964	R	88.1	Confident	84	Confident	121 Å²	121	52.8 Å²	52.8	46%	0.457	28%	0.276	S	S	.	.	H	α-helix	trans	-57.1	-42.5	175.7	-176.3	177.1	177.7	173.2	2.5	112.4	L1960 I1962 H1966 F1967 E1968 L1991	L1960-R1964 WeakPolarHBondContact O-CB 3.28Å; L1960-R1964 PolarHBondContact O-N 3.48Å; I1962-R1964 VanDerWaalsContact C-N 3.34Å; I1962-R1964 PolarHBondContact O-N 2.96Å; R1964-H1966 PolarHBondContact O-N 3.43Å; R1964-F1967 PolarHBondContact O-N 2.61Å; R1964-E1968 HydrophobicContact CG-CG 4.25Å; R1964-E1968 IonicContact CZ-OE1 3.9Å; R1964-E1968 IonicContact NE-OE1 2.87Å; R1964-E1968 PolarHBondContact NE-OE1 3.4Å; R1964-E1968 IonicContact NH2-OE1 2.82Å; R1964-E1968 PolarHBondContact NH2-OE1 3.36Å; R1964-E1968 VanDerWaalsContact NH2-OE1 3.09Å; R1964-E1968 WeakPolarHBondContact O-CB 3.35Å; R1964-E1968 WeakPolarHBondContact O-CG 3.25Å; R1964-E1968 PolarHBondContact O-N 3.5Å; R1964-L1991 HydrophobicContact CB-CD2 4.13Å; R1964-L1991 HydrophobicContact CG-CD2 4.4Å
1965	Q	90.1	Very high	84.6	Confident	69 Å²	69	52.5 Å²	52.5	32%	0.322	27%	0.274	S	S	.	.	H	α-helix	trans	-61	-42.2	176.4	-75	171.7	-11.8	0	0	112.5	A1930 F1931 N1961 I1962 W1963 E1968 N1969	A1930-Q1965 HydrophobicContact CB-CB 3.86Å; F1931-Q1965 HydrophobicContact CZ-CG 4.24Å; N1961-Q1965 WeakPolarHBondContact O-CG 3.37Å; N1961-Q1965 PolarHBondContact O-N 2.7Å; I1962-Q1965 PolarHBondContact O-N 3.31Å; W1963-Q1965 VanDerWaalsContact C-N 3.32Å; W1963-Q1965 PolarHBondContact O-N 3.09Å; Q1965-E1968 PolarHBondContact O-N 2.95Å; Q1965-N1969 WeakPolarHBondContact O-CB 3.37Å; Q1965-N1969 PolarHBondContact O-N 3.02Å; Q1965-N1969 PolarHBondContact O-ND2 3Å
1966	H	93.7	Very high	85.3	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-62.9	-45.7	174.4	-82.3	-70.1	0	0	0	111.7	S1926 N1929 A1930 L1943 M1945 I1962 W1963 R1964 E1968 N1969 W1970	S1926-H1966 PolarHBondContact O-NE2 3.48Å; N1929-H1966 PolarHBondContact OD1-CE1 3.46Å; A1930-H1966 WeakPolarHBondContact CA-CE1 3.34Å; A1930-H1966 PolarHBondContact N-CE1 3.34Å; L1943-H1966 HydrophobicContact CD2-CB 4.11Å; M1945-H1966 HydrophobicContact CE-CB 4.22Å; M1945-H1966 HydrophobicContact SD-CB 4.06Å; I1962-H1966 PolarHBondContact O-CD2 3.19Å; I1962-H1966 PolarHBondContact O-N 3.32Å; I1962-H1966 VanDerWaalsContact O-N 3.1Å; W1963-H1966 PolarHBondContact O-N 2.79Å; W1963-H1966 VanDerWaalsContact O-N 3.16Å; R1964-H1966 PolarHBondContact O-N 3.43Å; H1966-E1968 PolarHBondContact O-N 3.2Å; H1966-N1969 PolarHBondContact O-N 3.37Å; H1966-W1970 VanDerWaalsContact O-CB 3.26Å; H1966-W1970 WeakPolarHBondContact O-CB 3.42Å; H1966-W1970 PolarHBondContact O-N 3.45Å
1967	F	91.2	Very high	85.8	Confident	1 Å²	1	49.9 Å²	49.9	0%	0.004	26%	0.256	C	S	.	.	H	α-helix	trans	-61.7	-41.2	176.1	-85.4	-112.9	0	0	0	112.4	M1945 W1963 R1964 I1976 V1988 L1991 A1992 T1995 R1997 V1999	M1945-F1967 HydrophobicContact CE-CD2 4.32Å; M1945-F1967 HydrophobicContact CE-CE2 4.07Å; M1945-F1967 HydrophobicContact SD-CD2 4.11Å; M1945-F1967 HydrophobicContact SD-CE2 3.78Å; W1963-F1967 VanDerWaalsContact O-CD2 3.24Å; W1963-F1967 WeakPolarHBondContact O-CD2 3.41Å; W1963-F1967 PolarHBondContact O-N 3.09Å; R1964-F1967 PolarHBondContact O-N 2.61Å; F1967-I1976 HydrophobicContact CB-CD1 4.28Å; F1967-I1976 HydrophobicContact CD1-CD1 3.9Å; F1967-I1976 HydrophobicContact CD2-CD1 3.84Å; F1967-I1976 HydrophobicContact CE1-CD1 4.18Å; F1967-I1976 HydrophobicContact CE2-CD1 4.12Å; F1967-I1976 HydrophobicContact CE2-CG2 3.97Å; F1967-I1976 HydrophobicContact CG-CD1 3.74Å; F1967-I1976 HydrophobicContact CZ-CD1 4.28Å; F1967-I1976 HydrophobicContact CZ-CG2 4.17Å; F1967-V1988 HydrophobicContact CZ-CG1 4.2Å; F1967-L1991 HydrophobicContact CD1-CB 3.91Å; F1967-L1991 HydrophobicContact CD2-CD1 4.44Å; F1967-L1991 HydrophobicContact CE1-CB 3.87Å; F1967-L1991 HydrophobicContact CE2-CD1 4.41Å; F1967-L1991 HydrophobicContact CG-CB 4.26Å; F1967-L1991 HydrophobicContact CZ-CB 4.2Å; F1967-A1992 HydrophobicContact CE1-CB 4.21Å; F1967-T1995 HydrophobicContact CB-CG2 4.01Å; F1967-T1995 WeakPolarHBondContact CD1-OG1 3.46Å; F1967-R1997 HydrophobicContact CB-CG 4.46Å; F1967-R1997 HydrophobicContact CD1-CB 4.04Å; F1967-R1997 HydrophobicContact CD1-CG 4.26Å; F1967-R1997 WeakPolarHBondContact O-CD 3.49Å; F1967-R1997 WeakPolarHBondContact O-CG 3.34Å; F1967-R1997 PolarHBondContact O-NE 2.77Å; F1967-V1999 HydrophobicContact CE1-CG2 3.49Å; F1967-V1999 VanDerWaalsContact CE1-CG2 3.49Å; F1967-V1999 HydrophobicContact CZ-CG2 3.75Å
1968	E	89.1	Confident	86.5	Confident	86 Å²	86	48.8 Å²	48.8	40%	0.402	25%	0.245	S	C	.	.	H	α-helix	trans	-69.8	-34.9	-179.9	-74.5	174.8	169.3	0	0	112.2	R1964 Q1965 H1966 T1995 R1997	R1964-E1968 HydrophobicContact CG-CG 4.25Å; R1964-E1968 IonicContact CZ-OE1 3.9Å; R1964-E1968 IonicContact NE-OE1 2.87Å; R1964-E1968 PolarHBondContact NE-OE1 3.4Å; R1964-E1968 IonicContact NH2-OE1 2.82Å; R1964-E1968 PolarHBondContact NH2-OE1 3.36Å; R1964-E1968 VanDerWaalsContact NH2-OE1 3.09Å; R1964-E1968 WeakPolarHBondContact O-CB 3.35Å; R1964-E1968 WeakPolarHBondContact O-CG 3.25Å; R1964-E1968 PolarHBondContact O-N 3.5Å; Q1965-E1968 PolarHBondContact O-N 2.95Å; H1966-E1968 PolarHBondContact O-N 3.2Å; E1968-T1995 HydrophobicContact CG-CG2 4.17Å; E1968-R1997 PolarHBondContact O-NH2 3.41Å
1969	N	90.6	Very high	87.1	Confident	57 Å²	57	43.7 Å²	43.7	31%	0.305	22%	0.217	S	C	.	.	H	α-helix	trans	-92.5	-24.3	-176	-70.5	-63.7	0	0	0	115.2	A1930 F1931 S1934 Q1965 H1966	A1930-N1969 VanDerWaalsContact O-CB 3.23Å; A1930-N1969 WeakPolarHBondContact O-CB 3.36Å; F1931-N1969 WeakPolarHBondContact CD1-ND2 3.4Å; F1931-N1969 WeakPolarHBondContact CE1-ND2 3.46Å; S1934-N1969 WeakPolarHBondContact CB-O 3.42Å; Q1965-N1969 WeakPolarHBondContact O-CB 3.37Å; Q1965-N1969 PolarHBondContact O-N 3.02Å; Q1965-N1969 PolarHBondContact O-ND2 3Å; H1966-N1969 PolarHBondContact O-N 3.37Å
1970	W	92.1	Very high	86.9	Confident	2 Å²	2	37.9 Å²	37.9	1%	0.008	19%	0.192	C	C	.	.	S	Bend	trans	-74.4	141.6	179.8	-164.2	-107.4	0	0	0	111.5	V1933 A1940 L1943 H1966 R1974 I1976 R1997	V1933-W1970 HydrophobicContact CB-CZ3 4.41Å; V1933-W1970 HydrophobicContact CG1-CE3 4Å; V1933-W1970 HydrophobicContact CG1-CZ3 3.98Å; V1933-W1970 HydrophobicContact CG2-CZ3 4.03Å; V1933-W1970 WeakPolarHBondContact O-CZ3 3.3Å; A1940-W1970 HydrophobicContact CB-CH2 4.43Å; L1943-W1970 HydrophobicContact CB-CD2 3.63Å; L1943-W1970 VanDerWaalsContact CB-CE2 3.48Å; L1943-W1970 HydrophobicContact CB-CE3 3.98Å; L1943-W1970 HydrophobicContact CB-CG 4.14Å; L1943-W1970 HydrophobicContact CB-CH2 4.05Å; L1943-W1970 HydrophobicContact CB-CZ2 3.73Å; L1943-W1970 HydrophobicContact CB-CZ3 4.17Å; L1943-W1970 HydrophobicContact CD1-CE3 4.27Å; L1943-W1970 HydrophobicContact CD1-CZ3 4.15Å; L1943-W1970 HydrophobicContact CD2-CB 4.28Å; L1943-W1970 HydrophobicContact CD2-CD2 4Å; L1943-W1970 HydrophobicContact CD2-CE3 4Å; L1943-W1970 HydrophobicContact CD2-CG 4.12Å; L1943-W1970 HydrophobicContact CG-CD2 4.33Å; L1943-W1970 HydrophobicContact CG-CE3 4.32Å; H1966-W1970 VanDerWaalsContact O-CB 3.26Å; H1966-W1970 WeakPolarHBondContact O-CB 3.42Å; H1966-W1970 PolarHBondContact O-N 3.45Å; W1970-R1974 HydrophobicContact CZ2-CB 4.42Å; W1970-R1974 VanDerWaalsContact NE1-CB 3.31Å; W1970-I1976 HydrophobicContact CB-CD1 4.12Å; W1970-I1976 HydrophobicContact CB-CG1 4.26Å; W1970-I1976 HydrophobicContact CG-CG1 4.12Å; W1970-R1997 PolarHBondContact O-NE 2.79Å; W1970-R1997 VanDerWaalsContact O-NE 3.1Å; W1970-R1997 PolarHBondContact O-NH1 2.8Å; W1970-R1997 PolarHBondContact O-NH2 2.69Å
1971	P	85.2	Confident	86.5	Confident	31 Å²	31	35.6 Å²	35.6	20%	0.201	18%	0.179	C	C	.	.			trans	-61.4	145.2	-179.9	-24.7	36.3	0	0	0	113.4	S1937 D1973 R1974	S1937-P1971 WeakPolarHBondContact OG-CG 3.28Å; P1971-D1973 VanDerWaalsContact C-N 3.3Å; P1971-D1973 WeakPolarHBondContact CB-OD1 3.43Å; P1971-D1973 PolarHBondContact O-N 3.06Å; P1971-R1974 PolarHBondContact O-N 2.87Å
1972	S	81.1	Confident	86	Confident	56 Å²	56	31.3 Å²	31.3	39%	0.392	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-17.8	-178	37.4	0	0	0	0	114	R1974 R1997	S1972-R1974 VanDerWaalsContact C-N 3.31Å; S1972-R1997 PolarHBondContact OG-NH1 3.07Å
1973	D	77.5	Confident	85.3	Confident	95 Å²	95	39 Å²	39	51%	0.508	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-1.2	176.7	62.7	-30.9	0	0	0	112.9	P1971	P1971-D1973 VanDerWaalsContact C-N 3.3Å; P1971-D1973 WeakPolarHBondContact CB-OD1 3.43Å; P1971-D1973 PolarHBondContact O-N 3.06Å
1974	R	84.5	Confident	84.8	Confident	17 Å²	17	39.5 Å²	39.5	6%	0.064	20%	0.204	C	C	.	.	S	Bend	trans	-120.1	137.7	175.8	-67.7	-62.2	-166.8	-142.4	-6	111.4	S1937 W1970 P1971 S1972 F2129	S1937-R1974 PolarHBondContact O-NE 2.84Å; W1970-R1974 HydrophobicContact CZ2-CB 4.42Å; W1970-R1974 VanDerWaalsContact NE1-CB 3.31Å; P1971-R1974 PolarHBondContact O-N 2.87Å; S1972-R1974 VanDerWaalsContact C-N 3.31Å; R1974-F2129 PolarHBondContact NH1-O 3.06Å
1975	P	91.3	Very high	84.6	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.182	C	C	.	.	P	Polyproline II helix	trans	-72.9	140.7	-180	29.3	-33.8	0	0	0	111.8	G1942 L1943 H2000 I2128 F2129	G1942-P1975 WeakPolarHBondContact CA-O 3.31Å; L1943-P1975 PolarHBondContact N-O 3.4Å; P1975-H2000 HydrophobicContact CB-CB 4.32Å; P1975-I2128 HydrophobicContact CB-CG2 4.47Å; P1975-I2128 HydrophobicContact CG-CG2 4.48Å; P1975-F2129 HydrophobicContact CB-CE1 4.41Å; P1975-F2129 HydrophobicContact CG-CD1 3.52Å; P1975-F2129 HydrophobicContact CG-CE1 3.61Å; P1975-F2129 HydrophobicContact CG-CG 4.39Å
1976	I	93.9	Very high	84.3	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	122.2	162.5	-60.3	174.7	0	0	0	107.6	M1945 F1967 W1970 R1997 S1998 V1999 H2000	M1945-I1976 HydrophobicContact CG-CG2 4.12Å; M1945-I1976 HydrophobicContact SD-CG2 3.4Å; M1945-I1976 WeakPolarHBondContact SD-CG2 3.42Å; F1967-I1976 HydrophobicContact CB-CD1 4.28Å; F1967-I1976 HydrophobicContact CD1-CD1 3.9Å; F1967-I1976 HydrophobicContact CD2-CD1 3.84Å; F1967-I1976 HydrophobicContact CE1-CD1 4.18Å; F1967-I1976 HydrophobicContact CE2-CD1 4.12Å; F1967-I1976 HydrophobicContact CE2-CG2 3.97Å; F1967-I1976 HydrophobicContact CG-CD1 3.74Å; F1967-I1976 HydrophobicContact CZ-CD1 4.28Å; F1967-I1976 HydrophobicContact CZ-CG2 4.17Å; W1970-I1976 HydrophobicContact CB-CD1 4.12Å; W1970-I1976 HydrophobicContact CB-CG1 4.26Å; W1970-I1976 HydrophobicContact CG-CG1 4.12Å; I1976-R1997 HydrophobicContact CD1-CB 4.21Å; I1976-R1997 HydrophobicContact CD1-CG 4.42Å; I1976-S1998 PolarHBondContact N-O 3.02Å; I1976-V1999 CarbonylContact O-C 3.54Å; I1976-V1999 VanDerWaalsContact O-CA 3.31Å; I1976-V1999 WeakPolarHBondContact O-CA 3.3Å; I1976-H2000 PolarHBondContact O-N 3.36Å
1977	C	93.7	Very high	83.9	Confident	0 Å²	0	34 Å²	34	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	124.8	-175.5	-60.2	0	0	0	0	110.6	Y1922 L1943 K1944 M1945 H2000	Y1922-C1977 HydrophobicContact CE1-CB 4.39Å; L1943-C1977 PolarHBondContact O-N 3.46Å; K1944-C1977 HydrophobicContact CD-CB 3.96Å; M1945-C1977 PolarHBondContact N-O 3.2Å; C1977-H2000 VanDerWaalsContact CA-O 3.29Å; C1977-H2000 WeakPolarHBondContact CA-O 2.96Å
1978	C	88.7	Confident	83.8	Confident	0 Å²	0	34 Å²	34	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	149.8	-177.8	-60.1	0	0	0	0	110.7	L1947 V1988 H2000 I2001 C2002	L1947-C1978 HydrophobicContact CD1-CB 4.09Å; C1978-V1988 HydrophobicContact CB-CG1 4.36Å; C1978-V1988 HydrophobicContact CB-CG2 4.32Å; C1978-H2000 PolarHBondContact N-O 3.43Å; C1978-I2001 CarbonylContact O-C 3.54Å; C1978-I2001 WeakPolarHBondContact O-CA 3.37Å; C1978-C2002 WeakPolarHBondContact O-CB 3.27Å; C1978-C2002 PolarHBondContact O-N 3.48Å
1979	H	81.7	Confident	83.7	Confident	14 Å²	14	30.2 Å²	30.2	7%	0.065	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	143.9	175.8	-73.3	-176.5	0	0	0	113.2	K1944 Y1946 E1981 H2003	K1944-H1979 WeakPolarHBondContact CE-NE2 3.02Å; K1944-H1979 PolarHBondContact NZ-CD2 2.85Å; K1944-H1979 VanDerWaalsContact NZ-CD2 3.34Å; K1944-H1979 PolarHBondContact NZ-NE2 2.87Å; Y1946-H1979 AromaticContact CD1-CE1 3.66Å; Y1946-H1979 AromaticContact CD1-NE2 3.96Å; Y1946-H1979 AromaticContact CE1-CE1 3.8Å; Y1946-H1979 AromaticContact CE1-NE2 3.79Å; H1979-E1981 HydrophobicContact CB-CG 3.93Å; H1979-E1981 WeakPolarHBondContact CB-OE1 3.44Å; H1979-E1981 IonicContact CG-OE1 2.84Å; H1979-E1981 IonicContact ND1-OE1 2.68Å; H1979-E1981 PolarHBondContact ND1-OE1 3.33Å; H1979-E1981 VanDerWaalsContact ND1-OE1 3.13Å; H1979-E1981 PolarHBondContact O-N 3.47Å; H1979-H2003 WeakPolarHBondContact CB-CE1 3.3Å; H1979-H2003 AromaticContact CD2-CE1 3.12Å; H1979-H2003 PolarHBondContact CD2-CE1 2.95Å; H1979-H2003 AromaticContact CD2-NE2 2.88Å; H1979-H2003 PolarHBondContact CD2-NE2 3.07Å; H1979-H2003 AromaticContact CE1-CE1 3.98Å; H1979-H2003 AromaticContact CE1-NE2 3.51Å; H1979-H2003 AromaticContact CG-CE1 3.14Å; H1979-H2003 AromaticContact CG-NE2 3.35Å; H1979-H2003 AromaticContact ND1-CE1 3.71Å; H1979-H2003 AromaticContact ND1-NE2 3.71Å; H1979-H2003 AromaticContact NE2-CE1 3.7Å; H1979-H2003 AromaticContact NE2-NE2 3.02Å; H1979-H2003 PolarHBondContact NE2-NE2 2.88Å
1980	A	72.4	Confident	83.5	Confident	0 Å²	0	32 Å²	32	0%	0	19%	0.188	C	C	.	.			trans	-76.1	98.6	164.9	0	0	0	0	0	110.2	I1985 I2001 C2002 V2004 P2050	A1980-I1985 HydrophobicContact CB-CD1 3.71Å; A1980-I2001 HydrophobicContact CB-CG2 3.76Å; A1980-C2002 VanDerWaalsContact CB-O 3.24Å; A1980-C2002 WeakPolarHBondContact CB-O 3.29Å; A1980-C2002 PolarHBondContact N-O 3.14Å; A1980-V2004 HydrophobicContact CB-CB 4.28Å; A1980-V2004 HydrophobicContact CB-CG2 3.98Å; A1980-P2050 WeakPolarHBondContact O-CG 3.22Å
1981	E	73.1	Confident	83.4	Confident	41 Å²	41	32.3 Å²	32.3	19%	0.192	19%	0.19	C	C	.	.			trans	-133.6	65	-179.1	-70.1	174.1	-169.7	0	0	110.6	N1948 H1979 E1983 T1984	N1948-E1981 WeakPolarHBondContact CB-OE2 3.43Å; N1948-E1981 PolarHBondContact ND2-OE2 2.78Å; H1979-E1981 HydrophobicContact CB-CG 3.93Å; H1979-E1981 WeakPolarHBondContact CB-OE1 3.44Å; H1979-E1981 IonicContact CG-OE1 2.84Å; H1979-E1981 IonicContact ND1-OE1 2.68Å; H1979-E1981 PolarHBondContact ND1-OE1 3.33Å; H1979-E1981 VanDerWaalsContact ND1-OE1 3.13Å; H1979-E1981 PolarHBondContact O-N 3.47Å; E1981-E1983 PolarHBondContact O-N 3.5Å; E1981-T1984 PolarHBondContact O-N 3.04Å; E1981-T1984 PolarHBondContact O-OG1 2.99Å
1982	G	72	Confident	83.4	Confident	40 Å²	40	31 Å²	31	41%	0.412	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	57	-118.2	172.8	0	0	0	0	0	114.5	T1984 I1985 E2009	G1982-T1984 PolarHBondContact O-N 3.3Å; G1982-I1985 WeakPolarHBondContact O-CB 3.44Å; G1982-I1985 WeakPolarHBondContact O-CG1 3.23Å; G1982-I1985 PolarHBondContact O-N 2.92Å; G1982-I1985 VanDerWaalsContact O-N 3.15Å; G1982-E2009 PolarHBondContact N-OE1 2.68Å
1983	E	71.1	Confident	83.7	Confident	185 Å²	185	32.8 Å²	32.8	86%	0.864	18%	0.184	S	C	*	.	H	α-helix	trans	-60.2	-26.7	-173.8	-62.4	-176.3	-179.2	0	0	113.5	E1981 I1985 A1986	E1981-E1983 PolarHBondContact O-N 3.5Å; E1983-I1985 VanDerWaalsContact C-N 3.25Å; E1983-I1985 PolarHBondContact O-N 3.39Å; E1983-A1986 PolarHBondContact O-N 3.27Å
1984	T	78.5	Confident	84.2	Confident	14 Å²	14	33.4 Å²	33.4	9%	0.086	19%	0.186	C	C	.	.	H	α-helix	trans	-65.3	-28	178.7	57.7	0	0	0	0	113	N1948 W1963 E1981 G1982 A1986 A1987 V1988	N1948-T1984 WeakPolarHBondContact ND2-CG2 3.47Å; W1963-T1984 HydrophobicContact CH2-CG2 4.29Å; E1981-T1984 PolarHBondContact O-N 3.04Å; E1981-T1984 PolarHBondContact O-OG1 2.99Å; G1982-T1984 PolarHBondContact O-N 3.3Å; T1984-A1986 VanDerWaalsContact C-N 3.3Å; T1984-A1986 PolarHBondContact O-N 2.84Å; T1984-A1987 PolarHBondContact O-N 3.19Å; T1984-V1988 WeakPolarHBondContact O-CG2 3.47Å; T1984-V1988 PolarHBondContact O-N 2.92Å
1985	I	84.9	Confident	84.3	Confident	1 Å²	1	34 Å²	34	1%	0.005	19%	0.192	C	C	.	.	H	α-helix	trans	-63.1	-39.9	178.7	-55.4	-179.5	0	0	0	110.3	A1980 G1982 E1983 A1987 V1988 I1989 I2001 E2009 L2012	A1980-I1985 HydrophobicContact CB-CD1 3.71Å; G1982-I1985 WeakPolarHBondContact O-CB 3.44Å; G1982-I1985 WeakPolarHBondContact O-CG1 3.23Å; G1982-I1985 PolarHBondContact O-N 2.92Å; G1982-I1985 VanDerWaalsContact O-N 3.15Å; E1983-I1985 VanDerWaalsContact C-N 3.25Å; E1983-I1985 PolarHBondContact O-N 3.39Å; I1985-A1987 VanDerWaalsContact C-N 3.3Å; I1985-A1987 PolarHBondContact O-N 2.9Å; I1985-V1988 PolarHBondContact O-N 3.48Å; I1985-I1989 HydrophobicContact CG2-CD1 3.82Å; I1985-I1989 HydrophobicContact CG2-CG1 4.17Å; I1985-I1989 WeakPolarHBondContact O-CB 3.45Å; I1985-I1989 VanDerWaalsContact O-CG1 3.32Å; I1985-I1989 WeakPolarHBondContact O-CG1 3.43Å; I1985-I1989 PolarHBondContact O-N 3.08Å; I1985-I2001 HydrophobicContact CD1-CG2 4.36Å; I1985-I2001 HydrophobicContact CG2-CD1 4.31Å; I1985-E2009 HydrophobicContact CD1-CB 3.61Å; I1985-E2009 HydrophobicContact CD1-CG 3.49Å; I1985-E2009 VanDerWaalsContact CD1-CG 3.49Å; I1985-L2012 HydrophobicContact CB-CD2 3.94Å; I1985-L2012 HydrophobicContact CG2-CD2 3.51Å
1986	A	83.8	Confident	84	Confident	50 Å²	50	36 Å²	36	41%	0.413	21%	0.212	S	C	.	.	H	α-helix	trans	-61.7	-39.8	178	0	0	0	0	0	111.8	E1983 T1984 L1990 L2012	E1983-A1986 PolarHBondContact O-N 3.27Å; T1984-A1986 VanDerWaalsContact C-N 3.3Å; T1984-A1986 PolarHBondContact O-N 2.84Å; A1986-L1990 WeakPolarHBondContact O-CB 3.47Å; A1986-L1990 PolarHBondContact O-N 2.79Å; A1986-L2012 HydrophobicContact CB-CD1 4.49Å; A1986-L2012 HydrophobicContact CB-CD2 4.33Å
1987	A	86.1	Confident	83.7	Confident	25 Å²	25	38.4 Å²	38.4	21%	0.207	22%	0.221	C	C	.	.	H	α-helix	trans	-66.9	-40.6	175.3	0	0	0	0	0	112.3	W1963 T1984 I1985 L1990 L1991	W1963-A1987 HydrophobicContact CZ3-CB 4.17Å; T1984-A1987 PolarHBondContact O-N 3.19Å; I1985-A1987 VanDerWaalsContact C-N 3.3Å; I1985-A1987 PolarHBondContact O-N 2.9Å; A1987-L1990 PolarHBondContact O-N 3.27Å; A1987-L1991 WeakPolarHBondContact O-CG 3.39Å; A1987-L1991 PolarHBondContact O-N 2.96Å
1988	V	88.9	Confident	83.5	Confident	1 Å²	1	38.4 Å²	38.4	1%	0.006	22%	0.221	C	C	.	.	H	α-helix	trans	-63.4	-45.2	176	167.6	0	0	0	0	111.5	L1947 F1967 C1978 T1984 I1985 L1990 L1991 A1992 V1999 I2001	L1947-V1988 HydrophobicContact CD1-CG2 3.38Å; F1967-V1988 HydrophobicContact CZ-CG1 4.2Å; C1978-V1988 HydrophobicContact CB-CG1 4.36Å; C1978-V1988 HydrophobicContact CB-CG2 4.32Å; T1984-V1988 WeakPolarHBondContact O-CG2 3.47Å; T1984-V1988 PolarHBondContact O-N 2.92Å; I1985-V1988 PolarHBondContact O-N 3.48Å; V1988-L1990 VanDerWaalsContact C-N 3.33Å; V1988-L1990 PolarHBondContact O-N 3.43Å; V1988-L1991 PolarHBondContact O-N 3.05Å; V1988-A1992 WeakPolarHBondContact O-CB 3.42Å; V1988-A1992 PolarHBondContact O-N 2.9Å; V1988-V1999 HydrophobicContact CG1-CG1 3.58Å; V1988-V1999 HydrophobicContact CG1-CG2 4.35Å; V1988-I2001 HydrophobicContact CG1-CD1 3.87Å
1989	I	86.6	Confident	83.7	Confident	5 Å²	5	38.4 Å²	38.4	3%	0.026	22%	0.221	C	C	.	.	H	α-helix	trans	-64.2	-40.2	177.8	-69.3	-179.6	0	0	0	110.7	I1985 A1992 E1993 L2012 A2016 L2021 V2023	I1985-I1989 HydrophobicContact CG2-CD1 3.82Å; I1985-I1989 HydrophobicContact CG2-CG1 4.17Å; I1985-I1989 WeakPolarHBondContact O-CB 3.45Å; I1985-I1989 VanDerWaalsContact O-CG1 3.32Å; I1985-I1989 WeakPolarHBondContact O-CG1 3.43Å; I1985-I1989 PolarHBondContact O-N 3.08Å; I1989-A1992 WeakPolarHBondContact O-CB 3.2Å; I1989-A1992 PolarHBondContact O-N 3.48Å; I1989-E1993 WeakPolarHBondContact O-CB 3.06Å; I1989-E1993 PolarHBondContact O-N 3.16Å; I1989-L2012 HydrophobicContact CD1-CD2 3.5Å; I1989-L2012 VanDerWaalsContact CD1-CD2 3.5Å; I1989-L2012 HydrophobicContact CD1-CG 4.14Å; I1989-A2016 HydrophobicContact CD1-CB 3.81Å; I1989-A2016 HydrophobicContact CG2-CB 3.85Å; I1989-L2021 HydrophobicContact CG2-CD1 3.54Å; I1989-V2023 HydrophobicContact CG1-CG2 4.35Å
1990	L	86.9	Confident	84.3	Confident	94 Å²	94	37.7 Å²	37.7	49%	0.492	22%	0.218	S	C	.	.	H	α-helix	trans	-62.7	-42.4	174.3	-178.7	65.8	0	0	0	112	A1986 A1987 V1988 E1993 I1994	A1986-L1990 WeakPolarHBondContact O-CB 3.47Å; A1986-L1990 PolarHBondContact O-N 2.79Å; A1987-L1990 PolarHBondContact O-N 3.27Å; V1988-L1990 VanDerWaalsContact C-N 3.33Å; V1988-L1990 PolarHBondContact O-N 3.43Å; L1990-E1993 PolarHBondContact O-N 2.91Å; L1990-I1994 HydrophobicContact CD1-CD1 4.11Å; L1990-I1994 HydrophobicContact CD1-CG1 4.46Å; L1990-I1994 HydrophobicContact CG-CD1 3.92Å; L1990-I1994 VanDerWaalsContact O-CG1 3.28Å; L1990-I1994 WeakPolarHBondContact O-CG1 3.45Å; L1990-I1994 PolarHBondContact O-N 3.48Å
1991	L	88.3	Confident	85.4	Confident	9 Å²	9	37.8 Å²	37.8	5%	0.047	22%	0.218	C	C	.	.	H	α-helix	trans	-65.1	-40.5	175.4	-74.7	173.7	0	0	0	111.7	W1963 R1964 F1967 A1987 V1988 E1993 I1994 T1995	W1963-L1991 HydrophobicContact CB-CD1 3.82Å; W1963-L1991 HydrophobicContact CE3-CD1 4.22Å; R1964-L1991 HydrophobicContact CB-CD2 4.13Å; R1964-L1991 HydrophobicContact CG-CD2 4.4Å; F1967-L1991 HydrophobicContact CD1-CB 3.91Å; F1967-L1991 HydrophobicContact CD2-CD1 4.44Å; F1967-L1991 HydrophobicContact CE1-CB 3.87Å; F1967-L1991 HydrophobicContact CE2-CD1 4.41Å; F1967-L1991 HydrophobicContact CG-CB 4.26Å; F1967-L1991 HydrophobicContact CZ-CB 4.2Å; A1987-L1991 WeakPolarHBondContact O-CG 3.39Å; A1987-L1991 PolarHBondContact O-N 2.96Å; V1988-L1991 PolarHBondContact O-N 3.05Å; L1991-E1993 VanDerWaalsContact C-N 3.32Å; L1991-E1993 PolarHBondContact O-N 3.35Å; L1991-I1994 PolarHBondContact O-N 2.81Å; L1991-T1995 WeakPolarHBondContact O-CB 3.44Å; L1991-T1995 WeakPolarHBondContact O-CG2 3.39Å; L1991-T1995 PolarHBondContact O-N 2.5Å; L1991-T1995 PolarHBondContact O-OG1 2.92Å
1992	A	87.1	Confident	86.3	Confident	5 Å²	5	35.8 Å²	35.8	4%	0.041	21%	0.209	C	C	.	.	H	α-helix	trans	-60	-43.2	174.8	0	0	0	0	0	111.4	F1967 V1988 I1989 G1996 R1997 V1999	F1967-A1992 HydrophobicContact CE1-CB 4.21Å; V1988-A1992 WeakPolarHBondContact O-CB 3.42Å; V1988-A1992 PolarHBondContact O-N 2.9Å; I1989-A1992 WeakPolarHBondContact O-CB 3.2Å; I1989-A1992 PolarHBondContact O-N 3.48Å; A1992-G1996 VanDerWaalsContact O-CA 3.3Å; A1992-G1996 WeakPolarHBondContact O-CA 3.24Å; A1992-G1996 PolarHBondContact O-N 2.77Å; A1992-R1997 PolarHBondContact O-N 2.69Å; A1992-V1999 HydrophobicContact CB-CB 4.35Å; A1992-V1999 HydrophobicContact CB-CG2 3.58Å
1993	E	86.9	Confident	87.2	Confident	92 Å²	92	34 Å²	34	43%	0.43	19%	0.19	S	C	.	.	H	α-helix	trans	-64.1	-45.2	176.8	-177.4	163.8	-165.6	0	0	112.2	I1989 L1990 L1991 R2019 L2021	I1989-E1993 WeakPolarHBondContact O-CB 3.06Å; I1989-E1993 PolarHBondContact O-N 3.16Å; L1990-E1993 PolarHBondContact O-N 2.91Å; L1991-E1993 VanDerWaalsContact C-N 3.32Å; L1991-E1993 PolarHBondContact O-N 3.35Å; E1993-R2019 IonicContact OE1-NH1 3.57Å; E1993-R2019 PolarHBondContact OE1-NH1 2.74Å; E1993-R2019 IonicContact OE2-CZ 2.71Å; E1993-R2019 IonicContact OE2-NH1 3.81Å; E1993-R2019 PolarHBondContact OE2-NH1 3.47Å; E1993-L2021 HydrophobicContact CB-CD1 4.19Å; E1993-L2021 HydrophobicContact CB-CD2 3.73Å; E1993-L2021 HydrophobicContact CG-CD2 3.71Å
1994	I	87.5	Confident	88.3	Confident	109 Å²	109	25.1 Å²	25.1	56%	0.559	15%	0.149	S	C	*	.	H	α-helix	trans	-68.7	-40.1	-180	-68.4	167.2	0	0	0	112.3	L1990 L1991	L1990-I1994 HydrophobicContact CD1-CD1 4.11Å; L1990-I1994 HydrophobicContact CD1-CG1 4.46Å; L1990-I1994 HydrophobicContact CG-CD1 3.92Å; L1990-I1994 VanDerWaalsContact O-CG1 3.28Å; L1990-I1994 WeakPolarHBondContact O-CG1 3.45Å; L1990-I1994 PolarHBondContact O-N 3.48Å; L1991-I1994 PolarHBondContact O-N 2.81Å
1995	T	87.6	Confident	88.9	Confident	30 Å²	30	24.5 Å²	24.5	18%	0.184	15%	0.145	C	C	.	.	H	α-helix	trans	-96.5	-9.7	-172.6	61	0	0	0	0	113.6	F1967 E1968 L1991 R1997	F1967-T1995 HydrophobicContact CB-CG2 4.01Å; F1967-T1995 WeakPolarHBondContact CD1-OG1 3.46Å; E1968-T1995 HydrophobicContact CG-CG2 4.17Å; L1991-T1995 WeakPolarHBondContact O-CB 3.44Å; L1991-T1995 WeakPolarHBondContact O-CG2 3.39Å; L1991-T1995 PolarHBondContact O-N 2.5Å; L1991-T1995 PolarHBondContact O-OG1 2.92Å; T1995-R1997 PolarHBondContact O-N 2.77Å; T1995-R1997 VanDerWaalsContact OG1-CG 3.31Å; T1995-R1997 WeakPolarHBondContact OG1-CG 3.46Å
1996	G	84.3	Confident	89.3	Confident	42 Å²	42	27.9 Å²	27.9	43%	0.433	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.7	21.7	-176.3	0	0	0	0	0	114	A1992	A1992-G1996 VanDerWaalsContact O-CA 3.3Å; A1992-G1996 WeakPolarHBondContact O-CA 3.24Å; A1992-G1996 PolarHBondContact O-N 2.77Å
1997	R	87.7	Confident	89.6	Confident	49 Å²	49	31.7 Å²	31.7	19%	0.185	16%	0.161	C	C	.	.			trans	-85.7	146.1	-179.3	-61.1	-60.2	-179.8	-165.8	-1.1	111.7	F1967 E1968 W1970 S1972 I1976 A1992 T1995	F1967-R1997 HydrophobicContact CB-CG 4.46Å; F1967-R1997 HydrophobicContact CD1-CB 4.04Å; F1967-R1997 HydrophobicContact CD1-CG 4.26Å; F1967-R1997 WeakPolarHBondContact O-CD 3.49Å; F1967-R1997 WeakPolarHBondContact O-CG 3.34Å; F1967-R1997 PolarHBondContact O-NE 2.77Å; E1968-R1997 PolarHBondContact O-NH2 3.41Å; W1970-R1997 PolarHBondContact O-NE 2.79Å; W1970-R1997 VanDerWaalsContact O-NE 3.1Å; W1970-R1997 PolarHBondContact O-NH1 2.8Å; W1970-R1997 PolarHBondContact O-NH2 2.69Å; S1972-R1997 PolarHBondContact OG-NH1 3.07Å; I1976-R1997 HydrophobicContact CD1-CB 4.21Å; I1976-R1997 HydrophobicContact CD1-CG 4.42Å; A1992-R1997 PolarHBondContact O-N 2.69Å; T1995-R1997 PolarHBondContact O-N 2.77Å; T1995-R1997 VanDerWaalsContact OG1-CG 3.31Å; T1995-R1997 WeakPolarHBondContact OG1-CG 3.46Å
1998	S	89.3	Confident	89.8	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.179	C	C	.	.			trans	-74.7	130.8	172	-177.4	0	0	0	0	110.4	I1976 K2022	I1976-S1998 PolarHBondContact N-O 3.02Å; S1998-K2022 WeakPolarHBondContact CA-O 2.97Å
1999	V	92.8	Very high	90	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	137.1	177.6	175.2	0	0	0	0	110.3	F1967 I1976 V1988 A1992 I2001 K2022 V2023 T2024	F1967-V1999 HydrophobicContact CE1-CG2 3.49Å; F1967-V1999 VanDerWaalsContact CE1-CG2 3.49Å; F1967-V1999 HydrophobicContact CZ-CG2 3.75Å; I1976-V1999 CarbonylContact O-C 3.54Å; I1976-V1999 VanDerWaalsContact O-CA 3.31Å; I1976-V1999 WeakPolarHBondContact O-CA 3.3Å; V1988-V1999 HydrophobicContact CG1-CG1 3.58Å; V1988-V1999 HydrophobicContact CG1-CG2 4.35Å; A1992-V1999 HydrophobicContact CB-CB 4.35Å; A1992-V1999 HydrophobicContact CB-CG2 3.58Å; V1999-I2001 HydrophobicContact CG1-CD1 3.55Å; V1999-I2001 HydrophobicContact CG1-CG1 4.31Å; V1999-K2022 PolarHBondContact N-O 2.73Å; V1999-V2023 CarbonylContact O-C 3.36Å; V1999-V2023 WeakPolarHBondContact O-CA 2.93Å; V1999-T2024 PolarHBondContact O-N 3.38Å; V1999-T2024 PolarHBondContact O-OG1 3.18Å
2000	H	95.2	Very high	90.3	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	119.6	168.7	-169.3	75.7	0	0	0	110	I1858 P1975 I1976 C1977 C1978 T2024 E2026 F2129	I1858-H2000 WeakPolarHBondContact CD1-NE2 3.47Å; P1975-H2000 HydrophobicContact CB-CB 4.32Å; I1976-H2000 PolarHBondContact O-N 3.36Å; C1977-H2000 VanDerWaalsContact CA-O 3.29Å; C1977-H2000 WeakPolarHBondContact CA-O 2.96Å; C1978-H2000 PolarHBondContact N-O 3.43Å; H2000-T2024 CarbonylContact C-O 3.52Å; H2000-T2024 WeakPolarHBondContact CA-O 3.41Å; H2000-T2024 PolarHBondContact ND1-OG1 3.38Å; H2000-E2026 IonicContact CD2-OE2 2.76Å; H2000-E2026 IonicContact NE2-OE2 2.73Å; H2000-E2026 PolarHBondContact NE2-OE2 3.34Å; H2000-F2129 HydrophobicContact CB-CZ 4.47Å; H2000-F2129 AromaticContact CD2-CZ 3.96Å
2001	I	94.2	Very high	90.5	Very high	1 Å²	1	32.3 Å²	32.3	1%	0.005	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	112.5	179	-53.5	-61.4	0	0	0	109.1	C1978 A1980 I1985 V1988 V1999 V2004 I2013 V2023 T2024 C2025 E2026	C1978-I2001 CarbonylContact O-C 3.54Å; C1978-I2001 WeakPolarHBondContact O-CA 3.37Å; A1980-I2001 HydrophobicContact CB-CG2 3.76Å; I1985-I2001 HydrophobicContact CD1-CG2 4.36Å; I1985-I2001 HydrophobicContact CG2-CD1 4.31Å; V1988-I2001 HydrophobicContact CG1-CD1 3.87Å; V1999-I2001 HydrophobicContact CG1-CD1 3.55Å; V1999-I2001 HydrophobicContact CG1-CG1 4.31Å; I2001-V2004 HydrophobicContact CB-CG2 4.43Å; I2001-V2004 HydrophobicContact CG2-CG2 3.83Å; I2001-I2013 HydrophobicContact CB-CD1 4.09Å; I2001-I2013 HydrophobicContact CG1-CD1 4.3Å; I2001-I2013 HydrophobicContact CG1-CG1 4.4Å; I2001-I2013 HydrophobicContact CG2-CD1 3.97Å; I2001-V2023 HydrophobicContact CG1-CG1 4.06Å; I2001-T2024 PolarHBondContact N-O 2.8Å; I2001-C2025 HydrophobicContact CB-CB 3.99Å; I2001-C2025 VanDerWaalsContact O-CA 3.23Å; I2001-C2025 WeakPolarHBondContact O-CA 3.43Å; I2001-C2025 WeakPolarHBondContact O-CB 3.36Å; I2001-E2026 PolarHBondContact O-N 3.23Å
2002	C	92.6	Very high	90.6	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	148.2	179.9	-63.7	0	0	0	0	112.1	K1944 C1978 A1980 V2004 E2026	K1944-C2002 PolarHBondContact NZ-SG 3Å; C1978-C2002 WeakPolarHBondContact O-CB 3.27Å; C1978-C2002 PolarHBondContact O-N 3.48Å; A1980-C2002 VanDerWaalsContact CB-O 3.24Å; A1980-C2002 WeakPolarHBondContact CB-O 3.29Å; A1980-C2002 PolarHBondContact N-O 3.14Å; C2002-V2004 PolarHBondContact O-N 2.62Å; C2002-E2026 WeakPolarHBondContact CA-OE1 3.37Å; C2002-E2026 WeakPolarHBondContact CB-OE1 3.24Å
2003	H	90.6	Very high	90.8	Very high	1 Å²	1	34.7 Å²	34.7	1%	0.005	18%	0.181	C	C	.	.	S	Bend	trans	40.6	50.7	164.9	51	50	0	0	0	116.7	H1859 H1979 A2005 E2026 C2028 P2050 D2074	H1859-H2003 AromaticContact CE1-CD2 3.77Å; H1979-H2003 WeakPolarHBondContact CB-CE1 3.3Å; H1979-H2003 AromaticContact CD2-CE1 3.12Å; H1979-H2003 PolarHBondContact CD2-CE1 2.95Å; H1979-H2003 AromaticContact CD2-NE2 2.88Å; H1979-H2003 PolarHBondContact CD2-NE2 3.07Å; H1979-H2003 AromaticContact CE1-CE1 3.98Å; H1979-H2003 AromaticContact CE1-NE2 3.51Å; H1979-H2003 AromaticContact CG-CE1 3.14Å; H1979-H2003 AromaticContact CG-NE2 3.35Å; H1979-H2003 AromaticContact ND1-CE1 3.71Å; H1979-H2003 AromaticContact ND1-NE2 3.71Å; H1979-H2003 AromaticContact NE2-CE1 3.7Å; H1979-H2003 AromaticContact NE2-NE2 3.02Å; H1979-H2003 PolarHBondContact NE2-NE2 2.88Å; H2003-A2005 PolarHBondContact O-N 2.82Å; H2003-E2026 VanDerWaalsContact N-CG 3.26Å; H2003-E2026 PolarHBondContact N-O 3.2Å; H2003-E2026 PolarHBondContact N-OE1 2.54Å; H2003-C2028 WeakPolarHBondContact CB-SG 3.24Å; H2003-P2050 WeakPolarHBondContact CE1-CD 3.5Å; H2003-P2050 WeakPolarHBondContact ND1-CD 3.4Å; H2003-P2050 VanDerWaalsContact ND1-CG 3.25Å; H2003-P2050 WeakPolarHBondContact ND1-CG 3.44Å; H2003-D2074 IonicContact CD2-OD2 3.47Å
2004	V	93.8	Very high	91	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.177	C	C	.	.			trans	-57.8	125.8	176.9	-178.4	0	0	0	0	110.7	A1980 I2001 C2002 E2009 I2010 I2013 C2025 E2026 V2027 L2061	A1980-V2004 HydrophobicContact CB-CB 4.28Å; A1980-V2004 HydrophobicContact CB-CG2 3.98Å; I2001-V2004 HydrophobicContact CB-CG2 4.43Å; I2001-V2004 HydrophobicContact CG2-CG2 3.83Å; C2002-V2004 PolarHBondContact O-N 2.62Å; V2004-E2009 HydrophobicContact CG1-CB 3.81Å; V2004-I2010 HydrophobicContact CG1-CB 4.02Å; V2004-I2010 HydrophobicContact CG1-CD1 4.32Å; V2004-I2013 HydrophobicContact CG1-CD1 4.25Å; V2004-I2013 HydrophobicContact CG2-CD1 3.47Å; V2004-I2013 VanDerWaalsContact CG2-CD1 3.47Å; V2004-C2025 HydrophobicContact CG2-CB 3.85Å; V2004-E2026 PolarHBondContact N-O 2.75Å; V2004-V2027 HydrophobicContact CB-CG2 4Å; V2004-L2061 HydrophobicContact CG1-CD2 4Å
2005	A	92.3	Very high	91.2	Very high	1 Å²	1	33 Å²	33	1%	0.008	17%	0.17	C	C	.	.			trans	-126.5	-16	-169.4	0	0	0	0	0	114.1	H2003 E2009 H2031 P2050	H2003-A2005 PolarHBondContact O-N 2.82Å; A2005-E2009 PolarHBondContact N-OE2 2.97Å; A2005-H2031 HydrophobicContact CB-CB 4.41Å; A2005-H2031 VanDerWaalsContact CB-CD2 3.42Å; A2005-H2031 WeakPolarHBondContact CB-CD2 3.17Å; A2005-P2050 HydrophobicContact CB-CB 3.99Å
2006	R	92.3	Very high	91.2	Very high	71 Å²	71	31.6 Å²	31.6	27%	0.268	16%	0.161	S	C	.	.	S	Bend	trans	-120.6	153.8	-173.4	-55.2	-65.8	174.7	176.6	-8.8	113.2	A2008 E2009 I2010 R2051 L2052 D2057	R2006-A2008 PolarHBondContact O-N 3.24Å; R2006-E2009 HydrophobicContact CB-CG 3.94Å; R2006-E2009 PolarHBondContact N-OE2 2.6Å; R2006-E2009 PolarHBondContact O-N 3.05Å; R2006-I2010 PolarHBondContact O-N 3.05Å; R2006-R2051 PolarHBondContact NH2-O 3Å; R2006-L2052 PolarHBondContact NH2-O 3.01Å; R2006-D2057 WeakPolarHBondContact CA-OD1 3.45Å; R2006-D2057 WeakPolarHBondContact CD-OD2 3.44Å; R2006-D2057 IonicContact CZ-OD2 2.92Å; R2006-D2057 IonicContact NH1-OD2 2.88Å; R2006-D2057 PolarHBondContact NH1-OD2 3.36Å
2007	R	91.3	Very high	91.6	Very high	130 Å²	130	32 Å²	32	49%	0.491	15%	0.151	S	C	.	.	H	α-helix	trans	-54.8	-48.1	174	176.2	175.7	-179.3	129.4	9.5	113	E2009 I2010 E2011 D2057 A2060	R2007-E2009 PolarHBondContact O-N 3.5Å; R2007-I2010 VanDerWaalsContact O-CG2 3.31Å; R2007-I2010 WeakPolarHBondContact O-CG2 3.11Å; R2007-I2010 PolarHBondContact O-N 2.98Å; R2007-E2011 HydrophobicContact CG-CG 4.37Å; R2007-E2011 IonicContact CZ-OE1 2.77Å; R2007-E2011 VanDerWaalsContact CZ-OE1 3.23Å; R2007-E2011 IonicContact NE-OE1 3.66Å; R2007-E2011 PolarHBondContact NE-OE1 3Å; R2007-E2011 IonicContact NE-OE2 3.17Å; R2007-E2011 IonicContact NH2-OE1 3.59Å; R2007-E2011 PolarHBondContact NH2-OE1 3.04Å; R2007-E2011 WeakPolarHBondContact O-CB 3.46Å; R2007-E2011 WeakPolarHBondContact O-CG 3.27Å; R2007-E2011 PolarHBondContact O-N 3.15Å; R2007-E2011 VanDerWaalsContact O-N 3.1Å; R2007-D2057 PolarHBondContact N-OD1 3.42Å; R2007-A2060 HydrophobicContact CB-CB 3.62Å; R2007-A2060 HydrophobicContact CG-CB 3.68Å
2008	A	90	Very high	91.5	Very high	71 Å²	71	36.5 Å²	36.5	59%	0.587	17%	0.174	S	C	*	.	H	α-helix	trans	-61.7	-33.1	-176.7	0	0	0	0	0	112.5	R2006 L2012	R2006-A2008 PolarHBondContact O-N 3.24Å; A2008-L2012 WeakPolarHBondContact O-CB 3.32Å; A2008-L2012 PolarHBondContact O-N 2.88Å
2009	E	92.1	Very high	91.5	Very high	11 Å²	11	42.2 Å²	42.2	5%	0.051	20%	0.195	C	C	.	.	H	α-helix	trans	-72.7	-48.3	-178.5	-59.2	171.3	159.7	0	0	111	G1982 I1985 V2004 A2005 R2006 R2007 E2011 L2012 I2013	G1982-E2009 PolarHBondContact N-OE1 2.68Å; I1985-E2009 HydrophobicContact CD1-CB 3.61Å; I1985-E2009 HydrophobicContact CD1-CG 3.49Å; I1985-E2009 VanDerWaalsContact CD1-CG 3.49Å; V2004-E2009 HydrophobicContact CG1-CB 3.81Å; A2005-E2009 PolarHBondContact N-OE2 2.97Å; R2006-E2009 HydrophobicContact CB-CG 3.94Å; R2006-E2009 PolarHBondContact N-OE2 2.6Å; R2006-E2009 PolarHBondContact O-N 3.05Å; R2007-E2009 PolarHBondContact O-N 3.5Å; E2009-E2011 VanDerWaalsContact C-N 3.32Å; E2009-E2011 PolarHBondContact O-N 2.68Å; E2009-L2012 PolarHBondContact O-N 3.19Å; E2009-I2013 WeakPolarHBondContact O-CD1 3.38Å; E2009-I2013 VanDerWaalsContact O-CG1 3.3Å; E2009-I2013 WeakPolarHBondContact O-CG1 3.34Å; E2009-I2013 PolarHBondContact O-N 2.9Å
2010	I	93.3	Very high	91.1	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-68.2	-32.6	-179.6	-165	62.1	0	0	0	112.2	V2004 R2006 R2007 R2014 L2061 N2064 T2067 I2068	V2004-I2010 HydrophobicContact CG1-CB 4.02Å; V2004-I2010 HydrophobicContact CG1-CD1 4.32Å; R2006-I2010 PolarHBondContact O-N 3.05Å; R2007-I2010 VanDerWaalsContact O-CG2 3.31Å; R2007-I2010 WeakPolarHBondContact O-CG2 3.11Å; R2007-I2010 PolarHBondContact O-N 2.98Å; I2010-R2014 WeakPolarHBondContact O-CB 3.28Å; I2010-R2014 PolarHBondContact O-N 2.72Å; I2010-L2061 HydrophobicContact CB-CD2 4.13Å; I2010-L2061 HydrophobicContact CG1-CD2 4.47Å; I2010-L2061 HydrophobicContact CG2-CD2 4.25Å; I2010-N2064 HydrophobicContact CG1-CB 3.55Å; I2010-N2064 HydrophobicContact CG2-CB 4.34Å; I2010-T2067 HydrophobicContact CD1-CG2 3.79Å; I2010-T2067 HydrophobicContact CG1-CG2 4.34Å; I2010-I2068 HydrophobicContact CD1-CG1 3.91Å
2011	E	91.2	Very high	90.7	Very high	56 Å²	56	46.1 Å²	46.1	26%	0.262	23%	0.229	S	C	.	.	H	α-helix	trans	-67	-39.9	174.4	-73.5	178.2	156.7	0	0	111.9	R2007 E2009 R2014 D2015	R2007-E2011 HydrophobicContact CG-CG 4.37Å; R2007-E2011 IonicContact CZ-OE1 2.77Å; R2007-E2011 VanDerWaalsContact CZ-OE1 3.23Å; R2007-E2011 IonicContact NE-OE1 3.66Å; R2007-E2011 PolarHBondContact NE-OE1 3Å; R2007-E2011 IonicContact NE-OE2 3.17Å; R2007-E2011 IonicContact NH2-OE1 3.59Å; R2007-E2011 PolarHBondContact NH2-OE1 3.04Å; R2007-E2011 WeakPolarHBondContact O-CB 3.46Å; R2007-E2011 WeakPolarHBondContact O-CG 3.27Å; R2007-E2011 PolarHBondContact O-N 3.15Å; R2007-E2011 VanDerWaalsContact O-N 3.1Å; E2009-E2011 VanDerWaalsContact C-N 3.32Å; E2009-E2011 PolarHBondContact O-N 2.68Å; E2011-R2014 PolarHBondContact O-N 2.77Å; E2011-D2015 PolarHBondContact O-N 3.04Å; E2011-D2015 VanDerWaalsContact O-N 3.08Å
2012	L	89.9	Confident	90.3	Very high	65 Å²	65	49.2 Å²	49.2	34%	0.34	24%	0.242	S	C	.	.	H	α-helix	trans	-66.9	-41.3	176	-168.2	104.2	0	0	0	111.9	I1985 A1986 I1989 A2008 E2009 D2015 A2016	I1985-L2012 HydrophobicContact CB-CD2 3.94Å; I1985-L2012 HydrophobicContact CG2-CD2 3.51Å; A1986-L2012 HydrophobicContact CB-CD1 4.49Å; A1986-L2012 HydrophobicContact CB-CD2 4.33Å; I1989-L2012 HydrophobicContact CD1-CD2 3.5Å; I1989-L2012 VanDerWaalsContact CD1-CD2 3.5Å; I1989-L2012 HydrophobicContact CD1-CG 4.14Å; A2008-L2012 WeakPolarHBondContact O-CB 3.32Å; A2008-L2012 PolarHBondContact O-N 2.88Å; E2009-L2012 PolarHBondContact O-N 3.19Å; L2012-D2015 PolarHBondContact O-N 2.89Å; L2012-A2016 PolarHBondContact O-N 2.82Å
2013	I	92.2	Very high	90.2	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-65.5	-40.6	175.9	-66.2	160.6	0	0	0	110.8	I2001 V2004 E2009 D2015 A2016 K2017 V2023 C2025 T2067	I2001-I2013 HydrophobicContact CB-CD1 4.09Å; I2001-I2013 HydrophobicContact CG1-CD1 4.3Å; I2001-I2013 HydrophobicContact CG1-CG1 4.4Å; I2001-I2013 HydrophobicContact CG2-CD1 3.97Å; V2004-I2013 HydrophobicContact CG1-CD1 4.25Å; V2004-I2013 HydrophobicContact CG2-CD1 3.47Å; V2004-I2013 VanDerWaalsContact CG2-CD1 3.47Å; E2009-I2013 WeakPolarHBondContact O-CD1 3.38Å; E2009-I2013 VanDerWaalsContact O-CG1 3.3Å; E2009-I2013 WeakPolarHBondContact O-CG1 3.34Å; E2009-I2013 PolarHBondContact O-N 2.9Å; I2013-D2015 VanDerWaalsContact C-N 3.34Å; I2013-D2015 PolarHBondContact O-N 3.44Å; I2013-A2016 PolarHBondContact O-N 2.74Å; I2013-K2017 HydrophobicContact CG2-CD 4.3Å; I2013-K2017 WeakPolarHBondContact O-CG 3.38Å; I2013-K2017 PolarHBondContact O-N 2.84Å; I2013-V2023 HydrophobicContact CG2-CG1 4.25Å; I2013-C2025 HydrophobicContact CD1-CB 3.86Å; I2013-C2025 HydrophobicContact CG2-CB 4.16Å; I2013-T2067 HydrophobicContact CG2-CG2 4.15Å
2014	R	91.9	Very high	90.4	Very high	88 Å²	88	49.8 Å²	49.8	33%	0.332	25%	0.246	S	C	.	.	H	α-helix	trans	-58.4	-46.5	174.9	-173.9	-177.6	64.1	-157.1	-0.4	111.3	I2010 E2011 K2017 Q2018 N2064 T2067	I2010-R2014 WeakPolarHBondContact O-CB 3.28Å; I2010-R2014 PolarHBondContact O-N 2.72Å; E2011-R2014 PolarHBondContact O-N 2.77Å; R2014-K2017 PolarHBondContact O-N 2.87Å; R2014-Q2018 WeakPolarHBondContact O-CB 3.49Å; R2014-Q2018 VanDerWaalsContact O-CG 3.3Å; R2014-Q2018 WeakPolarHBondContact O-CG 3.44Å; R2014-Q2018 PolarHBondContact O-N 3.24Å; R2014-N2064 PolarHBondContact NH1-OD1 3.44Å; R2014-T2067 HydrophobicContact CB-CG2 3.77Å; R2014-T2067 HydrophobicContact CG-CG2 4.36Å
2015	D	90.2	Very high	90.5	Very high	78 Å²	78	49.8 Å²	49.8	42%	0.417	25%	0.246	S	C	.	.	H	α-helix	trans	-60.9	-46.6	176.7	-178.5	75.8	0	0	0	111.6	E2011 L2012 I2013 K2017 Q2018 R2019	E2011-D2015 PolarHBondContact O-N 3.04Å; E2011-D2015 VanDerWaalsContact O-N 3.08Å; L2012-D2015 PolarHBondContact O-N 2.89Å; I2013-D2015 VanDerWaalsContact C-N 3.34Å; I2013-D2015 PolarHBondContact O-N 3.44Å; D2015-K2017 VanDerWaalsContact C-N 3.32Å; D2015-K2017 PolarHBondContact O-N 2.75Å; D2015-Q2018 PolarHBondContact O-N 3.31Å; D2015-Q2018 VanDerWaalsContact O-N 3.15Å; D2015-R2019 WeakPolarHBondContact O-CG 3.38Å; D2015-R2019 PolarHBondContact O-N 3.49Å; D2015-R2019 IonicContact OD2-CZ 2.98Å; D2015-R2019 IonicContact OD2-NE 2.76Å; D2015-R2019 PolarHBondContact OD2-NE 3.34Å; D2015-R2019 IonicContact OD2-NH2 3.33Å
2016	A	88.6	Confident	90.7	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-58.6	-42.1	176.9	0	0	0	0	0	113	I1989 L2012 I2013 R2019 G2020 L2021 V2023	I1989-A2016 HydrophobicContact CD1-CB 3.81Å; I1989-A2016 HydrophobicContact CG2-CB 3.85Å; L2012-A2016 PolarHBondContact O-N 2.82Å; I2013-A2016 PolarHBondContact O-N 2.74Å; A2016-R2019 PolarHBondContact O-N 2.76Å; A2016-G2020 PolarHBondContact O-N 3.24Å; A2016-L2021 HydrophobicContact CB-CB 4.49Å; A2016-L2021 HydrophobicContact CB-CD1 3.97Å; A2016-L2021 WeakPolarHBondContact O-CB 3.34Å; A2016-L2021 PolarHBondContact O-N 2.91Å; A2016-L2021 VanDerWaalsContact O-N 3.07Å; A2016-V2023 HydrophobicContact CB-CG2 4.36Å
2017	K	91.4	Very high	90.9	Very high	50 Å²	50	46.3 Å²	46.3	22%	0.217	23%	0.233	C	C	.	.	H	α-helix	trans	-66.2	-40.8	174.7	-74.5	-178.1	175.2	-175.6	0	112.6	I2013 R2014 D2015 R2019 G2020 V2023 T2067 D2069	I2013-K2017 HydrophobicContact CG2-CD 4.3Å; I2013-K2017 WeakPolarHBondContact O-CG 3.38Å; I2013-K2017 PolarHBondContact O-N 2.84Å; R2014-K2017 PolarHBondContact O-N 2.87Å; D2015-K2017 VanDerWaalsContact C-N 3.32Å; D2015-K2017 PolarHBondContact O-N 2.75Å; K2017-R2019 PolarHBondContact O-N 2.94Å; K2017-G2020 PolarHBondContact O-N 2.82Å; K2017-V2023 WeakPolarHBondContact CE-O 3.01Å; K2017-V2023 WeakPolarHBondContact CG-O 3.32Å; K2017-T2067 HydrophobicContact CD-CG2 4.25Å; K2017-T2067 PolarHBondContact NZ-O 3.3Å; K2017-D2069 WeakPolarHBondContact CE-OD2 3.37Å; K2017-D2069 IonicContact NZ-OD1 2.93Å; K2017-D2069 PolarHBondContact NZ-OD1 3.4Å; K2017-D2069 IonicContact NZ-OD2 3.48Å; K2017-D2069 PolarHBondContact NZ-OD2 3.25Å
2018	Q	87.5	Confident	91.1	Very high	144 Å²	144	40.1 Å²	40.1	67%	0.673	21%	0.209	S	C	*	.	H	α-helix	trans	-63.6	-29.7	175.4	-75.1	175.4	-11.2	0	0	112.2	R2014 D2015 G2020	R2014-Q2018 WeakPolarHBondContact O-CB 3.49Å; R2014-Q2018 VanDerWaalsContact O-CG 3.3Å; R2014-Q2018 WeakPolarHBondContact O-CG 3.44Å; R2014-Q2018 PolarHBondContact O-N 3.24Å; D2015-Q2018 PolarHBondContact O-N 3.31Å; D2015-Q2018 VanDerWaalsContact O-N 3.15Å; Q2018-G2020 PolarHBondContact O-N 2.88Å
2019	R	88.9	Confident	91.3	Very high	119 Å²	119	37 Å²	37	45%	0.449	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-0.2	171	-67.5	-169.4	-69.8	123.1	-1.7	114.2	E1993 D2015 A2016 K2017 L2021	E1993-R2019 IonicContact OE1-NH1 3.57Å; E1993-R2019 PolarHBondContact OE1-NH1 2.74Å; E1993-R2019 IonicContact OE2-CZ 2.71Å; E1993-R2019 IonicContact OE2-NH1 3.81Å; E1993-R2019 PolarHBondContact OE2-NH1 3.47Å; D2015-R2019 WeakPolarHBondContact O-CG 3.38Å; D2015-R2019 PolarHBondContact O-N 3.49Å; D2015-R2019 IonicContact OD2-CZ 2.98Å; D2015-R2019 IonicContact OD2-NE 2.76Å; D2015-R2019 PolarHBondContact OD2-NE 3.34Å; D2015-R2019 IonicContact OD2-NH2 3.33Å; A2016-R2019 PolarHBondContact O-N 2.76Å; K2017-R2019 PolarHBondContact O-N 2.94Å; R2019-L2021 VanDerWaalsContact C-N 3.34Å
2020	G	83.2	Confident	91.4	Very high	53 Å²	53	36.7 Å²	36.7	55%	0.546	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.8	17.6	178.7	0	0	0	0	0	114.7	A2016 K2017 Q2018	A2016-G2020 PolarHBondContact O-N 3.24Å; K2017-G2020 PolarHBondContact O-N 2.82Å; Q2018-G2020 PolarHBondContact O-N 2.88Å
2021	L	86.8	Confident	91.5	Very high	30 Å²	30	36.7 Å²	36.7	16%	0.157	18%	0.181	C	C	.	.			trans	-69.3	147.4	174.1	-61.7	179.5	0	0	0	110.8	I1989 E1993 A2016 R2019 V2023	I1989-L2021 HydrophobicContact CG2-CD1 3.54Å; E1993-L2021 HydrophobicContact CB-CD1 4.19Å; E1993-L2021 HydrophobicContact CB-CD2 3.73Å; E1993-L2021 HydrophobicContact CG-CD2 3.71Å; A2016-L2021 HydrophobicContact CB-CB 4.49Å; A2016-L2021 HydrophobicContact CB-CD1 3.97Å; A2016-L2021 WeakPolarHBondContact O-CB 3.34Å; A2016-L2021 PolarHBondContact O-N 2.91Å; A2016-L2021 VanDerWaalsContact O-N 3.07Å; R2019-L2021 VanDerWaalsContact C-N 3.34Å; L2021-V2023 HydrophobicContact CB-CG2 3.93Å; L2021-V2023 PolarHBondContact O-N 3.36Å
2022	K	86.1	Confident	91.6	Very high	66 Å²	66	34.1 Å²	34.1	29%	0.287	17%	0.169	S	C	.	.	S	Bend	trans	-75.8	59.7	176.4	-63.7	-174	178.5	-172.5	0	111.5	S1998 V1999 T2238	S1998-K2022 WeakPolarHBondContact CA-O 2.97Å; V1999-K2022 PolarHBondContact N-O 2.73Å; K2022-T2238 HydrophobicContact CG-CG2 4.33Å
2023	V	91.1	Very high	91.8	Very high	5 Å²	5	32.8 Å²	32.8	3%	0.03	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	129.7	-178.9	-179.5	0	0	0	0	108.9	I1989 V1999 I2001 I2013 A2016 K2017 L2021	I1989-V2023 HydrophobicContact CG1-CG2 4.35Å; V1999-V2023 CarbonylContact O-C 3.36Å; V1999-V2023 WeakPolarHBondContact O-CA 2.93Å; I2001-V2023 HydrophobicContact CG1-CG1 4.06Å; I2013-V2023 HydrophobicContact CG2-CG1 4.25Å; A2016-V2023 HydrophobicContact CB-CG2 4.36Å; K2017-V2023 WeakPolarHBondContact CE-O 3.01Å; K2017-V2023 WeakPolarHBondContact CG-O 3.32Å; L2021-V2023 HydrophobicContact CB-CG2 3.93Å; L2021-V2023 PolarHBondContact O-N 3.36Å
2024	T	94.2	Very high	91.9	Very high	7 Å²	7	32.9 Å²	32.9	4%	0.043	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	164.2	171.6	55.1	0	0	0	0	110.1	V1999 H2000 I2001 D2069 I2128 I2239	V1999-T2024 PolarHBondContact O-N 3.38Å; V1999-T2024 PolarHBondContact O-OG1 3.18Å; H2000-T2024 CarbonylContact C-O 3.52Å; H2000-T2024 WeakPolarHBondContact CA-O 3.41Å; H2000-T2024 PolarHBondContact ND1-OG1 3.38Å; I2001-T2024 PolarHBondContact N-O 2.8Å; T2024-D2069 VanDerWaalsContact C-OD2 3.3Å; T2024-D2069 WeakPolarHBondContact CA-OD2 3.19Å; T2024-D2069 WeakPolarHBondContact CB-OD2 3.44Å; T2024-I2128 HydrophobicContact CG2-CD1 3.87Å; T2024-I2128 HydrophobicContact CG2-CG1 4.04Å; T2024-I2239 HydrophobicContact CG2-CD1 4.32Å
2025	C	96	Very high	91.9	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	158.5	178	69.1	0	0	0	0	114.1	I2001 V2004 I2013 T2067 D2069 C2070	I2001-C2025 HydrophobicContact CB-CB 3.99Å; I2001-C2025 VanDerWaalsContact O-CA 3.23Å; I2001-C2025 WeakPolarHBondContact O-CA 3.43Å; I2001-C2025 WeakPolarHBondContact O-CB 3.36Å; V2004-C2025 HydrophobicContact CG2-CB 3.85Å; I2013-C2025 HydrophobicContact CD1-CB 3.86Å; I2013-C2025 HydrophobicContact CG2-CB 4.16Å; C2025-T2067 PolarHBondContact SG-O 2.99Å; C2025-T2067 VanDerWaalsContact SG-O 3.38Å; C2025-D2069 PolarHBondContact N-OD2 3.08Å; C2025-D2069 PolarHBondContact O-N 2.97Å; C2025-C2070 PolarHBondContact O-N 3.33Å; C2025-C2070 VanDerWaalsContact O-N 3.13Å
2026	E	96.8	Very high	91.5	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	158.4	172.6	76.3	-164.3	-177.3	0	0	111.8	I1858 H1859 H2000 I2001 C2002 H2003 V2004 C2070 A2072	I1858-E2026 HydrophobicContact CD1-CB 4.21Å; I1858-E2026 WeakPolarHBondContact CD1-OE2 3.32Å; I1858-E2026 WeakPolarHBondContact CG1-OE2 3.21Å; H1859-E2026 IonicContact CE1-OE1 2.79Å; H1859-E2026 IonicContact CG-OE1 3.13Å; H1859-E2026 IonicContact ND1-OE1 2.77Å; H1859-E2026 PolarHBondContact ND1-OE1 2.76Å; H2000-E2026 IonicContact CD2-OE2 2.76Å; H2000-E2026 IonicContact NE2-OE2 2.73Å; H2000-E2026 PolarHBondContact NE2-OE2 3.34Å; I2001-E2026 PolarHBondContact O-N 3.23Å; C2002-E2026 WeakPolarHBondContact CA-OE1 3.37Å; C2002-E2026 WeakPolarHBondContact CB-OE1 3.24Å; H2003-E2026 VanDerWaalsContact N-CG 3.26Å; H2003-E2026 PolarHBondContact N-O 3.2Å; H2003-E2026 PolarHBondContact N-OE1 2.54Å; V2004-E2026 PolarHBondContact N-O 2.75Å; E2026-C2070 WeakPolarHBondContact CA-O 3.14Å; E2026-C2070 HydrophobicContact CB-CB 3.89Å; E2026-C2070 WeakPolarHBondContact CB-O 3.42Å; E2026-A2072 HydrophobicContact CB-CB 4.25Å; E2026-A2072 VanDerWaalsContact CD-CB 3.49Å; E2026-A2072 HydrophobicContact CG-CB 4.08Å; E2026-A2072 WeakPolarHBondContact OE2-CB 3.07Å
2027	V	96.2	Very high	91.2	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	140.9	170.6	176.8	0	0	0	0	109.9	V2004 H2031 L2032 L2061 I2068 C2070 A2072	V2004-V2027 HydrophobicContact CB-CG2 4Å; V2027-H2031 HydrophobicContact CG1-CB 4.36Å; V2027-L2032 HydrophobicContact CG1-CD1 4.02Å; V2027-L2032 HydrophobicContact CG1-CD2 3.8Å; V2027-L2032 HydrophobicContact CG1-CG 3.58Å; V2027-L2061 HydrophobicContact CG1-CD1 4.04Å; V2027-L2061 HydrophobicContact CG2-CD2 4.17Å; V2027-I2068 HydrophobicContact CB-CD1 4.16Å; V2027-I2068 HydrophobicContact CB-CG2 4.12Å; V2027-I2068 HydrophobicContact CG2-CB 4.45Å; V2027-I2068 HydrophobicContact CG2-CD1 3.5Å; V2027-I2068 VanDerWaalsContact CG2-CD1 3.5Å; V2027-I2068 HydrophobicContact CG2-CG1 3.7Å; V2027-I2068 HydrophobicContact CG2-CG2 3.89Å; V2027-C2070 PolarHBondContact N-O 3.49Å; V2027-C2070 VanDerWaalsContact N-O 3.16Å; V2027-A2072 PolarHBondContact O-N 2.94Å
2028	C	95.5	Very high	91	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.19	C	C	.	.			trans	-87.3	146.5	177.3	-56.7	0	0	0	0	112.8	H2003 H2030 H2031 L2032 A2072 D2074	H2003-C2028 WeakPolarHBondContact CB-SG 3.24Å; C2028-H2030 WeakPolarHBondContact CB-CE1 3.25Å; C2028-H2030 PolarHBondContact O-N 2.99Å; C2028-H2031 PolarHBondContact O-N 2.84Å; C2028-L2032 PolarHBondContact O-N 2.83Å; C2028-A2072 WeakPolarHBondContact CA-O 3.48Å; C2028-A2072 WeakPolarHBondContact CB-O 3.34Å; C2028-A2072 PolarHBondContact SG-O 2.67Å; C2028-D2074 VanDerWaalsContact SG-CB 3.56Å
2029	P	94.4	Very high	90.9	Very high	4 Å²	4	29.1 Å²	29.1	3%	0.026	16%	0.161	C	C	.	.	H	α-helix	trans	-54.5	-38.8	176.7	-27.5	35	0	0	0	113.2	H2031 L2032 F2033 A2072 M2099 L2102	P2029-H2031 VanDerWaalsContact C-N 3.27Å; P2029-H2031 PolarHBondContact O-N 2.9Å; P2029-L2032 PolarHBondContact O-N 2.9Å; P2029-F2033 HydrophobicContact CB-CD2 4.27Å; P2029-F2033 WeakPolarHBondContact O-CB 3.49Å; P2029-F2033 WeakPolarHBondContact O-CD2 3.11Å; P2029-F2033 PolarHBondContact O-N 3.22Å; P2029-A2072 WeakPolarHBondContact CD-O 3.47Å; P2029-M2099 HydrophobicContact CG-CB 3.88Å; P2029-M2099 HydrophobicContact CG-CG 3.49Å; P2029-M2099 VanDerWaalsContact CG-CG 3.49Å; P2029-M2099 HydrophobicContact CG-SD 3.77Å; P2029-L2102 HydrophobicContact CB-CD1 4.28Å
2030	H	94.3	Very high	90.2	Very high	5 Å²	5	24.6 Å²	24.6	2%	0.023	15%	0.148	C	C	.	.	H	α-helix	trans	-65	-28.1	178.5	53.3	-99.7	0	0	0	113.2	C2028 L2034 L2052 T2073 F2093 F2188	C2028-H2030 WeakPolarHBondContact CB-CE1 3.25Å; C2028-H2030 PolarHBondContact O-N 2.99Å; H2030-L2034 HydrophobicContact CB-CD1 4.01Å; H2030-L2034 WeakPolarHBondContact O-CA 3.36Å; H2030-L2034 VanDerWaalsContact O-CB 3.26Å; H2030-L2034 WeakPolarHBondContact O-CB 3.29Å; H2030-L2034 PolarHBondContact O-N 3.49Å; H2030-L2052 HydrophobicContact CB-CD2 4.46Å; H2030-T2073 PolarHBondContact CE1-O 3.49Å; H2030-F2093 HydrophobicContact CB-CD2 4Å; H2030-F2093 HydrophobicContact CB-CE2 4.47Å; H2030-F2093 AromaticContact CG-CD2 3.91Å; H2030-F2188 HydrophobicContact CB-CZ 4.03Å
2031	H	95.2	Very high	89.6	Confident	1 Å²	1	29.5 Å²	29.5	1%	0.005	16%	0.156	C	C	.	.	H	α-helix	trans	-80.6	-16.1	171.1	-58.5	109.7	0	0	0	113.7	A2005 V2027 C2028 P2029 P2050 I2058 L2061	A2005-H2031 HydrophobicContact CB-CB 4.41Å; A2005-H2031 VanDerWaalsContact CB-CD2 3.42Å; A2005-H2031 WeakPolarHBondContact CB-CD2 3.17Å; V2027-H2031 HydrophobicContact CG1-CB 4.36Å; C2028-H2031 PolarHBondContact O-N 2.84Å; P2029-H2031 VanDerWaalsContact C-N 3.27Å; P2029-H2031 PolarHBondContact O-N 2.9Å; H2031-P2050 PolarHBondContact NE2-O 2.98Å; H2031-I2058 WeakPolarHBondContact O-CG1 3.29Å; H2031-L2061 HydrophobicContact CB-CD1 4.23Å
2032	L	94.4	Very high	88.8	Confident	1 Å²	1	36.4 Å²	36.4	1%	0.005	19%	0.187	C	C	.	.	H	α-helix	trans	-88.7	-23.6	174.1	-69.7	169.9	0	0	0	113.5	V2027 C2028 P2029 I2058 L2061 W2062 F2071 L2103	V2027-L2032 HydrophobicContact CG1-CD1 4.02Å; V2027-L2032 HydrophobicContact CG1-CD2 3.8Å; V2027-L2032 HydrophobicContact CG1-CG 3.58Å; C2028-L2032 PolarHBondContact O-N 2.83Å; P2029-L2032 PolarHBondContact O-N 2.9Å; L2032-I2058 WeakPolarHBondContact O-CG2 3.4Å; L2032-L2061 HydrophobicContact CD2-CB 3.92Å; L2032-L2061 HydrophobicContact CD2-CD1 4.46Å; L2032-W2062 HydrophobicContact CB-CZ2 3.94Å; L2032-W2062 HydrophobicContact CD1-CH2 4.5Å; L2032-W2062 HydrophobicContact CD1-CZ2 4.3Å; L2032-W2062 HydrophobicContact CD2-CD2 4.25Å; L2032-W2062 HydrophobicContact CD2-CZ2 4.23Å; L2032-W2062 HydrophobicContact CG-CZ2 4.38Å; L2032-W2062 PolarHBondContact O-NE1 3.14Å; L2032-F2071 HydrophobicContact CD1-CD1 4Å; L2032-F2071 HydrophobicContact CD1-CE1 3.6Å; L2032-F2071 HydrophobicContact CD1-CZ 4.45Å; L2032-L2103 HydrophobicContact CD1-CD2 4.39Å
2033	F	94	Very high	88	Confident	37 Å²	37	33.9 Å²	33.9	16%	0.162	18%	0.18	C	C	.	.	H	α-helix	trans	-125.8	-11.4	-168.5	-67.2	-75.8	0	0	0	114.9	P2029 W2062 L2102 L2103 A2106 F2188 R2191	P2029-F2033 HydrophobicContact CB-CD2 4.27Å; P2029-F2033 WeakPolarHBondContact O-CB 3.49Å; P2029-F2033 WeakPolarHBondContact O-CD2 3.11Å; P2029-F2033 PolarHBondContact O-N 3.22Å; F2033-W2062 HydrophobicContact CE1-CZ2 4.14Å; F2033-W2062 HydrophobicContact CE2-CZ2 4.3Å; F2033-W2062 HydrophobicContact CZ-CH2 4.29Å; F2033-W2062 AromaticContact CZ-CZ2 3.84Å; F2033-W2062 HydrophobicContact CZ-CZ2 3.84Å; F2033-L2102 HydrophobicContact CD2-CB 4.15Å; F2033-L2102 HydrophobicContact CE2-CB 3.81Å; F2033-L2102 HydrophobicContact CZ-CB 4.15Å; F2033-L2102 VanDerWaalsContact CZ-O 3.28Å; F2033-L2102 WeakPolarHBondContact CZ-O 3.33Å; F2033-L2103 HydrophobicContact CE2-CD2 4.2Å; F2033-A2106 HydrophobicContact CE1-CB 4.1Å; F2033-A2106 HydrophobicContact CZ-CB 3.77Å; F2033-F2188 HydrophobicContact CB-CE1 3.84Å; F2033-R2191 PolarHBondContact O-NH1 2.59Å; F2033-R2191 PolarHBondContact O-NH2 3.31Å
