A0A077Z134_TRITR Loading...

Rho GTPase activating protein 190

AlphaFold DB , UniProt , Accession A0A077Z134, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,282 aa.

						>A0A077Z134_TRITR|A0A077Z134
MSSTSEENLLQQSRRGVSGSRSPLKFRVANESRSTSSSQASPLSHNIASSPPPSTSSSPLSSRFFTIAVIGLSGTEREKGLVGVGKSCLCNRFVRPLEDRYRTDHISTLSQVDFGGPVVNNDHWLYWGERVVLSDSGAEIAFRLVEQTEFVDDESFQPLKGSASQREPYLKRCTAIKLHSPDKLMYICKDQLGVEHDYEQKTLPDGRAVVDGFVCVYDVSEVPSRPSERQNEFIIALLHNVMKVKKPFVLTTTKQDALDGQIVRSLEKLISRREFRSVAPVVETSAHFGVNTELPFLLLANMIDRTNSKPKIVSFVDAAHRRREIIDVATVAYLHKLKKTVQHFRWTWGQFCRLLQDDPDFEHFCDMCGRVAAQRLFQQYLIELRSCHMQQRRQLELAKLPDALMKLIPDSSVCCGKSWEDIVDLMQMSPMFREIFYTPQQSDSGDADNESVGDRLSLDILRTPEAEVCFHKHFAYLEAKCARQRLLSDFSQLLANCSQVTPGKPLSDVRLFLMGKEPFESLAEVDLQAVYDQYQVGMIGKELLCSDELHGSLNFFQRVLIKRARRNFIELMLEKVYIFVCIMQQSRLRHRPDEDSFNNASSPQLDDYDYQYMHDCLQEDSRYRLMNRLHQWRDNAVRKFFAFLHRPSKSSCPFKPRCIDSLISHRMSAKSPGTHSSDFVNPYYNIFYPITDNQVRILIVGAEMLVHQVCGELEGALDGGIFDYGGTCISVNFRCIPDREFPRFFSYVNEYEANGVIVAYSSRQSFSCARDFIFHTLMDVDVLTSTGEGPMNGIPAGALRRLPLVMLYACDVAHINDVPYLQQQGCNFADALQVRFVGLRQDDDFEYLVQQHGQQGSVMLTAEQVYRTIFSIVHSACVQYPSAGSSTANSCNCAQCQNDSSRHQSGSIVSGTVVICLMCGDDFEPDLVLNPLLTRLRTTHRLDQSTLVDSVSDQSIADSVTSSLWSLCLNGAGSRSNVVSKSVPVTFNVDVFLPVACNRFSISCSVASYHCALALTLKDILFDGYMFIYSPKRRSSLAHLEYAHVGNFAMVNFINKRFLLSCLSRLLPSSKPMMFVAVGEVVDFFSDQEANELIMEGSQLADKMNARFVSVSRSAEPSSTIYTSFFEEVWTRKTNAKEVAMELCKSTAESDIEKAANTTTGRQSLVQESSNAKESEYMTLSSFWSGAFPSTDASIVNGQQIDHGSVPTSHLFAKRFSESVQQGKPASFALPFNSMFVAVPIDMLKVKVFCSSHQIAKTVGNAFANSGCAGICPIQTVQAGLH
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.5	Very low	54.4	Low	216 Å²	216	92 Å²	92	100%	1.064	50%	0.499	S	S	*	.				0	-24.4	0	-80.6	-172.3	165.2	0	0	113.2
2	S	49.1	Very low	54.5	Low	74 Å²	74	95 Å²	95	52%	0.517	51%	0.507	S	S	.	.	H	α-helix	trans	-70.1	-37.5	176.5	47.8	0	0	0	0	114.9	T4 S5 E6	S2-T4 PolarHBondContact O-N 2.93Å; S2-S5 PolarHBondContact O-N 3.45Å; S2-S5 VanDerWaalsContact O-N 3.11Å; S2-S5 PolarHBondContact O-OG 2.71Å; S2-E6 WeakPolarHBondContact O-CG 3.31Å; S2-E6 PolarHBondContact O-N 2.75Å
3	S	49.5	Very low	54.3	Low	67 Å²	67	88.3 Å²	88.3	47%	0.469	47%	0.473	S	S	.	.	H	α-helix	trans	-59.5	-43	-173.1	54.5	0	0	0	0	113.9	S5 E6 E7	S3-S5 VanDerWaalsContact C-N 3.33Å; S3-S5 PolarHBondContact O-N 3.36Å; S3-E6 PolarHBondContact O-N 3.37Å; S3-E7 WeakPolarHBondContact O-CG 3.39Å; S3-E7 PolarHBondContact O-N 3Å
4	T	52.1	Low	54.2	Low	82 Å²	82	89.4 Å²	89.4	50%	0.503	47%	0.467	S	S	.	.	H	α-helix	trans	-70.9	-25.5	178.4	39.5	0	0	0	0	113.3	S2 N8	S2-T4 PolarHBondContact O-N 2.93Å; T4-N8 WeakPolarHBondContact O-CB 3.29Å; T4-N8 PolarHBondContact O-N 3Å; T4-N8 PolarHBondContact O-ND2 2.85Å
5	S	58.9	Low	53.7	Low	61 Å²	61	95.8 Å²	95.8	43%	0.427	48%	0.482	S	S	.	.	H	α-helix	trans	-73.2	-40.4	169.3	37.5	0	0	0	0	112	S2 S3 N8 L9	S2-S5 PolarHBondContact O-N 3.45Å; S2-S5 VanDerWaalsContact O-N 3.11Å; S2-S5 PolarHBondContact O-OG 2.71Å; S3-S5 VanDerWaalsContact C-N 3.33Å; S3-S5 PolarHBondContact O-N 3.36Å; S5-N8 PolarHBondContact O-N 2.98Å; S5-L9 WeakPolarHBondContact O-CG 3.27Å; S5-L9 PolarHBondContact O-N 3.26Å
6	E	57	Low	53.2	Low	100 Å²	100	93.9 Å²	93.9	47%	0.467	50%	0.495	S	S	.	.	H	α-helix	trans	-65	-45.7	178	-70.7	165.6	170.6	0	0	111.7	S2 S3 N8 L9 L10	S2-E6 WeakPolarHBondContact O-CG 3.31Å; S2-E6 PolarHBondContact O-N 2.75Å; S3-E6 PolarHBondContact O-N 3.37Å; E6-N8 VanDerWaalsContact C-N 3.33Å; E6-N8 PolarHBondContact O-N 3.37Å; E6-L9 PolarHBondContact O-N 2.94Å; E6-L10 WeakPolarHBondContact O-CB 3.24Å; E6-L10 WeakPolarHBondContact O-CG 3.32Å; E6-L10 PolarHBondContact O-N 2.89Å
7	E	59	Low	52.6	Low	116 Å²	116	91.4 Å²	91.4	54%	0.542	48%	0.483	S	S	.	.	H	α-helix	trans	-60.8	-40.1	174.8	-74.4	-177.6	152.2	0	0	112.5	S3 L10 Q11	S3-E7 WeakPolarHBondContact O-CG 3.39Å; S3-E7 PolarHBondContact O-N 3Å; E7-L10 PolarHBondContact O-N 3.44Å; E7-Q11 WeakPolarHBondContact O-CB 3.32Å; E7-Q11 WeakPolarHBondContact O-CG 3.47Å; E7-Q11 PolarHBondContact O-N 3.48Å
8	N	59.3	Low	51.5	Low	86 Å²	86	90.3 Å²	90.3	46%	0.46	49%	0.485	S	S	.	.	H	α-helix	trans	-67	-38.7	176.2	-86	-62.8	0	0	0	111.9	T4 S5 E6 Q11 Q12	T4-N8 WeakPolarHBondContact O-CB 3.29Å; T4-N8 PolarHBondContact O-N 3Å; T4-N8 PolarHBondContact O-ND2 2.85Å; S5-N8 PolarHBondContact O-N 2.98Å; E6-N8 VanDerWaalsContact C-N 3.33Å; E6-N8 PolarHBondContact O-N 3.37Å; N8-Q11 PolarHBondContact O-N 3.31Å; N8-Q12 WeakPolarHBondContact O-CB 3.45Å; N8-Q12 VanDerWaalsContact O-CG 3.24Å; N8-Q12 WeakPolarHBondContact O-CG 3.46Å; N8-Q12 PolarHBondContact O-N 3.34Å
9	L	60.1	Low	50.5	Low	64 Å²	64	88 Å²	88	34%	0.335	48%	0.484	S	S	.	.	H	α-helix	trans	-66.4	-42.5	174.8	-72.6	167.2	0	0	0	111.8	S5 E6 Q11 Q12 S13 V328	S5-L9 WeakPolarHBondContact O-CG 3.27Å; S5-L9 PolarHBondContact O-N 3.26Å; E6-L9 PolarHBondContact O-N 2.94Å; L9-Q11 VanDerWaalsContact C-N 3.34Å; L9-Q11 PolarHBondContact O-N 3Å; L9-Q12 PolarHBondContact O-N 3.43Å; L9-S13 WeakPolarHBondContact O-CB 3.3Å; L9-S13 PolarHBondContact O-N 3.21Å; L9-V328 HydrophobicContact CB-CG1 4.48Å; L9-V328 HydrophobicContact CB-CG2 4.27Å; L9-V328 HydrophobicContact CD1-CG2 4.23Å
10	L	57.8	Low	49.5	Very low	40 Å²	40	89 Å²	89	21%	0.209	50%	0.498	C	S	.	.	H	α-helix	trans	-61.8	-37.7	172.9	-76.1	163.6	0	0	0	112.6	E6 E7 S13 R14 V328 A332	E6-L10 WeakPolarHBondContact O-CB 3.24Å; E6-L10 WeakPolarHBondContact O-CG 3.32Å; E6-L10 PolarHBondContact O-N 2.89Å; E7-L10 PolarHBondContact O-N 3.44Å; L10-S13 PolarHBondContact O-OG 3.24Å; L10-R14 WeakPolarHBondContact O-CB 3.29Å; L10-R14 WeakPolarHBondContact O-CD 3.41Å; L10-R14 WeakPolarHBondContact O-CG 3.48Å; L10-R14 PolarHBondContact O-N 2.79Å; L10-V328 HydrophobicContact CD2-CG1 3.49Å; L10-V328 VanDerWaalsContact CD2-CG1 3.49Å; L10-V328 HydrophobicContact CG-CG1 3.53Å; L10-A332 HydrophobicContact CD2-CB 4.28Å
11	Q	58.6	Low	48.5	Very low	106 Å²	106	94.5 Å²	94.5	50%	0.495	51%	0.511	S	S	.	.	H	α-helix	trans	-71.3	-38.3	174.1	-74.5	-173.2	27.5	0	0	112.3	E7 N8 L9 R15	E7-Q11 WeakPolarHBondContact O-CB 3.32Å; E7-Q11 WeakPolarHBondContact O-CG 3.47Å; E7-Q11 PolarHBondContact O-N 3.48Å; N8-Q11 PolarHBondContact O-N 3.31Å; L9-Q11 VanDerWaalsContact C-N 3.34Å; L9-Q11 PolarHBondContact O-N 3Å; Q11-R15 WeakPolarHBondContact O-CG 3.31Å; Q11-R15 PolarHBondContact O-N 3.44Å
12	Q	55.9	Low	48	Very low	128 Å²	128	88.1 Å²	88.1	60%	0.598	49%	0.487	S	S	*	.	H	α-helix	trans	-66.1	-41.8	176.3	-75	174.4	24.8	0	0	111.7	N8 L9 R15	N8-Q12 WeakPolarHBondContact O-CB 3.45Å; N8-Q12 VanDerWaalsContact O-CG 3.24Å; N8-Q12 WeakPolarHBondContact O-CG 3.46Å; N8-Q12 PolarHBondContact O-N 3.34Å; L9-Q12 PolarHBondContact O-N 3.43Å; Q12-R15 PolarHBondContact O-N 2.99Å
13	S	52.5	Low	46.8	Very low	8 Å²	8	90.4 Å²	90.4	6%	0.056	50%	0.501	C	S	.	.	H	α-helix	trans	-63.6	-42.9	177.7	75	0	0	0	0	112.4	L9 L10 R15 G16 I325 H363	L9-S13 WeakPolarHBondContact O-CB 3.3Å; L9-S13 PolarHBondContact O-N 3.21Å; L10-S13 PolarHBondContact O-OG 3.24Å; S13-R15 VanDerWaalsContact C-N 3.3Å; S13-R15 PolarHBondContact O-N 2.92Å; S13-G16 PolarHBondContact O-N 3.48Å; S13-I325 VanDerWaalsContact CB-CG2 3.43Å; S13-H363 VanDerWaalsContact CB-NE2 3.31Å; S13-H363 WeakPolarHBondContact CB-NE2 3.36Å; S13-H363 PolarHBondContact OG-CE1 3.24Å; S13-H363 PolarHBondContact OG-NE2 3.38Å
14	R	51.8	Low	45.6	Very low	104 Å²	104	94 Å²	94	39%	0.392	51%	0.514	S	S	.	.	H	α-helix	trans	-65.9	-27.7	178.7	-71.7	173.2	178.6	-166.3	4.3	113.2	L10 G16 D360	L10-R14 WeakPolarHBondContact O-CB 3.29Å; L10-R14 WeakPolarHBondContact O-CD 3.41Å; L10-R14 WeakPolarHBondContact O-CG 3.48Å; L10-R14 PolarHBondContact O-N 2.79Å; R14-G16 VanDerWaalsContact C-N 3.33Å; R14-G16 PolarHBondContact O-N 3.18Å; R14-D360 IonicContact CZ-OD1 3.29Å; R14-D360 IonicContact NH2-OD1 3.5Å; R14-D360 PolarHBondContact NH2-OD1 3.34Å; R14-D360 IonicContact NH2-OD2 3.48Å
15	R	47.9	Very low	44.3	Very low	185 Å²	185	99.7 Å²	99.7	70%	0.698	53%	0.532	S	S	*	.	H	α-helix	trans	-71	-22.8	175.9	-75.2	178.4	-172.6	-163.9	4.6	114	Q11 Q12 S13 V17 S18	Q11-R15 WeakPolarHBondContact O-CG 3.31Å; Q11-R15 PolarHBondContact O-N 3.44Å; Q12-R15 PolarHBondContact O-N 2.99Å; S13-R15 VanDerWaalsContact C-N 3.3Å; S13-R15 PolarHBondContact O-N 2.92Å; R15-V17 VanDerWaalsContact C-N 3.31Å; R15-V17 PolarHBondContact O-N 3.43Å; R15-S18 PolarHBondContact O-OG 3.27Å
16	G	44.8	Very low	42.7	Very low	66 Å²	66	105.4 Å²	105.4	68%	0.68	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-15.9	179.4	0	0	0	0	0	115	S13 R14	S13-G16 PolarHBondContact O-N 3.48Å; R14-G16 VanDerWaalsContact C-N 3.33Å; R14-G16 PolarHBondContact O-N 3.18Å