2034	L	93	Very high	87.4	Confident	2 Å²	2	33.8 Å²	33.8	1%	0.01	18%	0.18	C	C	.	.			trans	-126.2	134	178.1	-52.8	174.1	0	0	0	111.7	H2030 D2038 L2039 L2052 I2058 P2187 F2188	H2030-L2034 HydrophobicContact CB-CD1 4.01Å; H2030-L2034 WeakPolarHBondContact O-CA 3.36Å; H2030-L2034 VanDerWaalsContact O-CB 3.26Å; H2030-L2034 WeakPolarHBondContact O-CB 3.29Å; H2030-L2034 PolarHBondContact O-N 3.49Å; L2034-D2038 WeakPolarHBondContact CA-OD2 3.44Å; L2034-D2038 HydrophobicContact CB-CB 4.33Å; L2034-D2038 HydrophobicContact CD2-CB 3.97Å; L2034-L2039 HydrophobicContact CD1-CD1 4.21Å; L2034-L2052 HydrophobicContact CB-CD1 4Å; L2034-L2052 HydrophobicContact CB-CD2 4.25Å; L2034-I2058 WeakPolarHBondContact O-CD1 3.5Å; L2034-P2187 HydrophobicContact CD1-CB 3.84Å; L2034-P2187 HydrophobicContact CD1-CG 4.25Å; L2034-F2188 HydrophobicContact CD1-CD1 4.24Å; L2034-F2188 HydrophobicContact CD1-CE1 3.72Å; L2034-F2188 HydrophobicContact CD1-CZ 3.99Å; L2034-F2188 HydrophobicContact CD2-CD1 3.87Å; L2034-F2188 HydrophobicContact CD2-CE1 3.71Å; L2034-F2188 HydrophobicContact CG-CD1 4.15Å; L2034-F2188 HydrophobicContact CG-CE1 3.52Å; L2034-F2188 HydrophobicContact CG-CZ 4.14Å
2035	T	91.4	Very high	87	Confident	22 Å²	22	35 Å²	35	14%	0.135	18%	0.184	C	C	.	.	B	Isolated β-bridge	trans	-95.2	167.3	164.6	63.1	0	0	0	0	110.1	D2037 D2038 L2052 G2053 A2055 I2058	T2035-D2037 PolarHBondContact O-N 3.07Å; T2035-D2037 VanDerWaalsContact O-N 3.15Å; T2035-D2037 PolarHBondContact OG1-N 3.46Å; T2035-D2038 PolarHBondContact N-OD2 3.24Å; T2035-D2038 PolarHBondContact O-N 3.01Å; T2035-D2038 VanDerWaalsContact O-N 3.14Å; T2035-D2038 PolarHBondContact OG1-N 2.94Å; T2035-D2038 PolarHBondContact OG1-OD2 3.15Å; T2035-L2052 WeakPolarHBondContact O-CD1 3.26Å; T2035-G2053 WeakPolarHBondContact CA-O 3.21Å; T2035-A2055 HydrophobicContact CG2-CB 4.33Å; T2035-I2058 HydrophobicContact CG2-CD1 3.43Å; T2035-I2058 VanDerWaalsContact CG2-CD1 3.43Å; T2035-I2058 HydrophobicContact CG2-CG1 4.46Å
2036	A	81.9	Confident	86.5	Confident	42 Å²	42	37 Å²	37	35%	0.347	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-24.6	173.8	0	0	0	0	0	113.7	L2052 G2053	A2036-L2052 HydrophobicContact CB-CB 4.43Å; A2036-G2053 PolarHBondContact N-O 3.27Å
2037	D	83.4	Confident	86.1	Confident	136 Å²	136	39.4 Å²	39.4	73%	0.727	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-12.6	-179.1	-61.3	-37.8	0	0	0	113.3	T2035 L2039	T2035-D2037 PolarHBondContact O-N 3.07Å; T2035-D2037 VanDerWaalsContact O-N 3.15Å; T2035-D2037 PolarHBondContact OG1-N 3.46Å; D2037-L2039 VanDerWaalsContact C-N 3.27Å; D2037-L2039 PolarHBondContact O-N 2.91Å
2038	D	86.3	Confident	85.8	Confident	67 Å²	67	39.4 Å²	39.4	36%	0.358	21%	0.206	S	C	.	.	S	Bend	trans	-73.7	-16.9	179.8	-79.4	-67.7	0	0	0	113.4	L2034 T2035 R2191	L2034-D2038 WeakPolarHBondContact CA-OD2 3.44Å; L2034-D2038 HydrophobicContact CB-CB 4.33Å; L2034-D2038 HydrophobicContact CD2-CB 3.97Å; T2035-D2038 PolarHBondContact N-OD2 3.24Å; T2035-D2038 PolarHBondContact O-N 3.01Å; T2035-D2038 VanDerWaalsContact O-N 3.14Å; T2035-D2038 PolarHBondContact OG1-N 2.94Å; T2035-D2038 PolarHBondContact OG1-OD2 3.15Å; D2038-R2191 IonicContact OD1-NH2 3.75Å; D2038-R2191 PolarHBondContact OD1-NH2 2.75Å
2039	L	85.8	Confident	85.2	Confident	14 Å²	14	43.5 Å²	43.5	7%	0.073	22%	0.222	C	C	.	.	S	Bend	trans	-120.6	153.1	-176.8	-64.7	176.8	0	0	0	111.3	L2034 D2037 Q2041 N2046 L2052 F2093 P2187	L2034-L2039 HydrophobicContact CD1-CD1 4.21Å; D2037-L2039 VanDerWaalsContact C-N 3.27Å; D2037-L2039 PolarHBondContact O-N 2.91Å; L2039-Q2041 PolarHBondContact O-N 3.03Å; L2039-N2046 HydrophobicContact CB-CB 4.04Å; L2039-L2052 HydrophobicContact CD1-CD1 3.88Å; L2039-F2093 HydrophobicContact CD1-CE1 4.3Å; L2039-F2093 HydrophobicContact CD1-CE2 4.05Å; L2039-F2093 HydrophobicContact CD1-CZ 3.53Å; L2039-P2187 HydrophobicContact CD1-CB 4.32Å; L2039-P2187 HydrophobicContact CD2-CB 4.25Å
2040	P	75	Confident	84.9	Confident	25 Å²	25	44 Å²	44	16%	0.162	23%	0.225	C	C	.	.			trans	-58.7	138.1	179.5	-20.4	30.8	0	0	0	112.5	W2169	P2040-W2169 HydrophobicContact CG-CB 3.97Å; P2040-W2169 HydrophobicContact CG-CD2 3.69Å; P2040-W2169 HydrophobicContact CG-CE3 4.34Å; P2040-W2169 HydrophobicContact CG-CG 3.47Å; P2040-W2169 VanDerWaalsContact CG-CG 3.47Å
2041	Q	70.6	Confident	84.5	Confident	155 Å²	155	51 Å²	51	72%	0.724	25%	0.251	S	S	*	.	S	Bend	trans	-77.3	-23.9	169.6	-66.8	-169.4	1.4	0	0	112.6	L2039	L2039-Q2041 PolarHBondContact O-N 3.03Å
2042	E	69.7	Low	84.3	Confident	175 Å²	175	51.4 Å²	51.4	82%	0.818	25%	0.253	S	S	*	.	S	Bend	trans	-81.9	126.1	175.5	-69.1	-175	179	0	0	111.1
2043	G	69.5	Low	84	Confident	13 Å²	13	51.5 Å²	51.5	13%	0.134	25%	0.254	C	S	.	.	S	Bend	trans	78	165.1	-169.5	0	0	0	0	0	112.2	W2045	G2043-W2045 PolarHBondContact O-N 2.94Å
2044	G	78.6	Confident	83.9	Confident	3 Å²	3	53.2 Å²	53.2	3%	0.031	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-79.1	30.8	-179.5	0	0	0	0	0	115.8	N2046 E2047 K2083 K2085 A2089	G2044-N2046 VanDerWaalsContact C-N 3.32Å; G2044-N2046 PolarHBondContact O-N 3.23Å; G2044-E2047 WeakPolarHBondContact O-CB 3.23Å; G2044-E2047 PolarHBondContact O-N 3.34Å; G2044-K2083 CarbonylContact C-O 3.34Å; G2044-K2083 WeakPolarHBondContact CA-O 3.48Å; G2044-K2083 PolarHBondContact N-O 2.92Å; G2044-K2083 VanDerWaalsContact N-O 3.12Å; G2044-K2083 WeakPolarHBondContact O-CE 3.48Å; G2044-K2083 PolarHBondContact O-NZ 3.44Å; G2044-K2085 PolarHBondContact N-O 2.73Å; G2044-A2089 VanDerWaalsContact CA-CB 3.47Å
2045	W	85.3	Confident	83.7	Confident	33 Å²	33	55.8 Å²	55.8	13%	0.125	29%	0.29	C	S	.	.	G	3₁₀ helix	trans	-68.9	-29.7	-177.4	-69.3	105.5	0	0	0	112.9	G2043 I2080 K2083 F2093 W2185	G2043-W2045 PolarHBondContact O-N 2.94Å; W2045-I2080 HydrophobicContact CH2-CG1 4.48Å; W2045-I2080 HydrophobicContact CH2-CG2 3.99Å; W2045-I2080 HydrophobicContact CZ2-CG2 4.35Å; W2045-K2083 HydrophobicContact CE3-CB 4.16Å; W2045-K2083 HydrophobicContact CZ3-CB 4.13Å; W2045-F2093 WeakPolarHBondContact O-CE1 3.3Å; W2045-F2093 WeakPolarHBondContact O-CZ 3.43Å; W2045-W2185 HydrophobicContact CE3-CD2 4.46Å; W2045-W2185 AromaticContact CE3-CE3 3.94Å; W2045-W2185 HydrophobicContact CE3-CE3 3.94Å; W2045-W2185 AromaticContact CE3-CH2 3.95Å; W2045-W2185 HydrophobicContact CE3-CH2 3.95Å; W2045-W2185 AromaticContact CE3-CZ3 3.65Å; W2045-W2185 HydrophobicContact CE3-CZ3 3.65Å; W2045-W2185 AromaticContact CZ3-CD2 3.69Å; W2045-W2185 HydrophobicContact CZ3-CD2 3.69Å; W2045-W2185 AromaticContact CZ3-CE3 3.51Å; W2045-W2185 HydrophobicContact CZ3-CE3 3.51Å; W2045-W2185 HydrophobicContact CZ3-CG 4.26Å; W2045-W2185 HydrophobicContact CZ3-CH2 4.09Å; W2045-W2185 HydrophobicContact CZ3-CZ2 4.32Å; W2045-W2185 AromaticContact CZ3-CZ3 3.71Å; W2045-W2185 HydrophobicContact CZ3-CZ3 3.71Å
2046	N	86.3	Confident	83.7	Confident	43 Å²	43	60.3 Å²	60.3	23%	0.23	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-89.3	-0.4	174.3	66.6	-3.4	0	0	0	113.6	L2039 G2044 V2048	L2039-N2046 HydrophobicContact CB-CB 4.04Å; G2044-N2046 VanDerWaalsContact C-N 3.32Å; G2044-N2046 PolarHBondContact O-N 3.23Å; N2046-V2048 PolarHBondContact O-N 2.93Å; N2046-V2048 VanDerWaalsContact O-N 3.16Å
2047	E	87.1	Confident	84.2	Confident	50 Å²	50	59.2 Å²	59.2	23%	0.234	30%	0.301	C	S	.	.			trans	-72.6	109.5	-178.9	-74.4	-66.1	160.3	0	0	111.6	G2044 R2049 K2083 P2091 G2092	G2044-E2047 WeakPolarHBondContact O-CB 3.23Å; G2044-E2047 PolarHBondContact O-N 3.34Å; E2047-R2049 IonicContact OE2-CZ 3.83Å; E2047-R2049 VanDerWaalsContact OE2-CZ 3.3Å; E2047-R2049 IonicContact OE2-NH1 3.02Å; E2047-R2049 PolarHBondContact OE2-NH1 3.24Å; E2047-R2049 IonicContact OE2-NH2 3.13Å; E2047-R2049 PolarHBondContact OE2-NH2 2.59Å; E2047-K2083 PolarHBondContact O-NZ 3.23Å; E2047-P2091 VanDerWaalsContact O-CA 3.3Å; E2047-P2091 WeakPolarHBondContact O-CA 3.47Å; E2047-G2092 PolarHBondContact O-N 3.32Å; E2047-G2092 VanDerWaalsContact O-N 3.07Å
2048	V	89.2	Confident	84.7	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	27%	0.27	C	S	.	.			trans	-146.9	154.9	173.1	61.7	0	0	0	0	109.1	N2046 P2050 R2051 L2052 F2093	N2046-V2048 PolarHBondContact O-N 2.93Å; N2046-V2048 VanDerWaalsContact O-N 3.16Å; V2048-P2050 CarbonylContact O-C 3.52Å; V2048-R2051 WeakPolarHBondContact O-CA 3.17Å; V2048-R2051 PolarHBondContact O-N 2.91Å; V2048-L2052 HydrophobicContact CG1-CD2 3.97Å; V2048-L2052 HydrophobicContact CG1-CG 3.79Å; V2048-F2093 HydrophobicContact CB-CD2 4.24Å; V2048-F2093 HydrophobicContact CB-CE2 3.84Å; V2048-F2093 HydrophobicContact CB-CZ 4.03Å; V2048-F2093 HydrophobicContact CG1-CE2 3.77Å; V2048-F2093 HydrophobicContact CG1-CZ 4.09Å; V2048-F2093 HydrophobicContact CG2-CD2 4.24Å; V2048-F2093 HydrophobicContact CG2-CE2 4.29Å
2049	R	84.5	Confident	85	Confident	86 Å²	86	54.6 Å²	54.6	33%	0.325	28%	0.276	S	S	.	.	S	Bend	trans	-130.8	115.3	176.8	-67.2	-65.8	177.8	-79.6	-7.9	108.6	E2047 P2091	E2047-R2049 IonicContact OE2-CZ 3.83Å; E2047-R2049 VanDerWaalsContact OE2-CZ 3.3Å; E2047-R2049 IonicContact OE2-NH1 3.02Å; E2047-R2049 PolarHBondContact OE2-NH1 3.24Å; E2047-R2049 IonicContact OE2-NH2 3.13Å; E2047-R2049 PolarHBondContact OE2-NH2 2.59Å; R2049-P2091 HydrophobicContact CB-CB 4.36Å; R2049-P2091 HydrophobicContact CG-CB 3.83Å; R2049-P2091 HydrophobicContact CG-CG 4.13Å
2050	P	86.7	Confident	85.4	Confident	14 Å²	14	54.1 Å²	54.1	9%	0.091	28%	0.275	C	S	.	.	S	Bend	cis	-70	148.6	6	-19.7	35.4	0	0	0	112.5	A1980 H2003 A2005 H2031 V2048	A1980-P2050 WeakPolarHBondContact O-CG 3.22Å; H2003-P2050 WeakPolarHBondContact CE1-CD 3.5Å; H2003-P2050 WeakPolarHBondContact ND1-CD 3.4Å; H2003-P2050 VanDerWaalsContact ND1-CG 3.25Å; H2003-P2050 WeakPolarHBondContact ND1-CG 3.44Å; A2005-P2050 HydrophobicContact CB-CB 3.99Å; H2031-P2050 PolarHBondContact NE2-O 2.98Å; V2048-P2050 CarbonylContact O-C 3.52Å
2051	R	86.7	Confident	86.3	Confident	152 Å²	152	53 Å²	53	57%	0.574	27%	0.267	S	S	*	.	P	Polyproline II helix	trans	-62.1	145.6	179.9	-71.4	-174.3	177.4	-173.8	-0.2	110.7	R2006 V2048	R2006-R2051 PolarHBondContact NH2-O 3Å; V2048-R2051 WeakPolarHBondContact O-CA 3.17Å; V2048-R2051 PolarHBondContact O-N 2.91Å
2052	L	90.6	Very high	87.5	Confident	9 Å²	9	46.8 Å²	46.8	5%	0.047	24%	0.237	C	C	.	.	P	Polyproline II helix	trans	-53.1	143.1	179.4	-66	179.3	0	0	0	113	R2006 H2030 L2034 T2035 A2036 L2039 V2048 F2093	R2006-L2052 PolarHBondContact NH2-O 3.01Å; H2030-L2052 HydrophobicContact CB-CD2 4.46Å; L2034-L2052 HydrophobicContact CB-CD1 4Å; L2034-L2052 HydrophobicContact CB-CD2 4.25Å; T2035-L2052 WeakPolarHBondContact O-CD1 3.26Å; A2036-L2052 HydrophobicContact CB-CB 4.43Å; L2039-L2052 HydrophobicContact CD1-CD1 3.88Å; V2048-L2052 HydrophobicContact CG1-CD2 3.97Å; V2048-L2052 HydrophobicContact CG1-CG 3.79Å; L2052-F2093 HydrophobicContact CD1-CE2 4.37Å; L2052-F2093 HydrophobicContact CD2-CE2 4.37Å
2053	G	88.3	Confident	88.5	Confident	3 Å²	3	42.2 Å²	42.2	3%	0.031	23%	0.229	C	C	.	.	B	Isolated β-bridge	trans	-69.6	167.5	-176.5	0	0	0	0	0	114.3	T2035 A2036	T2035-G2053 WeakPolarHBondContact CA-O 3.21Å; A2036-G2053 PolarHBondContact N-O 3.27Å
2054	T	91.4	Very high	89.7	Confident	73 Å²	73	42.2 Å²	42.2	45%	0.448	23%	0.226	S	C	.	.	P	Polyproline II helix	trans	-78.1	166.6	157.2	61.1	0	0	0	0	109.9	D2056 D2057 I2058	T2054-D2056 PolarHBondContact O-N 2.86Å; T2054-D2057 PolarHBondContact N-OD2 2.98Å; T2054-D2057 WeakPolarHBondContact O-CB 3.3Å; T2054-D2057 PolarHBondContact O-N 3.49Å; T2054-D2057 VanDerWaalsContact O-N 3.09Å; T2054-D2057 PolarHBondContact OG1-N 2.96Å; T2054-D2057 PolarHBondContact OG1-OD2 3.38Å; T2054-I2058 WeakPolarHBondContact O-CG1 3.4Å; T2054-I2058 PolarHBondContact O-N 3.46Å; T2054-I2058 VanDerWaalsContact O-N 3.13Å
2055	A	89.7	Confident	90.4	Very high	57 Å²	57	43.1 Å²	43.1	47%	0.471	23%	0.23	S	C	.	.	H	α-helix	trans	-57.5	-33.7	173.6	0	0	0	0	0	112.6	T2035 I2058 N2059	T2035-A2055 HydrophobicContact CG2-CB 4.33Å; A2055-I2058 PolarHBondContact O-N 3.24Å; A2055-N2059 WeakPolarHBondContact O-CB 3.45Å; A2055-N2059 VanDerWaalsContact O-CG 3.25Å; A2055-N2059 PolarHBondContact O-N 3.43Å; A2055-N2059 PolarHBondContact O-ND2 2.96Å
2056	D	90.9	Very high	90.7	Very high	117 Å²	117	46 Å²	46	63%	0.626	26%	0.255	S	S	*	.	H	α-helix	trans	-66.9	-37.3	176.1	-72.9	-17.7	0	0	0	112.4	T2054 N2059 A2060	T2054-D2056 PolarHBondContact O-N 2.86Å; D2056-N2059 PolarHBondContact O-N 3.48Å; D2056-A2060 WeakPolarHBondContact O-CB 3.45Å; D2056-A2060 PolarHBondContact O-N 3.19Å
2057	D	93.7	Very high	91	Very high	19 Å²	19	44.4 Å²	44.4	10%	0.102	25%	0.247	C	C	.	.	H	α-helix	trans	-62.2	-47.8	173.2	-68.5	-53.4	0	0	0	110.7	R2006 R2007 T2054 N2059 A2060 L2061	R2006-D2057 WeakPolarHBondContact CA-OD1 3.45Å; R2006-D2057 WeakPolarHBondContact CD-OD2 3.44Å; R2006-D2057 IonicContact CZ-OD2 2.92Å; R2006-D2057 IonicContact NH1-OD2 2.88Å; R2006-D2057 PolarHBondContact NH1-OD2 3.36Å; R2007-D2057 PolarHBondContact N-OD1 3.42Å; T2054-D2057 PolarHBondContact N-OD2 2.98Å; T2054-D2057 WeakPolarHBondContact O-CB 3.3Å; T2054-D2057 PolarHBondContact O-N 3.49Å; T2054-D2057 VanDerWaalsContact O-N 3.09Å; T2054-D2057 PolarHBondContact OG1-N 2.96Å; T2054-D2057 PolarHBondContact OG1-OD2 3.38Å; D2057-N2059 VanDerWaalsContact C-N 3.33Å; D2057-N2059 PolarHBondContact O-N 3.17Å; D2057-A2060 WeakPolarHBondContact O-CB 3.29Å; D2057-A2060 PolarHBondContact O-N 2.91Å; D2057-A2060 VanDerWaalsContact O-N 3.11Å; D2057-L2061 WeakPolarHBondContact O-CG 3.4Å; D2057-L2061 PolarHBondContact O-N 3.13Å
2058	I	93.7	Very high	91.4	Very high	14 Å²	14	42 Å²	42	7%	0.072	24%	0.236	C	C	.	.	H	α-helix	trans	-59.2	-45.7	178.1	-60.8	-174.8	0	0	0	110.9	H2031 L2032 L2034 T2035 T2054 A2055 A2060 L2061 W2062	H2031-I2058 WeakPolarHBondContact O-CG1 3.29Å; L2032-I2058 WeakPolarHBondContact O-CG2 3.4Å; L2034-I2058 WeakPolarHBondContact O-CD1 3.5Å; T2035-I2058 HydrophobicContact CG2-CD1 3.43Å; T2035-I2058 VanDerWaalsContact CG2-CD1 3.43Å; T2035-I2058 HydrophobicContact CG2-CG1 4.46Å; T2054-I2058 WeakPolarHBondContact O-CG1 3.4Å; T2054-I2058 PolarHBondContact O-N 3.46Å; T2054-I2058 VanDerWaalsContact O-N 3.13Å; A2055-I2058 PolarHBondContact O-N 3.24Å; I2058-A2060 VanDerWaalsContact C-N 3.29Å; I2058-A2060 PolarHBondContact O-N 2.85Å; I2058-L2061 PolarHBondContact O-N 3.25Å; I2058-W2062 PolarHBondContact O-N 2.92Å
2059	N	92	Very high	91.7	Very high	91 Å²	91	42.4 Å²	42.4	49%	0.487	24%	0.238	S	C	.	.	H	α-helix	trans	-62.2	-37.7	177.2	-72.3	-28.8	0	0	0	111.7	A2055 D2056 D2057 A2063	A2055-N2059 WeakPolarHBondContact O-CB 3.45Å; A2055-N2059 VanDerWaalsContact O-CG 3.25Å; A2055-N2059 PolarHBondContact O-N 3.43Å; A2055-N2059 PolarHBondContact O-ND2 2.96Å; D2056-N2059 PolarHBondContact O-N 3.48Å; D2057-N2059 VanDerWaalsContact C-N 3.33Å; D2057-N2059 PolarHBondContact O-N 3.17Å; N2059-A2063 WeakPolarHBondContact O-CB 3.28Å; N2059-A2063 PolarHBondContact O-N 3.03Å
2060	A	93.7	Very high	92.3	Very high	5 Å²	5	38.3 Å²	38.3	4%	0.041	22%	0.223	C	C	.	.	H	α-helix	trans	-66	-38.2	175.2	0	0	0	0	0	112.4	R2007 D2056 D2057 I2058 A2063 N2064	R2007-A2060 HydrophobicContact CB-CB 3.62Å; R2007-A2060 HydrophobicContact CG-CB 3.68Å; D2056-A2060 WeakPolarHBondContact O-CB 3.45Å; D2056-A2060 PolarHBondContact O-N 3.19Å; D2057-A2060 WeakPolarHBondContact O-CB 3.29Å; D2057-A2060 PolarHBondContact O-N 2.91Å; D2057-A2060 VanDerWaalsContact O-N 3.11Å; I2058-A2060 VanDerWaalsContact C-N 3.29Å; I2058-A2060 PolarHBondContact O-N 2.85Å; A2060-A2063 PolarHBondContact O-N 3.33Å; A2060-N2064 WeakPolarHBondContact O-CB 3.09Å; A2060-N2064 PolarHBondContact O-N 2.93Å; A2060-N2064 VanDerWaalsContact O-N 3.08Å; A2060-N2064 PolarHBondContact O-ND2 2.98Å
2061	L	95.2	Very high	92.8	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-63.4	-49.4	174.7	-64.2	174.6	0	0	0	111.1	V2004 I2010 V2027 H2031 L2032 D2057 I2058 A2063 N2064 I2065	V2004-L2061 HydrophobicContact CG1-CD2 4Å; I2010-L2061 HydrophobicContact CB-CD2 4.13Å; I2010-L2061 HydrophobicContact CG1-CD2 4.47Å; I2010-L2061 HydrophobicContact CG2-CD2 4.25Å; V2027-L2061 HydrophobicContact CG1-CD1 4.04Å; V2027-L2061 HydrophobicContact CG2-CD2 4.17Å; H2031-L2061 HydrophobicContact CB-CD1 4.23Å; L2032-L2061 HydrophobicContact CD2-CB 3.92Å; L2032-L2061 HydrophobicContact CD2-CD1 4.46Å; D2057-L2061 WeakPolarHBondContact O-CG 3.4Å; D2057-L2061 PolarHBondContact O-N 3.13Å; I2058-L2061 PolarHBondContact O-N 3.25Å; L2061-A2063 VanDerWaalsContact C-N 3.34Å; L2061-A2063 PolarHBondContact O-N 3.38Å; L2061-N2064 CarbonylContact O-C 3.55Å; L2061-N2064 PolarHBondContact O-N 3.29Å; L2061-N2064 VanDerWaalsContact O-N 3.11Å; L2061-I2065 PolarHBondContact O-N 3.39Å
2062	W	94.4	Very high	93.3	Very high	26 Å²	26	30.4 Å²	30.4	10%	0.098	19%	0.191	C	C	.	.	H	α-helix	trans	-61.8	-39.1	175.8	-78.1	110.2	0	0	0	112.6	L2032 F2033 I2058 N2064 I2065 A2106 R2111 L2112	L2032-W2062 HydrophobicContact CB-CZ2 3.94Å; L2032-W2062 HydrophobicContact CD1-CH2 4.5Å; L2032-W2062 HydrophobicContact CD1-CZ2 4.3Å; L2032-W2062 HydrophobicContact CD2-CD2 4.25Å; L2032-W2062 HydrophobicContact CD2-CZ2 4.23Å; L2032-W2062 HydrophobicContact CG-CZ2 4.38Å; L2032-W2062 PolarHBondContact O-NE1 3.14Å; F2033-W2062 HydrophobicContact CE1-CZ2 4.14Å; F2033-W2062 HydrophobicContact CE2-CZ2 4.3Å; F2033-W2062 HydrophobicContact CZ-CH2 4.29Å; F2033-W2062 AromaticContact CZ-CZ2 3.84Å; F2033-W2062 HydrophobicContact CZ-CZ2 3.84Å; I2058-W2062 PolarHBondContact O-N 2.92Å; W2062-N2064 PolarHBondContact O-N 2.88Å; W2062-I2065 HydrophobicContact CE3-CD1 4.25Å; W2062-I2065 HydrophobicContact CZ3-CD1 4.22Å; W2062-I2065 WeakPolarHBondContact O-CB 3.46Å; W2062-I2065 PolarHBondContact O-N 3.13Å; W2062-A2106 HydrophobicContact CH2-CB 3.62Å; W2062-A2106 HydrophobicContact CZ2-CB 4.14Å; W2062-A2106 HydrophobicContact CZ3-CB 4.44Å; W2062-R2111 HydrophobicContact CE3-CB 4.1Å; W2062-R2111 HydrophobicContact CH2-CB 4.39Å; W2062-R2111 HydrophobicContact CZ3-CB 3.98Å; W2062-L2112 HydrophobicContact CZ3-CB 4.37Å
2063	A	91.7	Very high	93.5	Very high	79 Å²	79	30 Å²	30	65%	0.653	19%	0.189	S	C	*	.	H	α-helix	trans	-67.4	-20.6	176.4	0	0	0	0	0	113.5	N2059 A2060 L2061	N2059-A2063 WeakPolarHBondContact O-CB 3.28Å; N2059-A2063 PolarHBondContact O-N 3.03Å; A2060-A2063 PolarHBondContact O-N 3.33Å; L2061-A2063 VanDerWaalsContact C-N 3.34Å; L2061-A2063 PolarHBondContact O-N 3.38Å
2064	N	94.6	Very high	93.7	Very high	12 Å²	12	30.3 Å²	30.3	6%	0.064	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.6	30.1	176.7	-70.3	-85.4	0	0	0	111.7	I2010 R2014 A2060 L2061 W2062 S2066 T2067 I2068	I2010-N2064 HydrophobicContact CG1-CB 3.55Å; I2010-N2064 HydrophobicContact CG2-CB 4.34Å; R2014-N2064 PolarHBondContact NH1-OD1 3.44Å; A2060-N2064 WeakPolarHBondContact O-CB 3.09Å; A2060-N2064 PolarHBondContact O-N 2.93Å; A2060-N2064 VanDerWaalsContact O-N 3.08Å; A2060-N2064 PolarHBondContact O-ND2 2.98Å; L2061-N2064 CarbonylContact O-C 3.55Å; L2061-N2064 PolarHBondContact O-N 3.29Å; L2061-N2064 VanDerWaalsContact O-N 3.11Å; W2062-N2064 PolarHBondContact O-N 2.88Å; N2064-S2066 PolarHBondContact O-N 3.28Å; N2064-S2066 VanDerWaalsContact O-N 3.15Å; N2064-T2067 WeakPolarHBondContact O-CA 3.29Å; N2064-T2067 VanDerWaalsContact O-CB 3.3Å; N2064-T2067 WeakPolarHBondContact O-CB 3.3Å; N2064-T2067 PolarHBondContact O-N 3.35Å; N2064-I2068 PolarHBondContact O-N 2.6Å
2065	I	93.8	Very high	93.9	Very high	22 Å²	22	26.9 Å²	26.9	11%	0.113	17%	0.169	C	C	.	.	G	3₁₀ helix	trans	-53.2	-39.1	-179.7	-162.4	62.2	0	0	0	112.1	L2061 W2062 T2067 I2068 F2071 L2112 R2120	L2061-I2065 PolarHBondContact O-N 3.39Å; W2062-I2065 HydrophobicContact CE3-CD1 4.25Å; W2062-I2065 HydrophobicContact CZ3-CD1 4.22Å; W2062-I2065 WeakPolarHBondContact O-CB 3.46Å; W2062-I2065 PolarHBondContact O-N 3.13Å; I2065-T2067 PolarHBondContact O-N 3.22Å; I2065-I2068 HydrophobicContact CD1-CD1 4.18Å; I2065-I2068 PolarHBondContact O-N 2.8Å; I2065-F2071 HydrophobicContact CD1-CE1 4.23Å; I2065-F2071 HydrophobicContact CD1-CZ 3.88Å; I2065-L2112 HydrophobicContact CD1-CD1 4.16Å; I2065-L2112 HydrophobicContact CG1-CD1 3.97Å; I2065-R2120 PolarHBondContact O-NE 3Å; I2065-R2120 PolarHBondContact O-NH2 2.91Å
2066	S	89.9	Confident	94.1	Very high	93 Å²	93	24.3 Å²	24.3	65%	0.65	15%	0.147	S	C	*	.	G	3₁₀ helix	trans	-63.4	-21.4	176.8	59.4	0	0	0	0	114.4	N2064	N2064-S2066 PolarHBondContact O-N 3.28Å; N2064-S2066 VanDerWaalsContact O-N 3.15Å
2067	T	93.3	Very high	94.1	Very high	10 Å²	10	18.7 Å²	18.7	6%	0.061	12%	0.118	C	C	.	.	G	3₁₀ helix	trans	-86	-21.7	175.5	-52.1	0	0	0	0	111.4	I2010 I2013 R2014 K2017 C2025 N2064 I2065	I2010-T2067 HydrophobicContact CD1-CG2 3.79Å; I2010-T2067 HydrophobicContact CG1-CG2 4.34Å; I2013-T2067 HydrophobicContact CG2-CG2 4.15Å; R2014-T2067 HydrophobicContact CB-CG2 3.77Å; R2014-T2067 HydrophobicContact CG-CG2 4.36Å; K2017-T2067 HydrophobicContact CD-CG2 4.25Å; K2017-T2067 PolarHBondContact NZ-O 3.3Å; C2025-T2067 PolarHBondContact SG-O 2.99Å; C2025-T2067 VanDerWaalsContact SG-O 3.38Å; N2064-T2067 WeakPolarHBondContact O-CA 3.29Å; N2064-T2067 VanDerWaalsContact O-CB 3.3Å; N2064-T2067 WeakPolarHBondContact O-CB 3.3Å; N2064-T2067 PolarHBondContact O-N 3.35Å; I2065-T2067 PolarHBondContact O-N 3.22Å
2068	I	96.4	Very high	94	Very high	1 Å²	1	18.1 Å²	18.1	1%	0.005	11%	0.114	C	C	.	.			trans	-82.9	122.6	179.9	-60.1	166.3	0	0	0	109	I2010 V2027 N2064 I2065 C2070 F2071 R2120	I2010-I2068 HydrophobicContact CD1-CG1 3.91Å; V2027-I2068 HydrophobicContact CB-CD1 4.16Å; V2027-I2068 HydrophobicContact CB-CG2 4.12Å; V2027-I2068 HydrophobicContact CG2-CB 4.45Å; V2027-I2068 HydrophobicContact CG2-CD1 3.5Å; V2027-I2068 VanDerWaalsContact CG2-CD1 3.5Å; V2027-I2068 HydrophobicContact CG2-CG1 3.7Å; V2027-I2068 HydrophobicContact CG2-CG2 3.89Å; N2064-I2068 PolarHBondContact O-N 2.6Å; I2065-I2068 HydrophobicContact CD1-CD1 4.18Å; I2065-I2068 PolarHBondContact O-N 2.8Å; I2068-C2070 VanDerWaalsContact CG2-O 3.31Å; I2068-C2070 WeakPolarHBondContact CG2-O 3.37Å; I2068-F2071 HydrophobicContact CG2-CD1 4.49Å; I2068-F2071 HydrophobicContact CG2-CE1 4.31Å; I2068-R2120 PolarHBondContact O-NE 2.98Å; I2068-R2120 PolarHBondContact O-NH2 2.88Å
2069	D	95.7	Very high	93.6	Very high	8 Å²	8	18.8 Å²	18.8	4%	0.043	12%	0.119	C	C	.	.			trans	-91.1	-35.2	-177	-49.2	-59.2	0	0	0	113	K2017 T2024 C2025 R2120 N2124 I2128 I2239	K2017-D2069 WeakPolarHBondContact CE-OD2 3.37Å; K2017-D2069 IonicContact NZ-OD1 2.93Å; K2017-D2069 PolarHBondContact NZ-OD1 3.4Å; K2017-D2069 IonicContact NZ-OD2 3.48Å; K2017-D2069 PolarHBondContact NZ-OD2 3.25Å; T2024-D2069 VanDerWaalsContact C-OD2 3.3Å; T2024-D2069 WeakPolarHBondContact CA-OD2 3.19Å; T2024-D2069 WeakPolarHBondContact CB-OD2 3.44Å; C2025-D2069 PolarHBondContact N-OD2 3.08Å; C2025-D2069 PolarHBondContact O-N 2.97Å; D2069-R2120 VanDerWaalsContact O-CA 3.3Å; D2069-R2120 WeakPolarHBondContact O-CA 3.16Å; D2069-R2120 VanDerWaalsContact O-CG 3.29Å; D2069-R2120 WeakPolarHBondContact O-CG 3.32Å; D2069-N2124 HydrophobicContact CB-CB 4.42Å; D2069-N2124 VanDerWaalsContact O-CB 3.23Å; D2069-N2124 WeakPolarHBondContact O-CB 3.44Å; D2069-N2124 PolarHBondContact O-ND2 3.1Å; D2069-I2128 HydrophobicContact CB-CD1 3.9Å; D2069-I2239 HydrophobicContact CB-CD1 4.01Å; D2069-I2239 WeakPolarHBondContact OD1-CD1 3.24Å
2070	C	96.6	Very high	93.2	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	154.3	-176.7	-64	0	0	0	0	112	I1858 C2025 E2026 V2027 I2068 R2120	I1858-C2070 HydrophobicContact CD1-CB 3.42Å; I1858-C2070 VanDerWaalsContact CD1-CB 3.42Å; I1858-C2070 HydrophobicContact CG1-CB 4.38Å; C2025-C2070 PolarHBondContact O-N 3.33Å; C2025-C2070 VanDerWaalsContact O-N 3.13Å; E2026-C2070 WeakPolarHBondContact CA-O 3.14Å; E2026-C2070 HydrophobicContact CB-CB 3.89Å; E2026-C2070 WeakPolarHBondContact CB-O 3.42Å; V2027-C2070 PolarHBondContact N-O 3.49Å; V2027-C2070 VanDerWaalsContact N-O 3.16Å; I2068-C2070 VanDerWaalsContact CG2-O 3.31Å; I2068-C2070 WeakPolarHBondContact CG2-O 3.37Å; C2070-R2120 VanDerWaalsContact CA-O 3.31Å; C2070-R2120 WeakPolarHBondContact CA-O 3.41Å
2071	F	97.4	Very high	92.7	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	137.2	158.5	-61.7	-55.4	0	0	0	108.5	L2032 I2065 I2068 M2099 L2103 L2112 R2120 L2121	L2032-F2071 HydrophobicContact CD1-CD1 4Å; L2032-F2071 HydrophobicContact CD1-CE1 3.6Å; L2032-F2071 HydrophobicContact CD1-CZ 4.45Å; I2065-F2071 HydrophobicContact CD1-CE1 4.23Å; I2065-F2071 HydrophobicContact CD1-CZ 3.88Å; I2068-F2071 HydrophobicContact CG2-CD1 4.49Å; I2068-F2071 HydrophobicContact CG2-CE1 4.31Å; F2071-M2099 HydrophobicContact CB-SD 4.25Å; F2071-L2103 HydrophobicContact CB-CD1 4.22Å; F2071-L2103 HydrophobicContact CD2-CD1 3.64Å; F2071-L2103 HydrophobicContact CD2-CD2 4.11Å; F2071-L2103 HydrophobicContact CE1-CD2 4.35Å; F2071-L2103 HydrophobicContact CE2-CD1 4.16Å; F2071-L2103 HydrophobicContact CE2-CD2 3.93Å; F2071-L2103 HydrophobicContact CG-CD1 4.03Å; F2071-L2103 HydrophobicContact CG-CD2 4.38Å; F2071-L2103 HydrophobicContact CZ-CD2 4.04Å; F2071-L2112 HydrophobicContact CE2-CD1 4.44Å; F2071-L2112 HydrophobicContact CE2-CD2 4.04Å; F2071-L2112 HydrophobicContact CZ-CD1 4.31Å; F2071-L2112 HydrophobicContact CZ-CD2 4.41Å; F2071-R2120 HydrophobicContact CD2-CB 3.58Å; F2071-R2120 HydrophobicContact CD2-CG 4.42Å; F2071-R2120 HydrophobicContact CE2-CB 3.78Å; F2071-R2120 VanDerWaalsContact CE2-CD 3.47Å; F2071-R2120 HydrophobicContact CE2-CG 4.23Å; F2071-R2120 HydrophobicContact CG-CB 4.23Å; F2071-R2120 PolarHBondContact N-O 3.32Å; F2071-L2121 HydrophobicContact CB-CD2 3.8Å; F2071-L2121 HydrophobicContact CB-CG 4.4Å; F2071-L2121 HydrophobicContact CD2-CG 4.26Å
2072	A	95.8	Very high	92.3	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	14%	0.141	C	C	.	.			trans	-140	139.9	177.8	0	0	0	0	0	108.9	D1857 I1858 H1859 E2026 V2027 C2028 P2029 D2074	D1857-A2072 WeakPolarHBondContact OD1-CA 3.4Å; I1858-A2072 HydrophobicContact CD1-CB 4.4Å; I1858-A2072 HydrophobicContact CG1-CB 3.64Å; H1859-A2072 HydrophobicContact CB-CB 3.63Å; E2026-A2072 HydrophobicContact CB-CB 4.25Å; E2026-A2072 VanDerWaalsContact CD-CB 3.49Å; E2026-A2072 HydrophobicContact CG-CB 4.08Å; E2026-A2072 WeakPolarHBondContact OE2-CB 3.07Å; V2027-A2072 PolarHBondContact O-N 2.94Å; C2028-A2072 WeakPolarHBondContact CA-O 3.48Å; C2028-A2072 WeakPolarHBondContact CB-O 3.34Å; C2028-A2072 PolarHBondContact SG-O 2.67Å; P2029-A2072 WeakPolarHBondContact CD-O 3.47Å; A2072-D2074 VanDerWaalsContact C-N 3.28Å; A2072-D2074 PolarHBondContact O-N 3.34Å
2073	T	94.8	Very high	92	Very high	1 Å²	1	20.9 Å²	20.9	1%	0.006	14%	0.136	C	C	.	.			trans	-71.5	-27.1	-173.8	51.5	0	0	0	0	113.6	D1857 H2030 H2075 M2099	D1857-T2073 PolarHBondContact OD1-N 3.06Å; D1857-T2073 VanDerWaalsContact OD1-N 3.11Å; D1857-T2073 WeakPolarHBondContact OD2-CB 3.46Å; D1857-T2073 WeakPolarHBondContact OD2-CG2 3.46Å; D1857-T2073 PolarHBondContact OD2-N 2.78Å; D1857-T2073 PolarHBondContact OD2-OG1 3.22Å; H2030-T2073 PolarHBondContact CE1-O 3.49Å; T2073-H2075 PolarHBondContact O-N 3.25Å; T2073-H2075 WeakPolarHBondContact OG1-CB 3.36Å; T2073-H2075 PolarHBondContact OG1-N 3.41Å; T2073-H2075 VanDerWaalsContact OG1-N 3.11Å; T2073-M2099 HydrophobicContact CG2-CB 3.68Å; T2073-M2099 HydrophobicContact CG2-CE 3.8Å; T2073-M2099 HydrophobicContact CG2-CG 4.21Å; T2073-M2099 HydrophobicContact CG2-SD 3.58Å; T2073-M2099 VanDerWaalsContact CG2-SD 3.58Å
2074	D	94.1	Very high	91.5	Very high	8 Å²	8	19.8 Å²	19.8	4%	0.043	12%	0.124	C	C	.	.			trans	46.8	48.9	-157.7	-174.2	32	0	0	0	109.9	H1859 H1861 H2003 C2028 A2072 A2076	H1859-D2074 IonicContact CD2-OD1 2.8Å; H1859-D2074 PolarHBondContact CD2-OD1 3.16Å; H1859-D2074 IonicContact NE2-OD1 3.79Å; H1859-D2074 PolarHBondContact NE2-OD1 3.13Å; H1859-D2074 WeakPolarHBondContact O-CA 3.26Å; H1859-D2074 PolarHBondContact O-N 2.6Å; H1861-D2074 IonicContact CD2-OD1 3.3Å; H1861-D2074 IonicContact NE2-OD1 2.75Å; H1861-D2074 PolarHBondContact NE2-OD1 3.24Å; H2003-D2074 IonicContact CD2-OD2 3.47Å; C2028-D2074 VanDerWaalsContact SG-CB 3.56Å; A2072-D2074 VanDerWaalsContact C-N 3.28Å; A2072-D2074 PolarHBondContact O-N 3.34Å; D2074-A2076 PolarHBondContact O-N 3.06Å
2075	H	95.2	Very high	91	Very high	1 Å²	1	24.3 Å²	24.3	1%	0.005	14%	0.143	C	C	.	.	B	Isolated β-bridge	trans	-63.2	100.8	-178.2	176.6	93.7	0	0	0	108.8	H1859 V1860 H1861 E1871 T2073 P2077 P2094 G2095 L2096	H1859-H2075 PolarHBondContact O-N 2.98Å; V1860-H2075 HydrophobicContact CG1-CB 4.35Å; H1861-H2075 VanDerWaalsContact CB-O 3.29Å; H1861-H2075 WeakPolarHBondContact CB-O 3.46Å; H1861-H2075 PolarHBondContact N-O 3.46Å; E1871-H2075 IonicContact OE2-CE1 3.94Å; E1871-H2075 IonicContact OE2-NE2 2.96Å; E1871-H2075 PolarHBondContact OE2-NE2 3.04Å; T2073-H2075 PolarHBondContact O-N 3.25Å; T2073-H2075 WeakPolarHBondContact OG1-CB 3.36Å; T2073-H2075 PolarHBondContact OG1-N 3.41Å; T2073-H2075 VanDerWaalsContact OG1-N 3.11Å; H2075-P2077 WeakPolarHBondContact O-CD 3.49Å; H2075-P2094 WeakPolarHBondContact ND1-CA 3.34Å; H2075-G2095 PolarHBondContact ND1-N 3.15Å; H2075-G2095 VanDerWaalsContact ND1-N 3.11Å; H2075-L2096 HydrophobicContact CB-CD1 4.11Å; H2075-L2096 HydrophobicContact CB-CG 3.77Å; H2075-L2096 PolarHBondContact ND1-N 2.78Å
2076	A	93.2	Very high	90	Very high	3 Å²	3	29.7 Å²	29.7	3%	0.025	18%	0.177	C	C	.	.			trans	-119	82.6	-177	0	0	0	0	0	108.4	D2074 H2078 G2092 F2093	D2074-A2076 PolarHBondContact O-N 3.06Å; A2076-H2078 PolarHBondContact O-CD2 3.01Å; A2076-G2092 CarbonylContact O-C 3.54Å; A2076-F2093 PolarHBondContact N-O 3.14Å; A2076-F2093 CarbonylContact O-C 3.59Å; A2076-F2093 PolarHBondContact O-N 3.08Å
2077	P	90.9	Very high	89.5	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	18%	0.181	C	C	.	.			trans	-73.4	134.4	-173.2	28.5	-32.2	0	0	0	110.4	H1861 R1863 E1871 H2075 A2183	H1861-P2077 WeakPolarHBondContact O-CD 3.31Å; R1863-P2077 HydrophobicContact CG-CG 4.02Å; E1871-P2077 HydrophobicContact CB-CB 4.12Å; E1871-P2077 HydrophobicContact CB-CG 3.44Å; E1871-P2077 VanDerWaalsContact CB-CG 3.44Å; E1871-P2077 HydrophobicContact CG-CB 4.48Å; E1871-P2077 HydrophobicContact CG-CG 3.86Å; H2075-P2077 WeakPolarHBondContact O-CD 3.49Å; P2077-A2183 HydrophobicContact CB-CB 4.05Å
2078	H	90.7	Very high	88.7	Confident	7 Å²	7	32.8 Å²	32.8	3%	0.032	21%	0.208	C	C	.	.			trans	-138.5	147.6	172.5	-63.4	-71.5	0	0	0	108.6	K1870 A2076 E2082 K2083 P2090 P2091 W2185	K1870-H2078 PolarHBondContact NZ-ND1 3.16Å; K1870-H2078 VanDerWaalsContact NZ-ND1 3.1Å; A2076-H2078 PolarHBondContact O-CD2 3.01Å; H2078-E2082 HydrophobicContact CB-CB 4.47Å; H2078-E2082 IonicContact ND1-OE2 2.85Å; H2078-K2083 HydrophobicContact CB-CD 4.17Å; H2078-K2083 HydrophobicContact CB-CG 3.8Å; H2078-P2090 HydrophobicContact CB-CG 4.08Å; H2078-P2090 VanDerWaalsContact CE1-CB 3.49Å; H2078-P2090 WeakPolarHBondContact CE1-CB 3.44Å; H2078-P2090 WeakPolarHBondContact ND1-CG 3.37Å; H2078-P2091 PolarHBondContact NE2-O 2.99Å; H2078-W2185 PolarHBondContact O-NE1 2.62Å
2079	T	87.3	Confident	88.2	Confident	28 Å²	28	33.1 Å²	33.1	17%	0.172	21%	0.211	C	C	.	.			trans	-67.7	154.8	179.9	67.8	0	0	0	0	110.6	Y1869 S2081 E2082 K2083	Y1869-T2079 HydrophobicContact CD2-CG2 4.18Å; Y1869-T2079 HydrophobicContact CE2-CG2 4.26Å; T2079-S2081 PolarHBondContact O-N 3.32Å; T2079-S2081 PolarHBondContact OG1-OG 3.41Å; T2079-E2082 PolarHBondContact N-OE2 2.96Å; T2079-E2082 PolarHBondContact O-N 3.29Å; T2079-E2082 VanDerWaalsContact OG1-CG 3.3Å; T2079-E2082 WeakPolarHBondContact OG1-CG 3.31Å; T2079-E2082 PolarHBondContact OG1-N 2.79Å; T2079-K2083 PolarHBondContact O-N 2.95Å; T2079-K2083 VanDerWaalsContact O-N 3.09Å
2080	I	82.8	Confident	87.8	Confident	65 Å²	65	33.1 Å²	33.1	33%	0.333	21%	0.211	S	C	.	.	H	α-helix	trans	-52.8	-40.6	174.5	-68.7	171.6	0	0	0	111	W2045 E2082 K2083 S2084 A2167 W2185	W2045-I2080 HydrophobicContact CH2-CG1 4.48Å; W2045-I2080 HydrophobicContact CH2-CG2 3.99Å; W2045-I2080 HydrophobicContact CZ2-CG2 4.35Å; I2080-E2082 PolarHBondContact O-N 3.32Å; I2080-K2083 PolarHBondContact O-N 2.66Å; I2080-S2084 VanDerWaalsContact O-CB 3.3Å; I2080-S2084 WeakPolarHBondContact O-CB 3.49Å; I2080-S2084 PolarHBondContact O-N 2.9Å; I2080-S2084 PolarHBondContact O-OG 2.88Å; I2080-A2167 HydrophobicContact CD1-CB 4.19Å; I2080-W2185 HydrophobicContact CD1-CB 4.25Å; I2080-W2185 HydrophobicContact CG1-CB 4.02Å; I2080-W2185 HydrophobicContact CG1-CG 4.07Å
2081	S	83.7	Confident	87.4	Confident	80 Å²	80	34.3 Å²	34.3	56%	0.559	22%	0.219	S	C	*	.	H	α-helix	trans	-67	-31.4	179.9	58	0	0	0	0	114	T2079 S2084	T2079-S2081 PolarHBondContact O-N 3.32Å; T2079-S2081 PolarHBondContact OG1-OG 3.41Å; S2081-S2084 WeakPolarHBondContact CA-OG 3.43Å; S2081-S2084 PolarHBondContact O-OG 2.89Å; S2081-S2084 VanDerWaalsContact O-OG 3.13Å
2082	E	86.5	Confident	87	Confident	21 Å²	21	34.4 Å²	34.4	10%	0.098	22%	0.22	C	C	.	.	H	α-helix	trans	-73.9	-44	174.5	-74.1	177.4	149.8	0	0	111.3	Y1869 K1870 H2078 T2079 I2080 S2084 K2085 P2090	Y1869-E2082 PolarHBondContact OH-OE1 3.08Å; K1870-E2082 WeakPolarHBondContact CE-OE1 3.48Å; K1870-E2082 WeakPolarHBondContact CE-OE2 3.48Å; K1870-E2082 IonicContact NZ-OE1 3.93Å; K1870-E2082 PolarHBondContact NZ-OE1 3.26Å; K1870-E2082 IonicContact NZ-OE2 3.08Å; K1870-E2082 PolarHBondContact NZ-OE2 3.06Å; H2078-E2082 HydrophobicContact CB-CB 4.47Å; H2078-E2082 IonicContact ND1-OE2 2.85Å; T2079-E2082 PolarHBondContact N-OE2 2.96Å; T2079-E2082 PolarHBondContact O-N 3.29Å; T2079-E2082 VanDerWaalsContact OG1-CG 3.3Å; T2079-E2082 WeakPolarHBondContact OG1-CG 3.31Å; T2079-E2082 PolarHBondContact OG1-N 2.79Å; I2080-E2082 PolarHBondContact O-N 3.32Å; E2082-S2084 VanDerWaalsContact C-N 3.32Å; E2082-S2084 PolarHBondContact O-N 3.24Å; E2082-K2085 WeakPolarHBondContact O-CG 3.39Å; E2082-K2085 PolarHBondContact O-N 3.08Å; E2082-P2090 HydrophobicContact CB-CG 3.89Å; E2082-P2090 WeakPolarHBondContact O-CD 3.23Å
2083	K	86.9	Confident	86.9	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-72	-24.9	-179.3	-71.1	-73.2	-73.9	166.6	0	113.4	G2044 W2045 E2047 H2078 T2079 I2080 K2085 P2090 G2092 W2185	G2044-K2083 CarbonylContact C-O 3.34Å; G2044-K2083 WeakPolarHBondContact CA-O 3.48Å; G2044-K2083 PolarHBondContact N-O 2.92Å; G2044-K2083 VanDerWaalsContact N-O 3.12Å; G2044-K2083 WeakPolarHBondContact O-CE 3.48Å; G2044-K2083 PolarHBondContact O-NZ 3.44Å; W2045-K2083 HydrophobicContact CE3-CB 4.16Å; W2045-K2083 HydrophobicContact CZ3-CB 4.13Å; E2047-K2083 PolarHBondContact O-NZ 3.23Å; H2078-K2083 HydrophobicContact CB-CD 4.17Å; H2078-K2083 HydrophobicContact CB-CG 3.8Å; T2079-K2083 PolarHBondContact O-N 2.95Å; T2079-K2083 VanDerWaalsContact O-N 3.09Å; I2080-K2083 PolarHBondContact O-N 2.66Å; K2083-K2085 VanDerWaalsContact C-N 3.27Å; K2083-K2085 PolarHBondContact O-N 3.47Å; K2083-P2090 WeakPolarHBondContact CD-O 3.36Å; K2083-G2092 WeakPolarHBondContact CE-O 3.32Å; K2083-G2092 PolarHBondContact NZ-O 2.77Å; K2083-W2185 HydrophobicContact CB-CZ2 4.31Å; K2083-W2185 HydrophobicContact CD-CH2 4.46Å; K2083-W2185 HydrophobicContact CD-CZ2 4.02Å; K2083-W2185 VanDerWaalsContact CE-CH2 3.5Å; K2083-W2185 HydrophobicContact CG-CH2 4.35Å; K2083-W2185 HydrophobicContact CG-CZ2 3.62Å
2084	S	82.8	Confident	86.7	Confident	55 Å²	55	34.7 Å²	34.7	39%	0.385	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-4.5	176.6	66.5	0	0	0	0	114.5	I2080 S2081 E2082	I2080-S2084 VanDerWaalsContact O-CB 3.3Å; I2080-S2084 WeakPolarHBondContact O-CB 3.49Å; I2080-S2084 PolarHBondContact O-N 2.9Å; I2080-S2084 PolarHBondContact O-OG 2.88Å; S2081-S2084 WeakPolarHBondContact CA-OG 3.43Å; S2081-S2084 PolarHBondContact O-OG 2.89Å; S2081-S2084 VanDerWaalsContact O-OG 3.13Å; E2082-S2084 VanDerWaalsContact C-N 3.32Å; E2082-S2084 PolarHBondContact O-N 3.24Å
2085	K	82.3	Confident	86.6	Confident	107 Å²	107	34.7 Å²	34.7	47%	0.465	22%	0.223	S	C	.	.			trans	-65.8	135.7	178.6	-68.9	178.2	-178.6	174.6	0	110.7	G2044 E2082 K2083 A2089	G2044-K2085 PolarHBondContact N-O 2.73Å; E2082-K2085 WeakPolarHBondContact O-CG 3.39Å; E2082-K2085 PolarHBondContact O-N 3.08Å; K2083-K2085 VanDerWaalsContact C-N 3.27Å; K2083-K2085 PolarHBondContact O-N 3.47Å; K2085-A2089 HydrophobicContact CB-CB 4.22Å
2086	V	74.3	Confident	86.6	Confident	136 Å²	136	34.7 Å²	34.7	82%	0.824	22%	0.223	S	C	*	.	S	Bend	trans	-73.3	-34.3	-179	-179.8	0	0	0	0	112.1
2087	S	78.3	Confident	86.5	Confident	107 Å²	107	35.6 Å²	35.6	75%	0.748	23%	0.227	S	C	*	.	S	Bend	trans	-131.7	144.1	170.1	83.4	0	0	0	0	109.8
2088	G	77.8	Confident	86.6	Confident	60 Å²	60	35.8 Å²	35.8	62%	0.619	23%	0.228	S	C	*	.	S	Bend	trans	73.6	21.6	-180	0	0	0	0	0	114.8
2089	A	85.6	Confident	86.8	Confident	9 Å²	9	35.5 Å²	35.5	7%	0.074	23%	0.227	C	C	.	.	P	Polyproline II helix	trans	-65.3	136.5	168.8	0	0	0	0	0	110.3	G2044 K2085	G2044-A2089 VanDerWaalsContact CA-CB 3.47Å; K2085-A2089 HydrophobicContact CB-CB 4.22Å
2090	P	87.3	Confident	87.2	Confident	7 Å²	7	34.2 Å²	34.2	5%	0.045	22%	0.219	C	C	.	.	P	Polyproline II helix	trans	-73.5	143.2	-176.7	31.7	-35.5	0	0	0	111.1	F1951 H2078 E2082 K2083	F1951-P2090 HydrophobicContact CE1-CB 4.4Å; H2078-P2090 HydrophobicContact CB-CG 4.08Å; H2078-P2090 VanDerWaalsContact CE1-CB 3.49Å; H2078-P2090 WeakPolarHBondContact CE1-CB 3.44Å; H2078-P2090 WeakPolarHBondContact ND1-CG 3.37Å; E2082-P2090 HydrophobicContact CB-CG 3.89Å; E2082-P2090 WeakPolarHBondContact O-CD 3.23Å; K2083-P2090 WeakPolarHBondContact CD-O 3.36Å
2091	P	87.7	Confident	87.7	Confident	25 Å²	25	31.3 Å²	31.3	16%	0.162	21%	0.205	C	C	.	.	P	Polyproline II helix	trans	-75.3	142.1	177.1	30.2	-33.6	0	0	0	111.9	F1951 E2047 R2049 H2078	F1951-P2091 HydrophobicContact CB-CG 4.32Å; F1951-P2091 VanDerWaalsContact CD2-CD 3.41Å; F1951-P2091 HydrophobicContact CD2-CG 3.98Å; F1951-P2091 HydrophobicContact CG-CG 4.41Å; E2047-P2091 VanDerWaalsContact O-CA 3.3Å; E2047-P2091 WeakPolarHBondContact O-CA 3.47Å; R2049-P2091 HydrophobicContact CB-CB 4.36Å; R2049-P2091 HydrophobicContact CG-CB 3.83Å; R2049-P2091 HydrophobicContact CG-CG 4.13Å; H2078-P2091 PolarHBondContact NE2-O 2.99Å
2092	G	89.9	Confident	88.2	Confident	2 Å²	2	27.7 Å²	27.7	2%	0.021	18%	0.179	C	C	.	.			trans	132.6	156.7	172.9	0	0	0	0	0	114.4	E2047 A2076 K2083	E2047-G2092 PolarHBondContact O-N 3.32Å; E2047-G2092 VanDerWaalsContact O-N 3.07Å; A2076-G2092 CarbonylContact O-C 3.54Å; K2083-G2092 WeakPolarHBondContact CE-O 3.32Å; K2083-G2092 PolarHBondContact NZ-O 2.77Å
2093	F	92.6	Very high	88.7	Confident	2 Å²	2	26.7 Å²	26.7	1%	0.009	17%	0.174	C	C	.	.	B	Isolated β-bridge	trans	-131	145.4	-179.8	-63.7	-34.8	0	0	0	113	H2030 L2039 W2045 V2048 L2052 A2076 W2185 P2187	H2030-F2093 HydrophobicContact CB-CD2 4Å; H2030-F2093 HydrophobicContact CB-CE2 4.47Å; H2030-F2093 AromaticContact CG-CD2 3.91Å; L2039-F2093 HydrophobicContact CD1-CE1 4.3Å; L2039-F2093 HydrophobicContact CD1-CE2 4.05Å; L2039-F2093 HydrophobicContact CD1-CZ 3.53Å; W2045-F2093 WeakPolarHBondContact O-CE1 3.3Å; W2045-F2093 WeakPolarHBondContact O-CZ 3.43Å; V2048-F2093 HydrophobicContact CB-CD2 4.24Å; V2048-F2093 HydrophobicContact CB-CE2 3.84Å; V2048-F2093 HydrophobicContact CB-CZ 4.03Å; V2048-F2093 HydrophobicContact CG1-CE2 3.77Å; V2048-F2093 HydrophobicContact CG1-CZ 4.09Å; V2048-F2093 HydrophobicContact CG2-CD2 4.24Å; V2048-F2093 HydrophobicContact CG2-CE2 4.29Å; L2052-F2093 HydrophobicContact CD1-CE2 4.37Å; L2052-F2093 HydrophobicContact CD2-CE2 4.37Å; A2076-F2093 PolarHBondContact N-O 3.14Å; A2076-F2093 CarbonylContact O-C 3.59Å; A2076-F2093 PolarHBondContact O-N 3.08Å; F2093-W2185 AromaticContact CD1-CH2 3.51Å; F2093-W2185 HydrophobicContact CD1-CH2 3.51Å; F2093-W2185 HydrophobicContact CD1-CZ2 4.25Å; F2093-W2185 HydrophobicContact CD1-CZ3 4.32Å; F2093-W2185 AromaticContact CE1-CH2 3.89Å; F2093-W2185 HydrophobicContact CE1-CH2 3.89Å; F2093-P2187 HydrophobicContact CB-CG 4.06Å; F2093-P2187 HydrophobicContact CD1-CB 4.39Å; F2093-P2187 HydrophobicContact CD1-CG 4.45Å; F2093-P2187 HydrophobicContact CD2-CB 4.36Å; F2093-P2187 HydrophobicContact CD2-CG 4.15Å; F2093-P2187 HydrophobicContact CG-CB 4.3Å; F2093-P2187 HydrophobicContact CG-CG 3.98Å
2094	P	91.8	Very high	89.1	Confident	6 Å²	6	26.7 Å²	26.7	4%	0.039	17%	0.174	C	C	.	.			trans	-75.6	125.9	165	30.9	-32.9	0	0	0	110.7	H2075 T2181 A2183 W2185	H2075-P2094 WeakPolarHBondContact ND1-CA 3.34Å; P2094-T2181 HydrophobicContact CB-CG2 4.47Å; P2094-A2183 HydrophobicContact CB-CB 4.19Å; P2094-A2183 HydrophobicContact CG-CB 4.13Å; P2094-W2185 HydrophobicContact CG-CD2 4.31Å; P2094-W2185 HydrophobicContact CG-CZ2 4.41Å; P2094-W2185 WeakPolarHBondContact CG-O 3.23Å
2095	G	92	Very high	89.6	Confident	7 Å²	7	25.2 Å²	25.2	7%	0.072	16%	0.163	C	C	.	.			trans	-127	-19.6	-179.5	0	0	0	0	0	118	H2075 E2097 T2098 M2099	H2075-G2095 PolarHBondContact ND1-N 3.15Å; H2075-G2095 VanDerWaalsContact ND1-N 3.11Å; G2095-E2097 PolarHBondContact O-N 3Å; G2095-T2098 PolarHBondContact O-N 2.92Å; G2095-T2098 PolarHBondContact O-OG1 3.12Å; G2095-M2099 PolarHBondContact O-N 3.26Å; G2095-M2099 VanDerWaalsContact O-N 3.08Å
2096	L	93.7	Very high	90	Very high	1 Å²	1	20.2 Å²	20.2	1%	0.005	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-47.1	-53.4	-171.4	-79.8	168.6	0	0	0	114.9	D1857 V1860 V1876 A1879 A1880 I1885 I1888 H2075 T2098	D1857-L2096 HydrophobicContact CB-CD2 4.27Å; D1857-L2096 WeakPolarHBondContact OD2-CD2 3.41Å; V1860-L2096 HydrophobicContact CG1-CD1 3.99Å; V1860-L2096 HydrophobicContact CG2-CD2 3.98Å; V1876-L2096 HydrophobicContact CG2-CD1 3.55Å; A1879-L2096 HydrophobicContact CB-CB 4.37Å; A1879-L2096 HydrophobicContact CB-CD1 4.45Å; A1880-L2096 HydrophobicContact CB-CD1 4.43Å; A1880-L2096 HydrophobicContact CB-CD2 4.22Å; I1885-L2096 HydrophobicContact CG1-CD2 4.36Å; I1888-L2096 HydrophobicContact CG2-CD2 4.32Å; H2075-L2096 HydrophobicContact CB-CD1 4.11Å; H2075-L2096 HydrophobicContact CB-CG 3.77Å; H2075-L2096 PolarHBondContact ND1-N 2.78Å; L2096-T2098 PolarHBondContact O-N 3.14Å
2097	E	92.6	Very high	90.8	Very high	22 Å²	22	15.4 Å²	15.4	10%	0.103	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-13	-176.1	-70.6	179.2	-115.6	0	0	114	A1879 A1882 G2095 F2179 F2180 T2181	A1879-E2097 HydrophobicContact CB-CG 3.86Å; A1879-E2097 VanDerWaalsContact CB-OE1 3.3Å; A1879-E2097 WeakPolarHBondContact CB-OE1 3.44Å; A1879-E2097 WeakPolarHBondContact O-CG 3.03Å; A1882-E2097 HydrophobicContact CB-CG 4.07Å; G2095-E2097 PolarHBondContact O-N 3Å; E2097-F2179 HydrophobicContact CB-CD1 4.06Å; E2097-F2179 HydrophobicContact CB-CE1 4.33Å; E2097-F2179 HydrophobicContact CG-CD1 4.48Å; E2097-F2179 WeakPolarHBondContact OE1-CB 2.99Å; E2097-F2179 WeakPolarHBondContact OE2-CD1 3.1Å; E2097-F2180 PolarHBondContact OE1-N 2.72Å; E2097-F2180 PolarHBondContact OE2-N 3.42Å; E2097-T2181 PolarHBondContact OE1-N 2.81Å; E2097-T2181 VanDerWaalsContact OE1-N 3.14Å
2098	T	91.9	Very high	91	Very high	4 Å²	4	16.2 Å²	16.2	3%	0.025	10%	0.098	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.3	-22.2	-170.4	57.8	0	0	0	0	114.7	G2095 L2096 L2100 S2101 L2102 W2162 I2164 F2179	G2095-T2098 PolarHBondContact O-N 2.92Å; G2095-T2098 PolarHBondContact O-OG1 3.12Å; L2096-T2098 PolarHBondContact O-N 3.14Å; T2098-L2100 PolarHBondContact O-N 2.88Å; T2098-S2101 PolarHBondContact O-N 3.26Å; T2098-L2102 WeakPolarHBondContact O-CD1 3.34Å; T2098-L2102 WeakPolarHBondContact O-CG 3.34Å; T2098-L2102 PolarHBondContact O-N 3.24Å; T2098-L2102 VanDerWaalsContact O-N 3.15Å; T2098-W2162 HydrophobicContact CG2-CH2 3.92Å; T2098-W2162 HydrophobicContact CG2-CZ3 4.17Å; T2098-I2164 HydrophobicContact CG2-CD1 4.08Å; T2098-I2164 HydrophobicContact CG2-CG2 3.88Å; T2098-F2179 HydrophobicContact CG2-CE1 4.38Å; T2098-F2179 HydrophobicContact CG2-CZ 4.5Å
2099	M	95.1	Very high	91.5	Very high	1 Å²	1	18.4 Å²	18.4	1%	0.005	10%	0.096	C	C	.	.	H	α-helix	trans	-55.8	-50.5	-173.6	171.6	166	71.9	0	0	113.1	D1857 I1885 P2029 F2071 T2073 G2095 L2102 L2103 L2121	D1857-M2099 HydrophobicContact CB-CE 4.45Å; I1885-M2099 HydrophobicContact CD1-CE 3.59Å; I1885-M2099 HydrophobicContact CG1-CE 4.26Å; P2029-M2099 HydrophobicContact CG-CB 3.88Å; P2029-M2099 HydrophobicContact CG-CG 3.49Å; P2029-M2099 VanDerWaalsContact CG-CG 3.49Å; P2029-M2099 HydrophobicContact CG-SD 3.77Å; F2071-M2099 HydrophobicContact CB-SD 4.25Å; T2073-M2099 HydrophobicContact CG2-CB 3.68Å; T2073-M2099 HydrophobicContact CG2-CE 3.8Å; T2073-M2099 HydrophobicContact CG2-CG 4.21Å; T2073-M2099 HydrophobicContact CG2-SD 3.58Å; T2073-M2099 VanDerWaalsContact CG2-SD 3.58Å; G2095-M2099 PolarHBondContact O-N 3.26Å; G2095-M2099 VanDerWaalsContact O-N 3.08Å; M2099-L2102 PolarHBondContact O-N 3.44Å; M2099-L2103 HydrophobicContact CG-CD1 3.65Å; M2099-L2103 HydrophobicContact CG-CG 4.36Å; M2099-L2103 WeakPolarHBondContact O-CG 3.15Å; M2099-L2103 PolarHBondContact O-N 3.28Å; M2099-L2103 HydrophobicContact SD-CD1 4.35Å; M2099-L2121 HydrophobicContact CE-CD2 3.64Å; M2099-L2121 HydrophobicContact SD-CD2 4.12Å
2100	L	95.5	Very high	91.4	Very high	2 Å²	2	21.3 Å²	21.3	1%	0.01	13%	0.126	C	C	.	.	H	α-helix	trans	-63.3	-48	-173.4	-178.9	56.3	0	0	0	111.3	L1852 L1855 G1883 T2098 L2102 L2103 L2104 L2117 L2121 V2154 V2156 V2197	L1852-L2100 HydrophobicContact CD1-CD1 3.76Å; L1852-L2100 HydrophobicContact CD1-CD2 4.1Å; L1852-L2100 HydrophobicContact CD1-CG 4.46Å; L1855-L2100 HydrophobicContact CD1-CD1 3.7Å; L1855-L2100 HydrophobicContact CD1-CD2 3.78Å; L1855-L2100 HydrophobicContact CD1-CG 4.3Å; G1883-L2100 WeakPolarHBondContact O-CB 3.36Å; T2098-L2100 PolarHBondContact O-N 2.88Å; L2100-L2102 VanDerWaalsContact C-N 3.31Å; L2100-L2102 PolarHBondContact O-N 3.04Å; L2100-L2103 PolarHBondContact O-N 3.12Å; L2100-L2104 HydrophobicContact CD1-CD1 3.92Å; L2100-L2104 HydrophobicContact CD1-CG 3.96Å; L2100-L2104 HydrophobicContact CG-CD1 3.8Å; L2100-L2104 HydrophobicContact CG-CG 4.3Å; L2100-L2104 WeakPolarHBondContact O-CB 3.5Å; L2100-L2104 VanDerWaalsContact O-CG 3.27Å; L2100-L2104 WeakPolarHBondContact O-CG 3.44Å; L2100-L2104 PolarHBondContact O-N 2.75Å; L2100-L2117 HydrophobicContact CD1-CD2 4.37Å; L2100-L2121 HydrophobicContact CD1-CD1 4.44Å; L2100-V2154 HydrophobicContact CD2-CG1 4.45Å; L2100-V2156 HydrophobicContact CD2-CG2 3.99Å; L2100-V2197 HydrophobicContact CD2-CG2 3.73Å
2101	S	93.6	Very high	91.4	Very high	4 Å²	4	27.5 Å²	27.5	3%	0.028	15%	0.148	C	C	.	.	H	α-helix	trans	-61.5	-37.1	177.8	-53.6	0	0	0	0	112.7	T2098 T2105 G2195	T2098-S2101 PolarHBondContact O-N 3.26Å; S2101-T2105 WeakPolarHBondContact O-CB 2.96Å; S2101-T2105 PolarHBondContact O-N 3.44Å; S2101-T2105 PolarHBondContact O-OG1 3.03Å; S2101-G2195 VanDerWaalsContact CB-O 3.24Å; S2101-G2195 WeakPolarHBondContact CB-O 3.06Å; S2101-G2195 PolarHBondContact OG-O 2.88Å
2102	L	95.1	Very high	91.5	Very high	4 Å²	4	26.5 Å²	26.5	2%	0.021	14%	0.142	C	C	.	.	H	α-helix	trans	-63.6	-46.6	174.9	-73.7	164	0	0	0	111.7	P2029 F2033 T2098 M2099 L2100 T2105 A2106 F2188 V2193	P2029-L2102 HydrophobicContact CB-CD1 4.28Å; F2033-L2102 HydrophobicContact CD2-CB 4.15Å; F2033-L2102 HydrophobicContact CE2-CB 3.81Å; F2033-L2102 HydrophobicContact CZ-CB 4.15Å; F2033-L2102 VanDerWaalsContact CZ-O 3.28Å; F2033-L2102 WeakPolarHBondContact CZ-O 3.33Å; T2098-L2102 WeakPolarHBondContact O-CD1 3.34Å; T2098-L2102 WeakPolarHBondContact O-CG 3.34Å; T2098-L2102 PolarHBondContact O-N 3.24Å; T2098-L2102 VanDerWaalsContact O-N 3.15Å; M2099-L2102 PolarHBondContact O-N 3.44Å; L2100-L2102 VanDerWaalsContact C-N 3.31Å; L2100-L2102 PolarHBondContact O-N 3.04Å; L2102-T2105 WeakPolarHBondContact O-CB 3.49Å; L2102-T2105 PolarHBondContact O-N 3.17Å; L2102-A2106 PolarHBondContact O-N 2.64Å; L2102-F2188 HydrophobicContact CD1-CD1 4.1Å; L2102-F2188 HydrophobicContact CD1-CD2 3.66Å; L2102-F2188 HydrophobicContact CD1-CE1 3.91Å; L2102-F2188 HydrophobicContact CD1-CE2 3.47Å; L2102-F2188 VanDerWaalsContact CD1-CE2 3.47Å; L2102-F2188 HydrophobicContact CD1-CG 3.96Å; L2102-F2188 HydrophobicContact CD1-CZ 3.58Å; L2102-F2188 HydrophobicContact CD2-CD1 4.14Å; L2102-F2188 HydrophobicContact CD2-CE1 4.35Å; L2102-F2188 HydrophobicContact CD2-CG 4.39Å; L2102-V2193 HydrophobicContact CD2-CG1 3.75Å; L2102-V2193 HydrophobicContact CG-CG1 4.35Å
2103	L	96.6	Very high	91.3	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-68.6	-37.8	179.7	-66.6	171.3	0	0	0	112.2	L2032 F2033 F2071 M2099 L2100 T2105 A2106 M2107 L2112 L2117 L2121	L2032-L2103 HydrophobicContact CD1-CD2 4.39Å; F2033-L2103 HydrophobicContact CE2-CD2 4.2Å; F2071-L2103 HydrophobicContact CB-CD1 4.22Å; F2071-L2103 HydrophobicContact CD2-CD1 3.64Å; F2071-L2103 HydrophobicContact CD2-CD2 4.11Å; F2071-L2103 HydrophobicContact CE1-CD2 4.35Å; F2071-L2103 HydrophobicContact CE2-CD1 4.16Å; F2071-L2103 HydrophobicContact CE2-CD2 3.93Å; F2071-L2103 HydrophobicContact CG-CD1 4.03Å; F2071-L2103 HydrophobicContact CG-CD2 4.38Å; F2071-L2103 HydrophobicContact CZ-CD2 4.04Å; M2099-L2103 HydrophobicContact CG-CD1 3.65Å; M2099-L2103 HydrophobicContact CG-CG 4.36Å; M2099-L2103 WeakPolarHBondContact O-CG 3.15Å; M2099-L2103 PolarHBondContact O-N 3.28Å; M2099-L2103 HydrophobicContact SD-CD1 4.35Å; L2100-L2103 PolarHBondContact O-N 3.12Å; L2103-T2105 VanDerWaalsContact C-N 3.31Å; L2103-T2105 PolarHBondContact O-N 3.33Å; L2103-A2106 WeakPolarHBondContact O-CB 3.21Å; L2103-A2106 PolarHBondContact O-N 2.82Å; L2103-M2107 PolarHBondContact O-N 2.98Å; L2103-L2112 HydrophobicContact CB-CD2 4.48Å; L2103-L2117 HydrophobicContact CB-CD1 3.69Å; L2103-L2117 HydrophobicContact CD1-CD1 3.86Å; L2103-L2117 HydrophobicContact CG-CD1 4.36Å; L2103-L2121 HydrophobicContact CD1-CD1 3.94Å
2104	L	94.1	Very high	90.8	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-66	-33.8	173.3	-71.1	173.8	0	0	0	112.2	I1850 L2100 M2107 Y2108 L2117 V2156 M2158	I1850-L2104 HydrophobicContact CD1-CD2 3.8Å; L2100-L2104 HydrophobicContact CD1-CD1 3.92Å; L2100-L2104 HydrophobicContact CD1-CG 3.96Å; L2100-L2104 HydrophobicContact CG-CD1 3.8Å; L2100-L2104 HydrophobicContact CG-CG 4.3Å; L2100-L2104 WeakPolarHBondContact O-CB 3.5Å; L2100-L2104 VanDerWaalsContact O-CG 3.27Å; L2100-L2104 WeakPolarHBondContact O-CG 3.44Å; L2100-L2104 PolarHBondContact O-N 2.75Å; L2104-M2107 HydrophobicContact CD2-CE 3.64Å; L2104-M2107 HydrophobicContact CD2-SD 4.28Å; L2104-M2107 WeakPolarHBondContact O-CB 3.19Å; L2104-M2107 PolarHBondContact O-N 3.24Å; L2104-Y2108 WeakPolarHBondContact O-CB 3.22Å; L2104-Y2108 PolarHBondContact O-N 3.44Å; L2104-L2117 HydrophobicContact CD2-CD2 3.6Å; L2104-L2117 HydrophobicContact CG-CD2 4.37Å; L2104-V2156 HydrophobicContact CD1-CB 4.34Å; L2104-V2156 HydrophobicContact CD1-CG1 3.5Å; L2104-V2156 VanDerWaalsContact CD1-CG1 3.5Å; L2104-V2156 HydrophobicContact CD1-CG2 4.4Å; L2104-M2158 HydrophobicContact CB-CE 4.08Å; L2104-M2158 HydrophobicContact CB-SD 3.93Å; L2104-M2158 HydrophobicContact CD1-SD 3.88Å; L2104-M2158 HydrophobicContact CD2-CE 4.43Å; L2104-M2158 HydrophobicContact CD2-SD 3.82Å; L2104-M2158 HydrophobicContact CG-SD 4.1Å
2105	T	92.9	Very high	90.4	Very high	23 Å²	23	36.1 Å²	36.1	14%	0.141	20%	0.198	C	C	.	.	H	α-helix	trans	-64.7	-41.7	170.7	-56.4	0	0	0	0	111.2	S2101 L2102 L2103 M2107 Y2108 N2109 V2193 R2194	S2101-T2105 WeakPolarHBondContact O-CB 2.96Å; S2101-T2105 PolarHBondContact O-N 3.44Å; S2101-T2105 PolarHBondContact O-OG1 3.03Å; L2102-T2105 WeakPolarHBondContact O-CB 3.49Å; L2102-T2105 PolarHBondContact O-N 3.17Å; L2103-T2105 VanDerWaalsContact C-N 3.31Å; L2103-T2105 PolarHBondContact O-N 3.33Å; T2105-M2107 VanDerWaalsContact C-N 3.32Å; T2105-M2107 PolarHBondContact O-N 3.23Å; T2105-Y2108 PolarHBondContact O-N 2.94Å; T2105-N2109 WeakPolarHBondContact O-CB 3.37Å; T2105-N2109 PolarHBondContact O-N 3.47Å; T2105-N2109 PolarHBondContact O-ND2 2.86Å; T2105-N2109 VanDerWaalsContact O-ND2 3.16Å; T2105-V2193 WeakPolarHBondContact OG1-CA 3.27Å; T2105-V2193 WeakPolarHBondContact OG1-CB 3.44Å; T2105-R2194 PolarHBondContact OG1-N 3.35Å; T2105-R2194 PolarHBondContact OG1-O 3.5Å
2106	A	91.9	Very high	90.3	Very high	2 Å²	2	37.9 Å²	37.9	2%	0.017	20%	0.204	C	C	.	.	H	α-helix	trans	-64.2	-37.3	173.4	0	0	0	0	0	112.4	F2033 W2062 L2102 L2103 N2109 G2110 R2111	F2033-A2106 HydrophobicContact CE1-CB 4.1Å; F2033-A2106 HydrophobicContact CZ-CB 3.77Å; W2062-A2106 HydrophobicContact CH2-CB 3.62Å; W2062-A2106 HydrophobicContact CZ2-CB 4.14Å; W2062-A2106 HydrophobicContact CZ3-CB 4.44Å; L2102-A2106 PolarHBondContact O-N 2.64Å; L2103-A2106 WeakPolarHBondContact O-CB 3.21Å; L2103-A2106 PolarHBondContact O-N 2.82Å; A2106-N2109 CarbonylContact O-C 3.59Å; A2106-N2109 PolarHBondContact O-N 3.26Å; A2106-G2110 PolarHBondContact O-N 3.38Å; A2106-R2111 HydrophobicContact CB-CB 4.23Å; A2106-R2111 PolarHBondContact O-N 3.36Å
2107	M	90.5	Very high	90.2	Very high	36 Å²	36	37.9 Å²	37.9	18%	0.177	20%	0.204	C	C	.	.	H	α-helix	trans	-62.9	-48.1	174.2	-177.8	-171.9	72.9	0	0	111.6	I1850 L2103 L2104 T2105 N2109 G2110 L2112 L2114 M2158	I1850-M2107 HydrophobicContact CD1-CE 4.36Å; L2103-M2107 PolarHBondContact O-N 2.98Å; L2104-M2107 HydrophobicContact CD2-CE 3.64Å; L2104-M2107 HydrophobicContact CD2-SD 4.28Å; L2104-M2107 WeakPolarHBondContact O-CB 3.19Å; L2104-M2107 PolarHBondContact O-N 3.24Å; T2105-M2107 VanDerWaalsContact C-N 3.32Å; T2105-M2107 PolarHBondContact O-N 3.23Å; M2107-N2109 PolarHBondContact O-N 2.94Å; M2107-G2110 PolarHBondContact O-N 2.89Å; M2107-L2112 WeakPolarHBondContact CA-O 3.42Å; M2107-L2112 HydrophobicContact CB-CB 4.39Å; M2107-L2112 WeakPolarHBondContact CG-O 3.2Å; M2107-L2114 HydrophobicContact SD-CB 3.82Å; M2107-L2114 HydrophobicContact SD-CD1 4.04Å; M2107-M2158 HydrophobicContact CE-CE 3.55Å; M2107-M2158 HydrophobicContact CE-SD 4.11Å
2108	Y	83.8	Confident	90	Very high	124 Å²	124	36.9 Å²	36.9	49%	0.486	20%	0.199	S	C	.	.	H	α-helix	trans	-58.3	-37.7	175.1	-178.5	-94.4	0	0	0	112.2	L2104 T2105 G2110	L2104-Y2108 WeakPolarHBondContact O-CB 3.22Å; L2104-Y2108 PolarHBondContact O-N 3.44Å; T2105-Y2108 PolarHBondContact O-N 2.94Å; Y2108-G2110 PolarHBondContact O-N 3.35Å
2109	N	87.4	Confident	89.8	Confident	106 Å²	106	38.3 Å²	38.3	57%	0.567	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80	5.6	176.3	-66.1	-27	0	0	0	114	T2105 A2106 M2107 R2111	T2105-N2109 WeakPolarHBondContact O-CB 3.37Å; T2105-N2109 PolarHBondContact O-N 3.47Å; T2105-N2109 PolarHBondContact O-ND2 2.86Å; T2105-N2109 VanDerWaalsContact O-ND2 3.16Å; A2106-N2109 CarbonylContact O-C 3.59Å; A2106-N2109 PolarHBondContact O-N 3.26Å; M2107-N2109 PolarHBondContact O-N 2.94Å; N2109-R2111 PolarHBondContact O-N 3.47Å
2110	G	82.9	Confident	89.8	Confident	69 Å²	69	38.6 Å²	38.6	71%	0.711	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	75.1	14.2	176.5	0	0	0	0	0	115.8	A2106 M2107 Y2108	A2106-G2110 PolarHBondContact O-N 3.38Å; M2107-G2110 PolarHBondContact O-N 2.89Å; Y2108-G2110 PolarHBondContact O-N 3.35Å
2111	R	87.8	Confident	89.7	Confident	137 Å²	137	38.5 Å²	38.5	52%	0.517	21%	0.206	S	C	.	.	S	Bend	trans	-85.7	-16.8	176	-65.7	-168.6	-179.5	-159	0.4	113.9	W2062 A2106 N2109	W2062-R2111 HydrophobicContact CE3-CB 4.1Å; W2062-R2111 HydrophobicContact CH2-CB 4.39Å; W2062-R2111 HydrophobicContact CZ3-CB 3.98Å; A2106-R2111 HydrophobicContact CB-CB 4.23Å; A2106-R2111 PolarHBondContact O-N 3.36Å; N2109-R2111 PolarHBondContact O-N 3.47Å
2112	L	89.9	Confident	89.6	Confident	5 Å²	5	39 Å²	39	3%	0.026	21%	0.208	C	C	.	.	S	Bend	trans	-143.9	146.9	-177.8	-169.5	68.5	0	0	0	109	W2062 I2065 F2071 L2103 M2107 E2116 L2117	W2062-L2112 HydrophobicContact CZ3-CB 4.37Å; I2065-L2112 HydrophobicContact CD1-CD1 4.16Å; I2065-L2112 HydrophobicContact CG1-CD1 3.97Å; F2071-L2112 HydrophobicContact CE2-CD1 4.44Å; F2071-L2112 HydrophobicContact CE2-CD2 4.04Å; F2071-L2112 HydrophobicContact CZ-CD1 4.31Å; F2071-L2112 HydrophobicContact CZ-CD2 4.41Å; L2103-L2112 HydrophobicContact CB-CD2 4.48Å; M2107-L2112 WeakPolarHBondContact CA-O 3.42Å; M2107-L2112 HydrophobicContact CB-CB 4.39Å; M2107-L2112 WeakPolarHBondContact CG-O 3.2Å; L2112-E2116 HydrophobicContact CD1-CB 3.64Å; L2112-E2116 HydrophobicContact CG-CB 4.27Å; L2112-L2117 HydrophobicContact CD2-CB 3.91Å; L2112-L2117 HydrophobicContact CD2-CD1 3.8Å; L2112-L2117 HydrophobicContact CD2-CG 4.44Å
2113	T	86.3	Confident	89.1	Confident	72 Å²	72	39.6 Å²	39.6	44%	0.442	21%	0.211	S	C	.	.			trans	-99	158.9	170.6	64	0	0	0	0	111.5	T2115 E2116 L2117	T2113-T2115 VanDerWaalsContact C-N 3.28Å; T2113-T2115 PolarHBondContact O-N 2.66Å; T2113-E2116 WeakPolarHBondContact CB-OE2 3.34Å; T2113-E2116 WeakPolarHBondContact CG2-OE2 3.44Å; T2113-E2116 PolarHBondContact N-OE2 2.85Å; T2113-E2116 PolarHBondContact O-N 3Å; T2113-E2116 WeakPolarHBondContact OG1-CB 3.42Å; T2113-E2116 WeakPolarHBondContact OG1-CG 3.28Å; T2113-E2116 PolarHBondContact OG1-N 2.85Å; T2113-E2116 PolarHBondContact OG1-OE2 3.25Å; T2113-L2117 PolarHBondContact O-N 3.06Å
2114	L	82.2	Confident	88.9	Confident	65 Å²	65	40.2 Å²	40.2	34%	0.34	21%	0.214	S	C	.	.	H	α-helix	trans	-58.3	-40.7	177.2	-179.8	61.7	0	0	0	112.1	I1850 L1852 M2107 L2117 I2118	I1850-L2114 HydrophobicContact CD1-CD1 4.49Å; L1852-L2114 HydrophobicContact CD2-CD1 3.62Å; M2107-L2114 HydrophobicContact SD-CB 3.82Å; M2107-L2114 HydrophobicContact SD-CD1 4.04Å; L2114-L2117 WeakPolarHBondContact O-CB 3.32Å; L2114-L2117 PolarHBondContact O-N 3.42Å; L2114-I2118 HydrophobicContact CD1-CD1 4.13Å; L2114-I2118 HydrophobicContact CD1-CG1 4.47Å; L2114-I2118 HydrophobicContact CG-CD1 4.05Å; L2114-I2118 WeakPolarHBondContact O-CG1 3.42Å; L2114-I2118 PolarHBondContact O-N 3.19Å
2115	T	82	Confident	88.7	Confident	75 Å²	75	40.2 Å²	40.2	46%	0.46	21%	0.214	S	C	.	.	H	α-helix	trans	-62.7	-44.7	176.4	-52.8	0	0	0	0	111.2	T2113 L2117 I2118 E2119	T2113-T2115 VanDerWaalsContact C-N 3.28Å; T2113-T2115 PolarHBondContact O-N 2.66Å; T2115-L2117 VanDerWaalsContact C-N 3.31Å; T2115-L2117 PolarHBondContact O-N 2.81Å; T2115-I2118 PolarHBondContact O-N 3.14Å; T2115-E2119 HydrophobicContact CG2-CG 4.47Å; T2115-E2119 WeakPolarHBondContact O-CB 3.4Å; T2115-E2119 VanDerWaalsContact O-CG 3.3Å; T2115-E2119 WeakPolarHBondContact O-CG 3.37Å; T2115-E2119 PolarHBondContact O-N 2.62Å
2116	E	89.8	Confident	88.3	Confident	44 Å²	44	41.2 Å²	41.2	21%	0.206	22%	0.215	C	C	.	.	H	α-helix	trans	-64.5	-35.2	177.8	-74.5	166.8	144.9	0	0	112.9	L2112 T2113 R2120	L2112-E2116 HydrophobicContact CD1-CB 3.64Å; L2112-E2116 HydrophobicContact CG-CB 4.27Å; T2113-E2116 WeakPolarHBondContact CB-OE2 3.34Å; T2113-E2116 WeakPolarHBondContact CG2-OE2 3.44Å; T2113-E2116 PolarHBondContact N-OE2 2.85Å; T2113-E2116 PolarHBondContact O-N 3Å; T2113-E2116 WeakPolarHBondContact OG1-CB 3.42Å; T2113-E2116 WeakPolarHBondContact OG1-CG 3.28Å; T2113-E2116 PolarHBondContact OG1-N 2.85Å; T2113-E2116 PolarHBondContact OG1-OE2 3.25Å; E2116-R2120 VanDerWaalsContact CA-NH1 3.33Å; E2116-R2120 WeakPolarHBondContact O-CD 3.17Å; E2116-R2120 WeakPolarHBondContact O-CG 3.4Å; E2116-R2120 PolarHBondContact O-N 3.44Å; E2116-R2120 PolarHBondContact O-NH1 2.89Å
2117	L	92.5	Very high	87.9	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-62.8	-50.2	173.5	-178.4	68.5	0	0	0	111.3	L2100 L2103 L2104 L2112 T2113 L2114 T2115 R2120 L2121	L2100-L2117 HydrophobicContact CD1-CD2 4.37Å; L2103-L2117 HydrophobicContact CB-CD1 3.69Å; L2103-L2117 HydrophobicContact CD1-CD1 3.86Å; L2103-L2117 HydrophobicContact CG-CD1 4.36Å; L2104-L2117 HydrophobicContact CD2-CD2 3.6Å; L2104-L2117 HydrophobicContact CG-CD2 4.37Å; L2112-L2117 HydrophobicContact CD2-CB 3.91Å; L2112-L2117 HydrophobicContact CD2-CD1 3.8Å; L2112-L2117 HydrophobicContact CD2-CG 4.44Å; T2113-L2117 PolarHBondContact O-N 3.06Å; L2114-L2117 WeakPolarHBondContact O-CB 3.32Å; L2114-L2117 PolarHBondContact O-N 3.42Å; T2115-L2117 VanDerWaalsContact C-N 3.31Å; T2115-L2117 PolarHBondContact O-N 2.81Å; L2117-R2120 PolarHBondContact O-N 3.11Å; L2117-L2121 HydrophobicContact CD1-CD1 3.59Å; L2117-L2121 HydrophobicContact CD1-CG 4.42Å; L2117-L2121 HydrophobicContact CG-CD1 4.2Å; L2117-L2121 PolarHBondContact O-N 3.12Å
2118	I	88	Confident	87.8	Confident	1 Å²	1	43.6 Å²	43.6	1%	0.005	23%	0.225	C	C	.	.	H	α-helix	trans	-66	-39.6	-180	-67.1	167.7	0	0	0	111.4	L1852 P1853 L2114 T2115 R2120 Y2122 I2123 V2144 Y2149	L1852-I2118 HydrophobicContact CD2-CD1 4.45Å; L1852-I2118 HydrophobicContact CD2-CG1 4.31Å; P1853-I2118 HydrophobicContact CG-CG1 4.39Å; P1853-I2118 HydrophobicContact CG-CG2 3.9Å; L2114-I2118 HydrophobicContact CD1-CD1 4.13Å; L2114-I2118 HydrophobicContact CD1-CG1 4.47Å; L2114-I2118 HydrophobicContact CG-CD1 4.05Å; L2114-I2118 WeakPolarHBondContact O-CG1 3.42Å; L2114-I2118 PolarHBondContact O-N 3.19Å; T2115-I2118 PolarHBondContact O-N 3.14Å; I2118-R2120 VanDerWaalsContact C-N 3.25Å; I2118-R2120 PolarHBondContact O-N 3.19Å; I2118-Y2122 HydrophobicContact CG2-CD1 4.2Å; I2118-Y2122 WeakPolarHBondContact O-CA 3.31Å; I2118-Y2122 VanDerWaalsContact O-CB 3.31Å; I2118-Y2122 WeakPolarHBondContact O-CB 3.29Å; I2118-Y2122 PolarHBondContact O-N 2.78Å; I2118-I2123 HydrophobicContact CG2-CD1 4.23Å; I2118-I2123 HydrophobicContact CG2-CG1 4.24Å; I2118-I2123 PolarHBondContact O-N 2.88Å; I2118-V2144 HydrophobicContact CD1-CG1 3.99Å; I2118-V2144 HydrophobicContact CD1-CG2 4.35Å; I2118-V2144 HydrophobicContact CG2-CG2 3.75Å; I2118-Y2149 WeakPolarHBondContact CD1-OH 3.45Å
2119	E	88.2	Confident	88	Confident	34 Å²	34	37.7 Å²	37.7	16%	0.159	20%	0.201	C	C	.	.	I	π-helix	trans	-53.7	-45.9	173.6	-78.6	174.6	173.4	0	0	110.8	T2115 I2123 N2124 K2244	T2115-E2119 HydrophobicContact CG2-CG 4.47Å; T2115-E2119 WeakPolarHBondContact O-CB 3.4Å; T2115-E2119 VanDerWaalsContact O-CG 3.3Å; T2115-E2119 WeakPolarHBondContact O-CG 3.37Å; T2115-E2119 PolarHBondContact O-N 2.62Å; E2119-I2123 HydrophobicContact CG-CD1 4.38Å; E2119-I2123 PolarHBondContact O-N 3.46Å; E2119-N2124 WeakPolarHBondContact O-CB 3.32Å; E2119-N2124 PolarHBondContact O-N 3.04Å; E2119-N2124 PolarHBondContact O-ND2 2.99Å; E2119-K2244 IonicContact OE1-NZ 3.4Å; E2119-K2244 PolarHBondContact OE1-NZ 3.14Å; E2119-K2244 IonicContact OE2-NZ 3.32Å; E2119-K2244 PolarHBondContact OE2-NZ 2.94Å
2120	R	94.6	Very high	87.4	Confident	7 Å²	7	34.1 Å²	34.1	3%	0.026	19%	0.19	C	C	.	.	I	π-helix	trans	-85	-23.6	-172.4	-72.2	163.2	-174.1	67.1	6.1	115.8	I2065 I2068 D2069 C2070 F2071 E2116 L2117 I2118	I2065-R2120 PolarHBondContact O-NE 3Å; I2065-R2120 PolarHBondContact O-NH2 2.91Å; I2068-R2120 PolarHBondContact O-NE 2.98Å; I2068-R2120 PolarHBondContact O-NH2 2.88Å; D2069-R2120 VanDerWaalsContact O-CA 3.3Å; D2069-R2120 WeakPolarHBondContact O-CA 3.16Å; D2069-R2120 VanDerWaalsContact O-CG 3.29Å; D2069-R2120 WeakPolarHBondContact O-CG 3.32Å; C2070-R2120 VanDerWaalsContact CA-O 3.31Å; C2070-R2120 WeakPolarHBondContact CA-O 3.41Å; F2071-R2120 HydrophobicContact CD2-CB 3.58Å; F2071-R2120 HydrophobicContact CD2-CG 4.42Å; F2071-R2120 HydrophobicContact CE2-CB 3.78Å; F2071-R2120 VanDerWaalsContact CE2-CD 3.47Å; F2071-R2120 HydrophobicContact CE2-CG 4.23Å; F2071-R2120 HydrophobicContact CG-CB 4.23Å; F2071-R2120 PolarHBondContact N-O 3.32Å; E2116-R2120 VanDerWaalsContact CA-NH1 3.33Å; E2116-R2120 WeakPolarHBondContact O-CD 3.17Å; E2116-R2120 WeakPolarHBondContact O-CG 3.4Å; E2116-R2120 PolarHBondContact O-N 3.44Å; E2116-R2120 PolarHBondContact O-NH1 2.89Å; L2117-R2120 PolarHBondContact O-N 3.11Å; I2118-R2120 VanDerWaalsContact C-N 3.25Å; I2118-R2120 PolarHBondContact O-N 3.19Å
2121	L	94.4	Very high	87	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.158	C	C	.	.	I	π-helix	trans	-106.9	-5.7	179.2	-72	176.1	0	0	0	113.8	L1855 I1856 F2071 M2099 L2100 L2103 L2117	L1855-L2121 HydrophobicContact CB-CB 4.35Å; L1855-L2121 HydrophobicContact CD1-CD1 4.15Å; L1855-L2121 HydrophobicContact CD2-CB 3.9Å; I1856-L2121 PolarHBondContact N-O 2.83Å; F2071-L2121 HydrophobicContact CB-CD2 3.8Å; F2071-L2121 HydrophobicContact CB-CG 4.4Å; F2071-L2121 HydrophobicContact CD2-CG 4.26Å; M2099-L2121 HydrophobicContact CE-CD2 3.64Å; M2099-L2121 HydrophobicContact SD-CD2 4.12Å; L2100-L2121 HydrophobicContact CD1-CD1 4.44Å; L2103-L2121 HydrophobicContact CD1-CD1 3.94Å; L2117-L2121 HydrophobicContact CD1-CD1 3.59Å; L2117-L2121 HydrophobicContact CD1-CG 4.42Å; L2117-L2121 HydrophobicContact CG-CD1 4.2Å; L2117-L2121 PolarHBondContact O-N 3.12Å
2122	Y	90.6	Very high	85.8	Confident	15 Å²	15	27 Å²	27	6%	0.059	15%	0.148	C	C	.	.	I	π-helix	trans	-138.5	-64.8	-176.9	179.9	-111.7	0	0	0	112.5	P1853 G1854 I2118 P2125 Y2126 A2140	P1853-Y2122 HydrophobicContact CB-CD1 3.74Å; P1853-Y2122 HydrophobicContact CB-CD2 3.66Å; P1853-Y2122 HydrophobicContact CB-CE1 3.81Å; P1853-Y2122 HydrophobicContact CB-CE2 3.66Å; P1853-Y2122 HydrophobicContact CB-CG 3.68Å; P1853-Y2122 HydrophobicContact CG-CD1 3.63Å; P1853-Y2122 HydrophobicContact CG-CD2 3.96Å; P1853-Y2122 HydrophobicContact CG-CE1 4.19Å; P1853-Y2122 HydrophobicContact CG-CE2 4.43Å; P1853-Y2122 HydrophobicContact CG-CG 3.52Å; G1854-Y2122 WeakPolarHBondContact O-CD2 3.33Å; I2118-Y2122 HydrophobicContact CG2-CD1 4.2Å; I2118-Y2122 WeakPolarHBondContact O-CA 3.31Å; I2118-Y2122 VanDerWaalsContact O-CB 3.31Å; I2118-Y2122 WeakPolarHBondContact O-CB 3.29Å; I2118-Y2122 PolarHBondContact O-N 2.78Å; Y2122-P2125 WeakPolarHBondContact O-CD 2.99Å; Y2122-Y2126 AromaticContact CD2-CD2 3.93Å; Y2122-Y2126 HydrophobicContact CD2-CD2 3.93Å; Y2122-Y2126 AromaticContact CD2-CE2 3.63Å; Y2122-Y2126 HydrophobicContact CD2-CE2 3.63Å; Y2122-Y2126 AromaticContact CE2-CD2 3.88Å; Y2122-Y2126 HydrophobicContact CE2-CD2 3.88Å; Y2122-Y2126 AromaticContact CE2-CE2 3.32Å; Y2122-Y2126 HydrophobicContact CE2-CE2 3.32Å; Y2122-Y2126 HydrophobicContact CG-CD2 4.45Å; Y2122-Y2126 AromaticContact CZ-CE2 3.99Å; Y2122-Y2126 VanDerWaalsContact O-CD2 3.24Å; Y2122-Y2126 WeakPolarHBondContact O-CD2 3.25Å; Y2122-Y2126 PolarHBondContact O-N 3.37Å; Y2122-A2140 HydrophobicContact CE1-CB 4.21Å
2123	I	85.6	Confident	84.1	Confident	17 Å²	17	28.8 Å²	28.8	9%	0.087	16%	0.16	C	C	.	.	I	π-helix	trans	-66.5	-49.4	-169.7	-56.9	175.9	0	0	0	112	I2118 E2119 Y2126 K2127 V2141 V2144	I2118-I2123 HydrophobicContact CG2-CD1 4.23Å; I2118-I2123 HydrophobicContact CG2-CG1 4.24Å; I2118-I2123 PolarHBondContact O-N 2.88Å; E2119-I2123 HydrophobicContact CG-CD1 4.38Å; E2119-I2123 PolarHBondContact O-N 3.46Å; I2123-Y2126 PolarHBondContact O-N 3.28Å; I2123-K2127 HydrophobicContact CG2-CD 4.32Å; I2123-K2127 WeakPolarHBondContact O-CG 2.97Å; I2123-K2127 PolarHBondContact O-N 2.8Å; I2123-V2141 HydrophobicContact CD1-CG2 4.49Å; I2123-V2144 HydrophobicContact CD1-CG2 4.4Å
2124	N	91.4	Very high	82.4	Confident	13 Å²	13	30.4 Å²	30.4	7%	0.07	18%	0.18	C	C	.	.	H	α-helix	trans	-69.7	-43.6	-177.2	-65.7	-18.6	0	0	0	112.4	D2069 E2119 Y2126 K2127 I2128	D2069-N2124 HydrophobicContact CB-CB 4.42Å; D2069-N2124 VanDerWaalsContact O-CB 3.23Å; D2069-N2124 WeakPolarHBondContact O-CB 3.44Å; D2069-N2124 PolarHBondContact O-ND2 3.1Å; E2119-N2124 WeakPolarHBondContact O-CB 3.32Å; E2119-N2124 PolarHBondContact O-N 3.04Å; E2119-N2124 PolarHBondContact O-ND2 2.99Å; N2124-Y2126 VanDerWaalsContact C-N 3.3Å; N2124-Y2126 PolarHBondContact O-N 3.21Å; N2124-K2127 PolarHBondContact O-N 3.02Å; N2124-K2127 VanDerWaalsContact O-N 3.15Å; N2124-I2128 HydrophobicContact CB-CD1 4.13Å; N2124-I2128 WeakPolarHBondContact O-CB 3.39Å; N2124-I2128 VanDerWaalsContact O-CG1 3.22Å; N2124-I2128 WeakPolarHBondContact O-CG1 3.43Å; N2124-I2128 PolarHBondContact O-N 3.39Å
2125	P	91	Very high	80.8	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-49.5	-47.6	170.2	-33.2	38	0	0	0	113.7	I1856 I1858 Y2122 K2127 I2128 F2129	I1856-P2125 HydrophobicContact CB-CB 3.9Å; I1856-P2125 HydrophobicContact CB-CG 4.36Å; I1856-P2125 HydrophobicContact CD1-CB 3.94Å; I1856-P2125 HydrophobicContact CG1-CB 4.45Å; I1856-P2125 HydrophobicContact CG2-CB 4.02Å; I1858-P2125 HydrophobicContact CG2-CB 3.67Å; I1858-P2125 HydrophobicContact CG2-CG 4.06Å; Y2122-P2125 WeakPolarHBondContact O-CD 2.99Å; P2125-K2127 PolarHBondContact O-N 3.48Å; P2125-I2128 PolarHBondContact O-N 3.41Å; P2125-F2129 WeakPolarHBondContact O-CD2 3.49Å; P2125-F2129 PolarHBondContact O-N 2.93Å; P2125-F2129 VanDerWaalsContact O-N 3.12Å
2126	Y	84.4	Confident	79.2	Confident	43 Å²	43	29.3 Å²	29.3	17%	0.169	17%	0.173	C	C	.	.	H	α-helix	trans	-59.9	-47	177.3	-90	-62.9	0	0	0	112.8	I1856 Y2122 I2123 N2124 G2130 I2131 P2132 T2133	I1856-Y2126 HydrophobicContact CD1-CD1 4.25Å; I1856-Y2126 HydrophobicContact CD1-CD2 3.56Å; I1856-Y2126 HydrophobicContact CD1-CE1 4.14Å; I1856-Y2126 HydrophobicContact CD1-CE2 3.37Å; I1856-Y2126 HydrophobicContact CD1-CG 4Å; I1856-Y2126 HydrophobicContact CG1-CE2 4.36Å; Y2122-Y2126 AromaticContact CD2-CD2 3.93Å; Y2122-Y2126 HydrophobicContact CD2-CD2 3.93Å; Y2122-Y2126 AromaticContact CD2-CE2 3.63Å; Y2122-Y2126 HydrophobicContact CD2-CE2 3.63Å; Y2122-Y2126 AromaticContact CE2-CD2 3.88Å; Y2122-Y2126 HydrophobicContact CE2-CD2 3.88Å; Y2122-Y2126 AromaticContact CE2-CE2 3.32Å; Y2122-Y2126 HydrophobicContact CE2-CE2 3.32Å; Y2122-Y2126 HydrophobicContact CG-CD2 4.45Å; Y2122-Y2126 AromaticContact CZ-CE2 3.99Å; Y2122-Y2126 VanDerWaalsContact O-CD2 3.24Å; Y2122-Y2126 WeakPolarHBondContact O-CD2 3.25Å; Y2122-Y2126 PolarHBondContact O-N 3.37Å; I2123-Y2126 PolarHBondContact O-N 3.28Å; N2124-Y2126 VanDerWaalsContact C-N 3.3Å; N2124-Y2126 PolarHBondContact O-N 3.21Å; Y2126-G2130 PolarHBondContact O-N 3.24Å; Y2126-G2130 VanDerWaalsContact O-N 3.12Å; Y2126-I2131 HydrophobicContact CD1-CB 3.51Å; Y2126-I2131 HydrophobicContact CD1-CG2 3.87Å; Y2126-I2131 WeakPolarHBondContact CD1-O 3.08Å; Y2126-I2131 HydrophobicContact CE1-CB 3.68Å; Y2126-I2131 HydrophobicContact CE1-CG2 3.45Å; Y2126-I2131 VanDerWaalsContact CE1-CG2 3.45Å; Y2126-I2131 PolarHBondContact O-N 2.92Å; Y2126-P2132 WeakPolarHBondContact CE1-O 3.18Å; Y2126-T2133 HydrophobicContact CD1-CG2 3.34Å; Y2126-T2133 HydrophobicContact CD2-CG2 3.67Å; Y2126-T2133 HydrophobicContact CE1-CG2 3.21Å; Y2126-T2133 HydrophobicContact CE2-CG2 3.56Å; Y2126-T2133 HydrophobicContact CG-CG2 3.58Å
2127	K	83.3	Confident	77.3	Confident	84 Å²	84	30 Å²	30	37%	0.365	18%	0.178	S	C	.	.	H	α-helix	trans	-63.3	-44.7	179	-76.3	178.8	179.7	-179.7	0	113.2	I2123 N2124 P2125 L2137	I2123-K2127 HydrophobicContact CG2-CD 4.32Å; I2123-K2127 WeakPolarHBondContact O-CG 2.97Å; I2123-K2127 PolarHBondContact O-N 2.8Å; N2124-K2127 PolarHBondContact O-N 3.02Å; N2124-K2127 VanDerWaalsContact O-N 3.15Å; P2125-K2127 PolarHBondContact O-N 3.48Å; K2127-L2137 HydrophobicContact CD-CD1 4.11Å; K2127-L2137 HydrophobicContact CG-CD1 3.58Å
2128	I	87.2	Confident	75.2	Confident	4 Å²	4	38.2 Å²	38.2	2%	0.021	21%	0.21	C	C	.	.	H	α-helix	trans	-74.9	-41	-170.1	-67.6	167.4	0	0	0	110.9	P1975 T2024 D2069 N2124 P2125 L2237	P1975-I2128 HydrophobicContact CB-CG2 4.47Å; P1975-I2128 HydrophobicContact CG-CG2 4.48Å; T2024-I2128 HydrophobicContact CG2-CD1 3.87Å; T2024-I2128 HydrophobicContact CG2-CG1 4.04Å; D2069-I2128 HydrophobicContact CB-CD1 3.9Å; N2124-I2128 HydrophobicContact CB-CD1 4.13Å; N2124-I2128 WeakPolarHBondContact O-CB 3.39Å; N2124-I2128 VanDerWaalsContact O-CG1 3.22Å; N2124-I2128 WeakPolarHBondContact O-CG1 3.43Å; N2124-I2128 PolarHBondContact O-N 3.39Å; P2125-I2128 PolarHBondContact O-N 3.41Å; I2128-L2237 WeakPolarHBondContact O-CD2 3.35Å
2129	F	87.7	Confident	73.2	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-98.3	-0.7	-174.7	-65	-79.3	0	0	0	113.6	I1858 L1889 Y1922 V1941 R1974 P1975 H2000 P2125 I2131	I1858-F2129 HydrophobicContact CB-CD2 4.38Å; I1858-F2129 HydrophobicContact CB-CE2 3.85Å; I1858-F2129 HydrophobicContact CB-CZ 4.3Å; I1858-F2129 HydrophobicContact CD1-CE2 3.57Å; I1858-F2129 HydrophobicContact CD1-CZ 4.01Å; I1858-F2129 HydrophobicContact CG1-CE2 4.32Å; I1858-F2129 HydrophobicContact CG2-CD2 3.88Å; I1858-F2129 HydrophobicContact CG2-CE2 3.75Å; L1889-F2129 HydrophobicContact CD1-CB 4.2Å; L1889-F2129 HydrophobicContact CD1-CD1 4.05Å; L1889-F2129 HydrophobicContact CD1-CD2 4.04Å; L1889-F2129 HydrophobicContact CD1-CG 3.8Å; Y1922-F2129 HydrophobicContact CE1-CD1 4.44Å; Y1922-F2129 AromaticContact CE1-CE1 3.96Å; Y1922-F2129 HydrophobicContact CE1-CE1 3.96Å; Y1922-F2129 AromaticContact CZ-CE1 3.78Å; Y1922-F2129 WeakPolarHBondContact OH-CE1 3.05Å; Y1922-F2129 VanDerWaalsContact OH-CZ 3.24Å; Y1922-F2129 WeakPolarHBondContact OH-CZ 3.28Å; V1941-F2129 HydrophobicContact CB-CD1 4.49Å; R1974-F2129 PolarHBondContact NH1-O 3.06Å; P1975-F2129 HydrophobicContact CB-CE1 4.41Å; P1975-F2129 HydrophobicContact CG-CD1 3.52Å; P1975-F2129 HydrophobicContact CG-CE1 3.61Å; P1975-F2129 HydrophobicContact CG-CG 4.39Å; H2000-F2129 HydrophobicContact CB-CZ 4.47Å; H2000-F2129 AromaticContact CD2-CZ 3.96Å; P2125-F2129 WeakPolarHBondContact O-CD2 3.49Å; P2125-F2129 PolarHBondContact O-N 2.93Å; P2125-F2129 VanDerWaalsContact O-N 3.12Å; F2129-I2131 VanDerWaalsContact C-N 3.27Å; F2129-I2131 HydrophobicContact CB-CD1 4.11Å; F2129-I2131 HydrophobicContact CB-CG1 3.92Å; F2129-I2131 PolarHBondContact O-N 2.97Å
2130	G	74.7	Confident	71.4	Confident	32 Å²	32	41.1 Å²	41.1	33%	0.33	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	60	38.8	178.4	0	0	0	0	0	112.5	Y2126 I2227	Y2126-G2130 PolarHBondContact O-N 3.24Å; Y2126-G2130 VanDerWaalsContact O-N 3.12Å; G2130-I2227 WeakPolarHBondContact O-CD1 3.44Å
2131	I	74.8	Confident	69.3	Low	8 Å²	8	44.4 Å²	44.4	4%	0.041	25%	0.245	C	C	.	.			trans	-76.1	130.2	178.9	-54.7	168.1	0	0	0	107.3	I1856 L1889 Y2126 F2129 T2133 V2223	I1856-I2131 HydrophobicContact CD1-CD1 4.15Å; I1856-I2131 HydrophobicContact CG2-CD1 4.43Å; L1889-I2131 HydrophobicContact CD1-CD1 4.32Å; L1889-I2131 HydrophobicContact CD2-CD1 4.09Å; Y2126-I2131 HydrophobicContact CD1-CB 3.51Å; Y2126-I2131 HydrophobicContact CD1-CG2 3.87Å; Y2126-I2131 WeakPolarHBondContact CD1-O 3.08Å; Y2126-I2131 HydrophobicContact CE1-CB 3.68Å; Y2126-I2131 HydrophobicContact CE1-CG2 3.45Å; Y2126-I2131 VanDerWaalsContact CE1-CG2 3.45Å; Y2126-I2131 PolarHBondContact O-N 2.92Å; F2129-I2131 VanDerWaalsContact C-N 3.27Å; F2129-I2131 HydrophobicContact CB-CD1 4.11Å; F2129-I2131 HydrophobicContact CB-CG1 3.92Å; F2129-I2131 PolarHBondContact O-N 2.97Å; I2131-T2133 PolarHBondContact O-N 3.28Å; I2131-V2223 HydrophobicContact CG1-CG2 4.49Å; I2131-V2223 HydrophobicContact CG2-CB 3.72Å; I2131-V2223 HydrophobicContact CG2-CG1 4.46Å; I2131-V2223 HydrophobicContact CG2-CG2 3.54Å
2132	P	63.1	Low	67	Low	47 Å²	47	46.7 Å²	46.7	31%	0.305	26%	0.258	S	S	.	.			trans	-63.7	131.7	176.8	-18.5	32.1	0	0	0	110.4	Y2126 V2223 D2226 I2227	Y2126-P2132 WeakPolarHBondContact CE1-O 3.18Å; P2132-V2223 WeakPolarHBondContact CD-O 3.39Å; P2132-D2226 HydrophobicContact CB-CB 4.4Å; P2132-D2226 HydrophobicContact CG-CB 3.93Å; P2132-I2227 HydrophobicContact CG-CG1 3.67Å
2133	T	54.4	Low	65.2	Low	44 Å²	44	47 Å²	47	27%	0.27	26%	0.262	S	S	.	.			trans	-106.1	149.4	167.3	32.7	0	0	0	0	109	Y2126 I2131 H2135	Y2126-T2133 HydrophobicContact CD1-CG2 3.34Å; Y2126-T2133 HydrophobicContact CD2-CG2 3.67Å; Y2126-T2133 HydrophobicContact CE1-CG2 3.21Å; Y2126-T2133 HydrophobicContact CE2-CG2 3.56Å; Y2126-T2133 HydrophobicContact CG-CG2 3.58Å; I2131-T2133 PolarHBondContact O-N 3.28Å; T2133-H2135 WeakPolarHBondContact CB-O 3.39Å; T2133-H2135 PolarHBondContact O-N 2.87Å; T2133-H2135 PolarHBondContact OG1-O 2.99Å
2134	A	50.7	Low	63.6	Low	105 Å²	105	47.7 Å²	47.7	87%	0.868	27%	0.267	S	S	*	.	S	Bend	trans	-66.3	-16.2	165.7	0	0	0	0	0	112.5
2135	H	48.1	Very low	61.4	Low	47 Å²	47	51.4 Å²	51.4	22%	0.218	29%	0.294	C	S	.	.	S	Bend	trans	-108.8	143.1	-175.9	-67.9	-57.3	0	0	0	111.7	T2133 E2139	T2133-H2135 WeakPolarHBondContact CB-O 3.39Å; T2133-H2135 PolarHBondContact O-N 2.87Å; T2133-H2135 PolarHBondContact OG1-O 2.99Å; H2135-E2139 WeakPolarHBondContact CA-OE2 3.43Å; H2135-E2139 HydrophobicContact CB-CB 3.97Å; H2135-E2139 IonicContact CG-OE2 3.52Å; H2135-E2139 IonicContact ND1-OE2 3.9Å; H2135-E2139 PolarHBondContact ND1-OE2 3.46Å
2136	T	48.3	Very low	59.3	Low	70 Å²	70	60.3 Å²	60.3	43%	0.429	33%	0.328	S	S	.	.			trans	-65.8	156.1	165	57.4	0	0	0	0	110	Y2138 E2139 A2140	T2136-Y2138 PolarHBondContact O-N 3.23Å; T2136-Y2138 VanDerWaalsContact O-N 3.14Å; T2136-E2139 PolarHBondContact N-OE2 2.99Å; T2136-E2139 WeakPolarHBondContact O-CA 3.37Å; T2136-E2139 WeakPolarHBondContact O-CB 3.43Å; T2136-E2139 PolarHBondContact O-N 3.4Å; T2136-E2139 WeakPolarHBondContact OG1-CG 3.04Å; T2136-E2139 PolarHBondContact OG1-N 2.91Å; T2136-A2140 PolarHBondContact O-N 2.88Å
2137	L	50.1	Low	57.8	Low	59 Å²	59	60 Å²	60	31%	0.309	34%	0.337	S	S	.	.	H	α-helix	trans	-59	-31	-180	-144.9	134.9	0	0	0	113	K2127 A2140 V2141 Y2234	K2127-L2137 HydrophobicContact CD-CD1 4.11Å; K2127-L2137 HydrophobicContact CG-CD1 3.58Å; L2137-A2140 PolarHBondContact O-N 3.11Å; L2137-V2141 HydrophobicContact CD2-CG2 4.46Å; L2137-V2141 WeakPolarHBondContact O-CG2 3.32Å; L2137-V2141 PolarHBondContact O-N 3.43Å; L2137-Y2234 HydrophobicContact CB-CE1 4.47Å
2138	Y	47.9	Very low	56.4	Low	172 Å²	172	61 Å²	61	68%	0.675	35%	0.346	S	S	*	.	H	α-helix	trans	-63.9	-40.7	171.9	-179.9	-101.2	0	0	0	112.6	T2136 N2142	T2136-Y2138 PolarHBondContact O-N 3.23Å; T2136-Y2138 VanDerWaalsContact O-N 3.14Å; Y2138-N2142 WeakPolarHBondContact CD1-ND2 3.27Å; Y2138-N2142 WeakPolarHBondContact CE1-ND2 3.27Å; Y2138-N2142 WeakPolarHBondContact O-CB 3.4Å; Y2138-N2142 PolarHBondContact O-N 2.72Å; Y2138-N2142 VanDerWaalsContact O-N 3.08Å; Y2138-N2142 PolarHBondContact O-ND2 2.69Å; Y2138-N2142 VanDerWaalsContact O-ND2 3.12Å
2139	E	47.3	Very low	55.2	Low	88 Å²	88	61.6 Å²	61.6	41%	0.411	35%	0.348	S	S	.	.	H	α-helix	trans	-68.1	-43.9	174.6	-76.2	175.6	179.9	0	0	111.5	H2135 T2136 V2141 N2142 S2143	H2135-E2139 WeakPolarHBondContact CA-OE2 3.43Å; H2135-E2139 HydrophobicContact CB-CB 3.97Å; H2135-E2139 IonicContact CG-OE2 3.52Å; H2135-E2139 IonicContact ND1-OE2 3.9Å; H2135-E2139 PolarHBondContact ND1-OE2 3.46Å; T2136-E2139 PolarHBondContact N-OE2 2.99Å; T2136-E2139 WeakPolarHBondContact O-CA 3.37Å; T2136-E2139 WeakPolarHBondContact O-CB 3.43Å; T2136-E2139 PolarHBondContact O-N 3.4Å; T2136-E2139 WeakPolarHBondContact OG1-CG 3.04Å; T2136-E2139 PolarHBondContact OG1-N 2.91Å; E2139-V2141 VanDerWaalsContact C-N 3.31Å; E2139-V2141 PolarHBondContact O-N 3.34Å; E2139-N2142 PolarHBondContact O-N 2.91Å; E2139-S2143 VanDerWaalsContact O-CB 3.27Å; E2139-S2143 WeakPolarHBondContact O-CB 3.3Å; E2139-S2143 PolarHBondContact O-N 3.45Å; E2139-S2143 PolarHBondContact O-OG 2.77Å
2140	A	50.7	Low	54	Low	8 Å²	8	63.2 Å²	63.2	7%	0.066	37%	0.365	C	S	.	.	H	α-helix	trans	-57.7	-41.8	178	0	0	0	0	0	112.4	Y2122 T2136 L2137 S2143 V2144	Y2122-A2140 HydrophobicContact CE1-CB 4.21Å; T2136-A2140 PolarHBondContact O-N 2.88Å; L2137-A2140 PolarHBondContact O-N 3.11Å; A2140-S2143 WeakPolarHBondContact O-CB 3.26Å; A2140-V2144 WeakPolarHBondContact O-CG2 3.2Å; A2140-V2144 PolarHBondContact O-N 2.66Å
2141	V	49.6	Very low	53.9	Low	76 Å²	76	67.3 Å²	67.3	46%	0.461	38%	0.375	S	S	.	.	H	α-helix	trans	-69.4	-43	176.3	174.7	0	0	0	0	111.6	I2123 L2137 E2139 S2143 V2144	I2123-V2141 HydrophobicContact CD1-CG2 4.49Å; L2137-V2141 HydrophobicContact CD2-CG2 4.46Å; L2137-V2141 WeakPolarHBondContact O-CG2 3.32Å; L2137-V2141 PolarHBondContact O-N 3.43Å; E2139-V2141 VanDerWaalsContact C-N 3.31Å; E2139-V2141 PolarHBondContact O-N 3.34Å; V2141-S2143 VanDerWaalsContact C-N 3.31Å; V2141-S2143 PolarHBondContact O-N 2.96Å; V2141-V2144 PolarHBondContact O-N 2.8Å
2142	N	46.3	Very low	54.1	Low	49 Å²	49	68.5 Å²	68.5	26%	0.262	38%	0.383	S	S	.	.	H	α-helix	trans	-64.7	-35.5	175.7	-84.1	-45.5	0	0	0	112.4	Y2138 E2139 V2144 S2145 R2146	Y2138-N2142 WeakPolarHBondContact CD1-ND2 3.27Å; Y2138-N2142 WeakPolarHBondContact CE1-ND2 3.27Å; Y2138-N2142 WeakPolarHBondContact O-CB 3.4Å; Y2138-N2142 PolarHBondContact O-N 2.72Å; Y2138-N2142 VanDerWaalsContact O-N 3.08Å; Y2138-N2142 PolarHBondContact O-ND2 2.69Å; Y2138-N2142 VanDerWaalsContact O-ND2 3.12Å; E2139-N2142 PolarHBondContact O-N 2.91Å; N2142-V2144 VanDerWaalsContact C-N 3.27Å; N2142-V2144 PolarHBondContact O-N 2.85Å; N2142-S2145 PolarHBondContact O-N 2.86Å; N2142-S2145 VanDerWaalsContact O-N 3.13Å; N2142-S2145 PolarHBondContact O-OG 3.23Å; N2142-R2146 PolarHBondContact O-N 3.07Å
2143	S	52.6	Low	55.2	Low	20 Å²	20	66.9 Å²	66.9	14%	0.14	37%	0.371	C	S	.	.	H	α-helix	trans	-58.3	-37	175.4	-83.3	0	0	0	0	112.4	E2139 A2140 V2141 R2146 G2147 I2148	E2139-S2143 VanDerWaalsContact O-CB 3.27Å; E2139-S2143 WeakPolarHBondContact O-CB 3.3Å; E2139-S2143 PolarHBondContact O-N 3.45Å; E2139-S2143 PolarHBondContact O-OG 2.77Å; A2140-S2143 WeakPolarHBondContact O-CB 3.26Å; V2141-S2143 VanDerWaalsContact C-N 3.31Å; V2141-S2143 PolarHBondContact O-N 2.96Å; S2143-R2146 PolarHBondContact O-N 2.94Å; S2143-G2147 WeakPolarHBondContact O-CA 3.45Å; S2143-G2147 PolarHBondContact O-N 2.8Å; S2143-I2148 WeakPolarHBondContact CB-O 3.49Å; S2143-I2148 PolarHBondContact O-N 2.62Å; S2143-I2148 VanDerWaalsContact O-N 3.12Å; S2143-I2148 PolarHBondContact OG-O 3.28Å
2144	V	51.7	Low	56.8	Low	32 Å²	32	64.8 Å²	64.8	19%	0.194	36%	0.358	C	S	.	.	H	α-helix	trans	-63.3	-43	174.6	179.1	0	0	0	0	111.4	I2118 I2123 A2140 V2141 N2142 R2146 G2147 Y2149	I2118-V2144 HydrophobicContact CD1-CG1 3.99Å; I2118-V2144 HydrophobicContact CD1-CG2 4.35Å; I2118-V2144 HydrophobicContact CG2-CG2 3.75Å; I2123-V2144 HydrophobicContact CD1-CG2 4.4Å; A2140-V2144 WeakPolarHBondContact O-CG2 3.2Å; A2140-V2144 PolarHBondContact O-N 2.66Å; V2141-V2144 PolarHBondContact O-N 2.8Å; N2142-V2144 VanDerWaalsContact C-N 3.27Å; N2142-V2144 PolarHBondContact O-N 2.85Å; V2144-R2146 VanDerWaalsContact C-N 3.27Å; V2144-R2146 PolarHBondContact O-N 3.35Å; V2144-G2147 PolarHBondContact O-N 3.4Å; V2144-Y2149 HydrophobicContact CG2-CE1 4.22Å
2145	S	46	Very low	58.5	Low	92 Å²	92	59.9 Å²	59.9	64%	0.643	32%	0.317	S	S	*	.	H	α-helix	trans	-67	-27.6	179.4	71.1	0	0	0	0	113.4	N2142	N2142-S2145 PolarHBondContact O-N 2.86Å; N2142-S2145 VanDerWaalsContact O-N 3.13Å; N2142-S2145 PolarHBondContact O-OG 3.23Å
2146	R	45.9	Very low	60.4	Low	187 Å²	187	57.6 Å²	57.6	71%	0.706	31%	0.307	S	S	*	.	H	α-helix	trans	-96.3	-16.7	178.9	-66.5	-177	-179.8	165.1	0.6	113.9	N2142 S2143 V2144 I2148	N2142-R2146 PolarHBondContact O-N 3.07Å; S2143-R2146 PolarHBondContact O-N 2.94Å; V2144-R2146 VanDerWaalsContact C-N 3.27Å; V2144-R2146 PolarHBondContact O-N 3.35Å; R2146-I2148 HydrophobicContact CB-CD1 4.28Å; R2146-I2148 HydrophobicContact CB-CG1 4.3Å
2147	G	53.1	Low	62.2	Low	36 Å²	36	54.9 Å²	54.9	37%	0.371	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.9	25.5	-172.7	0	0	0	0	0	115	S2143 V2144	S2143-G2147 WeakPolarHBondContact O-CA 3.45Å; S2143-G2147 PolarHBondContact O-N 2.8Å; V2144-G2147 PolarHBondContact O-N 3.4Å
2148	I	55.2	Low	64	Low	106 Å²	106	52.5 Å²	52.5	54%	0.544	28%	0.277	S	S	.	.			trans	-122.1	113.1	-174.4	-56.3	172.4	0	0	0	110	S2143 R2146	S2143-I2148 WeakPolarHBondContact CB-O 3.49Å; S2143-I2148 PolarHBondContact O-N 2.62Å; S2143-I2148 VanDerWaalsContact O-N 3.12Å; S2143-I2148 PolarHBondContact OG-O 3.28Å; R2146-I2148 HydrophobicContact CB-CD1 4.28Å; R2146-I2148 HydrophobicContact CB-CG1 4.3Å
2149	Y	61	Low	65.5	Low	15 Å²	15	46.4 Å²	46.4	6%	0.059	26%	0.26	C	S	.	.			trans	-111.7	24.2	-167.9	-54.5	-73.1	0	0	0	115.8	Y1851 P1853 I2118 V2144	Y1851-Y2149 WeakPolarHBondContact O-CE2 3.25Å; P1853-Y2149 HydrophobicContact CB-CD1 3.52Å; P1853-Y2149 HydrophobicContact CB-CE1 3.99Å; P1853-Y2149 HydrophobicContact CB-CG 3.82Å; P1853-Y2149 HydrophobicContact CG-CD1 4.05Å; P1853-Y2149 HydrophobicContact CG-CE1 3.99Å; I2118-Y2149 WeakPolarHBondContact CD1-OH 3.45Å; V2144-Y2149 HydrophobicContact CG2-CE1 4.22Å
2150	G	63.5	Low	67.1	Low	35 Å²	35	43 Å²	43	36%	0.361	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	68.9	-143.7	-179.9	0	0	0	0	0	112.8
2151	E	70.6	Confident	68.8	Low	117 Å²	117	48.4 Å²	48.4	55%	0.547	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-5	-172.5	-62.9	-170.2	164.2	0	0	114.9	M2201 R2203 G2204	E2151-M2201 VanDerWaalsContact O-CG 3.3Å; E2151-M2201 WeakPolarHBondContact O-CG 3.4Å; E2151-R2203 PolarHBondContact O-N 2.89Å; E2151-G2204 PolarHBondContact O-N 3.13Å
2152	T	79.9	Confident	70.4	Confident	34 Å²	34	47.1 Å²	47.1	21%	0.209	26%	0.257	C	S	.	.			trans	-128.1	113.4	-178.2	-59.6	0	0	0	0	110.4	G1854 V1886 M2201 L2202 R2203	G1854-T2152 PolarHBondContact N-O 3.02Å; V1886-T2152 HydrophobicContact CB-CG2 4.16Å; V1886-T2152 HydrophobicContact CG1-CG2 4.16Å; V1886-T2152 HydrophobicContact CG2-CG2 3.75Å; T2152-M2201 CarbonylContact C-O 3.6Å; T2152-M2201 VanDerWaalsContact CA-O 3.25Å; T2152-M2201 WeakPolarHBondContact CA-O 3.27Å; T2152-M2201 WeakPolarHBondContact CG2-O 3.4Å; T2152-L2202 HydrophobicContact CG2-CD1 4.03Å; T2152-R2203 PolarHBondContact OG1-N 2.85Å
2153	W	85.8	Confident	72.3	Confident	13 Å²	13	53.2 Å²	53.2	5%	0.049	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	162.2	-174.5	53.3	-100.5	0	0	0	112.2	Y1851 L1852 E2155 R2199 M2201	Y1851-W2153 HydrophobicContact CD1-CD2 4.46Å; Y1851-W2153 AromaticContact CD1-CE3 3.87Å; Y1851-W2153 HydrophobicContact CD1-CE3 3.87Å; Y1851-W2153 HydrophobicContact CD1-CZ3 4.17Å; Y1851-W2153 HydrophobicContact CE1-CE3 4.08Å; Y1851-W2153 HydrophobicContact CE1-CH2 4.42Å; Y1851-W2153 AromaticContact CE1-CZ3 3.89Å; Y1851-W2153 HydrophobicContact CE1-CZ3 3.89Å; L1852-W2153 CarbonylContact O-C 3.34Å; L1852-W2153 WeakPolarHBondContact O-CA 3.35Å; L1852-W2153 WeakPolarHBondContact O-CB 3.4Å; W2153-E2155 HydrophobicContact CE3-CB 4.35Å; W2153-E2155 HydrophobicContact CZ3-CB 3.87Å; W2153-R2199 HydrophobicContact CZ3-CB 4.25Å; W2153-M2201 HydrophobicContact CD2-CB 3.63Å; W2153-M2201 VanDerWaalsContact CE2-CB 3.42Å; W2153-M2201 HydrophobicContact CE3-CB 4.17Å; W2153-M2201 HydrophobicContact CG-CB 3.97Å; W2153-M2201 HydrophobicContact CH2-CB 4.33Å; W2153-M2201 HydrophobicContact CH2-CE 4.19Å; W2153-M2201 HydrophobicContact CZ2-CB 3.82Å; W2153-M2201 HydrophobicContact CZ2-CE 3.71Å; W2153-M2201 HydrophobicContact CZ2-CG 4.22Å; W2153-M2201 HydrophobicContact CZ3-CB 4.48Å; W2153-M2201 PolarHBondContact N-O 2.74Å; W2153-M2201 PolarHBondContact O-N 3.47Å
2154	V	87.8	Confident	73.9	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	125.6	-177.9	-177.4	0	0	0	0	108.9	Y1851 L1852 G1884 V1886 L2100 V2156 V2197 R2199 V2200	Y1851-V2154 WeakPolarHBondContact CA-O 3.41Å; L1852-V2154 HydrophobicContact CB-CB 4.3Å; L1852-V2154 PolarHBondContact N-O 3.31Å; L1852-V2154 PolarHBondContact O-N 3.16Å; G1884-V2154 WeakPolarHBondContact O-CG2 3.4Å; V1886-V2154 HydrophobicContact CG1-CG2 4.06Å; L2100-V2154 HydrophobicContact CD2-CG1 4.45Å; V2154-V2156 HydrophobicContact CG1-CG2 3.98Å; V2154-V2197 HydrophobicContact CG1-CG1 3.95Å; V2154-V2197 HydrophobicContact CG1-CG2 4.38Å; V2154-R2199 WeakPolarHBondContact CA-O 3.4Å; V2154-V2200 HydrophobicContact CG1-CG2 4.27Å; V2154-V2200 HydrophobicContact CG2-CG1 4.44Å; V2154-V2200 HydrophobicContact CG2-CG2 4.33Å
2155	E	86.5	Confident	75	Confident	1 Å²	1	52.7 Å²	52.7	1%	0.005	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	127.7	174.2	-179.9	175.4	106.2	0	0	110	K690 I1849 Y1851 W2153 R2198 R2199	K690-E2155 IonicContact NZ-OE1 2.8Å; K690-E2155 PolarHBondContact NZ-OE1 3.41Å; I1849-E2155 HydrophobicContact CG2-CG 3.55Å; Y1851-E2155 HydrophobicContact CD1-CB 4.14Å; Y1851-E2155 HydrophobicContact CD1-CG 4.46Å; Y1851-E2155 HydrophobicContact CE1-CB 3.83Å; Y1851-E2155 HydrophobicContact CE1-CG 3.86Å; Y1851-E2155 WeakPolarHBondContact CE1-OE2 3.16Å; Y1851-E2155 VanDerWaalsContact CZ-OE2 3.27Å; Y1851-E2155 PolarHBondContact OH-OE2 2.92Å; W2153-E2155 HydrophobicContact CE3-CB 4.35Å; W2153-E2155 HydrophobicContact CZ3-CB 3.87Å; E2155-R2198 HydrophobicContact CG-CB 4.38Å; E2155-R2198 PolarHBondContact O-N 3.1Å; E2155-R2199 HydrophobicContact CB-CB 4.07Å; E2155-R2199 VanDerWaalsContact CD-NE 3.31Å; E2155-R2199 PolarHBondContact N-O 2.93Å; E2155-R2199 PolarHBondContact O-N 3.03Å; E2155-R2199 IonicContact OE1-CZ 2.83Å; E2155-R2199 IonicContact OE1-NE 3.88Å; E2155-R2199 PolarHBondContact OE1-NE 3.01Å; E2155-R2199 IonicContact OE1-NH2 2.77Å; E2155-R2199 PolarHBondContact OE1-NH2 3.19Å; E2155-R2199 IonicContact OE2-CZ 3.32Å; E2155-R2199 VanDerWaalsContact OE2-CZ 3.3Å; E2155-R2199 IonicContact OE2-NE 3.72Å; E2155-R2199 PolarHBondContact OE2-NE 2.82Å; E2155-R2199 IonicContact OE2-NH2 2.8Å; E2155-R2199 PolarHBondContact OE2-NH2 3.37Å
2156	V	88.1	Confident	75.9	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	133.8	-178.4	-175	0	0	0	0	110.9	I1849 I1850 L1852 L2100 L2104 V2154 Q2196 V2197	I1849-V2156 WeakPolarHBondContact CA-O 3.35Å; I1850-V2156 HydrophobicContact CG1-CB 3.94Å; I1850-V2156 PolarHBondContact N-O 3.22Å; I1850-V2156 PolarHBondContact O-N 3.46Å; L1852-V2156 HydrophobicContact CD1-CG2 3.95Å; L2100-V2156 HydrophobicContact CD2-CG2 3.99Å; L2104-V2156 HydrophobicContact CD1-CB 4.34Å; L2104-V2156 HydrophobicContact CD1-CG1 3.5Å; L2104-V2156 VanDerWaalsContact CD1-CG1 3.5Å; L2104-V2156 HydrophobicContact CD1-CG2 4.4Å; V2154-V2156 HydrophobicContact CG1-CG2 3.98Å; V2156-Q2196 WeakPolarHBondContact CA-O 3.18Å; V2156-V2197 HydrophobicContact CG2-CG2 4.36Å
2157	D	87.6	Confident	76.3	Confident	13 Å²	13	42.2 Å²	42.2	7%	0.07	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	107.3	171.7	-174.8	-21.4	0	0	0	110.1	S1847 I1849 S2159 A2160 G2195 Q2196 R2198	S1847-D2157 WeakPolarHBondContact CB-OD2 3.44Å; S1847-D2157 PolarHBondContact OG-OD2 3.3Å; I1849-D2157 HydrophobicContact CD1-CB 3.73Å; D2157-S2159 VanDerWaalsContact C-N 3.34Å; D2157-S2159 WeakPolarHBondContact OD1-CA 3.31Å; D2157-S2159 WeakPolarHBondContact OD1-CB 3.38Å; D2157-S2159 PolarHBondContact OD1-N 3.17Å; D2157-S2159 PolarHBondContact OD1-OG 3.31Å; D2157-A2160 HydrophobicContact CB-CB 4.02Å; D2157-A2160 PolarHBondContact OD1-N 3.47Å; D2157-G2195 CarbonylContact O-C 3.48Å; D2157-G2195 WeakPolarHBondContact O-CA 3.16Å; D2157-Q2196 PolarHBondContact N-O 2.8Å; D2157-Q2196 PolarHBondContact O-N 3Å; D2157-R2198 HydrophobicContact CB-CG 3.78Å
2158	M	86	Confident	76.2	Confident	8 Å²	8	42.2 Å²	42.2	4%	0.039	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	-20.7	179	-68.8	-63	-61.9	0	0	113.6	Q1848 I1850 L2104 M2107	Q1848-M2158 HydrophobicContact CB-CB 4Å; Q1848-M2158 VanDerWaalsContact O-CB 3.32Å; Q1848-M2158 WeakPolarHBondContact O-CB 3.26Å; Q1848-M2158 PolarHBondContact O-N 3.28Å; I1850-M2158 HydrophobicContact CD1-CG 3.88Å; I1850-M2158 HydrophobicContact CD1-SD 3.76Å; I1850-M2158 HydrophobicContact CG1-CG 4Å; I1850-M2158 HydrophobicContact CG1-SD 4.4Å; I1850-M2158 HydrophobicContact CG2-CG 4.08Å; L2104-M2158 HydrophobicContact CB-CE 4.08Å; L2104-M2158 HydrophobicContact CB-SD 3.93Å; L2104-M2158 HydrophobicContact CD1-SD 3.88Å; L2104-M2158 HydrophobicContact CD2-CE 4.43Å; L2104-M2158 HydrophobicContact CD2-SD 3.82Å; L2104-M2158 HydrophobicContact CG-SD 4.1Å; M2107-M2158 HydrophobicContact CE-CE 3.55Å; M2107-M2158 HydrophobicContact CE-SD 4.11Å
2159	S	79.3	Confident	76.2	Confident	45 Å²	45	43.9 Å²	43.9	32%	0.315	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	-23.2	174.7	29.5	0	0	0	0	112.7	S1847 Q1848 D2157 E2161	S1847-S2159 WeakPolarHBondContact CA-OG 3.18Å; S1847-S2159 VanDerWaalsContact CB-OG 3.29Å; S1847-S2159 WeakPolarHBondContact CB-OG 3.18Å; Q1848-S2159 PolarHBondContact N-OG 2.82Å; D2157-S2159 VanDerWaalsContact C-N 3.34Å; D2157-S2159 WeakPolarHBondContact OD1-CA 3.31Å; D2157-S2159 WeakPolarHBondContact OD1-CB 3.38Å; D2157-S2159 PolarHBondContact OD1-N 3.17Å; D2157-S2159 PolarHBondContact OD1-OG 3.31Å; S2159-E2161 PolarHBondContact O-N 3.37Å
2160	A	82.5	Confident	75.6	Confident	16 Å²	16	51.5 Å²	51.5	13%	0.132	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	117.1	177	0	0	0	0	0	111.3	D2157 G2195 Q2196	D2157-A2160 HydrophobicContact CB-CB 4.02Å; D2157-A2160 PolarHBondContact OD1-N 3.47Å; A2160-G2195 PolarHBondContact O-N 3.1Å; A2160-Q2196 HydrophobicContact CB-CB 3.77Å
2161	E	84.9	Confident	74.7	Confident	121 Å²	121	53.4 Å²	53.4	57%	0.565	27%	0.269	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.2	126.2	165.3	-70	-168.4	165.3	0	0	109.5	S2159 V2192 V2193 R2194	S2159-E2161 PolarHBondContact O-N 3.37Å; E2161-V2192 HydrophobicContact CB-CG1 4.16Å; E2161-V2192 HydrophobicContact CG-CG1 4.48Å; E2161-V2193 WeakPolarHBondContact CA-O 3.37Å; E2161-R2194 HydrophobicContact CG-CG 4.07Å; E2161-R2194 IonicContact OE1-CZ 3.35Å; E2161-R2194 IonicContact OE1-NE 2.73Å; E2161-R2194 PolarHBondContact OE1-NE 3.31Å; E2161-R2194 IonicContact OE1-NH2 3.09Å; E2161-R2194 PolarHBondContact OE1-NH2 2.69Å
2162	W	84.1	Confident	73.4	Confident	49 Å²	49	58.2 Å²	58.2	19%	0.186	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	120.2	178.1	177.5	49.5	0	0	0	109.4	T2098 I2164 P2165 F2179 V2193	T2098-W2162 HydrophobicContact CG2-CH2 3.92Å; T2098-W2162 HydrophobicContact CG2-CZ3 4.17Å; W2162-I2164 HydrophobicContact CD2-CG1 4.33Å; W2162-I2164 HydrophobicContact CE3-CG1 3.94Å; W2162-I2164 HydrophobicContact CH2-CG1 4.24Å; W2162-I2164 HydrophobicContact CH2-CG2 4.48Å; W2162-I2164 HydrophobicContact CZ3-CD1 4.47Å; W2162-I2164 HydrophobicContact CZ3-CG1 3.89Å; W2162-P2165 HydrophobicContact CZ2-CG 4.2Å; W2162-F2179 AromaticContact CH2-CE1 3.9Å; W2162-F2179 HydrophobicContact CH2-CE1 3.9Å; W2162-F2179 AromaticContact CZ2-CE1 3.83Å; W2162-F2179 HydrophobicContact CZ2-CE1 3.83Å; W2162-F2179 HydrophobicContact CZ2-CZ 4.48Å; W2162-V2193 HydrophobicContact CB-CG2 4.25Å; W2162-V2193 HydrophobicContact CD2-CG2 4.32Å; W2162-V2193 HydrophobicContact CE3-CG2 3.57Å; W2162-V2193 HydrophobicContact CZ3-CG2 4.34Å; W2162-V2193 PolarHBondContact N-O 3.29Å; W2162-V2193 WeakPolarHBondContact O-CG2 3.32Å; W2162-V2193 PolarHBondContact O-N 3.43Å
2163	R	86.4	Confident	71.7	Confident	178 Å²	178	60 Å²	60	67%	0.672	30%	0.303	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.4	112.1	168.6	-168.2	176.9	-160.1	-150.3	5.9	108.3	P2165 G2190 R2191 V2192	R2163-P2165 WeakPolarHBondContact O-CD 3.35Å; R2163-G2190 PolarHBondContact NE-O 3.44Å; R2163-R2191 WeakPolarHBondContact CA-O 3.39Å; R2163-V2192 HydrophobicContact CB-CG2 4.4Å; R2163-V2192 HydrophobicContact CG-CG2 4.21Å
2164	I	86.8	Confident	69.7	Low	3 Å²	3	69 Å²	69	2%	0.015	35%	0.345	C	S	.	.			trans	-59.4	120.2	-175.5	-61.7	178.9	0	0	0	109.1	T2098 W2162 F2179 F2188 G2190 R2191 V2193	T2098-I2164 HydrophobicContact CG2-CD1 4.08Å; T2098-I2164 HydrophobicContact CG2-CG2 3.88Å; W2162-I2164 HydrophobicContact CD2-CG1 4.33Å; W2162-I2164 HydrophobicContact CE3-CG1 3.94Å; W2162-I2164 HydrophobicContact CH2-CG1 4.24Å; W2162-I2164 HydrophobicContact CH2-CG2 4.48Å; W2162-I2164 HydrophobicContact CZ3-CD1 4.47Å; W2162-I2164 HydrophobicContact CZ3-CG1 3.89Å; I2164-F2179 HydrophobicContact CG2-CZ 3.83Å; I2164-F2188 HydrophobicContact CD1-CB 3.67Å; I2164-G2190 PolarHBondContact O-N 2.86Å; I2164-R2191 PolarHBondContact N-O 3.49Å; I2164-V2193 HydrophobicContact CD1-CG1 3.84Å; I2164-V2193 HydrophobicContact CD1-CG2 3.99Å; I2164-V2193 HydrophobicContact CG1-CG1 4.4Å; I2164-V2193 HydrophobicContact CG1-CG2 3.81Å
2165	P	74.7	Confident	67.7	Low	37 Å²	37	73 Å²	73	24%	0.24	37%	0.373	C	S	.	.			trans	-77.5	177.5	-179.1	33.3	-35.1	0	0	0	111.7	W2162 R2163 S2178 F2179	W2162-P2165 HydrophobicContact CZ2-CG 4.2Å; R2163-P2165 WeakPolarHBondContact O-CD 3.35Å; P2165-S2178 WeakPolarHBondContact CB-OG 3.25Å; P2165-S2178 WeakPolarHBondContact CG-OG 3.3Å; P2165-F2179 HydrophobicContact CG-CE1 3.88Å; P2165-F2179 HydrophobicContact CG-CE2 4.05Å; P2165-F2179 HydrophobicContact CG-CZ 3.61Å; P2165-F2179 WeakPolarHBondContact O-CE2 3.45Å; P2165-F2179 VanDerWaalsContact O-CZ 3.31Å; P2165-F2179 WeakPolarHBondContact O-CZ 3.36Å
2166	G	63.4	Low	65.8	Low	31 Å²	31	81.4 Å²	81.4	32%	0.32	41%	0.412	S	S	.	.	S	Bend	trans	126.7	159.7	177.3	0	0	0	0	0	113.5	A2168	G2166-A2168 PolarHBondContact O-N 3.41Å
2167	A	55.7	Low	64	Low	29 Å²	29	86.5 Å²	86.5	24%	0.24	45%	0.445	C	S	.	.			trans	-59.9	107.1	175.5	0	0	0	0	0	109.5	I2080 W2169	I2080-A2167 HydrophobicContact CD1-CB 4.19Å; A2167-W2169 PolarHBondContact O-N 3.4Å
2168	A	51.1	Low	63.2	Low	36 Å²	36	88.3 Å²	88.3	30%	0.298	46%	0.459	S	S	.	.			trans	-57.1	140.3	160.4	0	0	0	0	0	106.5	G2166 K2170 T2171	G2166-A2168 PolarHBondContact O-N 3.41Å; A2168-K2170 PolarHBondContact O-N 3.24Å; A2168-T2171 PolarHBondContact O-N 3.07Å; A2168-T2171 PolarHBondContact O-OG1 3.15Å
2169	W	53.7	Low	63.2	Low	141 Å²	141	88.8 Å²	88.8	53%	0.534	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54	-8.8	175.1	61	93.8	0	0	0	113.5	P2040 A2167	P2040-W2169 HydrophobicContact CG-CB 3.97Å; P2040-W2169 HydrophobicContact CG-CD2 3.69Å; P2040-W2169 HydrophobicContact CG-CE3 4.34Å; P2040-W2169 HydrophobicContact CG-CG 3.47Å; P2040-W2169 VanDerWaalsContact CG-CG 3.47Å; A2167-W2169 PolarHBondContact O-N 3.4Å
2170	K	49	Very low	63.6	Low	174 Å²	174	89.7 Å²	89.7	76%	0.757	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.7	-8.5	175	-65.8	-172.1	176.8	-179.2	0	115.8	A2168	A2168-K2170 PolarHBondContact O-N 3.24Å
2171	T	45.4	Very low	64	Low	76 Å²	76	89.3 Å²	89.3	47%	0.466	46%	0.455	S	S	.	.			trans	-126.6	117.3	-173.1	46.4	0	0	0	0	112.5	A2168 S2173	A2168-T2171 PolarHBondContact O-N 3.07Å; A2168-T2171 PolarHBondContact O-OG1 3.15Å; T2171-S2173 PolarHBondContact O-N 3.11Å
2172	K	43.4	Very low	64.2	Low	217 Å²	217	89.2 Å²	89.2	94%	0.943	45%	0.45	S	S	*	.			trans	-77.4	16.7	171.6	-81.5	-172.2	173.8	-177.1	0	114	E2174	K2172-E2174 PolarHBondContact O-N 3.13Å
2173	S	44.4	Very low	64.3	Low	73 Å²	73	87 Å²	87	51%	0.51	44%	0.442	S	S	.	.			trans	-73.4	111	-176.7	169.5	0	0	0	0	110.4	T2171 S2175	T2171-S2173 PolarHBondContact O-N 3.11Å; S2173-S2175 PolarHBondContact O-N 3.41Å; S2173-S2175 WeakPolarHBondContact OG-CB 3.4Å; S2173-S2175 PolarHBondContact OG-N 3.1Å; S2173-S2175 PolarHBondContact OG-OG 3.2Å
2174	E	44	Very low	64.2	Low	202 Å²	202	80.8 Å²	80.8	94%	0.944	42%	0.422	S	S	*	.			trans	-74.3	47.2	165.1	-68.3	-179.2	168.9	0	0	111	K2172	K2172-E2174 PolarHBondContact O-N 3.13Å
2175	S	44.8	Very low	64.2	Low	82 Å²	82	80.9 Å²	80.9	57%	0.573	42%	0.422	S	S	*	.			trans	-68	153.8	171.2	46.6	0	0	0	0	110.5	S2173	S2173-S2175 PolarHBondContact O-N 3.41Å; S2173-S2175 WeakPolarHBondContact OG-CB 3.4Å; S2173-S2175 PolarHBondContact OG-N 3.1Å; S2173-S2175 PolarHBondContact OG-OG 3.2Å
2176	E	47.4	Very low	64.9	Low	178 Å²	178	79.5 Å²	79.5	83%	0.832	41%	0.413	S	S	*	.			trans	-36.2	143.4	-171.9	-70.5	-179.4	162.7	0	0	115.6	S2178	E2176-S2178 PolarHBondContact O-N 3.24Å; E2176-S2178 VanDerWaalsContact O-N 3.15Å
2177	P	49.9	Very low	66.1	Low	107 Å²	107	78.6 Å²	78.6	70%	0.695	40%	0.401	S	S	*	.			trans	-55.2	122.2	177.9	23.4	-32.4	0	0	0	110.3
2178	S	69.7	Low	67.8	Low	51 Å²	51	77.4 Å²	77.4	36%	0.357	39%	0.391	S	S	.	.			trans	-99.9	-17.3	-175.7	68.5	0	0	0	0	113.6	P2165 E2176 N2184	P2165-S2178 WeakPolarHBondContact CB-OG 3.25Å; P2165-S2178 WeakPolarHBondContact CG-OG 3.3Å; E2176-S2178 PolarHBondContact O-N 3.24Å; E2176-S2178 VanDerWaalsContact O-N 3.15Å; S2178-N2184 PolarHBondContact N-OD1 3.03Å; S2178-N2184 VanDerWaalsContact N-OD1 3.13Å
2179	F	85.7	Confident	69.4	Low	18 Å²	18	76.5 Å²	76.5	8%	0.079	38%	0.383	C	S	.	.	S	Bend	trans	-124	155.7	-178.3	-66.2	-62.2	0	0	0	110.4	E2097 T2098 W2162 I2164 P2165 T2181	E2097-F2179 HydrophobicContact CB-CD1 4.06Å; E2097-F2179 HydrophobicContact CB-CE1 4.33Å; E2097-F2179 HydrophobicContact CG-CD1 4.48Å; E2097-F2179 WeakPolarHBondContact OE1-CB 2.99Å; E2097-F2179 WeakPolarHBondContact OE2-CD1 3.1Å; T2098-F2179 HydrophobicContact CG2-CE1 4.38Å; T2098-F2179 HydrophobicContact CG2-CZ 4.5Å; W2162-F2179 AromaticContact CH2-CE1 3.9Å; W2162-F2179 HydrophobicContact CH2-CE1 3.9Å; W2162-F2179 AromaticContact CZ2-CE1 3.83Å; W2162-F2179 HydrophobicContact CZ2-CE1 3.83Å; W2162-F2179 HydrophobicContact CZ2-CZ 4.48Å; I2164-F2179 HydrophobicContact CG2-CZ 3.83Å; P2165-F2179 HydrophobicContact CG-CE1 3.88Å; P2165-F2179 HydrophobicContact CG-CE2 4.05Å; P2165-F2179 HydrophobicContact CG-CZ 3.61Å; P2165-F2179 WeakPolarHBondContact O-CE2 3.45Å; P2165-F2179 VanDerWaalsContact O-CZ 3.31Å; P2165-F2179 WeakPolarHBondContact O-CZ 3.36Å; F2179-T2181 HydrophobicContact CB-CG2 3.67Å; F2179-T2181 HydrophobicContact CG-CG2 4.35Å
2180	F	89.1	Confident	70.6	Confident	65 Å²	65	71.4 Å²	71.4	29%	0.285	38%	0.375	S	S	.	.	S	Bend	trans	-76.5	-27.7	172.1	-72.5	-79.5	0	0	0	112.6	S1875 K1878 A1879 A1882 E2097 R2182 F2208 G2211 V2213	S1875-F2180 WeakPolarHBondContact CB-O 3.12Å; K1878-F2180 HydrophobicContact CB-CB 3.85Å; K1878-F2180 HydrophobicContact CB-CD1 3.74Å; K1878-F2180 HydrophobicContact CB-CE1 4.48Å; K1878-F2180 HydrophobicContact CB-CG 3.86Å; K1878-F2180 HydrophobicContact CD-CD1 4.06Å; K1878-F2180 HydrophobicContact CD-CE1 4.41Å; K1878-F2180 HydrophobicContact CG-CD1 4.45Å; A1879-F2180 HydrophobicContact CB-CB 4.05Å; A1882-F2180 HydrophobicContact CB-CD2 3.57Å; A1882-F2180 HydrophobicContact CB-CE2 3.75Å; E2097-F2180 PolarHBondContact OE1-N 2.72Å; E2097-F2180 PolarHBondContact OE2-N 3.42Å; F2180-R2182 PolarHBondContact O-N 3.03Å; F2180-F2208 HydrophobicContact CE2-CE2 4.11Å; F2180-G2211 WeakPolarHBondContact CZ-O 3.13Å; F2180-V2213 HydrophobicContact CE1-CG2 4.08Å; F2180-V2213 HydrophobicContact CE2-CG2 4.38Å; F2180-V2213 HydrophobicContact CZ-CG2 3.94Å
2181	T	90.2	Very high	72.5	Confident	7 Å²	7	67 Å²	67	4%	0.043	35%	0.354	C	S	.	.	S	Bend	trans	-61.2	133.2	171.3	173.4	0	0	0	0	111	E1871 P2094 E2097 F2179 A2183 N2184	E1871-T2181 WeakPolarHBondContact OE2-CA 3.23Å; E1871-T2181 WeakPolarHBondContact OE2-CB 3.28Å; E1871-T2181 PolarHBondContact OE2-OG1 3.1Å; P2094-T2181 HydrophobicContact CB-CG2 4.47Å; E2097-T2181 PolarHBondContact OE1-N 2.81Å; E2097-T2181 VanDerWaalsContact OE1-N 3.14Å; F2179-T2181 HydrophobicContact CB-CG2 3.67Å; F2179-T2181 HydrophobicContact CG-CG2 4.35Å; T2181-A2183 HydrophobicContact CG2-CB 4.49Å; T2181-A2183 PolarHBondContact O-N 2.61Å; T2181-A2183 WeakPolarHBondContact OG1-CB 3.48Å; T2181-A2183 PolarHBondContact OG1-N 3.38Å; T2181-N2184 PolarHBondContact O-N 2.91Å; T2181-N2184 VanDerWaalsContact O-N 3.07Å
2182	R	89.6	Confident	74.5	Confident	120 Å²	120	67.3 Å²	67.3	45%	0.453	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-19.1	176.7	-69.2	-178.6	-179.8	-149.6	-8	112.8	E1868 K1870 E1871 D1872 F2180 N2184	E1868-R2182 PolarHBondContact O-NH1 3.15Å; K1870-R2182 WeakPolarHBondContact O-CB 3.29Å; E1871-R2182 WeakPolarHBondContact OE1-CB 3.25Å; E1871-R2182 WeakPolarHBondContact OE1-CG 3.41Å; E1871-R2182 PolarHBondContact OE1-N 2.83Å; D1872-R2182 IonicContact OD1-NE 3.86Å; D1872-R2182 IonicContact OD1-NH2 3Å; D1872-R2182 IonicContact OD2-CZ 3.31Å; D1872-R2182 IonicContact OD2-NE 3.59Å; D1872-R2182 IonicContact OD2-NH2 3.96Å; D1872-R2182 PolarHBondContact OD2-NH2 3.46Å; F2180-R2182 PolarHBondContact O-N 3.03Å; R2182-N2184 PolarHBondContact O-N 3.08Å
2183	A	86.3	Confident	76.8	Confident	3 Å²	3	57.2 Å²	57.2	3%	0.025	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-39.8	171.9	0	0	0	0	0	110.9	P2077 P2094 T2181 W2185	P2077-A2183 HydrophobicContact CB-CB 4.05Å; P2094-A2183 HydrophobicContact CB-CB 4.19Å; P2094-A2183 HydrophobicContact CG-CB 4.13Å; T2181-A2183 HydrophobicContact CG2-CB 4.49Å; T2181-A2183 PolarHBondContact O-N 2.61Å; T2181-A2183 WeakPolarHBondContact OG1-CB 3.48Å; T2181-A2183 PolarHBondContact OG1-N 3.38Å; A2183-W2185 VanDerWaalsContact O-CD1 3.25Å; A2183-W2185 PolarHBondContact O-N 2.92Å
2184	N	84.2	Confident	78.9	Confident	46 Å²	46	56.8 Å²	56.8	25%	0.246	30%	0.299	C	S	.	.			trans	52.5	34.3	178.8	-163.9	33.7	0	0	0	114.6	S2178 T2181 R2182	S2178-N2184 PolarHBondContact N-OD1 3.03Å; S2178-N2184 VanDerWaalsContact N-OD1 3.13Å; T2181-N2184 PolarHBondContact O-N 2.91Å; T2181-N2184 VanDerWaalsContact O-N 3.07Å; R2182-N2184 PolarHBondContact O-N 3.08Å
2185	W	86.9	Confident	80.9	Confident	6 Å²	6	47.1 Å²	47.1	2%	0.023	25%	0.254	C	S	.	.			trans	-147.7	164.6	170.5	72.7	-84.6	0	0	0	109.9	W2045 H2078 I2080 K2083 F2093 P2094 A2183 P2187	W2045-W2185 HydrophobicContact CE3-CD2 4.46Å; W2045-W2185 AromaticContact CE3-CE3 3.94Å; W2045-W2185 HydrophobicContact CE3-CE3 3.94Å; W2045-W2185 AromaticContact CE3-CH2 3.95Å; W2045-W2185 HydrophobicContact CE3-CH2 3.95Å; W2045-W2185 AromaticContact CE3-CZ3 3.65Å; W2045-W2185 HydrophobicContact CE3-CZ3 3.65Å; W2045-W2185 AromaticContact CZ3-CD2 3.69Å; W2045-W2185 HydrophobicContact CZ3-CD2 3.69Å; W2045-W2185 AromaticContact CZ3-CE3 3.51Å; W2045-W2185 HydrophobicContact CZ3-CE3 3.51Å; W2045-W2185 HydrophobicContact CZ3-CG 4.26Å; W2045-W2185 HydrophobicContact CZ3-CH2 4.09Å; W2045-W2185 HydrophobicContact CZ3-CZ2 4.32Å; W2045-W2185 AromaticContact CZ3-CZ3 3.71Å; W2045-W2185 HydrophobicContact CZ3-CZ3 3.71Å; H2078-W2185 PolarHBondContact O-NE1 2.62Å; I2080-W2185 HydrophobicContact CD1-CB 4.25Å; I2080-W2185 HydrophobicContact CG1-CB 4.02Å; I2080-W2185 HydrophobicContact CG1-CG 4.07Å; K2083-W2185 HydrophobicContact CB-CZ2 4.31Å; K2083-W2185 HydrophobicContact CD-CH2 4.46Å; K2083-W2185 HydrophobicContact CD-CZ2 4.02Å; K2083-W2185 VanDerWaalsContact CE-CH2 3.5Å; K2083-W2185 HydrophobicContact CG-CH2 4.35Å; K2083-W2185 HydrophobicContact CG-CZ2 3.62Å; F2093-W2185 AromaticContact CD1-CH2 3.51Å; F2093-W2185 HydrophobicContact CD1-CH2 3.51Å; F2093-W2185 HydrophobicContact CD1-CZ2 4.25Å; F2093-W2185 HydrophobicContact CD1-CZ3 4.32Å; F2093-W2185 AromaticContact CE1-CH2 3.89Å; F2093-W2185 HydrophobicContact CE1-CH2 3.89Å; P2094-W2185 HydrophobicContact CG-CD2 4.31Å; P2094-W2185 HydrophobicContact CG-CZ2 4.41Å; P2094-W2185 WeakPolarHBondContact CG-O 3.23Å; A2183-W2185 VanDerWaalsContact O-CD1 3.25Å; A2183-W2185 PolarHBondContact O-N 2.92Å; W2185-P2187 HydrophobicContact CZ3-CB 4.2Å
2186	S	88.8	Confident	83	Confident	7 Å²	7	46.5 Å²	46.5	5%	0.049	24%	0.242	C	C	.	.			trans	-140.2	141.8	175.1	176.9	0	0	0	0	110.1	F2188 A2189	S2186-F2188 PolarHBondContact O-N 3.4Å; S2186-F2188 PolarHBondContact OG-N 3.46Å; S2186-A2189 WeakPolarHBondContact O-CB 3.46Å; S2186-A2189 PolarHBondContact O-N 2.92Å
2187	P	89.1	Confident	85	Confident	12 Å²	12	38.6 Å²	38.6	8%	0.078	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-11.3	172.5	31.5	-37.6	0	0	0	112.6	L2034 L2039 F2093 W2185	L2034-P2187 HydrophobicContact CD1-CB 3.84Å; L2034-P2187 HydrophobicContact CD1-CG 4.25Å; L2039-P2187 HydrophobicContact CD1-CB 4.32Å; L2039-P2187 HydrophobicContact CD2-CB 4.25Å; F2093-P2187 HydrophobicContact CB-CG 4.06Å; F2093-P2187 HydrophobicContact CD1-CB 4.39Å; F2093-P2187 HydrophobicContact CD1-CG 4.45Å; F2093-P2187 HydrophobicContact CD2-CB 4.36Å; F2093-P2187 HydrophobicContact CD2-CG 4.15Å; F2093-P2187 HydrophobicContact CG-CB 4.3Å; F2093-P2187 HydrophobicContact CG-CG 3.98Å; W2185-P2187 HydrophobicContact CZ3-CB 4.2Å