17	V	43.6	Very low	41.1	Very low	50 Å²	50	112 Å²	112	30%	0.303	57%	0.569	S	S	.	*	S	Bend	trans	-110.3	-5.7	-170.2	-169.3	0	0	0	0	112.4	R15 G19 L97	R15-V17 VanDerWaalsContact C-N 3.31Å; R15-V17 PolarHBondContact O-N 3.43Å; V17-G19 PolarHBondContact O-N 3.25Å; V17-G19 VanDerWaalsContact O-N 3.08Å; V17-L97 HydrophobicContact CG1-CD2 4.04Å
18	S	33	Very low	39.6	Very low	73 Å²	73	113 Å²	113	51%	0.51	58%	0.583	S	S	.	*			trans	-75	3.2	-169.3	50.9	0	0	0	0	116.6	R15	R15-S18 PolarHBondContact O-OG 3.27Å
19	G	31.8	Very low	38	Very low	46 Å²	46	112.9 Å²	112.9	47%	0.474	60%	0.595	S	S	.	*	T	Hydrogen-bonded Turn	trans	-83.7	115.1	171	0	0	0	0	0	111.6	V17	V17-G19 PolarHBondContact O-N 3.25Å; V17-G19 VanDerWaalsContact O-N 3.08Å
20	S	31.2	Very low	36.4	Very low	108 Å²	108	117 Å²	117	76%	0.755	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	81.5	45.7	179.5	-166.3	0	0	0	0	118	S22	S20-S22 VanDerWaalsContact C-N 3.31Å; S20-S22 PolarHBondContact O-N 3.09Å
21	R	27.9	Very low	35	Very low	205 Å²	205	124.9 Å²	124.9	77%	0.774	65%	0.653	S	S	*	*			trans	-84.5	69.2	152.6	-87.2	-169.8	171.7	-162.4	-3.7	111.6
22	S	25.2	Very low	33.6	Very low	81 Å²	81	124.4 Å²	124.4	57%	0.566	66%	0.661	S	S	*	*			trans	-95.3	125.2	159.4	51.1	0	0	0	0	108.9	S20 L24	S20-S22 VanDerWaalsContact C-N 3.31Å; S20-S22 PolarHBondContact O-N 3.09Å; S22-L24 PolarHBondContact O-N 3.37Å
23	P	24.1	Very low	32.5	Very low	123 Å²	123	130.2 Å²	130.2	80%	0.799	68%	0.678	S	S	*	*			trans	-83	79.3	-167.8	32.8	-36.2	0	0	0	112.2	K25	P23-K25 VanDerWaalsContact C-N 3.32Å; P23-K25 PolarHBondContact O-N 3.39Å
24	L	25.1	Very low	31.4	Very low	142 Å²	142	135 Å²	135	74%	0.743	71%	0.711	S	S	*	*			trans	-71.8	90.7	162.8	-75.5	174.5	0	0	0	109.4	S22 F26	S22-L24 PolarHBondContact O-N 3.37Å; L24-F26 VanDerWaalsContact C-N 3.28Å; L24-F26 HydrophobicContact CB-CD2 4.47Å; L24-F26 PolarHBondContact O-N 2.75Å
25	K	23.7	Very low	30.5	Very low	202 Å²	202	136.3 Å²	136.3	88%	0.878	73%	0.731	S	S	*	*			trans	-61.7	84.4	169.8	-76.9	-179.2	172.7	176.6	0	110.7	P23 R27	P23-K25 VanDerWaalsContact C-N 3.32Å; P23-K25 PolarHBondContact O-N 3.39Å; K25-R27 PolarHBondContact O-N 3.15Å; K25-R27 VanDerWaalsContact O-N 3.11Å
26	F	25.9	Very low	29.8	Very low	180 Å²	180	132.2 Å²	132.2	79%	0.789	73%	0.731	S	S	*	*			trans	-75.5	96	163.1	-96.1	-88.9	0	0	0	109.6	L24 V28	L24-F26 VanDerWaalsContact C-N 3.28Å; L24-F26 HydrophobicContact CB-CD2 4.47Å; L24-F26 PolarHBondContact O-N 2.75Å; F26-V28 PolarHBondContact O-N 3.16Å; F26-V28 VanDerWaalsContact O-N 3.15Å
27	R	23.8	Very low	29.2	Very low	238 Å²	238	134.4 Å²	134.4	90%	0.898	74%	0.735	S	S	*	*			trans	-63.8	106.3	159.2	-102.3	178.9	167.7	163.7	-4.9	107.5	K25 A29	K25-R27 PolarHBondContact O-N 3.15Å; K25-R27 VanDerWaalsContact O-N 3.11Å; R27-A29 PolarHBondContact O-N 3.14Å
28	V	27	Very low	28.8	Very low	138 Å²	138	136.8 Å²	136.8	84%	0.836	75%	0.754	S	S	*	*			trans	-68.9	113.3	158.6	179.5	0	0	0	0	106.3	F26	F26-V28 PolarHBondContact O-N 3.16Å; F26-V28 VanDerWaalsContact O-N 3.15Å
29	A	26.4	Very low	28.7	Very low	84 Å²	84	142.4 Å²	142.4	69%	0.694	77%	0.772	S	S	*	*			trans	-78	137.9	177.2	0	0	0	0	0	109.9	R27 E31	R27-A29 PolarHBondContact O-N 3.14Å; A29-E31 PolarHBondContact O-N 3.33Å
30	N	27.1	Very low	28.8	Very low	151 Å²	151	144.3 Å²	144.3	81%	0.807	78%	0.783	S	S	*	*			trans	-61.2	127.1	168.7	-89.8	-12.2	0	0	0	109.9	S32	N30-S32 PolarHBondContact O-N 2.91Å
31	E	27.7	Very low	28.9	Very low	204 Å²	204	145 Å²	145	95%	0.953	79%	0.789	S	S	*	*			trans	-73.5	81.9	157	-68.9	-168.4	138.8	0	0	109.6	A29	A29-E31 PolarHBondContact O-N 3.33Å
32	S	30.2	Very low	29.4	Very low	97 Å²	97	140.8 Å²	140.8	68%	0.678	79%	0.788	S	S	*	*			trans	-101.1	128.3	163.2	53	0	0	0	0	109.5	N30	N30-S32 PolarHBondContact O-N 2.91Å
33	R	31.4	Very low	29.9	Very low	250 Å²	250	145.6 Å²	145.6	94%	0.943	81%	0.806	S	S	*	*			trans	-39.8	138.4	-175.3	-76.1	172.2	167.2	165.9	-5.8	114.6
34	S	29.5	Very low	30.3	Very low	108 Å²	108	144.3 Å²	144.3	76%	0.755	80%	0.8	S	S	*	*			trans	-53.2	135.8	172.6	53.2	0	0	0	0	114.9
35	T	32.7	Very low	31	Very low	131 Å²	131	146.9 Å²	146.9	80%	0.804	81%	0.808	S	S	*	*				-167	112.6	119.8	33.7	0	0	0	0	112.5
36	S	33.7	Very low	31.4	Very low	100 Å²	100	144.6 Å²	144.6	70%	0.699	81%	0.805	S	S	*	*			trans	44.4	128.1	142.7	59.1	0	0	0	0	123.9
37	S	33.1	Very low	31.8	Very low	111 Å²	111	144.4 Å²	144.4	78%	0.776	81%	0.811	S	S	*	*			trans	65.1	143.8	142	54.2	0	0	0	0	120.2
38	S	33.8	Very low	32.2	Very low	100 Å²	100	137.7 Å²	137.7	70%	0.699	81%	0.806	S	S	*	*			cis	-171.6	146.4	-6.9	45	0	0	0	0	112.8
39	Q	31.9	Very low	32.6	Very low	191 Å²	191	137 Å²	137	89%	0.893	81%	0.808	S	S	*	*			trans	69	146.7	148.2	-71.2	-178.3	5.7	0	0	123.4
40	A	34	Very low	33.1	Very low	86 Å²	86	138.3 Å²	138.3	71%	0.711	81%	0.812	S	S	*	*			trans	98.1	77	144.4	0	0	0	0	0	121.9
41	S	33.6	Very low	33.4	Very low	124 Å²	124	136.8 Å²	136.8	87%	0.867	81%	0.81	S	S	*	*				75.6	154.2	115.9	-58.2	0	0	0	0	123.1
42	P	37.8	Very low	33.8	Very low	116 Å²	116	132.8 Å²	132.8	75%	0.753	80%	0.801	S	S	*	*			trans	-124.6	172.2	-159.1	42	-26.6	0	0	0	115.8
43	L	35.3	Very low	34	Very low	181 Å²	181	133.8 Å²	133.8	95%	0.948	81%	0.806	S	S	*	*			trans	-137.2	151.9	161.5	-82.7	175.5	0	0	0	112.1
44	S	33.5	Very low	34	Very low	97 Å²	97	127.4 Å²	127.4	68%	0.678	80%	0.8	S	S	*	*			trans	-121.9	155.1	-165.5	53.2	0	0	0	0	112.6
45	H	38	Very low	34.1	Very low	195 Å²	195	128.9 Å²	128.9	90%	0.903	80%	0.804	S	S	*	*			trans	-147.4	128.7	153.4	-95.4	-71.7	0	0	0	111.3
46	N	32.3	Very low	33.8	Very low	154 Å²	154	128.8 Å²	128.8	82%	0.824	81%	0.809	S	S	*	*			trans	-100.6	145.1	172.7	-77.4	-37.5	0	0	0	110.1
47	I	36.2	Very low	33.6	Very low	177 Å²	177	129.1 Å²	129.1	91%	0.908	81%	0.811	S	S	*	*			trans	-134.8	132.8	148.1	-62	-175.7	0	0	0	107.6
48	A	31.2	Very low	33.3	Very low	96 Å²	96	128.6 Å²	128.6	79%	0.793	81%	0.807	S	S	*	*			trans	-102.6	155.8	-172.3	0	0	0	0	0	112.8
49	S	36.1	Very low	33.3	Very low	125 Å²	125	129.9 Å²	129.9	87%	0.874	81%	0.813	S	S	*	*			trans	-146.1	146.7	155.6	46.9	0	0	0	0	111
50	S	35.8	Very low	33.3	Very low	111 Å²	111	128.4 Å²	128.4	78%	0.776	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-70.6	156.7	-157.6	45.2	0	0	0	0	118
51	P	33.3	Very low	33.5	Very low	119 Å²	119	129.9 Å²	129.9	77%	0.773	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-89.8	150.5	173.2	36.8	-34.3	0	0	0	113.8
52	P	36.8	Very low	34.6	Very low	119 Å²	119	127.7 Å²	127.7	77%	0.773	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-86.7	166.9	166.9	35.3	-32.4	0	0	0	112.5
53	P	35	Very low	36.6	Very low	118 Å²	118	128.5 Å²	128.5	77%	0.766	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-94.1	163.1	-145.8	35.5	-37.6	0	0	0	116.7
54	S	29.6	Very low	39.2	Very low	117 Å²	117	122.7 Å²	122.7	82%	0.818	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-51.7	128.7	172	54	0	0	0	0	114.4
55	T	32.4	Very low	42.1	Very low	138 Å²	138	118.8 Å²	118.8	85%	0.847	73%	0.727	S	S	*	*			trans	-117.5	128.4	150.8	37.4	0	0	0	0	109.2	S57	T55-S57 PolarHBondContact O-N 3.23Å
56	S	26.9	Very low	44.9	Very low	129 Å²	129	110 Å²	110	90%	0.902	69%	0.686	S	S	*	*			trans	-79.8	108.7	-173.5	52.3	0	0	0	0	111.7
57	S	29.1	Very low	48.1	Very low	108 Å²	108	102.7 Å²	102.7	76%	0.755	65%	0.647	S	S	*	*			trans	-124.9	124.5	158.3	56.6	0	0	0	0	108.7	T55	T55-S57 PolarHBondContact O-N 3.23Å
58	S	27.4	Very low	51	Low	99 Å²	99	94.2 Å²	94.2	69%	0.692	60%	0.604	S	S	*	*			trans	-58.6	141.9	177.9	42	0	0	0	0	111.1	L60	S58-L60 PolarHBondContact O-N 2.68Å
59	P	32.9	Very low	54.2	Low	127 Å²	127	89.7 Å²	89.7	83%	0.825	57%	0.566	S	S	*	*			trans	-65.7	106.5	170.9	28	-32.2	0	0	0	107.9	S61	P59-S61 PolarHBondContact O-N 3.47Å
60	L	33	Very low	57.2	Low	160 Å²	160	83.7 Å²	83.7	84%	0.838	53%	0.525	S	S	*	.			trans	-57	113	168.7	-79.3	161.4	0	0	0	107.2	S58 S62	S58-L60 PolarHBondContact O-N 2.68Å; L60-S62 VanDerWaalsContact C-N 3.29Å; L60-S62 PolarHBondContact O-N 3.44Å
61	S	36.8	Very low	60.1	Low	117 Å²	117	78.4 Å²	78.4	82%	0.818	49%	0.488	S	S	*	.			trans	-64.8	93.5	172.8	45.9	0	0	0	0	108.2	P59 R63	P59-S61 PolarHBondContact O-N 3.47Å; S61-R63 PolarHBondContact O-N 3.18Å
62	S	56.3	Low	63.1	Low	78 Å²	78	73 Å²	73	55%	0.545	45%	0.452	S	S	.	.			trans	-62.5	103.6	-174.6	46.9	0	0	0	0	109.7	L60 F64	L60-S62 VanDerWaalsContact C-N 3.29Å; L60-S62 PolarHBondContact O-N 3.44Å; S62-F64 WeakPolarHBondContact O-CD2 3.39Å; S62-F64 PolarHBondContact O-N 3.27Å; S62-F64 VanDerWaalsContact O-N 3.16Å
63	R	81.5	Confident	65.9	Low	134 Å²	134	67.5 Å²	67.5	51%	0.506	42%	0.416	S	S	.	.			trans	-63.2	117.2	177.4	178.5	-178.3	170.9	-146.1	-7.9	108.4	S61 D211 D304	S61-R63 PolarHBondContact O-N 3.18Å; R63-D211 IonicContact NH2-OD1 2.93Å; R63-D211 PolarHBondContact NH2-OD1 3.35Å; R63-D304 IonicContact CZ-OD1 3.82Å; R63-D304 IonicContact NH1-OD1 3.83Å; R63-D304 PolarHBondContact NH1-OD1 3.04Å
64	F	90.1	Very high	68.6	Low	59 Å²	59	61.9 Å²	61.9	26%	0.259	38%	0.38	S	S	.	.			trans	-74.1	126.2	172.7	-74.6	-90.7	0	0	0	110.6	S62 T66 E129 A141 R143	S62-F64 WeakPolarHBondContact O-CD2 3.39Å; S62-F64 PolarHBondContact O-N 3.27Å; S62-F64 VanDerWaalsContact O-N 3.16Å; F64-T66 PolarHBondContact O-N 2.88Å; F64-E129 HydrophobicContact CD1-CB 4.37Å; F64-E129 HydrophobicContact CD1-CG 4.16Å; F64-E129 HydrophobicContact CE1-CB 3.81Å; F64-E129 HydrophobicContact CE1-CG 3.91Å; F64-A141 CarbonylContact C-O 3.51Å; F64-A141 WeakPolarHBondContact CA-O 3.43Å; F64-A141 HydrophobicContact CD1-CB 3.7Å; F64-A141 HydrophobicContact CE1-CB 3.74Å; F64-A141 HydrophobicContact CG-CB 4.15Å; F64-A141 HydrophobicContact CZ-CB 4.23Å; F64-R143 HydrophobicContact CB-CB 4.23Å; F64-R143 HydrophobicContact CD1-CB 4.38Å
65	F	94.3	Very high	71.6	Confident	15 Å²	15	57.1 Å²	57.1	7%	0.066	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	110.2	164.5	-64.9	-83.7	0	0	0	108.7	I67 I140 A141 F142 R143 A300 I303 D304	F65-I67 HydrophobicContact CB-CD1 4.07Å; F65-I67 HydrophobicContact CB-CG1 4.43Å; F65-I67 PolarHBondContact O-N 3.09Å; F65-I140 HydrophobicContact CD2-CG2 3.66Å; F65-I140 HydrophobicContact CE2-CG2 3.63Å; F65-A141 WeakPolarHBondContact CD2-O 3.18Å; F65-A141 PolarHBondContact N-O 3.04Å; F65-F142 HydrophobicContact CB-CD1 3.94Å; F65-F142 HydrophobicContact CB-CE1 4.22Å; F65-F142 WeakPolarHBondContact O-CA 3.49Å; F65-R143 PolarHBondContact O-N 2.89Å; F65-A300 HydrophobicContact CD1-CB 4.25Å; F65-A300 HydrophobicContact CD2-CB 4.12Å; F65-A300 HydrophobicContact CE1-CB 4.26Å; F65-A300 HydrophobicContact CE2-CB 4.16Å; F65-A300 HydrophobicContact CG-CB 4.18Å; F65-A300 HydrophobicContact CZ-CB 4.21Å; F65-I303 HydrophobicContact CD1-CB 4.07Å; F65-I303 HydrophobicContact CD1-CD1 3.82Å; F65-I303 HydrophobicContact CD1-CG2 3.86Å; F65-I303 HydrophobicContact CE1-CB 3.97Å; F65-I303 HydrophobicContact CE1-CG2 3.73Å; F65-D304 HydrophobicContact CE1-CB 4.48Å; F65-D304 WeakPolarHBondContact CE1-OD1 3.44Å; F65-D304 HydrophobicContact CZ-CB 4.45Å; F65-D304 WeakPolarHBondContact CZ-OD2 3.21Å
66	T	96.7	Very high	74.3	Confident	9 Å²	9	55.8 Å²	55.8	6%	0.055	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	105.4	178.2	-58.8	0	0	0	0	109.5	F64 R143 A208 V209 V210 D211	F64-T66 PolarHBondContact O-N 2.88Å; T66-R143 CarbonylContact C-O 3.57Å; T66-R143 WeakPolarHBondContact CA-O 3.4Å; T66-A208 HydrophobicContact CG2-CB 4Å; T66-V209 VanDerWaalsContact CB-O 3.22Å; T66-V209 WeakPolarHBondContact CB-O 3.3Å; T66-V210 CarbonylContact O-C 3.21Å; T66-V210 WeakPolarHBondContact O-CA 3.29Å; T66-D211 PolarHBondContact N-OD2 3.4Å; T66-D211 PolarHBondContact O-N 3.16Å
67	I	97.8	Very high	77.2	Confident	1 Å²	1	59.7 Å²	59.7	1%	0.005	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	131.3	-175	-54.5	-48.9	0	0	0	110.5	F65 F142 R143 L144 V145 V214 F296 L299 I303	F65-I67 HydrophobicContact CB-CD1 4.07Å; F65-I67 HydrophobicContact CB-CG1 4.43Å; F65-I67 PolarHBondContact O-N 3.09Å; I67-F142 HydrophobicContact CG1-CD1 3.98Å; I67-F142 HydrophobicContact CG1-CE1 4.46Å; I67-R143 PolarHBondContact N-O 3.37Å; I67-L144 HydrophobicContact CB-CD1 4.18Å; I67-L144 HydrophobicContact CG2-CD1 4.36Å; I67-V145 PolarHBondContact O-N 2.88Å; I67-V214 HydrophobicContact CG2-CG2 3.78Å; I67-F296 HydrophobicContact CB-CD1 4.34Å; I67-F296 HydrophobicContact CG1-CD1 4.39Å; I67-F296 HydrophobicContact CG2-CD1 3.92Å; I67-F296 HydrophobicContact CG2-CE1 3.9Å; I67-L299 HydrophobicContact CD1-CD2 3.68Å; I67-L299 HydrophobicContact CD1-CG 3.96Å; I67-L299 HydrophobicContact CG1-CD2 4.26Å; I67-L299 HydrophobicContact CG2-CD2 3.63Å; I67-I303 HydrophobicContact CD1-CD1 3.75Å
68	A	98.3	Very high	80.1	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	121.9	171.2	0	0	0	0	0	110.9	I70 V145 V210 G212 F213 V214	A68-I70 HydrophobicContact CB-CG2 4.32Å; A68-V145 CarbonylContact C-O 3.55Å; A68-V145 WeakPolarHBondContact CA-O 3.44Å; A68-V210 HydrophobicContact CB-CB 4.49Å; A68-V210 HydrophobicContact CB-CG1 3.67Å; A68-V210 HydrophobicContact CB-CG2 3.94Å; A68-G212 PolarHBondContact N-O 3.47Å; A68-G212 VanDerWaalsContact N-O 3.11Å; A68-F213 HydrophobicContact CB-CD1 3.73Å; A68-F213 HydrophobicContact CB-CE1 3.86Å; A68-F213 CarbonylContact O-C 3.57Å; A68-F213 WeakPolarHBondContact O-CA 3.45Å; A68-V214 PolarHBondContact O-N 3.43Å
69	V	98.5	Very high	83.1	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	122.8	171.6	-173.3	0	0	0	0	108.6	K86 C90 L144 V145 Q147 V214 V216 F296	V69-K86 HydrophobicContact CG1-CB 4.15Å; V69-K86 HydrophobicContact CG1-CG 4.44Å; V69-C90 VanDerWaalsContact CG2-SG 3.51Å; V69-L144 HydrophobicContact CG2-CD1 3.69Å; V69-L144 HydrophobicContact CG2-CG 4.48Å; V69-V145 PolarHBondContact N-O 3.1Å; V69-Q147 PolarHBondContact O-N 3.09Å; V69-V214 WeakPolarHBondContact CA-O 3.47Å; V69-V214 HydrophobicContact CG1-CG1 4.42Å; V69-V214 HydrophobicContact CG2-CB 4.22Å; V69-V216 HydrophobicContact CG1-CG2 3.59Å; V69-F296 HydrophobicContact CG2-CE1 4.08Å; V69-F296 HydrophobicContact CG2-CZ 4.14Å
70	I	98.3	Very high	85.8	Confident	0 Å²	0	49 Å²	49	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	157.3	-172.1	70.8	176.1	0	0	0	109.7	A68 Q147 C173 F213 V214 C215 V216 L237 V241	A68-I70 HydrophobicContact CB-CG2 4.32Å; I70-Q147 HydrophobicContact CG2-CB 4.04Å; I70-Q147 HydrophobicContact CG2-CG 4.21Å; I70-C173 HydrophobicContact CB-CB 4.43Å; I70-C173 HydrophobicContact CG2-CB 4.24Å; I70-C173 WeakPolarHBondContact CG2-O 3.31Å; I70-F213 HydrophobicContact CD1-CB 4.12Å; I70-F213 HydrophobicContact CD1-CD1 3.88Å; I70-F213 HydrophobicContact CD1-CG 4.21Å; I70-F213 HydrophobicContact CG2-CD1 3.79Å; I70-F213 HydrophobicContact CG2-CE1 4.3Å; I70-V214 PolarHBondContact N-O 3.32Å; I70-C215 HydrophobicContact CG1-CB 4.41Å; I70-V216 PolarHBondContact O-N 3.31Å; I70-L237 HydrophobicContact CD1-CD1 3.92Å; I70-L237 HydrophobicContact CD1-CD2 4.24Å; I70-L237 HydrophobicContact CD1-CG 4.1Å; I70-L237 HydrophobicContact CG1-CD1 4.45Å; I70-L237 HydrophobicContact CG1-CD2 4.17Å; I70-V241 HydrophobicContact CD1-CG2 3.4Å
71	G	96.8	Very high	88.3	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	163.5	-178.5	-178.9	0	0	0	0	0	111.2	S73 Y169	G71-S73 PolarHBondContact O-N 2.86Å; G71-S73 VanDerWaalsContact O-N 3.14Å; G71-S73 PolarHBondContact O-OG 3.31Å; G71-Y169 PolarHBondContact N-OH 3.46Å; G71-Y169 VanDerWaalsContact N-OH 3.13Å; G71-Y169 WeakPolarHBondContact O-CE1 3.46Å; G71-Y169 PolarHBondContact O-OH 3.49Å
72	L	96.4	Very high	90.9	Very high	5 Å²	5	44.6 Å²	44.6	3%	0.026	21%	0.212	C	C	.	.	S	Bend	trans	-55.2	124.1	-178.8	-179.3	66.5	0	0	0	111.7	K79 V84 R225 F233	L72-K79 HydrophobicContact CD2-CB 4.46Å; L72-K79 HydrophobicContact CG-CB 4.15Å; L72-V84 HydrophobicContact CB-CG1 3.82Å; L72-V84 HydrophobicContact CD2-CG1 4.46Å; L72-V84 WeakPolarHBondContact O-CG2 3.48Å; L72-R225 HydrophobicContact CD2-CG 4.32Å; L72-F233 VanDerWaalsContact CA-CE1 3.43Å; L72-F233 HydrophobicContact CB-CD1 4.03Å; L72-F233 HydrophobicContact CB-CE1 4.03Å; L72-F233 HydrophobicContact CD1-CB 4.18Å; L72-F233 HydrophobicContact CD1-CD1 3.84Å; L72-F233 HydrophobicContact CD1-CD2 3.51Å; L72-F233 HydrophobicContact CD1-CE1 4.03Å; L72-F233 HydrophobicContact CD1-CE2 3.68Å; L72-F233 HydrophobicContact CD1-CG 3.57Å; L72-F233 HydrophobicContact CD1-CZ 3.92Å
73	S	95.1	Very high	92.7	Very high	3 Å²	3	42.3 Å²	42.3	2%	0.021	20%	0.201	C	C	.	.			trans	-151.4	152.4	-172.1	-52.9	0	0	0	0	107.6	G71 K86 Y169	G71-S73 PolarHBondContact O-N 2.86Å; G71-S73 VanDerWaalsContact O-N 3.14Å; G71-S73 PolarHBondContact O-OG 3.31Å; S73-K86 VanDerWaalsContact OG-CE 3.26Å; S73-K86 WeakPolarHBondContact OG-CE 3.45Å; S73-K86 PolarHBondContact OG-NZ 3.49Å; S73-Y169 VanDerWaalsContact CB-CE2 3.43Å; S73-Y169 WeakPolarHBondContact OG-CE2 3.4Å; S73-Y169 PolarHBondContact OG-OH 3.45Å
74	G	92.4	Very high	93.4	Very high	1 Å²	1	36 Å²	36	1%	0.01	18%	0.177	C	C	.	.	S	Bend	trans	147.3	-158.9	-176.5	0	0	0	0	0	112	K79	G74-K79 VanDerWaalsContact O-CD 3.29Å; G74-K79 WeakPolarHBondContact O-CD 3.22Å; G74-K79 VanDerWaalsContact O-CE 3.27Å; G74-K79 WeakPolarHBondContact O-CE 3.39Å; G74-K79 PolarHBondContact O-NZ 2.88Å