2188	F	90.2	Very high	86.7	Confident	4 Å²	4	35.7 Å²	35.7	2%	0.018	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.1	8.5	177.9	-53.7	-76.4	0	0	0	113.5	H2030 F2033 L2034 L2102 I2164 S2186 G2190 R2191	H2030-F2188 HydrophobicContact CB-CZ 4.03Å; F2033-F2188 HydrophobicContact CB-CE1 3.84Å; L2034-F2188 HydrophobicContact CD1-CD1 4.24Å; L2034-F2188 HydrophobicContact CD1-CE1 3.72Å; L2034-F2188 HydrophobicContact CD1-CZ 3.99Å; L2034-F2188 HydrophobicContact CD2-CD1 3.87Å; L2034-F2188 HydrophobicContact CD2-CE1 3.71Å; L2034-F2188 HydrophobicContact CG-CD1 4.15Å; L2034-F2188 HydrophobicContact CG-CE1 3.52Å; L2034-F2188 HydrophobicContact CG-CZ 4.14Å; L2102-F2188 HydrophobicContact CD1-CD1 4.1Å; L2102-F2188 HydrophobicContact CD1-CD2 3.66Å; L2102-F2188 HydrophobicContact CD1-CE1 3.91Å; L2102-F2188 HydrophobicContact CD1-CE2 3.47Å; L2102-F2188 VanDerWaalsContact CD1-CE2 3.47Å; L2102-F2188 HydrophobicContact CD1-CG 3.96Å; L2102-F2188 HydrophobicContact CD1-CZ 3.58Å; L2102-F2188 HydrophobicContact CD2-CD1 4.14Å; L2102-F2188 HydrophobicContact CD2-CE1 4.35Å; L2102-F2188 HydrophobicContact CD2-CG 4.39Å; I2164-F2188 HydrophobicContact CD1-CB 3.67Å; S2186-F2188 PolarHBondContact O-N 3.4Å; S2186-F2188 PolarHBondContact OG-N 3.46Å; F2188-G2190 PolarHBondContact O-N 2.92Å; F2188-R2191 WeakPolarHBondContact O-CB 3.39Å; F2188-R2191 PolarHBondContact O-N 3.19Å
2189	A	85.1	Confident	87.6	Confident	17 Å²	17	33.6 Å²	33.6	14%	0.14	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.2	131.4	-177.6	0	0	0	0	0	111.9	S2186 R2191	S2186-A2189 WeakPolarHBondContact O-CB 3.46Å; S2186-A2189 PolarHBondContact O-N 2.92Å; A2189-R2191 VanDerWaalsContact C-N 3.34Å; A2189-R2191 PolarHBondContact O-N 2.84Å
2190	G	80.4	Confident	87.8	Confident	35 Å²	35	32.7 Å²	32.7	36%	0.361	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	86.7	-13	-179	0	0	0	0	0	115.8	R2163 I2164 F2188	R2163-G2190 PolarHBondContact NE-O 3.44Å; I2164-G2190 PolarHBondContact O-N 2.86Å; F2188-G2190 PolarHBondContact O-N 2.92Å
2191	R	87.2	Confident	87.6	Confident	82 Å²	82	30.4 Å²	30.4	31%	0.309	15%	0.151	S	C	.	.			trans	-68.7	143.3	170.2	-68.7	-169.6	174.5	-169.7	-3.1	110.2	F2033 D2038 R2163 I2164 F2188 A2189	F2033-R2191 PolarHBondContact O-NH1 2.59Å; F2033-R2191 PolarHBondContact O-NH2 3.31Å; D2038-R2191 IonicContact OD1-NH2 3.75Å; D2038-R2191 PolarHBondContact OD1-NH2 2.75Å; R2163-R2191 WeakPolarHBondContact CA-O 3.39Å; I2164-R2191 PolarHBondContact N-O 3.49Å; F2188-R2191 WeakPolarHBondContact O-CB 3.39Å; F2188-R2191 PolarHBondContact O-N 3.19Å; A2189-R2191 VanDerWaalsContact C-N 3.34Å; A2189-R2191 PolarHBondContact O-N 2.84Å
2192	V	89.3	Confident	87.5	Confident	81 Å²	81	30.1 Å²	30.1	49%	0.491	15%	0.149	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	122.4	172.2	-178.3	0	0	0	0	107.6	E2161 R2163	E2161-V2192 HydrophobicContact CB-CG1 4.16Å; E2161-V2192 HydrophobicContact CG-CG1 4.48Å; R2163-V2192 HydrophobicContact CB-CG2 4.4Å; R2163-V2192 HydrophobicContact CG-CG2 4.21Å
2193	V	91.3	Very high	87.1	Confident	5 Å²	5	26.9 Å²	26.9	3%	0.03	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	161.5	178.3	-65	0	0	0	0	110	L2102 T2105 E2161 W2162 I2164	L2102-V2193 HydrophobicContact CD2-CG1 3.75Å; L2102-V2193 HydrophobicContact CG-CG1 4.35Å; T2105-V2193 WeakPolarHBondContact OG1-CA 3.27Å; T2105-V2193 WeakPolarHBondContact OG1-CB 3.44Å; E2161-V2193 WeakPolarHBondContact CA-O 3.37Å; W2162-V2193 HydrophobicContact CB-CG2 4.25Å; W2162-V2193 HydrophobicContact CD2-CG2 4.32Å; W2162-V2193 HydrophobicContact CE3-CG2 3.57Å; W2162-V2193 HydrophobicContact CZ3-CG2 4.34Å; W2162-V2193 PolarHBondContact N-O 3.29Å; W2162-V2193 WeakPolarHBondContact O-CG2 3.32Å; W2162-V2193 PolarHBondContact O-N 3.43Å; I2164-V2193 HydrophobicContact CD1-CG1 3.84Å; I2164-V2193 HydrophobicContact CD1-CG2 3.99Å; I2164-V2193 HydrophobicContact CG1-CG1 4.4Å; I2164-V2193 HydrophobicContact CG1-CG2 3.81Å
2194	R	88.1	Confident	86.4	Confident	64 Å²	64	27.2 Å²	27.2	24%	0.242	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	148.9	176.2	-74.6	-178.2	169	-111.6	-2.1	111	T2105 E2161	T2105-R2194 PolarHBondContact OG1-N 3.35Å; T2105-R2194 PolarHBondContact OG1-O 3.5Å; E2161-R2194 HydrophobicContact CG-CG 4.07Å; E2161-R2194 IonicContact OE1-CZ 3.35Å; E2161-R2194 IonicContact OE1-NE 2.73Å; E2161-R2194 PolarHBondContact OE1-NE 3.31Å; E2161-R2194 IonicContact OE1-NH2 3.09Å; E2161-R2194 PolarHBondContact OE1-NH2 2.69Å
2195	G	85.9	Confident	86.2	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	93.6	96	-176.8	0	0	0	0	0	110.9	S2101 D2157 A2160	S2101-G2195 VanDerWaalsContact CB-O 3.24Å; S2101-G2195 WeakPolarHBondContact CB-O 3.06Å; S2101-G2195 PolarHBondContact OG-O 2.88Å; D2157-G2195 CarbonylContact O-C 3.48Å; D2157-G2195 WeakPolarHBondContact O-CA 3.16Å; A2160-G2195 PolarHBondContact O-N 3.1Å
2196	Q	88	Confident	85.9	Confident	69 Å²	69	31.1 Å²	31.1	32%	0.322	16%	0.159	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	128.2	175.7	-169.9	179.9	32	0	0	110.7	V2156 D2157 A2160 R2198	V2156-Q2196 WeakPolarHBondContact CA-O 3.18Å; D2157-Q2196 PolarHBondContact N-O 2.8Å; D2157-Q2196 PolarHBondContact O-N 3Å; A2160-Q2196 HydrophobicContact CB-CB 3.77Å; Q2196-R2198 PolarHBondContact O-N 3Å
2197	V	90.2	Very high	85.9	Confident	11 Å²	11	30.8 Å²	30.8	7%	0.067	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	120.5	174.6	179.4	0	0	0	0	108.9	A1882 L2100 V2154 V2156 V2200 F2208	A1882-V2197 WeakPolarHBondContact O-CB 3.48Å; L2100-V2197 HydrophobicContact CD2-CG2 3.73Å; V2154-V2197 HydrophobicContact CG1-CG1 3.95Å; V2154-V2197 HydrophobicContact CG1-CG2 4.38Å; V2156-V2197 HydrophobicContact CG2-CG2 4.36Å; V2197-V2200 HydrophobicContact CG1-CG2 3.94Å; V2197-F2208 HydrophobicContact CB-CE1 4.47Å; V2197-F2208 HydrophobicContact CG1-CD1 4.06Å; V2197-F2208 HydrophobicContact CG1-CE1 3.96Å
2198	R	86.3	Confident	85.9	Confident	46 Å²	46	30.6 Å²	30.6	17%	0.174	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	-43.7	178	-59.8	-53.7	-59.7	-135.3	-5.8	111.1	E2155 D2157 Q2196 V2209 D2210	E2155-R2198 HydrophobicContact CG-CB 4.38Å; E2155-R2198 PolarHBondContact O-N 3.1Å; D2157-R2198 HydrophobicContact CB-CG 3.78Å; Q2196-R2198 PolarHBondContact O-N 3Å; R2198-V2209 CarbonylContact O-C 3.44Å; R2198-V2209 WeakPolarHBondContact O-CA 3.45Å; R2198-D2210 IonicContact CZ-OD1 3.64Å; R2198-D2210 IonicContact NE-OD1 3.72Å; R2198-D2210 PolarHBondContact NE-OD1 3.21Å; R2198-D2210 IonicContact NH2-OD1 2.78Å; R2198-D2210 PolarHBondContact NH2-OD1 2.97Å; R2198-D2210 IonicContact NH2-OD2 2.82Å; R2198-D2210 PolarHBondContact O-N 2.96Å
2199	R	87.3	Confident	85.7	Confident	7 Å²	7	30.6 Å²	30.6	3%	0.026	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	148.4	-176.4	-63.4	-174.7	-78.2	-167.5	-3.6	112.8	K690 A707 E708 W2153 V2154 E2155 L2206 F2208 V2209	K690-R2199 VanDerWaalsContact NZ-NH2 3.17Å; A707-R2199 PolarHBondContact O-NH1 3.22Å; E708-R2199 IonicContact OE1-CZ 2.78Å; E708-R2199 IonicContact OE1-NH1 3.38Å; E708-R2199 PolarHBondContact OE1-NH1 3.47Å; E708-R2199 IonicContact OE1-NH2 2.94Å; E708-R2199 PolarHBondContact OE1-NH2 3.43Å; E708-R2199 VanDerWaalsContact OE1-NH2 3.15Å; E708-R2199 IonicContact OE2-NH1 3.87Å; W2153-R2199 HydrophobicContact CZ3-CB 4.25Å; V2154-R2199 WeakPolarHBondContact CA-O 3.4Å; E2155-R2199 HydrophobicContact CB-CB 4.07Å; E2155-R2199 VanDerWaalsContact CD-NE 3.31Å; E2155-R2199 PolarHBondContact N-O 2.93Å; E2155-R2199 PolarHBondContact O-N 3.03Å; E2155-R2199 IonicContact OE1-CZ 2.83Å; E2155-R2199 IonicContact OE1-NE 3.88Å; E2155-R2199 PolarHBondContact OE1-NE 3.01Å; E2155-R2199 IonicContact OE1-NH2 2.77Å; E2155-R2199 PolarHBondContact OE1-NH2 3.19Å; E2155-R2199 IonicContact OE2-CZ 3.32Å; E2155-R2199 VanDerWaalsContact OE2-CZ 3.3Å; E2155-R2199 IonicContact OE2-NE 3.72Å; E2155-R2199 PolarHBondContact OE2-NE 2.82Å; E2155-R2199 IonicContact OE2-NH2 2.8Å; E2155-R2199 PolarHBondContact OE2-NH2 3.37Å; R2199-L2206 HydrophobicContact CB-CD1 4.22Å; R2199-L2206 HydrophobicContact CG-CD1 4.38Å; R2199-F2208 VanDerWaalsContact CA-O 3.26Å; R2199-F2208 WeakPolarHBondContact CA-O 3.21Å; R2199-V2209 HydrophobicContact CG-CB 4.31Å; R2199-V2209 HydrophobicContact CG-CG2 3.99Å
2200	V	89.7	Confident	85.4	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	120.1	169.1	-178.9	0	0	0	0	109.2	L1881 V1886 V2154 V2197 A2207 F2208	L1881-V2200 HydrophobicContact CD2-CB 4.43Å; L1881-V2200 HydrophobicContact CD2-CG1 3.83Å; L1881-V2200 VanDerWaalsContact O-CG2 3.26Å; L1881-V2200 WeakPolarHBondContact O-CG2 3.25Å; V1886-V2200 HydrophobicContact CG1-CG1 3.51Å; V2154-V2200 HydrophobicContact CG1-CG2 4.27Å; V2154-V2200 HydrophobicContact CG2-CG1 4.44Å; V2154-V2200 HydrophobicContact CG2-CG2 4.33Å; V2197-V2200 HydrophobicContact CG1-CG2 3.94Å; V2200-A2207 PolarHBondContact O-N 3.02Å; V2200-F2208 HydrophobicContact CB-CB 3.91Å; V2200-F2208 HydrophobicContact CG2-CB 4.02Å; V2200-F2208 HydrophobicContact CG2-CD1 4.31Å; V2200-F2208 PolarHBondContact N-O 2.94Å; V2200-F2208 PolarHBondContact O-N 3.23Å
2201	M	86.3	Confident	85.3	Confident	17 Å²	17	32.9 Å²	32.9	8%	0.084	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	125	167.6	-166.4	63.5	60.2	0	0	108.3	E2151 T2152 W2153 H2205 L2206	E2151-M2201 VanDerWaalsContact O-CG 3.3Å; E2151-M2201 WeakPolarHBondContact O-CG 3.4Å; T2152-M2201 CarbonylContact C-O 3.6Å; T2152-M2201 VanDerWaalsContact CA-O 3.25Å; T2152-M2201 WeakPolarHBondContact CA-O 3.27Å; T2152-M2201 WeakPolarHBondContact CG2-O 3.4Å; W2153-M2201 HydrophobicContact CD2-CB 3.63Å; W2153-M2201 VanDerWaalsContact CE2-CB 3.42Å; W2153-M2201 HydrophobicContact CE3-CB 4.17Å; W2153-M2201 HydrophobicContact CG-CB 3.97Å; W2153-M2201 HydrophobicContact CH2-CB 4.33Å; W2153-M2201 HydrophobicContact CH2-CE 4.19Å; W2153-M2201 HydrophobicContact CZ2-CB 3.82Å; W2153-M2201 HydrophobicContact CZ2-CE 3.71Å; W2153-M2201 HydrophobicContact CZ2-CG 4.22Å; W2153-M2201 HydrophobicContact CZ3-CB 4.48Å; W2153-M2201 PolarHBondContact N-O 2.74Å; W2153-M2201 PolarHBondContact O-N 3.47Å; M2201-H2205 PolarHBondContact SD-N 2.86Å; M2201-H2205 VanDerWaalsContact SD-O 3.37Å; M2201-L2206 HydrophobicContact CE-CB 4.12Å; M2201-L2206 HydrophobicContact CE-CD1 4.18Å; M2201-L2206 HydrophobicContact SD-CB 4.46Å; M2201-L2206 PolarHBondContact SD-N 2.7Å; M2201-L2206 VanDerWaalsContact SD-N 3.4Å
2202	L	87.6	Confident	85.2	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	110.8	179.4	178.5	56.5	0	0	0	109.5	V1886 C1917 T2152 G2204 H2205 A2207 F2219	V1886-L2202 HydrophobicContact CB-CD1 4.14Å; C1917-L2202 HydrophobicContact CB-CD2 4.4Å; T2152-L2202 HydrophobicContact CG2-CD1 4.03Å; L2202-G2204 VanDerWaalsContact C-N 3.25Å; L2202-G2204 PolarHBondContact O-N 3.36Å; L2202-H2205 PolarHBondContact N-O 3.29Å; L2202-H2205 WeakPolarHBondContact O-CB 3.48Å; L2202-H2205 PolarHBondContact O-N 2.77Å; L2202-A2207 HydrophobicContact CB-CB 3.96Å; L2202-F2219 HydrophobicContact CB-CE1 4.5Å; L2202-F2219 HydrophobicContact CD2-CD1 4.14Å; L2202-F2219 HydrophobicContact CD2-CE1 3.98Å; L2202-F2219 HydrophobicContact CG-CE1 4.11Å
2203	R	81.5	Confident	85.1	Confident	52 Å²	52	33.2 Å²	33.2	20%	0.196	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.8	47.3	-178.1	-54.7	-176.2	-55.9	-80.6	6.4	112.1	D1918 E2151 T2152 H2205 F2219	D1918-R2203 IonicContact OD1-CZ 3.65Å; D1918-R2203 IonicContact OD1-NH1 3.28Å; D1918-R2203 PolarHBondContact OD1-NH1 2.81Å; D1918-R2203 IonicContact OD1-NH2 2.8Å; D1918-R2203 IonicContact OD2-CZ 2.69Å; D1918-R2203 IonicContact OD2-NH1 3.95Å; D1918-R2203 PolarHBondContact OD2-NH1 3.41Å; E2151-R2203 PolarHBondContact O-N 2.89Å; T2152-R2203 PolarHBondContact OG1-N 2.85Å; R2203-H2205 PolarHBondContact O-N 3.16Å; R2203-H2205 PolarHBondContact O-ND1 3.4Å; R2203-F2219 PolarHBondContact NH2-O 3.27Å
2204	G	70.5	Confident	84.8	Confident	10 Å²	10	36.1 Å²	36.1	10%	0.103	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.6	1.3	-179.5	0	0	0	0	0	115.3	H1836 E2151 L2202	H1836-G2204 PolarHBondContact CE1-O 3.17Å; H1836-G2204 PolarHBondContact ND1-O 2.63Å; E2151-G2204 PolarHBondContact O-N 3.13Å; L2202-G2204 VanDerWaalsContact C-N 3.25Å; L2202-G2204 PolarHBondContact O-N 3.36Å
2205	H	80.1	Confident	84.8	Confident	103 Å²	103	33.8 Å²	33.8	48%	0.477	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	131.4	177.6	-62.2	70.8	0	0	0	111	M2201 L2202 R2203 A2207 F2219	M2201-H2205 PolarHBondContact SD-N 2.86Å; M2201-H2205 VanDerWaalsContact SD-O 3.37Å; L2202-H2205 PolarHBondContact N-O 3.29Å; L2202-H2205 WeakPolarHBondContact O-CB 3.48Å; L2202-H2205 PolarHBondContact O-N 2.77Å; R2203-H2205 PolarHBondContact O-N 3.16Å; R2203-H2205 PolarHBondContact O-ND1 3.4Å; H2205-A2207 PolarHBondContact O-N 2.95Å; H2205-F2219 HydrophobicContact CB-CE1 4.29Å; H2205-F2219 HydrophobicContact CB-CE2 4.31Å; H2205-F2219 HydrophobicContact CB-CZ 3.6Å; H2205-F2219 AromaticContact CG-CE2 3.98Å; H2205-F2219 AromaticContact CG-CZ 3.54Å; H2205-F2219 AromaticContact ND1-CZ 3.78Å
2206	L	82	Confident	84.9	Confident	32 Å²	32	40.8 Å²	40.8	17%	0.168	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	99.5	175.6	-178.4	65.3	0	0	0	108.9	R2199 M2201 F2208 V2209 L2214	R2199-L2206 HydrophobicContact CB-CD1 4.22Å; R2199-L2206 HydrophobicContact CG-CD1 4.38Å; M2201-L2206 HydrophobicContact CE-CB 4.12Å; M2201-L2206 HydrophobicContact CE-CD1 4.18Å; M2201-L2206 HydrophobicContact SD-CB 4.46Å; M2201-L2206 PolarHBondContact SD-N 2.7Å; M2201-L2206 VanDerWaalsContact SD-N 3.4Å; L2206-F2208 WeakPolarHBondContact CD1-O 3.41Å; L2206-V2209 HydrophobicContact CD2-CB 4.31Å; L2206-V2209 HydrophobicContact CD2-CG1 4.38Å; L2206-L2214 HydrophobicContact CD2-CD1 3.94Å; L2206-L2214 HydrophobicContact CG-CD1 4.1Å
2207	A	87.9	Confident	85.1	Confident	0 Å²	0	40 Å²	40	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	-32.8	-173.8	0	0	0	0	0	112.7	L1881 V2200 L2202 H2205 V2213 L2214 V2215	L1881-A2207 HydrophobicContact CD1-CB 4.02Å; L1881-A2207 HydrophobicContact CD2-CB 4.04Å; V2200-A2207 PolarHBondContact O-N 3.02Å; L2202-A2207 HydrophobicContact CB-CB 3.96Å; H2205-A2207 PolarHBondContact O-N 2.95Å; A2207-V2213 WeakPolarHBondContact O-CA 3.46Å; A2207-L2214 PolarHBondContact O-N 3.03Å; A2207-V2215 HydrophobicContact CB-CG1 3.99Å; A2207-V2215 HydrophobicContact CB-CG2 3.98Å
2208	F	90	Very high	85.1	Confident	7 Å²	7	40.8 Å²	40.8	3%	0.031	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	139.8	-179.9	177.6	-93.9	0	0	0	111.1	L1881 A1882 F2180 V2197 R2199 V2200 L2206 G2211 R2212 V2213	L1881-F2208 HydrophobicContact CB-CB 4.24Å; A1882-F2208 HydrophobicContact CB-CD2 4.34Å; A1882-F2208 HydrophobicContact CB-CE2 3.69Å; A1882-F2208 HydrophobicContact CB-CZ 4.05Å; F2180-F2208 HydrophobicContact CE2-CE2 4.11Å; V2197-F2208 HydrophobicContact CB-CE1 4.47Å; V2197-F2208 HydrophobicContact CG1-CD1 4.06Å; V2197-F2208 HydrophobicContact CG1-CE1 3.96Å; R2199-F2208 VanDerWaalsContact CA-O 3.26Å; R2199-F2208 WeakPolarHBondContact CA-O 3.21Å; V2200-F2208 HydrophobicContact CB-CB 3.91Å; V2200-F2208 HydrophobicContact CG2-CB 4.02Å; V2200-F2208 HydrophobicContact CG2-CD1 4.31Å; V2200-F2208 PolarHBondContact N-O 2.94Å; V2200-F2208 PolarHBondContact O-N 3.23Å; L2206-F2208 WeakPolarHBondContact CD1-O 3.41Å; F2208-G2211 VanDerWaalsContact CZ-CA 3.45Å; F2208-G2211 VanDerWaalsContact CZ-N 3.26Å; F2208-R2212 WeakPolarHBondContact CA-O 3.38Å; F2208-R2212 WeakPolarHBondContact CD2-O 3.46Å; F2208-V2213 HydrophobicContact CD2-CG2 3.88Å
2209	V	85.6	Confident	85.4	Confident	5 Å²	5	41.1 Å²	41.1	3%	0.03	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149	125	171.8	60.7	0	0	0	0	110.9	R709 R2198 R2199 L2206 G2211 R2212 L2214	R709-V2209 HydrophobicContact CG-CG1 4.04Å; R2198-V2209 CarbonylContact O-C 3.44Å; R2198-V2209 WeakPolarHBondContact O-CA 3.45Å; R2199-V2209 HydrophobicContact CG-CB 4.31Å; R2199-V2209 HydrophobicContact CG-CG2 3.99Å; L2206-V2209 HydrophobicContact CD2-CB 4.31Å; L2206-V2209 HydrophobicContact CD2-CG1 4.38Å; V2209-G2211 VanDerWaalsContact C-N 3.33Å; V2209-G2211 PolarHBondContact O-N 2.88Å; V2209-G2211 VanDerWaalsContact O-N 3.17Å; V2209-R2212 PolarHBondContact N-O 3.22Å; V2209-R2212 WeakPolarHBondContact O-CB 3.4Å; V2209-R2212 PolarHBondContact O-N 3.4Å; V2209-L2214 HydrophobicContact CG1-CD1 3.77Å; V2209-L2214 HydrophobicContact CG1-CD2 4.4Å; V2209-L2214 HydrophobicContact CG1-CG 4.12Å
2210	D	77.6	Confident	85.6	Confident	54 Å²	54	41.1 Å²	41.1	29%	0.289	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	45.4	49.1	171.7	-59.6	-39.4	0	0	0	114.8	K636 R2198	K636-D2210 IonicContact NZ-OD2 3.19Å; K636-D2210 PolarHBondContact NZ-OD2 3.09Å; R2198-D2210 IonicContact CZ-OD1 3.64Å; R2198-D2210 IonicContact NE-OD1 3.72Å; R2198-D2210 PolarHBondContact NE-OD1 3.21Å; R2198-D2210 IonicContact NH2-OD1 2.78Å; R2198-D2210 PolarHBondContact NH2-OD1 2.97Å; R2198-D2210 IonicContact NH2-OD2 2.82Å; R2198-D2210 PolarHBondContact O-N 2.96Å
2211	G	78.4	Confident	85.6	Confident	45 Å²	45	47.3 Å²	47.3	46%	0.464	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	83.6	6.3	178.3	0	0	0	0	0	114.9	F2180 F2208 V2209	F2180-G2211 WeakPolarHBondContact CZ-O 3.13Å; F2208-G2211 VanDerWaalsContact CZ-CA 3.45Å; F2208-G2211 VanDerWaalsContact CZ-N 3.26Å; V2209-G2211 VanDerWaalsContact C-N 3.33Å; V2209-G2211 PolarHBondContact O-N 2.88Å; V2209-G2211 VanDerWaalsContact O-N 3.17Å
2212	R	85	Confident	85.7	Confident	143 Å²	143	47.5 Å²	47.5	54%	0.54	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	129.7	176	-59.6	-179.4	-178.2	168.3	2.6	110.6	F2208 V2209 L2214	F2208-R2212 WeakPolarHBondContact CA-O 3.38Å; F2208-R2212 WeakPolarHBondContact CD2-O 3.46Å; V2209-R2212 PolarHBondContact N-O 3.22Å; V2209-R2212 WeakPolarHBondContact O-CB 3.4Å; V2209-R2212 PolarHBondContact O-N 3.4Å; R2212-L2214 HydrophobicContact CB-CD2 4.5Å
2213	V	88.1	Confident	85.5	Confident	27 Å²	27	48.4 Å²	48.4	16%	0.164	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	125.3	168.8	179	0	0	0	0	108.6	K1878 L1881 F2180 A2207 F2208 V2215	K1878-V2213 HydrophobicContact CB-CG2 4.02Å; K1878-V2213 HydrophobicContact CD-CB 4.43Å; K1878-V2213 HydrophobicContact CD-CG2 4.45Å; K1878-V2213 HydrophobicContact CG-CB 4.19Å; K1878-V2213 HydrophobicContact CG-CG1 4.07Å; K1878-V2213 HydrophobicContact CG-CG2 3.93Å; L1881-V2213 HydrophobicContact CD1-CG1 3.92Å; F2180-V2213 HydrophobicContact CE1-CG2 4.08Å; F2180-V2213 HydrophobicContact CE2-CG2 4.38Å; F2180-V2213 HydrophobicContact CZ-CG2 3.94Å; A2207-V2213 WeakPolarHBondContact O-CA 3.46Å; F2208-V2213 HydrophobicContact CD2-CG2 3.88Å; V2213-V2215 HydrophobicContact CG1-CG2 3.76Å
2214	L	85	Confident	85.1	Confident	67 Å²	67	46 Å²	46	35%	0.351	24%	0.244	S	C	.	.			trans	-101.3	-16.9	-175	-59.8	-174.5	0	0	0	113.9	L2206 A2207 V2209 R2212	L2206-L2214 HydrophobicContact CD2-CD1 3.94Å; L2206-L2214 HydrophobicContact CG-CD1 4.1Å; A2207-L2214 PolarHBondContact O-N 3.03Å; V2209-L2214 HydrophobicContact CG1-CD1 3.77Å; V2209-L2214 HydrophobicContact CG1-CD2 4.4Å; V2209-L2214 HydrophobicContact CG1-CG 4.12Å; R2212-L2214 HydrophobicContact CB-CD2 4.5Å
2215	V	88	Confident	84.4	Confident	14 Å²	14	49 Å²	49	9%	0.085	26%	0.264	C	S	.	.	S	Bend	trans	-83.8	138.3	178.1	-75.4	0	0	0	0	111	L1881 C1916 A2207 V2213 F2219	L1881-V2215 HydrophobicContact CD1-CG2 3.83Å; C1916-V2215 HydrophobicContact CB-CG2 3.92Å; A2207-V2215 HydrophobicContact CB-CG1 3.99Å; A2207-V2215 HydrophobicContact CB-CG2 3.98Å; V2213-V2215 HydrophobicContact CG1-CG2 3.76Å; V2215-F2219 HydrophobicContact CB-CB 3.97Å; V2215-F2219 HydrophobicContact CB-CD1 4.04Å; V2215-F2219 HydrophobicContact CB-CG 3.94Å; V2215-F2219 HydrophobicContact CG1-CB 4.36Å; V2215-F2219 HydrophobicContact CG1-CD1 3.63Å; V2215-F2219 HydrophobicContact CG1-CD2 4.14Å; V2215-F2219 HydrophobicContact CG1-CE1 3.9Å; V2215-F2219 HydrophobicContact CG1-CE2 4.38Å; V2215-F2219 HydrophobicContact CG1-CG 3.77Å; V2215-F2219 HydrophobicContact CG1-CZ 4.28Å; V2215-F2219 HydrophobicContact CG2-CD1 4.5Å
2216	E	88	Confident	83	Confident	147 Å²	147	48.9 Å²	48.9	69%	0.687	27%	0.266	S	S	*	.	P	Polyproline II helix	trans	-72.6	152.4	175.6	-66.1	-60	155.2	0	0	111.5	G2218 F2219	E2216-G2218 PolarHBondContact O-N 3.41Å; E2216-F2219 WeakPolarHBondContact O-CB 3.36Å; E2216-F2219 PolarHBondContact O-N 3.2Å
2217	P	91	Very high	81.5	Confident	52 Å²	52	48.6 Å²	48.6	34%	0.338	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.1	131.8	170.3	-23.4	34.2	0	0	0	111.5	T1874 S1913 K1914	T1874-P2217 HydrophobicContact CG2-CB 4.31Å; T1874-P2217 HydrophobicContact CG2-CG 3.8Å; S1913-P2217 CarbonylContact O-C 3.55Å; K1914-P2217 WeakPolarHBondContact O-CA 3.33Å; K1914-P2217 WeakPolarHBondContact O-CB 3.3Å
2218	G	90.4	Very high	79.5	Confident	29 Å²	29	53.6 Å²	53.6	30%	0.299	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	97.8	1.8	-175.5	0	0	0	0	0	114.5	A1912 A1915 E2216 G2220	A1912-G2218 WeakPolarHBondContact O-CA 3.38Å; A1915-G2218 CarbonylContact O-C 3.59Å; A1915-G2218 WeakPolarHBondContact O-CA 3.24Å; A1915-G2218 PolarHBondContact O-N 2.84Å; E2216-G2218 PolarHBondContact O-N 3.41Å; G2218-G2220 VanDerWaalsContact C-N 3.34Å
2219	F	92.4	Very high	77.2	Confident	53 Å²	53	60 Å²	60	23%	0.232	33%	0.334	C	S	.	.			trans	-70.5	-27.6	172.9	-174	-98.5	0	0	0	113.6	A1915 L2202 R2203 H2205 V2215 E2216	A1915-F2219 PolarHBondContact O-N 2.89Å; L2202-F2219 HydrophobicContact CB-CE1 4.5Å; L2202-F2219 HydrophobicContact CD2-CD1 4.14Å; L2202-F2219 HydrophobicContact CD2-CE1 3.98Å; L2202-F2219 HydrophobicContact CG-CE1 4.11Å; R2203-F2219 PolarHBondContact NH2-O 3.27Å; H2205-F2219 HydrophobicContact CB-CE1 4.29Å; H2205-F2219 HydrophobicContact CB-CE2 4.31Å; H2205-F2219 HydrophobicContact CB-CZ 3.6Å; H2205-F2219 AromaticContact CG-CE2 3.98Å; H2205-F2219 AromaticContact CG-CZ 3.54Å; H2205-F2219 AromaticContact ND1-CZ 3.78Å; V2215-F2219 HydrophobicContact CB-CB 3.97Å; V2215-F2219 HydrophobicContact CB-CD1 4.04Å; V2215-F2219 HydrophobicContact CB-CG 3.94Å; V2215-F2219 HydrophobicContact CG1-CB 4.36Å; V2215-F2219 HydrophobicContact CG1-CD1 3.63Å; V2215-F2219 HydrophobicContact CG1-CD2 4.14Å; V2215-F2219 HydrophobicContact CG1-CE1 3.9Å; V2215-F2219 HydrophobicContact CG1-CE2 4.38Å; V2215-F2219 HydrophobicContact CG1-CG 3.77Å; V2215-F2219 HydrophobicContact CG1-CZ 4.28Å; V2215-F2219 HydrophobicContact CG2-CD1 4.5Å; E2216-F2219 WeakPolarHBondContact O-CB 3.36Å; E2216-F2219 PolarHBondContact O-N 3.2Å
2220	G	91.5	Very high	74.9	Confident	6 Å²	6	62.8 Å²	62.8	6%	0.062	35%	0.353	C	S	.	.			trans	-64.2	142.9	-179.3	0	0	0	0	0	113.5	A1915 C1917 G2218	A1915-G2220 PolarHBondContact O-N 2.91Å; C1917-G2220 WeakPolarHBondContact O-CA 3.45Å; G2218-G2220 VanDerWaalsContact C-N 3.34Å
2221	K	89.7	Confident	72.9	Confident	131 Å²	131	70.1 Å²	70.1	57%	0.57	38%	0.383	S	S	*	.			trans	-111.9	147.6	176.6	-68.7	-172.2	174.6	-172.7	0	111.7	D1918 Y1919 V2223	D1918-K2221 WeakPolarHBondContact CA-O 3.39Å; D1918-K2221 WeakPolarHBondContact OD1-CA 3.49Å; D1918-K2221 WeakPolarHBondContact OD1-CB 3.28Å; D1918-K2221 PolarHBondContact OD1-N 3.4Å; Y1919-K2221 PolarHBondContact N-O 3.42Å; K2221-V2223 PolarHBondContact O-N 2.77Å
2222	D	89.1	Confident	70.8	Confident	21 Å²	21	74.5 Å²	74.5	11%	0.112	40%	0.395	C	S	.	.	B	Isolated β-bridge	trans	-77.2	107.1	172.4	-169	-17.4	0	0	0	110.6	Y1919 S2224 S2225	Y1919-D2222 HydrophobicContact CD2-CB 4.36Å; Y1919-D2222 HydrophobicContact CE2-CB 3.62Å; Y1919-D2222 CarbonylContact O-C 3.54Å; Y1919-D2222 WeakPolarHBondContact O-CA 3.41Å; D2222-S2224 PolarHBondContact O-N 3.21Å; D2222-S2224 VanDerWaalsContact OD1-CB 3.28Å; D2222-S2224 WeakPolarHBondContact OD1-CB 3.43Å; D2222-S2224 PolarHBondContact OD1-N 3.03Å; D2222-S2224 PolarHBondContact OD1-OG 3.44Å; D2222-S2224 PolarHBondContact OD2-OG 3.03Å; D2222-S2225 PolarHBondContact O-N 2.68Å; D2222-S2225 PolarHBondContact O-OG 3.25Å
2223	V	83.9	Confident	68.3	Low	18 Å²	18	73.5 Å²	73.5	11%	0.109	41%	0.41	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-10.1	-178.8	-56.5	0	0	0	0	113.1	T1887 D1918 Y1919 I2131 P2132 K2221	T1887-V2223 HydrophobicContact CG2-CG1 4.24Å; T1887-V2223 HydrophobicContact CG2-CG2 4.14Å; D1918-V2223 HydrophobicContact CB-CG1 3.81Å; Y1919-V2223 WeakPolarHBondContact O-CG2 3.4Å; Y1919-V2223 PolarHBondContact O-N 3.44Å; I2131-V2223 HydrophobicContact CG1-CG2 4.49Å; I2131-V2223 HydrophobicContact CG2-CB 3.72Å; I2131-V2223 HydrophobicContact CG2-CG1 4.46Å; I2131-V2223 HydrophobicContact CG2-CG2 3.54Å; P2132-V2223 WeakPolarHBondContact CD-O 3.39Å; K2221-V2223 PolarHBondContact O-N 2.77Å
2224	S	72.3	Confident	65.7	Low	1 Å²	1	78.3 Å²	78.3	1%	0.007	43%	0.426	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-26.4	177	72.1	0	0	0	0	113.2	K1939 D2222 D2226 I2227	K1939-S2224 WeakPolarHBondContact O-CB 3.4Å; K1939-S2224 PolarHBondContact O-OG 3.15Å; D2222-S2224 PolarHBondContact O-N 3.21Å; D2222-S2224 VanDerWaalsContact OD1-CB 3.28Å; D2222-S2224 WeakPolarHBondContact OD1-CB 3.43Å; D2222-S2224 PolarHBondContact OD1-N 3.03Å; D2222-S2224 PolarHBondContact OD1-OG 3.44Å; D2222-S2224 PolarHBondContact OD2-OG 3.03Å; S2224-D2226 VanDerWaalsContact C-N 3.31Å; S2224-D2226 PolarHBondContact O-N 2.82Å; S2224-I2227 WeakPolarHBondContact O-CD1 3.48Å; S2224-I2227 VanDerWaalsContact O-CG1 3.29Å; S2224-I2227 WeakPolarHBondContact O-CG1 3.34Å; S2224-I2227 PolarHBondContact O-N 2.83Å
2225	S	56.2	Low	63.4	Low	75 Å²	75	82.2 Å²	82.2	52%	0.524	45%	0.448	S	S	.	.	G	3₁₀ helix	trans	-67.7	-27.3	-173	61.9	0	0	0	0	114	D2222 I2227	D2222-S2225 PolarHBondContact O-N 2.68Å; D2222-S2225 PolarHBondContact O-OG 3.25Å; S2225-I2227 PolarHBondContact O-N 3.27Å
2226	D	50.2	Low	61.1	Low	99 Å²	99	84.1 Å²	84.1	53%	0.529	46%	0.46	S	S	.	.	G	3₁₀ helix	trans	-83.3	-3.7	-179.1	-86.6	-29.8	0	0	0	114.6	P2132 S2224 S2228 L2229	P2132-D2226 HydrophobicContact CB-CB 4.4Å; P2132-D2226 HydrophobicContact CG-CB 3.93Å; S2224-D2226 VanDerWaalsContact C-N 3.31Å; S2224-D2226 PolarHBondContact O-N 2.82Å; D2226-S2228 PolarHBondContact O-N 2.75Å; D2226-L2229 PolarHBondContact O-N 3Å
2227	I	51.7	Low	59	Low	27 Å²	27	78.3 Å²	78.3	14%	0.138	43%	0.434	C	S	.	.	G	3₁₀ helix	trans	-70.1	-20.2	-173.3	-54.9	168	0	0	0	112.3	G2130 P2132 S2224 S2225 L2229	G2130-I2227 WeakPolarHBondContact O-CD1 3.44Å; P2132-I2227 HydrophobicContact CG-CG1 3.67Å; S2224-I2227 WeakPolarHBondContact O-CD1 3.48Å; S2224-I2227 VanDerWaalsContact O-CG1 3.29Å; S2224-I2227 WeakPolarHBondContact O-CG1 3.34Å; S2224-I2227 PolarHBondContact O-N 2.83Å; S2225-I2227 PolarHBondContact O-N 3.27Å; I2227-L2229 PolarHBondContact O-N 3.11Å
2228	S	45.7	Very low	56.6	Low	105 Å²	105	80.1 Å²	80.1	73%	0.734	44%	0.444	S	S	*	.	G	3₁₀ helix	trans	-65.8	-16.7	177.4	65.9	0	0	0	0	114.4	D2226	D2226-S2228 PolarHBondContact O-N 2.75Å
2229	L	41.9	Very low	54.3	Low	142 Å²	142	81.5 Å²	81.5	74%	0.743	44%	0.444	S	S	*	.	G	3₁₀ helix	trans	-94.9	-13.5	-174.1	-73.1	166.9	0	0	0	114.8	D2226 I2227 K2231	D2226-L2229 PolarHBondContact O-N 3Å; I2227-L2229 PolarHBondContact O-N 3.11Å; L2229-K2231 PolarHBondContact O-N 3.4Å
2230	S	36.3	Very low	51.7	Low	63 Å²	63	83.6 Å²	83.6	44%	0.441	46%	0.457	S	S	.	.			trans	-95.8	85.8	177.8	63.2	0	0	0	0	112.2	N2232	S2230-N2232 PolarHBondContact O-N 3.16Å
2231	K	35.5	Very low	49	Very low	208 Å²	208	88.7 Å²	88.7	90%	0.904	49%	0.488	S	S	*	.			trans	-79.4	6.5	163.3	-93.5	-175.3	178.1	177.9	0	113.6	L2229 S2233	L2229-K2231 PolarHBondContact O-N 3.4Å; K2231-S2233 PolarHBondContact O-N 3.27Å
2232	N	34.4	Very low	46.2	Very low	136 Å²	136	85.9 Å²	85.9	73%	0.727	48%	0.484	S	S	*	.	S	Bend	trans	-77	117	174.6	-75.7	-16.3	0	0	0	109	S2230 Y2234	S2230-N2232 PolarHBondContact O-N 3.16Å; N2232-Y2234 PolarHBondContact O-N 2.85Å
2233	S	33.2	Very low	43.4	Very low	122 Å²	122	91.9 Å²	91.9	85%	0.853	52%	0.516	S	S	*	.			trans	-54.8	90.2	179.4	53.3	0	0	0	0	111.6	K2231	K2231-S2233 PolarHBondContact O-N 3.27Å
2234	Y	34	Very low	40.7	Very low	128 Å²	128	97.7 Å²	97.7	50%	0.502	54%	0.539	S	S	.	.	P	Polyproline II helix	trans	-75.7	120.6	155.3	-75	-78.3	0	0	0	106.9	L2137 N2232 P2236	L2137-Y2234 HydrophobicContact CB-CE1 4.47Å; N2232-Y2234 PolarHBondContact O-N 2.85Å; Y2234-P2236 VanDerWaalsContact O-CD 3.31Å; Y2234-P2236 WeakPolarHBondContact O-CD 3.38Å
2235	D	36.3	Very low	38.4	Very low	150 Å²	150	106.1 Å²	106.1	80%	0.802	58%	0.578	S	S	*	*	P	Polyproline II helix	trans	-59.9	116.7	174.4	-155	-7.6	0	0	0	108.3	L2237	D2235-L2237 PolarHBondContact O-N 2.96Å
2236	P	39	Very low	37	Very low	54 Å²	54	109.3 Å²	109.3	35%	0.351	59%	0.588	S	S	.	*	P	Polyproline II helix	trans	-73.9	123.9	-165.7	24.9	-31.9	0	0	0	112.7	Y2234 T2238	Y2234-P2236 VanDerWaalsContact O-CD 3.31Å; Y2234-P2236 WeakPolarHBondContact O-CD 3.38Å; P2236-T2238 PolarHBondContact O-N 3.35Å
2237	L	44.8	Very low	35.7	Very low	25 Å²	25	109.9 Å²	109.9	13%	0.131	60%	0.597	C	S	.	*	S	Bend	trans	68	28.4	140.8	-61.7	158.8	0	0	0	117.6	I2128 D2235	I2128-L2237 WeakPolarHBondContact O-CD2 3.35Å; D2235-L2237 PolarHBondContact O-N 2.96Å
2238	T	40.8	Very low	34.5	Very low	89 Å²	89	115.2 Å²	115.2	55%	0.546	63%	0.631	S	S	.	*			trans	-116.5	119.5	160.7	49.6	0	0	0	0	109.7	K2022 P2236 D2240	K2022-T2238 HydrophobicContact CG-CG2 4.33Å; P2236-T2238 PolarHBondContact O-N 3.35Å; T2238-D2240 VanDerWaalsContact C-N 3.31Å; T2238-D2240 PolarHBondContact O-N 3.27Å
2239	I	41.6	Very low	33.5	Very low	59 Å²	59	115.1 Å²	115.1	30%	0.303	63%	0.63	S	S	.	*			trans	-72.7	97.7	166.4	-64.1	166.6	0	0	0	104.8	T2024 D2069 T2241	T2024-I2239 HydrophobicContact CG2-CD1 4.32Å; D2069-I2239 HydrophobicContact CB-CD1 4.01Å; D2069-I2239 WeakPolarHBondContact OD1-CD1 3.24Å; I2239-T2241 HydrophobicContact CG2-CG2 4.41Å; I2239-T2241 PolarHBondContact O-N 2.91Å
2240	D	36.8	Very low	32.7	Very low	96 Å²	96	113.1 Å²	113.1	51%	0.513	63%	0.634	S	S	.	*			trans	-62.8	98.6	174.1	-174.5	4.9	0	0	0	109	T2238 S2242	T2238-D2240 VanDerWaalsContact C-N 3.31Å; T2238-D2240 PolarHBondContact O-N 3.27Å; D2240-S2242 PolarHBondContact O-N 2.86Å; D2240-S2242 WeakPolarHBondContact OD1-CB 3.48Å; D2240-S2242 PolarHBondContact OD1-N 3.35Å; D2240-S2242 PolarHBondContact OD1-OG 2.97Å; D2240-S2242 PolarHBondContact OD2-OG 3.44Å; D2240-S2242 VanDerWaalsContact OD2-OG 3.14Å
2241	T	35.9	Very low	32.1	Very low	114 Å²	114	112.9 Å²	112.9	70%	0.699	64%	0.642	S	S	*	*	G	3₁₀ helix	trans	-74.2	-6.4	177	46.6	0	0	0	0	112.1	I2239 L2243 K2244	I2239-T2241 HydrophobicContact CG2-CG2 4.41Å; I2239-T2241 PolarHBondContact O-N 2.91Å; T2241-L2243 VanDerWaalsContact C-N 3.28Å; T2241-L2243 PolarHBondContact O-N 3.09Å; T2241-K2244 PolarHBondContact O-N 3.42Å
2242	S	30.9	Very low	31.6	Very low	72 Å²	72	106.7 Å²	106.7	50%	0.503	63%	0.625	S	S	.	*	G	3₁₀ helix	trans	-72.3	-16.6	-176.1	76	0	0	0	0	114.2	D2240 K2244	D2240-S2242 PolarHBondContact O-N 2.86Å; D2240-S2242 WeakPolarHBondContact OD1-CB 3.48Å; D2240-S2242 PolarHBondContact OD1-N 3.35Å; D2240-S2242 PolarHBondContact OD1-OG 2.97Å; D2240-S2242 PolarHBondContact OD2-OG 3.44Å; D2240-S2242 VanDerWaalsContact OD2-OG 3.14Å; S2242-K2244 VanDerWaalsContact C-N 3.28Å; S2242-K2244 PolarHBondContact O-N 3.49Å
2243	L	29.2	Very low	31.2	Very low	146 Å²	146	106.3 Å²	106.3	76%	0.764	63%	0.63	S	S	*	*	G	3₁₀ helix	trans	-79.7	0.6	176.3	-81.6	163.7	0	0	0	114.8	T2241	T2241-L2243 VanDerWaalsContact C-N 3.28Å; T2241-L2243 PolarHBondContact O-N 3.09Å
2244	K	28.2	Very low	30.8	Very low	140 Å²	140	105.6 Å²	105.6	61%	0.609	62%	0.62	S	S	*	*			trans	-102.5	47.3	170.2	-72.3	-173.9	179.6	176.3	0	112.1	E2119 T2241 S2242	E2119-K2244 IonicContact OE1-NZ 3.4Å; E2119-K2244 PolarHBondContact OE1-NZ 3.14Å; E2119-K2244 IonicContact OE2-NZ 3.32Å; E2119-K2244 PolarHBondContact OE2-NZ 2.94Å; T2241-K2244 PolarHBondContact O-N 3.42Å; S2242-K2244 VanDerWaalsContact C-N 3.28Å; S2242-K2244 PolarHBondContact O-N 3.49Å
2245	H	24.2	Very low	30.3	Very low	178 Å²	178	106.7 Å²	106.7	82%	0.824	63%	0.634	S	S	*	*			trans	-102.4	47.6	157.6	-91.6	-67	0	0	0	110.9
2246	I	26	Very low	29.6	Very low	142 Å²	142	109.6 Å²	109.6	73%	0.728	63%	0.634	S	S	*	*	S	Bend	trans	-94.5	115.7	148.9	-59.5	176.8	0	0	0	104	V2248	I2246-V2248 PolarHBondContact O-N 3.23Å
2247	P	23.4	Very low	28.8	Very low	112 Å²	112	113.2 Å²	113.2	73%	0.727	65%	0.65	S	S	*	*			trans	-62.8	100.4	-170.7	25.2	-32	0	0	0	108.6	S2249	P2247-S2249 PolarHBondContact O-N 3.17Å
2248	V	25.9	Very low	27.7	Very low	139 Å²	139	122 Å²	122	84%	0.842	68%	0.681	S	S	*	*			trans	-68.4	89.9	152.6	-175.5	0	0	0	0	103.2	I2246 A2250	I2246-V2248 PolarHBondContact O-N 3.23Å; V2248-A2250 PolarHBondContact O-N 2.96Å
2249	S	25.3	Very low	26.9	Very low	103 Å²	103	128.3 Å²	128.3	72%	0.72	70%	0.697	S	S	*	*			trans	-47.6	101.9	162.4	153.1	0	0	0	0	105.7	P2247 G2251	P2247-S2249 PolarHBondContact O-N 3.17Å; S2249-G2251 PolarHBondContact O-N 3.15Å; S2249-G2251 PolarHBondContact OG-N 3.23Å
2250	A	25.5	Very low	26	Very low	99 Å²	99	130.9 Å²	130.9	82%	0.818	72%	0.72	S	S	*	*			trans	-63.8	69.7	160.8	0	0	0	0	0	106.7	V2248 S2252	V2248-A2250 PolarHBondContact O-N 2.96Å; A2250-S2252 PolarHBondContact O-N 3.35Å
2251	G	23.6	Very low	25.5	Very low	59 Å²	59	131 Å²	131	61%	0.608	73%	0.728	S	S	*	*			trans	-69.4	83.2	162.6	0	0	0	0	0	105.4	S2249	S2249-G2251 PolarHBondContact O-N 3.15Å; S2249-G2251 PolarHBondContact OG-N 3.23Å
2252	S	25	Very low	25	Very low	78 Å²	78	131.9 Å²	131.9	55%	0.545	73%	0.734	S	S	.	*			trans	-35.1	127.6	166.5	178.1	0	0	0	0	109.3	A2250 T2254	A2250-S2252 PolarHBondContact O-N 3.35Å; S2252-T2254 PolarHBondContact O-N 3.04Å
2253	P	25.4	Very low	24.7	Very low	128 Å²	128	136.4 Å²	136.4	83%	0.831	75%	0.752	S	S	*	*			trans	-72.5	64.9	174.6	31.5	-33	0	0	0	108.6	L2255	P2253-L2255 VanDerWaalsContact C-N 3.26Å; P2253-L2255 PolarHBondContact O-N 3.45Å
2254	T	24.7	Very low	24.5	Very low	107 Å²	107	138.1 Å²	138.1	66%	0.656	76%	0.756	S	S	*	*			trans	-86	86.4	162.3	42.7	0	0	0	0	105.7	S2252 R2256	S2252-T2254 PolarHBondContact O-N 3.04Å; T2254-R2256 PolarHBondContact O-N 3.17Å
2255	L	23.2	Very low	24	Very low	150 Å²	150	142.8 Å²	142.8	79%	0.785	77%	0.77	S	S	*	*			trans	-54.4	81.7	166.2	-148.4	112.2	0	0	0	108	P2253 N2257	P2253-L2255 VanDerWaalsContact C-N 3.26Å; P2253-L2255 PolarHBondContact O-N 3.45Å; L2255-N2257 PolarHBondContact O-N 2.95Å
2256	R	21.3	Very low	24	Very low	212 Å²	212	140 Å²	140	80%	0.8	77%	0.765	S	S	*	*			trans	-75.2	85.3	169.5	-101.7	-176.3	173.1	175.2	-0.4	107	T2254 R2258	T2254-R2256 PolarHBondContact O-N 3.17Å; R2256-R2258 PolarHBondContact O-N 2.82Å
2257	N	24.1	Very low	23.8	Very low	130 Å²	130	141.5 Å²	141.5	70%	0.695	77%	0.769	S	S	*	*			trans	-44.5	102.4	152.2	-89.4	-26.7	0	0	0	109	L2255	L2255-N2257 PolarHBondContact O-N 2.95Å
2258	R	21.6	Very low	23.7	Very low	209 Å²	209	140.6 Å²	140.6	79%	0.789	77%	0.765	S	S	*	*			trans	-128.5	73.9	151.2	-91.3	-164.1	-96	-178	-5.6	108	R2256 S2260	R2256-R2258 PolarHBondContact O-N 2.82Å; R2258-S2260 VanDerWaalsContact C-N 3.27Å; R2258-S2260 PolarHBondContact O-N 3.47Å
2259	Y	23.7	Very low	23.7	Very low	222 Å²	222	142 Å²	142	87%	0.871	76%	0.763	S	S	*	*			trans	-69.7	101.6	135.8	-88.2	-84.2	0	0	0	105.9	S2261	Y2259-S2261 PolarHBondContact O-N 2.68Å; Y2259-S2261 VanDerWaalsContact O-N 3.15Å
2260	S	22.2	Very low	23.9	Very low	113 Å²	113	144 Å²	144	79%	0.79	77%	0.766	S	S	*	*			trans	-57.9	110.4	161.4	-177	0	0	0	0	107.1	R2258	R2258-S2260 VanDerWaalsContact C-N 3.27Å; R2258-S2260 PolarHBondContact O-N 3.47Å
2261	S	27.1	Very low	23.8	Very low	98 Å²	98	147.9 Å²	147.9	69%	0.685	77%	0.767	S	S	*	*			trans	-64.3	146.9	165.4	54.9	0	0	0	0	109.6	Y2259	Y2259-S2261 PolarHBondContact O-N 2.68Å; Y2259-S2261 VanDerWaalsContact O-N 3.15Å
2262	T	25.4	Very low	24.4	Very low	133 Å²	133	150.8 Å²	150.8	82%	0.816	78%	0.775	S	S	*	*			trans	-35.9	134.3	168.6	41.7	0	0	0	0	114.9	E2264	T2262-E2264 PolarHBondContact O-N 2.94Å
2263	N	24.4	Very low	24.6	Very low	167 Å²	167	150.8 Å²	150.8	89%	0.893	79%	0.787	S	S	*	*			trans	-43.3	112.1	155.9	-76.8	-40.8	0	0	0	112.6
2264	E	24	Very low	24.6	Very low	181 Å²	181	151.2 Å²	151.2	85%	0.846	79%	0.788	S	S	*	*			trans	-135.9	113.8	142.4	-84.9	-165.2	150.5	0	0	108.9	T2262	T2262-E2264 PolarHBondContact O-N 2.94Å
2265	R	19.3	Very low	24.7	Very low	238 Å²	238	151.1 Å²	151.1	90%	0.898	79%	0.789	S	S	*	*			trans	25.5	124.6	143.8	-70.5	175	163.6	169.3	-4.4	119.3
2266	V	23.7	Very low	24.8	Very low	119 Å²	119	152.2 Å²	152.2	72%	0.721	79%	0.794	S	S	*	*				156.8	110.8	109.3	169.6	0	0	0	0	109
2267	Q	21.2	Very low	25	Very low	174 Å²	174	147.2 Å²	147.2	81%	0.813	79%	0.789	S	S	*	*			trans	35.9	139.1	135.6	-63.6	168.3	-22.6	0	0	118.7
2268	S	21.8	Very low	24.9	Very low	93 Å²	93	145 Å²	145	65%	0.65	79%	0.789	S	S	*	*			cis	173.4	167.4	20.9	41.4	0	0	0	0	107.8
2269	Q	25.7	Very low	25	Very low	169 Å²	169	142.3 Å²	142.3	79%	0.79	79%	0.79	S	S	*	*			trans	78.5	133.5	165	-62.7	172.8	-13	0	0	115.6
2270	D	28.8	Very low	25.2	Very low	146 Å²	146	137.8 Å²	137.8	78%	0.781	79%	0.785	S	S	*	*			cis	-158.1	151.8	0.8	-90.5	-34.1	0	0	0	108.4
2271	E	23.7	Very low	25.2	Very low	180 Å²	180	140.7 Å²	140.7	84%	0.841	79%	0.787	S	S	*	*			trans	-60.9	-172	167	-88.2	-173.5	170.4	0	0	114
2272	P	36.3	Very low	25.1	Very low	119 Å²	119	140.8 Å²	140.8	77%	0.773	79%	0.787	S	S	*	*			cis	-137.6	172.2	-34.1	31.5	-12.2	0	0	0	113.2
2273	G	29.3	Very low	25.4	Very low	78 Å²	78	142.7 Å²	142.7	80%	0.804	79%	0.793	S	S	*	*			trans	-170.4	94.8	167.2	0	0	0	0	0	113
2274	T	25.9	Very low	25.3	Very low	137 Å²	137	144 Å²	144	84%	0.84	79%	0.793	S	S	*	*			trans	-60.4	158.6	-163.7	21.3	0	0	0	0	119.1
2275	P	26.8	Very low	25.3	Very low	106 Å²	106	138.9 Å²	138.9	69%	0.688	79%	0.789	S	S	*	*			trans	-89.7	167	178.2	39	-32.5	0	0	0	111.7
2276	I	24.5	Very low	26	Very low	172 Å²	172	133.3 Å²	133.3	88%	0.882	78%	0.783	S	S	*	*			trans	-175.9	152.9	146.8	-94.8	149.1	0	0	0	111.1
2277	P	25.8	Very low	25.9	Very low	108 Å²	108	139.1 Å²	139.1	70%	0.701	79%	0.792	S	S	*	*			trans	-118.5	179.1	-154.5	38.8	-22.2	0	0	0	115.1
2278	A	22.8	Very low	26.1	Very low	84 Å²	84	136.1 Å²	136.1	69%	0.694	79%	0.791	S	S	*	*			trans	71.6	135.3	145	0	0	0	0	0	121.6
2279	N	22.9	Very low	26.4	Very low	152 Å²	152	137.5 Å²	137.5	81%	0.813	80%	0.797	S	S	*	*			trans	72.6	122.2	151.3	-78.6	-11.5	0	0	0	120.2
2280	T	27.8	Very low	26.5	Very low	126 Å²	126	136.9 Å²	136.9	77%	0.773	80%	0.798	S	S	*	*				171.5	116.4	121.7	37	0	0	0	0	107.8
2281	Q	22.7	Very low	26.2	Very low	174 Å²	174	137 Å²	137	81%	0.813	80%	0.797	S	S	*	*				55.1	104.4	95.9	-73.3	-173	-6.6	0	0	112
2282	S	24.4	Very low	26.2	Very low	100 Å²	100	134.2 Å²	134.2	70%	0.699	79%	0.792	S	S	*	*				105.7	109.7	84.5	63.1	0	0	0	0	108.8
2283	D	31.5	Very low	25.6	Very low	174 Å²	174	138 Å²	138	93%	0.93	79%	0.792	S	S	*	*			trans	-137.9	117.9	159.4	-109.5	-22.2	0	0	0	109.6
2284	E	22.1	Very low	25.3	Very low	195 Å²	195	143.5 Å²	143.5	91%	0.911	80%	0.797	S	S	*	*			trans	-84.5	142.8	175.8	-63.2	-178.9	143.5	0	0	109.6
2285	G	24.8	Very low	25.2	Very low	72 Å²	72	141.9 Å²	141.9	74%	0.742	79%	0.789	S	S	*	*			trans	177.6	145.4	165.9	0	0	0	0	0	113
2286	P	33.6	Very low	25.1	Very low	121 Å²	121	142.4 Å²	142.4	79%	0.786	80%	0.795	S	S	*	*			trans	-118.3	152.6	-131.1	35.7	-23.2	0	0	0	116.3
2287	R	22.4	Very low	25.1	Very low	241 Å²	241	138.3 Å²	138.3	91%	0.909	79%	0.787	S	S	*	*			trans	27	114.5	142	-65.7	179.7	176.8	174.8	-0.4	118.3
2288	S	24.8	Very low	25	Very low	112 Å²	112	139.1 Å²	139.1	78%	0.783	80%	0.795	S	S	*	*			trans	-145	128.1	140.4	-75.7	0	0	0	0	109.6
2289	P	28.4	Very low	25	Very low	121 Å²	121	138.4 Å²	138.4	79%	0.786	80%	0.796	S	S	*	*			trans	-83.5	116.8	-178.9	31.4	-29.4	0	0	0	110.2	I2291	P2289-I2291 PolarHBondContact O-N 2.9Å
2290	I	26.3	Very low	25.1	Very low	157 Å²	157	139.5 Å²	139.5	81%	0.805	80%	0.801	S	S	*	*			trans	-81.7	108.3	170.8	-64.6	175.7	0	0	0	108	V2292	I2290-V2292 HydrophobicContact CG2-CG2 4.48Å; I2290-V2292 PolarHBondContact O-N 3.17Å
2291	I	23.9	Very low	24.9	Very low	148 Å²	148	140.7 Å²	140.7	76%	0.759	80%	0.801	S	S	*	*			trans	-63.2	101.1	169.9	-64.2	163.9	0	0	0	107.4	P2289 Y2293	P2289-I2291 PolarHBondContact O-N 2.9Å; I2291-Y2293 PolarHBondContact O-N 3.26Å
2292	V	24.3	Very low	24.9	Very low	121 Å²	121	138 Å²	138	73%	0.733	80%	0.799	S	S	*	*			trans	-85.6	109.1	167.7	178.9	0	0	0	0	107.9	I2290 Q2294	I2290-V2292 HydrophobicContact CG2-CG2 4.48Å; I2290-V2292 PolarHBondContact O-N 3.17Å; V2292-Q2294 PolarHBondContact O-N 2.71Å
2293	Y	21.9	Very low	24.9	Very low	200 Å²	200	139.6 Å²	139.6	78%	0.784	80%	0.804	S	S	*	*			trans	-38.6	120.7	162.3	-101.7	-109.7	0	0	0	111.9	I2291 P2295	I2291-Y2293 PolarHBondContact O-N 3.26Å; Y2293-P2295 HydrophobicContact CD1-CG 4.44Å; Y2293-P2295 WeakPolarHBondContact O-CD 3.23Å
2294	Q	23.1	Very low	24.6	Very low	192 Å²	192	135.6 Å²	135.6	90%	0.897	80%	0.795	S	S	*	*			trans	-109.6	94.1	155.6	-82.2	-172.1	-27.4	0	0	108.4	V2292	V2292-Q2294 PolarHBondContact O-N 2.71Å
2295	P	24.6	Very low	24.6	Very low	103 Å²	103	134.6 Å²	134.6	67%	0.669	79%	0.791	S	S	*	*			trans	-82.6	125.3	162.6	21.2	-7.6	0	0	0	109.7	Y2293	Y2293-P2295 HydrophobicContact CD1-CG 4.44Å; Y2293-P2295 WeakPolarHBondContact O-CD 3.23Å
2296	S	24.1	Very low	24.5	Very low	117 Å²	117	138.6 Å²	138.6	82%	0.818	79%	0.794	S	S	*	*			trans	-46.4	140.2	163.3	49.1	0	0	0	0	115.5
2297	A	25.1	Very low	24	Very low	86 Å²	86	137.5 Å²	137.5	71%	0.711	79%	0.787	S	S	*	*			trans	159.9	85.8	131.7	0	0	0	0	0	108.8
2298	S	23.5	Very low	24	Very low	126 Å²	126	134 Å²	134	88%	0.881	78%	0.781	S	S	*	*				38.8	87.4	90.5	72.6	0	0	0	0	114.1
2299	G	23.8	Very low	24	Very low	69 Å²	69	133.7 Å²	133.7	71%	0.711	78%	0.775	S	S	*	*			trans	179.3	111.4	165	0	0	0	0	0	112.1
2300	L	23.7	Very low	23.9	Very low	175 Å²	175	135.2 Å²	135.2	92%	0.916	77%	0.771	S	S	*	*	S	Bend	trans	85.8	55.9	157.7	-51.3	165.9	0	0	0	118.8
2301	I	23.8	Very low	23.8	Very low	151 Å²	151	136.5 Å²	136.5	77%	0.774	77%	0.773	S	S	*	*				-134.7	124.4	126.3	-60.1	-176	0	0	0	106.3	T2303	I2301-T2303 PolarHBondContact O-N 3.32Å
2302	P	23.8	Very low	24	Very low	118 Å²	118	133.8 Å²	133.8	77%	0.766	77%	0.768	S	S	*	*			trans	-62	111.2	172.8	3.2	6.4	0	0	0	107.7	A2304	P2302-A2304 PolarHBondContact O-N 3.3Å
2303	T	23.6	Very low	24.6	Very low	132 Å²	132	133.9 Å²	133.9	81%	0.81	76%	0.764	S	S	*	*			trans	-64	77.1	159	36.6	0	0	0	0	108	I2301 Q2305	I2301-T2303 PolarHBondContact O-N 3.32Å; T2303-Q2305 PolarHBondContact O-N 2.81Å
2304	A	24.5	Very low	25.7	Very low	91 Å²	91	128.5 Å²	128.5	75%	0.752	75%	0.753	S	S	*	*			trans	-63.9	95.6	147.3	0	0	0	0	0	104.8	P2302 L2306	P2302-A2304 PolarHBondContact O-N 3.3Å; A2304-L2306 PolarHBondContact O-N 2.86Å
2305	Q	23.3	Very low	27.3	Very low	173 Å²	173	123 Å²	123	81%	0.808	74%	0.736	S	S	*	*			trans	-28.7	109	170.1	-66.9	163	-20.7	0	0	109.4	T2303 P2307	T2303-Q2305 PolarHBondContact O-N 2.81Å; Q2305-P2307 WeakPolarHBondContact O-CD 3.39Å
2306	L	21.4	Very low	29.5	Very low	157 Å²	157	119.9 Å²	119.9	82%	0.822	71%	0.713	S	S	*	*			trans	-52.3	116.5	144.8	-101.6	121.8	0	0	0	103.2	A2304 Q2308	A2304-L2306 PolarHBondContact O-N 2.86Å; L2306-Q2308 PolarHBondContact O-N 3.03Å
2307	P	24.2	Very low	32.1	Very low	97 Å²	97	117.4 Å²	117.4	63%	0.63	69%	0.686	S	S	*	*			trans	-59.8	100.8	161.9	-7.9	24.9	0	0	0	102.2	Q2305 T2309	Q2305-P2307 WeakPolarHBondContact O-CD 3.39Å; P2307-T2309 HydrophobicContact CB-CG2 4.06Å; P2307-T2309 PolarHBondContact O-N 3.17Å
2308	Q	22.4	Very low	34.7	Very low	169 Å²	169	113.6 Å²	113.6	79%	0.79	65%	0.653	S	S	*	*			trans	-61.2	67.1	146.7	-71.7	-175.8	-6.4	0	0	105.4	L2306 H2310	L2306-Q2308 PolarHBondContact O-N 3.03Å; Q2308-H2310 PolarHBondContact O-N 3.28Å
2309	T	23.6	Very low	37.4	Very low	105 Å²	105	114.5 Å²	114.5	64%	0.644	64%	0.644	S	S	*	*			trans	-65.7	77.3	138.2	55.7	0	0	0	0	103.7	P2307 Q2311	P2307-T2309 HydrophobicContact CB-CG2 4.06Å; P2307-T2309 PolarHBondContact O-N 3.17Å; T2309-Q2311 PolarHBondContact O-N 2.89Å
2310	H	26.2	Very low	40.1	Very low	153 Å²	153	113.7 Å²	113.7	71%	0.708	64%	0.636	S	S	*	*				-38.4	105.1	117	-86.5	-78.6	0	0	0	103	Q2308 S2312	Q2308-H2310 PolarHBondContact O-N 3.28Å; H2310-S2312 PolarHBondContact O-N 3.36Å
2311	Q	24.8	Very low	43.2	Very low	183 Å²	183	105.5 Å²	105.5	86%	0.855	59%	0.593	S	S	*	*			trans	-58	85.1	159	-77.9	-174.8	-6.1	0	0	102.2	T2309 L2313	T2309-Q2311 PolarHBondContact O-N 2.89Å; Q2311-L2313 PolarHBondContact O-N 3.45Å
2312	S	28.5	Very low	46.2	Very low	91 Å²	91	99 Å²	99	64%	0.636	56%	0.561	S	S	*	*			trans	-52.6	120.8	172.9	41.8	0	0	0	0	100.7	H2310 P2314	H2310-S2312 PolarHBondContact O-N 3.36Å; S2312-P2314 VanDerWaalsContact C-N 3.34Å; S2312-P2314 WeakPolarHBondContact O-CD 3.33Å
2313	L	36	Very low	49.1	Very low	124 Å²	124	95.6 Å²	95.6	65%	0.649	55%	0.547	S	S	*	.			trans	-37	114.8	154.7	-87.6	148.6	0	0	0	104.4	Q2311 S2315	Q2311-L2313 PolarHBondContact O-N 3.45Å; L2313-S2315 PolarHBondContact O-N 2.99Å
2314	P	45.9	Very low	52.2	Low	86 Å²	86	95.3 Å²	95.3	56%	0.558	53%	0.534	S	S	*	.			trans	-47.9	120.5	-169.1	14.6	-29.3	0	0	0	106	S2312 I2316	S2312-P2314 VanDerWaalsContact C-N 3.34Å; S2312-P2314 WeakPolarHBondContact O-CD 3.33Å; P2314-I2316 PolarHBondContact O-N 3.25Å
2315	S	56.1	Low	55.3	Low	78 Å²	78	93.7 Å²	93.7	55%	0.545	51%	0.511	S	S	.	.			trans	-29.9	102.6	-172.5	161.8	0	0	0	0	109.1	L2313 W2317	L2313-S2315 PolarHBondContact O-N 2.99Å; S2315-W2317 PolarHBondContact O-N 3.2Å; S2315-W2317 VanDerWaalsContact O-O 3.13Å; S2315-W2317 PolarHBondContact OG-O 2.95Å
2316	I	71.4	Confident	58.7	Low	36 Å²	36	85.5 Å²	85.5	19%	0.185	47%	0.473	C	S	.	.			trans	-63	-26.2	-179.5	-60.5	177.8	0	0	0	108	P2314 L2318 L2343 I2360 A2621 I2622 A2625	P2314-I2316 PolarHBondContact O-N 3.25Å; I2316-L2318 PolarHBondContact O-N 3.06Å; I2316-L2343 HydrophobicContact CG2-CD2 4.31Å; I2316-I2360 HydrophobicContact CD1-CG2 4.06Å; I2316-A2621 HydrophobicContact CG2-CB 3.79Å; I2316-A2621 WeakPolarHBondContact CG2-O 3.5Å; I2316-I2622 HydrophobicContact CG2-CG1 4.23Å; I2316-I2622 WeakPolarHBondContact O-CG1 3.46Å; I2316-A2625 HydrophobicContact CB-CB 4.34Å; I2316-A2625 HydrophobicContact CG2-CB 3.99Å
2317	W	78.8	Confident	61.9	Low	66 Å²	66	79 Å²	79	25%	0.25	44%	0.439	C	S	.	.			trans	-60.4	126	170.6	-164.1	86.7	0	0	0	111.9	S2315 E2319 S2322 A2625 Q2627	S2315-W2317 PolarHBondContact O-N 3.2Å; S2315-W2317 VanDerWaalsContact O-O 3.13Å; S2315-W2317 PolarHBondContact OG-O 2.95Å; W2317-E2319 HydrophobicContact CE3-CB 4.46Å; W2317-E2319 HydrophobicContact CH2-CB 3.66Å; W2317-E2319 HydrophobicContact CH2-CG 3.68Å; W2317-E2319 HydrophobicContact CZ3-CB 3.52Å; W2317-E2319 HydrophobicContact CZ3-CG 3.99Å; W2317-S2322 WeakPolarHBondContact CA-OG 3.39Å; W2317-A2625 HydrophobicContact CB-CB 4.47Å; W2317-Q2627 HydrophobicContact CD2-CG 4.4Å; W2317-Q2627 HydrophobicContact CZ2-CG 4.04Å
2318	L	79.9	Confident	65.1	Low	5 Å²	5	75.1 Å²	75.1	3%	0.026	41%	0.414	C	S	.	.			trans	-127.9	113	-178	-157.3	113	0	0	0	108.7	I2316 G2320 I2321 S2322 H2336 R2339 I2622	I2316-L2318 PolarHBondContact O-N 3.06Å; L2318-G2320 PolarHBondContact O-N 2.87Å; L2318-I2321 HydrophobicContact CB-CB 4.37Å; L2318-I2321 HydrophobicContact CD2-CB 3.64Å; L2318-I2321 HydrophobicContact CD2-CG1 3.41Å; L2318-I2321 VanDerWaalsContact CD2-CG1 3.41Å; L2318-I2321 HydrophobicContact CD2-CG2 4.29Å; L2318-I2321 PolarHBondContact O-N 3.27Å; L2318-I2321 VanDerWaalsContact O-N 3.08Å; L2318-S2322 PolarHBondContact N-OG 3.09Å; L2318-S2322 PolarHBondContact O-N 3.05Å; L2318-S2322 PolarHBondContact O-OG 3.38Å; L2318-H2336 HydrophobicContact CD2-CB 3.76Å; L2318-R2339 HydrophobicContact CD1-CB 3.46Å; L2318-R2339 VanDerWaalsContact CD1-CB 3.46Å; L2318-R2339 VanDerWaalsContact CD1-CD 3.47Å; L2318-R2339 HydrophobicContact CD1-CG 4.1Å; L2318-I2622 HydrophobicContact CB-CG2 3.46Å; L2318-I2622 VanDerWaalsContact CB-CG2 3.46Å; L2318-I2622 HydrophobicContact CD1-CD1 4.44Å; L2318-I2622 HydrophobicContact CD2-CG2 4.44Å; L2318-I2622 HydrophobicContact CG-CG2 4.43Å
2319	E	79.2	Confident	68.1	Low	145 Å²	145	67.2 Å²	67.2	68%	0.678	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	131.2	-178.8	-163.8	159.6	-164.3	0	0	111	W2317 I2321 H2336	W2317-E2319 HydrophobicContact CE3-CB 4.46Å; W2317-E2319 HydrophobicContact CH2-CB 3.66Å; W2317-E2319 HydrophobicContact CH2-CG 3.68Å; W2317-E2319 HydrophobicContact CZ3-CB 3.52Å; W2317-E2319 HydrophobicContact CZ3-CG 3.99Å; E2319-I2321 VanDerWaalsContact C-N 3.32Å; E2319-I2321 PolarHBondContact O-N 2.74Å; E2319-H2336 PolarHBondContact O-NE2 3.5Å
2320	G	81	Confident	71.1	Confident	53 Å²	53	66.2 Å²	66.2	55%	0.546	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.2	-18.8	-177	0	0	0	0	0	116.2	L2318	L2318-G2320 PolarHBondContact O-N 2.87Å
2321	I	88.3	Confident	73.9	Confident	3 Å²	3	62 Å²	62	2%	0.015	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.9	-43.5	-178.6	-61.2	-60.9	0	0	0	111.9	L2318 E2319 G2323 K2324 I2326 D2331 F2332 I2622 V2623	L2318-I2321 HydrophobicContact CB-CB 4.37Å; L2318-I2321 HydrophobicContact CD2-CB 3.64Å; L2318-I2321 HydrophobicContact CD2-CG1 3.41Å; L2318-I2321 VanDerWaalsContact CD2-CG1 3.41Å; L2318-I2321 HydrophobicContact CD2-CG2 4.29Å; L2318-I2321 PolarHBondContact O-N 3.27Å; L2318-I2321 VanDerWaalsContact O-N 3.08Å; E2319-I2321 VanDerWaalsContact C-N 3.32Å; E2319-I2321 PolarHBondContact O-N 2.74Å; I2321-G2323 PolarHBondContact O-N 3.4Å; I2321-K2324 PolarHBondContact O-N 3.33Å; I2321-K2324 VanDerWaalsContact O-N 3.1Å; I2321-I2326 HydrophobicContact CD1-CD1 3.99Å; I2321-I2326 HydrophobicContact CG2-CD1 3.73Å; I2321-D2331 HydrophobicContact CD1-CB 4.47Å; I2321-D2331 WeakPolarHBondContact CD1-O 3.2Å; I2321-F2332 HydrophobicContact CD1-CD1 4.16Å; I2321-F2332 HydrophobicContact CD1-CE1 4.02Å; I2321-F2332 HydrophobicContact CG1-CE1 4.45Å; I2321-I2622 HydrophobicContact CB-CG2 4.19Å; I2321-I2622 HydrophobicContact CG2-CG2 3.61Å; I2321-V2623 HydrophobicContact CG2-CG2 4.37Å
2322	S	87.4	Confident	77	Confident	14 Å²	14	53.6 Å²	53.6	10%	0.098	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	127.3	-177.6	-69.4	0	0	0	0	112	W2317 L2318 K2324 I2622	W2317-S2322 WeakPolarHBondContact CA-OG 3.39Å; L2318-S2322 PolarHBondContact N-OG 3.09Å; L2318-S2322 PolarHBondContact O-N 3.05Å; L2318-S2322 PolarHBondContact O-OG 3.38Å; S2322-K2324 PolarHBondContact O-N 2.99Å; S2322-I2622 WeakPolarHBondContact CA-O 3.4Å; S2322-I2622 VanDerWaalsContact CB-O 3.27Å; S2322-I2622 WeakPolarHBondContact CB-O 3.5Å; S2322-I2622 PolarHBondContact OG-O 2.93Å
2323	G	84.6	Confident	79.8	Confident	46 Å²	46	51.4 Å²	51.4	47%	0.474	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.4	8.3	-176.5	0	0	0	0	0	115.6	I2321 V2623	I2321-G2323 PolarHBondContact O-N 3.4Å; G2323-V2623 WeakPolarHBondContact CA-O 3.47Å; G2323-V2623 PolarHBondContact N-O 3.03Å
2324	K	87.8	Confident	81.9	Confident	127 Å²	127	50.3 Å²	50.3	55%	0.552	28%	0.283	S	S	*	.	S	Bend	trans	-107	161	179.2	-60.9	-63.5	-176.7	179.1	0	111.8	I2321 S2322	I2321-K2324 PolarHBondContact O-N 3.33Å; I2321-K2324 VanDerWaalsContact O-N 3.1Å; S2322-K2324 PolarHBondContact O-N 2.99Å
2325	H	91.3	Very high	83.5	Confident	56 Å²	56	48.5 Å²	48.5	26%	0.259	27%	0.269	S	S	.	.			trans	-70	145.3	170	-51.1	-79.2	0	0	0	110	L2327 V2440 K2442 I2444	H2325-L2327 HydrophobicContact CB-CD1 3.99Å; H2325-L2327 HydrophobicContact CB-CD2 3.96Å; H2325-L2327 HydrophobicContact CB-CG 3.79Å; H2325-V2440 PolarHBondContact CE1-O 2.92Å; H2325-V2440 VanDerWaalsContact CE1-O 3.25Å; H2325-V2440 PolarHBondContact NE2-O 2.82Å; H2325-K2442 PolarHBondContact CE1-O 3.14Å; H2325-K2442 PolarHBondContact ND1-O 2.86Å; H2325-I2444 CarbonylContact C-O 3.55Å; H2325-I2444 VanDerWaalsContact CA-O 3.32Å; H2325-I2444 WeakPolarHBondContact CA-O 3.44Å; H2325-I2444 PolarHBondContact ND1-N 3.45Å
2326	I	93.2	Very high	85	Confident	1 Å²	1	46.4 Å²	46.4	1%	0.005	25%	0.251	C	S	.	.	B	Isolated β-bridge	trans	-115	97.2	175.4	-52.4	-58.4	0	0	0	107.1	I2321 F2332 I2444 I2445 N2446 L2619 V2623	I2321-I2326 HydrophobicContact CD1-CD1 3.99Å; I2321-I2326 HydrophobicContact CG2-CD1 3.73Å; I2326-F2332 HydrophobicContact CD1-CZ 4.31Å; I2326-F2332 HydrophobicContact CG2-CE2 3.61Å; I2326-F2332 HydrophobicContact CG2-CZ 3.61Å; I2326-I2444 PolarHBondContact N-O 2.91Å; I2326-I2445 HydrophobicContact CB-CG1 4.45Å; I2326-I2445 HydrophobicContact CG1-CG1 4.43Å; I2326-N2446 WeakPolarHBondContact O-CB 3.2Å; I2326-N2446 PolarHBondContact O-N 3.07Å; I2326-L2619 HydrophobicContact CG1-CD1 4.44Å; I2326-V2623 HydrophobicContact CD1-CG2 4.27Å; I2326-V2623 HydrophobicContact CG1-CG2 3.82Å
2327	L	90	Very high	85.8	Confident	20 Å²	20	44.7 Å²	44.7	11%	0.105	24%	0.242	C	C	.	.			trans	-110.1	-36	-166.8	-57.9	176.5	0	0	0	111.7	H2325 D2331 I2432 A2436 N2446	H2325-L2327 HydrophobicContact CB-CD1 3.99Å; H2325-L2327 HydrophobicContact CB-CD2 3.96Å; H2325-L2327 HydrophobicContact CB-CG 3.79Å; L2327-D2331 PolarHBondContact N-OD2 2.98Å; L2327-I2432 HydrophobicContact CD2-CG2 3.9Å; L2327-A2436 HydrophobicContact CD1-CB 3.67Å; L2327-A2436 HydrophobicContact CD2-CB 3.85Å; L2327-A2436 HydrophobicContact CG-CB 4.43Å; L2327-N2446 WeakPolarHBondContact O-CB 3.48Å; L2327-N2446 PolarHBondContact O-ND2 3.17Å
2328	S	90	Very high	86	Confident	17 Å²	17	48.7 Å²	48.7	12%	0.119	26%	0.257	C	S	.	.	S	Bend	trans	-133.5	156.3	-176	175.4	0	0	0	0	111.8	E2330 D2331 E2453	S2328-E2330 PolarHBondContact O-N 2.82Å; S2328-E2330 WeakPolarHBondContact OG-CG 3.27Å; S2328-E2330 PolarHBondContact OG-N 3.24Å; S2328-D2331 PolarHBondContact N-OD2 2.8Å; S2328-D2331 WeakPolarHBondContact O-CB 3.12Å; S2328-D2331 PolarHBondContact O-N 3.37Å; S2328-E2453 VanDerWaalsContact OG-CD 3.26Å; S2328-E2453 PolarHBondContact OG-OE1 3.43Å; S2328-E2453 PolarHBondContact OG-OE2 3.16Å
2329	S	86.6	Confident	86.3	Confident	3 Å²	3	54.4 Å²	54.4	2%	0.021	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-60.7	-21	170.7	-79.3	0	0	0	0	112.3	D2331 F2332 E2453 S2491	S2329-D2331 VanDerWaalsContact C-N 3.26Å; S2329-D2331 PolarHBondContact O-N 3.11Å; S2329-F2332 PolarHBondContact O-N 3.18Å; S2329-E2453 PolarHBondContact N-OE2 3.12Å; S2329-S2491 VanDerWaalsContact OG-CB 3.3Å; S2329-S2491 WeakPolarHBondContact OG-CB 3.49Å; S2329-S2491 PolarHBondContact OG-O 2.93Å