75	T	92.9	Very high	93.7	Very high	16 Å²	16	33.9 Å²	33.9	10%	0.098	17%	0.172	C	C	.	.	S	Bend	trans	-67.2	166.3	169.5	65.7	0	0	0	0	112.2	R77 E78 K79 V151 P158	T75-R77 PolarHBondContact O-N 2.65Å; T75-E78 WeakPolarHBondContact CB-OE2 3.43Å; T75-E78 PolarHBondContact N-OE2 3.16Å; T75-E78 PolarHBondContact O-N 3.32Å; T75-E78 PolarHBondContact OG1-OE2 3.27Å; T75-K79 PolarHBondContact O-N 3.26Å; T75-V151 HydrophobicContact CG2-CG2 4.32Å; T75-P158 HydrophobicContact CG2-CG 4.13Å
76	E	88.2	Confident	93.8	Very high	111 Å²	111	33.7 Å²	33.7	52%	0.519	17%	0.171	S	C	.	.	H	α-helix	trans	-57.1	-31.8	173.9	-162.1	-168.3	130.4	0	0	112.4	E78 G80 L81	E76-E78 PolarHBondContact O-N 3.38Å; E76-G80 CarbonylContact O-C 3.6Å; E76-G80 WeakPolarHBondContact O-CA 3.4Å; E76-G80 PolarHBondContact O-N 2.83Å; E76-L81 HydrophobicContact CG-CD2 4.26Å; E76-L81 HydrophobicContact CG-CG 4.46Å; E76-L81 WeakPolarHBondContact OE1-CD2 3.4Å
77	R	88.6	Confident	93.9	Very high	211 Å²	211	34.2 Å²	34.2	80%	0.796	18%	0.175	S	C	*	.	H	α-helix	trans	-64.6	-25.7	175.9	-63.7	-178	178	-176	0.3	113.3	T75 R229	T75-R77 PolarHBondContact O-N 2.65Å; R77-R229 PolarHBondContact O-NH1 2.9Å
78	E	89.2	Confident	93.9	Very high	89 Å²	89	34.9 Å²	34.9	42%	0.416	18%	0.18	S	C	.	.	H	α-helix	trans	-97.8	-48.8	-176.3	-67.1	160.6	119.6	0	0	111.6	T75 E76	T75-E78 WeakPolarHBondContact CB-OE2 3.43Å; T75-E78 PolarHBondContact N-OE2 3.16Å; T75-E78 PolarHBondContact O-N 3.32Å; T75-E78 PolarHBondContact OG1-OE2 3.27Å; E76-E78 PolarHBondContact O-N 3.38Å
79	K	90.4	Very high	93.9	Very high	17 Å²	17	34.9 Å²	34.9	7%	0.074	18%	0.18	C	C	.	.	H	α-helix	trans	-93.8	-10.7	-177.1	80.7	-164.7	168.8	-156	0	114.5	L72 G74 T75 S107 R225	L72-K79 HydrophobicContact CD2-CB 4.46Å; L72-K79 HydrophobicContact CG-CB 4.15Å; G74-K79 VanDerWaalsContact O-CD 3.29Å; G74-K79 WeakPolarHBondContact O-CD 3.22Å; G74-K79 VanDerWaalsContact O-CE 3.27Å; G74-K79 WeakPolarHBondContact O-CE 3.39Å; G74-K79 PolarHBondContact O-NZ 2.88Å; T75-K79 PolarHBondContact O-N 3.26Å; K79-S107 PolarHBondContact NZ-OG 2.94Å; K79-R225 WeakPolarHBondContact O-CD 3.45Å; K79-R225 PolarHBondContact O-NH1 3.45Å
80	G	89.4	Confident	93.9	Very high	2 Å²	2	34.9 Å²	34.9	2%	0.021	18%	0.18	C	C	.	.			trans	78	-177.1	-167.2	0	0	0	0	0	112.6	E76 V82	E76-G80 CarbonylContact O-C 3.6Å; E76-G80 WeakPolarHBondContact O-CA 3.4Å; E76-G80 PolarHBondContact O-N 2.83Å; G80-V82 PolarHBondContact O-N 3.35Å
81	L	87.2	Confident	93.8	Very high	109 Å²	109	34.9 Å²	34.9	57%	0.571	18%	0.18	S	C	*	.	S	Bend	trans	-59.5	-26.4	179.2	-77.4	162.5	0	0	0	114	E76 P223	E76-L81 HydrophobicContact CG-CD2 4.26Å; E76-L81 HydrophobicContact CG-CG 4.46Å; E76-L81 WeakPolarHBondContact OE1-CD2 3.4Å; L81-P223 HydrophobicContact CD1-CB 4.39Å
82	V	91.3	Very high	93.8	Very high	76 Å²	76	35 Å²	35	46%	0.461	18%	0.18	S	C	.	.	S	Bend	trans	-128.8	125.3	-174.5	-168.4	0	0	0	0	110.4	G80 V222 R225	G80-V82 PolarHBondContact O-N 3.35Å; V82-V222 HydrophobicContact CB-CG1 4.46Å; V82-R225 PolarHBondContact O-NH1 3.04Å
83	G	93.1	Very high	93.8	Very high	31 Å²	31	34.9 Å²	34.9	32%	0.32	18%	0.179	S	C	.	.			trans	-62.4	160.3	175.8	0	0	0	0	0	113.2	G85 K254	G83-G85 PolarHBondContact O-N 3.03Å; G83-K254 WeakPolarHBondContact O-CE 3.46Å; G83-K254 PolarHBondContact O-NZ 3.33Å
84	V	96	Very high	93.9	Very high	1 Å²	1	35.7 Å²	35.7	1%	0.006	18%	0.184	C	C	.	.			trans	-70.5	12.1	-176.2	-58.9	0	0	0	0	115.6	L72 K86 V216 D218 T253	L72-V84 HydrophobicContact CB-CG1 3.82Å; L72-V84 HydrophobicContact CD2-CG1 4.46Å; L72-V84 WeakPolarHBondContact O-CG2 3.48Å; V84-K86 HydrophobicContact CG2-CD 4.3Å; V84-K86 HydrophobicContact CG2-CG 3.68Å; V84-V216 HydrophobicContact CB-CG1 4.13Å; V84-V216 HydrophobicContact CG2-CB 4.33Å; V84-V216 HydrophobicContact CG2-CG1 3.76Å; V84-V216 WeakPolarHBondContact O-CG1 3.39Å; V84-D218 HydrophobicContact CB-CB 3.82Å; V84-D218 HydrophobicContact CG1-CB 3.78Å; V84-T253 WeakPolarHBondContact O-CB 3.42Å; V84-T253 PolarHBondContact O-OG1 2.9Å
85	G	96.5	Very high	93.9	Very high	14 Å²	14	37 Å²	37	14%	0.144	19%	0.189	C	C	.	.	S	Bend	trans	81.4	13.9	176.3	0	0	0	0	0	116.3	G83 S87 C88 L89	G83-G85 PolarHBondContact O-N 3.03Å; G85-S87 PolarHBondContact O-N 3.01Å; G85-C88 PolarHBondContact O-N 3.4Å; G85-L89 PolarHBondContact O-N 2.88Å
86	K	97.6	Very high	93.8	Very high	11 Å²	11	38.3 Å²	38.3	5%	0.048	20%	0.198	C	C	.	.	H	α-helix	trans	-51.3	-56.3	175.9	-56.3	-170.4	-47.3	-64.7	0	111.9	V69 S73 V84 C88 L89 C90 E146 Q147 T148 V216	V69-K86 HydrophobicContact CG1-CB 4.15Å; V69-K86 HydrophobicContact CG1-CG 4.44Å; S73-K86 VanDerWaalsContact OG-CE 3.26Å; S73-K86 WeakPolarHBondContact OG-CE 3.45Å; S73-K86 PolarHBondContact OG-NZ 3.49Å; V84-K86 HydrophobicContact CG2-CD 4.3Å; V84-K86 HydrophobicContact CG2-CG 3.68Å; K86-C88 PolarHBondContact O-N 3.01Å; K86-L89 WeakPolarHBondContact O-CB 3.27Å; K86-L89 PolarHBondContact O-N 3.15Å; K86-L89 VanDerWaalsContact O-N 3.15Å; K86-C90 PolarHBondContact O-N 3.16Å; K86-C90 PolarHBondContact O-SG 2.91Å; K86-E146 HydrophobicContact CB-CG 3.98Å; K86-E146 VanDerWaalsContact CB-OE1 3.25Å; K86-E146 WeakPolarHBondContact CB-OE1 3.12Å; K86-E146 HydrophobicContact CD-CG 4.46Å; K86-E146 WeakPolarHBondContact CE-OE1 3.33Å; K86-E146 IonicContact NZ-OE1 2.69Å; K86-E146 PolarHBondContact NZ-OE1 3.44Å; K86-Q147 WeakPolarHBondContact CE-O 3.32Å; K86-T148 PolarHBondContact NZ-OG1 3.13Å; K86-V216 HydrophobicContact CG-CB 4.19Å; K86-V216 HydrophobicContact CG-CG1 4.37Å; K86-V216 HydrophobicContact CG-CG2 4.24Å
87	S	97.8	Very high	94	Very high	21 Å²	21	35.1 Å²	35.1	15%	0.147	18%	0.184	C	C	.	.	H	α-helix	trans	-59.3	-41.6	-179.6	-47.2	0	0	0	0	113.1	G85 C90 N91 W127 E146	G85-S87 PolarHBondContact O-N 3.01Å; S87-C90 PolarHBondContact O-N 3.35Å; S87-N91 VanDerWaalsContact O-CB 3.26Å; S87-N91 WeakPolarHBondContact O-CB 3.43Å; S87-N91 PolarHBondContact O-N 2.71Å; S87-W127 WeakPolarHBondContact O-CH2 3.09Å; S87-W127 WeakPolarHBondContact O-CZ2 3.42Å; S87-E146 WeakPolarHBondContact CA-OE2 3.45Å; S87-E146 WeakPolarHBondContact CB-OE2 3.43Å; S87-E146 PolarHBondContact N-OE2 3.03Å; S87-E146 VanDerWaalsContact OG-CD 3.24Å; S87-E146 PolarHBondContact OG-OE1 3.49Å; S87-E146 PolarHBondContact OG-OE2 3.42Å
88	C	97.9	Very high	94.2	Very high	15 Å²	15	27.8 Å²	27.8	10%	0.101	16%	0.159	C	C	.	.	H	α-helix	trans	-62.9	-44.1	174.7	-67.1	0	0	0	0	112.1	G85 K86 N91 R92 Y101 T103 A286	G85-C88 PolarHBondContact O-N 3.4Å; K86-C88 PolarHBondContact O-N 3.01Å; C88-N91 PolarHBondContact O-N 2.94Å; C88-R92 WeakPolarHBondContact O-CB 3.26Å; C88-R92 PolarHBondContact O-N 3.39Å; C88-Y101 HydrophobicContact CB-CE2 4.47Å; C88-T103 PolarHBondContact SG-O 2.89Å; C88-A286 HydrophobicContact CB-CB 3.71Å
89	L	98.1	Very high	94.4	Very high	0 Å²	0	27 Å²	27	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-62.4	-43.1	176	179	64.1	0	0	0	111.2	G85 K86 F93 V214 V216 T251 T253 T292 F296	G85-L89 PolarHBondContact O-N 2.88Å; K86-L89 WeakPolarHBondContact O-CB 3.27Å; K86-L89 PolarHBondContact O-N 3.15Å; K86-L89 VanDerWaalsContact O-N 3.15Å; L89-F93 WeakPolarHBondContact O-CB 3.48Å; L89-F93 PolarHBondContact O-N 2.88Å; L89-V214 HydrophobicContact CD2-CG1 4.07Å; L89-V216 HydrophobicContact CD2-CG2 3.96Å; L89-T251 HydrophobicContact CD2-CG2 3.88Å; L89-T253 HydrophobicContact CB-CG2 4.45Å; L89-T253 HydrophobicContact CD2-CG2 4.26Å; L89-T292 HydrophobicContact CD1-CG2 3.99Å; L89-F296 HydrophobicContact CD1-CE2 4.48Å; L89-F296 HydrophobicContact CG-CE2 4.42Å; L89-F296 HydrophobicContact CG-CZ 4.48Å
90	C	98.1	Very high	94.4	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-63.2	-47.1	175.6	-65	0	0	0	0	112.5	V69 K86 S87 F93 V94 W127 L144	V69-C90 VanDerWaalsContact CG2-SG 3.51Å; K86-C90 PolarHBondContact O-N 3.16Å; K86-C90 PolarHBondContact O-SG 2.91Å; S87-C90 PolarHBondContact O-N 3.35Å; C90-F93 PolarHBondContact O-N 3.21Å; C90-V94 PolarHBondContact O-N 3.36Å; C90-W127 HydrophobicContact CB-CB 4.46Å; C90-W127 HydrophobicContact CB-CD2 3.53Å; C90-W127 VanDerWaalsContact CB-CE2 3.41Å; C90-W127 HydrophobicContact CB-CE3 4.24Å; C90-W127 HydrophobicContact CB-CG 3.62Å; C90-W127 HydrophobicContact CB-CZ2 4Å; C90-L144 HydrophobicContact CB-CD2 3.6Å
91	N	97.4	Very high	94.6	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-62	-49.6	179.7	-175.7	-99.6	0	0	0	110.8	S87 C88 F93 V94 R95 Y101 R102 W127	S87-N91 VanDerWaalsContact O-CB 3.26Å; S87-N91 WeakPolarHBondContact O-CB 3.43Å; S87-N91 PolarHBondContact O-N 2.71Å; C88-N91 PolarHBondContact O-N 2.94Å; N91-F93 VanDerWaalsContact C-N 3.29Å; N91-F93 PolarHBondContact O-N 3.18Å; N91-V94 PolarHBondContact O-N 3.31Å; N91-R95 WeakPolarHBondContact O-CA 3.27Å; N91-R95 WeakPolarHBondContact O-CB 3.09Å; N91-R95 PolarHBondContact O-N 3.06Å; N91-Y101 HydrophobicContact CB-CD2 4.44Å; N91-Y101 VanDerWaalsContact OD1-CA 3.27Å; N91-Y101 WeakPolarHBondContact OD1-CA 3.46Å; N91-Y101 WeakPolarHBondContact OD1-CD2 3.39Å; N91-R102 PolarHBondContact OD1-N 3.43Å; N91-W127 HydrophobicContact CB-CE3 4.43Å; N91-W127 HydrophobicContact CB-CH2 3.65Å; N91-W127 HydrophobicContact CB-CZ3 3.54Å
92	R	96.5	Very high	94.9	Very high	3 Å²	3	35.4 Å²	35.4	1%	0.011	18%	0.18	C	C	.	.	H	α-helix	trans	-64.3	-32.6	177	-174.9	61.9	77.2	168.9	9.2	112.5	C88 R95 P96 E98 Y101 A286 H287 T292	C88-R92 WeakPolarHBondContact O-CB 3.26Å; C88-R92 PolarHBondContact O-N 3.39Å; R92-R95 CarbonylContact O-C 3.58Å; R92-P96 PolarHBondContact NH1-O 3.33Å; R92-P96 VanDerWaalsContact O-CA 3.29Å; R92-P96 WeakPolarHBondContact O-CA 3.14Å; R92-E98 IonicContact CZ-OE2 2.8Å; R92-E98 IonicContact NH1-OE2 2.92Å; R92-E98 PolarHBondContact NH1-OE2 2.86Å; R92-E98 IonicContact NH2-OE1 3.26Å; R92-E98 PolarHBondContact NH2-OE1 3.02Å; R92-E98 IonicContact NH2-OE2 3.57Å; R92-E98 PolarHBondContact NH2-OE2 2.96Å; R92-Y101 HydrophobicContact CB-CD2 3.81Å; R92-Y101 HydrophobicContact CB-CE2 3.75Å; R92-Y101 VanDerWaalsContact CZ-CG 3.41Å; R92-A286 HydrophobicContact CB-CB 4.21Å; R92-A286 PolarHBondContact NE-O 3.34Å; R92-A286 PolarHBondContact NH2-O 2.92Å; R92-H287 PolarHBondContact NH2-O 3.46Å; R92-T292 HydrophobicContact CB-CG2 4.31Å; R92-T292 HydrophobicContact CG-CG2 3.81Å
93	F	96.8	Very high	95	Very high	1 Å²	1	36.1 Å²	36.1	0%	0.004	19%	0.185	C	C	.	.	H	α-helix	trans	-67.7	-52.2	172.8	-178.9	-102.1	0	0	0	111.9	L89 C90 N91 R130 V132 F142 L144 E293 F296	L89-F93 WeakPolarHBondContact O-CB 3.48Å; L89-F93 PolarHBondContact O-N 2.88Å; C90-F93 PolarHBondContact O-N 3.21Å; N91-F93 VanDerWaalsContact C-N 3.29Å; N91-F93 PolarHBondContact O-N 3.18Å; F93-R130 HydrophobicContact CE1-CB 4.25Å; F93-R130 WeakPolarHBondContact O-CD 3.38Å; F93-R130 PolarHBondContact O-NE 3.27Å; F93-R130 PolarHBondContact O-NH1 3.14Å; F93-V132 HydrophobicContact CE2-CG2 3.96Å; F93-V132 HydrophobicContact CZ-CG2 3.77Å; F93-F142 HydrophobicContact CE1-CB 3.95Å; F93-F142 HydrophobicContact CE1-CD2 4.38Å; F93-F142 HydrophobicContact CE1-CG 4.15Å; F93-F142 HydrophobicContact CZ-CB 4.18Å; F93-F142 HydrophobicContact CZ-CD1 4.46Å; F93-F142 AromaticContact CZ-CD2 3.76Å; F93-F142 HydrophobicContact CZ-CD2 3.76Å; F93-F142 HydrophobicContact CZ-CE2 4.2Å; F93-F142 AromaticContact CZ-CG 3.89Å; F93-F142 HydrophobicContact CZ-CG 3.89Å; F93-L144 HydrophobicContact CD1-CD2 4.12Å; F93-E293 HydrophobicContact CD2-CB 4.41Å; F93-E293 HydrophobicContact CD2-CG 4.19Å; F93-E293 HydrophobicContact CE2-CB 4.29Å; F93-E293 HydrophobicContact CE2-CG 4.32Å; F93-F296 HydrophobicContact CB-CD2 4.21Å; F93-F296 HydrophobicContact CB-CE2 3.7Å; F93-F296 HydrophobicContact CB-CZ 4.18Å; F93-F296 HydrophobicContact CD1-CD1 4.49Å; F93-F296 HydrophobicContact CD1-CD2 4.25Å; F93-F296 HydrophobicContact CD1-CE2 4.29Å; F93-F296 HydrophobicContact CD1-CG 4.35Å; F93-F296 HydrophobicContact CD1-CZ 4.44Å; F93-F296 HydrophobicContact CD2-CB 4.28Å; F93-F296 AromaticContact CD2-CD2 3.21Å; F93-F296 HydrophobicContact CD2-CD2 3.21Å; F93-F296 AromaticContact CD2-CE2 3.65Å; F93-F296 HydrophobicContact CD2-CE2 3.65Å; F93-F296 AromaticContact CD2-CG 3.81Å; F93-F296 HydrophobicContact CD2-CG 3.81Å; F93-F296 HydrophobicContact CE1-CD1 4.4Å; F93-F296 HydrophobicContact CE1-CD2 4.48Å; F93-F296 HydrophobicContact CE1-CG 4.2Å; F93-F296 HydrophobicContact CE2-CB 3.64Å; F93-F296 AromaticContact CE2-CD2 3.52Å; F93-F296 HydrophobicContact CE2-CD2 3.52Å; F93-F296 HydrophobicContact CE2-CE2 4.35Å; F93-F296 AromaticContact CE2-CG 3.65Å; F93-F296 HydrophobicContact CE2-CG 3.65Å; F93-F296 AromaticContact CG-CD2 3.61Å; F93-F296 HydrophobicContact CG-CD2 3.61Å; F93-F296 AromaticContact CG-CE2 3.59Å; F93-F296 HydrophobicContact CG-CE2 3.59Å; F93-F296 HydrophobicContact CG-CG 4.15Å; F93-F296 HydrophobicContact CG-CZ 4.12Å; F93-F296 HydrophobicContact CZ-CB 3.78Å; F93-F296 HydrophobicContact CZ-CD1 4.44Å; F93-F296 HydrophobicContact CZ-CD2 4.14Å; F93-F296 AromaticContact CZ-CG 3.85Å; F93-F296 HydrophobicContact CZ-CG 3.85Å
94	V	95.5	Very high	94.8	Very high	20 Å²	20	38.6 Å²	38.6	12%	0.121	19%	0.191	C	C	.	.	H	α-helix	trans	-72.2	-32.7	-176.8	178.6	0	0	0	0	112	C90 N91 W127 L144	C90-V94 PolarHBondContact O-N 3.36Å; N91-V94 PolarHBondContact O-N 3.31Å; V94-W127 HydrophobicContact CG2-CB 4.19Å; V94-L144 HydrophobicContact CG2-CB 4.19Å; V94-L144 HydrophobicContact CG2-CD2 3.72Å
95	R	93.1	Very high	94.7	Very high	30 Å²	30	39.7 Å²	39.7	11%	0.113	20%	0.196	C	C	.	.			trans	-127.1	82.4	-176.7	-59.8	-178.2	-177	90.6	8.6	109.1	N91 R92 L97 R100 M185 Y186	N91-R95 WeakPolarHBondContact O-CA 3.27Å; N91-R95 WeakPolarHBondContact O-CB 3.09Å; N91-R95 PolarHBondContact O-N 3.06Å; R92-R95 CarbonylContact O-C 3.58Å; R95-L97 PolarHBondContact O-N 3.46Å; R95-R100 HydrophobicContact CB-CB 3.93Å; R95-M185 PolarHBondContact NH2-SD 2.87Å; R95-M185 VanDerWaalsContact NH2-SD 3.43Å; R95-Y186 PolarHBondContact NH1-O 2.93Å
96	P	91.3	Very high	94.5	Very high	43 Å²	43	42.4 Å²	42.4	28%	0.279	21%	0.207	S	C	.	.			trans	-70.9	-30	-173.8	28	-36.5	0	0	0	113.9	R92	R92-P96 PolarHBondContact NH1-O 3.33Å; R92-P96 VanDerWaalsContact O-CA 3.29Å; R92-P96 WeakPolarHBondContact O-CA 3.14Å
97	L	91.8	Very high	94.2	Very high	43 Å²	43	43.3 Å²	43.3	23%	0.225	21%	0.214	C	C	.	.	S	Bend	trans	-65.6	139.1	-177.4	-52.6	-179.3	0	0	0	111.7	V17 R95 D99 R100 Y101 D366	V17-L97 HydrophobicContact CG1-CD2 4.04Å; R95-L97 PolarHBondContact O-N 3.46Å; L97-D99 PolarHBondContact O-N 3.18Å; L97-R100 PolarHBondContact O-N 2.82Å; L97-Y101 PolarHBondContact O-N 3.16Å; L97-D366 HydrophobicContact CD2-CB 3.87Å
98	E	93.4	Very high	94.1	Very high	58 Å²	58	44.5 Å²	44.5	27%	0.271	22%	0.221	S	C	.	.	G	3₁₀ helix	trans	-62	-45.4	-170.9	-164.6	60.8	-151.8	0	0	113.3	R92 R100 Y101 D366	R92-E98 IonicContact CZ-OE2 2.8Å; R92-E98 IonicContact NH1-OE2 2.92Å; R92-E98 PolarHBondContact NH1-OE2 2.86Å; R92-E98 IonicContact NH2-OE1 3.26Å; R92-E98 PolarHBondContact NH2-OE1 3.02Å; R92-E98 IonicContact NH2-OE2 3.57Å; R92-E98 PolarHBondContact NH2-OE2 2.96Å; E98-R100 PolarHBondContact O-N 3.45Å; E98-Y101 PolarHBondContact O-N 3.43Å; E98-D366 PolarHBondContact N-O 2.63Å; E98-D366 VanDerWaalsContact N-O 3.12Å
99	D	92.2	Very high	93.9	Very high	72 Å²	72	44 Å²	44	39%	0.385	22%	0.217	S	C	.	.	G	3₁₀ helix	trans	-62.2	-13.8	177.4	-77.8	-20.6	0	0	0	113.9	L97 G369 R370	L97-D99 PolarHBondContact O-N 3.18Å; D99-G369 WeakPolarHBondContact OD1-CA 3.35Å; D99-R370 PolarHBondContact OD1-N 3.4Å; D99-R370 WeakPolarHBondContact OD2-CD 3.49Å; D99-R370 WeakPolarHBondContact OD2-CG 3.31Å; D99-R370 PolarHBondContact OD2-N 2.88Å; D99-R370 IonicContact OD2-NE 2.75Å; D99-R370 PolarHBondContact OD2-NE 2.77Å
100	R	91.6	Very high	93.8	Very high	166 Å²	166	45.1 Å²	45.1	63%	0.626	23%	0.225	S	C	*	.	G	3₁₀ helix	trans	-106.4	-6.1	177.9	-61	-172.2	179	-168.2	-0.4	113.5	R95 L97 E98	R95-R100 HydrophobicContact CB-CB 3.93Å; L97-R100 PolarHBondContact O-N 2.82Å; E98-R100 PolarHBondContact O-N 3.45Å
101	Y	94.3	Very high	93.5	Very high	16 Å²	16	49.8 Å²	49.8	6%	0.063	25%	0.247	C	C	.	.			trans	-81.5	140.8	176.2	177.6	-114.5	0	0	0	110.8	C88 N91 R92 L97 E98 T103 A286 H287	C88-Y101 HydrophobicContact CB-CE2 4.47Å; N91-Y101 HydrophobicContact CB-CD2 4.44Å; N91-Y101 VanDerWaalsContact OD1-CA 3.27Å; N91-Y101 WeakPolarHBondContact OD1-CA 3.46Å; N91-Y101 WeakPolarHBondContact OD1-CD2 3.39Å; R92-Y101 HydrophobicContact CB-CD2 3.81Å; R92-Y101 HydrophobicContact CB-CE2 3.75Å; R92-Y101 VanDerWaalsContact CZ-CG 3.41Å; L97-Y101 PolarHBondContact O-N 3.16Å; E98-Y101 PolarHBondContact O-N 3.43Å; Y101-T103 HydrophobicContact CD1-CG2 4.36Å; Y101-T103 HydrophobicContact CE1-CG2 3.7Å; Y101-A286 HydrophobicContact CE2-CB 4.28Å; Y101-A286 WeakPolarHBondContact OH-CB 3.46Å; Y101-A286 PolarHBondContact OH-O 3.42Å; Y101-H287 AromaticContact CE1-ND1 3.94Å; Y101-H287 PolarHBondContact OH-CE1 3.23Å; Y101-H287 PolarHBondContact OH-ND1 2.89Å
102	R	93.3	Very high	93.4	Very high	122 Å²	122	55.4 Å²	55.4	46%	0.46	28%	0.28	S	S	.	.			trans	-126.3	136.6	176.9	-60.3	-63.7	-166.6	173.2	6.6	109.2	N91 H105 C188	N91-R102 PolarHBondContact OD1-N 3.43Å; R102-H105 PolarHBondContact O-NE2 2.82Å; R102-C188 HydrophobicContact CG-CB 4.03Å