2330	E	85.2	Confident	86.9	Confident	83 Å²	83	47.6 Å²	47.6	39%	0.388	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	-72.3	-17.9	-179.3	-54.7	-162.8	-151.2	0	0	113.7	S2328 F2332 R2494 Y2521	S2328-E2330 PolarHBondContact O-N 2.82Å; S2328-E2330 WeakPolarHBondContact OG-CG 3.27Å; S2328-E2330 PolarHBondContact OG-N 3.24Å; E2330-F2332 PolarHBondContact O-N 2.7Å; E2330-F2332 VanDerWaalsContact O-N 3.14Å; E2330-R2494 IonicContact OE1-CZ 2.91Å; E2330-R2494 IonicContact OE1-NH1 3.74Å; E2330-R2494 PolarHBondContact OE1-NH1 3.21Å; E2330-Y2521 VanDerWaalsContact CD-CE2 3.44Å; E2330-Y2521 HydrophobicContact CG-CE2 4.41Å; E2330-Y2521 WeakPolarHBondContact CG-OH 3.46Å; E2330-Y2521 VanDerWaalsContact OE1-CE2 3.24Å; E2330-Y2521 WeakPolarHBondContact OE1-CE2 3.26Å; E2330-Y2521 PolarHBondContact OE1-OH 3.31Å; E2330-Y2521 VanDerWaalsContact OE2-CE2 3.31Å; E2330-Y2521 WeakPolarHBondContact OE2-CE2 3.4Å; E2330-Y2521 PolarHBondContact OE2-OH 3.28Å
2331	D	86.3	Confident	87.3	Confident	64 Å²	64	45.1 Å²	45.1	34%	0.342	22%	0.22	S	C	.	.	G	3₁₀ helix	trans	-63.9	-17.9	176.1	-61.6	-29.3	0	0	0	111.7	I2321 L2327 S2328 S2329 H2336	I2321-D2331 HydrophobicContact CD1-CB 4.47Å; I2321-D2331 WeakPolarHBondContact CD1-O 3.2Å; L2327-D2331 PolarHBondContact N-OD2 2.98Å; S2328-D2331 PolarHBondContact N-OD2 2.8Å; S2328-D2331 WeakPolarHBondContact O-CB 3.12Å; S2328-D2331 PolarHBondContact O-N 3.37Å; S2329-D2331 VanDerWaalsContact C-N 3.26Å; S2329-D2331 PolarHBondContact O-N 3.11Å; D2331-H2336 PolarHBondContact O-ND1 3.49Å
2332	F	90.6	Very high	87.2	Confident	7 Å²	7	48.5 Å²	48.5	3%	0.031	24%	0.239	C	C	.	.			trans	-98.2	124.6	-177.1	-62.9	-83.8	0	0	0	112.5	I2321 I2326 S2329 E2330 H2336 L2337 L2340 L2459 L2495 L2498 L2619	I2321-F2332 HydrophobicContact CD1-CD1 4.16Å; I2321-F2332 HydrophobicContact CD1-CE1 4.02Å; I2321-F2332 HydrophobicContact CG1-CE1 4.45Å; I2326-F2332 HydrophobicContact CD1-CZ 4.31Å; I2326-F2332 HydrophobicContact CG2-CE2 3.61Å; I2326-F2332 HydrophobicContact CG2-CZ 3.61Å; S2329-F2332 PolarHBondContact O-N 3.18Å; E2330-F2332 PolarHBondContact O-N 2.7Å; E2330-F2332 VanDerWaalsContact O-N 3.14Å; F2332-H2336 HydrophobicContact CB-CB 4.5Å; F2332-H2336 HydrophobicContact CD1-CB 4.06Å; F2332-L2337 HydrophobicContact CB-CD2 3.81Å; F2332-L2337 HydrophobicContact CB-CG 4.24Å; F2332-L2337 HydrophobicContact CD1-CD2 4.12Å; F2332-L2337 HydrophobicContact CG-CD2 4.06Å; F2332-L2340 HydrophobicContact CE1-CD1 4.1Å; F2332-L2459 HydrophobicContact CD1-CD2 4.25Å; F2332-L2459 HydrophobicContact CD2-CD2 4.18Å; F2332-L2459 HydrophobicContact CE1-CD1 4.19Å; F2332-L2459 HydrophobicContact CE1-CD2 4.36Å; F2332-L2459 HydrophobicContact CE2-CD1 3.98Å; F2332-L2459 HydrophobicContact CE2-CD2 4.29Å; F2332-L2459 HydrophobicContact CE2-CG 4.46Å; F2332-L2459 HydrophobicContact CG-CD2 4.16Å; F2332-L2459 HydrophobicContact CZ-CD1 3.72Å; F2332-L2459 HydrophobicContact CZ-CD2 4.39Å; F2332-L2495 HydrophobicContact CB-CD1 4.17Å; F2332-L2498 WeakPolarHBondContact O-CD1 3.5Å; F2332-L2619 HydrophobicContact CE1-CD1 4.23Å; F2332-L2619 HydrophobicContact CZ-CD1 3.97Å
2333	S	86.6	Confident	87.3	Confident	45 Å²	45	48.6 Å²	48.6	32%	0.315	24%	0.238	S	C	.	.			trans	-86	166.5	164.1	75.6	0	0	0	0	111	D2335 H2336 L2337	S2333-D2335 PolarHBondContact O-N 2.91Å; S2333-D2335 PolarHBondContact OG-N 3.13Å; S2333-H2336 PolarHBondContact N-ND1 2.85Å; S2333-H2336 WeakPolarHBondContact O-CB 3.37Å; S2333-H2336 PolarHBondContact O-N 2.93Å; S2333-H2336 VanDerWaalsContact O-N 3.09Å; S2333-H2336 PolarHBondContact OG-CD2 3.05Å; S2333-H2336 VanDerWaalsContact OG-CD2 3.26Å; S2333-H2336 VanDerWaalsContact OG-CG 3.23Å; S2333-H2336 PolarHBondContact OG-N 3.27Å; S2333-L2337 PolarHBondContact O-N 3.43Å
2334	K	79.6	Confident	87.6	Confident	101 Å²	101	46.4 Å²	46.4	44%	0.439	22%	0.216	S	C	.	.	H	α-helix	trans	-59	-32.3	174.4	-164.8	174.1	-169	151.6	0	112.7	R2338 L2498	K2334-R2338 PolarHBondContact O-N 3.17Å; K2334-R2338 VanDerWaalsContact O-N 3.11Å; K2334-L2498 WeakPolarHBondContact CD-O 3.4Å; K2334-L2498 VanDerWaalsContact CE-O 3.31Å; K2334-L2498 WeakPolarHBondContact CE-O 3.2Å; K2334-L2498 PolarHBondContact NZ-O 2.93Å
2335	D	79.2	Confident	87.6	Confident	48 Å²	48	41.5 Å²	41.5	26%	0.257	20%	0.195	S	C	.	.	H	α-helix	trans	-71	-40.1	175	-166.1	48.1	0	0	0	111.7	S2333 L2337 R2338 R2339	S2333-D2335 PolarHBondContact O-N 2.91Å; S2333-D2335 PolarHBondContact OG-N 3.13Å; D2335-L2337 VanDerWaalsContact C-N 3.33Å; D2335-L2337 PolarHBondContact O-N 2.84Å; D2335-R2338 PolarHBondContact O-N 3.24Å; D2335-R2338 IonicContact OD1-CZ 3.08Å; D2335-R2338 IonicContact OD1-NE 2.94Å; D2335-R2338 PolarHBondContact OD1-NE 2.96Å; D2335-R2338 IonicContact OD1-NH2 3.79Å; D2335-R2338 PolarHBondContact OD1-NH2 2.96Å; D2335-R2339 PolarHBondContact O-N 3.23Å; D2335-R2339 VanDerWaalsContact O-N 3.08Å; D2335-R2339 IonicContact OD1-NE 2.81Å; D2335-R2339 IonicContact OD2-CZ 3.01Å; D2335-R2339 VanDerWaalsContact OD2-CZ 3.31Å; D2335-R2339 IonicContact OD2-NE 3.25Å; D2335-R2339 PolarHBondContact OD2-NE 2.83Å; D2335-R2339 IonicContact OD2-NH2 2.78Å; D2335-R2339 PolarHBondContact OD2-NH2 3.46Å
2336	H	88.7	Confident	87.2	Confident	35 Å²	35	41.6 Å²	41.6	16%	0.162	20%	0.201	C	C	.	.	H	α-helix	trans	-57.8	-47.4	174.9	-60.8	168.1	0	0	0	110.9	L2318 E2319 D2331 F2332 S2333 R2338 R2339 L2340	L2318-H2336 HydrophobicContact CD2-CB 3.76Å; E2319-H2336 PolarHBondContact O-NE2 3.5Å; D2331-H2336 PolarHBondContact O-ND1 3.49Å; F2332-H2336 HydrophobicContact CB-CB 4.5Å; F2332-H2336 HydrophobicContact CD1-CB 4.06Å; S2333-H2336 PolarHBondContact N-ND1 2.85Å; S2333-H2336 WeakPolarHBondContact O-CB 3.37Å; S2333-H2336 PolarHBondContact O-N 2.93Å; S2333-H2336 VanDerWaalsContact O-N 3.09Å; S2333-H2336 PolarHBondContact OG-CD2 3.05Å; S2333-H2336 VanDerWaalsContact OG-CD2 3.26Å; S2333-H2336 VanDerWaalsContact OG-CG 3.23Å; S2333-H2336 PolarHBondContact OG-N 3.27Å; H2336-R2338 PolarHBondContact O-N 2.92Å; H2336-R2339 PolarHBondContact O-N 2.98Å; H2336-L2340 VanDerWaalsContact O-CB 3.24Å; H2336-L2340 WeakPolarHBondContact O-CB 3.49Å; H2336-L2340 PolarHBondContact O-N 3.45Å
2337	L	88.5	Confident	87.1	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-62	-44.3	178.3	-66.4	-168.1	0	0	0	112.8	F2332 S2333 D2335 R2339 L2340 Y2341 L2459 L2495 L2498 Y2499	F2332-L2337 HydrophobicContact CB-CD2 3.81Å; F2332-L2337 HydrophobicContact CB-CG 4.24Å; F2332-L2337 HydrophobicContact CD1-CD2 4.12Å; F2332-L2337 HydrophobicContact CG-CD2 4.06Å; S2333-L2337 PolarHBondContact O-N 3.43Å; D2335-L2337 VanDerWaalsContact C-N 3.33Å; D2335-L2337 PolarHBondContact O-N 2.84Å; L2337-R2339 VanDerWaalsContact C-N 3.34Å; L2337-R2339 PolarHBondContact O-N 3.04Å; L2337-L2340 PolarHBondContact O-N 2.89Å; L2337-Y2341 HydrophobicContact CB-CD2 4.21Å; L2337-Y2341 HydrophobicContact CB-CE2 3.8Å; L2337-Y2341 HydrophobicContact CD1-CE2 4.28Å; L2337-Y2341 HydrophobicContact CD2-CE2 4.36Å; L2337-Y2341 HydrophobicContact CG-CE2 4.38Å; L2337-Y2341 VanDerWaalsContact O-CB 3.3Å; L2337-Y2341 WeakPolarHBondContact O-CB 3.22Å; L2337-Y2341 WeakPolarHBondContact O-CD2 3.17Å; L2337-Y2341 PolarHBondContact O-N 3.17Å; L2337-L2459 HydrophobicContact CD2-CD2 3.21Å; L2337-L2495 HydrophobicContact CD1-CD1 3.96Å; L2337-L2495 HydrophobicContact CD1-CD2 4.34Å; L2337-L2495 HydrophobicContact CD1-CG 4.01Å; L2337-L2495 HydrophobicContact CD2-CD1 4.2Å; L2337-L2498 HydrophobicContact CD1-CD1 3.52Å; L2337-L2498 HydrophobicContact CG-CD1 4.17Å; L2337-Y2499 HydrophobicContact CD1-CE2 3.81Å
2338	R	82.9	Confident	86.9	Confident	150 Å²	150	42.3 Å²	42.3	57%	0.566	20%	0.204	S	C	*	.	H	α-helix	trans	-57	-48.7	178.1	179.9	174	63.3	172.8	2.3	111.2	K2334 D2335 H2336 N2342	K2334-R2338 PolarHBondContact O-N 3.17Å; K2334-R2338 VanDerWaalsContact O-N 3.11Å; D2335-R2338 PolarHBondContact O-N 3.24Å; D2335-R2338 IonicContact OD1-CZ 3.08Å; D2335-R2338 IonicContact OD1-NE 2.94Å; D2335-R2338 PolarHBondContact OD1-NE 2.96Å; D2335-R2338 IonicContact OD1-NH2 3.79Å; D2335-R2338 PolarHBondContact OD1-NH2 2.96Å; H2336-R2338 PolarHBondContact O-N 2.92Å; R2338-N2342 WeakPolarHBondContact O-CB 3.45Å; R2338-N2342 PolarHBondContact O-N 2.85Å; R2338-N2342 PolarHBondContact O-ND2 3.45Å; R2338-N2342 PolarHBondContact O-OD1 2.81Å
2339	R	84.6	Confident	86.2	Confident	125 Å²	125	43.9 Å²	43.9	47%	0.472	21%	0.213	S	C	.	.	H	α-helix	trans	-67.4	-45.8	179.6	-68.7	-176.4	-166.3	-160	10.5	112	L2318 D2335 H2336 L2337 Y2341 N2342 L2343	L2318-R2339 HydrophobicContact CD1-CB 3.46Å; L2318-R2339 VanDerWaalsContact CD1-CB 3.46Å; L2318-R2339 VanDerWaalsContact CD1-CD 3.47Å; L2318-R2339 HydrophobicContact CD1-CG 4.1Å; D2335-R2339 PolarHBondContact O-N 3.23Å; D2335-R2339 VanDerWaalsContact O-N 3.08Å; D2335-R2339 IonicContact OD1-NE 2.81Å; D2335-R2339 IonicContact OD2-CZ 3.01Å; D2335-R2339 VanDerWaalsContact OD2-CZ 3.31Å; D2335-R2339 IonicContact OD2-NE 3.25Å; D2335-R2339 PolarHBondContact OD2-NE 2.83Å; D2335-R2339 IonicContact OD2-NH2 2.78Å; D2335-R2339 PolarHBondContact OD2-NH2 3.46Å; H2336-R2339 PolarHBondContact O-N 2.98Å; L2337-R2339 VanDerWaalsContact C-N 3.34Å; L2337-R2339 PolarHBondContact O-N 3.04Å; R2339-Y2341 PolarHBondContact O-N 3.25Å; R2339-N2342 PolarHBondContact O-N 2.85Å; R2339-L2343 PolarHBondContact O-N 2.86Å
2340	L	91.8	Very high	85.7	Confident	1 Å²	1	44.4 Å²	44.4	1%	0.005	22%	0.217	C	C	.	.	H	α-helix	trans	-61.1	-44.5	178.8	-177.6	143.7	0	0	0	112.1	F2332 H2336 L2337 L2343 A2344 L2459 V2615 A2618 L2619 I2622	F2332-L2340 HydrophobicContact CE1-CD1 4.1Å; H2336-L2340 VanDerWaalsContact O-CB 3.24Å; H2336-L2340 WeakPolarHBondContact O-CB 3.49Å; H2336-L2340 PolarHBondContact O-N 3.45Å; L2337-L2340 PolarHBondContact O-N 2.89Å; L2340-L2343 PolarHBondContact O-N 3.18Å; L2340-A2344 WeakPolarHBondContact O-CB 3.49Å; L2340-A2344 PolarHBondContact O-N 2.75Å; L2340-L2459 HydrophobicContact CD1-CD1 4.34Å; L2340-V2615 HydrophobicContact CD2-CG1 4.04Å; L2340-A2618 HydrophobicContact CG-CB 4.38Å; L2340-L2619 HydrophobicContact CD1-CB 4.22Å; L2340-L2619 HydrophobicContact CD1-CD1 3.77Å; L2340-I2622 HydrophobicContact CB-CD1 4.03Å; L2340-I2622 HydrophobicContact CD1-CD1 4.07Å; L2340-I2622 HydrophobicContact CG-CD1 4.11Å
2341	Y	90.9	Very high	85.3	Confident	1 Å²	1	41.5 Å²	41.5	0%	0.004	20%	0.204	C	C	.	.	H	α-helix	trans	-71	-33.8	177.8	-64.6	-27.5	0	0	0	113.1	L2337 R2339 L2343 A2344 H2345 L2459 V2462 F2463	L2337-Y2341 HydrophobicContact CB-CD2 4.21Å; L2337-Y2341 HydrophobicContact CB-CE2 3.8Å; L2337-Y2341 HydrophobicContact CD1-CE2 4.28Å; L2337-Y2341 HydrophobicContact CD2-CE2 4.36Å; L2337-Y2341 HydrophobicContact CG-CE2 4.38Å; L2337-Y2341 VanDerWaalsContact O-CB 3.3Å; L2337-Y2341 WeakPolarHBondContact O-CB 3.22Å; L2337-Y2341 WeakPolarHBondContact O-CD2 3.17Å; L2337-Y2341 PolarHBondContact O-N 3.17Å; R2339-Y2341 PolarHBondContact O-N 3.25Å; Y2341-L2343 VanDerWaalsContact C-N 3.31Å; Y2341-A2344 PolarHBondContact O-N 3.18Å; Y2341-H2345 VanDerWaalsContact O-CB 3.28Å; Y2341-H2345 WeakPolarHBondContact O-CB 3.35Å; Y2341-H2345 PolarHBondContact O-N 3.47Å; Y2341-L2459 HydrophobicContact CE1-CB 4.44Å; Y2341-L2459 WeakPolarHBondContact CE1-O 3.28Å; Y2341-L2459 PolarHBondContact OH-O 3.02Å; Y2341-L2459 VanDerWaalsContact OH-O 3.11Å; Y2341-V2462 HydrophobicContact CE2-CB 4.33Å; Y2341-V2462 HydrophobicContact CE2-CG1 3.66Å; Y2341-V2462 WeakPolarHBondContact OH-CB 3.49Å; Y2341-F2463 HydrophobicContact CD1-CB 3.83Å; Y2341-F2463 AromaticContact CD1-CD2 3.61Å; Y2341-F2463 HydrophobicContact CD1-CD2 3.61Å; Y2341-F2463 HydrophobicContact CD1-CG 4.12Å; Y2341-F2463 HydrophobicContact CE1-CB 3.84Å; Y2341-F2463 HydrophobicContact CE1-CD2 4.47Å; Y2341-F2463 AromaticContact CG-CD2 3.82Å; Y2341-F2463 HydrophobicContact CG-CD2 3.82Å; Y2341-F2463 WeakPolarHBondContact O-CE2 3.31Å
2342	N	84.9	Confident	84.7	Confident	74 Å²	74	43.2 Å²	43.2	40%	0.396	21%	0.213	S	C	.	.	H	α-helix	trans	-64.7	-40.3	172.3	-70.9	-6	0	0	0	110.8	R2338 R2339 S2346 R2466	R2338-N2342 WeakPolarHBondContact O-CB 3.45Å; R2338-N2342 PolarHBondContact O-N 2.85Å; R2338-N2342 PolarHBondContact O-ND2 3.45Å; R2338-N2342 PolarHBondContact O-OD1 2.81Å; R2339-N2342 PolarHBondContact O-N 2.85Å; N2342-S2346 WeakPolarHBondContact O-CB 3.49Å; N2342-S2346 PolarHBondContact O-N 3.38Å; N2342-S2346 PolarHBondContact O-OG 3.44Å; N2342-R2466 PolarHBondContact OD1-NH1 2.89Å; N2342-R2466 PolarHBondContact OD1-NH2 3.16Å
2343	L	89.5	Confident	83.6	Confident	17 Å²	17	49.3 Å²	49.3	9%	0.089	24%	0.24	C	C	.	.	H	α-helix	trans	-66.1	-43.6	174.6	-173.1	62.8	0	0	0	111.8	I2316 R2339 L2340 Y2341 H2345 S2346 F2347 A2618 A2621 I2622	I2316-L2343 HydrophobicContact CG2-CD2 4.31Å; R2339-L2343 PolarHBondContact O-N 2.86Å; L2340-L2343 PolarHBondContact O-N 3.18Å; Y2341-L2343 VanDerWaalsContact C-N 3.31Å; L2343-H2345 PolarHBondContact O-N 2.9Å; L2343-S2346 WeakPolarHBondContact O-CB 3.31Å; L2343-S2346 PolarHBondContact O-N 3.29Å; L2343-S2346 VanDerWaalsContact O-N 3.13Å; L2343-F2347 HydrophobicContact CD1-CE1 3.96Å; L2343-F2347 HydrophobicContact CD1-CE2 4.17Å; L2343-F2347 HydrophobicContact CD1-CZ 3.73Å; L2343-F2347 HydrophobicContact CD2-CE2 4.19Å; L2343-F2347 HydrophobicContact CD2-CZ 4.29Å; L2343-F2347 HydrophobicContact CG-CD2 4.33Å; L2343-F2347 HydrophobicContact CG-CE2 3.85Å; L2343-F2347 HydrophobicContact CG-CZ 3.93Å; L2343-F2347 PolarHBondContact O-N 2.86Å; L2343-A2618 HydrophobicContact CB-CB 3.98Å; L2343-A2618 HydrophobicContact CD2-CB 4Å; L2343-A2618 HydrophobicContact CG-CB 3.91Å; L2343-A2621 HydrophobicContact CD2-CB 4.41Å; L2343-I2622 HydrophobicContact CD2-CD1 4Å; L2343-I2622 HydrophobicContact CD2-CG1 3.83Å
2344	A	90.6	Very high	82.8	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-61.5	-44.3	176.8	0	0	0	0	0	111.8	L2340 Y2341 S2346 F2347 K2348 F2463 V2615 A2618	L2340-A2344 WeakPolarHBondContact O-CB 3.49Å; L2340-A2344 PolarHBondContact O-N 2.75Å; Y2341-A2344 PolarHBondContact O-N 3.18Å; A2344-S2346 VanDerWaalsContact C-N 3.33Å; A2344-S2346 PolarHBondContact O-N 2.85Å; A2344-F2347 PolarHBondContact O-N 3.02Å; A2344-K2348 PolarHBondContact O-N 2.83Å; A2344-F2463 HydrophobicContact CB-CD2 4.36Å; A2344-F2463 HydrophobicContact CB-CE2 3.95Å; A2344-F2463 HydrophobicContact CB-CZ 4.15Å; A2344-V2615 HydrophobicContact CB-CG2 3.99Å; A2344-A2618 HydrophobicContact CB-CB 3.81Å
2345	H	88.1	Confident	82.3	Confident	24 Å²	24	55 Å²	55	11%	0.111	27%	0.265	C	S	.	.	H	α-helix	trans	-60.9	-42.9	172.6	-170.6	83.5	0	0	0	111.5	Y1677 L1681 Y2341 L2343 F2347 K2348 V2349 F2463 E2467	Y1677-H2345 AromaticContact CE1-CE1 3.56Å; L1681-H2345 WeakPolarHBondContact CD1-NE2 3.08Å; Y2341-H2345 VanDerWaalsContact O-CB 3.28Å; Y2341-H2345 WeakPolarHBondContact O-CB 3.35Å; Y2341-H2345 PolarHBondContact O-N 3.47Å; L2343-H2345 PolarHBondContact O-N 2.9Å; H2345-F2347 VanDerWaalsContact C-N 3.29Å; H2345-F2347 PolarHBondContact O-N 3.15Å; H2345-K2348 WeakPolarHBondContact O-CB 3.35Å; H2345-K2348 PolarHBondContact O-N 2.86Å; H2345-V2349 WeakPolarHBondContact NE2-CG2 3.2Å; H2345-V2349 WeakPolarHBondContact O-CG2 3.37Å; H2345-V2349 PolarHBondContact O-N 2.95Å; H2345-F2463 HydrophobicContact CB-CE2 4.13Å; H2345-F2463 HydrophobicContact CB-CZ 4.2Å; H2345-E2467 IonicContact CE1-OE1 3.99Å; H2345-E2467 IonicContact CE1-OE2 2.66Å; H2345-E2467 IonicContact CG-OE1 2.75Å; H2345-E2467 IonicContact ND1-OE1 3.49Å; H2345-E2467 PolarHBondContact ND1-OE1 2.81Å; H2345-E2467 IonicContact ND1-OE2 3.49Å; H2345-E2467 PolarHBondContact ND1-OE2 3.32Å
2346	S	84.5	Confident	82.2	Confident	58 Å²	58	57.7 Å²	57.7	41%	0.406	29%	0.285	S	S	.	.	H	α-helix	trans	-59.2	-41.5	176.2	-54.7	0	0	0	0	111.6	N2342 L2343 A2344 V2349 A2350	N2342-S2346 WeakPolarHBondContact O-CB 3.49Å; N2342-S2346 PolarHBondContact O-N 3.38Å; N2342-S2346 PolarHBondContact O-OG 3.44Å; L2343-S2346 WeakPolarHBondContact O-CB 3.31Å; L2343-S2346 PolarHBondContact O-N 3.29Å; L2343-S2346 VanDerWaalsContact O-N 3.13Å; A2344-S2346 VanDerWaalsContact C-N 3.33Å; A2344-S2346 PolarHBondContact O-N 2.85Å; S2346-V2349 PolarHBondContact O-N 3.43Å; S2346-A2350 VanDerWaalsContact O-CB 3.29Å; S2346-A2350 WeakPolarHBondContact O-CB 3.14Å; S2346-A2350 PolarHBondContact O-N 3.19Å
2347	F	89.7	Confident	82.1	Confident	7 Å²	7	57.2 Å²	57.2	3%	0.031	28%	0.284	C	S	.	.	H	α-helix	trans	-69.8	-38.9	175.6	-68	-22.9	0	0	0	113.2	L2343 A2344 H2345 V2349 A2350 L2351 L2357 I2360 L2388 M2617 A2618 A2621	L2343-F2347 HydrophobicContact CD1-CE1 3.96Å; L2343-F2347 HydrophobicContact CD1-CE2 4.17Å; L2343-F2347 HydrophobicContact CD1-CZ 3.73Å; L2343-F2347 HydrophobicContact CD2-CE2 4.19Å; L2343-F2347 HydrophobicContact CD2-CZ 4.29Å; L2343-F2347 HydrophobicContact CG-CD2 4.33Å; L2343-F2347 HydrophobicContact CG-CE2 3.85Å; L2343-F2347 HydrophobicContact CG-CZ 3.93Å; L2343-F2347 PolarHBondContact O-N 2.86Å; A2344-F2347 PolarHBondContact O-N 3.02Å; H2345-F2347 VanDerWaalsContact C-N 3.29Å; H2345-F2347 PolarHBondContact O-N 3.15Å; F2347-V2349 VanDerWaalsContact C-N 3.33Å; F2347-V2349 PolarHBondContact O-N 2.96Å; F2347-A2350 PolarHBondContact O-N 2.97Å; F2347-L2351 WeakPolarHBondContact O-CB 3.22Å; F2347-L2351 VanDerWaalsContact O-CG 3.25Å; F2347-L2351 WeakPolarHBondContact O-CG 3.4Å; F2347-L2351 PolarHBondContact O-N 3.2Å; F2347-L2357 HydrophobicContact CB-CD1 4.14Å; F2347-L2357 HydrophobicContact CD1-CD1 3.6Å; F2347-L2357 HydrophobicContact CD1-CD2 4.02Å; F2347-L2357 HydrophobicContact CD1-CG 4.44Å; F2347-L2357 HydrophobicContact CE1-CD1 4.27Å; F2347-L2357 HydrophobicContact CE1-CD2 4.11Å; F2347-L2357 HydrophobicContact CG-CD1 4.04Å; F2347-I2360 HydrophobicContact CE1-CD1 3.48Å; F2347-I2360 VanDerWaalsContact CE1-CD1 3.48Å; F2347-I2360 HydrophobicContact CZ-CD1 3.53Å; F2347-L2388 HydrophobicContact CE2-CD2 3.99Å; F2347-L2388 HydrophobicContact CZ-CD2 4Å; F2347-M2617 HydrophobicContact CB-CE 4.22Å; F2347-M2617 HydrophobicContact CD2-CB 3.56Å; F2347-M2617 HydrophobicContact CD2-CE 4.33Å; F2347-M2617 HydrophobicContact CE2-CB 4.03Å; F2347-M2617 HydrophobicContact CG-CB 4.46Å; F2347-M2617 HydrophobicContact CG-CE 4.26Å; F2347-A2618 HydrophobicContact CD2-CB 4.27Å; F2347-A2618 HydrophobicContact CE2-CB 4.35Å; F2347-A2621 HydrophobicContact CE2-CB 4.06Å; F2347-A2621 HydrophobicContact CZ-CB 4.14Å
2348	K	86.5	Confident	81.9	Confident	28 Å²	28	60.6 Å²	60.6	12%	0.122	30%	0.302	C	S	.	.	H	α-helix	trans	-56.4	-49	171.1	176.9	-179.6	172.8	-178.1	0	110.7	A2344 H2345 L2351 N2352 E2467 Y2611 H2614	A2344-K2348 PolarHBondContact O-N 2.83Å; H2345-K2348 WeakPolarHBondContact O-CB 3.35Å; H2345-K2348 PolarHBondContact O-N 2.86Å; K2348-L2351 PolarHBondContact O-N 2.99Å; K2348-N2352 VanDerWaalsContact O-CB 3.31Å; K2348-N2352 WeakPolarHBondContact O-CB 3.1Å; K2348-N2352 PolarHBondContact O-N 3.1Å; K2348-E2467 IonicContact NZ-OE2 3.6Å; K2348-E2467 PolarHBondContact NZ-OE2 2.79Å; K2348-Y2611 HydrophobicContact CD-CD1 4.4Å; K2348-Y2611 HydrophobicContact CD-CE1 4.19Å; K2348-Y2611 PolarHBondContact NZ-OH 3.17Å; K2348-H2614 HydrophobicContact CB-CB 4.29Å
2349	V	75.2	Confident	81.8	Confident	51 Å²	51	61 Å²	61	31%	0.309	31%	0.31	S	S	.	.	H	α-helix	trans	-63.7	-42.6	177.7	173.2	0	0	0	0	111.4	H2345 S2346 F2347 K2353	H2345-V2349 WeakPolarHBondContact NE2-CG2 3.2Å; H2345-V2349 WeakPolarHBondContact O-CG2 3.37Å; H2345-V2349 PolarHBondContact O-N 2.95Å; S2346-V2349 PolarHBondContact O-N 3.43Å; F2347-V2349 VanDerWaalsContact C-N 3.33Å; F2347-V2349 PolarHBondContact O-N 2.96Å; V2349-K2353 HydrophobicContact CG1-CD 4.02Å; V2349-K2353 WeakPolarHBondContact O-CB 3.46Å; V2349-K2353 VanDerWaalsContact O-CG 3.25Å; V2349-K2353 WeakPolarHBondContact O-CG 3.29Å; V2349-K2353 PolarHBondContact O-N 3.47Å
2350	A	76.7	Confident	81.9	Confident	14 Å²	14	57.4 Å²	57.4	12%	0.116	30%	0.3	C	S	.	.	H	α-helix	trans	-63	-45.6	177.6	0	0	0	0	0	111.8	S2346 F2347 K2353 N2354 K2355 L2357	S2346-A2350 VanDerWaalsContact O-CB 3.29Å; S2346-A2350 WeakPolarHBondContact O-CB 3.14Å; S2346-A2350 PolarHBondContact O-N 3.19Å; F2347-A2350 PolarHBondContact O-N 2.97Å; A2350-K2353 CarbonylContact O-C 3.33Å; A2350-K2353 VanDerWaalsContact O-C 3.27Å; A2350-K2353 WeakPolarHBondContact O-CA 3.06Å; A2350-K2353 PolarHBondContact O-N 2.65Å; A2350-K2353 VanDerWaalsContact O-N 3.13Å; A2350-N2354 PolarHBondContact O-N 2.98Å; A2350-N2354 VanDerWaalsContact O-N 3.1Å; A2350-K2355 HydrophobicContact CB-CB 4.1Å; A2350-K2355 PolarHBondContact O-N 2.67Å; A2350-L2357 HydrophobicContact CB-CD1 3.94Å; A2350-L2357 HydrophobicContact CB-CD2 4.06Å; A2350-L2357 HydrophobicContact CB-CG 4.25Å
2351	L	76.8	Confident	81.8	Confident	21 Å²	21	57.5 Å²	57.5	11%	0.11	30%	0.3	C	S	.	.	H	α-helix	trans	-67	-40.7	177.7	-71.1	170.6	0	0	0	112.5	F2347 K2348 K2353 N2354 L2357 R2387 M2617	F2347-L2351 WeakPolarHBondContact O-CB 3.22Å; F2347-L2351 VanDerWaalsContact O-CG 3.25Å; F2347-L2351 WeakPolarHBondContact O-CG 3.4Å; F2347-L2351 PolarHBondContact O-N 3.2Å; K2348-L2351 PolarHBondContact O-N 2.99Å; L2351-K2353 PolarHBondContact O-N 3.46Å; L2351-N2354 PolarHBondContact O-N 3.13Å; L2351-N2354 PolarHBondContact O-OD1 3.49Å; L2351-L2357 HydrophobicContact CD2-CD1 4.27Å; L2351-L2357 HydrophobicContact CG-CD1 4.19Å; L2351-R2387 HydrophobicContact CD2-CG 4.49Å; L2351-M2617 HydrophobicContact CD1-CE 3.87Å; L2351-M2617 HydrophobicContact CD1-SD 3.48Å; L2351-M2617 WeakPolarHBondContact CD1-SD 3.39Å; L2351-M2617 HydrophobicContact CD2-CE 4.44Å; L2351-M2617 HydrophobicContact CG-CE 4.34Å
2352	N	72.6	Confident	81.7	Confident	100 Å²	100	66.5 Å²	66.5	54%	0.535	33%	0.334	S	S	.	.	H	α-helix	trans	-65.6	-21	173.9	-71.7	-7.9	0	0	0	112.4	K2348	K2348-N2352 VanDerWaalsContact O-CB 3.31Å; K2348-N2352 WeakPolarHBondContact O-CB 3.1Å; K2348-N2352 PolarHBondContact O-N 3.1Å
2353	K	67.1	Low	81.8	Confident	136 Å²	136	66 Å²	66	59%	0.591	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.5	12.4	171.8	-68.5	-179.9	178.6	-174.8	0	112.8	V2349 A2350 L2351 K2355	V2349-K2353 HydrophobicContact CG1-CD 4.02Å; V2349-K2353 WeakPolarHBondContact O-CB 3.46Å; V2349-K2353 VanDerWaalsContact O-CG 3.25Å; V2349-K2353 WeakPolarHBondContact O-CG 3.29Å; V2349-K2353 PolarHBondContact O-N 3.47Å; A2350-K2353 CarbonylContact O-C 3.33Å; A2350-K2353 VanDerWaalsContact O-C 3.27Å; A2350-K2353 WeakPolarHBondContact O-CA 3.06Å; A2350-K2353 PolarHBondContact O-N 2.65Å; A2350-K2353 VanDerWaalsContact O-N 3.13Å; L2351-K2353 PolarHBondContact O-N 3.46Å; K2353-K2355 HydrophobicContact CB-CG 4.43Å; K2353-K2355 PolarHBondContact O-N 2.64Å
2354	N	70	Confident	82	Confident	137 Å²	137	68 Å²	68	73%	0.733	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.4	27.3	-176.4	-71.1	-29.1	0	0	0	115	A2350 L2351	A2350-N2354 PolarHBondContact O-N 2.98Å; A2350-N2354 VanDerWaalsContact O-N 3.1Å; L2351-N2354 PolarHBondContact O-N 3.13Å; L2351-N2354 PolarHBondContact O-OD1 3.49Å
2355	K	70.3	Confident	82.1	Confident	128 Å²	128	69.7 Å²	69.7	56%	0.557	37%	0.365	S	S	*	.			trans	-71.3	127.2	175	-74.7	-168.1	173.3	-167.6	0	109.7	A2350 K2353 L2357	A2350-K2355 HydrophobicContact CB-CB 4.1Å; A2350-K2355 PolarHBondContact O-N 2.67Å; K2353-K2355 HydrophobicContact CB-CG 4.43Å; K2353-K2355 PolarHBondContact O-N 2.64Å; K2355-L2357 PolarHBondContact O-N 3.03Å
2356	P	76.9	Confident	82.6	Confident	105 Å²	105	68.5 Å²	68.5	68%	0.682	36%	0.36	S	S	*	.			trans	-65.4	132.6	174.3	26.5	-32	0	0	0	109.9
2357	L	86.4	Confident	82.9	Confident	25 Å²	25	65.8 Å²	65.8	13%	0.131	34%	0.341	C	S	.	.			trans	-117.9	12.3	178	-65.4	170.8	0	0	0	111.4	F2347 A2350 L2351 K2355 Q2359 I2360 R2387 L2388 M2617	F2347-L2357 HydrophobicContact CB-CD1 4.14Å; F2347-L2357 HydrophobicContact CD1-CD1 3.6Å; F2347-L2357 HydrophobicContact CD1-CD2 4.02Å; F2347-L2357 HydrophobicContact CD1-CG 4.44Å; F2347-L2357 HydrophobicContact CE1-CD1 4.27Å; F2347-L2357 HydrophobicContact CE1-CD2 4.11Å; F2347-L2357 HydrophobicContact CG-CD1 4.04Å; A2350-L2357 HydrophobicContact CB-CD1 3.94Å; A2350-L2357 HydrophobicContact CB-CD2 4.06Å; A2350-L2357 HydrophobicContact CB-CG 4.25Å; L2351-L2357 HydrophobicContact CD2-CD1 4.27Å; L2351-L2357 HydrophobicContact CG-CD1 4.19Å; K2355-L2357 PolarHBondContact O-N 3.03Å; L2357-Q2359 PolarHBondContact O-N 2.73Å; L2357-Q2359 VanDerWaalsContact O-N 3.12Å; L2357-I2360 HydrophobicContact CB-CD1 4.3Å; L2357-I2360 HydrophobicContact CD2-CD1 4.15Å; L2357-I2360 WeakPolarHBondContact O-CG1 3.35Å; L2357-I2360 PolarHBondContact O-N 3.49Å; L2357-R2387 CarbonylContact C-O 3.6Å; L2357-L2388 HydrophobicContact CB-CD2 4.25Å; L2357-L2388 CarbonylContact O-C 3.47Å; L2357-L2388 WeakPolarHBondContact O-CA 3.3Å; L2357-M2617 HydrophobicContact CB-CE 4.47Å; L2357-M2617 HydrophobicContact CD1-CE 3.55Å
2358	D	83.5	Confident	83.1	Confident	71 Å²	71	65.5 Å²	65.5	38%	0.38	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70	-5	-172.1	67.2	-39.5	0	0	0	114.4	R2362 L2388 G2389	D2358-R2362 WeakPolarHBondContact O-CB 3.46Å; D2358-L2388 CarbonylContact C-O 3.58Å; D2358-L2388 VanDerWaalsContact CA-C 3.48Å; D2358-G2389 VanDerWaalsContact O-CA 3.31Å; D2358-G2389 WeakPolarHBondContact O-CA 3.17Å
2359	Q	80.7	Confident	83.4	Confident	159 Å²	159	64.1 Å²	64.1	74%	0.743	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-19.5	176.5	-60.4	-173.4	7.9	0	0	113	L2357	L2357-Q2359 PolarHBondContact O-N 2.73Å; L2357-Q2359 VanDerWaalsContact O-N 3.12Å
2360	I	87.3	Confident	84.1	Confident	49 Å²	49	62.5 Å²	62.5	25%	0.251	32%	0.323	S	S	.	.	S	Bend	trans	-71.1	-44.6	-167.6	-63.2	178.6	0	0	0	112.1	I2316 F2347 L2357 L2388 A2621	I2316-I2360 HydrophobicContact CD1-CG2 4.06Å; F2347-I2360 HydrophobicContact CE1-CD1 3.48Å; F2347-I2360 VanDerWaalsContact CE1-CD1 3.48Å; F2347-I2360 HydrophobicContact CZ-CD1 3.53Å; L2357-I2360 HydrophobicContact CB-CD1 4.3Å; L2357-I2360 HydrophobicContact CD2-CD1 4.15Å; L2357-I2360 WeakPolarHBondContact O-CG1 3.35Å; L2357-I2360 PolarHBondContact O-N 3.49Å; I2360-L2388 HydrophobicContact CB-CB 4.44Å; I2360-L2388 HydrophobicContact CB-CD2 3.99Å; I2360-L2388 HydrophobicContact CD1-CD2 3.8Å; I2360-L2388 HydrophobicContact CG1-CD2 4.39Å; I2360-L2388 HydrophobicContact CG2-CD2 4.16Å; I2360-L2388 PolarHBondContact N-O 2.83Å; I2360-A2621 HydrophobicContact CG2-CB 3.75Å
2361	C	90.2	Very high	84.5	Confident	2 Å²	2	62.5 Å²	62.5	1%	0.014	32%	0.32	C	S	.	.	S	Bend	trans	-115.1	21.6	179.1	-64.6	0	0	0	0	111.9	G2363 K2364 M2385 L2388 G2390	C2361-G2363 PolarHBondContact O-N 2.86Å; C2361-K2364 HydrophobicContact CB-CB 4.33Å; C2361-K2364 HydrophobicContact CB-CG 4.42Å; C2361-K2364 VanDerWaalsContact O-CB 3.3Å; C2361-K2364 WeakPolarHBondContact O-CB 3.33Å; C2361-K2364 PolarHBondContact O-N 2.86Å; C2361-M2385 HydrophobicContact CB-CE 4.29Å; C2361-M2385 HydrophobicContact CB-SD 4.2Å; C2361-L2388 WeakPolarHBondContact CA-O 3.33Å; C2361-L2388 HydrophobicContact CB-CB 3.82Å; C2361-L2388 PolarHBondContact N-O 3Å; C2361-G2390 VanDerWaalsContact O-CA 3.31Å; C2361-G2390 WeakPolarHBondContact O-CA 3.29Å; C2361-G2390 PolarHBondContact O-N 3.16Å
2362	R	88.8	Confident	84.8	Confident	190 Å²	190	62.8 Å²	62.8	72%	0.717	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	125.5	-178.9	-165.8	173.6	179.5	178.6	1.2	111	D2358 K2364 G2389	D2358-R2362 WeakPolarHBondContact O-CB 3.46Å; R2362-K2364 VanDerWaalsContact C-N 3.27Å; R2362-K2364 PolarHBondContact O-N 2.86Å; R2362-G2389 WeakPolarHBondContact CA-O 3.2Å
2363	G	86.8	Confident	85.2	Confident	65 Å²	65	63.4 Å²	63.4	67%	0.67	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.4	2.1	-179.7	0	0	0	0	0	115.2	C2361	C2361-G2363 PolarHBondContact O-N 2.86Å
2364	K	92.6	Very high	86.1	Confident	57 Å²	57	58.1 Å²	58.1	25%	0.248	31%	0.31	C	S	.	.			trans	-85	144.4	171.5	-59.1	-62.3	-172.5	177.5	0	111	C2361 R2362 M2385 G2390 T2391 D2420 L2624	C2361-K2364 HydrophobicContact CB-CB 4.33Å; C2361-K2364 HydrophobicContact CB-CG 4.42Å; C2361-K2364 VanDerWaalsContact O-CB 3.3Å; C2361-K2364 WeakPolarHBondContact O-CB 3.33Å; C2361-K2364 PolarHBondContact O-N 2.86Å; R2362-K2364 VanDerWaalsContact C-N 3.27Å; R2362-K2364 PolarHBondContact O-N 2.86Å; K2364-M2385 HydrophobicContact CB-CE 3.53Å; K2364-M2385 WeakPolarHBondContact O-CE 3.45Å; K2364-G2390 CarbonylContact O-C 3.48Å; K2364-G2390 WeakPolarHBondContact O-CA 3.48Å; K2364-T2391 PolarHBondContact O-N 2.54Å; K2364-T2391 PolarHBondContact O-OG1 3.46Å; K2364-D2420 VanDerWaalsContact CA-OD2 3.27Å; K2364-D2420 WeakPolarHBondContact CA-OD2 3.41Å; K2364-D2420 HydrophobicContact CD-CB 4.27Å; K2364-L2624 HydrophobicContact CB-CD1 4.22Å
2365	V	94.6	Very high	86.8	Confident	36 Å²	36	57.2 Å²	57.2	22%	0.218	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	124.1	179	-171.6	0	0	0	0	110	T2391 V2393 D2420	V2365-T2391 CarbonylContact C-O 3.56Å; V2365-T2391 WeakPolarHBondContact CA-O 3.48Å; V2365-V2393 HydrophobicContact CG1-CG2 3.77Å; V2365-D2420 PolarHBondContact N-OD2 3.01Å; V2365-D2420 PolarHBondContact O-N 3.14Å
2366	M	96.7	Very high	87.7	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	126.7	175.2	-179.3	-174.7	81.4	0	0	110.4	N2368 F2381 M2385 T2391 V2392 V2393 V2423 L2620	M2366-N2368 HydrophobicContact CE-CB 4.08Å; M2366-F2381 HydrophobicContact CE-CB 3.96Å; M2366-F2381 HydrophobicContact SD-CB 4.45Å; M2366-F2381 HydrophobicContact SD-CD1 4.48Å; M2366-M2385 HydrophobicContact CB-CE 3.89Å; M2366-M2385 HydrophobicContact CB-CG 3.85Å; M2366-M2385 HydrophobicContact CB-SD 4.05Å; M2366-M2385 HydrophobicContact CE-CB 4.13Å; M2366-M2385 HydrophobicContact SD-CB 4.14Å; M2366-M2385 HydrophobicContact SD-CG 4.39Å; M2366-T2391 PolarHBondContact N-O 3.18Å; M2366-V2392 HydrophobicContact CE-CB 4.48Å; M2366-V2392 HydrophobicContact CE-CG1 3.77Å; M2366-V2392 HydrophobicContact CE-CG2 3.96Å; M2366-V2392 CarbonylContact O-C 3.57Å; M2366-V2392 WeakPolarHBondContact O-CA 3.5Å; M2366-V2393 PolarHBondContact O-N 3.39Å; M2366-V2423 HydrophobicContact CE-CG2 4.47Å; M2366-V2423 HydrophobicContact CG-CG2 3.97Å; M2366-V2423 HydrophobicContact SD-CG2 3.57Å; M2366-V2423 VanDerWaalsContact SD-CG2 3.57Å; M2366-L2620 HydrophobicContact SD-CD1 4.05Å; M2366-L2620 HydrophobicContact SD-CD2 3.75Å
2367	G	92.4	Very high	88.3	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	123.3	168.8	0	0	0	0	0	110.3	C2419 C2421 L2422 V2423	G2367-C2419 VanDerWaalsContact CA-SG 3.52Å; G2367-C2419 PolarHBondContact N-SG 3.1Å; G2367-C2419 VanDerWaalsContact N-SG 3.44Å; G2367-C2421 PolarHBondContact N-O 3.4Å; G2367-L2422 CarbonylContact O-C 3.52Å; G2367-L2422 WeakPolarHBondContact O-CA 3.19Å; G2367-V2423 PolarHBondContact O-N 2.74Å
2368	N	93.9	Very high	88.5	Confident	1 Å²	1	47.9 Å²	47.9	1%	0.005	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	91.5	-175.8	-164.5	34.9	0	0	0	110	M2366 F2370 S2378 V2392 V2393 H2394 F2395	M2366-N2368 HydrophobicContact CE-CB 4.08Å; N2368-F2370 WeakPolarHBondContact OD1-CE2 3.5Å; N2368-S2378 PolarHBondContact ND2-O 2.97Å; N2368-S2378 PolarHBondContact ND2-OG 2.99Å; N2368-V2392 HydrophobicContact CB-CG1 3.86Å; N2368-V2393 PolarHBondContact N-O 3.42Å; N2368-H2394 PolarHBondContact ND2-ND1 3.13Å; N2368-F2395 PolarHBondContact O-N 3.04Å
2369	L	91.2	Very high	88.9	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	106.1	-169.4	-68.1	69.9	0	0	0	111.3	F2371 F2395 V2412 L2415 L2422 V2423 I2424 R2425	L2369-F2371 HydrophobicContact CB-CE2 4.37Å; L2369-F2395 HydrophobicContact CB-CB 4.45Å; L2369-F2395 HydrophobicContact CB-CD1 3.99Å; L2369-F2395 HydrophobicContact CD2-CD1 4.43Å; L2369-F2395 HydrophobicContact CG-CB 3.97Å; L2369-F2395 HydrophobicContact CG-CD1 3.88Å; L2369-F2395 HydrophobicContact CG-CG 4.06Å; L2369-V2412 HydrophobicContact CD2-CG2 3.81Å; L2369-L2415 HydrophobicContact CD1-CD1 3.97Å; L2369-L2415 HydrophobicContact CD2-CD1 3.59Å; L2369-L2415 HydrophobicContact CG-CD1 3.72Å; L2369-L2422 HydrophobicContact CD1-CD2 4Å; L2369-V2423 PolarHBondContact N-O 2.93Å; L2369-I2424 HydrophobicContact CB-CG1 4.26Å; L2369-I2424 HydrophobicContact CB-CG2 4.21Å; L2369-I2424 HydrophobicContact CD2-CD1 4.4Å; L2369-I2424 HydrophobicContact CD2-CG1 4.36Å; L2369-I2424 CarbonylContact O-C 3.47Å; L2369-I2424 VanDerWaalsContact O-CA 3.3Å; L2369-I2424 WeakPolarHBondContact O-CA 3.38Å; L2369-R2425 PolarHBondContact O-N 3.44Å
2370	F	91.2	Very high	89.5	Confident	17 Å²	17	41.2 Å²	41.2	8%	0.075	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	99.4	-179.7	-82.5	-115.1	0	0	0	110.3	N2368 E2372 T2377 F2395 V2423 R2425 A2447	N2368-F2370 WeakPolarHBondContact OD1-CE2 3.5Å; F2370-E2372 VanDerWaalsContact C-N 3.34Å; F2370-T2377 HydrophobicContact CE1-CG2 4.03Å; F2370-T2377 HydrophobicContact CZ-CG2 3.76Å; F2370-F2395 PolarHBondContact N-O 2.64Å; F2370-F2395 VanDerWaalsContact N-O 3.15Å; F2370-V2423 HydrophobicContact CE2-CG1 4.15Å; F2370-R2425 HydrophobicContact CD1-CB 3.72Å; F2370-R2425 HydrophobicContact CD1-CG 4.23Å; F2370-R2425 HydrophobicContact CD2-CB 4.45Å; F2370-R2425 HydrophobicContact CE1-CB 3.8Å; F2370-R2425 VanDerWaalsContact CE1-CD 3.46Å; F2370-R2425 HydrophobicContact CE1-CG 4.29Å; F2370-R2425 HydrophobicContact CG-CB 4.05Å; F2370-R2425 HydrophobicContact CZ-CB 4.21Å; F2370-A2447 HydrophobicContact CE1-CB 4.44Å; F2370-A2447 HydrophobicContact CE2-CB 4.27Å; F2370-A2447 HydrophobicContact CZ-CB 3.75Å
2371	F	85.7	Confident	89.9	Confident	13 Å²	13	38.9 Å²	38.9	6%	0.057	22%	0.217	C	C	.	.	S	Bend	trans	-76.5	-25.1	171.4	-59.7	-78	0	0	0	111.8	L2369 F2395 E2397 T2408 I2424 R2425 H2426	L2369-F2371 HydrophobicContact CB-CE2 4.37Å; F2371-F2395 HydrophobicContact CD1-CE1 4.33Å; F2371-F2395 AromaticContact CE1-CE1 3.52Å; F2371-F2395 HydrophobicContact CE1-CE1 3.52Å; F2371-F2395 HydrophobicContact CE1-CZ 4.2Å; F2371-F2395 HydrophobicContact CZ-CD1 4.48Å; F2371-F2395 AromaticContact CZ-CE1 3.73Å; F2371-F2395 HydrophobicContact CZ-CE1 3.73Å; F2371-F2395 HydrophobicContact CZ-CZ 4.46Å; F2371-E2397 HydrophobicContact CD1-CB 4.33Å; F2371-E2397 HydrophobicContact CD1-CG 4.5Å; F2371-T2408 HydrophobicContact CE1-CG2 4.11Å; F2371-T2408 HydrophobicContact CE2-CG2 3.9Å; F2371-T2408 HydrophobicContact CZ-CG2 3.61Å; F2371-I2424 HydrophobicContact CD2-CG2 4.19Å; F2371-I2424 HydrophobicContact CE2-CG2 3.9Å; F2371-R2425 WeakPolarHBondContact CB-O 3.28Å; F2371-R2425 WeakPolarHBondContact CD2-O 3.28Å; F2371-R2425 PolarHBondContact N-O 3.36Å; F2371-H2426 HydrophobicContact CD2-CB 4.37Å; F2371-H2426 AromaticContact CD2-CD2 3.68Å; F2371-H2426 AromaticContact CG-CD2 3.99Å
2372	E	81.4	Confident	90.1	Very high	28 Å²	28	39.1 Å²	39.1	13%	0.131	22%	0.219	C	C	.	.	S	Bend	trans	-113.7	123.7	169.3	-168.5	-165.6	-134.9	0	0	108.7	F2370 R2425 R2487 R2554	F2370-E2372 VanDerWaalsContact C-N 3.34Å; E2372-R2425 HydrophobicContact CB-CG 4.36Å; E2372-R2425 WeakPolarHBondContact O-CD 3.48Å; E2372-R2425 IonicContact OE2-CZ 2.69Å; E2372-R2425 IonicContact OE2-NE 2.75Å; E2372-R2425 PolarHBondContact OE2-NE 2.91Å; E2372-R2425 IonicContact OE2-NH2 3.95Å; E2372-R2425 PolarHBondContact OE2-NH2 3.34Å; E2372-R2425 VanDerWaalsContact OE2-NH2 3.09Å; E2372-R2487 IonicContact OE1-NH1 3.3Å; E2372-R2487 IonicContact OE2-CZ 3.88Å; E2372-R2487 VanDerWaalsContact OE2-CZ 3.25Å; E2372-R2487 IonicContact OE2-NH1 3.29Å; E2372-R2487 PolarHBondContact OE2-NH1 3.45Å; E2372-R2487 IonicContact OE2-NH2 3.51Å; E2372-R2487 PolarHBondContact OE2-NH2 3.38Å; E2372-R2554 IonicContact OE1-CZ 2.9Å; E2372-R2554 IonicContact OE1-NE 2.63Å; E2372-R2554 IonicContact OE1-NH2 3.69Å; E2372-R2554 PolarHBondContact OE1-NH2 3.47Å; E2372-R2554 IonicContact OE2-NH2 3.43Å
2373	P	81.9	Confident	90.4	Very high	113 Å²	113	32.5 Å²	32.5	73%	0.734	20%	0.2	S	C	*	.			trans	-59.7	143.9	-173.9	-24.9	33	0	0	0	114.5	R2425	P2373-R2425 PolarHBondContact O-NH2 2.92Å
2374	S	86.7	Confident	90.8	Very high	25 Å²	25	29.4 Å²	29.4	18%	0.175	17%	0.168	C	C	.	.			trans	-157.5	108.5	170.8	-174	0	0	0	0	112.9	T2377 S2378 R2425	S2374-T2377 VanDerWaalsContact OG-CB 3.31Å; S2374-T2377 WeakPolarHBondContact OG-CB 3.43Å; S2374-T2377 PolarHBondContact OG-N 3.45Å; S2374-T2377 PolarHBondContact OG-OG1 2.8Å; S2374-S2378 WeakPolarHBondContact O-CB 3.26Å; S2374-S2378 PolarHBondContact O-N 3.14Å; S2374-S2378 VanDerWaalsContact O-N 3.12Å; S2374-R2425 PolarHBondContact OG-NH1 2.78Å; S2374-R2425 VanDerWaalsContact OG-NH1 3.13Å
2375	T	84.4	Confident	90.9	Very high	117 Å²	117	26.7 Å²	26.7	72%	0.718	16%	0.156	S	C	*	.	H	α-helix	trans	-62.5	-46.1	177.8	-46.8	0	0	0	0	111.9	N2379	T2375-N2379 VanDerWaalsContact O-CB 3.26Å; T2375-N2379 WeakPolarHBondContact O-CB 3.5Å; T2375-N2379 VanDerWaalsContact O-CG 3.3Å; T2375-N2379 PolarHBondContact O-N 2.87Å; T2375-N2379 PolarHBondContact O-ND2 2.94Å; T2375-N2379 VanDerWaalsContact O-ND2 3.1Å
2376	R	87.8	Confident	90.9	Very high	38 Å²	38	30.3 Å²	30.3	14%	0.143	17%	0.171	C	C	.	.	H	α-helix	trans	-69.3	-52.3	-176.3	-165.4	-153.9	-66.6	-125.2	22.8	111.6	S2380 H2585 P2586 Y2605 A2609	R2376-S2380 VanDerWaalsContact O-CB 3.28Å; R2376-S2380 WeakPolarHBondContact O-CB 3.45Å; R2376-S2380 PolarHBondContact O-N 2.93Å; R2376-S2380 VanDerWaalsContact O-N 3.12Å; R2376-S2380 PolarHBondContact O-OG 3.31Å; R2376-H2585 PolarHBondContact NH2-O 2.96Å; R2376-P2586 VanDerWaalsContact CZ-O 3.31Å; R2376-P2586 PolarHBondContact NE-O 3.39Å; R2376-P2586 PolarHBondContact NH2-O 3.2Å; R2376-Y2605 PolarHBondContact NH1-O 3.27Å; R2376-Y2605 VanDerWaalsContact NH1-O 3.13Å; R2376-A2609 HydrophobicContact CG-CB 4.34Å
2377	T	89.9	Confident	90.6	Very high	4 Å²	4	35.8 Å²	35.8	3%	0.025	19%	0.191	C	C	.	.	H	α-helix	trans	-68.9	-46.9	-173.4	-43.8	0	0	0	0	111.1	F2370 S2374 S2380 F2381 A2447	F2370-T2377 HydrophobicContact CE1-CG2 4.03Å; F2370-T2377 HydrophobicContact CZ-CG2 3.76Å; S2374-T2377 VanDerWaalsContact OG-CB 3.31Å; S2374-T2377 WeakPolarHBondContact OG-CB 3.43Å; S2374-T2377 PolarHBondContact OG-N 3.45Å; S2374-T2377 PolarHBondContact OG-OG1 2.8Å; T2377-S2380 PolarHBondContact O-OG 3.15Å; T2377-S2380 VanDerWaalsContact O-OG 3.06Å; T2377-F2381 HydrophobicContact CG2-CD2 4.02Å; T2377-F2381 HydrophobicContact CG2-CE2 3.95Å; T2377-F2381 WeakPolarHBondContact O-CD2 3.25Å; T2377-F2381 PolarHBondContact O-N 3.35Å; T2377-A2447 HydrophobicContact CG2-CB 4.08Å
2378	S	91.9	Very high	90.7	Very high	20 Å²	20	35.8 Å²	35.8	14%	0.14	19%	0.191	C	C	.	.	H	α-helix	trans	-62.5	-49.2	-178.2	-177.9	0	0	0	0	111.7	N2368 S2374 F2381 A2382	N2368-S2378 PolarHBondContact ND2-O 2.97Å; N2368-S2378 PolarHBondContact ND2-OG 2.99Å; S2374-S2378 WeakPolarHBondContact O-CB 3.26Å; S2374-S2378 PolarHBondContact O-N 3.14Å; S2374-S2378 VanDerWaalsContact O-N 3.12Å; S2378-F2381 PolarHBondContact O-N 2.86Å; S2378-A2382 PolarHBondContact O-N 2.92Å; S2378-A2382 VanDerWaalsContact O-N 3.08Å
2379	N	91	Very high	90.5	Very high	84 Å²	84	36.8 Å²	36.8	45%	0.449	20%	0.202	S	C	.	.	H	α-helix	trans	-70.5	-37.2	-176.3	-68.2	-24.8	0	0	0	112.7	T2375 A2382 V2383	T2375-N2379 VanDerWaalsContact O-CB 3.26Å; T2375-N2379 WeakPolarHBondContact O-CB 3.5Å; T2375-N2379 VanDerWaalsContact O-CG 3.3Å; T2375-N2379 PolarHBondContact O-N 2.87Å; T2375-N2379 PolarHBondContact O-ND2 2.94Å; T2375-N2379 VanDerWaalsContact O-ND2 3.1Å; N2379-A2382 PolarHBondContact O-N 2.82Å; N2379-V2383 WeakPolarHBondContact O-CB 3.41Å; N2379-V2383 VanDerWaalsContact O-CG2 3.27Å; N2379-V2383 WeakPolarHBondContact O-CG2 3.39Å; N2379-V2383 PolarHBondContact O-N 2.77Å
2380	S	93.4	Very high	90.5	Very high	7 Å²	7	37.1 Å²	37.1	5%	0.049	21%	0.205	C	C	.	.	H	α-helix	trans	-69.7	-33	178.8	55.1	0	0	0	0	113.3	R2376 T2377 A2384 R2616	R2376-S2380 VanDerWaalsContact O-CB 3.28Å; R2376-S2380 WeakPolarHBondContact O-CB 3.45Å; R2376-S2380 PolarHBondContact O-N 2.93Å; R2376-S2380 VanDerWaalsContact O-N 3.12Å; R2376-S2380 PolarHBondContact O-OG 3.31Å; T2377-S2380 PolarHBondContact O-OG 3.15Å; T2377-S2380 VanDerWaalsContact O-OG 3.06Å; S2380-A2384 WeakPolarHBondContact O-CB 3.4Å; S2380-A2384 PolarHBondContact O-N 3.03Å; S2380-R2616 WeakPolarHBondContact OG-CD 3.2Å; S2380-R2616 VanDerWaalsContact OG-CZ 3.24Å; S2380-R2616 PolarHBondContact OG-NE 3.05Å; S2380-R2616 PolarHBondContact OG-NH1 3.44Å
2381	F	96.2	Very high	90.6	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-66.6	-43.2	168.5	-88.5	-70.8	0	0	0	111.4	M2366 T2377 S2378 A2384 M2385 V2423 I2445 A2447 T2456 R2616 L2620	M2366-F2381 HydrophobicContact CE-CB 3.96Å; M2366-F2381 HydrophobicContact SD-CB 4.45Å; M2366-F2381 HydrophobicContact SD-CD1 4.48Å; T2377-F2381 HydrophobicContact CG2-CD2 4.02Å; T2377-F2381 HydrophobicContact CG2-CE2 3.95Å; T2377-F2381 WeakPolarHBondContact O-CD2 3.25Å; T2377-F2381 PolarHBondContact O-N 3.35Å; S2378-F2381 PolarHBondContact O-N 2.86Å; F2381-A2384 PolarHBondContact O-N 3.05Å; F2381-M2385 PolarHBondContact O-N 3.47Å; F2381-V2423 HydrophobicContact CD1-CG1 4.35Å; F2381-V2423 HydrophobicContact CD1-CG2 3.94Å; F2381-V2423 HydrophobicContact CD2-CG1 3.74Å; F2381-V2423 HydrophobicContact CE1-CG1 4.4Å; F2381-V2423 HydrophobicContact CE1-CG2 4.13Å; F2381-V2423 HydrophobicContact CE2-CG1 3.8Å; F2381-V2423 HydrophobicContact CG-CG1 4.03Å; F2381-V2423 HydrophobicContact CG-CG2 4.27Å; F2381-V2423 HydrophobicContact CZ-CG1 4.13Å; F2381-I2445 HydrophobicContact CE1-CG2 4.3Å; F2381-I2445 HydrophobicContact CZ-CG2 3.95Å; F2381-A2447 HydrophobicContact CE2-CB 4.33Å; F2381-T2456 HydrophobicContact CZ-CG2 3.89Å; F2381-R2616 HydrophobicContact CD1-CB 4.07Å; F2381-R2616 HydrophobicContact CD1-CG 4.02Å; F2381-R2616 HydrophobicContact CD2-CG 4.38Å; F2381-R2616 HydrophobicContact CE1-CB 4.08Å; F2381-R2616 HydrophobicContact CE1-CG 3.77Å; F2381-R2616 HydrophobicContact CE2-CG 4.15Å; F2381-R2616 VanDerWaalsContact CE2-NE 3.31Å; F2381-R2616 HydrophobicContact CG-CG 4.32Å; F2381-R2616 HydrophobicContact CZ-CG 3.84Å; F2381-L2620 HydrophobicContact CD1-CD1 4.2Å; F2381-L2620 HydrophobicContact CD1-CD2 4.47Å; F2381-L2620 HydrophobicContact CD1-CG 4.36Å
2382	A	94.7	Very high	91.1	Very high	6 Å²	6	40.8 Å²	40.8	5%	0.05	23%	0.231	C	C	.	.	H	α-helix	trans	-62	-49.4	179.6	0	0	0	0	0	111.9	S2378 N2379 A2384 M2385 Q2386 V2392	S2378-A2382 PolarHBondContact O-N 2.92Å; S2378-A2382 VanDerWaalsContact O-N 3.08Å; N2379-A2382 PolarHBondContact O-N 2.82Å; A2382-A2384 VanDerWaalsContact C-N 3.33Å; A2382-A2384 PolarHBondContact O-N 3.07Å; A2382-M2385 PolarHBondContact O-N 3.43Å; A2382-Q2386 WeakPolarHBondContact O-CB 3.4Å; A2382-Q2386 VanDerWaalsContact O-CG 3.31Å; A2382-Q2386 WeakPolarHBondContact O-CG 3.25Å; A2382-Q2386 PolarHBondContact O-N 2.84Å; A2382-V2392 HydrophobicContact CB-CG1 4.22Å; A2382-V2392 HydrophobicContact CB-CG2 4.33Å
2383	V	93.2	Very high	91.5	Very high	52 Å²	52	42.3 Å²	42.3	32%	0.315	24%	0.241	S	C	.	.	H	α-helix	trans	-62.8	-39.6	175.5	173	0	0	0	0	111	N2379 Q2386 R2387 T2613	N2379-V2383 WeakPolarHBondContact O-CB 3.41Å; N2379-V2383 VanDerWaalsContact O-CG2 3.27Å; N2379-V2383 WeakPolarHBondContact O-CG2 3.39Å; N2379-V2383 PolarHBondContact O-N 2.77Å; V2383-Q2386 PolarHBondContact O-N 2.81Å; V2383-R2387 HydrophobicContact CG1-CG 4.15Å; V2383-R2387 VanDerWaalsContact O-CB 3.32Å; V2383-R2387 WeakPolarHBondContact O-CB 3.32Å; V2383-R2387 WeakPolarHBondContact O-CG 3.41Å; V2383-R2387 PolarHBondContact O-N 3.34Å; V2383-T2613 HydrophobicContact CB-CG2 4.43Å; V2383-T2613 HydrophobicContact CG1-CG2 3.88Å
2384	A	95.7	Very high	91.8	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-60.6	-48.1	176.6	0	0	0	0	0	112	S2380 F2381 A2382 R2387 L2388 T2613 R2616 M2617 L2620	S2380-A2384 WeakPolarHBondContact O-CB 3.4Å; S2380-A2384 PolarHBondContact O-N 3.03Å; F2381-A2384 PolarHBondContact O-N 3.05Å; A2382-A2384 VanDerWaalsContact C-N 3.33Å; A2382-A2384 PolarHBondContact O-N 3.07Å; A2384-R2387 PolarHBondContact O-N 2.77Å; A2384-L2388 VanDerWaalsContact O-CG 3.31Å; A2384-L2388 WeakPolarHBondContact O-CG 3.26Å; A2384-L2388 PolarHBondContact O-N 3.21Å; A2384-T2613 HydrophobicContact CB-CG2 4.45Å; A2384-R2616 HydrophobicContact CB-CB 3.9Å; A2384-M2617 VanDerWaalsContact CA-CG 3.49Å; A2384-M2617 HydrophobicContact CB-CB 4.32Å; A2384-M2617 HydrophobicContact CB-CG 3.48Å; A2384-M2617 VanDerWaalsContact CB-CG 3.48Å; A2384-L2620 HydrophobicContact CB-CD1 3.93Å
2385	M	95.8	Very high	91.5	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-63.5	-44	178.2	-170.4	66.1	172.7	0	0	111.6	C2361 K2364 M2366 F2381 A2382 L2388 G2389 G2390 V2392 L2620 L2624	C2361-M2385 HydrophobicContact CB-CE 4.29Å; C2361-M2385 HydrophobicContact CB-SD 4.2Å; K2364-M2385 HydrophobicContact CB-CE 3.53Å; K2364-M2385 WeakPolarHBondContact O-CE 3.45Å; M2366-M2385 HydrophobicContact CB-CE 3.89Å; M2366-M2385 HydrophobicContact CB-CG 3.85Å; M2366-M2385 HydrophobicContact CB-SD 4.05Å; M2366-M2385 HydrophobicContact CE-CB 4.13Å; M2366-M2385 HydrophobicContact SD-CB 4.14Å; M2366-M2385 HydrophobicContact SD-CG 4.39Å; F2381-M2385 PolarHBondContact O-N 3.47Å; A2382-M2385 PolarHBondContact O-N 3.43Å; M2385-L2388 CarbonylContact O-C 3.5Å; M2385-L2388 PolarHBondContact O-N 3.48Å; M2385-G2389 PolarHBondContact O-N 2.78Å; M2385-G2390 WeakPolarHBondContact O-CA 3.2Å; M2385-G2390 PolarHBondContact O-N 2.84Å; M2385-V2392 HydrophobicContact CB-CG2 3.73Å; M2385-V2392 HydrophobicContact CG-CG2 3.93Å; M2385-L2620 HydrophobicContact CB-CD1 3.97Å; M2385-L2620 HydrophobicContact SD-CD1 4.24Å; M2385-L2624 HydrophobicContact CE-CD1 3.7Å; M2385-L2624 HydrophobicContact SD-CD1 3.95Å
2386	Q	93.8	Very high	91.2	Very high	112 Å²	112	38.3 Å²	38.3	52%	0.523	21%	0.206	S	C	.	.	H	α-helix	trans	-65.4	-41.1	178.6	-73.3	174.4	-13.6	0	0	112.7	A2382 V2383 L2388 G2389 V2392	A2382-Q2386 WeakPolarHBondContact O-CB 3.4Å; A2382-Q2386 VanDerWaalsContact O-CG 3.31Å; A2382-Q2386 WeakPolarHBondContact O-CG 3.25Å; A2382-Q2386 PolarHBondContact O-N 2.84Å; V2383-Q2386 PolarHBondContact O-N 2.81Å; Q2386-L2388 PolarHBondContact O-N 3.47Å; Q2386-G2389 WeakPolarHBondContact O-CA 3.34Å; Q2386-G2389 PolarHBondContact O-N 2.59Å; Q2386-V2392 HydrophobicContact CG-CG2 4.26Å
2387	R	90.9	Very high	90.2	Very high	114 Å²	114	41 Å²	41	43%	0.43	22%	0.22	S	C	.	.	H	α-helix	trans	-65.7	-24.2	175.7	-76.9	-173.3	173.1	-153.9	0.7	113	L2351 L2357 V2383 A2384 G2389 M2617	L2351-R2387 HydrophobicContact CD2-CG 4.49Å; L2357-R2387 CarbonylContact C-O 3.6Å; V2383-R2387 HydrophobicContact CG1-CG 4.15Å; V2383-R2387 VanDerWaalsContact O-CB 3.32Å; V2383-R2387 WeakPolarHBondContact O-CB 3.32Å; V2383-R2387 WeakPolarHBondContact O-CG 3.41Å; V2383-R2387 PolarHBondContact O-N 3.34Å; A2384-R2387 PolarHBondContact O-N 2.77Å; R2387-G2389 VanDerWaalsContact C-N 3.33Å; R2387-M2617 HydrophobicContact CB-CE 3.84Å; R2387-M2617 HydrophobicContact CB-SD 4.14Å
2388	L	93.6	Very high	89.3	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	0.8	171.6	-63.3	172	0	0	0	113.1	F2347 L2357 D2358 I2360 C2361 A2384 M2385 Q2386 M2617 L2620 A2621	F2347-L2388 HydrophobicContact CE2-CD2 3.99Å; F2347-L2388 HydrophobicContact CZ-CD2 4Å; L2357-L2388 HydrophobicContact CB-CD2 4.25Å; L2357-L2388 CarbonylContact O-C 3.47Å; L2357-L2388 WeakPolarHBondContact O-CA 3.3Å; D2358-L2388 CarbonylContact C-O 3.58Å; D2358-L2388 VanDerWaalsContact CA-C 3.48Å; I2360-L2388 HydrophobicContact CB-CB 4.44Å; I2360-L2388 HydrophobicContact CB-CD2 3.99Å; I2360-L2388 HydrophobicContact CD1-CD2 3.8Å; I2360-L2388 HydrophobicContact CG1-CD2 4.39Å; I2360-L2388 HydrophobicContact CG2-CD2 4.16Å; I2360-L2388 PolarHBondContact N-O 2.83Å; C2361-L2388 WeakPolarHBondContact CA-O 3.33Å; C2361-L2388 HydrophobicContact CB-CB 3.82Å; C2361-L2388 PolarHBondContact N-O 3Å; A2384-L2388 VanDerWaalsContact O-CG 3.31Å; A2384-L2388 WeakPolarHBondContact O-CG 3.26Å; A2384-L2388 PolarHBondContact O-N 3.21Å; M2385-L2388 CarbonylContact O-C 3.5Å; M2385-L2388 PolarHBondContact O-N 3.48Å; Q2386-L2388 PolarHBondContact O-N 3.47Å; L2388-M2617 HydrophobicContact CD1-CB 3.95Å; L2388-M2617 HydrophobicContact CD1-CG 4.25Å; L2388-M2617 VanDerWaalsContact CD1-O 3.29Å; L2388-M2617 WeakPolarHBondContact CD1-O 3.27Å; L2388-M2617 HydrophobicContact CD2-CB 4.36Å; L2388-M2617 HydrophobicContact CD2-CE 3.71Å; L2388-M2617 HydrophobicContact CG-CB 4.24Å; L2388-M2617 HydrophobicContact CG-CE 4.01Å; L2388-M2617 HydrophobicContact CG-CG 4.2Å; L2388-L2620 HydrophobicContact CD1-CB 4.18Å; L2388-A2621 HydrophobicContact CD1-CB 4.27Å
2389	G	89.4	Confident	88.1	Confident	23 Å²	23	49.7 Å²	49.7	24%	0.237	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	84.1	10.1	176.7	0	0	0	0	0	115.6	D2358 R2362 M2385 Q2386 R2387	D2358-G2389 VanDerWaalsContact O-CA 3.31Å; D2358-G2389 WeakPolarHBondContact O-CA 3.17Å; R2362-G2389 WeakPolarHBondContact CA-O 3.2Å; M2385-G2389 PolarHBondContact O-N 2.78Å; Q2386-G2389 WeakPolarHBondContact O-CA 3.34Å; Q2386-G2389 PolarHBondContact O-N 2.59Å; R2387-G2389 VanDerWaalsContact C-N 3.33Å
2390	G	92.3	Very high	87.2	Confident	6 Å²	6	46.1 Å²	46.1	6%	0.062	26%	0.258	C	S	.	.			trans	-81	168.8	170.8	0	0	0	0	0	112.9	C2361 K2364 M2385	C2361-G2390 VanDerWaalsContact O-CA 3.31Å; C2361-G2390 WeakPolarHBondContact O-CA 3.29Å; C2361-G2390 PolarHBondContact O-N 3.16Å; K2364-G2390 CarbonylContact O-C 3.48Å; K2364-G2390 WeakPolarHBondContact O-CA 3.48Å; M2385-G2390 WeakPolarHBondContact O-CA 3.2Å; M2385-G2390 PolarHBondContact O-N 2.84Å
2391	T	93.5	Very high	86.4	Confident	81 Å²	81	48.3 Å²	48.3	50%	0.497	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	155.6	174.4	50.8	0	0	0	0	110.8	K2364 V2365 M2366	K2364-T2391 PolarHBondContact O-N 2.54Å; K2364-T2391 PolarHBondContact O-OG1 3.46Å; V2365-T2391 CarbonylContact C-O 3.56Å; V2365-T2391 WeakPolarHBondContact CA-O 3.48Å; M2366-T2391 PolarHBondContact N-O 3.18Å
2392	V	95.8	Very high	85.2	Confident	27 Å²	27	49.7 Å²	49.7	16%	0.164	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	129.9	-172.8	-176	0	0	0	0	109.6	M2366 N2368 A2382 M2385 Q2386	M2366-V2392 HydrophobicContact CE-CB 4.48Å; M2366-V2392 HydrophobicContact CE-CG1 3.77Å; M2366-V2392 HydrophobicContact CE-CG2 3.96Å; M2366-V2392 CarbonylContact O-C 3.57Å; M2366-V2392 WeakPolarHBondContact O-CA 3.5Å; N2368-V2392 HydrophobicContact CB-CG1 3.86Å; A2382-V2392 HydrophobicContact CB-CG1 4.22Å; A2382-V2392 HydrophobicContact CB-CG2 4.33Å; M2385-V2392 HydrophobicContact CB-CG2 3.73Å; M2385-V2392 HydrophobicContact CG-CG2 3.93Å; Q2386-V2392 HydrophobicContact CG-CG2 4.26Å
2393	V	89.7	Confident	84.2	Confident	59 Å²	59	54 Å²	54	36%	0.358	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	109.4	170.1	179.7	0	0	0	0	107.7	V2365 M2366 N2368	V2365-V2393 HydrophobicContact CG1-CG2 3.77Å; M2366-V2393 PolarHBondContact O-N 3.39Å; N2368-V2393 PolarHBondContact N-O 3.42Å
2394	H	89.2	Confident	83.4	Confident	102 Å²	102	60 Å²	60	47%	0.472	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	133.8	178.2	-72.2	-86.8	0	0	0	110.9	N2368	N2368-H2394 PolarHBondContact ND2-ND1 3.13Å
2395	F	79.8	Confident	82.3	Confident	28 Å²	28	63.1 Å²	63.1	12%	0.123	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	128.7	177.2	176	-83.8	0	0	0	110.3	N2368 L2369 F2370 F2371 T2411 L2415	N2368-F2395 PolarHBondContact O-N 3.04Å; L2369-F2395 HydrophobicContact CB-CB 4.45Å; L2369-F2395 HydrophobicContact CB-CD1 3.99Å; L2369-F2395 HydrophobicContact CD2-CD1 4.43Å; L2369-F2395 HydrophobicContact CG-CB 3.97Å; L2369-F2395 HydrophobicContact CG-CD1 3.88Å; L2369-F2395 HydrophobicContact CG-CG 4.06Å; F2370-F2395 PolarHBondContact N-O 2.64Å; F2370-F2395 VanDerWaalsContact N-O 3.15Å; F2371-F2395 HydrophobicContact CD1-CE1 4.33Å; F2371-F2395 AromaticContact CE1-CE1 3.52Å; F2371-F2395 HydrophobicContact CE1-CE1 3.52Å; F2371-F2395 HydrophobicContact CE1-CZ 4.2Å; F2371-F2395 HydrophobicContact CZ-CD1 4.48Å; F2371-F2395 AromaticContact CZ-CE1 3.73Å; F2371-F2395 HydrophobicContact CZ-CE1 3.73Å; F2371-F2395 HydrophobicContact CZ-CZ 4.46Å; F2395-T2411 HydrophobicContact CD2-CG2 4.32Å; F2395-T2411 HydrophobicContact CE1-CG2 4.21Å; F2395-T2411 HydrophobicContact CE2-CG2 3.31Å; F2395-T2411 HydrophobicContact CZ-CG2 3.25Å; F2395-L2415 HydrophobicContact CB-CD1 4.17Å; F2395-L2415 HydrophobicContact CD2-CD1 3.6Å; F2395-L2415 HydrophobicContact CE2-CD1 4.05Å; F2395-L2415 HydrophobicContact CG-CD1 3.85Å
2396	S	77.4	Confident	81.6	Confident	41 Å²	41	65.7 Å²	65.7	29%	0.287	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	150.5	171.6	76.2	0	0	0	0	110	S2398 T2399 S2400	S2396-S2398 VanDerWaalsContact C-N 3.27Å; S2396-S2398 PolarHBondContact O-N 2.97Å; S2396-S2398 PolarHBondContact OG-OG 3.44Å; S2396-S2398 VanDerWaalsContact OG-OG 3.12Å; S2396-T2399 PolarHBondContact O-N 3.14Å; S2396-T2399 VanDerWaalsContact O-N 3.17Å; S2396-T2399 PolarHBondContact O-OG1 2.92Å; S2396-T2399 PolarHBondContact OG-OG1 3.44Å; S2396-S2400 PolarHBondContact O-N 3.33Å
2397	E	67.6	Low	81	Confident	95 Å²	95	63.8 Å²	63.8	44%	0.444	37%	0.367	S	S	.	.	G	3₁₀ helix	trans	-55.6	-42.2	-179.2	-170.7	177.9	171.5	0	0	112.1	F2371 T2399 S2400 T2403	F2371-E2397 HydrophobicContact CD1-CB 4.33Å; F2371-E2397 HydrophobicContact CD1-CG 4.5Å; E2397-T2399 PolarHBondContact O-N 2.96Å; E2397-S2400 PolarHBondContact O-N 2.91Å; E2397-S2400 VanDerWaalsContact O-N 3.09Å; E2397-S2400 PolarHBondContact O-OG 3.28Å; E2397-T2403 WeakPolarHBondContact O-CG2 3.25Å
2398	S	70.8	Confident	80.5	Confident	98 Å²	98	60.2 Å²	60.2	69%	0.685	36%	0.358	S	S	*	.	G	3₁₀ helix	trans	-63.4	-22.7	-178.4	56.7	0	0	0	0	114.4	S2396	S2396-S2398 VanDerWaalsContact C-N 3.27Å; S2396-S2398 PolarHBondContact O-N 2.97Å; S2396-S2398 PolarHBondContact OG-OG 3.44Å; S2396-S2398 VanDerWaalsContact OG-OG 3.12Å