103	T	92.1	Very high	93.3	Very high	92 Å²	92	57.2 Å²	57.2	56%	0.564	29%	0.29	S	S	*	.	S	Bend	trans	-92.7	-26.9	-178.7	50.6	0	0	0	0	113.1	C88 Y101	C88-T103 PolarHBondContact SG-O 2.89Å; Y101-T103 HydrophobicContact CD1-CG2 4.36Å; Y101-T103 HydrophobicContact CE1-CG2 3.7Å
104	D	90.5	Very high	93.3	Very high	82 Å²	82	57.1 Å²	57.1	44%	0.439	29%	0.29	S	S	.	.			trans	-104.7	120.2	-176.6	-173.6	11.4	0	0	0	111.1	K189	D104-K189 WeakPolarHBondContact OD2-CE 3.09Å; D104-K189 IonicContact OD2-NZ 3.17Å; D104-K189 PolarHBondContact OD2-NZ 3.22Å
105	H	93.9	Very high	93.2	Very high	25 Å²	25	57.6 Å²	57.6	12%	0.116	30%	0.299	C	S	.	.			trans	-135.8	108.5	-179.6	-71.7	-58.9	0	0	0	108.8	R102 W127 Y186	R102-H105 PolarHBondContact O-NE2 2.82Å; H105-W127 AromaticContact CE1-CH2 3.59Å; H105-W127 AromaticContact ND1-CH2 3.94Å; H105-W127 AromaticContact NE2-CH2 3.75Å; H105-Y186 AromaticContact CE1-CE1 3.85Å; H105-Y186 AromaticContact ND1-CE1 3.39Å; H105-Y186 WeakPolarHBondContact ND1-CE1 3.48Å; H105-Y186 AromaticContact ND1-CZ 3.63Å; H105-Y186 PolarHBondContact ND1-OH 3.37Å
106	I	91.5	Very high	93.3	Very high	71 Å²	71	56.8 Å²	56.8	36%	0.364	30%	0.3	S	S	.	.			trans	-72.2	140.6	-173.3	-158.9	174.5	0	0	0	111.2	T108 L109 K189 L192	I106-T108 WeakPolarHBondContact CD1-O 3.28Å; I106-T108 WeakPolarHBondContact CG1-O 3.45Å; I106-L109 HydrophobicContact CG2-CD2 3.61Å; I106-K189 HydrophobicContact CB-CB 4.07Å; I106-K189 HydrophobicContact CG2-CB 3.64Å; I106-L192 HydrophobicContact CG2-CD1 4.35Å
107	S	91.9	Very high	93.5	Very high	29 Å²	29	57.2 Å²	57.2	20%	0.203	30%	0.303	C	S	.	.			trans	-124.8	1.9	173.6	60.7	0	0	0	0	113.4	K79 F150 V151	K79-S107 PolarHBondContact NZ-OG 2.94Å; S107-F150 WeakPolarHBondContact O-CA 3.17Å; S107-V151 PolarHBondContact O-N 2.84Å
108	T	94.3	Very high	93.7	Very high	47 Å²	47	55.1 Å²	55.1	29%	0.288	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	116.1	172.4	-49.9	0	0	0	0	106.2	I106 V151 D153	I106-T108 WeakPolarHBondContact CD1-O 3.28Å; I106-T108 WeakPolarHBondContact CG1-O 3.45Å; T108-V151 CarbonylContact C-O 3.55Å; T108-V151 WeakPolarHBondContact CA-O 3.28Å; T108-V151 HydrophobicContact CG2-CB 4.48Å; T108-D153 HydrophobicContact CG2-CB 3.91Å
109	L	95.3	Very high	93.8	Very high	4 Å²	4	52.4 Å²	52.4	2%	0.021	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	152.1	-168.3	-68.8	-179.2	0	0	0	110.3	I106 D113 V119 F150 V151 D153 L159 L192	I106-L109 HydrophobicContact CG2-CD2 3.61Å; L109-D113 HydrophobicContact CB-CB 4.35Å; L109-D113 HydrophobicContact CD2-CB 4.14Å; L109-V119 HydrophobicContact CD1-CG1 4.24Å; L109-V119 HydrophobicContact CD1-CG2 3.84Å; L109-F150 HydrophobicContact CD1-CB 4.26Å; L109-F150 HydrophobicContact CD1-CD1 3.41Å; L109-F150 VanDerWaalsContact CD1-CD1 3.41Å; L109-F150 HydrophobicContact CD1-CD2 4.42Å; L109-F150 HydrophobicContact CD1-CE1 3.79Å; L109-F150 HydrophobicContact CD1-CG 3.78Å; L109-F150 HydrophobicContact CD1-CZ 4.44Å; L109-F150 HydrophobicContact CG-CD1 3.91Å; L109-F150 HydrophobicContact CG-CE1 4.45Å; L109-V151 PolarHBondContact N-O 3.37Å; L109-D153 PolarHBondContact O-N 3.14Å; L109-L159 HydrophobicContact CB-CD1 4.04Å; L109-L192 HydrophobicContact CD1-CD1 4.5Å; L109-L192 HydrophobicContact CD2-CD1 3.51Å
110	S	94.5	Very high	93.9	Very high	24 Å²	24	50.8 Å²	50.8	17%	0.168	27%	0.27	C	S	.	.			trans	-67	155.9	163.5	78.3	0	0	0	0	110.5	V112 D113 F114 D153	S110-V112 PolarHBondContact O-N 2.89Å; S110-V112 VanDerWaalsContact O-N 3.13Å; S110-V112 PolarHBondContact OG-N 3.18Å; S110-D113 WeakPolarHBondContact CB-OD2 3.26Å; S110-D113 PolarHBondContact O-N 3.48Å; S110-D113 PolarHBondContact OG-N 3.47Å; S110-D113 VanDerWaalsContact OG-N 3.09Å; S110-D113 PolarHBondContact OG-OD2 3.06Å; S110-F114 WeakPolarHBondContact O-CB 3.41Å; S110-F114 PolarHBondContact O-N 2.88Å; S110-D153 WeakPolarHBondContact CA-OD1 3.22Å; S110-D153 PolarHBondContact N-OD2 2.96Å
111	Q	93.2	Very high	94.1	Very high	98 Å²	98	45.4 Å²	45.4	46%	0.458	25%	0.254	S	S	.	.	H	α-helix	trans	-59.8	-20.6	172.2	-177.4	56.6	89.5	0	0	112.7	G115 L159	Q111-G115 PolarHBondContact O-N 3.47Å; Q111-L159 HydrophobicContact CB-CD2 4.4Å
112	V	94.1	Very high	94.1	Very high	117 Å²	117	44.8 Å²	44.8	71%	0.709	25%	0.252	S	S	*	.	H	α-helix	trans	-76.5	-52.5	175.1	-179.3	0	0	0	0	110.7	S110 F114 G115 G116	S110-V112 PolarHBondContact O-N 2.89Å; S110-V112 VanDerWaalsContact O-N 3.13Å; S110-V112 PolarHBondContact OG-N 3.18Å; V112-F114 VanDerWaalsContact C-N 3.27Å; V112-F114 PolarHBondContact O-N 2.94Å; V112-G115 CarbonylContact O-C 3.49Å; V112-G115 WeakPolarHBondContact O-CA 3.23Å; V112-G115 PolarHBondContact O-N 3.09Å; V112-G116 PolarHBondContact O-N 2.85Å
113	D	95.5	Very high	94.3	Very high	41 Å²	41	39.1 Å²	39.1	22%	0.219	23%	0.231	C	C	.	.	H	α-helix	trans	-62.1	-36.5	-179.8	-58.7	-54.1	0	0	0	112	L109 S110 G115 G116 L192	L109-D113 HydrophobicContact CB-CB 4.35Å; L109-D113 HydrophobicContact CD2-CB 4.14Å; S110-D113 WeakPolarHBondContact CB-OD2 3.26Å; S110-D113 PolarHBondContact O-N 3.48Å; S110-D113 PolarHBondContact OG-N 3.47Å; S110-D113 VanDerWaalsContact OG-N 3.09Å; S110-D113 PolarHBondContact OG-OD2 3.06Å; D113-G115 VanDerWaalsContact C-N 3.26Å; D113-G115 PolarHBondContact O-N 2.96Å; D113-G116 PolarHBondContact O-N 3.16Å; D113-L192 HydrophobicContact CB-CB 4.24Å; D113-L192 HydrophobicContact CB-CD1 4.3Å
114	F	95.5	Very high	94.5	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-64.5	-31.3	174.3	-177.8	-102.2	0	0	0	112.9	S110 V112 V119 N120 N121 D122 H123 F150 L159	S110-F114 WeakPolarHBondContact O-CB 3.41Å; S110-F114 PolarHBondContact O-N 2.88Å; V112-F114 VanDerWaalsContact C-N 3.27Å; V112-F114 PolarHBondContact O-N 2.94Å; F114-V119 HydrophobicContact CB-CG1 4.49Å; F114-V119 HydrophobicContact CD2-CG1 3.53Å; F114-V119 HydrophobicContact CE2-CG1 4.04Å; F114-V119 HydrophobicContact CG-CG1 4.22Å; F114-N120 PolarHBondContact O-N 3.09Å; F114-N121 HydrophobicContact CE1-CB 4.1Å; F114-N121 WeakPolarHBondContact O-CA 3.49Å; F114-N121 PolarHBondContact O-N 2.79Å; F114-D122 WeakPolarHBondContact CE2-O 3.44Å; F114-H123 AromaticContact CE2-CD2 3.91Å; F114-H123 AromaticContact CE2-NE2 3.67Å; F114-H123 AromaticContact CZ-CD2 3.76Å; F114-H123 AromaticContact CZ-NE2 3.38Å; F114-H123 WeakPolarHBondContact CZ-NE2 3.4Å; F114-F150 HydrophobicContact CD2-CB 3.87Å; F114-F150 HydrophobicContact CD2-CD2 4.1Å; F114-F150 HydrophobicContact CD2-CG 4.24Å; F114-F150 HydrophobicContact CE2-CB 4Å; F114-F150 HydrophobicContact CE2-CD2 4.03Å; F114-F150 HydrophobicContact CE2-CG 4.43Å; F114-L159 HydrophobicContact CB-CD1 3.88Å; F114-L159 HydrophobicContact CB-CD2 4.35Å; F114-L159 HydrophobicContact CD1-CB 4.03Å; F114-L159 HydrophobicContact CD1-CD2 4.36Å; F114-L159 HydrophobicContact CD2-CB 3.93Å; F114-L159 HydrophobicContact CD2-CD1 3.74Å; F114-L159 HydrophobicContact CD2-CG 4.37Å; F114-L159 HydrophobicContact CE1-CB 3.95Å; F114-L159 HydrophobicContact CE2-CB 3.87Å; F114-L159 HydrophobicContact CE2-CD1 4.44Å; F114-L159 HydrophobicContact CG-CB 4.01Å; F114-L159 HydrophobicContact CG-CD1 3.81Å; F114-L159 HydrophobicContact CG-CD2 4.3Å; F114-L159 HydrophobicContact CG-CG 4.25Å; F114-L159 HydrophobicContact CZ-CB 3.88Å
115	G	93.7	Very high	94.8	Very high	30 Å²	30	31 Å²	31	31%	0.309	18%	0.184	S	C	.	.	H	α-helix	trans	-81.4	-20.9	174.8	0	0	0	0	0	114.3	Q111 V112 D113	Q111-G115 PolarHBondContact O-N 3.47Å; V112-G115 CarbonylContact O-C 3.49Å; V112-G115 WeakPolarHBondContact O-CA 3.23Å; V112-G115 PolarHBondContact O-N 3.09Å; D113-G115 VanDerWaalsContact C-N 3.26Å; D113-G115 PolarHBondContact O-N 2.96Å
116	G	94.4	Very high	95	Very high	13 Å²	13	29.8 Å²	29.8	13%	0.134	18%	0.178	C	C	.	.	S	Bend	trans	-62.5	153.7	-180	0	0	0	0	0	113.3	V112 D113 V118 V119 N120	V112-G116 PolarHBondContact O-N 2.85Å; D113-G116 PolarHBondContact O-N 3.16Å; G116-V118 PolarHBondContact O-N 3.15Å; G116-V119 PolarHBondContact O-N 3.13Å; G116-V119 VanDerWaalsContact O-N 3.09Å; G116-N120 WeakPolarHBondContact O-CA 3.37Å; G116-N120 PolarHBondContact O-N 2.82Å
117	P	95.9	Very high	95.3	Very high	51 Å²	51	26.4 Å²	26.4	33%	0.331	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-15.1	-165	23.3	-33.8	0	0	0	115.6	K183 L184 E195	P117-K183 WeakPolarHBondContact O-CA 3.37Å; P117-L184 HydrophobicContact CB-CD1 3.92Å; P117-L184 HydrophobicContact CB-CG 4.17Å; P117-L184 HydrophobicContact CG-CD1 3.8Å; P117-L184 PolarHBondContact O-N 2.8Å; P117-E195 HydrophobicContact CG-CG 4.15Å