2399	T	66.5	Low	80	Confident	109 Å²	109	62.9 Å²	62.9	67%	0.669	37%	0.373	S	S	*	.	G	3₁₀ helix	trans	-101.2	2.9	179.2	52.1	0	0	0	0	113.3	S2396 E2397	S2396-T2399 PolarHBondContact O-N 3.14Å; S2396-T2399 VanDerWaalsContact O-N 3.17Å; S2396-T2399 PolarHBondContact O-OG1 2.92Å; S2396-T2399 PolarHBondContact OG-OG1 3.44Å; E2397-T2399 PolarHBondContact O-N 2.96Å
2400	S	72.7	Confident	79.7	Confident	9 Å²	9	65 Å²	65	6%	0.063	38%	0.378	C	S	.	.	S	Bend	trans	-102.3	161.1	-170.2	82.6	0	0	0	0	114.1	S2396 E2397 Q2402 T2403	S2396-S2400 PolarHBondContact O-N 3.33Å; E2397-S2400 PolarHBondContact O-N 2.91Å; E2397-S2400 VanDerWaalsContact O-N 3.09Å; E2397-S2400 PolarHBondContact O-OG 3.28Å; S2400-Q2402 PolarHBondContact O-N 3.09Å; S2400-Q2402 VanDerWaalsContact O-N 3.14Å; S2400-Q2402 VanDerWaalsContact OG-CB 3.29Å; S2400-Q2402 WeakPolarHBondContact OG-CB 3.46Å; S2400-Q2402 WeakPolarHBondContact OG-CG 3.31Å; S2400-Q2402 PolarHBondContact OG-N 3.01Å; S2400-Q2402 VanDerWaalsContact OG-N 3.1Å; S2400-T2403 PolarHBondContact O-N 2.88Å; S2400-T2403 PolarHBondContact O-OG1 2.93Å
2401	S	76.8	Confident	79.3	Confident	53 Å²	53	64.9 Å²	64.9	37%	0.371	38%	0.377	S	S	.	.	G	3₁₀ helix	trans	-65.8	-5.9	169.9	-64.2	0	0	0	0	113.7	T2403 K2404 G2405 E2406	S2401-T2403 PolarHBondContact O-N 2.88Å; S2401-K2404 CarbonylContact O-C 3.54Å; S2401-K2404 VanDerWaalsContact O-CA 3.3Å; S2401-K2404 WeakPolarHBondContact O-CA 3.19Å; S2401-K2404 VanDerWaalsContact O-CB 3.3Å; S2401-K2404 WeakPolarHBondContact O-CB 3.5Å; S2401-K2404 PolarHBondContact O-N 3.32Å; S2401-G2405 PolarHBondContact O-N 3.34Å; S2401-E2406 VanDerWaalsContact O-CB 3.32Å; S2401-E2406 WeakPolarHBondContact O-CB 3.43Å; S2401-E2406 PolarHBondContact O-N 3.4Å; S2401-E2406 VanDerWaalsContact O-N 3.09Å
2402	Q	70.8	Confident	79	Confident	29 Å²	29	61.1 Å²	61.1	14%	0.136	35%	0.353	C	S	.	.	G	3₁₀ helix	trans	-65.2	-29.2	170.8	-58	-170	13.6	0	0	111.7	S2400 K2404 G2405 E2406 T2408 T2411	S2400-Q2402 PolarHBondContact O-N 3.09Å; S2400-Q2402 VanDerWaalsContact O-N 3.14Å; S2400-Q2402 VanDerWaalsContact OG-CB 3.29Å; S2400-Q2402 WeakPolarHBondContact OG-CB 3.46Å; S2400-Q2402 WeakPolarHBondContact OG-CG 3.31Å; S2400-Q2402 PolarHBondContact OG-N 3.01Å; S2400-Q2402 VanDerWaalsContact OG-N 3.1Å; Q2402-K2404 PolarHBondContact O-N 3.34Å; Q2402-K2404 VanDerWaalsContact O-N 3.14Å; Q2402-G2405 WeakPolarHBondContact O-CA 3.42Å; Q2402-G2405 PolarHBondContact O-N 3.06Å; Q2402-E2406 WeakPolarHBondContact CG-O 3.49Å; Q2402-T2408 VanDerWaalsContact NE2-CA 3.35Å; Q2402-T2408 PolarHBondContact OE1-OG1 3.15Å; Q2402-T2411 VanDerWaalsContact CG-OG1 3.31Å; Q2402-T2411 WeakPolarHBondContact CG-OG1 3.31Å; Q2402-T2411 PolarHBondContact NE2-OG1 2.68Å
2403	T	73.1	Confident	78.4	Confident	96 Å²	96	64.6 Å²	64.6	59%	0.589	36%	0.364	S	S	*	.	G	3₁₀ helix	trans	-60.8	-20.5	168.7	61.5	0	0	0	0	112.6	E2397 S2400 S2401	E2397-T2403 WeakPolarHBondContact O-CG2 3.25Å; S2400-T2403 PolarHBondContact O-N 2.88Å; S2400-T2403 PolarHBondContact O-OG1 2.93Å; S2401-T2403 PolarHBondContact O-N 2.88Å
2404	K	76.7	Confident	78.2	Confident	179 Å²	179	65.3 Å²	65.3	78%	0.778	36%	0.364	S	S	*	.	G	3₁₀ helix	trans	-98.9	8.6	173.6	-54.4	178.4	-179.2	174.5	0	112.9	S2401 Q2402	S2401-K2404 CarbonylContact O-C 3.54Å; S2401-K2404 VanDerWaalsContact O-CA 3.3Å; S2401-K2404 WeakPolarHBondContact O-CA 3.19Å; S2401-K2404 VanDerWaalsContact O-CB 3.3Å; S2401-K2404 WeakPolarHBondContact O-CB 3.5Å; S2401-K2404 PolarHBondContact O-N 3.32Å; Q2402-K2404 PolarHBondContact O-N 3.34Å; Q2402-K2404 VanDerWaalsContact O-N 3.14Å
2405	G	71.7	Confident	78	Confident	64 Å²	64	61.3 Å²	61.3	66%	0.66	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.9	10.9	179	0	0	0	0	0	116	S2401 Q2402	S2401-G2405 PolarHBondContact O-N 3.34Å; Q2402-G2405 WeakPolarHBondContact O-CA 3.42Å; Q2402-G2405 PolarHBondContact O-N 3.06Å
2406	E	81.2	Confident	78.2	Confident	55 Å²	55	60.5 Å²	60.5	26%	0.257	35%	0.345	S	S	.	.			trans	-60.8	137.9	170	-173.4	177.6	-104.5	0	0	110.5	S2401 Q2402 D2410 T2411 I2414	S2401-E2406 VanDerWaalsContact O-CB 3.32Å; S2401-E2406 WeakPolarHBondContact O-CB 3.43Å; S2401-E2406 PolarHBondContact O-N 3.4Å; S2401-E2406 VanDerWaalsContact O-N 3.09Å; Q2402-E2406 WeakPolarHBondContact CG-O 3.49Å; E2406-D2410 HydrophobicContact CG-CB 3.95Å; E2406-T2411 WeakPolarHBondContact OE2-CB 3.29Å; E2406-T2411 PolarHBondContact OE2-OG1 2.94Å; E2406-I2414 WeakPolarHBondContact OE1-CD1 3.27Å
2407	T	81.3	Confident	78.6	Confident	71 Å²	71	61.6 Å²	61.6	44%	0.436	36%	0.363	S	S	.	.			trans	-73.1	147.5	179.5	76.4	0	0	0	0	110.7	L2409 D2410 T2411	T2407-L2409 PolarHBondContact O-N 2.89Å; T2407-L2409 VanDerWaalsContact O-N 3.14Å; T2407-D2410 PolarHBondContact O-N 3.26Å; T2407-D2410 PolarHBondContact OG1-N 3.37Å; T2407-D2410 PolarHBondContact OG1-OD2 3.1Å; T2407-T2411 PolarHBondContact O-N 3.13Å; T2407-T2411 PolarHBondContact O-OG1 2.66Å
2408	T	81.1	Confident	79.5	Confident	39 Å²	39	65 Å²	65	24%	0.239	37%	0.373	C	S	.	.	H	α-helix	trans	-55.4	-35.3	177.3	-47.4	0	0	0	0	112.9	F2371 Q2402 V2412 L2435	F2371-T2408 HydrophobicContact CE1-CG2 4.11Å; F2371-T2408 HydrophobicContact CE2-CG2 3.9Å; F2371-T2408 HydrophobicContact CZ-CG2 3.61Å; Q2402-T2408 VanDerWaalsContact NE2-CA 3.35Å; Q2402-T2408 PolarHBondContact OE1-OG1 3.15Å; T2408-V2412 HydrophobicContact CG2-CG2 4.48Å; T2408-V2412 WeakPolarHBondContact O-CB 3.26Å; T2408-V2412 WeakPolarHBondContact O-CG2 3.48Å; T2408-V2412 PolarHBondContact O-N 2.93Å; T2408-L2435 HydrophobicContact CG2-CD1 4.48Å
2409	L	82.5	Confident	80.6	Confident	57 Å²	57	60.5 Å²	60.5	30%	0.298	34%	0.341	S	S	.	.	H	α-helix	trans	-67.1	-41	177.8	-176.6	145.3	0	0	0	112.2	T2407 V2412 R2413 L2435 S2438	T2407-L2409 PolarHBondContact O-N 2.89Å; T2407-L2409 VanDerWaalsContact O-N 3.14Å; L2409-V2412 PolarHBondContact O-N 3.25Å; L2409-R2413 WeakPolarHBondContact O-CB 3.47Å; L2409-R2413 WeakPolarHBondContact O-CG 3.42Å; L2409-R2413 PolarHBondContact O-N 3.31Å; L2409-L2435 HydrophobicContact CB-CD2 4.33Å; L2409-S2438 VanDerWaalsContact CD1-CB 3.47Å; L2409-S2438 WeakPolarHBondContact CD1-OG 3.22Å
2410	D	82.9	Confident	81.8	Confident	67 Å²	67	57.2 Å²	57.2	36%	0.358	32%	0.32	S	S	.	.	H	α-helix	trans	-67.1	-44.7	176.2	-65.6	-36.6	0	0	0	111.3	E2406 T2407 V2412 R2413 I2414	E2406-D2410 HydrophobicContact CG-CB 3.95Å; T2407-D2410 PolarHBondContact O-N 3.26Å; T2407-D2410 PolarHBondContact OG1-N 3.37Å; T2407-D2410 PolarHBondContact OG1-OD2 3.1Å; D2410-V2412 VanDerWaalsContact C-N 3.32Å; D2410-V2412 PolarHBondContact O-N 3.27Å; D2410-R2413 PolarHBondContact O-N 3.23Å; D2410-I2414 WeakPolarHBondContact O-CG1 3.38Å; D2410-I2414 PolarHBondContact O-N 3.28Å
2411	T	84.5	Confident	82.8	Confident	4 Å²	4	56.8 Å²	56.8	3%	0.025	32%	0.317	C	S	.	.	H	α-helix	trans	-58.8	-44.5	176.2	-48.9	0	0	0	0	111.9	F2395 Q2402 E2406 T2407 I2414 L2415	F2395-T2411 HydrophobicContact CD2-CG2 4.32Å; F2395-T2411 HydrophobicContact CE1-CG2 4.21Å; F2395-T2411 HydrophobicContact CE2-CG2 3.31Å; F2395-T2411 HydrophobicContact CZ-CG2 3.25Å; Q2402-T2411 VanDerWaalsContact CG-OG1 3.31Å; Q2402-T2411 WeakPolarHBondContact CG-OG1 3.31Å; Q2402-T2411 PolarHBondContact NE2-OG1 2.68Å; E2406-T2411 WeakPolarHBondContact OE2-CB 3.29Å; E2406-T2411 PolarHBondContact OE2-OG1 2.94Å; T2407-T2411 PolarHBondContact O-N 3.13Å; T2407-T2411 PolarHBondContact O-OG1 2.66Å; T2411-I2414 PolarHBondContact O-N 3.11Å; T2411-L2415 HydrophobicContact CG2-CD1 4.08Å; T2411-L2415 WeakPolarHBondContact O-CG 3.26Å; T2411-L2415 PolarHBondContact O-N 3.19Å
2412	V	87.3	Confident	83.6	Confident	1 Å²	1	54.3 Å²	54.3	1%	0.006	30%	0.299	C	S	.	.	H	α-helix	trans	-65.8	-39.3	178.5	170.3	0	0	0	0	111	L2369 T2408 L2409 D2410 L2415 A2416 L2422 I2424 L2435 V2440	L2369-V2412 HydrophobicContact CD2-CG2 3.81Å; T2408-V2412 HydrophobicContact CG2-CG2 4.48Å; T2408-V2412 WeakPolarHBondContact O-CB 3.26Å; T2408-V2412 WeakPolarHBondContact O-CG2 3.48Å; T2408-V2412 PolarHBondContact O-N 2.93Å; L2409-V2412 PolarHBondContact O-N 3.25Å; D2410-V2412 VanDerWaalsContact C-N 3.32Å; D2410-V2412 PolarHBondContact O-N 3.27Å; V2412-L2415 PolarHBondContact O-N 3.08Å; V2412-A2416 VanDerWaalsContact O-CB 3.28Å; V2412-A2416 WeakPolarHBondContact O-CB 3.05Å; V2412-A2416 PolarHBondContact O-N 3.47Å; V2412-L2422 HydrophobicContact CG1-CD1 3.95Å; V2412-I2424 HydrophobicContact CG1-CD1 3.93Å; V2412-I2424 HydrophobicContact CG2-CD1 4.1Å; V2412-L2435 HydrophobicContact CB-CD2 4.2Å; V2412-L2435 HydrophobicContact CG1-CD2 4.37Å; V2412-L2435 HydrophobicContact CG2-CD1 4.09Å; V2412-L2435 HydrophobicContact CG2-CD2 4.07Å; V2412-V2440 HydrophobicContact CG1-CG2 4.01Å
2413	R	83.5	Confident	84.8	Confident	101 Å²	101	52.9 Å²	52.9	38%	0.381	29%	0.293	S	S	.	.	H	α-helix	trans	-64.1	-42.3	175.3	-81.9	179.9	176.9	176.4	1.5	112.7	L2409 D2410 A2416 G2417 S2438	L2409-R2413 WeakPolarHBondContact O-CB 3.47Å; L2409-R2413 WeakPolarHBondContact O-CG 3.42Å; L2409-R2413 PolarHBondContact O-N 3.31Å; D2410-R2413 PolarHBondContact O-N 3.23Å; R2413-A2416 PolarHBondContact O-N 3.11Å; R2413-G2417 PolarHBondContact O-N 2.81Å; R2413-S2438 PolarHBondContact NE-O 2.83Å; R2413-S2438 PolarHBondContact NH2-O 2.87Å
2414	I	84.5	Confident	85.8	Confident	73 Å²	73	48.3 Å²	48.3	37%	0.374	27%	0.265	S	S	.	.	H	α-helix	trans	-60.6	-49.7	176.8	-69.2	164.9	0	0	0	109.9	E2406 D2410 T2411 A2416 G2417 Y2418	E2406-I2414 WeakPolarHBondContact OE1-CD1 3.27Å; D2410-I2414 WeakPolarHBondContact O-CG1 3.38Å; D2410-I2414 PolarHBondContact O-N 3.28Å; T2411-I2414 PolarHBondContact O-N 3.11Å; I2414-A2416 PolarHBondContact O-N 2.71Å; I2414-G2417 PolarHBondContact O-N 3.21Å; I2414-Y2418 HydrophobicContact CG2-CD2 4.4Å; I2414-Y2418 HydrophobicContact CG2-CE2 3.6Å
2415	L	85	Confident	86.5	Confident	18 Å²	18	41 Å²	41	9%	0.094	23%	0.232	C	C	.	.	H	α-helix	trans	-68	-33.8	-179.7	-70.5	169.5	0	0	0	112.7	L2369 F2395 T2411 V2412 G2417 Y2418 C2419 L2422	L2369-L2415 HydrophobicContact CD1-CD1 3.97Å; L2369-L2415 HydrophobicContact CD2-CD1 3.59Å; L2369-L2415 HydrophobicContact CG-CD1 3.72Å; F2395-L2415 HydrophobicContact CB-CD1 4.17Å; F2395-L2415 HydrophobicContact CD2-CD1 3.6Å; F2395-L2415 HydrophobicContact CE2-CD1 4.05Å; F2395-L2415 HydrophobicContact CG-CD1 3.85Å; T2411-L2415 HydrophobicContact CG2-CD1 4.08Å; T2411-L2415 WeakPolarHBondContact O-CG 3.26Å; T2411-L2415 PolarHBondContact O-N 3.19Å; V2412-L2415 PolarHBondContact O-N 3.08Å; L2415-G2417 PolarHBondContact O-N 2.84Å; L2415-Y2418 HydrophobicContact CD2-CD2 4.33Å; L2415-Y2418 PolarHBondContact O-N 3.22Å; L2415-C2419 PolarHBondContact O-N 3.42Å; L2415-L2422 HydrophobicContact CB-CD2 4.27Å
2416	A	85.1	Confident	87.3	Confident	11 Å²	11	39.7 Å²	39.7	9%	0.091	21%	0.209	C	C	.	.	H	α-helix	trans	-59.9	-25.5	171.4	0	0	0	0	0	112.7	V2412 R2413 I2414 L2422 V2440 K2442	V2412-A2416 VanDerWaalsContact O-CB 3.28Å; V2412-A2416 WeakPolarHBondContact O-CB 3.05Å; V2412-A2416 PolarHBondContact O-N 3.47Å; R2413-A2416 PolarHBondContact O-N 3.11Å; I2414-A2416 PolarHBondContact O-N 2.71Å; A2416-L2422 HydrophobicContact CB-CD1 3.84Å; A2416-V2440 HydrophobicContact CB-CG1 3.81Å; A2416-K2442 HydrophobicContact CB-CG 4.49Å; A2416-K2442 WeakPolarHBondContact O-CG 3.37Å
2417	G	84.8	Confident	87.4	Confident	65 Å²	65	40.4 Å²	40.4	67%	0.67	22%	0.218	S	C	*	.	H	α-helix	trans	-73.1	-25.6	173.2	0	0	0	0	0	114.1	R2413 I2414 L2415	R2413-G2417 PolarHBondContact O-N 2.81Å; I2414-G2417 PolarHBondContact O-N 3.21Å; L2415-G2417 PolarHBondContact O-N 2.84Å
2418	Y	87.7	Confident	87.5	Confident	166 Å²	166	38.4 Å²	38.4	65%	0.651	21%	0.211	S	C	*	.	H	α-helix	trans	-99.3	-19.4	-177.6	-55.6	-35.7	0	0	0	113.9	I2414 L2415	I2414-Y2418 HydrophobicContact CG2-CD2 4.4Å; I2414-Y2418 HydrophobicContact CG2-CE2 3.6Å; L2415-Y2418 HydrophobicContact CD2-CD2 4.33Å; L2415-Y2418 PolarHBondContact O-N 3.22Å
2419	C	92.6	Very high	87.6	Confident	3 Å²	3	41.8 Å²	41.8	2%	0.02	22%	0.223	C	C	.	.			trans	-116.1	152	-172.2	-57.2	0	0	0	0	112.5	G2367 L2415 L2422	G2367-C2419 VanDerWaalsContact CA-SG 3.52Å; G2367-C2419 PolarHBondContact N-SG 3.1Å; G2367-C2419 VanDerWaalsContact N-SG 3.44Å; L2415-C2419 PolarHBondContact O-N 3.42Å; C2419-L2422 HydrophobicContact CB-CD2 3.82Å
2420	D	92.3	Very high	87.5	Confident	41 Å²	41	40.6 Å²	40.6	22%	0.219	22%	0.224	C	C	.	.	S	Bend	trans	-80.7	-29.5	174.1	-68.2	-70.1	0	0	0	112.7	K2364 V2365 P2443 L2624	K2364-D2420 VanDerWaalsContact CA-OD2 3.27Å; K2364-D2420 WeakPolarHBondContact CA-OD2 3.41Å; K2364-D2420 HydrophobicContact CD-CB 4.27Å; V2365-D2420 PolarHBondContact N-OD2 3.01Å; V2365-D2420 PolarHBondContact O-N 3.14Å; D2420-P2443 WeakPolarHBondContact O-CD 3.49Å; D2420-L2624 HydrophobicContact CB-CD2 3.96Å
2421	C	94.2	Very high	87.5	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	159.6	170	66.6	0	0	0	0	110.9	G2367 P2443 L2624	G2367-C2421 PolarHBondContact N-O 3.4Å; C2421-P2443 WeakPolarHBondContact CA-O 3.45Å; C2421-P2443 HydrophobicContact CB-CB 4.24Å; C2421-L2624 HydrophobicContact CB-CD2 3.82Å
2422	L	93.7	Very high	87.7	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	128.7	178.5	-58.6	178.4	0	0	0	110.5	G2367 L2369 V2412 L2415 A2416 C2419 I2424 V2440 P2443 I2444 I2445	G2367-L2422 CarbonylContact O-C 3.52Å; G2367-L2422 WeakPolarHBondContact O-CA 3.19Å; L2369-L2422 HydrophobicContact CD1-CD2 4Å; V2412-L2422 HydrophobicContact CG1-CD1 3.95Å; L2415-L2422 HydrophobicContact CB-CD2 4.27Å; A2416-L2422 HydrophobicContact CB-CD1 3.84Å; C2419-L2422 HydrophobicContact CB-CD2 3.82Å; L2422-I2424 HydrophobicContact CB-CD1 4.14Å; L2422-I2424 HydrophobicContact CB-CG1 4.02Å; L2422-I2424 HydrophobicContact CD1-CD1 4.34Å; L2422-V2440 HydrophobicContact CD1-CG1 4.33Å; L2422-P2443 PolarHBondContact N-O 3.13Å; L2422-I2444 HydrophobicContact CB-CG1 4.36Å; L2422-I2444 CarbonylContact O-C 3.5Å; L2422-I2444 VanDerWaalsContact O-CA 3.26Å; L2422-I2444 WeakPolarHBondContact O-CA 3.4Å; L2422-I2445 PolarHBondContact O-N 2.87Å
2423	V	95.7	Very high	87.6	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	115.7	169	179.7	0	0	0	0	106.7	M2366 G2367 L2369 F2370 F2381 I2445 A2447	M2366-V2423 HydrophobicContact CE-CG2 4.47Å; M2366-V2423 HydrophobicContact CG-CG2 3.97Å; M2366-V2423 HydrophobicContact SD-CG2 3.57Å; M2366-V2423 VanDerWaalsContact SD-CG2 3.57Å; G2367-V2423 PolarHBondContact O-N 2.74Å; L2369-V2423 PolarHBondContact N-O 2.93Å; F2370-V2423 HydrophobicContact CE2-CG1 4.15Å; F2381-V2423 HydrophobicContact CD1-CG1 4.35Å; F2381-V2423 HydrophobicContact CD1-CG2 3.94Å; F2381-V2423 HydrophobicContact CD2-CG1 3.74Å; F2381-V2423 HydrophobicContact CE1-CG1 4.4Å; F2381-V2423 HydrophobicContact CE1-CG2 4.13Å; F2381-V2423 HydrophobicContact CE2-CG1 3.8Å; F2381-V2423 HydrophobicContact CG-CG1 4.03Å; F2381-V2423 HydrophobicContact CG-CG2 4.27Å; F2381-V2423 HydrophobicContact CZ-CG1 4.13Å; V2423-I2445 HydrophobicContact CG2-CB 4.26Å; V2423-I2445 HydrophobicContact CG2-CD1 4.33Å; V2423-A2447 HydrophobicContact CG1-CB 3.62Å
2424	I	92.7	Very high	87.5	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	131.8	-172.1	-47	-179.8	0	0	0	110.3	L2369 F2371 V2412 L2422 I2432 L2435 I2444 I2445 A2447	L2369-I2424 HydrophobicContact CB-CG1 4.26Å; L2369-I2424 HydrophobicContact CB-CG2 4.21Å; L2369-I2424 HydrophobicContact CD2-CD1 4.4Å; L2369-I2424 HydrophobicContact CD2-CG1 4.36Å; L2369-I2424 CarbonylContact O-C 3.47Å; L2369-I2424 VanDerWaalsContact O-CA 3.3Å; L2369-I2424 WeakPolarHBondContact O-CA 3.38Å; F2371-I2424 HydrophobicContact CD2-CG2 4.19Å; F2371-I2424 HydrophobicContact CE2-CG2 3.9Å; V2412-I2424 HydrophobicContact CG1-CD1 3.93Å; V2412-I2424 HydrophobicContact CG2-CD1 4.1Å; L2422-I2424 HydrophobicContact CB-CD1 4.14Å; L2422-I2424 HydrophobicContact CB-CG1 4.02Å; L2422-I2424 HydrophobicContact CD1-CD1 4.34Å; I2424-I2432 HydrophobicContact CB-CD1 3.71Å; I2424-I2432 HydrophobicContact CG2-CD1 3.37Å; I2424-L2435 HydrophobicContact CD1-CD1 4.42Å; I2424-L2435 HydrophobicContact CG2-CD1 4.48Å; I2424-I2444 HydrophobicContact CD1-CD1 4.27Å; I2424-I2444 HydrophobicContact CD1-CG2 3.87Å; I2424-I2444 HydrophobicContact CG1-CG2 4.09Å; I2424-I2445 PolarHBondContact N-O 3.24Å; I2424-A2447 PolarHBondContact O-N 2.97Å
2425	R	91.9	Very high	87.5	Confident	25 Å²	25	37.3 Å²	37.3	9%	0.094	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	125.5	169	-177.4	174.1	172	163.5	-29.9	110	L2369 F2370 F2371 E2372 P2373 S2374 A2447 G2448	L2369-R2425 PolarHBondContact O-N 3.44Å; F2370-R2425 HydrophobicContact CD1-CB 3.72Å; F2370-R2425 HydrophobicContact CD1-CG 4.23Å; F2370-R2425 HydrophobicContact CD2-CB 4.45Å; F2370-R2425 HydrophobicContact CE1-CB 3.8Å; F2370-R2425 VanDerWaalsContact CE1-CD 3.46Å; F2370-R2425 HydrophobicContact CE1-CG 4.29Å; F2370-R2425 HydrophobicContact CG-CB 4.05Å; F2370-R2425 HydrophobicContact CZ-CB 4.21Å; F2371-R2425 WeakPolarHBondContact CB-O 3.28Å; F2371-R2425 WeakPolarHBondContact CD2-O 3.28Å; F2371-R2425 PolarHBondContact N-O 3.36Å; E2372-R2425 HydrophobicContact CB-CG 4.36Å; E2372-R2425 WeakPolarHBondContact O-CD 3.48Å; E2372-R2425 IonicContact OE2-CZ 2.69Å; E2372-R2425 IonicContact OE2-NE 2.75Å; E2372-R2425 PolarHBondContact OE2-NE 2.91Å; E2372-R2425 IonicContact OE2-NH2 3.95Å; E2372-R2425 PolarHBondContact OE2-NH2 3.34Å; E2372-R2425 VanDerWaalsContact OE2-NH2 3.09Å; P2373-R2425 PolarHBondContact O-NH2 2.92Å; S2374-R2425 PolarHBondContact OG-NH1 2.78Å; S2374-R2425 VanDerWaalsContact OG-NH1 3.13Å; R2425-A2447 HydrophobicContact CB-CB 4.06Å; R2425-A2447 WeakPolarHBondContact CD-O 3.39Å; R2425-G2448 CarbonylContact C-O 3.56Å; R2425-G2448 VanDerWaalsContact CA-O 3.3Å; R2425-G2448 WeakPolarHBondContact CA-O 3.35Å; R2425-G2448 WeakPolarHBondContact CG-O 3.46Å
2426	H	88.7	Confident	87.4	Confident	36 Å²	36	37 Å²	37	17%	0.167	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	144.7	-173.5	-167.7	-88.1	0	0	0	111.8	F2371 G2428 A2431 I2432 G2448 D2449 G2450	F2371-H2426 HydrophobicContact CD2-CB 4.37Å; F2371-H2426 AromaticContact CD2-CD2 3.68Å; F2371-H2426 AromaticContact CG-CD2 3.99Å; H2426-G2428 PolarHBondContact ND1-N 3.01Å; H2426-A2431 HydrophobicContact CB-CB 4.12Å; H2426-A2431 WeakPolarHBondContact ND1-CB 3.42Å; H2426-I2432 HydrophobicContact CB-CD1 3.6Å; H2426-I2432 HydrophobicContact CB-CG1 4.34Å; H2426-G2448 PolarHBondContact N-O 2.68Å; H2426-D2449 CarbonylContact O-C 3.55Å; H2426-D2449 VanDerWaalsContact O-CA 3.24Å; H2426-D2449 WeakPolarHBondContact O-CA 3.35Å; H2426-G2450 PolarHBondContact O-N 2.98Å
2427	P	84.2	Confident	87.2	Confident	71 Å²	71	42.1 Å²	42.1	46%	0.461	25%	0.249	S	C	.	.	S	Bend	trans	-73.8	-21.6	-178.9	27	-35.1	0	0	0	114.7	G2450	P2427-G2450 WeakPolarHBondContact O-CA 3.31Å; P2427-G2450 PolarHBondContact O-N 3.07Å
2428	G	82.4	Confident	86.3	Confident	28 Å²	28	40 Å²	40	29%	0.289	22%	0.224	S	C	.	.	S	Bend	trans	-83	135.8	177.8	0	0	0	0	0	114.5	H2426 A2431 D2449	H2426-G2428 PolarHBondContact ND1-N 3.01Å; G2428-A2431 WeakPolarHBondContact O-CB 3.21Å; G2428-A2431 PolarHBondContact O-N 3.3Å; G2428-D2449 CarbonylContact O-C 3.41Å
2429	K	83.1	Confident	85.1	Confident	111 Å²	111	37.7 Å²	37.7	48%	0.483	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	129.5	172.1	-172	-172.6	-167.3	176.5	0	110.1	A2431 I2451 E2517	K2429-A2431 PolarHBondContact O-N 3.02Å; K2429-I2451 HydrophobicContact CB-CG1 4.06Å; K2429-I2451 HydrophobicContact CD-CD1 4.12Å; K2429-I2451 HydrophobicContact CD-CG1 3.81Å; K2429-I2451 HydrophobicContact CG-CG1 4.1Å; K2429-E2517 IonicContact NZ-OE1 3.62Å; K2429-E2517 PolarHBondContact NZ-OE1 3.02Å; K2429-E2517 IonicContact NZ-OE2 2.78Å
2430	G	80.1	Confident	83.9	Confident	32 Å²	32	37.9 Å²	37.9	33%	0.33	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.3	0.6	179	0	0	0	0	0	115.2	I2432 Q2433 A2434 D2449	G2430-I2432 VanDerWaalsContact C-N 3.32Å; G2430-I2432 PolarHBondContact O-N 3.09Å; G2430-Q2433 WeakPolarHBondContact O-CB 3.39Å; G2430-Q2433 PolarHBondContact O-N 3.36Å; G2430-A2434 PolarHBondContact O-N 3.41Å; G2430-D2449 WeakPolarHBondContact CA-OD2 3.1Å; G2430-D2449 PolarHBondContact N-OD2 3.29Å
2431	A	84.3	Confident	83.2	Confident	20 Å²	20	44 Å²	44	17%	0.165	25%	0.249	C	C	.	.	H	α-helix	trans	-64.2	-35.7	-174.9	0	0	0	0	0	112.9	H2426 G2428 K2429 A2434 L2435	H2426-A2431 HydrophobicContact CB-CB 4.12Å; H2426-A2431 WeakPolarHBondContact ND1-CB 3.42Å; G2428-A2431 WeakPolarHBondContact O-CB 3.21Å; G2428-A2431 PolarHBondContact O-N 3.3Å; K2429-A2431 PolarHBondContact O-N 3.02Å; A2431-A2434 PolarHBondContact O-N 2.94Å; A2431-L2435 WeakPolarHBondContact O-CG 3.08Å; A2431-L2435 PolarHBondContact O-N 3.39Å
2432	I	88.7	Confident	82.9	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-69.7	-37.6	178.4	-54.2	-53.3	0	0	0	111.1	L2327 I2424 H2426 G2430 A2434 L2435 A2436 I2444 N2446 D2449	L2327-I2432 HydrophobicContact CD2-CG2 3.9Å; I2424-I2432 HydrophobicContact CB-CD1 3.71Å; I2424-I2432 HydrophobicContact CG2-CD1 3.37Å; H2426-I2432 HydrophobicContact CB-CD1 3.6Å; H2426-I2432 HydrophobicContact CB-CG1 4.34Å; G2430-I2432 VanDerWaalsContact C-N 3.32Å; G2430-I2432 PolarHBondContact O-N 3.09Å; I2432-A2434 VanDerWaalsContact C-N 3.34Å; I2432-L2435 HydrophobicContact CD1-CD1 4.17Å; I2432-L2435 PolarHBondContact O-N 2.94Å; I2432-A2436 WeakPolarHBondContact O-CB 3.23Å; I2432-A2436 PolarHBondContact O-N 3.15Å; I2432-I2444 HydrophobicContact CG2-CG2 3.8Å; I2432-N2446 HydrophobicContact CG2-CB 4.08Å; I2432-D2449 HydrophobicContact CB-CB 4.46Å; I2432-D2449 HydrophobicContact CG1-CB 3.79Å
2433	Q	84.3	Confident	82.8	Confident	84 Å²	84	48.5 Å²	48.5	39%	0.393	27%	0.271	S	S	.	.	H	α-helix	trans	-62.4	-43.1	172.5	-172.6	68	48.6	0	0	111	G2430 A2436 N2437	G2430-Q2433 WeakPolarHBondContact O-CB 3.39Å; G2430-Q2433 PolarHBondContact O-N 3.36Å; Q2433-A2436 PolarHBondContact O-N 3.12Å; Q2433-N2437 PolarHBondContact NE2-OD1 3.2Å; Q2433-N2437 PolarHBondContact O-N 2.91Å; Q2433-N2437 PolarHBondContact O-ND2 2.7Å; Q2433-N2437 PolarHBondContact O-OD1 3.05Å
2434	A	81.3	Confident	82.7	Confident	60 Å²	60	48.5 Å²	48.5	50%	0.496	27%	0.271	S	S	.	.	H	α-helix	trans	-62.5	-41.5	175.8	0	0	0	0	0	112.2	G2430 A2431 I2432 N2437 S2438	G2430-A2434 PolarHBondContact O-N 3.41Å; A2431-A2434 PolarHBondContact O-N 2.94Å; I2432-A2434 VanDerWaalsContact C-N 3.34Å; A2434-N2437 PolarHBondContact O-N 2.85Å; A2434-S2438 WeakPolarHBondContact O-CB 3.45Å; A2434-S2438 PolarHBondContact O-N 3.47Å
2435	L	84.8	Confident	82.8	Confident	13 Å²	13	48.5 Å²	48.5	7%	0.068	27%	0.271	C	S	.	.	H	α-helix	trans	-63.7	-46.2	175.6	-74.9	168.5	0	0	0	112.1	T2408 L2409 V2412 I2424 A2431 I2432 N2437 S2438	T2408-L2435 HydrophobicContact CG2-CD1 4.48Å; L2409-L2435 HydrophobicContact CB-CD2 4.33Å; V2412-L2435 HydrophobicContact CB-CD2 4.2Å; V2412-L2435 HydrophobicContact CG1-CD2 4.37Å; V2412-L2435 HydrophobicContact CG2-CD1 4.09Å; V2412-L2435 HydrophobicContact CG2-CD2 4.07Å; I2424-L2435 HydrophobicContact CD1-CD1 4.42Å; I2424-L2435 HydrophobicContact CG2-CD1 4.48Å; A2431-L2435 WeakPolarHBondContact O-CG 3.08Å; A2431-L2435 PolarHBondContact O-N 3.39Å; I2432-L2435 HydrophobicContact CD1-CD1 4.17Å; I2432-L2435 PolarHBondContact O-N 2.94Å; L2435-N2437 VanDerWaalsContact C-N 3.25Å; L2435-N2437 PolarHBondContact O-N 3.13Å; L2435-S2438 WeakPolarHBondContact CA-OG 3.45Å; L2435-S2438 PolarHBondContact O-N 3.01Å; L2435-S2438 PolarHBondContact O-OG 3.01Å
2436	A	83.6	Confident	82.9	Confident	10 Å²	10	47.5 Å²	47.5	8%	0.083	27%	0.267	C	S	.	.	H	α-helix	trans	-60.2	-35.7	177.3	0	0	0	0	0	112.4	L2327 I2432 Q2433 S2438 I2444	L2327-A2436 HydrophobicContact CD1-CB 3.67Å; L2327-A2436 HydrophobicContact CD2-CB 3.85Å; L2327-A2436 HydrophobicContact CG-CB 4.43Å; I2432-A2436 WeakPolarHBondContact O-CB 3.23Å; I2432-A2436 PolarHBondContact O-N 3.15Å; Q2433-A2436 PolarHBondContact O-N 3.12Å; A2436-S2438 PolarHBondContact O-N 3.1Å; A2436-I2444 HydrophobicContact CB-CD1 4.18Å
2437	N	80.4	Confident	83	Confident	120 Å²	120	45.8 Å²	45.8	64%	0.642	26%	0.259	S	S	*	.	H	α-helix	trans	-72.2	-13.7	176.2	-66.8	-9.6	0	0	0	113.5	Q2433 A2434 L2435 I2439	Q2433-N2437 PolarHBondContact NE2-OD1 3.2Å; Q2433-N2437 PolarHBondContact O-N 2.91Å; Q2433-N2437 PolarHBondContact O-ND2 2.7Å; Q2433-N2437 PolarHBondContact O-OD1 3.05Å; A2434-N2437 PolarHBondContact O-N 2.85Å; L2435-N2437 VanDerWaalsContact C-N 3.25Å; L2435-N2437 PolarHBondContact O-N 3.13Å; N2437-I2439 PolarHBondContact O-N 3.4Å
2438	S	66.3	Low	83.4	Confident	20 Å²	20	42.4 Å²	42.4	14%	0.14	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.2	39.5	-164.7	72.9	0	0	0	0	117	L2409 R2413 A2434 L2435 A2436	L2409-S2438 VanDerWaalsContact CD1-CB 3.47Å; L2409-S2438 WeakPolarHBondContact CD1-OG 3.22Å; R2413-S2438 PolarHBondContact NE-O 2.83Å; R2413-S2438 PolarHBondContact NH2-O 2.87Å; A2434-S2438 WeakPolarHBondContact O-CB 3.45Å; A2434-S2438 PolarHBondContact O-N 3.47Å; L2435-S2438 WeakPolarHBondContact CA-OG 3.45Å; L2435-S2438 PolarHBondContact O-N 3.01Å; L2435-S2438 PolarHBondContact O-OG 3.01Å; A2436-S2438 PolarHBondContact O-N 3.1Å
2439	I	61.6	Low	83.6	Confident	117 Å²	117	41.6 Å²	41.6	60%	0.6	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	81.3	17.8	177.9	-40.8	177.3	0	0	0	114.5	N2437 H2441	N2437-I2439 PolarHBondContact O-N 3.4Å; I2439-H2441 PolarHBondContact O-N 2.93Å
2440	V	68.7	Low	83.5	Confident	7 Å²	7	36.5 Å²	36.5	4%	0.042	21%	0.205	C	C	.	.			trans	-87	104.8	173.7	-175.9	0	0	0	0	110.3	H2325 V2412 A2416 L2422 K2442 I2444	H2325-V2440 PolarHBondContact CE1-O 2.92Å; H2325-V2440 VanDerWaalsContact CE1-O 3.25Å; H2325-V2440 PolarHBondContact NE2-O 2.82Å; V2412-V2440 HydrophobicContact CG1-CG2 4.01Å; A2416-V2440 HydrophobicContact CB-CG1 3.81Å; L2422-V2440 HydrophobicContact CD1-CG1 4.33Å; V2440-K2442 HydrophobicContact CG1-CB 4.49Å; V2440-I2444 HydrophobicContact CB-CD1 4.01Å; V2440-I2444 HydrophobicContact CG1-CD1 3.83Å; V2440-I2444 HydrophobicContact CG1-CG1 4.12Å; V2440-I2444 HydrophobicContact CG2-CD1 4.42Å
2441	H	77.6	Confident	83.6	Confident	170 Å²	170	37.9 Å²	37.9	79%	0.787	20%	0.204	S	C	*	.			trans	-81.3	-9.6	-179.5	-63.8	-62	0	0	0	114.8	I2439	I2439-H2441 PolarHBondContact O-N 2.93Å
2442	K	86	Confident	83.6	Confident	80 Å²	80	37.3 Å²	37.3	35%	0.348	20%	0.201	S	C	.	.	S	Bend	trans	-85.9	143.3	177.5	-64.3	-65.6	-169.8	168.4	0	110.6	H2325 A2416 V2440 I2444	H2325-K2442 PolarHBondContact CE1-O 3.14Å; H2325-K2442 PolarHBondContact ND1-O 2.86Å; A2416-K2442 HydrophobicContact CB-CG 4.49Å; A2416-K2442 WeakPolarHBondContact O-CG 3.37Å; V2440-K2442 HydrophobicContact CG1-CB 4.49Å; K2442-I2444 PolarHBondContact O-N 2.84Å
2443	P	91.7	Very high	83.5	Confident	15 Å²	15	38.3 Å²	38.3	10%	0.097	21%	0.205	C	C	.	.			trans	-52.6	131.5	176.8	-27	34.4	0	0	0	112.6	D2420 C2421 L2422 V2623	D2420-P2443 WeakPolarHBondContact O-CD 3.49Å; C2421-P2443 WeakPolarHBondContact CA-O 3.45Å; C2421-P2443 HydrophobicContact CB-CB 4.24Å; L2422-P2443 PolarHBondContact N-O 3.13Å; P2443-V2623 HydrophobicContact CB-CG1 3.56Å; P2443-V2623 HydrophobicContact CG-CG1 4.16Å
2444	I	93.4	Very high	83.9	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	131.1	175.6	-61.2	179.6	0	0	0	107.7	H2325 I2326 L2422 I2424 I2432 A2436 V2440 K2442	H2325-I2444 CarbonylContact C-O 3.55Å; H2325-I2444 VanDerWaalsContact CA-O 3.32Å; H2325-I2444 WeakPolarHBondContact CA-O 3.44Å; H2325-I2444 PolarHBondContact ND1-N 3.45Å; I2326-I2444 PolarHBondContact N-O 2.91Å; L2422-I2444 HydrophobicContact CB-CG1 4.36Å; L2422-I2444 CarbonylContact O-C 3.5Å; L2422-I2444 VanDerWaalsContact O-CA 3.26Å; L2422-I2444 WeakPolarHBondContact O-CA 3.4Å; I2424-I2444 HydrophobicContact CD1-CD1 4.27Å; I2424-I2444 HydrophobicContact CD1-CG2 3.87Å; I2424-I2444 HydrophobicContact CG1-CG2 4.09Å; I2432-I2444 HydrophobicContact CG2-CG2 3.8Å; A2436-I2444 HydrophobicContact CB-CD1 4.18Å; V2440-I2444 HydrophobicContact CB-CD1 4.01Å; V2440-I2444 HydrophobicContact CG1-CD1 3.83Å; V2440-I2444 HydrophobicContact CG1-CG1 4.12Å; V2440-I2444 HydrophobicContact CG2-CD1 4.42Å; K2442-I2444 PolarHBondContact O-N 2.84Å
2445	I	95	Very high	84.4	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	121.6	175.3	-60	173.8	0	0	0	108.5	I2326 F2381 L2422 V2423 I2424 A2447 T2456 L2619 L2620 V2623	I2326-I2445 HydrophobicContact CB-CG1 4.45Å; I2326-I2445 HydrophobicContact CG1-CG1 4.43Å; F2381-I2445 HydrophobicContact CE1-CG2 4.3Å; F2381-I2445 HydrophobicContact CZ-CG2 3.95Å; L2422-I2445 PolarHBondContact O-N 2.87Å; V2423-I2445 HydrophobicContact CG2-CB 4.26Å; V2423-I2445 HydrophobicContact CG2-CD1 4.33Å; I2424-I2445 PolarHBondContact N-O 3.24Å; I2445-A2447 PolarHBondContact O-N 3.48Å; I2445-T2456 HydrophobicContact CG2-CG2 3.57Å; I2445-L2619 HydrophobicContact CG2-CD2 4.22Å; I2445-L2620 HydrophobicContact CD1-CD2 3.94Å; I2445-V2623 HydrophobicContact CD1-CG1 4.41Å; I2445-V2623 HydrophobicContact CD1-CG2 4.36Å
2446	N	94.3	Very high	84.8	Confident	4 Å²	4	31.1 Å²	31.1	2%	0.021	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	108	175.9	-174.3	1.5	0	0	0	110.6	I2326 L2327 I2432 G2448 D2449 P2455	I2326-N2446 WeakPolarHBondContact O-CB 3.2Å; I2326-N2446 PolarHBondContact O-N 3.07Å; L2327-N2446 WeakPolarHBondContact O-CB 3.48Å; L2327-N2446 PolarHBondContact O-ND2 3.17Å; I2432-N2446 HydrophobicContact CG2-CB 4.08Å; N2446-G2448 WeakPolarHBondContact OD1-CA 3.32Å; N2446-G2448 PolarHBondContact OD1-N 2.81Å; N2446-D2449 PolarHBondContact ND2-OD1 2.94Å; N2446-P2455 HydrophobicContact CB-CG 3.96Å
2447	A	92.1	Very high	85.2	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	13.3	173.6	0	0	0	0	0	113.1	F2370 T2377 F2381 V2423 I2424 R2425 I2445 H2454	F2370-A2447 HydrophobicContact CE1-CB 4.44Å; F2370-A2447 HydrophobicContact CE2-CB 4.27Å; F2370-A2447 HydrophobicContact CZ-CB 3.75Å; T2377-A2447 HydrophobicContact CG2-CB 4.08Å; F2381-A2447 HydrophobicContact CE2-CB 4.33Å; V2423-A2447 HydrophobicContact CG1-CB 3.62Å; I2424-A2447 PolarHBondContact O-N 2.97Å; R2425-A2447 HydrophobicContact CB-CB 4.06Å; R2425-A2447 WeakPolarHBondContact CD-O 3.39Å; I2445-A2447 PolarHBondContact O-N 3.48Å; A2447-H2454 VanDerWaalsContact C-CE1 3.41Å; A2447-H2454 PolarHBondContact O-CE1 2.68Å; A2447-H2454 PolarHBondContact O-NE2 2.85Å; A2447-H2454 VanDerWaalsContact O-NE2 3.11Å
2448	G	91.1	Very high	85.7	Confident	0 Å²	0	25 Å²	25	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	127.4	129.6	174.5	0	0	0	0	0	112.4	R2425 H2426 N2446 E2453	R2425-G2448 CarbonylContact C-O 3.56Å; R2425-G2448 VanDerWaalsContact CA-O 3.3Å; R2425-G2448 WeakPolarHBondContact CA-O 3.35Å; R2425-G2448 WeakPolarHBondContact CG-O 3.46Å; H2426-G2448 PolarHBondContact N-O 2.68Å; N2446-G2448 WeakPolarHBondContact OD1-CA 3.32Å; N2446-G2448 PolarHBondContact OD1-N 2.81Å; G2448-E2453 WeakPolarHBondContact CA-O 3.36Å
2449	D	86.5	Confident	87	Confident	11 Å²	11	24.1 Å²	24.1	6%	0.059	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	95.3	178.1	69.4	-60.1	0	0	0	112.7	H2426 G2428 G2430 I2432 N2446 I2451 G2452 E2453	H2426-D2449 CarbonylContact O-C 3.55Å; H2426-D2449 VanDerWaalsContact O-CA 3.24Å; H2426-D2449 WeakPolarHBondContact O-CA 3.35Å; G2428-D2449 CarbonylContact O-C 3.41Å; G2430-D2449 WeakPolarHBondContact CA-OD2 3.1Å; G2430-D2449 PolarHBondContact N-OD2 3.29Å; I2432-D2449 HydrophobicContact CB-CB 4.46Å; I2432-D2449 HydrophobicContact CG1-CB 3.79Å; N2446-D2449 PolarHBondContact ND2-OD1 2.94Å; D2449-I2451 PolarHBondContact O-N 2.8Å; D2449-G2452 VanDerWaalsContact O-CA 3.28Å; D2449-G2452 WeakPolarHBondContact O-CA 3.42Å; D2449-G2452 PolarHBondContact O-N 3.43Å; D2449-E2453 PolarHBondContact N-O 3.15Å; D2449-E2453 PolarHBondContact OD1-N 3.49Å
2450	G	82.6	Confident	88.6	Confident	3 Å²	3	18.5 Å²	18.5	3%	0.031	9%	0.092	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.4	-129.6	-179.3	0	0	0	0	0	114.4	H2426 P2427 G2452 R2487 R2554	H2426-G2450 PolarHBondContact O-N 2.98Å; P2427-G2450 WeakPolarHBondContact O-CA 3.31Å; P2427-G2450 PolarHBondContact O-N 3.07Å; G2450-G2452 VanDerWaalsContact C-N 3.26Å; G2450-R2487 WeakPolarHBondContact O-CD 3.28Å; G2450-R2554 VanDerWaalsContact O-CZ 3.24Å; G2450-R2554 PolarHBondContact O-NH1 2.92Å; G2450-R2554 PolarHBondContact O-NH2 3Å
2451	I	82.3	Confident	89.8	Confident	61 Å²	61	18.2 Å²	18.2	31%	0.313	9%	0.09	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.2	6.2	171.4	62.1	167.5	0	0	0	113.6	K2429 D2449 N2485 H2490	K2429-I2451 HydrophobicContact CB-CG1 4.06Å; K2429-I2451 HydrophobicContact CD-CD1 4.12Å; K2429-I2451 HydrophobicContact CD-CG1 3.81Å; K2429-I2451 HydrophobicContact CG-CG1 4.1Å; D2449-I2451 PolarHBondContact O-N 2.8Å; I2451-N2485 HydrophobicContact CG2-CB 4.19Å; I2451-H2490 PolarHBondContact O-CE1 2.68Å; I2451-H2490 PolarHBondContact O-ND1 2.69Å; I2451-H2490 VanDerWaalsContact O-ND1 3.08Å
2452	G	83	Confident	90.6	Very high	9 Å²	9	10.1 Å²	10.1	9%	0.093	5%	0.052	C	C	.	.	S	Bend	trans	-73.5	-115.4	-179.6	0	0	0	0	0	112.5	D2449 G2450 R2487 H2490	D2449-G2452 VanDerWaalsContact O-CA 3.28Å; D2449-G2452 WeakPolarHBondContact O-CA 3.42Å; D2449-G2452 PolarHBondContact O-N 3.43Å; G2450-G2452 VanDerWaalsContact C-N 3.26Å; G2452-R2487 WeakPolarHBondContact O-CA 3.43Å; G2452-R2487 WeakPolarHBondContact O-CB 3.29Å; G2452-H2490 PolarHBondContact O-ND1 2.64Å
2453	E	87.8	Confident	90.9	Very high	21 Å²	21	6.3 Å²	6.3	10%	0.098	4%	0.036	C	C	.	.			trans	-120.2	160	-172.2	-73	-154.4	-130.2	0	0	112.8	S2328 S2329 G2448 D2449 S2491 R2494	S2328-E2453 VanDerWaalsContact OG-CD 3.26Å; S2328-E2453 PolarHBondContact OG-OE1 3.43Å; S2328-E2453 PolarHBondContact OG-OE2 3.16Å; S2329-E2453 PolarHBondContact N-OE2 3.12Å; G2448-E2453 WeakPolarHBondContact CA-O 3.36Å; D2449-E2453 PolarHBondContact N-O 3.15Å; D2449-E2453 PolarHBondContact OD1-N 3.49Å; E2453-S2491 WeakPolarHBondContact CA-OG 3.45Å; E2453-S2491 VanDerWaalsContact CB-OG 3.24Å; E2453-S2491 WeakPolarHBondContact CB-OG 3.38Å; E2453-S2491 PolarHBondContact OE2-OG 3.1Å; E2453-S2491 VanDerWaalsContact OE2-OG 3.11Å; E2453-R2494 IonicContact OE1-CZ 2.75Å; E2453-R2494 IonicContact OE1-NE 2.93Å; E2453-R2494 IonicContact OE1-NH1 3.3Å; E2453-R2494 PolarHBondContact OE1-NH1 2.92Å
2454	H	92.2	Very high	91	Very high	3 Å²	3	5.6 Å²	5.6	1%	0.014	3%	0.031	C	C	.	.			trans	-142.3	73.2	167.7	-164.6	-11.9	0	0	0	109.3	A2447 T2456 Q2457 A2458 R2487 T2488 S2491	A2447-H2454 VanDerWaalsContact C-CE1 3.41Å; A2447-H2454 PolarHBondContact O-CE1 2.68Å; A2447-H2454 PolarHBondContact O-NE2 2.85Å; A2447-H2454 VanDerWaalsContact O-NE2 3.11Å; H2454-T2456 VanDerWaalsContact C-N 3.27Å; H2454-T2456 PolarHBondContact CE1-OG1 2.9Å; H2454-T2456 VanDerWaalsContact CE1-OG1 3.27Å; H2454-T2456 PolarHBondContact ND1-OG1 3.32Å; H2454-T2456 PolarHBondContact O-N 3.02Å; H2454-Q2457 HydrophobicContact CB-CB 4.22Å; H2454-Q2457 WeakPolarHBondContact O-CB 3.03Å; H2454-Q2457 PolarHBondContact O-N 3.15Å; H2454-A2458 PolarHBondContact O-N 3.36Å; H2454-R2487 HydrophobicContact CB-CG 4.21Å; H2454-T2488 HydrophobicContact CB-CG2 4.3Å; H2454-S2491 PolarHBondContact N-OG 3.28Å
2455	P	92.4	Very high	90.9	Very high	0 Å²	0	5.6 Å²	5.6	0%	0	3%	0.031	C	C	.	.	H	α-helix	trans	-58.1	-39	-170.1	19.9	-31.9	0	0	0	112.9	N2446 Q2457 A2458 L2459	N2446-P2455 HydrophobicContact CB-CG 3.96Å; P2455-Q2457 VanDerWaalsContact C-N 3.26Å; P2455-Q2457 PolarHBondContact O-N 3.25Å; P2455-A2458 PolarHBondContact O-N 3.33Å; P2455-A2458 VanDerWaalsContact O-N 3.13Å; P2455-L2459 WeakPolarHBondContact O-CG 3.33Å; P2455-L2459 PolarHBondContact O-N 2.85Å
2456	T	92.4	Very high	90.3	Very high	2 Å²	2	8 Å²	8	1%	0.012	4%	0.04	C	C	.	.	H	α-helix	trans	-69.1	-22.5	-178.1	60.9	0	0	0	0	114.1	F2381 I2445 H2454 L2619	F2381-T2456 HydrophobicContact CZ-CG2 3.89Å; I2445-T2456 HydrophobicContact CG2-CG2 3.57Å; H2454-T2456 VanDerWaalsContact C-N 3.27Å; H2454-T2456 PolarHBondContact CE1-OG1 2.9Å; H2454-T2456 VanDerWaalsContact CE1-OG1 3.27Å; H2454-T2456 PolarHBondContact ND1-OG1 3.32Å; H2454-T2456 PolarHBondContact O-N 3.02Å; T2456-L2619 HydrophobicContact CG2-CD2 3.48Å; T2456-L2619 VanDerWaalsContact CG2-CD2 3.48Å
2457	Q	91.2	Very high	89.8	Confident	3 Å²	3	8.6 Å²	8.6	1%	0.014	4%	0.043	C	C	.	.	H	α-helix	trans	-76.8	-41.3	170	-172.6	63.7	44.2	0	0	110.9	H2454 P2455 L2459 L2460 D2461 T2488	H2454-Q2457 HydrophobicContact CB-CB 4.22Å; H2454-Q2457 WeakPolarHBondContact O-CB 3.03Å; H2454-Q2457 PolarHBondContact O-N 3.15Å; P2455-Q2457 VanDerWaalsContact C-N 3.26Å; P2455-Q2457 PolarHBondContact O-N 3.25Å; Q2457-L2459 VanDerWaalsContact C-N 3.31Å; Q2457-L2459 PolarHBondContact O-N 3.09Å; Q2457-L2460 WeakPolarHBondContact O-CG 3.25Å; Q2457-L2460 PolarHBondContact O-N 3.34Å; Q2457-D2461 PolarHBondContact NE2-OD1 3.43Å; Q2457-D2461 PolarHBondContact O-N 3.09Å; Q2457-T2488 HydrophobicContact CB-CG2 4.19Å; Q2457-T2488 HydrophobicContact CG-CG2 3.74Å
2458	A	91.5	Very high	89.4	Confident	0 Å²	0	11.2 Å²	11.2	0%	0	6%	0.055	C	C	.	.	H	α-helix	trans	-60.8	-40.3	175.8	0	0	0	0	0	112.5	H2454 P2455 L2460 D2461 V2462 S2491 L2492 L2495	H2454-A2458 PolarHBondContact O-N 3.36Å; P2455-A2458 PolarHBondContact O-N 3.33Å; P2455-A2458 VanDerWaalsContact O-N 3.13Å; A2458-L2460 PolarHBondContact O-N 3.28Å; A2458-D2461 PolarHBondContact O-N 3.43Å; A2458-V2462 WeakPolarHBondContact O-CG2 3.47Å; A2458-V2462 PolarHBondContact O-N 2.86Å; A2458-V2462 VanDerWaalsContact O-N 3.09Å; A2458-S2491 WeakPolarHBondContact CB-O 3.16Å; A2458-L2492 HydrophobicContact CB-CB 4.35Å; A2458-L2495 HydrophobicContact CB-CB 4.18Å; A2458-L2495 HydrophobicContact CB-CD2 3.83Å
2459	L	94.5	Very high	88.8	Confident	0 Å²	0	13.6 Å²	13.6	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-57.4	-46.6	176.2	-68.5	175.6	0	0	0	112.1	F2332 L2337 L2340 Y2341 P2455 Q2457 D2461 F2463 L2495 V2615 L2619	F2332-L2459 HydrophobicContact CD1-CD2 4.25Å; F2332-L2459 HydrophobicContact CD2-CD2 4.18Å; F2332-L2459 HydrophobicContact CE1-CD1 4.19Å; F2332-L2459 HydrophobicContact CE1-CD2 4.36Å; F2332-L2459 HydrophobicContact CE2-CD1 3.98Å; F2332-L2459 HydrophobicContact CE2-CD2 4.29Å; F2332-L2459 HydrophobicContact CE2-CG 4.46Å; F2332-L2459 HydrophobicContact CG-CD2 4.16Å; F2332-L2459 HydrophobicContact CZ-CD1 3.72Å; F2332-L2459 HydrophobicContact CZ-CD2 4.39Å; L2337-L2459 HydrophobicContact CD2-CD2 3.21Å; L2340-L2459 HydrophobicContact CD1-CD1 4.34Å; Y2341-L2459 HydrophobicContact CE1-CB 4.44Å; Y2341-L2459 WeakPolarHBondContact CE1-O 3.28Å; Y2341-L2459 PolarHBondContact OH-O 3.02Å; Y2341-L2459 VanDerWaalsContact OH-O 3.11Å; P2455-L2459 WeakPolarHBondContact O-CG 3.33Å; P2455-L2459 PolarHBondContact O-N 2.85Å; Q2457-L2459 VanDerWaalsContact C-N 3.31Å; Q2457-L2459 PolarHBondContact O-N 3.09Å; L2459-D2461 VanDerWaalsContact C-N 3.34Å; L2459-F2463 WeakPolarHBondContact O-CB 3.43Å; L2459-F2463 PolarHBondContact O-N 3.21Å; L2459-F2463 VanDerWaalsContact O-N 3.07Å; L2459-L2495 HydrophobicContact CD2-CD2 3.96Å; L2459-V2615 HydrophobicContact CB-CG1 3.81Å; L2459-L2619 HydrophobicContact CD1-CD1 4.45Å; L2459-L2619 HydrophobicContact CD1-CD2 4.29Å
2460	L	94.3	Very high	87.8	Confident	0 Å²	0	14.7 Å²	14.7	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-74	-29.1	-177.7	82.2	86.5	0	0	0	112.4	Q2457 A2458 F2463 T2464 Q2608 V2615	Q2457-L2460 WeakPolarHBondContact O-CG 3.25Å; Q2457-L2460 PolarHBondContact O-N 3.34Å; A2458-L2460 PolarHBondContact O-N 3.28Å; L2460-F2463 PolarHBondContact O-N 2.67Å; L2460-T2464 WeakPolarHBondContact O-CB 3.4Å; L2460-T2464 PolarHBondContact O-N 3.35Å; L2460-T2464 PolarHBondContact O-OG1 2.88Å; L2460-Q2608 HydrophobicContact CD1-CG 3.6Å; L2460-Q2608 VanDerWaalsContact CD1-O 3.23Å; L2460-Q2608 WeakPolarHBondContact CD1-O 3.45Å; L2460-V2615 HydrophobicContact CB-CB 4.12Å; L2460-V2615 HydrophobicContact CB-CG1 4.21Å; L2460-V2615 HydrophobicContact CB-CG2 4.19Å
2461	D	94.4	Very high	87.6	Confident	0 Å²	0	16.4 Å²	16.4	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-66.9	-47.8	176.8	-64.2	-13.2	0	0	0	110.5	Q2457 A2458 L2459 F2463 T2464 I2465 L2492 Y2546 M2584 Q2608	Q2457-D2461 PolarHBondContact NE2-OD1 3.43Å; Q2457-D2461 PolarHBondContact O-N 3.09Å; A2458-D2461 PolarHBondContact O-N 3.43Å; L2459-D2461 VanDerWaalsContact C-N 3.34Å; D2461-F2463 VanDerWaalsContact C-N 3.31Å; D2461-F2463 PolarHBondContact O-N 3.41Å; D2461-T2464 WeakPolarHBondContact O-CB 3.44Å; D2461-T2464 PolarHBondContact O-N 2.87Å; D2461-T2464 VanDerWaalsContact O-N 3.1Å; D2461-I2465 WeakPolarHBondContact O-CG1 3.42Å; D2461-I2465 PolarHBondContact O-N 2.64Å; D2461-L2492 HydrophobicContact CB-CD1 3.89Å; D2461-L2492 HydrophobicContact CB-CD2 4.27Å; D2461-Y2546 HydrophobicContact CB-CE2 4.16Å; D2461-Y2546 VanDerWaalsContact OD2-CE2 3.23Å; D2461-Y2546 WeakPolarHBondContact OD2-CE2 3.39Å; D2461-Y2546 VanDerWaalsContact OD2-CZ 3.25Å; D2461-Y2546 PolarHBondContact OD2-OH 2.96Å; D2461-M2584 HydrophobicContact CB-CE 3.86Å; D2461-M2584 WeakPolarHBondContact O-CE 3.41Å; D2461-Q2608 PolarHBondContact OD1-NE2 2.63Å
2462	V	93.2	Very high	87.7	Confident	0 Å²	0	13.9 Å²	13.9	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-63.7	-38.1	175.2	174.3	0	0	0	0	111.6	Y2341 A2458 T2464 I2465 R2466 V2472 L2492 L2495 L2496 Y2499	Y2341-V2462 HydrophobicContact CE2-CB 4.33Å; Y2341-V2462 HydrophobicContact CE2-CG1 3.66Å; Y2341-V2462 WeakPolarHBondContact OH-CB 3.49Å; A2458-V2462 WeakPolarHBondContact O-CG2 3.47Å; A2458-V2462 PolarHBondContact O-N 2.86Å; A2458-V2462 VanDerWaalsContact O-N 3.09Å; V2462-T2464 VanDerWaalsContact C-N 3.31Å; V2462-T2464 PolarHBondContact O-N 3.15Å; V2462-I2465 PolarHBondContact O-N 3.43Å; V2462-R2466 WeakPolarHBondContact O-CB 3.21Å; V2462-R2466 PolarHBondContact O-N 3.33Å; V2462-V2472 HydrophobicContact CG1-CG2 4.08Å; V2462-L2492 HydrophobicContact CG2-CD1 3.82Å; V2462-L2495 HydrophobicContact CG2-CD2 3.91Å; V2462-L2496 HydrophobicContact CG2-CD2 3.98Å; V2462-L2496 HydrophobicContact CG2-CG 4.44Å; V2462-Y2499 HydrophobicContact CG1-CE2 3.72Å
2463	F	93.4	Very high	87.7	Confident	0 Å²	0	16.6 Å²	16.6	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-62.2	-39	172.8	-175.4	-101.6	0	0	0	112.1	Y2341 A2344 H2345 L2459 L2460 D2461 R2466 E2467 Y2611 V2615	Y2341-F2463 HydrophobicContact CD1-CB 3.83Å; Y2341-F2463 AromaticContact CD1-CD2 3.61Å; Y2341-F2463 HydrophobicContact CD1-CD2 3.61Å; Y2341-F2463 HydrophobicContact CD1-CG 4.12Å; Y2341-F2463 HydrophobicContact CE1-CB 3.84Å; Y2341-F2463 HydrophobicContact CE1-CD2 4.47Å; Y2341-F2463 AromaticContact CG-CD2 3.82Å; Y2341-F2463 HydrophobicContact CG-CD2 3.82Å; Y2341-F2463 WeakPolarHBondContact O-CE2 3.31Å; A2344-F2463 HydrophobicContact CB-CD2 4.36Å; A2344-F2463 HydrophobicContact CB-CE2 3.95Å; A2344-F2463 HydrophobicContact CB-CZ 4.15Å; H2345-F2463 HydrophobicContact CB-CE2 4.13Å; H2345-F2463 HydrophobicContact CB-CZ 4.2Å; L2459-F2463 WeakPolarHBondContact O-CB 3.43Å; L2459-F2463 PolarHBondContact O-N 3.21Å; L2459-F2463 VanDerWaalsContact O-N 3.07Å; L2460-F2463 PolarHBondContact O-N 2.67Å; D2461-F2463 VanDerWaalsContact C-N 3.31Å; D2461-F2463 PolarHBondContact O-N 3.41Å; F2463-R2466 PolarHBondContact O-N 3.09Å; F2463-E2467 HydrophobicContact CD1-CG 3.98Å; F2463-E2467 HydrophobicContact CE1-CG 3.57Å; F2463-E2467 HydrophobicContact CE2-CG 4.15Å; F2463-E2467 HydrophobicContact CG-CG 4.46Å; F2463-E2467 HydrophobicContact CZ-CG 3.66Å; F2463-E2467 WeakPolarHBondContact O-CG 3.45Å; F2463-E2467 PolarHBondContact O-N 3.48Å; F2463-Y2611 HydrophobicContact CD1-CG 4.27Å; F2463-Y2611 HydrophobicContact CE1-CD1 4.45Å; F2463-Y2611 HydrophobicContact CE1-CG 4.27Å; F2463-V2615 HydrophobicContact CB-CG2 3.67Å; F2463-V2615 HydrophobicContact CD1-CG2 3.59Å; F2463-V2615 HydrophobicContact CD2-CG2 4.21Å; F2463-V2615 HydrophobicContact CE1-CG2 4.26Å; F2463-V2615 HydrophobicContact CG-CG2 3.54Å
2464	T	93.3	Very high	87.5	Confident	0 Å²	0	18.7 Å²	18.7	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-62.5	-47.8	175.8	-55.8	0	0	0	0	111.1	L2460 D2461 V2462 R2466 E2467 E2468 M2584 A2604 Q2608 Y2611	L2460-T2464 WeakPolarHBondContact O-CB 3.4Å; L2460-T2464 PolarHBondContact O-N 3.35Å; L2460-T2464 PolarHBondContact O-OG1 2.88Å; D2461-T2464 WeakPolarHBondContact O-CB 3.44Å; D2461-T2464 PolarHBondContact O-N 2.87Å; D2461-T2464 VanDerWaalsContact O-N 3.1Å; V2462-T2464 VanDerWaalsContact C-N 3.31Å; V2462-T2464 PolarHBondContact O-N 3.15Å; T2464-R2466 VanDerWaalsContact C-N 3.28Å; T2464-R2466 PolarHBondContact O-N 2.99Å; T2464-E2467 PolarHBondContact O-N 3.4Å; T2464-E2467 VanDerWaalsContact O-N 3.16Å; T2464-E2468 HydrophobicContact CG2-CG 3.93Å; T2464-E2468 WeakPolarHBondContact O-CB 3.35Å; T2464-E2468 VanDerWaalsContact O-CG 3.24Å; T2464-E2468 WeakPolarHBondContact O-CG 3.47Å; T2464-E2468 PolarHBondContact O-N 2.98Å; T2464-M2584 HydrophobicContact CG2-CE 3.88Å; T2464-M2584 HydrophobicContact CG2-SD 4.19Å; T2464-A2604 HydrophobicContact CG2-CB 4.45Å; T2464-Q2608 HydrophobicContact CG2-CB 3.97Å; T2464-Q2608 HydrophobicContact CG2-CG 4.31Å; T2464-Y2611 HydrophobicContact CG2-CD2 3.89Å; T2464-Y2611 HydrophobicContact CG2-CE2 4.07Å
2465	I	90.7	Very high	87.4	Confident	0 Å²	0	19.3 Å²	19.3	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-56.6	-46.2	176.1	-64.2	169.7	0	0	0	110.1	D2461 V2462 E2467 E2468 I2469 V2472 L2475 I2477 V2544 I2582 M2584	D2461-I2465 WeakPolarHBondContact O-CG1 3.42Å; D2461-I2465 PolarHBondContact O-N 2.64Å; V2462-I2465 PolarHBondContact O-N 3.43Å; I2465-E2467 PolarHBondContact O-N 2.9Å; I2465-E2468 PolarHBondContact O-N 2.7Å; I2465-I2469 HydrophobicContact CG2-CD1 4.36Å; I2465-I2469 WeakPolarHBondContact O-CB 3.38Å; I2465-I2469 PolarHBondContact O-N 3.09Å; I2465-V2472 HydrophobicContact CB-CG2 4.43Å; I2465-V2472 HydrophobicContact CG2-CG2 4.04Å; I2465-L2475 HydrophobicContact CG2-CD1 3.49Å; I2465-L2475 VanDerWaalsContact CG2-CD1 3.49Å; I2465-I2477 HydrophobicContact CD1-CD1 4.06Å; I2465-V2544 HydrophobicContact CD1-CG1 4.12Å; I2465-V2544 HydrophobicContact CD1-CG2 4.2Å; I2465-V2544 HydrophobicContact CG1-CG1 4.15Å; I2465-V2544 HydrophobicContact CG1-CG2 4.05Å; I2465-V2544 HydrophobicContact CG2-CG2 4.1Å; I2465-I2582 HydrophobicContact CG1-CD1 4.36Å; I2465-M2584 HydrophobicContact CD1-SD 4.35Å; I2465-M2584 HydrophobicContact CG1-CE 4.26Å; I2465-M2584 HydrophobicContact CG1-SD 3.64Å
2466	R	83.7	Confident	87.4	Confident	50 Å²	50	20.2 Å²	20.2	19%	0.189	13%	0.128	C	C	.	.	H	α-helix	trans	-61.1	-42	177.5	179.9	-177.8	169.4	-176	-5.1	112.6	N2342 V2462 F2463 T2464 G2470 V2472	N2342-R2466 PolarHBondContact OD1-NH1 2.89Å; N2342-R2466 PolarHBondContact OD1-NH2 3.16Å; V2462-R2466 WeakPolarHBondContact O-CB 3.21Å; V2462-R2466 PolarHBondContact O-N 3.33Å; F2463-R2466 PolarHBondContact O-N 3.09Å; T2464-R2466 VanDerWaalsContact C-N 3.28Å; T2464-R2466 PolarHBondContact O-N 2.99Å; R2466-G2470 CarbonylContact O-C 3.6Å; R2466-G2470 WeakPolarHBondContact O-CA 3.41Å; R2466-G2470 PolarHBondContact O-N 2.89Å; R2466-V2472 HydrophobicContact CB-CG2 4.24Å
2467	E	82.5	Confident	87.5	Confident	18 Å²	18	20.1 Å²	20.1	8%	0.084	13%	0.127	C	C	.	.	H	α-helix	trans	-75	-34	-178.8	-72.7	-69.1	128.3	0	0	113.1	H2345 K2348 F2463 T2464 I2465 Y2611	H2345-E2467 IonicContact CE1-OE1 3.99Å; H2345-E2467 IonicContact CE1-OE2 2.66Å; H2345-E2467 IonicContact CG-OE1 2.75Å; H2345-E2467 IonicContact ND1-OE1 3.49Å; H2345-E2467 PolarHBondContact ND1-OE1 2.81Å; H2345-E2467 IonicContact ND1-OE2 3.49Å; H2345-E2467 PolarHBondContact ND1-OE2 3.32Å; K2348-E2467 IonicContact NZ-OE2 3.6Å; K2348-E2467 PolarHBondContact NZ-OE2 2.79Å; F2463-E2467 HydrophobicContact CD1-CG 3.98Å; F2463-E2467 HydrophobicContact CE1-CG 3.57Å; F2463-E2467 HydrophobicContact CE2-CG 4.15Å; F2463-E2467 HydrophobicContact CG-CG 4.46Å; F2463-E2467 HydrophobicContact CZ-CG 3.66Å; F2463-E2467 WeakPolarHBondContact O-CG 3.45Å; F2463-E2467 PolarHBondContact O-N 3.48Å; T2464-E2467 PolarHBondContact O-N 3.4Å; T2464-E2467 VanDerWaalsContact O-N 3.16Å; I2465-E2467 PolarHBondContact O-N 2.9Å; E2467-Y2611 HydrophobicContact CB-CE2 4.01Å
2468	E	84.6	Confident	87.8	Confident	54 Å²	54	20 Å²	20	25%	0.252	13%	0.126	S	C	.	.	H	α-helix	trans	-89.5	-38.2	-175.3	-60.8	-71.9	141.2	0	0	112.7	T2464 I2465 I2582 A2604 R2607 Y2611	T2464-E2468 HydrophobicContact CG2-CG 3.93Å; T2464-E2468 WeakPolarHBondContact O-CB 3.35Å; T2464-E2468 VanDerWaalsContact O-CG 3.24Å; T2464-E2468 WeakPolarHBondContact O-CG 3.47Å; T2464-E2468 PolarHBondContact O-N 2.98Å; I2465-E2468 PolarHBondContact O-N 2.7Å; E2468-I2582 HydrophobicContact CB-CD1 3.9Å; E2468-I2582 HydrophobicContact CB-CG2 4.01Å; E2468-I2582 HydrophobicContact CG-CD1 4.42Å; E2468-A2604 HydrophobicContact CG-CB 4.34Å; E2468-R2607 VanDerWaalsContact CD-NE 3.34Å; E2468-R2607 IonicContact OE1-NE 2.8Å; E2468-R2607 PolarHBondContact OE1-NE 2.97Å; E2468-R2607 IonicContact OE2-CZ 2.67Å; E2468-R2607 VanDerWaalsContact OE2-CZ 3.3Å; E2468-R2607 IonicContact OE2-NE 3.61Å; E2468-R2607 PolarHBondContact OE2-NE 2.93Å; E2468-R2607 IonicContact OE2-NH2 3.4Å; E2468-R2607 PolarHBondContact OE2-NH2 2.93Å; E2468-Y2611 HydrophobicContact CG-CE2 4.23Å; E2468-Y2611 VanDerWaalsContact OE1-CE2 3.29Å; E2468-Y2611 WeakPolarHBondContact OE1-CE2 3.46Å; E2468-Y2611 PolarHBondContact OE1-OH 2.84Å
2469	I	77.6	Confident	88	Confident	50 Å²	50	20 Å²	20	26%	0.256	13%	0.126	S	C	.	.	H	α-helix	trans	-101.4	-26.9	-179.1	-65.4	174.1	0	0	0	112.1	I2465 L2475 V2544 I2582	I2465-I2469 HydrophobicContact CG2-CD1 4.36Å; I2465-I2469 WeakPolarHBondContact O-CB 3.38Å; I2465-I2469 PolarHBondContact O-N 3.09Å; I2469-L2475 HydrophobicContact CD1-CD1 3.92Å; I2469-L2475 HydrophobicContact CG2-CD1 4.08Å; I2469-L2475 HydrophobicContact CG2-CD2 3.99Å; I2469-V2544 HydrophobicContact CD1-CG2 3.49Å; I2469-V2544 VanDerWaalsContact CD1-CG2 3.49Å; I2469-I2582 HydrophobicContact CD1-CD1 3.91Å; I2469-I2582 HydrophobicContact CD1-CG1 3.96Å; I2469-I2582 HydrophobicContact CD1-CG2 4.46Å; I2469-I2582 HydrophobicContact CG1-CD1 4.13Å; I2469-I2582 HydrophobicContact CG1-CG1 4.44Å; I2469-I2582 HydrophobicContact CG1-CG2 4.16Å
2470	G	66.7	Low	87.9	Confident	35 Å²	35	20 Å²	20	36%	0.361	13%	0.126	S	C	.	.	S	Bend	trans	98.2	-26.1	179	0	0	0	0	0	114.6	R2466	R2466-G2470 CarbonylContact O-C 3.6Å; R2466-G2470 WeakPolarHBondContact O-CA 3.41Å; R2466-G2470 PolarHBondContact O-N 2.89Å
2471	T	78.3	Confident	87.6	Confident	39 Å²	39	20.4 Å²	20.4	24%	0.239	13%	0.131	C	C	.	.			trans	-140.4	161.4	175.7	-175.3	0	0	0	0	110.2	N2473 L2475	T2471-N2473 PolarHBondContact OG1-N 3.25Å; T2471-L2475 WeakPolarHBondContact O-CD1 3.23Å
2472	V	83.7	Confident	87.4	Confident	7 Å²	7	20.4 Å²	20.4	4%	0.042	13%	0.131	C	C	.	.	S	Bend	trans	-110.1	-21.4	173	-174.4	0	0	0	0	110.9	V2462 I2465 R2466 L2496 Y2499 V2501	V2462-V2472 HydrophobicContact CG1-CG2 4.08Å; I2465-V2472 HydrophobicContact CB-CG2 4.43Å; I2465-V2472 HydrophobicContact CG2-CG2 4.04Å; R2466-V2472 HydrophobicContact CB-CG2 4.24Å; V2472-L2496 HydrophobicContact CG1-CD2 3.94Å; V2472-Y2499 HydrophobicContact CB-CD1 3.8Å; V2472-Y2499 HydrophobicContact CB-CE1 4.17Å; V2472-Y2499 HydrophobicContact CB-CG 4.04Å; V2472-Y2499 HydrophobicContact CG1-CD1 4Å; V2472-Y2499 HydrophobicContact CG1-CD2 3.99Å; V2472-Y2499 HydrophobicContact CG1-CG 3.68Å; V2472-Y2499 HydrophobicContact CG2-CE1 4.44Å; V2472-V2501 HydrophobicContact CG1-CG1 4.17Å; V2472-V2501 WeakPolarHBondContact O-CG1 3.42Å
2473	N	84	Confident	87.2	Confident	67 Å²	67	20.4 Å²	20.4	36%	0.358	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.8	145.2	-179.1	-61.1	-62	0	0	0	111	T2471 L2475 K2500	T2471-N2473 PolarHBondContact OG1-N 3.25Å; N2473-L2475 VanDerWaalsContact C-N 3.27Å; N2473-K2500 CarbonylContact C-O 3.58Å; N2473-K2500 WeakPolarHBondContact CA-O 3.35Å; N2473-K2500 HydrophobicContact CB-CB 4.5Å; N2473-K2500 PolarHBondContact OD1-N 3.2Å
2474	G	82.3	Confident	86.9	Confident	65 Å²	65	21.3 Å²	21.3	67%	0.67	14%	0.138	S	C	*	.	T	Hydrogen-bonded Turn	trans	81.5	1.8	178.2	0	0	0	0	0	114.4	K2500	G2474-K2500 PolarHBondContact N-O 3.33Å
2475	L	90.2	Very high	86.5	Confident	15 Å²	15	22.5 Å²	22.5	8%	0.079	14%	0.144	C	C	.	.			trans	-86.9	140.9	-177	-56.8	-174.2	0	0	0	112.2	I2465 I2469 T2471 N2473 I2477 K2502 D2543 V2544	I2465-L2475 HydrophobicContact CG2-CD1 3.49Å; I2465-L2475 VanDerWaalsContact CG2-CD1 3.49Å; I2469-L2475 HydrophobicContact CD1-CD1 3.92Å; I2469-L2475 HydrophobicContact CG2-CD1 4.08Å; I2469-L2475 HydrophobicContact CG2-CD2 3.99Å; T2471-L2475 WeakPolarHBondContact O-CD1 3.23Å; N2473-L2475 VanDerWaalsContact C-N 3.27Å; L2475-I2477 HydrophobicContact CB-CG1 4.26Å; L2475-K2502 PolarHBondContact O-N 3.44Å; L2475-D2543 WeakPolarHBondContact CA-OD2 3.27Å; L2475-D2543 HydrophobicContact CB-CB 4.21Å; L2475-D2543 HydrophobicContact CD2-CB 3.94Å; L2475-V2544 HydrophobicContact CD1-CG2 4.12Å
2476	T	93	Very high	86.1	Confident	20 Å²	20	22.8 Å²	22.8	12%	0.123	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	112.2	164.2	-57.8	0	0	0	0	108.9	K2502 R2504 D2541 D2543 V2544	T2476-K2502 HydrophobicContact CG2-CD 4.45Å; T2476-R2504 HydrophobicContact CG2-CG 4.29Å; T2476-D2541 WeakPolarHBondContact CB-O 2.95Å; T2476-D2543 PolarHBondContact N-OD2 2.76Å; T2476-D2543 PolarHBondContact O-N 2.78Å; T2476-V2544 PolarHBondContact O-N 3.47Å
2477	I	95.5	Very high	86.2	Confident	0 Å²	0	21.1 Å²	21.1	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	114.7	-178.3	-55.9	177.1	0	0	0	108.3	I2465 L2475 M2479 L2496 V2501 K2502 L2503 R2504 V2544	I2465-I2477 HydrophobicContact CD1-CD1 4.06Å; L2475-I2477 HydrophobicContact CB-CG1 4.26Å; I2477-M2479 HydrophobicContact CG2-CE 4.29Å; I2477-L2496 HydrophobicContact CD1-CD1 3.64Å; I2477-L2496 HydrophobicContact CD1-CD2 3.59Å; I2477-L2496 HydrophobicContact CD1-CG 4.26Å; I2477-L2496 HydrophobicContact CG2-CD1 4.29Å; I2477-V2501 HydrophobicContact CD1-CB 4.23Å; I2477-V2501 HydrophobicContact CD1-CG1 3.86Å; I2477-K2502 PolarHBondContact N-O 3.4Å; I2477-L2503 HydrophobicContact CB-CD2 3.98Å; I2477-L2503 HydrophobicContact CG2-CD2 4.44Å; I2477-L2503 WeakPolarHBondContact O-CA 3.19Å; I2477-R2504 PolarHBondContact O-N 2.65Å; I2477-V2544 WeakPolarHBondContact CA-O 3.25Å; I2477-V2544 HydrophobicContact CB-CB 4.43Å; I2477-V2544 HydrophobicContact CG1-CB 4.09Å; I2477-V2544 HydrophobicContact CG1-CG2 4.29Å; I2477-V2544 HydrophobicContact CG2-CB 4.19Å; I2477-V2544 HydrophobicContact CG2-CG1 4.3Å
2478	T	95.9	Very high	86.5	Confident	0 Å²	0	21.1 Å²	21.1	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	117.4	-176.6	-58.7	0	0	0	0	109.5	V2480 R2504 V2506 A2538 T2542 V2544 L2545 Y2546	T2478-V2480 HydrophobicContact CG2-CG2 3.96Å; T2478-R2504 WeakPolarHBondContact CA-O 3.3Å; T2478-R2504 HydrophobicContact CG2-CB 4.11Å; T2478-V2506 HydrophobicContact CG2-CG2 3.51Å; T2478-A2538 HydrophobicContact CG2-CB 4.01Å; T2478-T2542 PolarHBondContact OG1-OG1 3Å; T2478-V2544 PolarHBondContact N-O 2.94Å; T2478-L2545 HydrophobicContact CG2-CD1 4.14Å; T2478-Y2546 PolarHBondContact O-N 2.77Å
2479	M	95.4	Very high	86.8	Confident	0 Å²	0	18.5 Å²	18.5	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	126.3	-178.8	-61	173	175.5	0	0	109.7	I2477 L2483 V2489 L2492 A2493 L2496 L2503 R2504 Y2505 V2506 M2514 Y2546	I2477-M2479 HydrophobicContact CG2-CE 4.29Å; M2479-L2483 HydrophobicContact CB-CD2 4.1Å; M2479-V2489 HydrophobicContact CB-CG1 4.14Å; M2479-V2489 HydrophobicContact CE-CG1 4.42Å; M2479-V2489 HydrophobicContact CG-CG1 4.1Å; M2479-V2489 HydrophobicContact SD-CG1 3.3Å; M2479-V2489 WeakPolarHBondContact SD-CG1 3.26Å; M2479-L2492 HydrophobicContact CE-CB 4.44Å; M2479-L2492 HydrophobicContact CE-CD2 3.99Å; M2479-L2492 HydrophobicContact CE-CG 3.92Å; M2479-A2493 HydrophobicContact CE-CB 4.34Å; M2479-L2496 HydrophobicContact CE-CD1 3.7Å; M2479-L2503 HydrophobicContact CE-CD2 4.11Å; M2479-R2504 PolarHBondContact N-O 3.46Å; M2479-Y2505 HydrophobicContact CB-CD1 4.33Å; M2479-Y2505 HydrophobicContact SD-CD1 4.32Å; M2479-Y2505 HydrophobicContact SD-CE1 3.97Å; M2479-V2506 PolarHBondContact O-N 3.08Å; M2479-M2514 HydrophobicContact SD-CE 4.28Å; M2479-Y2546 WeakPolarHBondContact CA-O 3.34Å
2480	V	92.9	Very high	87.4	Confident	0 Å²	0	16.4 Å²	16.4	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	138.4	-167.9	-171.9	0	0	0	0	111	T2478 V2506 L2535 L2545 Y2546 M2547 T2548 F2566	T2478-V2480 HydrophobicContact CG2-CG2 3.96Å; V2480-V2506 WeakPolarHBondContact CA-O 3.46Å; V2480-V2506 HydrophobicContact CB-CB 4.35Å; V2480-V2506 HydrophobicContact CG1-CB 4.11Å; V2480-V2506 HydrophobicContact CG1-CG1 4.36Å; V2480-V2506 HydrophobicContact CG2-CB 3.95Å; V2480-V2506 HydrophobicContact CG2-CG2 4.09Å; V2480-L2535 HydrophobicContact CG1-CD1 4.48Å; V2480-L2535 HydrophobicContact CG1-CD2 4.49Å; V2480-L2535 HydrophobicContact CG2-CD1 3.92Å; V2480-L2545 HydrophobicContact CG2-CD1 3.66Å; V2480-Y2546 PolarHBondContact N-O 2.94Å; V2480-M2547 HydrophobicContact CB-CE 4.48Å; V2480-M2547 HydrophobicContact CB-SD 3.57Å; V2480-M2547 VanDerWaalsContact CB-SD 3.57Å; V2480-M2547 HydrophobicContact CG1-CE 4.18Å; V2480-M2547 HydrophobicContact CG1-SD 3.74Å; V2480-M2547 HydrophobicContact CG2-SD 4.05Å; V2480-M2547 CarbonylContact O-C 3.54Å; V2480-T2548 PolarHBondContact O-N 2.8Å; V2480-T2548 PolarHBondContact O-OG1 2.8Å; V2480-F2566 HydrophobicContact CG1-CB 4.08Å; V2480-F2566 HydrophobicContact CG1-CD2 3.67Å; V2480-F2566 HydrophobicContact CG1-CE2 4.45Å; V2480-F2566 HydrophobicContact CG1-CG 4.09Å
2481	G	89	Confident	88.6	Confident	9 Å²	9	14.8 Å²	14.8	9%	0.093	10%	0.102	C	C	.	.	S	Bend	trans	117.4	-139	173.9	0	0	0	0	0	113.7	L2483 V2506 T2548	G2481-L2483 PolarHBondContact O-N 2.96Å; G2481-V2506 PolarHBondContact N-O 2.97Å; G2481-T2548 WeakPolarHBondContact CA-OG1 3.48Å
2482	D	88.7	Confident	89.3	Confident	0 Å²	0	12.9 Å²	12.9	0%	0	9%	0.091	C	C	.	.			trans	-85.9	89.1	177.8	176.2	8.1	0	0	0	110.3	A2484 N2485 G2486 F2512 T2548 V2550 Q2551	D2482-A2484 PolarHBondContact OD1-N 3.12Å; D2482-N2485 PolarHBondContact OD1-N 3.45Å; D2482-N2485 PolarHBondContact OD1-ND2 2.63Å; D2482-N2485 WeakPolarHBondContact OD2-CB 3.24Å; D2482-N2485 PolarHBondContact OD2-ND2 2.89Å; D2482-G2486 PolarHBondContact O-N 3.29Å; D2482-F2512 HydrophobicContact CB-CD1 4.03Å; D2482-F2512 HydrophobicContact CB-CE1 4.44Å; D2482-F2512 HydrophobicContact CB-CG 4.42Å; D2482-T2548 PolarHBondContact N-OG1 3.47Å; D2482-V2550 HydrophobicContact CB-CB 4.39Å; D2482-V2550 HydrophobicContact CB-CG2 4.33Å; D2482-Q2551 PolarHBondContact OD2-N 3.49Å
2483	L	90.6	Very high	89.7	Confident	0 Å²	0	12.6 Å²	12.6	0%	0	9%	0.089	C	C	.	.			trans	-86.3	-12.7	-177.9	-46.2	-177.5	0	0	0	112.6	M2479 G2481 V2489 H2490 Y2505 T2507 F2512 M2514 P2515	M2479-L2483 HydrophobicContact CB-CD2 4.1Å; G2481-L2483 PolarHBondContact O-N 2.96Å; L2483-V2489 HydrophobicContact CD2-CG1 4.12Å; L2483-V2489 HydrophobicContact CD2-CG2 4.24Å; L2483-H2490 PolarHBondContact O-CD2 3.43Å; L2483-H2490 PolarHBondContact O-NE2 3.04Å; L2483-Y2505 HydrophobicContact CD1-CD1 3.98Å; L2483-Y2505 HydrophobicContact CD1-CG 4.15Å; L2483-T2507 HydrophobicContact CB-CG2 4.39Å; L2483-T2507 HydrophobicContact CD1-CG2 3.55Å; L2483-T2507 HydrophobicContact CG-CG2 3.7Å; L2483-F2512 CarbonylContact C-O 3.42Å; L2483-F2512 WeakPolarHBondContact CA-O 3.25Å; L2483-F2512 VanDerWaalsContact CB-O 3.3Å; L2483-F2512 WeakPolarHBondContact CB-O 3.37Å; L2483-F2512 PolarHBondContact N-O 2.88Å; L2483-M2514 HydrophobicContact CB-CB 4.43Å; L2483-M2514 HydrophobicContact CB-CE 4.12Å; L2483-M2514 HydrophobicContact CD1-CE 4.33Å; L2483-P2515 WeakPolarHBondContact O-CD 3.09Å
2484	A	86.3	Confident	90	Very high	18 Å²	18	11.2 Å²	11.2	15%	0.149	8%	0.079	C	C	.	.	S	Bend	trans	-79.4	-42	178.9	0	0	0	0	0	112.6	D2482 H2490 E2511 F2512 K2513	D2482-A2484 PolarHBondContact OD1-N 3.12Å; A2484-H2490 PolarHBondContact O-CE1 3.29Å; A2484-H2490 PolarHBondContact O-NE2 3.33Å; A2484-E2511 WeakPolarHBondContact CB-O 3.45Å; A2484-F2512 PolarHBondContact N-O 3.11Å; A2484-F2512 VanDerWaalsContact N-O 3.1Å; A2484-K2513 WeakPolarHBondContact CA-O 3.34Å; A2484-K2513 VanDerWaalsContact CB-O 3.32Å; A2484-K2513 WeakPolarHBondContact CB-O 3.43Å
2485	N	84.4	Confident	90.4	Very high	26 Å²	26	8.2 Å²	8.2	14%	0.139	5%	0.047	C	C	.	.	S	Bend	trans	-101.4	-1.8	-177.8	-54.5	-73.4	0	0	0	112.8	I2451 D2482 R2487 Q2551 R2554	I2451-N2485 HydrophobicContact CG2-CB 4.19Å; D2482-N2485 PolarHBondContact OD1-N 3.45Å; D2482-N2485 PolarHBondContact OD1-ND2 2.63Å; D2482-N2485 WeakPolarHBondContact OD2-CB 3.24Å; D2482-N2485 PolarHBondContact OD2-ND2 2.89Å; N2485-R2487 PolarHBondContact O-N 3.08Å; N2485-Q2551 HydrophobicContact CB-CB 4.11Å; N2485-Q2551 HydrophobicContact CB-CG 4.41Å; N2485-R2554 HydrophobicContact CB-CB 4.49Å; N2485-R2554 PolarHBondContact O-NH1 3.21Å
2486	G	83.6	Confident	90.5	Very high	6 Å²	6	7.5 Å²	7.5	6%	0.062	4%	0.043	C	C	.	.			trans	-82.7	81.5	-177.3	0	0	0	0	0	114	D2482 T2488 V2489 H2490	D2482-G2486 PolarHBondContact O-N 3.29Å; G2486-T2488 PolarHBondContact O-N 3.46Å; G2486-V2489 WeakPolarHBondContact O-CB 3.44Å; G2486-V2489 PolarHBondContact O-N 3.06Å; G2486-H2490 PolarHBondContact O-CD2 3.05Å; G2486-H2490 PolarHBondContact O-N 3.5Å
2487	R	84.8	Confident	90.3	Very high	14 Å²	14	7.3 Å²	7.3	5%	0.053	4%	0.043	C	C	.	.	H	α-helix	trans	-50.4	-30	176.4	63.7	170.3	173.2	-126.7	-19.7	115	E2372 G2450 G2452 H2454 N2485 S2491 R2554	E2372-R2487 IonicContact OE1-NH1 3.3Å; E2372-R2487 IonicContact OE2-CZ 3.88Å; E2372-R2487 VanDerWaalsContact OE2-CZ 3.25Å; E2372-R2487 IonicContact OE2-NH1 3.29Å; E2372-R2487 PolarHBondContact OE2-NH1 3.45Å; E2372-R2487 IonicContact OE2-NH2 3.51Å; E2372-R2487 PolarHBondContact OE2-NH2 3.38Å; G2450-R2487 WeakPolarHBondContact O-CD 3.28Å; G2452-R2487 WeakPolarHBondContact O-CA 3.43Å; G2452-R2487 WeakPolarHBondContact O-CB 3.29Å; H2454-R2487 HydrophobicContact CB-CG 4.21Å; N2485-R2487 PolarHBondContact O-N 3.08Å; R2487-S2491 PolarHBondContact O-N 3.26Å; R2487-R2554 VanDerWaalsContact CZ-NH2 3.28Å
2488	T	89.7	Confident	90	Very high	18 Å²	18	9.1 Å²	9.1	11%	0.11	5%	0.052	C	C	.	.	H	α-helix	trans	-69.7	-38.7	179.3	53.4	0	0	0	0	111.3	H2454 Q2457 G2486 L2492 P2586	H2454-T2488 HydrophobicContact CB-CG2 4.3Å; Q2457-T2488 HydrophobicContact CB-CG2 4.19Å; Q2457-T2488 HydrophobicContact CG-CG2 3.74Å; G2486-T2488 PolarHBondContact O-N 3.46Å; T2488-L2492 VanDerWaalsContact O-CB 3.26Å; T2488-L2492 WeakPolarHBondContact O-CB 3.35Å; T2488-L2492 PolarHBondContact O-N 3.39Å; T2488-P2586 HydrophobicContact CG2-CB 4.13Å
2489	V	90.1	Very high	89.7	Confident	0 Å²	0	10.3 Å²	10.3	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-70.2	-40.8	178.1	-166.5	0	0	0	0	110.4	M2479 L2483 G2486 S2491 L2492 A2493 M2514 Y2546 T2548	M2479-V2489 HydrophobicContact CB-CG1 4.14Å; M2479-V2489 HydrophobicContact CE-CG1 4.42Å; M2479-V2489 HydrophobicContact CG-CG1 4.1Å; M2479-V2489 HydrophobicContact SD-CG1 3.3Å; M2479-V2489 WeakPolarHBondContact SD-CG1 3.26Å; L2483-V2489 HydrophobicContact CD2-CG1 4.12Å; L2483-V2489 HydrophobicContact CD2-CG2 4.24Å; G2486-V2489 WeakPolarHBondContact O-CB 3.44Å; G2486-V2489 PolarHBondContact O-N 3.06Å; V2489-S2491 PolarHBondContact O-N 2.91Å; V2489-L2492 PolarHBondContact O-N 2.73Å; V2489-A2493 WeakPolarHBondContact O-CB 3.31Å; V2489-A2493 PolarHBondContact O-N 3.05Å; V2489-M2514 HydrophobicContact CB-CE 4.43Å; V2489-M2514 HydrophobicContact CG1-CE 3.47Å; V2489-M2514 VanDerWaalsContact CG1-CE 3.47Å; V2489-Y2546 HydrophobicContact CG2-CE1 4.3Å; V2489-T2548 HydrophobicContact CG2-CG2 3.28Å
2490	H	90.5	Very high	89.2	Confident	6 Å²	6	18.4 Å²	18.4	3%	0.028	9%	0.092	C	C	.	.	H	α-helix	trans	-56.7	-51.3	176.1	-55.9	166.5	0	0	0	111	I2451 G2452 L2483 A2484 G2486 L2492 R2494 P2515 V2518	I2451-H2490 PolarHBondContact O-CE1 2.68Å; I2451-H2490 PolarHBondContact O-ND1 2.69Å; I2451-H2490 VanDerWaalsContact O-ND1 3.08Å; G2452-H2490 PolarHBondContact O-ND1 2.64Å; L2483-H2490 PolarHBondContact O-CD2 3.43Å; L2483-H2490 PolarHBondContact O-NE2 3.04Å; A2484-H2490 PolarHBondContact O-CE1 3.29Å; A2484-H2490 PolarHBondContact O-NE2 3.33Å; G2486-H2490 PolarHBondContact O-CD2 3.05Å; G2486-H2490 PolarHBondContact O-N 3.5Å; H2490-L2492 PolarHBondContact O-N 3.42Å; H2490-R2494 WeakPolarHBondContact O-CG 3.24Å; H2490-R2494 PolarHBondContact O-N 3.4Å; H2490-R2494 VanDerWaalsContact O-N 3.14Å; H2490-P2515 WeakPolarHBondContact NE2-CD 3.37Å; H2490-P2515 WeakPolarHBondContact NE2-CG 3.25Å; H2490-V2518 HydrophobicContact CB-CG2 4.16Å
2491	S	91.5	Very high	89.2	Confident	0 Å²	0	18.7 Å²	18.7	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-66	-35.3	177.8	-74.6	0	0	0	0	113.1	S2329 E2453 H2454 A2458 R2487 V2489 L2495	S2329-S2491 VanDerWaalsContact OG-CB 3.3Å; S2329-S2491 WeakPolarHBondContact OG-CB 3.49Å; S2329-S2491 PolarHBondContact OG-O 2.93Å; E2453-S2491 WeakPolarHBondContact CA-OG 3.45Å; E2453-S2491 VanDerWaalsContact CB-OG 3.24Å; E2453-S2491 WeakPolarHBondContact CB-OG 3.38Å; E2453-S2491 PolarHBondContact OE2-OG 3.1Å; E2453-S2491 VanDerWaalsContact OE2-OG 3.11Å; H2454-S2491 PolarHBondContact N-OG 3.28Å; A2458-S2491 WeakPolarHBondContact CB-O 3.16Å; R2487-S2491 PolarHBondContact O-N 3.26Å; V2489-S2491 PolarHBondContact O-N 2.91Å; S2491-L2495 WeakPolarHBondContact O-CB 3.5Å; S2491-L2495 PolarHBondContact O-N 3.21Å; S2491-L2495 VanDerWaalsContact O-N 3.09Å
2492	L	94.1	Very high	89.4	Confident	0 Å²	0	20.9 Å²	20.9	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-68.8	-46.5	178.1	-179.6	57.9	0	0	0	111.5	A2458 D2461 V2462 M2479 T2488 V2489 H2490 R2494 L2495 L2496 Y2546	A2458-L2492 HydrophobicContact CB-CB 4.35Å; D2461-L2492 HydrophobicContact CB-CD1 3.89Å; D2461-L2492 HydrophobicContact CB-CD2 4.27Å; V2462-L2492 HydrophobicContact CG2-CD1 3.82Å; M2479-L2492 HydrophobicContact CE-CB 4.44Å; M2479-L2492 HydrophobicContact CE-CD2 3.99Å; M2479-L2492 HydrophobicContact CE-CG 3.92Å; T2488-L2492 VanDerWaalsContact O-CB 3.26Å; T2488-L2492 WeakPolarHBondContact O-CB 3.35Å; T2488-L2492 PolarHBondContact O-N 3.39Å; V2489-L2492 PolarHBondContact O-N 2.73Å; H2490-L2492 PolarHBondContact O-N 3.42Å; L2492-R2494 VanDerWaalsContact C-N 3.33Å; L2492-R2494 PolarHBondContact O-N 3.3Å; L2492-L2495 PolarHBondContact O-N 3.29Å; L2492-L2496 HydrophobicContact CD1-CD1 3.86Å; L2492-L2496 HydrophobicContact CD1-CD2 4.47Å; L2492-L2496 HydrophobicContact CD1-CG 3.88Å; L2492-L2496 HydrophobicContact CD2-CD1 4.47Å; L2492-L2496 HydrophobicContact CG-CD1 3.74Å; L2492-L2496 HydrophobicContact CG-CG 4.24Å; L2492-L2496 WeakPolarHBondContact O-CB 3.4Å; L2492-L2496 VanDerWaalsContact O-CG 3.26Å; L2492-L2496 WeakPolarHBondContact O-CG 3.34Å; L2492-L2496 PolarHBondContact O-N 3.05Å; L2492-Y2546 HydrophobicContact CD2-CD1 4.34Å; L2492-Y2546 HydrophobicContact CD2-CD2 3.64Å; L2492-Y2546 HydrophobicContact CD2-CE1 4.26Å; L2492-Y2546 HydrophobicContact CD2-CE2 3.53Å; L2492-Y2546 HydrophobicContact CD2-CG 4.04Å
2493	A	90.5	Very high	89.7	Confident	0 Å²	0	20.9 Å²	20.9	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-58.3	-45.1	176.6	0	0	0	0	0	111.3	M2479 V2489 L2495 L2496 C2497 L2503 V2518 V2522	M2479-A2493 HydrophobicContact CE-CB 4.34Å; V2489-A2493 WeakPolarHBondContact O-CB 3.31Å; V2489-A2493 PolarHBondContact O-N 3.05Å; A2493-L2495 PolarHBondContact O-N 3.44Å; A2493-L2496 PolarHBondContact O-N 3.42Å; A2493-C2497 PolarHBondContact O-N 2.93Å; A2493-C2497 PolarHBondContact O-SG 3.24Å; A2493-L2503 HydrophobicContact CB-CD1 4.18Å; A2493-V2518 HydrophobicContact CB-CG1 4.05Å; A2493-V2522 HydrophobicContact CB-CG2 4.12Å
2494	R	90.6	Very high	89.9	Confident	39 Å²	39	21.8 Å²	21.8	15%	0.147	10%	0.104	C	C	.	.	H	α-helix	trans	-60.7	-43.3	175.8	-71.6	179.3	178.7	-144.9	-7.5	113	E2330 E2453 H2490 L2492 C2497 Y2521 R2525	E2330-R2494 IonicContact OE1-CZ 2.91Å; E2330-R2494 IonicContact OE1-NH1 3.74Å; E2330-R2494 PolarHBondContact OE1-NH1 3.21Å; E2453-R2494 IonicContact OE1-CZ 2.75Å; E2453-R2494 IonicContact OE1-NE 2.93Å; E2453-R2494 IonicContact OE1-NH1 3.3Å; E2453-R2494 PolarHBondContact OE1-NH1 2.92Å; H2490-R2494 WeakPolarHBondContact O-CG 3.24Å; H2490-R2494 PolarHBondContact O-N 3.4Å; H2490-R2494 VanDerWaalsContact O-N 3.14Å; L2492-R2494 VanDerWaalsContact C-N 3.33Å; L2492-R2494 PolarHBondContact O-N 3.3Å; R2494-C2497 WeakPolarHBondContact O-CB 3.48Å; R2494-Y2521 HydrophobicContact CB-CD1 4.3Å; R2494-Y2521 HydrophobicContact CB-CE1 3.84Å; R2494-Y2521 HydrophobicContact CG-CD1 3.76Å; R2494-Y2521 HydrophobicContact CG-CE1 3.72Å; R2494-Y2521 HydrophobicContact CG-CG 4.44Å; R2494-R2525 PolarHBondContact O-NH1 3.17Å
2495	L	91.5	Very high	90.2	Very high	1 Å²	1	21 Å²	21	1%	0.005	10%	0.097	C	C	.	.	H	α-helix	trans	-72.7	-36.4	-178.1	-163.3	72.1	0	0	0	112.2	F2332 L2337 A2458 L2459 V2462 S2491 L2492 A2493 C2497 L2498	F2332-L2495 HydrophobicContact CB-CD1 4.17Å; L2337-L2495 HydrophobicContact CD1-CD1 3.96Å; L2337-L2495 HydrophobicContact CD1-CD2 4.34Å; L2337-L2495 HydrophobicContact CD1-CG 4.01Å; L2337-L2495 HydrophobicContact CD2-CD1 4.2Å; A2458-L2495 HydrophobicContact CB-CB 4.18Å; A2458-L2495 HydrophobicContact CB-CD2 3.83Å; L2459-L2495 HydrophobicContact CD2-CD2 3.96Å; V2462-L2495 HydrophobicContact CG2-CD2 3.91Å; S2491-L2495 WeakPolarHBondContact O-CB 3.5Å; S2491-L2495 PolarHBondContact O-N 3.21Å; S2491-L2495 VanDerWaalsContact O-N 3.09Å; L2492-L2495 PolarHBondContact O-N 3.29Å; A2493-L2495 PolarHBondContact O-N 3.44Å; L2495-C2497 PolarHBondContact O-N 2.83Å; L2495-L2498 HydrophobicContact CD1-CD1 4.04Å; L2495-L2498 WeakPolarHBondContact O-CB 3.44Å; L2495-L2498 WeakPolarHBondContact O-CG 3.24Å; L2495-L2498 PolarHBondContact O-N 2.74Å; L2495-L2498 VanDerWaalsContact O-N 3.13Å
2496	L	92.5	Very high	90.6	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-63.8	-22.3	177.8	-77.9	171.5	0	0	0	113	V2462 V2472 I2477 M2479 L2492 A2493 L2498 Y2499 V2501 L2503	V2462-L2496 HydrophobicContact CG2-CD2 3.98Å; V2462-L2496 HydrophobicContact CG2-CG 4.44Å; V2472-L2496 HydrophobicContact CG1-CD2 3.94Å; I2477-L2496 HydrophobicContact CD1-CD1 3.64Å; I2477-L2496 HydrophobicContact CD1-CD2 3.59Å; I2477-L2496 HydrophobicContact CD1-CG 4.26Å; I2477-L2496 HydrophobicContact CG2-CD1 4.29Å; M2479-L2496 HydrophobicContact CE-CD1 3.7Å; L2492-L2496 HydrophobicContact CD1-CD1 3.86Å; L2492-L2496 HydrophobicContact CD1-CD2 4.47Å; L2492-L2496 HydrophobicContact CD1-CG 3.88Å; L2492-L2496 HydrophobicContact CD2-CD1 4.47Å; L2492-L2496 HydrophobicContact CG-CD1 3.74Å; L2492-L2496 HydrophobicContact CG-CG 4.24Å; L2492-L2496 WeakPolarHBondContact O-CB 3.4Å; L2492-L2496 VanDerWaalsContact O-CG 3.26Å; L2492-L2496 WeakPolarHBondContact O-CG 3.34Å; L2492-L2496 PolarHBondContact O-N 3.05Å; A2493-L2496 PolarHBondContact O-N 3.42Å; L2496-L2498 PolarHBondContact O-N 2.93Å; L2496-Y2499 PolarHBondContact O-N 3.49Å; L2496-Y2499 VanDerWaalsContact O-O 3.14Å; L2496-V2501 HydrophobicContact CB-CG2 4.05Å; L2496-V2501 HydrophobicContact CD2-CG1 4.44Å; L2496-L2503 HydrophobicContact CD1-CD2 3.83Å
2497	C	89	Confident	90.8	Very high	17 Å²	17	19.8 Å²	19.8	12%	0.115	9%	0.09	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-12.2	172.2	-59.4	0	0	0	0	114.5	A2493 R2494 L2495 Y2499 R2525 I2527	A2493-C2497 PolarHBondContact O-N 2.93Å; A2493-C2497 PolarHBondContact O-SG 3.24Å; R2494-C2497 WeakPolarHBondContact O-CB 3.48Å; L2495-C2497 PolarHBondContact O-N 2.83Å; C2497-Y2499 PolarHBondContact O-N 3.22Å; C2497-R2525 HydrophobicContact CB-CB 4.06Å; C2497-R2525 HydrophobicContact CB-CG 4.35Å; C2497-I2527 HydrophobicContact CB-CG1 4.21Å
2498	L	88.7	Confident	90.5	Very high	37 Å²	37	21.8 Å²	21.8	19%	0.194	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-9	171.2	-61.5	170.5	0	0	0	112.9	F2332 K2334 L2337 L2495 L2496	F2332-L2498 WeakPolarHBondContact O-CD1 3.5Å; K2334-L2498 WeakPolarHBondContact CD-O 3.4Å; K2334-L2498 VanDerWaalsContact CE-O 3.31Å; K2334-L2498 WeakPolarHBondContact CE-O 3.2Å; K2334-L2498 PolarHBondContact NZ-O 2.93Å; L2337-L2498 HydrophobicContact CD1-CD1 3.52Å; L2337-L2498 HydrophobicContact CG-CD1 4.17Å; L2495-L2498 HydrophobicContact CD1-CD1 4.04Å; L2495-L2498 WeakPolarHBondContact O-CB 3.44Å; L2495-L2498 WeakPolarHBondContact O-CG 3.24Å; L2495-L2498 PolarHBondContact O-N 2.74Å; L2495-L2498 VanDerWaalsContact O-N 3.13Å; L2496-L2498 PolarHBondContact O-N 2.93Å
2499	Y	88.8	Confident	90	Very high	26 Å²	26	24.7 Å²	24.7	10%	0.102	11%	0.109	C	C	.	.	S	Bend	trans	-120.3	159.2	-178.9	-59.5	-85.5	0	0	0	110.7	L2337 V2462 V2472 L2496 C2497 V2501 I2527	L2337-Y2499 HydrophobicContact CD1-CE2 3.81Å; V2462-Y2499 HydrophobicContact CG1-CE2 3.72Å; V2472-Y2499 HydrophobicContact CB-CD1 3.8Å; V2472-Y2499 HydrophobicContact CB-CE1 4.17Å; V2472-Y2499 HydrophobicContact CB-CG 4.04Å; V2472-Y2499 HydrophobicContact CG1-CD1 4Å; V2472-Y2499 HydrophobicContact CG1-CD2 3.99Å; V2472-Y2499 HydrophobicContact CG1-CG 3.68Å; V2472-Y2499 HydrophobicContact CG2-CE1 4.44Å; L2496-Y2499 PolarHBondContact O-N 3.49Å; L2496-Y2499 VanDerWaalsContact O-O 3.14Å; C2497-Y2499 PolarHBondContact O-N 3.22Å; Y2499-V2501 PolarHBondContact O-N 3.36Å; Y2499-I2527 WeakPolarHBondContact O-CD1 3.44Å
2500	K	85.7	Confident	89.5	Confident	169 Å²	169	30.6 Å²	30.6	74%	0.735	14%	0.14	S	C	*	.			trans	-86.3	91.8	173.4	-67.1	-173.3	178.7	-174.2	0	108.8	N2473 G2474	N2473-K2500 CarbonylContact C-O 3.58Å; N2473-K2500 WeakPolarHBondContact CA-O 3.35Å; N2473-K2500 HydrophobicContact CB-CB 4.5Å; N2473-K2500 PolarHBondContact OD1-N 3.2Å; G2474-K2500 PolarHBondContact N-O 3.33Å
2501	V	92.5	Very high	88.9	Confident	7 Å²	7	34.2 Å²	34.2	4%	0.042	16%	0.157	C	C	.	.			trans	-123.1	165.2	178.7	-64.4	0	0	0	0	110.7	V2472 I2477 L2496 Y2499 L2503 I2527	V2472-V2501 HydrophobicContact CG1-CG1 4.17Å; V2472-V2501 WeakPolarHBondContact O-CG1 3.42Å; I2477-V2501 HydrophobicContact CD1-CB 4.23Å; I2477-V2501 HydrophobicContact CD1-CG1 3.86Å; L2496-V2501 HydrophobicContact CB-CG2 4.05Å; L2496-V2501 HydrophobicContact CD2-CG1 4.44Å; Y2499-V2501 PolarHBondContact O-N 3.36Å; V2501-L2503 HydrophobicContact CG2-CD2 3.84Å; V2501-L2503 HydrophobicContact CG2-CG 4.24Å; V2501-I2527 HydrophobicContact CG2-CD1 4.4Å; V2501-I2527 HydrophobicContact CG2-CG2 4.2Å
2502	K	92.8	Very high	88.7	Confident	54 Å²	54	34.2 Å²	34.2	24%	0.235	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	126	164.7	179.1	176.8	-176.2	-179.7	0	108	L2475 T2476 I2477 P2528 E2530	L2475-K2502 PolarHBondContact O-N 3.44Å; T2476-K2502 HydrophobicContact CG2-CD 4.45Å; I2477-K2502 PolarHBondContact N-O 3.4Å; K2502-P2528 HydrophobicContact CG-CB 4.33Å; K2502-E2530 WeakPolarHBondContact CE-OE1 3.44Å; K2502-E2530 WeakPolarHBondContact CE-OE2 3.36Å; K2502-E2530 IonicContact NZ-OE1 3.75Å; K2502-E2530 PolarHBondContact NZ-OE1 2.86Å; K2502-E2530 IonicContact NZ-OE2 2.64Å; K2502-E2530 PolarHBondContact NZ-OE2 3.26Å
2503	L	94.9	Very high	88.5	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	133.1	178.3	-60.8	-171.9	0	0	0	110.7	I2477 M2479 A2493 L2496 V2501 Y2505 V2522 I2527 P2528 Q2529 E2530	I2477-L2503 HydrophobicContact CB-CD2 3.98Å; I2477-L2503 HydrophobicContact CG2-CD2 4.44Å; I2477-L2503 WeakPolarHBondContact O-CA 3.19Å; M2479-L2503 HydrophobicContact CE-CD2 4.11Å; A2493-L2503 HydrophobicContact CB-CD1 4.18Å; L2496-L2503 HydrophobicContact CD1-CD2 3.83Å; V2501-L2503 HydrophobicContact CG2-CD2 3.84Å; V2501-L2503 HydrophobicContact CG2-CG 4.24Å; L2503-Y2505 HydrophobicContact CB-CE1 4.24Å; L2503-V2522 HydrophobicContact CD1-CG1 3.92Å; L2503-V2522 HydrophobicContact CD1-CG2 4.45Å; L2503-I2527 HydrophobicContact CD1-CG2 4.31Å; L2503-I2527 HydrophobicContact CG-CG2 3.98Å; L2503-P2528 PolarHBondContact N-O 3.18Å; L2503-Q2529 HydrophobicContact CB-CG 4.39Å; L2503-Q2529 CarbonylContact O-C 3.59Å; L2503-Q2529 VanDerWaalsContact O-CA 3.27Å; L2503-Q2529 WeakPolarHBondContact O-CA 3.36Å; L2503-E2530 PolarHBondContact O-N 3.06Å
2504	R	94.7	Very high	88.5	Confident	20 Å²	20	37.8 Å²	37.8	8%	0.075	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	136.7	172.7	-72	-178.5	164.6	169.9	-3.1	109.8	T2476 I2477 T2478 M2479 E2530 M2532 D2541	T2476-R2504 HydrophobicContact CG2-CG 4.29Å; I2477-R2504 PolarHBondContact O-N 2.65Å; T2478-R2504 WeakPolarHBondContact CA-O 3.3Å; T2478-R2504 HydrophobicContact CG2-CB 4.11Å; M2479-R2504 PolarHBondContact N-O 3.46Å; R2504-E2530 CarbonylContact C-O 3.53Å; R2504-E2530 WeakPolarHBondContact CA-O 3.25Å; R2504-E2530 HydrophobicContact CG-CB 4.18Å; R2504-E2530 IonicContact CZ-OE2 2.67Å; R2504-E2530 IonicContact NE-OE2 3.33Å; R2504-E2530 PolarHBondContact NE-OE2 3.15Å; R2504-E2530 IonicContact NH2-OE2 2.87Å; R2504-E2530 PolarHBondContact NH2-OE2 3.11Å; R2504-M2532 HydrophobicContact CG-SD 4.45Å; R2504-D2541 IonicContact NH1-OD2 3.38Å
2505	Y	94.4	Very high	88.4	Confident	1 Å²	1	37 Å²	37	0%	0.004	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	119	178.8	-51.9	-53	0	0	0	109.3	M2479 L2483 L2503 M2514 K2519 Q2529 E2530 E2531 M2532	M2479-Y2505 HydrophobicContact CB-CD1 4.33Å; M2479-Y2505 HydrophobicContact SD-CD1 4.32Å; M2479-Y2505 HydrophobicContact SD-CE1 3.97Å; L2483-Y2505 HydrophobicContact CD1-CD1 3.98Å; L2483-Y2505 HydrophobicContact CD1-CG 4.15Å; L2503-Y2505 HydrophobicContact CB-CE1 4.24Å; Y2505-M2514 HydrophobicContact CD1-CE 3.73Å; Y2505-M2514 HydrophobicContact CD2-CB 4.5Å; Y2505-M2514 HydrophobicContact CE1-CE 3.45Å; Y2505-M2514 VanDerWaalsContact CE1-CE 3.45Å; Y2505-K2519 HydrophobicContact CE2-CG 4.24Å; Y2505-Q2529 HydrophobicContact CE2-CB 4.07Å; Y2505-Q2529 HydrophobicContact CE2-CG 4.13Å; Y2505-Q2529 PolarHBondContact OH-OE1 2.77Å; Y2505-E2530 PolarHBondContact N-O 3.39Å; Y2505-E2531 HydrophobicContact CD2-CG 4.16Å; Y2505-E2531 WeakPolarHBondContact O-CA 3.25Å; Y2505-M2532 PolarHBondContact O-N 3.07Å
2506	V	92.8	Very high	88.1	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	111.3	179.9	-169.9	0	0	0	0	109.7	T2478 M2479 V2480 G2481 M2532 L2535 A2538 F2566	T2478-V2506 HydrophobicContact CG2-CG2 3.51Å; M2479-V2506 PolarHBondContact O-N 3.08Å; V2480-V2506 WeakPolarHBondContact CA-O 3.46Å; V2480-V2506 HydrophobicContact CB-CB 4.35Å; V2480-V2506 HydrophobicContact CG1-CB 4.11Å; V2480-V2506 HydrophobicContact CG1-CG1 4.36Å; V2480-V2506 HydrophobicContact CG2-CB 3.95Å; V2480-V2506 HydrophobicContact CG2-CG2 4.09Å; G2481-V2506 PolarHBondContact N-O 2.97Å; V2506-M2532 WeakPolarHBondContact CA-O 3.43Å; V2506-M2532 HydrophobicContact CG2-CB 4.3Å; V2506-L2535 HydrophobicContact CG1-CB 4.4Å; V2506-A2538 HydrophobicContact CG2-CB 4.16Å; V2506-F2566 HydrophobicContact CG1-CD2 4.49Å; V2506-F2566 HydrophobicContact CG1-CE2 3.87Å; V2506-F2566 HydrophobicContact CG1-CZ 3.97Å
2507	T	87.6	Confident	87.8	Confident	6 Å²	6	46.9 Å²	46.9	4%	0.037	23%	0.228	C	C	.	.			trans	-141.2	141.5	-176.7	58.9	0	0	0	0	110.5	L2483 F2512 M2532	L2483-T2507 HydrophobicContact CB-CG2 4.39Å; L2483-T2507 HydrophobicContact CD1-CG2 3.55Å; L2483-T2507 HydrophobicContact CG-CG2 3.7Å; T2507-F2512 HydrophobicContact CG2-CB 4.37Å; T2507-F2512 WeakPolarHBondContact CG2-O 3.28Å; T2507-M2532 PolarHBondContact N-O 3.26Å
2508	H	77.9	Confident	87.7	Confident	56 Å²	56	46.1 Å²	46.1	26%	0.259	22%	0.223	S	C	.	.	S	Bend	trans	-98.2	-18.1	-179	64.4	-76.2	0	0	0	114	F2512 D2564 F2566	H2508-F2512 AromaticContact CE1-CD2 3.54Å; H2508-F2512 AromaticContact CE1-CE2 3.44Å; H2508-F2512 VanDerWaalsContact CE1-CE2 3.44Å; H2508-F2512 WeakPolarHBondContact CE1-CE2 3.34Å; H2508-F2512 AromaticContact NE2-CD2 3.92Å; H2508-F2512 AromaticContact NE2-CE2 3.54Å; H2508-D2564 PolarHBondContact CD2-O 3.35Å; H2508-D2564 VanDerWaalsContact CD2-O 3.26Å; H2508-D2564 PolarHBondContact CE1-O 2.83Å; H2508-D2564 PolarHBondContact NE2-O 3.44Å; H2508-F2566 HydrophobicContact CB-CE2 4.04Å; H2508-F2566 HydrophobicContact CB-CZ 4.1Å
2509	R	79.9	Confident	87.8	Confident	80 Å²	80	47.4 Å²	47.4	30%	0.302	23%	0.227	S	C	.	.	S	Bend	trans	-124.4	145.2	174.8	-54.4	-179.1	103.4	-165.7	9	110.7	E2511 F2512 D2558	R2509-E2511 HydrophobicContact CB-CG 3.76Å; R2509-E2511 WeakPolarHBondContact CD-OE1 3.15Å; R2509-E2511 IonicContact CZ-OE1 3.04Å; R2509-E2511 IonicContact NE-OE1 3.47Å; R2509-E2511 IonicContact NH1-OE1 3.64Å; R2509-E2511 PolarHBondContact NH1-OE1 3.05Å; R2509-E2511 PolarHBondContact O-N 3.44Å; R2509-F2512 HydrophobicContact CB-CD2 3.9Å; R2509-F2512 HydrophobicContact CB-CE2 4.21Å; R2509-F2512 HydrophobicContact CG-CD2 4.21Å; R2509-F2512 HydrophobicContact CG-CE2 4.11Å; R2509-F2512 PolarHBondContact O-N 2.87Å; R2509-F2512 VanDerWaalsContact O-N 3.07Å; R2509-D2558 IonicContact NH1-OD2 3.64Å
2510	D	78.3	Confident	87.7	Confident	123 Å²	123	49.2 Å²	49.2	66%	0.658	24%	0.243	S	C	*	.	G	3₁₀ helix	trans	-60.3	-31.9	178.6	-78.5	-30.2	0	0	0	112.8	F2512 K2513	D2510-F2512 PolarHBondContact O-N 3.02Å; D2510-K2513 WeakPolarHBondContact O-CB 3.38Å; D2510-K2513 PolarHBondContact O-N 3.35Å; D2510-K2513 WeakPolarHBondContact OD1-CE 3.5Å; D2510-K2513 IonicContact OD1-NZ 2.83Å; D2510-K2513 PolarHBondContact OD1-NZ 3.01Å
2511	E	78.9	Confident	87.9	Confident	83 Å²	83	42.8 Å²	42.8	39%	0.388	22%	0.215	S	C	.	.	G	3₁₀ helix	trans	-66.6	-16.7	176.6	60.4	-178.2	-167.2	0	0	114.4	A2484 R2509	A2484-E2511 WeakPolarHBondContact CB-O 3.45Å; R2509-E2511 HydrophobicContact CB-CG 3.76Å; R2509-E2511 WeakPolarHBondContact CD-OE1 3.15Å; R2509-E2511 IonicContact CZ-OE1 3.04Å; R2509-E2511 IonicContact NE-OE1 3.47Å; R2509-E2511 IonicContact NH1-OE1 3.64Å; R2509-E2511 PolarHBondContact NH1-OE1 3.05Å; R2509-E2511 PolarHBondContact O-N 3.44Å
2512	F	87.5	Confident	87.7	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-97.4	-2.9	177.7	-64.2	-31.3	0	0	0	113.4	D2482 L2483 A2484 T2507 H2508 R2509 D2510 V2550 M2555 A2561	D2482-F2512 HydrophobicContact CB-CD1 4.03Å; D2482-F2512 HydrophobicContact CB-CE1 4.44Å; D2482-F2512 HydrophobicContact CB-CG 4.42Å; L2483-F2512 CarbonylContact C-O 3.42Å; L2483-F2512 WeakPolarHBondContact CA-O 3.25Å; L2483-F2512 VanDerWaalsContact CB-O 3.3Å; L2483-F2512 WeakPolarHBondContact CB-O 3.37Å; L2483-F2512 PolarHBondContact N-O 2.88Å; A2484-F2512 PolarHBondContact N-O 3.11Å; A2484-F2512 VanDerWaalsContact N-O 3.1Å; T2507-F2512 HydrophobicContact CG2-CB 4.37Å; T2507-F2512 WeakPolarHBondContact CG2-O 3.28Å; H2508-F2512 AromaticContact CE1-CD2 3.54Å; H2508-F2512 AromaticContact CE1-CE2 3.44Å; H2508-F2512 VanDerWaalsContact CE1-CE2 3.44Å; H2508-F2512 WeakPolarHBondContact CE1-CE2 3.34Å; H2508-F2512 AromaticContact NE2-CD2 3.92Å; H2508-F2512 AromaticContact NE2-CE2 3.54Å; R2509-F2512 HydrophobicContact CB-CD2 3.9Å; R2509-F2512 HydrophobicContact CB-CE2 4.21Å; R2509-F2512 HydrophobicContact CG-CD2 4.21Å; R2509-F2512 HydrophobicContact CG-CE2 4.11Å; R2509-F2512 PolarHBondContact O-N 2.87Å; R2509-F2512 VanDerWaalsContact O-N 3.07Å; D2510-F2512 PolarHBondContact O-N 3.02Å; F2512-V2550 HydrophobicContact CE1-CG1 4.08Å; F2512-V2550 HydrophobicContact CZ-CG1 3.87Å; F2512-M2555 HydrophobicContact CE1-CE 3.69Å; F2512-M2555 HydrophobicContact CE1-SD 3.88Å; F2512-M2555 HydrophobicContact CZ-CE 4.23Å; F2512-M2555 HydrophobicContact CZ-SD 4.44Å; F2512-A2561 HydrophobicContact CZ-CB 4.3Å
2513	K	89.1	Confident	87.4	Confident	69 Å²	69	42.5 Å²	42.5	30%	0.3	22%	0.223	S	C	.	.	S	Bend	trans	-63.7	149.3	-178.6	-74.9	-179.7	169.5	172.7	0	111.7	A2484 D2510 E2531	A2484-K2513 WeakPolarHBondContact CA-O 3.34Å; A2484-K2513 VanDerWaalsContact CB-O 3.32Å; A2484-K2513 WeakPolarHBondContact CB-O 3.43Å; D2510-K2513 WeakPolarHBondContact O-CB 3.38Å; D2510-K2513 PolarHBondContact O-N 3.35Å; D2510-K2513 WeakPolarHBondContact OD1-CE 3.5Å; D2510-K2513 IonicContact OD1-NZ 2.83Å; D2510-K2513 PolarHBondContact OD1-NZ 3.01Å; K2513-E2531 IonicContact NZ-OE2 3.8Å
2514	M	91.5	Very high	86.9	Confident	6 Å²	6	48.6 Å²	48.6	3%	0.03	26%	0.256	C	S	.	.	P	Polyproline II helix	trans	-53.9	131.2	175.9	-173.8	67.3	70.6	0	0	109.9	M2479 L2483 V2489 Y2505 V2518 K2519	M2479-M2514 HydrophobicContact SD-CE 4.28Å; L2483-M2514 HydrophobicContact CB-CB 4.43Å; L2483-M2514 HydrophobicContact CB-CE 4.12Å; L2483-M2514 HydrophobicContact CD1-CE 4.33Å; V2489-M2514 HydrophobicContact CB-CE 4.43Å; V2489-M2514 HydrophobicContact CG1-CE 3.47Å; V2489-M2514 VanDerWaalsContact CG1-CE 3.47Å; Y2505-M2514 HydrophobicContact CD1-CE 3.73Å; Y2505-M2514 HydrophobicContact CD2-CB 4.5Å; Y2505-M2514 HydrophobicContact CE1-CE 3.45Å; Y2505-M2514 VanDerWaalsContact CE1-CE 3.45Å; M2514-V2518 HydrophobicContact CG-CB 4.02Å; M2514-V2518 HydrophobicContact CG-CG1 4.1Å; M2514-V2518 HydrophobicContact SD-CB 3.99Å; M2514-V2518 HydrophobicContact SD-CG1 3.75Å; M2514-V2518 HydrophobicContact SD-CG2 4.5Å; M2514-K2519 HydrophobicContact CB-CD 4.16Å; M2514-K2519 HydrophobicContact CB-CG 3.85Å; M2514-K2519 HydrophobicContact CG-CG 3.72Å
2515	P	87.8	Confident	86.5	Confident	21 Å²	21	52.8 Å²	52.8	14%	0.136	27%	0.272	C	S	.	.	P	Polyproline II helix	trans	-56.6	141.4	-177.7	-27.5	36.4	0	0	0	111.6	L2483 H2490 E2517 V2518 K2519	L2483-P2515 WeakPolarHBondContact O-CD 3.09Å; H2490-P2515 WeakPolarHBondContact NE2-CD 3.37Å; H2490-P2515 WeakPolarHBondContact NE2-CG 3.25Å; P2515-E2517 HydrophobicContact CB-CG 4.01Å; P2515-E2517 PolarHBondContact O-N 3.05Å; P2515-E2517 VanDerWaalsContact O-N 3.11Å; P2515-V2518 HydrophobicContact CB-CG2 4.37Å; P2515-V2518 PolarHBondContact O-N 2.97Å; P2515-K2519 PolarHBondContact O-N 2.77Å; P2515-K2519 VanDerWaalsContact O-N 3.15Å
2516	P	85.7	Confident	86.1	Confident	111 Å²	111	55.8 Å²	55.8	72%	0.721	30%	0.303	S	S	*	.	H	α-helix	trans	-54.6	-34.8	-179.1	-26.5	33.5	0	0	0	113.3	V2518 K2519 S2520	P2516-V2518 VanDerWaalsContact C-N 3.35Å; P2516-V2518 PolarHBondContact O-N 3.13Å; P2516-K2519 PolarHBondContact O-N 3.18Å; P2516-S2520 WeakPolarHBondContact O-CB 3.16Å; P2516-S2520 PolarHBondContact O-N 2.82Å
2517	E	85.5	Confident	85.9	Confident	99 Å²	99	56.6 Å²	56.6	46%	0.463	31%	0.307	S	S	.	.	H	α-helix	trans	-60.5	-40	176.9	65.5	-175.8	-174.9	0	0	112.7	K2429 P2515 Y2521	K2429-E2517 IonicContact NZ-OE1 3.62Å; K2429-E2517 PolarHBondContact NZ-OE1 3.02Å; K2429-E2517 IonicContact NZ-OE2 2.78Å; P2515-E2517 HydrophobicContact CB-CG 4.01Å; P2515-E2517 PolarHBondContact O-N 3.05Å; P2515-E2517 VanDerWaalsContact O-N 3.11Å; E2517-Y2521 WeakPolarHBondContact O-CB 3.42Å; E2517-Y2521 PolarHBondContact O-N 3.05Å; E2517-Y2521 VanDerWaalsContact O-N 3.16Å
2518	V	87.7	Confident	86	Confident	1 Å²	1	59.9 Å²	59.9	1%	0.006	33%	0.329	C	S	.	.	H	α-helix	trans	-75.9	-42	179.5	-178	0	0	0	0	110.5	H2490 A2493 M2514 P2515 P2516 S2520 Y2521 V2522	H2490-V2518 HydrophobicContact CB-CG2 4.16Å; A2493-V2518 HydrophobicContact CB-CG1 4.05Å; M2514-V2518 HydrophobicContact CG-CB 4.02Å; M2514-V2518 HydrophobicContact CG-CG1 4.1Å; M2514-V2518 HydrophobicContact SD-CB 3.99Å; M2514-V2518 HydrophobicContact SD-CG1 3.75Å; M2514-V2518 HydrophobicContact SD-CG2 4.5Å; P2515-V2518 HydrophobicContact CB-CG2 4.37Å; P2515-V2518 PolarHBondContact O-N 2.97Å; P2516-V2518 VanDerWaalsContact C-N 3.35Å; P2516-V2518 PolarHBondContact O-N 3.13Å; V2518-S2520 VanDerWaalsContact C-N 3.34Å; V2518-S2520 PolarHBondContact O-N 2.82Å; V2518-Y2521 WeakPolarHBondContact O-CB 3.38Å; V2518-Y2521 PolarHBondContact O-N 3.05Å; V2518-V2522 HydrophobicContact CG1-CG2 4.44Å; V2518-V2522 WeakPolarHBondContact O-CG2 3.27Å; V2518-V2522 PolarHBondContact O-N 3.09Å
2519	K	89.7	Confident	86.7	Confident	64 Å²	64	59.4 Å²	59.4	28%	0.278	33%	0.327	S	S	.	.	H	α-helix	trans	-61.3	-43.1	176.9	-71.6	-173.1	71.1	-173.3	0	112.1	Y2505 M2514 P2515 P2516 V2522 A2523 Q2529 E2531	Y2505-K2519 HydrophobicContact CE2-CG 4.24Å; M2514-K2519 HydrophobicContact CB-CD 4.16Å; M2514-K2519 HydrophobicContact CB-CG 3.85Å; M2514-K2519 HydrophobicContact CG-CG 3.72Å; P2515-K2519 PolarHBondContact O-N 2.77Å; P2515-K2519 VanDerWaalsContact O-N 3.15Å; P2516-K2519 PolarHBondContact O-N 3.18Å; K2519-V2522 PolarHBondContact O-N 3.49Å; K2519-A2523 WeakPolarHBondContact O-CB 3.39Å; K2519-A2523 PolarHBondContact O-N 2.92Å; K2519-Q2529 PolarHBondContact O-NE2 3.5Å; K2519-E2531 WeakPolarHBondContact CE-OE1 3.4Å; K2519-E2531 VanDerWaalsContact NZ-CD 3.31Å; K2519-E2531 IonicContact NZ-OE1 3.85Å; K2519-E2531 PolarHBondContact NZ-OE1 3.28Å; K2519-E2531 IonicContact NZ-OE2 3.82Å
2520	S	87.2	Confident	87.2	Confident	63 Å²	63	59.3 Å²	59.3	44%	0.441	33%	0.33	S	S	.	.	H	α-helix	trans	-60.2	-47.6	175.5	-165.2	0	0	0	0	110.5	P2516 V2518 V2522 A2523 D2524	P2516-S2520 WeakPolarHBondContact O-CB 3.16Å; P2516-S2520 PolarHBondContact O-N 2.82Å; V2518-S2520 VanDerWaalsContact C-N 3.34Å; V2518-S2520 PolarHBondContact O-N 2.82Å; S2520-V2522 VanDerWaalsContact C-N 3.33Å; S2520-V2522 PolarHBondContact O-N 2.97Å; S2520-A2523 WeakPolarHBondContact O-CB 3.24Å; S2520-A2523 PolarHBondContact O-N 3.17Å; S2520-A2523 VanDerWaalsContact O-N 3.07Å; S2520-D2524 PolarHBondContact O-N 3.09Å
2521	Y	88.8	Confident	87.7	Confident	34 Å²	34	57.2 Å²	57.2	13%	0.133	32%	0.316	C	S	.	.	H	α-helix	trans	-56.4	-44.7	177.7	-175.9	-89.6	0	0	0	113.5	E2330 R2494 E2517 V2518 A2523 R2525	E2330-Y2521 VanDerWaalsContact CD-CE2 3.44Å; E2330-Y2521 HydrophobicContact CG-CE2 4.41Å; E2330-Y2521 WeakPolarHBondContact CG-OH 3.46Å; E2330-Y2521 VanDerWaalsContact OE1-CE2 3.24Å; E2330-Y2521 WeakPolarHBondContact OE1-CE2 3.26Å; E2330-Y2521 PolarHBondContact OE1-OH 3.31Å; E2330-Y2521 VanDerWaalsContact OE2-CE2 3.31Å; E2330-Y2521 WeakPolarHBondContact OE2-CE2 3.4Å; E2330-Y2521 PolarHBondContact OE2-OH 3.28Å; R2494-Y2521 HydrophobicContact CB-CD1 4.3Å; R2494-Y2521 HydrophobicContact CB-CE1 3.84Å; R2494-Y2521 HydrophobicContact CG-CD1 3.76Å; R2494-Y2521 HydrophobicContact CG-CE1 3.72Å; R2494-Y2521 HydrophobicContact CG-CG 4.44Å; E2517-Y2521 WeakPolarHBondContact O-CB 3.42Å; E2517-Y2521 PolarHBondContact O-N 3.05Å; E2517-Y2521 VanDerWaalsContact O-N 3.16Å; V2518-Y2521 WeakPolarHBondContact O-CB 3.38Å; V2518-Y2521 PolarHBondContact O-N 3.05Å; Y2521-A2523 VanDerWaalsContact C-N 3.33Å; Y2521-R2525 PolarHBondContact O-N 2.65Å; Y2521-R2525 PolarHBondContact OH-NH1 3.45Å; Y2521-R2525 PolarHBondContact OH-NH2 2.83Å
2522	V	89.8	Confident	88.2	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-68.4	-35.7	178.4	176.4	0	0	0	0	110.9	A2493 L2503 V2518 K2519 S2520 R2525 I2527 Q2529	A2493-V2522 HydrophobicContact CB-CG2 4.12Å; L2503-V2522 HydrophobicContact CD1-CG1 3.92Å; L2503-V2522 HydrophobicContact CD1-CG2 4.45Å; V2518-V2522 HydrophobicContact CG1-CG2 4.44Å; V2518-V2522 WeakPolarHBondContact O-CG2 3.27Å; V2518-V2522 PolarHBondContact O-N 3.09Å; K2519-V2522 PolarHBondContact O-N 3.49Å; S2520-V2522 VanDerWaalsContact C-N 3.33Å; S2520-V2522 PolarHBondContact O-N 2.97Å; V2522-R2525 PolarHBondContact O-N 2.86Å; V2522-I2527 HydrophobicContact CG1-CB 3.66Å; V2522-I2527 HydrophobicContact CG1-CG1 4.44Å; V2522-I2527 HydrophobicContact CG1-CG2 3.79Å; V2522-I2527 PolarHBondContact O-N 2.97Å; V2522-Q2529 HydrophobicContact CB-CG 4.41Å; V2522-Q2529 VanDerWaalsContact CB-NE2 3.29Å; V2522-Q2529 HydrophobicContact CG1-CG 3.58Å
2523	A	85.9	Confident	88	Confident	55 Å²	55	60.2 Å²	60.2	46%	0.455	34%	0.338	S	S	.	.	H	α-helix	trans	-69.8	-41.1	178.2	0	0	0	0	0	112.1	K2519 S2520 Y2521 R2525 G2526	K2519-A2523 WeakPolarHBondContact O-CB 3.39Å; K2519-A2523 PolarHBondContact O-N 2.92Å; S2520-A2523 WeakPolarHBondContact O-CB 3.24Å; S2520-A2523 PolarHBondContact O-N 3.17Å; S2520-A2523 VanDerWaalsContact O-N 3.07Å; Y2521-A2523 VanDerWaalsContact C-N 3.33Å; A2523-R2525 PolarHBondContact O-N 3.11Å; A2523-R2525 VanDerWaalsContact O-N 3.13Å; A2523-G2526 PolarHBondContact O-N 3.26Å
2524	D	84.9	Confident	87.9	Confident	129 Å²	129	58.2 Å²	58.2	69%	0.69	33%	0.333	S	S	*	.	H	α-helix	trans	-61.6	-21.1	176.9	-66.8	-27.6	0	0	0	112.4	S2520	S2520-D2524 PolarHBondContact O-N 3.09Å
2525	R	86.9	Confident	87.7	Confident	107 Å²	107	58 Å²	58	40%	0.404	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.3	6.3	174.4	-68.8	-173.7	169.6	-179.8	-5.8	114.3	R2494 C2497 Y2521 V2522 A2523 I2527	R2494-R2525 PolarHBondContact O-NH1 3.17Å; C2497-R2525 HydrophobicContact CB-CB 4.06Å; C2497-R2525 HydrophobicContact CB-CG 4.35Å; Y2521-R2525 PolarHBondContact O-N 2.65Å; Y2521-R2525 PolarHBondContact OH-NH1 3.45Å; Y2521-R2525 PolarHBondContact OH-NH2 2.83Å; V2522-R2525 PolarHBondContact O-N 2.86Å; A2523-R2525 PolarHBondContact O-N 3.11Å; A2523-R2525 VanDerWaalsContact O-N 3.13Å; R2525-I2527 VanDerWaalsContact C-N 3.33Å; R2525-I2527 PolarHBondContact O-N 3.45Å
2526	G	84.4	Confident	87.7	Confident	65 Å²	65	61.2 Å²	61.2	67%	0.67	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.8	21.8	173.4	0	0	0	0	0	115.1	A2523	A2523-G2526 PolarHBondContact O-N 3.26Å
2527	I	89.8	Confident	87.6	Confident	16 Å²	16	62.3 Å²	62.3	8%	0.082	34%	0.341	C	S	.	.			trans	-84.1	124.9	175.6	-63	-69.1	0	0	0	109.1	C2497 Y2499 V2501 L2503 V2522 R2525 Q2529	C2497-I2527 HydrophobicContact CB-CG1 4.21Å; Y2499-I2527 WeakPolarHBondContact O-CD1 3.44Å; V2501-I2527 HydrophobicContact CG2-CD1 4.4Å; V2501-I2527 HydrophobicContact CG2-CG2 4.2Å; L2503-I2527 HydrophobicContact CD1-CG2 4.31Å; L2503-I2527 HydrophobicContact CG-CG2 3.98Å; V2522-I2527 HydrophobicContact CG1-CB 3.66Å; V2522-I2527 HydrophobicContact CG1-CG1 4.44Å; V2522-I2527 HydrophobicContact CG1-CG2 3.79Å; V2522-I2527 PolarHBondContact O-N 2.97Å; R2525-I2527 VanDerWaalsContact C-N 3.33Å; R2525-I2527 PolarHBondContact O-N 3.45Å; I2527-Q2529 PolarHBondContact O-N 3.49Å
2528	P	89.2	Confident	87.7	Confident	76 Å²	76	57.6 Å²	57.6	49%	0.494	32%	0.319	S	S	.	.			trans	-61.8	132.7	175.5	-21.2	32.4	0	0	0	111.6	K2502 L2503	K2502-P2528 HydrophobicContact CG-CB 4.33Å; L2503-P2528 PolarHBondContact N-O 3.18Å
2529	Q	91.7	Very high	87.8	Confident	46 Å²	46	57.6 Å²	57.6	22%	0.215	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	134.8	-178.7	-65.9	175.5	79.7	0	0	110.2	L2503 Y2505 K2519 V2522 I2527	L2503-Q2529 HydrophobicContact CB-CG 4.39Å; L2503-Q2529 CarbonylContact O-C 3.59Å; L2503-Q2529 VanDerWaalsContact O-CA 3.27Å; L2503-Q2529 WeakPolarHBondContact O-CA 3.36Å; Y2505-Q2529 HydrophobicContact CE2-CB 4.07Å; Y2505-Q2529 HydrophobicContact CE2-CG 4.13Å; Y2505-Q2529 PolarHBondContact OH-OE1 2.77Å; K2519-Q2529 PolarHBondContact O-NE2 3.5Å; V2522-Q2529 HydrophobicContact CB-CG 4.41Å; V2522-Q2529 VanDerWaalsContact CB-NE2 3.29Å; V2522-Q2529 HydrophobicContact CG1-CG 3.58Å; I2527-Q2529 PolarHBondContact O-N 3.49Å
2530	E	90.2	Very high	87.6	Confident	77 Å²	77	57.5 Å²	57.5	36%	0.36	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	138.5	174.1	-72.5	169.7	-176.9	0	0	109.8	K2502 L2503 R2504 Y2505	K2502-E2530 WeakPolarHBondContact CE-OE1 3.44Å; K2502-E2530 WeakPolarHBondContact CE-OE2 3.36Å; K2502-E2530 IonicContact NZ-OE1 3.75Å; K2502-E2530 PolarHBondContact NZ-OE1 2.86Å; K2502-E2530 IonicContact NZ-OE2 2.64Å; K2502-E2530 PolarHBondContact NZ-OE2 3.26Å; L2503-E2530 PolarHBondContact O-N 3.06Å; R2504-E2530 CarbonylContact C-O 3.53Å; R2504-E2530 WeakPolarHBondContact CA-O 3.25Å; R2504-E2530 HydrophobicContact CG-CB 4.18Å; R2504-E2530 IonicContact CZ-OE2 2.67Å; R2504-E2530 IonicContact NE-OE2 3.33Å; R2504-E2530 PolarHBondContact NE-OE2 3.15Å; R2504-E2530 IonicContact NH2-OE2 2.87Å; R2504-E2530 PolarHBondContact NH2-OE2 3.11Å; Y2505-E2530 PolarHBondContact N-O 3.39Å
2531	E	89.4	Confident	87.5	Confident	80 Å²	80	58.7 Å²	58.7	37%	0.374	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	137.6	168.8	-74.1	-171	176.5	0	0	109.6	Y2505 K2513 K2519	Y2505-E2531 HydrophobicContact CD2-CG 4.16Å; Y2505-E2531 WeakPolarHBondContact O-CA 3.25Å; K2513-E2531 IonicContact NZ-OE2 3.8Å; K2519-E2531 WeakPolarHBondContact CE-OE1 3.4Å; K2519-E2531 VanDerWaalsContact NZ-CD 3.31Å; K2519-E2531 IonicContact NZ-OE1 3.85Å; K2519-E2531 PolarHBondContact NZ-OE1 3.28Å; K2519-E2531 IonicContact NZ-OE2 3.82Å
2532	M	90.5	Very high	87.7	Confident	33 Å²	33	57 Å²	57	16%	0.163	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	152.4	179.6	-56.2	178.8	71.8	0	0	109.4	R2504 Y2505 V2506 T2507 E2537 A2538	R2504-M2532 HydrophobicContact CG-SD 4.45Å; Y2505-M2532 PolarHBondContact O-N 3.07Å; V2506-M2532 WeakPolarHBondContact CA-O 3.43Å; V2506-M2532 HydrophobicContact CG2-CB 4.3Å; T2507-M2532 PolarHBondContact N-O 3.26Å; M2532-E2537 HydrophobicContact CE-CB 3.8Å; M2532-A2538 HydrophobicContact CE-CB 3.96Å; M2532-A2538 HydrophobicContact SD-CB 3.83Å
2533	T	83.2	Confident	87.8	Confident	112 Å²	112	58.1 Å²	58.1	69%	0.687	33%	0.325	S	S	*	.	S	Bend	trans	-107.1	-7.7	177.7	51.3	0	0	0	0	113.2	F2566	T2533-F2566 WeakPolarHBondContact O-CZ 3.36Å
2534	S	86.7	Confident	88.2	Confident	27 Å²	27	55.5 Å²	55.5	19%	0.189	30%	0.304	C	S	.	.			trans	-120.2	133.1	-178.2	171.2	0	0	0	0	110.6	E2536 E2537	S2534-E2536 PolarHBondContact OG-N 2.91Å; S2534-E2536 PolarHBondContact OG-OE2 2.99Å; S2534-E2537 PolarHBondContact OG-N 3.1Å
2535	L	87.7	Confident	88.7	Confident	1 Å²	1	49.4 Å²	49.4	1%	0.005	27%	0.271	C	S	.	.	S	Bend	trans	-81.2	-37.3	176.5	178.6	54.2	0	0	0	110.6	V2480 V2506 E2537 A2538 L2539 L2545 F2566 L2572	V2480-L2535 HydrophobicContact CG1-CD1 4.48Å; V2480-L2535 HydrophobicContact CG1-CD2 4.49Å; V2480-L2535 HydrophobicContact CG2-CD1 3.92Å; V2506-L2535 HydrophobicContact CG1-CB 4.4Å; L2535-E2537 VanDerWaalsContact C-N 3.29Å; L2535-E2537 PolarHBondContact O-N 2.8Å; L2535-A2538 PolarHBondContact O-N 2.95Å; L2535-L2539 HydrophobicContact CD1-CD2 4.33Å; L2535-L2539 HydrophobicContact CD1-CG 4.32Å; L2535-L2539 HydrophobicContact CG-CD1 4.43Å; L2535-L2539 HydrophobicContact CG-CG 4.44Å; L2535-L2539 WeakPolarHBondContact O-CG 3.28Å; L2535-L2539 PolarHBondContact O-N 3.34Å; L2535-L2545 HydrophobicContact CD1-CD1 3.83Å; L2535-F2566 HydrophobicContact CB-CD1 3.82Å; L2535-F2566 HydrophobicContact CB-CE1 4.08Å; L2535-F2566 HydrophobicContact CB-CG 4.36Å; L2535-F2566 HydrophobicContact CD2-CB 4.02Å; L2535-F2566 HydrophobicContact CD2-CD1 4.4Å; L2535-F2566 HydrophobicContact CD2-CG 4.37Å; L2535-L2572 HydrophobicContact CD2-CD2 3.66Å; L2535-L2572 HydrophobicContact CG-CD2 4.14Å
2536	E	86.1	Confident	89.1	Confident	89 Å²	89	44.3 Å²	44.3	42%	0.416	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-41.6	178.3	-66.1	71.4	-166	0	0	111.6	S2534 A2538 L2572 L2575	S2534-E2536 PolarHBondContact OG-N 2.91Å; S2534-E2536 PolarHBondContact OG-OE2 2.99Å; E2536-A2538 VanDerWaalsContact C-N 3.33Å; E2536-A2538 PolarHBondContact O-N 3.04Å; E2536-L2572 HydrophobicContact CG-CD1 3.68Å; E2536-L2575 HydrophobicContact CB-CD1 4.2Å; E2536-L2575 HydrophobicContact CG-CD1 4.26Å
2537	E	84.8	Confident	89.6	Confident	135 Å²	135	41.2 Å²	41.2	63%	0.631	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-26.9	177.1	-73.5	-176.3	175.1	0	0	113.1	M2532 S2534 L2535	M2532-E2537 HydrophobicContact CE-CB 3.8Å; S2534-E2537 PolarHBondContact OG-N 3.1Å; L2535-E2537 VanDerWaalsContact C-N 3.29Å; L2535-E2537 PolarHBondContact O-N 2.8Å
2538	A	87.1	Confident	89.6	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-29.3	-176.4	0	0	0	0	0	113.1	T2478 V2506 M2532 L2535 E2536 T2542	T2478-A2538 HydrophobicContact CG2-CB 4.01Å; V2506-A2538 HydrophobicContact CG2-CB 4.16Å; M2532-A2538 HydrophobicContact CE-CB 3.96Å; M2532-A2538 HydrophobicContact SD-CB 3.83Å; L2535-A2538 PolarHBondContact O-N 2.95Å; E2536-A2538 VanDerWaalsContact C-N 3.33Å; E2536-A2538 PolarHBondContact O-N 3.04Å; A2538-T2542 PolarHBondContact O-N 2.94Å; A2538-T2542 PolarHBondContact O-OG1 2.82Å
2539	L	89.7	Confident	89.5	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-61.4	-40.5	-170	-74.3	168.8	0	0	0	116.2	L2535 D2541 T2542 L2545 L2572 M2573 L2575 A2576 M2581	L2535-L2539 HydrophobicContact CD1-CD2 4.33Å; L2535-L2539 HydrophobicContact CD1-CG 4.32Å; L2535-L2539 HydrophobicContact CG-CD1 4.43Å; L2535-L2539 HydrophobicContact CG-CG 4.44Å; L2535-L2539 WeakPolarHBondContact O-CG 3.28Å; L2535-L2539 PolarHBondContact O-N 3.34Å; L2539-D2541 PolarHBondContact O-N 3.43Å; L2539-T2542 PolarHBondContact O-N 2.81Å; L2539-L2545 HydrophobicContact CD2-CD1 4.42Å; L2539-L2545 HydrophobicContact CD2-CD2 3.91Å; L2539-L2572 HydrophobicContact CD1-CD1 3.73Å; L2539-L2572 HydrophobicContact CD1-CD2 4.19Å; L2539-L2572 HydrophobicContact CD1-CG 3.6Å; L2539-M2573 HydrophobicContact CD2-SD 4.41Å; L2539-L2575 HydrophobicContact CD1-CB 4.46Å; L2539-A2576 HydrophobicContact CB-CB 4.33Å; L2539-A2576 HydrophobicContact CD2-CB 4.31Å; L2539-M2581 HydrophobicContact CD2-CE 4.47Å
2540	P	85.2	Confident	89.1	Confident	62 Å²	62	36.9 Å²	36.9	40%	0.403	19%	0.191	S	C	.	.	G	3₁₀ helix	trans	-60.4	-31.7	-174.8	-27.1	35.9	0	0	0	114.3	K2577	P2540-K2577 WeakPolarHBondContact O-CE 3.44Å; P2540-K2577 WeakPolarHBondContact O-CG 3.37Å
2541	D	85	Confident	88.5	Confident	88 Å²	88	34.6 Å²	34.6	47%	0.471	18%	0.181	S	C	.	.	G	3₁₀ helix	trans	-103.3	-3	-177.6	-65	-32.9	0	0	0	113.5	T2476 R2504 L2539	T2476-D2541 WeakPolarHBondContact CB-O 2.95Å; R2504-D2541 IonicContact NH1-OD2 3.38Å; L2539-D2541 PolarHBondContact O-N 3.43Å
2542	T	93.1	Very high	87.8	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	18%	0.175	C	C	.	.			trans	-78.6	133.1	-175.9	-68	0	0	0	0	111.3	T2478 A2538 L2539 V2544 L2545 M2581	T2478-T2542 PolarHBondContact OG1-OG1 3Å; A2538-T2542 PolarHBondContact O-N 2.94Å; A2538-T2542 PolarHBondContact O-OG1 2.82Å; L2539-T2542 PolarHBondContact O-N 2.81Å; T2542-V2544 VanDerWaalsContact CG2-C 3.45Å; T2542-V2544 WeakPolarHBondContact CG2-O 3.45Å; T2542-L2545 HydrophobicContact CG2-CB 4.1Å; T2542-M2581 HydrophobicContact CG2-SD 4.24Å; T2542-M2581 VanDerWaalsContact O-CG 3.31Å; T2542-M2581 WeakPolarHBondContact O-CG 3.29Å
2543	D	91.4	Very high	86.9	Confident	23 Å²	23	36.2 Å²	36.2	12%	0.123	19%	0.191	C	C	.	.	S	Bend	trans	-101.2	-32.9	172.7	-53.6	-58.9	0	0	0	111.5	L2475 T2476 K2577 M2581 I2582	L2475-D2543 WeakPolarHBondContact CA-OD2 3.27Å; L2475-D2543 HydrophobicContact CB-CB 4.21Å; L2475-D2543 HydrophobicContact CD2-CB 3.94Å; T2476-D2543 PolarHBondContact N-OD2 2.76Å; T2476-D2543 PolarHBondContact O-N 2.78Å; D2543-K2577 IonicContact OD1-NZ 3.99Å; D2543-K2577 PolarHBondContact OD1-NZ 3.09Å; D2543-M2581 CarbonylContact O-C 3.38Å; D2543-M2581 WeakPolarHBondContact O-CA 3.3Å; D2543-M2581 WeakPolarHBondContact O-CG 3.48Å; D2543-I2582 PolarHBondContact O-N 3.4Å
2544	V	94.7	Very high	86.4	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	115.9	174.5	-177.6	0	0	0	0	109.3	I2465 I2469 L2475 T2476 I2477 T2478 T2542 I2582 M2584	I2465-V2544 HydrophobicContact CD1-CG1 4.12Å; I2465-V2544 HydrophobicContact CD1-CG2 4.2Å; I2465-V2544 HydrophobicContact CG1-CG1 4.15Å; I2465-V2544 HydrophobicContact CG1-CG2 4.05Å; I2465-V2544 HydrophobicContact CG2-CG2 4.1Å; I2469-V2544 HydrophobicContact CD1-CG2 3.49Å; I2469-V2544 VanDerWaalsContact CD1-CG2 3.49Å; L2475-V2544 HydrophobicContact CD1-CG2 4.12Å; T2476-V2544 PolarHBondContact O-N 3.47Å; I2477-V2544 WeakPolarHBondContact CA-O 3.25Å; I2477-V2544 HydrophobicContact CB-CB 4.43Å; I2477-V2544 HydrophobicContact CG1-CB 4.09Å; I2477-V2544 HydrophobicContact CG1-CG2 4.29Å; I2477-V2544 HydrophobicContact CG2-CB 4.19Å; I2477-V2544 HydrophobicContact CG2-CG1 4.3Å; T2478-V2544 PolarHBondContact N-O 2.94Å; T2542-V2544 VanDerWaalsContact CG2-C 3.45Å; T2542-V2544 WeakPolarHBondContact CG2-O 3.45Å; V2544-I2582 HydrophobicContact CB-CG1 4.42Å; V2544-I2582 HydrophobicContact CG1-CD1 4.47Å; V2544-I2582 HydrophobicContact CG1-CG1 4.12Å; V2544-I2582 HydrophobicContact CG2-CD1 4.29Å; V2544-I2582 HydrophobicContact CG2-CG1 4.08Å; V2544-M2584 HydrophobicContact CG1-CG 4.43Å; V2544-M2584 HydrophobicContact CG1-SD 3.73Å
2545	L	95.8	Very high	85.7	Confident	0 Å²	0	34 Å²	34	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	108.5	172.7	-174.7	67.7	0	0	0	109.6	T2478 V2480 L2535 L2539 T2542 M2547 V2568 M2573 M2581 I2582 V2583 M2584	T2478-L2545 HydrophobicContact CG2-CD1 4.14Å; V2480-L2545 HydrophobicContact CG2-CD1 3.66Å; L2535-L2545 HydrophobicContact CD1-CD1 3.83Å; L2539-L2545 HydrophobicContact CD2-CD1 4.42Å; L2539-L2545 HydrophobicContact CD2-CD2 3.91Å; T2542-L2545 HydrophobicContact CG2-CB 4.1Å; L2545-M2547 HydrophobicContact CD2-CG 4.43Å; L2545-M2547 HydrophobicContact CD2-SD 4.48Å; L2545-M2547 HydrophobicContact CG-CG 4.33Å; L2545-M2547 HydrophobicContact CG-SD 4.46Å; L2545-V2568 HydrophobicContact CD2-CG2 3.98Å; L2545-M2573 HydrophobicContact CD2-SD 4.46Å; L2545-M2581 HydrophobicContact CB-CE 4.09Å; L2545-M2581 HydrophobicContact CD2-CE 4.39Å; L2545-I2582 PolarHBondContact N-O 3.08Å; L2545-V2583 HydrophobicContact CB-CG2 4.35Å; L2545-V2583 HydrophobicContact CD2-CG1 4.41Å; L2545-V2583 HydrophobicContact CD2-CG2 4.26Å; L2545-V2583 CarbonylContact O-C 3.54Å; L2545-V2583 WeakPolarHBondContact O-CA 3.49Å; L2545-M2584 PolarHBondContact O-N 3.39Å
2546	Y	95.8	Very high	84.4	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	98.4	179.7	-164.2	-83.3	0	0	0	110.3	D2461 T2478 M2479 V2480 V2489 L2492 T2548 M2584 P2586	D2461-Y2546 HydrophobicContact CB-CE2 4.16Å; D2461-Y2546 VanDerWaalsContact OD2-CE2 3.23Å; D2461-Y2546 WeakPolarHBondContact OD2-CE2 3.39Å; D2461-Y2546 VanDerWaalsContact OD2-CZ 3.25Å; D2461-Y2546 PolarHBondContact OD2-OH 2.96Å; T2478-Y2546 PolarHBondContact O-N 2.77Å; M2479-Y2546 WeakPolarHBondContact CA-O 3.34Å; V2480-Y2546 PolarHBondContact N-O 2.94Å; V2489-Y2546 HydrophobicContact CG2-CE1 4.3Å; L2492-Y2546 HydrophobicContact CD2-CD1 4.34Å; L2492-Y2546 HydrophobicContact CD2-CD2 3.64Å; L2492-Y2546 HydrophobicContact CD2-CE1 4.26Å; L2492-Y2546 HydrophobicContact CD2-CE2 3.53Å; L2492-Y2546 HydrophobicContact CD2-CG 4.04Å; Y2546-T2548 HydrophobicContact CD1-CG2 3.94Å; Y2546-T2548 HydrophobicContact CE1-CG2 3.82Å; Y2546-M2584 HydrophobicContact CD2-CB 3.78Å; Y2546-M2584 HydrophobicContact CD2-CE 4.31Å; Y2546-M2584 HydrophobicContact CE2-CB 4.29Å; Y2546-M2584 HydrophobicContact CE2-CE 4.26Å; Y2546-P2586 HydrophobicContact CE1-CG 4.33Å
2547	M	93.7	Very high	82.6	Confident	1 Å²	1	43.8 Å²	43.8	1%	0.005	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	145.5	179.9	-70.3	-66.6	-62.6	0	0	110.8	V2480 L2545 F2566 V2568 M2584 H2585 P2586 E2592 I2593	V2480-M2547 HydrophobicContact CB-CE 4.48Å; V2480-M2547 HydrophobicContact CB-SD 3.57Å; V2480-M2547 VanDerWaalsContact CB-SD 3.57Å; V2480-M2547 HydrophobicContact CG1-CE 4.18Å; V2480-M2547 HydrophobicContact CG1-SD 3.74Å; V2480-M2547 HydrophobicContact CG2-SD 4.05Å; V2480-M2547 CarbonylContact O-C 3.54Å; L2545-M2547 HydrophobicContact CD2-CG 4.43Å; L2545-M2547 HydrophobicContact CD2-SD 4.48Å; L2545-M2547 HydrophobicContact CG-CG 4.33Å; L2545-M2547 HydrophobicContact CG-SD 4.46Å; M2547-F2566 HydrophobicContact CE-CB 4.38Å; M2547-V2568 HydrophobicContact CE-CG2 3.88Å; M2547-V2568 HydrophobicContact CG-CG2 3.7Å; M2547-V2568 HydrophobicContact SD-CG2 3.6Å; M2547-V2568 VanDerWaalsContact SD-CG2 3.6Å; M2547-M2584 PolarHBondContact N-O 2.98Å; M2547-H2585 VanDerWaalsContact C-CD2 3.49Å; M2547-H2585 PolarHBondContact O-CD2 3.15Å; M2547-P2586 WeakPolarHBondContact O-CD 3.37Å; M2547-E2592 HydrophobicContact CE-CB 4.11Å; M2547-E2592 WeakPolarHBondContact CE-O 3.42Å; M2547-I2593 HydrophobicContact CB-CD1 4.07Å; M2547-I2593 HydrophobicContact CB-CG1 4.28Å; M2547-I2593 HydrophobicContact CG-CD1 4.35Å; M2547-I2593 HydrophobicContact CG-CG1 4.27Å