118	V	96.6	Very high	95.4	Very high	0 Å²	0	25 Å²	25	0%	0	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76	-46.7	174.4	178.8	0	0	0	0	111.4	G116 K183 L184 Y186 Q191 L192 E195	G116-V118 PolarHBondContact O-N 3.15Å; V118-K183 PolarHBondContact O-NZ 2.85Å; V118-L184 HydrophobicContact CG2-CB 3.82Å; V118-L184 HydrophobicContact CG2-CD1 4.36Å; V118-Y186 HydrophobicContact CG1-CD2 3.66Å; V118-Y186 HydrophobicContact CG1-CG 4.17Å; V118-Q191 HydrophobicContact CG2-CG 4.24Å; V118-L192 HydrophobicContact CB-CD2 3.92Å; V118-L192 HydrophobicContact CG1-CD2 4.06Å; V118-L192 HydrophobicContact CG2-CD2 4.48Å; V118-E195 HydrophobicContact CG2-CG 3.71Å
119	V	95.3	Very high	95.4	Very high	1 Å²	1	24.7 Å²	24.7	1%	0.006	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-38.3	179.6	-176.6	0	0	0	0	110.8	L109 F114 G116 N121 D122 L125 F150 K183 L192	L109-V119 HydrophobicContact CD1-CG1 4.24Å; L109-V119 HydrophobicContact CD1-CG2 3.84Å; F114-V119 HydrophobicContact CB-CG1 4.49Å; F114-V119 HydrophobicContact CD2-CG1 3.53Å; F114-V119 HydrophobicContact CE2-CG1 4.04Å; F114-V119 HydrophobicContact CG-CG1 4.22Å; G116-V119 PolarHBondContact O-N 3.13Å; G116-V119 VanDerWaalsContact O-N 3.09Å; V119-N121 VanDerWaalsContact C-N 3.33Å; V119-N121 PolarHBondContact O-N 3.13Å; V119-D122 WeakPolarHBondContact CG1-O 3.19Å; V119-D122 VanDerWaalsContact O-CB 3.31Å; V119-D122 WeakPolarHBondContact O-CB 3.4Å; V119-D122 PolarHBondContact O-N 3.15Å; V119-L125 HydrophobicContact CG2-CD2 4.34Å; V119-F150 HydrophobicContact CG1-CD2 3.72Å; V119-F150 HydrophobicContact CG1-CE2 3.64Å; V119-F150 HydrophobicContact CG1-CG 4.49Å; V119-F150 HydrophobicContact CG1-CZ 4.35Å; V119-K183 PolarHBondContact O-NZ 2.89Å; V119-L192 HydrophobicContact CG2-CD2 4.02Å
120	N	95.1	Very high	95.3	Very high	37 Å²	37	26.4 Å²	26.4	20%	0.198	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	54	41.1	167.5	-153.7	40.2	0	0	0	114.6	F114 G116 D122 S180 P181 K183	F114-N120 PolarHBondContact O-N 3.09Å; G116-N120 WeakPolarHBondContact O-CA 3.37Å; G116-N120 PolarHBondContact O-N 2.82Å; N120-D122 PolarHBondContact O-N 3.32Å; N120-S180 PolarHBondContact ND2-OG 2.97Å; N120-P181 PolarHBondContact ND2-O 2.79Å; N120-K183 HydrophobicContact CB-CG 4.22Å
121	N	95.1	Very high	95.2	Very high	54 Å²	54	28.6 Å²	28.6	29%	0.289	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.3	26.2	-176.8	-56.2	-82.2	0	0	0	114.5	F114 V119 G161 S162	F114-N121 HydrophobicContact CE1-CB 4.1Å; F114-N121 WeakPolarHBondContact O-CA 3.49Å; F114-N121 PolarHBondContact O-N 2.79Å; V119-N121 VanDerWaalsContact C-N 3.33Å; V119-N121 PolarHBondContact O-N 3.13Å; N121-G161 WeakPolarHBondContact O-CA 3.23Å; N121-S162 PolarHBondContact O-N 2.91Å; N121-S162 VanDerWaalsContact O-N 3.16Å
122	D	95.5	Very high	95	Very high	2 Å²	2	24.1 Å²	24.1	1%	0.011	14%	0.144	C	C	.	.			trans	-109.7	152	177	-69.1	-57.4	0	0	0	112.8	F114 V119 N120 W124 F150 Q165 S180 K183	F114-D122 WeakPolarHBondContact CE2-O 3.44Å; V119-D122 WeakPolarHBondContact CG1-O 3.19Å; V119-D122 VanDerWaalsContact O-CB 3.31Å; V119-D122 WeakPolarHBondContact O-CB 3.4Å; V119-D122 PolarHBondContact O-N 3.15Å; N120-D122 PolarHBondContact O-N 3.32Å; D122-W124 VanDerWaalsContact CB-CD1 3.5Å; D122-W124 HydrophobicContact CB-CD2 4.48Å; D122-W124 HydrophobicContact CB-CG 4.12Å; D122-W124 PolarHBondContact O-N 2.79Å; D122-W124 PolarHBondContact OD1-NE1 2.86Å; D122-W124 PolarHBondContact OD2-NE1 2.89Å; D122-F150 VanDerWaalsContact O-CD2 3.31Å; D122-F150 WeakPolarHBondContact O-CD2 3.34Å; D122-F150 WeakPolarHBondContact O-CE2 3.28Å; D122-Q165 PolarHBondContact OD1-NE2 2.75Å; D122-S180 WeakPolarHBondContact OD2-CB 3.26Å; D122-S180 PolarHBondContact OD2-OG 3.05Å; D122-K183 IonicContact OD2-NZ 3.87Å; D122-K183 PolarHBondContact OD2-NZ 3.05Å
123	H	96.3	Very high	94.6	Very high	3 Å²	3	22 Å²	22	1%	0.014	13%	0.128	C	C	.	.	S	Bend	trans	-93.8	34.2	168.3	-65.3	-114.5	0	0	0	111.6	F114 T148 F150 L159 R172	F114-H123 AromaticContact CE2-CD2 3.91Å; F114-H123 AromaticContact CE2-NE2 3.67Å; F114-H123 AromaticContact CZ-CD2 3.76Å; F114-H123 AromaticContact CZ-NE2 3.38Å; F114-H123 WeakPolarHBondContact CZ-NE2 3.4Å; H123-T148 CarbonylContact O-C 3.42Å; H123-T148 PolarHBondContact O-N 2.9Å; H123-F150 PolarHBondContact CE1-O 2.63Å; H123-F150 PolarHBondContact ND1-N 2.83Å; H123-L159 PolarHBondContact CE1-O 3.48Å; H123-L159 PolarHBondContact NE2-O 2.88Å; H123-R172 VanDerWaalsContact CB-NH2 3.29Å
124	W	96.3	Very high	93.8	Very high	0 Å²	0	21 Å²	21	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	148	175.9	64.1	-85.5	0	0	0	111.6	D122 V145 E146 Q165 L178 K183 L203	D122-W124 VanDerWaalsContact CB-CD1 3.5Å; D122-W124 HydrophobicContact CB-CD2 4.48Å; D122-W124 HydrophobicContact CB-CG 4.12Å; D122-W124 PolarHBondContact O-N 2.79Å; D122-W124 PolarHBondContact OD1-NE1 2.86Å; D122-W124 PolarHBondContact OD2-NE1 2.89Å; W124-V145 HydrophobicContact CB-CG1 4.3Å; W124-V145 HydrophobicContact CD2-CG1 4.23Å; W124-V145 HydrophobicContact CE3-CB 4.45Å; W124-V145 HydrophobicContact CE3-CG1 3.57Å; W124-V145 HydrophobicContact CE3-CG2 4.09Å; W124-V145 HydrophobicContact CZ3-CG1 4.24Å; W124-V145 HydrophobicContact CZ3-CG2 3.91Å; W124-E146 CarbonylContact C-O 3.49Å; W124-E146 WeakPolarHBondContact CA-O 3.47Å; W124-E146 WeakPolarHBondContact CB-O 3.5Å; W124-Q165 VanDerWaalsContact NE1-NE2 3.2Å; W124-L178 HydrophobicContact CD2-CD1 4.18Å; W124-L178 HydrophobicContact CE3-CD1 4.25Å; W124-L178 HydrophobicContact CH2-CB 4.12Å; W124-L178 HydrophobicContact CZ2-CB 3.79Å; W124-L178 HydrophobicContact CZ3-CD1 4.42Å; W124-K183 HydrophobicContact CE3-CD 4.08Å; W124-K183 HydrophobicContact CH2-CD 3.45Å; W124-K183 VanDerWaalsContact CH2-CD 3.45Å; W124-K183 HydrophobicContact CZ2-CD 3.91Å; W124-K183 HydrophobicContact CZ3-CD 3.54Å; W124-K183 WeakPolarHBondContact O-CE 3.15Å; W124-K183 PolarHBondContact O-NZ 2.88Å; W124-L203 HydrophobicContact CH2-CD2 3.64Å; W124-L203 HydrophobicContact CZ3-CD2 4.24Å
125	L	97.3	Very high	92.8	Very high	4 Å²	4	28.3 Å²	28.3	2%	0.021	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	138.2	178.9	-66.4	175	0	0	0	110.5	V119 W127 V145 E146 F150 Y186	V119-L125 HydrophobicContact CG2-CD2 4.34Å; L125-W127 HydrophobicContact CD1-CZ2 4.46Å; L125-V145 CarbonylContact O-C 3.56Å; L125-V145 WeakPolarHBondContact O-CA 3.39Å; L125-E146 HydrophobicContact CB-CB 4.47Å; L125-E146 PolarHBondContact N-O 2.91Å; L125-E146 PolarHBondContact O-N 2.91Å; L125-F150 HydrophobicContact CD1-CZ 4.06Å; L125-F150 HydrophobicContact CD2-CE2 4.23Å; L125-F150 HydrophobicContact CD2-CZ 3.72Å; L125-F150 HydrophobicContact CG-CE2 4.38Å; L125-F150 HydrophobicContact CG-CZ 3.77Å; L125-Y186 HydrophobicContact CD1-CD1 3.87Å; L125-Y186 HydrophobicContact CD1-CD2 4.06Å; L125-Y186 HydrophobicContact CD1-CE1 4.11Å; L125-Y186 HydrophobicContact CD1-CE2 4.31Å; L125-Y186 HydrophobicContact CD1-CG 3.84Å; L125-Y186 HydrophobicContact CD2-CD2 3.92Å; L125-Y186 HydrophobicContact CD2-CG 4.05Å; L125-Y186 HydrophobicContact CG-CG 4.39Å
126	Y	97.8	Very high	91.9	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	115	164.9	167.8	-133.5	0	0	0	107.8	G128 R143 M185 Y186 T202 L203	Y126-G128 WeakPolarHBondContact CE2-O 3.5Å; Y126-R143 HydrophobicContact CE2-CG 3.93Å; Y126-M185 HydrophobicContact CD1-CB 4.06Å; Y126-M185 HydrophobicContact CE1-CB 3.97Å; Y126-M185 CarbonylContact O-C 3.52Å; Y126-M185 WeakPolarHBondContact O-CA 3.09Å; Y126-Y186 PolarHBondContact O-N 2.81Å; Y126-T202 WeakPolarHBondContact CE1-O 3.46Å; Y126-L203 HydrophobicContact CD1-CB 3.83Å; Y126-L203 HydrophobicContact CD1-CD1 4.42Å; Y126-L203 HydrophobicContact CD2-CD1 3.92Å; Y126-L203 HydrophobicContact CE1-CB 3.98Å; Y126-L203 HydrophobicContact CE1-CD1 4.44Å; Y126-L203 HydrophobicContact CE2-CD1 3.94Å; Y126-L203 HydrophobicContact CG-CB 4.25Å; Y126-L203 HydrophobicContact CG-CD1 4.17Å