2548	T	89.8	Confident	81	Confident	5 Å²	5	40.9 Å²	40.9	3%	0.031	22%	0.222	C	C	.	.			trans	-131.7	148.8	175.6	59.9	0	0	0	0	113.3	V2480 G2481 D2482 V2489 Y2546 P2586	V2480-T2548 PolarHBondContact O-N 2.8Å; V2480-T2548 PolarHBondContact O-OG1 2.8Å; G2481-T2548 WeakPolarHBondContact CA-OG1 3.48Å; D2482-T2548 PolarHBondContact N-OG1 3.47Å; V2489-T2548 HydrophobicContact CG2-CG2 3.28Å; Y2546-T2548 HydrophobicContact CD1-CG2 3.94Å; Y2546-T2548 HydrophobicContact CE1-CG2 3.82Å; T2548-P2586 HydrophobicContact CG2-CG 4.43Å
2549	R	87.2	Confident	79.3	Confident	37 Å²	37	44.8 Å²	44.8	14%	0.14	26%	0.262	C	S	.	.			trans	-81.5	135.3	175.9	-171.8	-167.5	69.5	160	0.7	111.6	Q2551 E2553 V2590 E2592	R2549-Q2551 PolarHBondContact O-N 2.65Å; R2549-Q2551 PolarHBondContact O-NE2 3.4Å; R2549-Q2551 VanDerWaalsContact O-NE2 3.15Å; R2549-E2553 IonicContact CZ-OE1 2.75Å; R2549-E2553 IonicContact NH2-OE1 3.32Å; R2549-E2553 PolarHBondContact NH2-OE1 3.01Å; R2549-E2553 IonicContact NH2-OE2 3.98Å; R2549-E2553 PolarHBondContact NH2-OE2 2.77Å; R2549-V2590 VanDerWaalsContact CD-CG2 3.41Å; R2549-V2590 HydrophobicContact CG-CB 4.43Å; R2549-V2590 HydrophobicContact CG-CG2 4.19Å; R2549-E2592 WeakPolarHBondContact CB-OE1 3.38Å
2550	V	83.1	Confident	77.6	Confident	4 Å²	4	49.1 Å²	49.1	2%	0.024	29%	0.286	C	S	.	.			trans	-59.2	118	167	-177	0	0	0	0	111	D2482 F2512 T2552 M2555 A2561 Q2565	D2482-V2550 HydrophobicContact CB-CB 4.39Å; D2482-V2550 HydrophobicContact CB-CG2 4.33Å; F2512-V2550 HydrophobicContact CE1-CG1 4.08Å; F2512-V2550 HydrophobicContact CZ-CG1 3.87Å; V2550-T2552 HydrophobicContact CG1-CG2 4.26Å; V2550-T2552 PolarHBondContact O-N 3.17Å; V2550-T2552 VanDerWaalsContact O-N 3.14Å; V2550-M2555 HydrophobicContact CG1-SD 4.38Å; V2550-A2561 HydrophobicContact CG1-CB 4.35Å; V2550-Q2565 HydrophobicContact CG2-CB 4.48Å
2551	Q	79.1	Confident	76.3	Confident	29 Å²	29	46.3 Å²	46.3	14%	0.136	27%	0.267	C	S	.	.			trans	-88.6	69	-175	-59.3	-67.1	-52.1	0	0	111.4	D2482 N2485 R2549 E2553 R2554	D2482-Q2551 PolarHBondContact OD2-N 3.49Å; N2485-Q2551 HydrophobicContact CB-CB 4.11Å; N2485-Q2551 HydrophobicContact CB-CG 4.41Å; R2549-Q2551 PolarHBondContact O-N 2.65Å; R2549-Q2551 PolarHBondContact O-NE2 3.4Å; R2549-Q2551 VanDerWaalsContact O-NE2 3.15Å; Q2551-E2553 PolarHBondContact O-N 2.61Å; Q2551-R2554 HydrophobicContact CB-CB 4.49Å; Q2551-R2554 HydrophobicContact CB-CG 4.46Å; Q2551-R2554 PolarHBondContact O-N 3.19Å
2552	T	73.1	Confident	75	Confident	42 Å²	42	47.7 Å²	47.7	26%	0.258	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-52.8	-31.7	-177.5	43.9	0	0	0	0	114	V2550 R2554 M2555 R2562	V2550-T2552 HydrophobicContact CG1-CG2 4.26Å; V2550-T2552 PolarHBondContact O-N 3.17Å; V2550-T2552 VanDerWaalsContact O-N 3.14Å; T2552-R2554 PolarHBondContact O-N 3.26Å; T2552-R2554 VanDerWaalsContact O-N 3.15Å; T2552-M2555 PolarHBondContact O-N 3.26Å; T2552-R2562 HydrophobicContact CG2-CG 3.98Å; T2552-R2562 PolarHBondContact OG1-NH2 3.31Å
2553	E	72.4	Confident	73.2	Confident	106 Å²	106	57.6 Å²	57.6	50%	0.495	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-67.3	-8.5	178.5	62.7	-96.4	-131.2	0	0	114.8	R2549 Q2551	R2549-E2553 IonicContact CZ-OE1 2.75Å; R2549-E2553 IonicContact NH2-OE1 3.32Å; R2549-E2553 PolarHBondContact NH2-OE1 3.01Å; R2549-E2553 IonicContact NH2-OE2 3.98Å; R2549-E2553 PolarHBondContact NH2-OE2 2.77Å; Q2551-E2553 PolarHBondContact O-N 2.61Å
2554	R	73.3	Confident	71.8	Confident	51 Å²	51	61.9 Å²	61.9	19%	0.192	33%	0.326	C	S	.	.	G	3₁₀ helix	trans	-109.2	-1.3	178.9	-65.5	168	-170	-156.2	-15.8	112.8	E2372 G2450 N2485 R2487 Q2551 T2552	E2372-R2554 IonicContact OE1-CZ 2.9Å; E2372-R2554 IonicContact OE1-NE 2.63Å; E2372-R2554 IonicContact OE1-NH2 3.69Å; E2372-R2554 PolarHBondContact OE1-NH2 3.47Å; E2372-R2554 IonicContact OE2-NH2 3.43Å; G2450-R2554 VanDerWaalsContact O-CZ 3.24Å; G2450-R2554 PolarHBondContact O-NH1 2.92Å; G2450-R2554 PolarHBondContact O-NH2 3Å; N2485-R2554 HydrophobicContact CB-CB 4.49Å; N2485-R2554 PolarHBondContact O-NH1 3.21Å; R2487-R2554 VanDerWaalsContact CZ-NH2 3.28Å; Q2551-R2554 HydrophobicContact CB-CB 4.49Å; Q2551-R2554 HydrophobicContact CB-CG 4.46Å; Q2551-R2554 PolarHBondContact O-N 3.19Å; T2552-R2554 PolarHBondContact O-N 3.26Å; T2552-R2554 VanDerWaalsContact O-N 3.15Å
2555	M	71.6	Confident	70.8	Confident	41 Å²	41	63.9 Å²	63.9	20%	0.202	34%	0.336	C	S	.	.	S	Bend	trans	-99.7	146.3	-179.6	-58.5	-177.4	77.2	0	0	109.7	F2512 V2550 T2552 D2557 A2561	F2512-M2555 HydrophobicContact CE1-CE 3.69Å; F2512-M2555 HydrophobicContact CE1-SD 3.88Å; F2512-M2555 HydrophobicContact CZ-CE 4.23Å; F2512-M2555 HydrophobicContact CZ-SD 4.44Å; V2550-M2555 HydrophobicContact CG1-SD 4.38Å; T2552-M2555 PolarHBondContact O-N 3.26Å; M2555-D2557 PolarHBondContact O-N 3.31Å; M2555-D2557 VanDerWaalsContact O-N 3.1Å; M2555-A2561 HydrophobicContact CE-CB 4.33Å; M2555-A2561 HydrophobicContact SD-CB 4.1Å
2556	S	60.6	Low	70.2	Confident	124 Å²	124	65.5 Å²	65.5	87%	0.867	34%	0.343	S	S	*	.	S	Bend	trans	-79.2	89.3	172.2	15.6	0	0	0	0	109	D2558	S2556-D2558 PolarHBondContact O-N 3.05Å
2557	D	49.2	Very low	69.9	Low	171 Å²	171	68.3 Å²	68.3	91%	0.914	36%	0.36	S	S	*	.	S	Bend	trans	54.6	51.1	156.5	-126.7	11.1	0	0	0	118.2	M2555	M2555-D2557 PolarHBondContact O-N 3.31Å; M2555-D2557 VanDerWaalsContact O-N 3.1Å
2558	D	49.9	Very low	69.7	Low	74 Å²	74	68.3 Å²	68.3	40%	0.396	36%	0.36	S	S	.	.			trans	-117.6	93.2	171.5	-153.6	10.2	0	0	0	111.8	R2509 S2556 N2560 A2561	R2509-D2558 IonicContact NH1-OD2 3.64Å; S2556-D2558 PolarHBondContact O-N 3.05Å; D2558-N2560 PolarHBondContact O-N 3.1Å; D2558-A2561 PolarHBondContact O-N 3.07Å
2559	G	52.7	Low	69.7	Low	83 Å²	83	69.8 Å²	69.8	86%	0.856	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-9.6	179.4	0	0	0	0	0	114.8
2560	N	54	Low	69.5	Low	91 Å²	91	70 Å²	70	49%	0.487	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87	-10.6	177.9	-82.1	-30.2	0	0	0	114.6	D2558 R2562 R2563	D2558-N2560 PolarHBondContact O-N 3.1Å; N2560-R2562 PolarHBondContact O-N 3.34Å; N2560-R2563 PolarHBondContact O-N 2.89Å
2561	A	56.9	Low	69.5	Low	2 Å²	2	75.6 Å²	75.6	2%	0.017	40%	0.401	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-20.2	-172.2	0	0	0	0	0	115.5	F2512 V2550 M2555 D2558	F2512-A2561 HydrophobicContact CZ-CB 4.3Å; V2550-A2561 HydrophobicContact CG1-CB 4.35Å; M2555-A2561 HydrophobicContact CE-CB 4.33Å; M2555-A2561 HydrophobicContact SD-CB 4.1Å; D2558-A2561 PolarHBondContact O-N 3.07Å
2562	R	58.1	Low	69.8	Low	117 Å²	117	75.2 Å²	75.2	44%	0.442	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.8	-15	-179	-69.5	-171.5	-173.4	-179.1	6.2	115.2	T2552 N2560 D2564	T2552-R2562 HydrophobicContact CG2-CG 3.98Å; T2552-R2562 PolarHBondContact OG1-NH2 3.31Å; N2560-R2562 PolarHBondContact O-N 3.34Å; R2562-D2564 VanDerWaalsContact C-N 3.29Å; R2562-D2564 PolarHBondContact O-N 3.03Å
2563	R	55.8	Low	70.5	Confident	209 Å²	209	73.3 Å²	73.3	79%	0.789	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-29.7	-170.7	-104.4	-179	174.2	173.9	-2.1	113.4	N2560	N2560-R2563 PolarHBondContact O-N 2.89Å
2564	D	62.2	Low	70.9	Confident	112 Å²	112	73.7 Å²	73.7	60%	0.599	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.2	26.8	-170.3	-58.5	-31.5	0	0	0	113.7	H2508 R2562	H2508-D2564 PolarHBondContact CD2-O 3.35Å; H2508-D2564 VanDerWaalsContact CD2-O 3.26Å; H2508-D2564 PolarHBondContact CE1-O 2.83Å; H2508-D2564 PolarHBondContact NE2-O 3.44Å; R2562-D2564 VanDerWaalsContact C-N 3.29Å; R2562-D2564 PolarHBondContact O-N 3.03Å
2565	Q	72.1	Confident	71.4	Confident	43 Å²	43	75.5 Å²	75.5	20%	0.201	41%	0.411	C	S	.	.			trans	-75.8	146	179.7	80.7	179	7.4	0	0	113	V2550 V2567	V2550-Q2565 HydrophobicContact CG2-CB 4.48Å; Q2565-V2567 HydrophobicContact CG-CG2 4.34Å
2566	F	84.8	Confident	72	Confident	34 Å²	34	73.9 Å²	73.9	15%	0.149	40%	0.403	C	S	.	.			trans	-64	136.9	169.2	-63.9	-71.1	0	0	0	111.3	V2480 V2506 H2508 T2533 L2535 M2547	V2480-F2566 HydrophobicContact CG1-CB 4.08Å; V2480-F2566 HydrophobicContact CG1-CD2 3.67Å; V2480-F2566 HydrophobicContact CG1-CE2 4.45Å; V2480-F2566 HydrophobicContact CG1-CG 4.09Å; V2506-F2566 HydrophobicContact CG1-CD2 4.49Å; V2506-F2566 HydrophobicContact CG1-CE2 3.87Å; V2506-F2566 HydrophobicContact CG1-CZ 3.97Å; H2508-F2566 HydrophobicContact CB-CE2 4.04Å; H2508-F2566 HydrophobicContact CB-CZ 4.1Å; T2533-F2566 WeakPolarHBondContact O-CZ 3.36Å; L2535-F2566 HydrophobicContact CB-CD1 3.82Å; L2535-F2566 HydrophobicContact CB-CE1 4.08Å; L2535-F2566 HydrophobicContact CB-CG 4.36Å; L2535-F2566 HydrophobicContact CD2-CB 4.02Å; L2535-F2566 HydrophobicContact CD2-CD1 4.4Å; L2535-F2566 HydrophobicContact CD2-CG 4.37Å; M2547-F2566 HydrophobicContact CE-CB 4.38Å
2567	V	88.6	Confident	72.4	Confident	59 Å²	59	71.1 Å²	71.1	36%	0.358	38%	0.376	S	S	.	.			trans	-122.8	120.3	178.5	-177	0	0	0	0	110	Q2565 T2569 G2591 E2592	Q2565-V2567 HydrophobicContact CG-CG2 4.34Å; V2567-T2569 HydrophobicContact CG1-CG2 3.93Å; V2567-T2569 PolarHBondContact O-N 2.92Å; V2567-G2591 WeakPolarHBondContact CG1-O 3.37Å; V2567-E2592 CarbonylContact C-O 3.55Å; V2567-E2592 WeakPolarHBondContact CA-O 3.38Å
2568	V	90.2	Very high	73.1	Confident	0 Å²	0	68.6 Å²	68.6	0%	0	37%	0.369	C	S	.	.	B	Isolated β-bridge	trans	-77.2	114.6	172.4	177.4	0	0	0	0	109.5	L2545 M2547 M2573 E2592 I2593 S2594 F2597	L2545-V2568 HydrophobicContact CD2-CG2 3.98Å; M2547-V2568 HydrophobicContact CE-CG2 3.88Å; M2547-V2568 HydrophobicContact CG-CG2 3.7Å; M2547-V2568 HydrophobicContact SD-CG2 3.6Å; M2547-V2568 VanDerWaalsContact SD-CG2 3.6Å; V2568-M2573 HydrophobicContact CG1-CG 3.77Å; V2568-M2573 HydrophobicContact CG1-SD 3.85Å; V2568-E2592 PolarHBondContact N-O 2.79Å; V2568-I2593 HydrophobicContact CB-CG1 4.3Å; V2568-S2594 WeakPolarHBondContact O-CB 3.39Å; V2568-S2594 PolarHBondContact O-N 3.44Å; V2568-F2597 HydrophobicContact CG1-CD1 4.25Å; V2568-F2597 HydrophobicContact CG1-CE1 4.43Å; V2568-F2597 HydrophobicContact CG1-CG 4.4Å
2569	T	88.6	Confident	73.6	Confident	37 Å²	37	75.3 Å²	75.3	23%	0.227	39%	0.389	C	S	.	.			trans	-118.5	159.5	174.6	77.5	0	0	0	0	111.2	V2567 E2571 L2572 M2573	V2567-T2569 HydrophobicContact CG1-CG2 3.93Å; V2567-T2569 PolarHBondContact O-N 2.92Å; T2569-E2571 WeakPolarHBondContact CB-OE2 3.24Å; T2569-E2571 PolarHBondContact O-N 3.47Å; T2569-E2571 PolarHBondContact OG1-N 2.89Å; T2569-E2571 PolarHBondContact OG1-OE2 3.17Å; T2569-L2572 PolarHBondContact O-N 3.47Å; T2569-L2572 PolarHBondContact OG1-N 2.87Å; T2569-M2573 WeakPolarHBondContact O-CG 3.43Å; T2569-M2573 PolarHBondContact O-N 3.33Å
2570	P	82.5	Confident	74.4	Confident	42 Å²	42	73.9 Å²	73.9	27%	0.273	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-34.7	174.2	-25.5	35.4	0	0	0	113.4	M2573 K2596	P2570-M2573 PolarHBondContact O-N 2.94Å; P2570-K2596 HydrophobicContact CG-CB 3.95Å
2571	E	83.6	Confident	76	Confident	121 Å²	121	69.8 Å²	69.8	57%	0.565	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-46.7	178.5	-55.7	78.5	-167.3	0	0	111.6	T2569 M2573 T2574	T2569-E2571 WeakPolarHBondContact CB-OE2 3.24Å; T2569-E2571 PolarHBondContact O-N 3.47Å; T2569-E2571 PolarHBondContact OG1-N 2.89Å; T2569-E2571 PolarHBondContact OG1-OE2 3.17Å; E2571-M2573 PolarHBondContact O-N 3.16Å; E2571-T2574 PolarHBondContact O-N 3.14Å; E2571-T2574 PolarHBondContact O-OG1 3.41Å
2572	L	85.9	Confident	77.7	Confident	21 Å²	21	70.1 Å²	70.1	11%	0.11	35%	0.354	C	S	.	.	G	3₁₀ helix	trans	-58.8	-34.5	175.8	-179.3	64.5	0	0	0	111.4	L2535 E2536 L2539 T2569 T2574 L2575	L2535-L2572 HydrophobicContact CD2-CD2 3.66Å; L2535-L2572 HydrophobicContact CG-CD2 4.14Å; E2536-L2572 HydrophobicContact CG-CD1 3.68Å; L2539-L2572 HydrophobicContact CD1-CD1 3.73Å; L2539-L2572 HydrophobicContact CD1-CD2 4.19Å; L2539-L2572 HydrophobicContact CD1-CG 3.6Å; T2569-L2572 PolarHBondContact O-N 3.47Å; T2569-L2572 PolarHBondContact OG1-N 2.87Å; L2572-T2574 PolarHBondContact O-N 3.03Å; L2572-L2575 HydrophobicContact CD1-CD1 4.37Å; L2572-L2575 PolarHBondContact O-N 3.3Å
2573	M	86.7	Confident	79.4	Confident	1 Å²	1	64.6 Å²	64.6	1%	0.005	33%	0.333	C	S	.	.	G	3₁₀ helix	trans	-75.8	-0.2	-176.5	-68.9	-67.1	-58.1	0	0	114.7	L2539 L2545 V2568 T2569 P2570 E2571 L2575 A2576 M2581 V2583 F2597 R2602	L2539-M2573 HydrophobicContact CD2-SD 4.41Å; L2545-M2573 HydrophobicContact CD2-SD 4.46Å; V2568-M2573 HydrophobicContact CG1-CG 3.77Å; V2568-M2573 HydrophobicContact CG1-SD 3.85Å; T2569-M2573 WeakPolarHBondContact O-CG 3.43Å; T2569-M2573 PolarHBondContact O-N 3.33Å; P2570-M2573 PolarHBondContact O-N 2.94Å; E2571-M2573 PolarHBondContact O-N 3.16Å; M2573-L2575 VanDerWaalsContact C-N 3.33Å; M2573-A2576 HydrophobicContact CE-CB 4.05Å; M2573-A2576 HydrophobicContact SD-CB 4.39Å; M2573-M2581 HydrophobicContact CE-CE 3.14Å; M2573-M2581 HydrophobicContact SD-CE 3.91Å; M2573-V2583 HydrophobicContact CE-CG2 3.71Å; M2573-V2583 HydrophobicContact SD-CG2 4.25Å; M2573-F2597 HydrophobicContact CB-CE2 3.99Å; M2573-F2597 HydrophobicContact CE-CE2 3.82Å; M2573-F2597 HydrophobicContact CE-CZ 3.59Å; M2573-F2597 HydrophobicContact CG-CD2 4.05Å; M2573-F2597 HydrophobicContact CG-CE2 3.56Å; M2573-F2597 HydrophobicContact CG-CZ 4.09Å; M2573-F2597 HydrophobicContact SD-CE2 4.34Å; M2573-F2597 HydrophobicContact SD-CZ 4.29Å; M2573-R2602 PolarHBondContact O-NH1 2.88Å; M2573-R2602 PolarHBondContact O-NH2 3.17Å
2574	T	82.1	Confident	81.3	Confident	114 Å²	114	54.6 Å²	54.6	70%	0.699	30%	0.295	S	S	*	.	G	3₁₀ helix	trans	-76.3	-21.8	167.6	62.1	0	0	0	0	112.6	E2571 L2572 A2576	E2571-T2574 PolarHBondContact O-N 3.14Å; E2571-T2574 PolarHBondContact O-OG1 3.41Å; L2572-T2574 PolarHBondContact O-N 3.03Å; T2574-A2576 VanDerWaalsContact C-N 3.3Å
2575	L	84.2	Confident	82.9	Confident	90 Å²	90	49.3 Å²	49.3	47%	0.471	27%	0.267	S	S	.	.	S	Bend	trans	-78.4	-15.7	174.5	-60.2	175.6	0	0	0	112.8	E2536 L2539 L2572 M2573	E2536-L2575 HydrophobicContact CB-CD1 4.2Å; E2536-L2575 HydrophobicContact CG-CD1 4.26Å; L2539-L2575 HydrophobicContact CD1-CB 4.46Å; L2572-L2575 HydrophobicContact CD1-CD1 4.37Å; L2572-L2575 PolarHBondContact O-N 3.3Å; M2573-L2575 VanDerWaalsContact C-N 3.33Å
2576	A	82.6	Confident	83.7	Confident	6 Å²	6	48.1 Å²	48.1	5%	0.05	26%	0.263	C	S	.	.	S	Bend	trans	-79	161	-179	0	0	0	0	0	112.4	L2539 M2573 T2574 M2581	L2539-A2576 HydrophobicContact CB-CB 4.33Å; L2539-A2576 HydrophobicContact CD2-CB 4.31Å; M2573-A2576 HydrophobicContact CE-CB 4.05Å; M2573-A2576 HydrophobicContact SD-CB 4.39Å; T2574-A2576 VanDerWaalsContact C-N 3.3Å; A2576-M2581 HydrophobicContact CB-CE 3.94Å; A2576-M2581 HydrophobicContact CB-SD 3.7Å
2577	K	70.8	Confident	84	Confident	66 Å²	66	48.9 Å²	48.9	29%	0.287	27%	0.268	S	S	.	.			trans	-52.6	125.7	171.8	-67.9	-175.3	-174.5	169.5	0	110.1	P2540 D2543 R2579 M2581	P2540-K2577 WeakPolarHBondContact O-CE 3.44Å; P2540-K2577 WeakPolarHBondContact O-CG 3.37Å; D2543-K2577 IonicContact OD1-NZ 3.99Å; D2543-K2577 PolarHBondContact OD1-NZ 3.09Å; K2577-R2579 PolarHBondContact O-N 3.4Å; K2577-M2581 HydrophobicContact CB-CB 4.34Å
2578	P	62.3	Low	84	Confident	119 Å²	119	49.6 Å²	49.6	77%	0.773	27%	0.274	S	S	*	.	S	Bend	trans	-67.2	-20.7	-175.7	21.4	-30.3	0	0	0	113.2
2579	R	62	Low	83.7	Confident	214 Å²	214	52.6 Å²	52.6	81%	0.808	29%	0.286	S	S	*	.	S	Bend	trans	-145.4	150.1	173.2	-69	-172.6	177.9	169	2.9	111.2	K2577	K2577-R2579 PolarHBondContact O-N 3.4Å
2580	G	69.3	Low	83.4	Confident	54 Å²	54	54.3 Å²	54.3	56%	0.557	30%	0.296	S	S	*	.	S	Bend	trans	91.6	-10.5	178	0	0	0	0	0	114.8
2581	M	87.7	Confident	83.4	Confident	4 Å²	4	54 Å²	54	2%	0.02	30%	0.301	C	S	.	.			trans	-91.7	143.4	173.8	-165.2	-172.5	102	0	0	111.9	L2539 T2542 D2543 L2545 M2573 A2576 K2577 V2583 R2602	L2539-M2581 HydrophobicContact CD2-CE 4.47Å; T2542-M2581 HydrophobicContact CG2-SD 4.24Å; T2542-M2581 VanDerWaalsContact O-CG 3.31Å; T2542-M2581 WeakPolarHBondContact O-CG 3.29Å; D2543-M2581 CarbonylContact O-C 3.38Å; D2543-M2581 WeakPolarHBondContact O-CA 3.3Å; D2543-M2581 WeakPolarHBondContact O-CG 3.48Å; L2545-M2581 HydrophobicContact CB-CE 4.09Å; L2545-M2581 HydrophobicContact CD2-CE 4.39Å; M2573-M2581 HydrophobicContact CE-CE 3.14Å; M2573-M2581 HydrophobicContact SD-CE 3.91Å; A2576-M2581 HydrophobicContact CB-CE 3.94Å; A2576-M2581 HydrophobicContact CB-SD 3.7Å; K2577-M2581 HydrophobicContact CB-CB 4.34Å; M2581-V2583 HydrophobicContact CE-CG2 3.7Å; M2581-R2602 VanDerWaalsContact O-CG 3.31Å; M2581-R2602 WeakPolarHBondContact O-CG 3.3Å
2582	I	91.5	Very high	83.7	Confident	10 Å²	10	48.4 Å²	48.4	5%	0.051	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	152.6	169	67.5	-178.5	0	0	0	111.9	I2465 E2468 I2469 D2543 V2544 L2545 M2584 R2602 A2604	I2465-I2582 HydrophobicContact CG1-CD1 4.36Å; E2468-I2582 HydrophobicContact CB-CD1 3.9Å; E2468-I2582 HydrophobicContact CB-CG2 4.01Å; E2468-I2582 HydrophobicContact CG-CD1 4.42Å; I2469-I2582 HydrophobicContact CD1-CD1 3.91Å; I2469-I2582 HydrophobicContact CD1-CG1 3.96Å; I2469-I2582 HydrophobicContact CD1-CG2 4.46Å; I2469-I2582 HydrophobicContact CG1-CD1 4.13Å; I2469-I2582 HydrophobicContact CG1-CG1 4.44Å; I2469-I2582 HydrophobicContact CG1-CG2 4.16Å; D2543-I2582 PolarHBondContact O-N 3.4Å; V2544-I2582 HydrophobicContact CB-CG1 4.42Å; V2544-I2582 HydrophobicContact CG1-CD1 4.47Å; V2544-I2582 HydrophobicContact CG1-CG1 4.12Å; V2544-I2582 HydrophobicContact CG2-CD1 4.29Å; V2544-I2582 HydrophobicContact CG2-CG1 4.08Å; L2545-I2582 PolarHBondContact N-O 3.08Å; I2582-M2584 HydrophobicContact CD1-CG 4.15Å; I2582-M2584 HydrophobicContact CD1-SD 3.74Å; I2582-M2584 HydrophobicContact CG1-CG 4.26Å; I2582-M2584 HydrophobicContact CG1-SD 4.29Å; I2582-R2602 CarbonylContact C-O 3.6Å; I2582-R2602 WeakPolarHBondContact CA-O 3.46Å; I2582-A2604 HydrophobicContact CB-CB 4.28Å
2583	V	94.3	Very high	84	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	123.8	175.2	-176	0	0	0	0	109.4	L2545 M2573 M2581 I2593 F2597 R2602 A2604	L2545-V2583 HydrophobicContact CB-CG2 4.35Å; L2545-V2583 HydrophobicContact CD2-CG1 4.41Å; L2545-V2583 HydrophobicContact CD2-CG2 4.26Å; L2545-V2583 CarbonylContact O-C 3.54Å; L2545-V2583 WeakPolarHBondContact O-CA 3.49Å; M2573-V2583 HydrophobicContact CE-CG2 3.71Å; M2573-V2583 HydrophobicContact SD-CG2 4.25Å; M2581-V2583 HydrophobicContact CE-CG2 3.7Å; V2583-I2593 HydrophobicContact CG1-CD1 4.47Å; V2583-F2597 HydrophobicContact CB-CE1 3.79Å; V2583-F2597 HydrophobicContact CB-CZ 4.34Å; V2583-F2597 HydrophobicContact CG1-CE1 4.12Å; V2583-F2597 HydrophobicContact CG2-CE1 3.62Å; V2583-F2597 HydrophobicContact CG2-CZ 3.68Å; V2583-R2602 PolarHBondContact N-O 3.19Å; V2583-A2604 PolarHBondContact O-N 3.35Å
2584	M	96.3	Very high	84	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	153.9	-175.2	-67.1	177.4	62.4	0	0	111.4	D2461 T2464 I2465 V2544 L2545 Y2546 M2547 I2582 A2604 Q2608	D2461-M2584 HydrophobicContact CB-CE 3.86Å; D2461-M2584 WeakPolarHBondContact O-CE 3.41Å; T2464-M2584 HydrophobicContact CG2-CE 3.88Å; T2464-M2584 HydrophobicContact CG2-SD 4.19Å; I2465-M2584 HydrophobicContact CD1-SD 4.35Å; I2465-M2584 HydrophobicContact CG1-CE 4.26Å; I2465-M2584 HydrophobicContact CG1-SD 3.64Å; V2544-M2584 HydrophobicContact CG1-CG 4.43Å; V2544-M2584 HydrophobicContact CG1-SD 3.73Å; L2545-M2584 PolarHBondContact O-N 3.39Å; Y2546-M2584 HydrophobicContact CD2-CB 3.78Å; Y2546-M2584 HydrophobicContact CD2-CE 4.31Å; Y2546-M2584 HydrophobicContact CE2-CB 4.29Å; Y2546-M2584 HydrophobicContact CE2-CE 4.26Å; M2547-M2584 PolarHBondContact N-O 2.98Å; I2582-M2584 HydrophobicContact CD1-CG 4.15Å; I2582-M2584 HydrophobicContact CD1-SD 3.74Å; I2582-M2584 HydrophobicContact CG1-CG 4.26Å; I2582-M2584 HydrophobicContact CG1-SD 4.29Å; M2584-A2604 HydrophobicContact CG-CB 4.3Å; M2584-Q2608 HydrophobicContact CE-CG 4.13Å
2585	H	94.6	Very high	84.3	Confident	1 Å²	1	47.3 Å²	47.3	1%	0.005	27%	0.271	C	S	.	.			trans	-157.9	132	-177.4	-167.9	-92.1	0	0	0	112.4	R2376 M2547 L2587 P2588 E2592 I2593 Y2605 Q2608	R2376-H2585 PolarHBondContact NH2-O 2.96Å; M2547-H2585 VanDerWaalsContact C-CD2 3.49Å; M2547-H2585 PolarHBondContact O-CD2 3.15Å; H2585-L2587 VanDerWaalsContact C-N 3.28Å; H2585-L2587 PolarHBondContact CE1-N 2.85Å; H2585-L2587 WeakPolarHBondContact ND1-CA 3.12Å; H2585-L2587 PolarHBondContact ND1-N 3.35Å; H2585-L2587 PolarHBondContact O-N 3.13Å; H2585-P2588 PolarHBondContact CE1-O 2.79Å; H2585-E2592 IonicContact CD2-OE1 3.67Å; H2585-E2592 IonicContact CE1-OE1 2.63Å; H2585-E2592 PolarHBondContact CE1-OE1 3.42Å; H2585-E2592 IonicContact NE2-OE1 3.78Å; H2585-E2592 PolarHBondContact NE2-OE1 3.16Å; H2585-I2593 HydrophobicContact CB-CD1 3.72Å; H2585-Y2605 HydrophobicContact CB-CG 4.32Å; H2585-Q2608 PolarHBondContact O-OE1 3.42Å; H2585-Q2608 VanDerWaalsContact O-OE1 3.05Å
2586	P	89.7	Confident	84.3	Confident	17 Å²	17	50.5 Å²	50.5	11%	0.11	28%	0.281	C	S	.	.			trans	-71.3	-17	-177.1	27.5	-33	0	0	0	114.3	R2376 T2488 Y2546 M2547 T2548	R2376-P2586 VanDerWaalsContact CZ-O 3.31Å; R2376-P2586 PolarHBondContact NE-O 3.39Å; R2376-P2586 PolarHBondContact NH2-O 3.2Å; T2488-P2586 HydrophobicContact CG2-CB 4.13Å; Y2546-P2586 HydrophobicContact CE1-CG 4.33Å; M2547-P2586 WeakPolarHBondContact O-CD 3.37Å; T2548-P2586 HydrophobicContact CG2-CG 4.43Å
2587	L	90.2	Very high	84.6	Confident	50 Å²	50	50.3 Å²	50.3	26%	0.262	28%	0.279	S	S	.	.	S	Bend	trans	58.4	158.2	-174.6	-66.7	175	0	0	0	113.9	H2585 R2589 F2606	H2585-L2587 VanDerWaalsContact C-N 3.28Å; H2585-L2587 PolarHBondContact CE1-N 2.85Å; H2585-L2587 WeakPolarHBondContact ND1-CA 3.12Å; H2585-L2587 PolarHBondContact ND1-N 3.35Å; H2585-L2587 PolarHBondContact O-N 3.13Å; L2587-R2589 HydrophobicContact CD2-CB 3.91Å; L2587-R2589 HydrophobicContact CD2-CG 3.98Å; L2587-F2606 HydrophobicContact CD1-CE1 4.37Å
2588	P	88	Confident	85.5	Confident	75 Å²	75	50 Å²	50	49%	0.487	28%	0.281	S	S	.	.			cis	-66.7	148.6	-3.5	30.7	-36.2	0	0	0	112.4	H2585	H2585-P2588 PolarHBondContact CE1-O 2.79Å
2589	R	85.3	Confident	86.3	Confident	63 Å²	63	49.8 Å²	49.8	24%	0.238	28%	0.282	C	S	.	.			trans	-90	139.1	169.2	68.1	174.3	-178.5	-168.1	-4.6	110.1	L2587 E2592 D2598	L2587-R2589 HydrophobicContact CD2-CB 3.91Å; L2587-R2589 HydrophobicContact CD2-CG 3.98Å; R2589-E2592 VanDerWaalsContact CA-OE1 3.26Å; R2589-E2592 WeakPolarHBondContact CA-OE1 3.47Å; R2589-D2598 IonicContact CZ-OD1 2.75Å; R2589-D2598 IonicContact CZ-OD2 2.78Å; R2589-D2598 IonicContact NH1-OD1 3.77Å; R2589-D2598 PolarHBondContact NH1-OD1 3Å; R2589-D2598 IonicContact NH1-OD2 3.44Å; R2589-D2598 IonicContact NH2-OD1 3.25Å; R2589-D2598 PolarHBondContact NH2-OD1 3.05Å; R2589-D2598 IonicContact NH2-OD2 2.75Å; R2589-D2598 PolarHBondContact NH2-OD2 2.8Å
2590	V	82.7	Confident	87.3	Confident	72 Å²	72	41.1 Å²	41.1	44%	0.436	25%	0.251	S	S	.	.	S	Bend	trans	-130.5	6.8	-175.1	-168.3	0	0	0	0	112.7	R2549 E2592	R2549-V2590 VanDerWaalsContact CD-CG2 3.41Å; R2549-V2590 HydrophobicContact CG-CB 4.43Å; R2549-V2590 HydrophobicContact CG-CG2 4.19Å; V2590-E2592 PolarHBondContact N-OE1 3.08Å; V2590-E2592 PolarHBondContact N-OE2 3.06Å
2591	G	82.4	Confident	87.5	Confident	37 Å²	37	43.6 Å²	43.6	38%	0.381	26%	0.258	S	S	.	.	S	Bend	trans	151.8	-10.9	169.3	0	0	0	0	0	115	V2567 I2593	V2567-G2591 WeakPolarHBondContact CG1-O 3.37Å; G2591-I2593 VanDerWaalsContact C-N 3.29Å; G2591-I2593 PolarHBondContact O-N 2.82Å
2592	E	89	Confident	87.4	Confident	2 Å²	2	45.2 Å²	45.2	1%	0.009	26%	0.264	C	S	.	.	S	Bend	trans	-73.1	-16	-175.8	65.7	-82.8	-158.9	0	0	113.7	M2547 R2549 V2567 V2568 H2585 R2589 V2590	M2547-E2592 HydrophobicContact CE-CB 4.11Å; M2547-E2592 WeakPolarHBondContact CE-O 3.42Å; R2549-E2592 WeakPolarHBondContact CB-OE1 3.38Å; V2567-E2592 CarbonylContact C-O 3.55Å; V2567-E2592 WeakPolarHBondContact CA-O 3.38Å; V2568-E2592 PolarHBondContact N-O 2.79Å; H2585-E2592 IonicContact CD2-OE1 3.67Å; H2585-E2592 IonicContact CE1-OE1 2.63Å; H2585-E2592 PolarHBondContact CE1-OE1 3.42Å; H2585-E2592 IonicContact NE2-OE1 3.78Å; H2585-E2592 PolarHBondContact NE2-OE1 3.16Å; R2589-E2592 VanDerWaalsContact CA-OE1 3.26Å; R2589-E2592 WeakPolarHBondContact CA-OE1 3.47Å; V2590-E2592 PolarHBondContact N-OE1 3.08Å; V2590-E2592 PolarHBondContact N-OE2 3.06Å
2593	I	91.6	Very high	87.4	Confident	2 Å²	2	45 Å²	45	1%	0.01	26%	0.264	C	S	.	.	B	Isolated β-bridge	trans	-130	120.9	170.8	-61	171.4	0	0	0	107.4	M2547 V2568 V2583 H2585 G2591 F2597 Y2605	M2547-I2593 HydrophobicContact CB-CD1 4.07Å; M2547-I2593 HydrophobicContact CB-CG1 4.28Å; M2547-I2593 HydrophobicContact CG-CD1 4.35Å; M2547-I2593 HydrophobicContact CG-CG1 4.27Å; V2568-I2593 HydrophobicContact CB-CG1 4.3Å; V2583-I2593 HydrophobicContact CG1-CD1 4.47Å; H2585-I2593 HydrophobicContact CB-CD1 3.72Å; G2591-I2593 VanDerWaalsContact C-N 3.29Å; G2591-I2593 PolarHBondContact O-N 2.82Å; I2593-F2597 HydrophobicContact CG2-CB 4.49Å; I2593-F2597 HydrophobicContact CG2-CD1 4.27Å; I2593-Y2605 HydrophobicContact CD1-CD1 4.21Å; I2593-Y2605 HydrophobicContact CD1-CE1 4.29Å; I2593-Y2605 HydrophobicContact CG2-CE1 4.22Å
2594	S	88.6	Confident	87.3	Confident	24 Å²	24	45 Å²	45	17%	0.168	26%	0.264	C	S	.	.			trans	-63	131.3	175.8	179.4	0	0	0	0	110.7	V2568 K2596 F2597	V2568-S2594 WeakPolarHBondContact O-CB 3.39Å; V2568-S2594 PolarHBondContact O-N 3.44Å; S2594-K2596 PolarHBondContact O-N 2.85Å; S2594-K2596 VanDerWaalsContact O-N 3.09Å; S2594-K2596 PolarHBondContact OG-N 2.78Å; S2594-F2597 WeakPolarHBondContact O-CB 3.27Å; S2594-F2597 PolarHBondContact O-N 3.17Å
2595	P	86.3	Confident	87.1	Confident	87 Å²	87	45.1 Å²	45.1	57%	0.565	26%	0.264	S	S	*	.	G	3₁₀ helix	trans	-56.4	-25.1	173.5	-25.5	34.4	0	0	0	113.5	F2597 D2598	P2595-F2597 PolarHBondContact O-N 3.02Å; P2595-F2597 VanDerWaalsContact O-N 3.1Å; P2595-D2598 WeakPolarHBondContact O-CB 3.44Å; P2595-D2598 VanDerWaalsContact O-CG 3.26Å; P2595-D2598 PolarHBondContact O-N 2.83Å; P2595-D2598 VanDerWaalsContact O-N 3.08Å
2596	K	85.1	Confident	87	Confident	158 Å²	158	50.2 Å²	50.2	69%	0.687	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	-61.5	-17.6	175.5	-63.4	-174.5	178.8	-179.2	0	113.3	P2570 S2594	P2570-K2596 HydrophobicContact CG-CB 3.95Å; S2594-K2596 PolarHBondContact O-N 2.85Å; S2594-K2596 VanDerWaalsContact O-N 3.09Å; S2594-K2596 PolarHBondContact OG-N 2.78Å
2597	F	89.6	Confident	87	Confident	2 Å²	2	53.2 Å²	53.2	1%	0.009	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-85.7	-8.1	178.2	-172.3	-109.2	0	0	0	113.3	V2568 M2573 V2583 I2593 S2594 P2595 S2599 D2600 R2602 A2603 Y2605	V2568-F2597 HydrophobicContact CG1-CD1 4.25Å; V2568-F2597 HydrophobicContact CG1-CE1 4.43Å; V2568-F2597 HydrophobicContact CG1-CG 4.4Å; M2573-F2597 HydrophobicContact CB-CE2 3.99Å; M2573-F2597 HydrophobicContact CE-CE2 3.82Å; M2573-F2597 HydrophobicContact CE-CZ 3.59Å; M2573-F2597 HydrophobicContact CG-CD2 4.05Å; M2573-F2597 HydrophobicContact CG-CE2 3.56Å; M2573-F2597 HydrophobicContact CG-CZ 4.09Å; M2573-F2597 HydrophobicContact SD-CE2 4.34Å; M2573-F2597 HydrophobicContact SD-CZ 4.29Å; V2583-F2597 HydrophobicContact CB-CE1 3.79Å; V2583-F2597 HydrophobicContact CB-CZ 4.34Å; V2583-F2597 HydrophobicContact CG1-CE1 4.12Å; V2583-F2597 HydrophobicContact CG2-CE1 3.62Å; V2583-F2597 HydrophobicContact CG2-CZ 3.68Å; I2593-F2597 HydrophobicContact CG2-CB 4.49Å; I2593-F2597 HydrophobicContact CG2-CD1 4.27Å; S2594-F2597 WeakPolarHBondContact O-CB 3.27Å; S2594-F2597 PolarHBondContact O-N 3.17Å; P2595-F2597 PolarHBondContact O-N 3.02Å; P2595-F2597 VanDerWaalsContact O-N 3.1Å; F2597-S2599 PolarHBondContact O-N 3.28Å; F2597-D2600 HydrophobicContact CD2-CB 3.66Å; F2597-D2600 HydrophobicContact CE1-CB 4.43Å; F2597-D2600 HydrophobicContact CE2-CB 3.39Å; F2597-D2600 WeakPolarHBondContact CE2-OD2 3.36Å; F2597-D2600 HydrophobicContact CG-CB 4.28Å; F2597-D2600 HydrophobicContact CZ-CB 3.82Å; F2597-D2600 VanDerWaalsContact O-CB 3.32Å; F2597-D2600 WeakPolarHBondContact O-CB 3.34Å; F2597-D2600 PolarHBondContact O-N 3.3Å; F2597-R2602 HydrophobicContact CZ-CB 4.17Å; F2597-A2603 HydrophobicContact CD1-CB 4.08Å; F2597-A2603 HydrophobicContact CE1-CB 3.86Å; F2597-Y2605 HydrophobicContact CD1-CE1 4.2Å; F2597-Y2605 HydrophobicContact CE1-CE1 4.39Å
2598	D	88.4	Confident	87.1	Confident	59 Å²	59	50.9 Å²	50.9	32%	0.316	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-30.3	-175.3	-73.8	-22.3	0	0	0	113.9	R2589 P2595 D2600 Y2605	R2589-D2598 IonicContact CZ-OD1 2.75Å; R2589-D2598 IonicContact CZ-OD2 2.78Å; R2589-D2598 IonicContact NH1-OD1 3.77Å; R2589-D2598 PolarHBondContact NH1-OD1 3Å; R2589-D2598 IonicContact NH1-OD2 3.44Å; R2589-D2598 IonicContact NH2-OD1 3.25Å; R2589-D2598 PolarHBondContact NH2-OD1 3.05Å; R2589-D2598 IonicContact NH2-OD2 2.75Å; R2589-D2598 PolarHBondContact NH2-OD2 2.8Å; P2595-D2598 WeakPolarHBondContact O-CB 3.44Å; P2595-D2598 VanDerWaalsContact O-CG 3.26Å; P2595-D2598 PolarHBondContact O-N 2.83Å; P2595-D2598 VanDerWaalsContact O-N 3.08Å; D2598-D2600 VanDerWaalsContact C-N 3.32Å; D2598-Y2605 WeakPolarHBondContact CA-OH 3.47Å; D2598-Y2605 WeakPolarHBondContact OD1-CE2 3.42Å; D2598-Y2605 PolarHBondContact OD1-OH 3.18Å
2599	S	78.9	Confident	87.2	Confident	114 Å²	114	48.4 Å²	48.4	80%	0.797	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-8.8	179.2	56.2	0	0	0	0	113.8	F2597	F2597-S2599 PolarHBondContact O-N 3.28Å
2600	D	83.5	Confident	87.4	Confident	32 Å²	32	50.3 Å²	50.3	17%	0.171	28%	0.281	C	S	.	.	S	Bend	trans	-73.3	130.8	178.8	-168.3	-61.4	0	0	0	110	F2597 D2598 R2602 A2603	F2597-D2600 HydrophobicContact CD2-CB 3.66Å; F2597-D2600 HydrophobicContact CE1-CB 4.43Å; F2597-D2600 HydrophobicContact CE2-CB 3.39Å; F2597-D2600 WeakPolarHBondContact CE2-OD2 3.36Å; F2597-D2600 HydrophobicContact CG-CB 4.28Å; F2597-D2600 HydrophobicContact CZ-CB 3.82Å; F2597-D2600 VanDerWaalsContact O-CB 3.32Å; F2597-D2600 WeakPolarHBondContact O-CB 3.34Å; F2597-D2600 PolarHBondContact O-N 3.3Å; D2598-D2600 VanDerWaalsContact C-N 3.32Å; D2600-R2602 PolarHBondContact O-N 2.84Å; D2600-R2602 VanDerWaalsContact O-N 3.09Å; D2600-R2602 WeakPolarHBondContact OD1-CB 3.46Å; D2600-R2602 VanDerWaalsContact OD1-CG 3.25Å; D2600-R2602 WeakPolarHBondContact OD1-CG 3.49Å; D2600-R2602 IonicContact OD1-CZ 2.64Å; D2600-R2602 PolarHBondContact OD1-N 3.11Å; D2600-R2602 IonicContact OD1-NE 2.87Å; D2600-R2602 PolarHBondContact OD1-NE 2.69Å; D2600-R2602 IonicContact OD1-NH2 3.89Å; D2600-R2602 IonicContact OD2-CZ 3.96Å; D2600-R2602 IonicContact OD2-NE 3.09Å; D2600-R2602 PolarHBondContact OD2-NE 3.09Å; D2600-R2602 IonicContact OD2-NH2 2.65Å; D2600-R2602 PolarHBondContact OD2-NH2 3.37Å; D2600-A2603 WeakPolarHBondContact O-CB 3.43Å; D2600-A2603 PolarHBondContact O-N 3.48Å
2601	P	74.8	Confident	87.9	Confident	106 Å²	106	47.7 Å²	47.7	69%	0.688	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-24.2	-179.2	22.7	-33.3	0	0	0	113.7	A2603 R2607	P2601-A2603 PolarHBondContact O-N 3.2Å; P2601-R2607 PolarHBondContact O-NH2 3.42Å
2602	R	85.4	Confident	88.3	Confident	38 Å²	38	46 Å²	46	14%	0.143	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-19.5	175.9	-57.5	173.8	-75.8	-174.7	-1.4	111.9	M2573 M2581 I2582 V2583 F2597 D2600 A2604	M2573-R2602 PolarHBondContact O-NH1 2.88Å; M2573-R2602 PolarHBondContact O-NH2 3.17Å; M2581-R2602 VanDerWaalsContact O-CG 3.31Å; M2581-R2602 WeakPolarHBondContact O-CG 3.3Å; I2582-R2602 CarbonylContact C-O 3.6Å; I2582-R2602 WeakPolarHBondContact CA-O 3.46Å; V2583-R2602 PolarHBondContact N-O 3.19Å; F2597-R2602 HydrophobicContact CZ-CB 4.17Å; D2600-R2602 PolarHBondContact O-N 2.84Å; D2600-R2602 VanDerWaalsContact O-N 3.09Å; D2600-R2602 WeakPolarHBondContact OD1-CB 3.46Å; D2600-R2602 VanDerWaalsContact OD1-CG 3.25Å; D2600-R2602 WeakPolarHBondContact OD1-CG 3.49Å; D2600-R2602 IonicContact OD1-CZ 2.64Å; D2600-R2602 PolarHBondContact OD1-N 3.11Å; D2600-R2602 IonicContact OD1-NE 2.87Å; D2600-R2602 PolarHBondContact OD1-NE 2.69Å; D2600-R2602 IonicContact OD1-NH2 3.89Å; D2600-R2602 IonicContact OD2-CZ 3.96Å; D2600-R2602 IonicContact OD2-NE 3.09Å; D2600-R2602 PolarHBondContact OD2-NE 3.09Å; D2600-R2602 IonicContact OD2-NH2 2.65Å; D2600-R2602 PolarHBondContact OD2-NH2 3.37Å; R2602-A2604 PolarHBondContact O-N 3.34Å
2603	A	90.9	Very high	88.5	Confident	7 Å²	7	46.9 Å²	46.9	6%	0.058	25%	0.251	C	S	.	.	B	Isolated β-bridge	trans	-68	100.9	175.4	0	0	0	0	0	111	F2597 D2600 P2601 Y2605 R2607	F2597-A2603 HydrophobicContact CD1-CB 4.08Å; F2597-A2603 HydrophobicContact CE1-CB 3.86Å; D2600-A2603 WeakPolarHBondContact O-CB 3.43Å; D2600-A2603 PolarHBondContact O-N 3.48Å; P2601-A2603 PolarHBondContact O-N 3.2Å; A2603-Y2605 HydrophobicContact CB-CD1 4.35Å; A2603-Y2605 HydrophobicContact CB-CE1 3.5Å; A2603-Y2605 VanDerWaalsContact CB-CE1 3.5Å; A2603-Y2605 WeakPolarHBondContact CB-OH 3.36Å; A2603-R2607 PolarHBondContact O-NH1 2.68Å; A2603-R2607 PolarHBondContact O-NH2 3.09Å
2604	A	91.3	Very high	88.6	Confident	0 Å²	0	47 Å²	47	0%	0	25%	0.251	C	S	.	.			trans	-102.6	-9	-176.7	0	0	0	0	0	113.5	T2464 E2468 I2582 V2583 M2584 R2602 F2606 R2607 Q2608	T2464-A2604 HydrophobicContact CG2-CB 4.45Å; E2468-A2604 HydrophobicContact CG-CB 4.34Å; I2582-A2604 HydrophobicContact CB-CB 4.28Å; V2583-A2604 PolarHBondContact O-N 3.35Å; M2584-A2604 HydrophobicContact CG-CB 4.3Å; R2602-A2604 PolarHBondContact O-N 3.34Å; A2604-F2606 VanDerWaalsContact C-N 3.34Å; A2604-F2606 PolarHBondContact O-N 3.16Å; A2604-R2607 CarbonylContact O-C 3.48Å; A2604-R2607 PolarHBondContact O-N 3.29Å; A2604-Q2608 WeakPolarHBondContact O-CB 3.48Å; A2604-Q2608 PolarHBondContact O-N 3.31Å
2605	Y	93.3	Very high	88.9	Confident	1 Å²	1	45.9 Å²	45.9	0%	0.004	24%	0.244	C	C	.	.	H	α-helix	trans	-63	-26.7	-168.9	40.3	-94.4	0	0	0	116.4	R2376 H2585 I2593 F2597 D2598 A2603 A2609	R2376-Y2605 PolarHBondContact NH1-O 3.27Å; R2376-Y2605 VanDerWaalsContact NH1-O 3.13Å; H2585-Y2605 HydrophobicContact CB-CG 4.32Å; I2593-Y2605 HydrophobicContact CD1-CD1 4.21Å; I2593-Y2605 HydrophobicContact CD1-CE1 4.29Å; I2593-Y2605 HydrophobicContact CG2-CE1 4.22Å; F2597-Y2605 HydrophobicContact CD1-CE1 4.2Å; F2597-Y2605 HydrophobicContact CE1-CE1 4.39Å; D2598-Y2605 WeakPolarHBondContact CA-OH 3.47Å; D2598-Y2605 WeakPolarHBondContact OD1-CE2 3.42Å; D2598-Y2605 PolarHBondContact OD1-OH 3.18Å; A2603-Y2605 HydrophobicContact CB-CD1 4.35Å; A2603-Y2605 HydrophobicContact CB-CE1 3.5Å; A2603-Y2605 VanDerWaalsContact CB-CE1 3.5Å; A2603-Y2605 WeakPolarHBondContact CB-OH 3.36Å; Y2605-A2609 PolarHBondContact O-N 3.04Å
2606	F	91.1	Very high	89.3	Confident	109 Å²	109	41.8 Å²	41.8	48%	0.478	22%	0.217	S	C	.	.	H	α-helix	trans	-79.6	-39.4	170.9	-68.9	-59.4	0	0	0	112.3	L2587 A2604 Q2608 A2609 E2610	L2587-F2606 HydrophobicContact CD1-CE1 4.37Å; A2604-F2606 VanDerWaalsContact C-N 3.34Å; A2604-F2606 PolarHBondContact O-N 3.16Å; F2606-Q2608 VanDerWaalsContact C-N 3.33Å; F2606-Q2608 PolarHBondContact O-N 3.25Å; F2606-A2609 WeakPolarHBondContact O-CA 3.36Å; F2606-A2609 WeakPolarHBondContact O-CB 3.37Å; F2606-A2609 PolarHBondContact O-N 3.01Å; F2606-E2610 PolarHBondContact O-N 3.4Å
2607	R	90	Very high	89.8	Confident	80 Å²	80	34.3 Å²	34.3	30%	0.302	19%	0.185	S	C	.	.	H	α-helix	trans	-63.8	-39.9	172.6	-63	-167.6	-66	-80.5	6.3	111.3	E2468 P2601 A2603 A2604 A2609 E2610 Y2611	E2468-R2607 VanDerWaalsContact CD-NE 3.34Å; E2468-R2607 IonicContact OE1-NE 2.8Å; E2468-R2607 PolarHBondContact OE1-NE 2.97Å; E2468-R2607 IonicContact OE2-CZ 2.67Å; E2468-R2607 VanDerWaalsContact OE2-CZ 3.3Å; E2468-R2607 IonicContact OE2-NE 3.61Å; E2468-R2607 PolarHBondContact OE2-NE 2.93Å; E2468-R2607 IonicContact OE2-NH2 3.4Å; E2468-R2607 PolarHBondContact OE2-NH2 2.93Å; P2601-R2607 PolarHBondContact O-NH2 3.42Å; A2603-R2607 PolarHBondContact O-NH1 2.68Å; A2603-R2607 PolarHBondContact O-NH2 3.09Å; A2604-R2607 CarbonylContact O-C 3.48Å; A2604-R2607 PolarHBondContact O-N 3.29Å; R2607-A2609 PolarHBondContact O-N 2.97Å; R2607-E2610 WeakPolarHBondContact O-CB 3.47Å; R2607-E2610 PolarHBondContact O-N 3.42Å; R2607-E2610 VanDerWaalsContact O-N 3.1Å; R2607-Y2611 HydrophobicContact CB-CE2 4.09Å; R2607-Y2611 WeakPolarHBondContact O-CD2 3.12Å; R2607-Y2611 PolarHBondContact O-N 3.44Å
2608	Q	93.3	Very high	90	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-52.9	-37.9	168.4	-175.4	-174.8	10.1	0	0	111.5	L2460 D2461 T2464 M2584 H2585 A2604 F2606 G2612	L2460-Q2608 HydrophobicContact CD1-CG 3.6Å; L2460-Q2608 VanDerWaalsContact CD1-O 3.23Å; L2460-Q2608 WeakPolarHBondContact CD1-O 3.45Å; D2461-Q2608 PolarHBondContact OD1-NE2 2.63Å; T2464-Q2608 HydrophobicContact CG2-CB 3.97Å; T2464-Q2608 HydrophobicContact CG2-CG 4.31Å; M2584-Q2608 HydrophobicContact CE-CG 4.13Å; H2585-Q2608 PolarHBondContact O-OE1 3.42Å; H2585-Q2608 VanDerWaalsContact O-OE1 3.05Å; A2604-Q2608 WeakPolarHBondContact O-CB 3.48Å; A2604-Q2608 PolarHBondContact O-N 3.31Å; F2606-Q2608 VanDerWaalsContact C-N 3.33Å; F2606-Q2608 PolarHBondContact O-N 3.25Å; Q2608-G2612 PolarHBondContact O-N 3.1Å
2609	A	89.2	Confident	90.3	Very high	24 Å²	24	31.4 Å²	31.4	20%	0.198	17%	0.169	C	C	.	.	H	α-helix	trans	-64.2	-47.4	175.6	0	0	0	0	0	112.6	R2376 Y2605 F2606 R2607 G2612	R2376-A2609 HydrophobicContact CG-CB 4.34Å; Y2605-A2609 PolarHBondContact O-N 3.04Å; F2606-A2609 WeakPolarHBondContact O-CA 3.36Å; F2606-A2609 WeakPolarHBondContact O-CB 3.37Å; F2606-A2609 PolarHBondContact O-N 3.01Å; R2607-A2609 PolarHBondContact O-N 2.97Å; A2609-G2612 PolarHBondContact O-N 3.3Å
2610	E	90.1	Very high	91.1	Very high	102 Å²	102	26 Å²	26	48%	0.477	13%	0.131	S	C	.	.	H	α-helix	trans	-62	-47.6	179.6	-173.2	-175.5	172.3	0	0	110.8	F2606 R2607 G2612 T2613	F2606-E2610 PolarHBondContact O-N 3.4Å; R2607-E2610 WeakPolarHBondContact O-CB 3.47Å; R2607-E2610 PolarHBondContact O-N 3.42Å; R2607-E2610 VanDerWaalsContact O-N 3.1Å; E2610-G2612 PolarHBondContact O-N 3.11Å; E2610-G2612 VanDerWaalsContact O-N 3.14Å; E2610-T2613 WeakPolarHBondContact O-CB 3.48Å; E2610-T2613 PolarHBondContact O-N 2.64Å; E2610-T2613 PolarHBondContact O-OG1 3.23Å
2611	Y	92.3	Very high	91.5	Very high	18 Å²	18	24.6 Å²	24.6	7%	0.071	12%	0.124	C	C	.	.	H	α-helix	trans	-57.5	-29.1	176.5	-65.2	-19.1	0	0	0	113.3	K2348 F2463 T2464 E2467 E2468 R2607 T2613 H2614 V2615	K2348-Y2611 HydrophobicContact CD-CD1 4.4Å; K2348-Y2611 HydrophobicContact CD-CE1 4.19Å; K2348-Y2611 PolarHBondContact NZ-OH 3.17Å; F2463-Y2611 HydrophobicContact CD1-CG 4.27Å; F2463-Y2611 HydrophobicContact CE1-CD1 4.45Å; F2463-Y2611 HydrophobicContact CE1-CG 4.27Å; T2464-Y2611 HydrophobicContact CG2-CD2 3.89Å; T2464-Y2611 HydrophobicContact CG2-CE2 4.07Å; E2467-Y2611 HydrophobicContact CB-CE2 4.01Å; E2468-Y2611 HydrophobicContact CG-CE2 4.23Å; E2468-Y2611 VanDerWaalsContact OE1-CE2 3.29Å; E2468-Y2611 WeakPolarHBondContact OE1-CE2 3.46Å; E2468-Y2611 PolarHBondContact OE1-OH 2.84Å; R2607-Y2611 HydrophobicContact CB-CE2 4.09Å; R2607-Y2611 WeakPolarHBondContact O-CD2 3.12Å; R2607-Y2611 PolarHBondContact O-N 3.44Å; Y2611-T2613 PolarHBondContact O-N 2.89Å; Y2611-H2614 PolarHBondContact O-N 3.17Å; Y2611-V2615 WeakPolarHBondContact O-CG2 3.48Å; Y2611-V2615 PolarHBondContact O-N 3.35Å; Y2611-V2615 VanDerWaalsContact O-N 3.09Å
2612	G	91	Very high	92.3	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-54.8	-35.2	171.4	0	0	0	0	0	113.9	Q2608 A2609 E2610 R2616	Q2608-G2612 PolarHBondContact O-N 3.1Å; A2609-G2612 PolarHBondContact O-N 3.3Å; E2610-G2612 PolarHBondContact O-N 3.11Å; E2610-G2612 VanDerWaalsContact O-N 3.14Å; G2612-R2616 VanDerWaalsContact O-CB 3.24Å; G2612-R2616 WeakPolarHBondContact O-CB 3.22Å; G2612-R2616 VanDerWaalsContact O-CD 3.31Å; G2612-R2616 WeakPolarHBondContact O-CD 3.43Å; G2612-R2616 WeakPolarHBondContact O-CG 3.35Å; G2612-R2616 PolarHBondContact O-N 2.93Å
2613	T	93.5	Very high	92.6	Very high	21 Å²	21	18 Å²	18	13%	0.129	9%	0.086	C	C	.	.	H	α-helix	trans	-66.5	-46.3	177.3	-53.1	0	0	0	0	111	V2383 A2384 E2610 Y2611 R2616 M2617	V2383-T2613 HydrophobicContact CB-CG2 4.43Å; V2383-T2613 HydrophobicContact CG1-CG2 3.88Å; A2384-T2613 HydrophobicContact CB-CG2 4.45Å; E2610-T2613 WeakPolarHBondContact O-CB 3.48Å; E2610-T2613 PolarHBondContact O-N 2.64Å; E2610-T2613 PolarHBondContact O-OG1 3.23Å; Y2611-T2613 PolarHBondContact O-N 2.89Å; T2613-R2616 PolarHBondContact O-N 2.74Å; T2613-M2617 HydrophobicContact CG2-SD 4.3Å; T2613-M2617 VanDerWaalsContact O-CG 3.26Å; T2613-M2617 WeakPolarHBondContact O-CG 3.28Å; T2613-M2617 PolarHBondContact O-N 2.72Å
2614	H	93.5	Very high	92.6	Very high	4 Å²	4	18.6 Å²	18.6	2%	0.019	9%	0.088	C	C	.	.	H	α-helix	trans	-67.3	-41.1	-177.4	-48.7	-45.8	0	0	0	112.6	K2348 Y2611 M2617 A2618	K2348-H2614 HydrophobicContact CB-CB 4.29Å; Y2611-H2614 PolarHBondContact O-N 3.17Å; H2614-M2617 WeakPolarHBondContact O-CB 3.32Å; H2614-M2617 PolarHBondContact O-N 2.76Å; H2614-A2618 PolarHBondContact O-N 3.07Å
2615	V	95.1	Very high	92.1	Very high	2 Å²	2	19.5 Å²	19.5	1%	0.012	10%	0.096	C	C	.	.	H	α-helix	trans	-65.8	-41.4	176.6	173.7	0	0	0	0	110.7	L2340 A2344 L2459 L2460 F2463 Y2611 A2618 L2619	L2340-V2615 HydrophobicContact CD2-CG1 4.04Å; A2344-V2615 HydrophobicContact CB-CG2 3.99Å; L2459-V2615 HydrophobicContact CB-CG1 3.81Å; L2460-V2615 HydrophobicContact CB-CB 4.12Å; L2460-V2615 HydrophobicContact CB-CG1 4.21Å; L2460-V2615 HydrophobicContact CB-CG2 4.19Å; F2463-V2615 HydrophobicContact CB-CG2 3.67Å; F2463-V2615 HydrophobicContact CD1-CG2 3.59Å; F2463-V2615 HydrophobicContact CD2-CG2 4.21Å; F2463-V2615 HydrophobicContact CE1-CG2 4.26Å; F2463-V2615 HydrophobicContact CG-CG2 3.54Å; Y2611-V2615 WeakPolarHBondContact O-CG2 3.48Å; Y2611-V2615 PolarHBondContact O-N 3.35Å; Y2611-V2615 VanDerWaalsContact O-N 3.09Å; V2615-A2618 PolarHBondContact O-N 3.14Å; V2615-L2619 WeakPolarHBondContact O-CB 3.31Å; V2615-L2619 PolarHBondContact O-N 3.48Å
2616	R	96	Very high	90.8	Very high	1 Å²	1	24.8 Å²	24.8	0%	0.004	12%	0.124	C	C	.	.	H	α-helix	trans	-67.4	-34.3	175.5	-72.1	169.9	176.4	117.7	10.5	112.5	S2380 F2381 A2384 G2612 T2613 L2619 L2620	S2380-R2616 WeakPolarHBondContact OG-CD 3.2Å; S2380-R2616 VanDerWaalsContact OG-CZ 3.24Å; S2380-R2616 PolarHBondContact OG-NE 3.05Å; S2380-R2616 PolarHBondContact OG-NH1 3.44Å; F2381-R2616 HydrophobicContact CD1-CB 4.07Å; F2381-R2616 HydrophobicContact CD1-CG 4.02Å; F2381-R2616 HydrophobicContact CD2-CG 4.38Å; F2381-R2616 HydrophobicContact CE1-CB 4.08Å; F2381-R2616 HydrophobicContact CE1-CG 3.77Å; F2381-R2616 HydrophobicContact CE2-CG 4.15Å; F2381-R2616 VanDerWaalsContact CE2-NE 3.31Å; F2381-R2616 HydrophobicContact CG-CG 4.32Å; F2381-R2616 HydrophobicContact CZ-CG 3.84Å; A2384-R2616 HydrophobicContact CB-CB 3.9Å; G2612-R2616 VanDerWaalsContact O-CB 3.24Å; G2612-R2616 WeakPolarHBondContact O-CB 3.22Å; G2612-R2616 VanDerWaalsContact O-CD 3.31Å; G2612-R2616 WeakPolarHBondContact O-CD 3.43Å; G2612-R2616 WeakPolarHBondContact O-CG 3.35Å; G2612-R2616 PolarHBondContact O-N 2.93Å; T2613-R2616 PolarHBondContact O-N 2.74Å; R2616-L2619 PolarHBondContact O-N 3.39Å; R2616-L2620 WeakPolarHBondContact O-CB 3.35Å; R2616-L2620 VanDerWaalsContact O-CG 3.27Å; R2616-L2620 WeakPolarHBondContact O-CG 3.32Å; R2616-L2620 PolarHBondContact O-N 3.39Å
2617	M	95	Very high	88.8	Confident	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-61.3	-50.7	170.9	-72.7	171.4	71.8	0	0	111	F2347 L2351 L2357 A2384 R2387 L2388 T2613 H2614 L2619 L2620 A2621	F2347-M2617 HydrophobicContact CB-CE 4.22Å; F2347-M2617 HydrophobicContact CD2-CB 3.56Å; F2347-M2617 HydrophobicContact CD2-CE 4.33Å; F2347-M2617 HydrophobicContact CE2-CB 4.03Å; F2347-M2617 HydrophobicContact CG-CB 4.46Å; F2347-M2617 HydrophobicContact CG-CE 4.26Å; L2351-M2617 HydrophobicContact CD1-CE 3.87Å; L2351-M2617 HydrophobicContact CD1-SD 3.48Å; L2351-M2617 WeakPolarHBondContact CD1-SD 3.39Å; L2351-M2617 HydrophobicContact CD2-CE 4.44Å; L2351-M2617 HydrophobicContact CG-CE 4.34Å; L2357-M2617 HydrophobicContact CB-CE 4.47Å; L2357-M2617 HydrophobicContact CD1-CE 3.55Å; A2384-M2617 VanDerWaalsContact CA-CG 3.49Å; A2384-M2617 HydrophobicContact CB-CB 4.32Å; A2384-M2617 HydrophobicContact CB-CG 3.48Å; A2384-M2617 VanDerWaalsContact CB-CG 3.48Å; R2387-M2617 HydrophobicContact CB-CE 3.84Å; R2387-M2617 HydrophobicContact CB-SD 4.14Å; L2388-M2617 HydrophobicContact CD1-CB 3.95Å; L2388-M2617 HydrophobicContact CD1-CG 4.25Å; L2388-M2617 VanDerWaalsContact CD1-O 3.29Å; L2388-M2617 WeakPolarHBondContact CD1-O 3.27Å; L2388-M2617 HydrophobicContact CD2-CB 4.36Å; L2388-M2617 HydrophobicContact CD2-CE 3.71Å; L2388-M2617 HydrophobicContact CG-CB 4.24Å; L2388-M2617 HydrophobicContact CG-CE 4.01Å; L2388-M2617 HydrophobicContact CG-CG 4.2Å; T2613-M2617 HydrophobicContact CG2-SD 4.3Å; T2613-M2617 VanDerWaalsContact O-CG 3.26Å; T2613-M2617 WeakPolarHBondContact O-CG 3.28Å; T2613-M2617 PolarHBondContact O-N 2.72Å; H2614-M2617 WeakPolarHBondContact O-CB 3.32Å; H2614-M2617 PolarHBondContact O-N 2.76Å; M2617-L2619 VanDerWaalsContact C-N 3.31Å; M2617-L2619 PolarHBondContact O-N 3.47Å; M2617-L2620 PolarHBondContact O-N 3.05Å; M2617-A2621 WeakPolarHBondContact O-CB 3.47Å; M2617-A2621 PolarHBondContact O-N 3.46Å
2618	A	93.6	Very high	86.4	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-58.4	-45.1	177.5	0	0	0	0	0	111.8	L2340 L2343 A2344 F2347 H2614 V2615 A2621 I2622	L2340-A2618 HydrophobicContact CG-CB 4.38Å; L2343-A2618 HydrophobicContact CB-CB 3.98Å; L2343-A2618 HydrophobicContact CD2-CB 4Å; L2343-A2618 HydrophobicContact CG-CB 3.91Å; A2344-A2618 HydrophobicContact CB-CB 3.81Å; F2347-A2618 HydrophobicContact CD2-CB 4.27Å; F2347-A2618 HydrophobicContact CE2-CB 4.35Å; H2614-A2618 PolarHBondContact O-N 3.07Å; V2615-A2618 PolarHBondContact O-N 3.14Å; A2618-A2621 PolarHBondContact O-N 2.59Å; A2618-I2622 WeakPolarHBondContact O-CB 3.37Å; A2618-I2622 WeakPolarHBondContact O-CD1 3.34Å; A2618-I2622 WeakPolarHBondContact O-CG1 3.28Å; A2618-I2622 PolarHBondContact O-N 3.19Å
2619	L	94.7	Very high	86	Confident	1 Å²	1	37.6 Å²	37.6	1%	0.005	19%	0.185	C	C	.	.	H	α-helix	trans	-62.3	-47.6	178	-175.3	65.6	0	0	0	112.3	I2326 F2332 L2340 I2445 T2456 L2459 V2615 R2616 M2617 I2622 V2623	I2326-L2619 HydrophobicContact CG1-CD1 4.44Å; F2332-L2619 HydrophobicContact CE1-CD1 4.23Å; F2332-L2619 HydrophobicContact CZ-CD1 3.97Å; L2340-L2619 HydrophobicContact CD1-CB 4.22Å; L2340-L2619 HydrophobicContact CD1-CD1 3.77Å; I2445-L2619 HydrophobicContact CG2-CD2 4.22Å; T2456-L2619 HydrophobicContact CG2-CD2 3.48Å; T2456-L2619 VanDerWaalsContact CG2-CD2 3.48Å; L2459-L2619 HydrophobicContact CD1-CD1 4.45Å; L2459-L2619 HydrophobicContact CD1-CD2 4.29Å; V2615-L2619 WeakPolarHBondContact O-CB 3.31Å; V2615-L2619 PolarHBondContact O-N 3.48Å; R2616-L2619 PolarHBondContact O-N 3.39Å; M2617-L2619 VanDerWaalsContact C-N 3.31Å; M2617-L2619 PolarHBondContact O-N 3.47Å; L2619-I2622 PolarHBondContact O-N 3.35Å; L2619-V2623 HydrophobicContact CD1-CG2 4.09Å; L2619-V2623 HydrophobicContact CG-CG2 4.3Å; L2619-V2623 WeakPolarHBondContact O-CB 3.42Å; L2619-V2623 VanDerWaalsContact O-CG2 3.29Å; L2619-V2623 WeakPolarHBondContact O-CG2 3.45Å; L2619-V2623 PolarHBondContact O-N 3.5Å
2620	L	95	Very high	85.9	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-62.6	-43.7	178.7	-75.8	171	0	0	0	111.7	M2366 F2381 A2384 M2385 L2388 I2445 R2616 M2617 I2622 V2623 L2624	M2366-L2620 HydrophobicContact SD-CD1 4.05Å; M2366-L2620 HydrophobicContact SD-CD2 3.75Å; F2381-L2620 HydrophobicContact CD1-CD1 4.2Å; F2381-L2620 HydrophobicContact CD1-CD2 4.47Å; F2381-L2620 HydrophobicContact CD1-CG 4.36Å; A2384-L2620 HydrophobicContact CB-CD1 3.93Å; M2385-L2620 HydrophobicContact CB-CD1 3.97Å; M2385-L2620 HydrophobicContact SD-CD1 4.24Å; L2388-L2620 HydrophobicContact CD1-CB 4.18Å; I2445-L2620 HydrophobicContact CD1-CD2 3.94Å; R2616-L2620 WeakPolarHBondContact O-CB 3.35Å; R2616-L2620 VanDerWaalsContact O-CG 3.27Å; R2616-L2620 WeakPolarHBondContact O-CG 3.32Å; R2616-L2620 PolarHBondContact O-N 3.39Å; M2617-L2620 PolarHBondContact O-N 3.05Å; L2620-I2622 VanDerWaalsContact C-N 3.32Å; L2620-I2622 PolarHBondContact O-N 2.93Å; L2620-V2623 PolarHBondContact O-N 3.08Å; L2620-L2624 VanDerWaalsContact O-CB 3.28Å; L2620-L2624 WeakPolarHBondContact O-CB 3.48Å; L2620-L2624 WeakPolarHBondContact O-CG 3.21Å; L2620-L2624 PolarHBondContact O-N 2.93Å
2621	A	92.1	Very high	85.6	Confident	3 Å²	3	34.7 Å²	34.7	3%	0.025	17%	0.168	C	C	.	.	H	α-helix	trans	-58.1	-45.4	175.7	0	0	0	0	0	111.1	I2316 L2343 F2347 I2360 L2388 M2617 A2618 A2625	I2316-A2621 HydrophobicContact CG2-CB 3.79Å; I2316-A2621 WeakPolarHBondContact CG2-O 3.5Å; L2343-A2621 HydrophobicContact CD2-CB 4.41Å; F2347-A2621 HydrophobicContact CE2-CB 4.06Å; F2347-A2621 HydrophobicContact CZ-CB 4.14Å; I2360-A2621 HydrophobicContact CG2-CB 3.75Å; L2388-A2621 HydrophobicContact CD1-CB 4.27Å; M2617-A2621 WeakPolarHBondContact O-CB 3.47Å; M2617-A2621 PolarHBondContact O-N 3.46Å; A2618-A2621 PolarHBondContact O-N 2.59Å; A2621-A2625 WeakPolarHBondContact O-CB 3.09Å; A2621-A2625 PolarHBondContact O-N 2.65Å
2622	I	92	Very high	85.2	Confident	2 Å²	2	35.7 Å²	35.7	1%	0.01	17%	0.174	C	C	.	.	H	α-helix	trans	-66.1	-48.6	178.2	-67.3	163.6	0	0	0	111.6	I2316 L2318 I2321 S2322 L2340 L2343 A2618 L2619 L2620 L2624 A2625	I2316-I2622 HydrophobicContact CG2-CG1 4.23Å; I2316-I2622 WeakPolarHBondContact O-CG1 3.46Å; L2318-I2622 HydrophobicContact CB-CG2 3.46Å; L2318-I2622 VanDerWaalsContact CB-CG2 3.46Å; L2318-I2622 HydrophobicContact CD1-CD1 4.44Å; L2318-I2622 HydrophobicContact CD2-CG2 4.44Å; L2318-I2622 HydrophobicContact CG-CG2 4.43Å; I2321-I2622 HydrophobicContact CB-CG2 4.19Å; I2321-I2622 HydrophobicContact CG2-CG2 3.61Å; S2322-I2622 WeakPolarHBondContact CA-O 3.4Å; S2322-I2622 VanDerWaalsContact CB-O 3.27Å; S2322-I2622 WeakPolarHBondContact CB-O 3.5Å; S2322-I2622 PolarHBondContact OG-O 2.93Å; L2340-I2622 HydrophobicContact CB-CD1 4.03Å; L2340-I2622 HydrophobicContact CD1-CD1 4.07Å; L2340-I2622 HydrophobicContact CG-CD1 4.11Å; L2343-I2622 HydrophobicContact CD2-CD1 4Å; L2343-I2622 HydrophobicContact CD2-CG1 3.83Å; A2618-I2622 WeakPolarHBondContact O-CB 3.37Å; A2618-I2622 WeakPolarHBondContact O-CD1 3.34Å; A2618-I2622 WeakPolarHBondContact O-CG1 3.28Å; A2618-I2622 PolarHBondContact O-N 3.19Å; L2619-I2622 PolarHBondContact O-N 3.35Å; L2620-I2622 VanDerWaalsContact C-N 3.32Å; L2620-I2622 PolarHBondContact O-N 2.93Å; I2622-L2624 VanDerWaalsContact C-N 3.34Å; I2622-L2624 PolarHBondContact O-N 3.14Å; I2622-A2625 VanDerWaalsContact O-CB 3.31Å; I2622-A2625 WeakPolarHBondContact O-CB 3.19Å; I2622-A2625 PolarHBondContact O-N 3.22Å
2623	V	90.9	Very high	84.9	Confident	2 Å²	2	37.9 Å²	37.9	1%	0.012	19%	0.185	C	C	.	.	H	α-helix	trans	-65.7	-37.8	-176.4	170.4	0	0	0	0	111.4	I2321 G2323 I2326 P2443 I2445 L2619 L2620	I2321-V2623 HydrophobicContact CG2-CG2 4.37Å; G2323-V2623 WeakPolarHBondContact CA-O 3.47Å; G2323-V2623 PolarHBondContact N-O 3.03Å; I2326-V2623 HydrophobicContact CD1-CG2 4.27Å; I2326-V2623 HydrophobicContact CG1-CG2 3.82Å; P2443-V2623 HydrophobicContact CB-CG1 3.56Å; P2443-V2623 HydrophobicContact CG-CG1 4.16Å; I2445-V2623 HydrophobicContact CD1-CG1 4.41Å; I2445-V2623 HydrophobicContact CD1-CG2 4.36Å; L2619-V2623 HydrophobicContact CD1-CG2 4.09Å; L2619-V2623 HydrophobicContact CG-CG2 4.3Å; L2619-V2623 WeakPolarHBondContact O-CB 3.42Å; L2619-V2623 VanDerWaalsContact O-CG2 3.29Å; L2619-V2623 WeakPolarHBondContact O-CG2 3.45Å; L2619-V2623 PolarHBondContact O-N 3.5Å; L2620-V2623 PolarHBondContact O-N 3.08Å
2624	L	90.8	Very high	84.3	Confident	21 Å²	21	39.1 Å²	39.1	11%	0.11	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89	-0.4	178.5	-66.8	170.9	0	0	0	113.7	K2364 M2385 D2420 C2421 L2620 I2622 N2626	K2364-L2624 HydrophobicContact CB-CD1 4.22Å; M2385-L2624 HydrophobicContact CE-CD1 3.7Å; M2385-L2624 HydrophobicContact SD-CD1 3.95Å; D2420-L2624 HydrophobicContact CB-CD2 3.96Å; C2421-L2624 HydrophobicContact CB-CD2 3.82Å; L2620-L2624 VanDerWaalsContact O-CB 3.28Å; L2620-L2624 WeakPolarHBondContact O-CB 3.48Å; L2620-L2624 WeakPolarHBondContact O-CG 3.21Å; L2620-L2624 PolarHBondContact O-N 2.93Å; I2622-L2624 VanDerWaalsContact C-N 3.34Å; I2622-L2624 PolarHBondContact O-N 3.14Å; L2624-N2626 PolarHBondContact O-N 3.07Å
2625	A	82.1	Confident	83.6	Confident	19 Å²	19	41.6 Å²	41.6	16%	0.157	20%	0.2	C	C	.	.			trans	-63.7	125.6	176.1	0	0	0	0	0	110.1	I2316 W2317 A2621 I2622	I2316-A2625 HydrophobicContact CB-CB 4.34Å; I2316-A2625 HydrophobicContact CG2-CB 3.99Å; W2317-A2625 HydrophobicContact CB-CB 4.47Å; A2621-A2625 WeakPolarHBondContact O-CB 3.09Å; A2621-A2625 PolarHBondContact O-N 2.65Å; I2622-A2625 VanDerWaalsContact O-CB 3.31Å; I2622-A2625 WeakPolarHBondContact O-CB 3.19Å; I2622-A2625 PolarHBondContact O-N 3.22Å
2626	N	66	Low	82.8	Confident	112 Å²	112	44.6 Å²	44.6	60%	0.599	22%	0.215	S	C	*	.			trans	-76.8	150.6	166.3	-82.1	-19.2	0	0	0	109.3	L2624 K2628	L2624-N2626 PolarHBondContact O-N 3.07Å; N2626-K2628 PolarHBondContact O-N 2.76Å; N2626-K2628 VanDerWaalsContact O-N 3.16Å
2627	Q	48.9	Very low	81.6	Confident	157 Å²	157	48.3 Å²	48.3	73%	0.734	23%	0.233	S	C	*	.			trans	-69	-5.3	174.4	-154.4	175	23.6	0	0	112.9	W2317	W2317-Q2627 HydrophobicContact CD2-CG 4.4Å; W2317-Q2627 HydrophobicContact CZ2-CG 4.04Å
2628	K	38.6	Very low	80.4	Confident	262 Å²	262	52.6 Å²	52.6	100%	1.139	25%	0.254	S	S	*	.			trans	-95.8	0	179.1	-82.2	-168.8	176.5	-175.7	0	111.7	N2626	N2626-K2628 PolarHBondContact O-N 2.76Å; N2626-K2628 VanDerWaalsContact O-N 3.16Å

Retrieved 2,628 of 2,628 residues in 3295.2 ms (Link to these results)

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