127	W	97.6	Very high	91	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	-6.7	-175.2	-86.3	98.7	0	0	0	113.9	S87 C90 N91 V94 H105 L125 L144 E146 Y186	S87-W127 WeakPolarHBondContact O-CH2 3.09Å; S87-W127 WeakPolarHBondContact O-CZ2 3.42Å; C90-W127 HydrophobicContact CB-CB 4.46Å; C90-W127 HydrophobicContact CB-CD2 3.53Å; C90-W127 VanDerWaalsContact CB-CE2 3.41Å; C90-W127 HydrophobicContact CB-CE3 4.24Å; C90-W127 HydrophobicContact CB-CG 3.62Å; C90-W127 HydrophobicContact CB-CZ2 4Å; N91-W127 HydrophobicContact CB-CE3 4.43Å; N91-W127 HydrophobicContact CB-CH2 3.65Å; N91-W127 HydrophobicContact CB-CZ3 3.54Å; V94-W127 HydrophobicContact CG2-CB 4.19Å; H105-W127 AromaticContact CE1-CH2 3.59Å; H105-W127 AromaticContact ND1-CH2 3.94Å; H105-W127 AromaticContact NE2-CH2 3.75Å; L125-W127 HydrophobicContact CD1-CZ2 4.46Å; W127-L144 HydrophobicContact CB-CB 3.93Å; W127-L144 HydrophobicContact CB-CD2 3.9Å; W127-L144 HydrophobicContact CB-CG 4Å; W127-L144 HydrophobicContact CG-CD2 4.31Å; W127-L144 PolarHBondContact N-O 2.74Å; W127-E146 PolarHBondContact NE1-OE2 2.87Å; W127-Y186 HydrophobicContact CD2-CD1 4.22Å; W127-Y186 AromaticContact CE2-CD1 3.96Å; W127-Y186 HydrophobicContact CE3-CD1 4.03Å; W127-Y186 AromaticContact CH2-CD1 3.42Å; W127-Y186 HydrophobicContact CH2-CD1 3.42Å; W127-Y186 VanDerWaalsContact CH2-CD1 3.42Å; W127-Y186 AromaticContact CH2-CE1 3.35Å; W127-Y186 HydrophobicContact CH2-CE1 3.35Å; W127-Y186 AromaticContact CZ2-CD1 3.58Å; W127-Y186 HydrophobicContact CZ2-CD1 3.58Å; W127-Y186 AromaticContact CZ2-CE1 3.64Å; W127-Y186 HydrophobicContact CZ2-CE1 3.64Å; W127-Y186 AromaticContact CZ3-CD1 3.62Å; W127-Y186 HydrophobicContact CZ3-CD1 3.62Å; W127-Y186 AromaticContact CZ3-CE1 3.93Å; W127-Y186 HydrophobicContact CZ3-CE1 3.93Å
128	G	94.8	Very high	90.3	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	105.3	-157.5	-176.9	0	0	0	0	0	112.9	Y126 L144 M185	Y126-G128 WeakPolarHBondContact CE2-O 3.5Å; G128-L144 PolarHBondContact O-N 3.22Å; G128-M185 VanDerWaalsContact CA-SD 3.6Å
129	E	94	Very high	89.9	Confident	39 Å²	39	40.1 Å²	40.1	18%	0.182	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	142.7	-177.2	-68	167.3	154.5	0	0	109.4	F64 F142 R143 K201	F64-E129 HydrophobicContact CD1-CB 4.37Å; F64-E129 HydrophobicContact CD1-CG 4.16Å; F64-E129 HydrophobicContact CE1-CB 3.81Å; F64-E129 HydrophobicContact CE1-CG 3.91Å; E129-F142 CarbonylContact C-O 3.6Å; E129-F142 WeakPolarHBondContact CA-O 3.41Å; E129-R143 HydrophobicContact CG-CB 4.11Å; E129-R143 HydrophobicContact CG-CG 4.04Å; E129-R143 IonicContact OE1-CZ 3.88Å; E129-R143 IonicContact OE1-NE 2.7Å; E129-R143 PolarHBondContact OE1-NE 3.25Å; E129-R143 IonicContact OE1-NH2 3.92Å; E129-R143 PolarHBondContact OE1-NH2 3.05Å; E129-K201 WeakPolarHBondContact OE2-CE 3.38Å; E129-K201 IonicContact OE2-NZ 3.72Å; E129-K201 PolarHBondContact OE2-NZ 2.92Å
130	R	93.3	Very high	89.6	Confident	41 Å²	41	41.7 Å²	41.7	16%	0.155	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	138.1	177.4	-178.9	173.3	178.8	-145.8	-9.4	110.6	F93 V132 F142 E293	F93-R130 HydrophobicContact CE1-CB 4.25Å; F93-R130 WeakPolarHBondContact O-CD 3.38Å; F93-R130 PolarHBondContact O-NE 3.27Å; F93-R130 PolarHBondContact O-NH1 3.14Å; R130-V132 HydrophobicContact CG-CG2 4.07Å; R130-F142 PolarHBondContact N-O 3.28Å; R130-F142 PolarHBondContact O-N 2.9Å; R130-E293 IonicContact CZ-OE1 3.05Å; R130-E293 IonicContact NH1-OE1 2.73Å; R130-E293 PolarHBondContact NH1-OE1 3.21Å; R130-E293 IonicContact NH2-OE1 3.95Å; R130-E293 PolarHBondContact NH2-OE1 3.13Å
131	V	92.5	Very high	89.5	Confident	69 Å²	69	40.2 Å²	40.2	42%	0.418	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	133.2	165.8	-177.3	0	0	0	0	108.6	E139 I140 A141	V131-E139 HydrophobicContact CG1-CB 3.74Å; V131-E139 HydrophobicContact CG1-CG 4.01Å; V131-I140 WeakPolarHBondContact CA-O 3.19Å; V131-A141 HydrophobicContact CG2-CB 4.27Å
132	V	89.4	Confident	89.6	Confident	5 Å²	5	37.7 Å²	37.7	3%	0.03	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	135.9	177.7	-175.5	0	0	0	0	108.7	F93 R130 I140 F142 L297	F93-V132 HydrophobicContact CE2-CG2 3.96Å; F93-V132 HydrophobicContact CZ-CG2 3.77Å; R130-V132 HydrophobicContact CG-CG2 4.07Å; V132-I140 PolarHBondContact N-O 3.49Å; V132-I140 PolarHBondContact O-N 3.44Å; V132-F142 HydrophobicContact CB-CE2 4.18Å; V132-F142 HydrophobicContact CG2-CD2 4.06Å; V132-F142 HydrophobicContact CG2-CE2 4.09Å; V132-L297 HydrophobicContact CB-CD2 4.46Å; V132-L297 HydrophobicContact CG1-CD2 4.04Å
133	L	85.5	Confident	89.6	Confident	72 Å²	72	39.3 Å²	39.3	38%	0.377	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	121.6	171.3	-72.2	165.2	0	0	0	108.9	E139	L133-E139 HydrophobicContact CD2-CG 3.54Å
134	S	77.9	Confident	89.7	Confident	19 Å²	19	39.3 Å²	39.3	13%	0.133	23%	0.229	C	C	.	.			trans	-74.3	164.5	173.3	57.1	0	0	0	0	112.3	S136 G137 A138	S134-S136 PolarHBondContact O-N 2.95Å; S134-S136 PolarHBondContact OG-OG 3.11Å; S134-G137 WeakPolarHBondContact O-CA 3.32Å; S134-G137 PolarHBondContact O-N 2.79Å; S134-A138 WeakPolarHBondContact CB-O 3.42Å; S134-A138 PolarHBondContact N-O 2.84Å; S134-A138 WeakPolarHBondContact OG-CA 3.47Å; S134-A138 WeakPolarHBondContact OG-CB 3.49Å; S134-A138 PolarHBondContact OG-N 2.99Å; S134-A138 VanDerWaalsContact OG-N 3.1Å; S134-A138 PolarHBondContact OG-O 3.39Å
135	D	74.4	Confident	89.8	Confident	154 Å²	154	39.3 Å²	39.3	82%	0.824	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.3	-24.9	175.4	-62.5	-27.1	0	0	0	113.4	G137	D135-G137 VanDerWaalsContact C-N 3.31Å
136	S	74.3	Confident	89.8	Confident	90 Å²	90	39.1 Å²	39.1	63%	0.629	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.9	6.4	174.7	60.6	0	0	0	0	114.1	S134 A138	S134-S136 PolarHBondContact O-N 2.95Å; S134-S136 PolarHBondContact OG-OG 3.11Å; S136-A138 VanDerWaalsContact C-N 3.26Å; S136-A138 PolarHBondContact O-N 3.31Å
137	G	76	Confident	89.8	Confident	55 Å²	55	39.2 Å²	39.2	57%	0.567	23%	0.229	S	C	*	.	S	Bend	trans	75.6	4.7	-177.3	0	0	0	0	0	115.2	S134 D135	S134-G137 WeakPolarHBondContact O-CA 3.32Å; S134-G137 PolarHBondContact O-N 2.79Å; D135-G137 VanDerWaalsContact C-N 3.31Å
138	A	81.9	Confident	89.7	Confident	50 Å²	50	39.5 Å²	39.5	41%	0.413	23%	0.231	S	C	.	.			trans	-83.1	135.3	178.5	0	0	0	0	0	110.9	S134 S136	S134-A138 WeakPolarHBondContact CB-O 3.42Å; S134-A138 PolarHBondContact N-O 2.84Å; S134-A138 WeakPolarHBondContact OG-CA 3.47Å; S134-A138 WeakPolarHBondContact OG-CB 3.49Å; S134-A138 PolarHBondContact OG-N 2.99Å; S134-A138 VanDerWaalsContact OG-N 3.1Å; S134-A138 PolarHBondContact OG-O 3.39Å; S136-A138 VanDerWaalsContact C-N 3.26Å; S136-A138 PolarHBondContact O-N 3.31Å
139	E	87.1	Confident	89.7	Confident	147 Å²	147	40.2 Å²	40.2	69%	0.687	23%	0.234	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-76.2	124.3	175.1	-72.9	-176	175.6	0	0	111.2	V131 L133	V131-E139 HydrophobicContact CG1-CB 3.74Å; V131-E139 HydrophobicContact CG1-CG 4.01Å; L133-E139 HydrophobicContact CD2-CG 3.54Å
140	I	90.1	Very high	89.8	Confident	35 Å²	35	38.6 Å²	38.6	18%	0.179	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	118.9	178.9	-55.2	-176.2	0	0	0	108.6	F65 V131 V132 F142 L297 A300	F65-I140 HydrophobicContact CD2-CG2 3.66Å; F65-I140 HydrophobicContact CE2-CG2 3.63Å; V131-I140 WeakPolarHBondContact CA-O 3.19Å; V132-I140 PolarHBondContact N-O 3.49Å; V132-I140 PolarHBondContact O-N 3.44Å; I140-F142 HydrophobicContact CB-CE2 3.86Å; I140-F142 HydrophobicContact CB-CZ 4.37Å; I140-F142 HydrophobicContact CG2-CD2 4.1Å; I140-F142 HydrophobicContact CG2-CE1 4.31Å; I140-F142 HydrophobicContact CG2-CE2 3.37Å; I140-F142 HydrophobicContact CG2-CZ 3.5Å; I140-F142 WeakPolarHBondContact O-CD2 3.47Å; I140-L297 HydrophobicContact CD1-CD2 4.16Å; I140-A300 HydrophobicContact CG2-CB 4.12Å
141	A	93.7	Very high	89.9	Confident	5 Å²	5	36.9 Å²	36.9	4%	0.041	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	127.3	-178	0	0	0	0	0	111.5	F64 F65 V131	F64-A141 CarbonylContact C-O 3.51Å; F64-A141 WeakPolarHBondContact CA-O 3.43Å; F64-A141 HydrophobicContact CD1-CB 3.7Å; F64-A141 HydrophobicContact CE1-CB 3.74Å; F64-A141 HydrophobicContact CG-CB 4.15Å; F64-A141 HydrophobicContact CZ-CB 4.23Å; F65-A141 WeakPolarHBondContact CD2-O 3.18Å; F65-A141 PolarHBondContact N-O 3.04Å; V131-A141 HydrophobicContact CG2-CB 4.27Å
142	F	95.9	Very high	90	Very high	2 Å²	2	34.7 Å²	34.7	1%	0.009	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	140.6	-179.1	-67	-88.5	0	0	0	111.2	F65 I67 F93 E129 R130 V132 I140 F296 L297 A300	F65-F142 HydrophobicContact CB-CD1 3.94Å; F65-F142 HydrophobicContact CB-CE1 4.22Å; F65-F142 WeakPolarHBondContact O-CA 3.49Å; I67-F142 HydrophobicContact CG1-CD1 3.98Å; I67-F142 HydrophobicContact CG1-CE1 4.46Å; F93-F142 HydrophobicContact CE1-CB 3.95Å; F93-F142 HydrophobicContact CE1-CD2 4.38Å; F93-F142 HydrophobicContact CE1-CG 4.15Å; F93-F142 HydrophobicContact CZ-CB 4.18Å; F93-F142 HydrophobicContact CZ-CD1 4.46Å; F93-F142 AromaticContact CZ-CD2 3.76Å; F93-F142 HydrophobicContact CZ-CD2 3.76Å; F93-F142 HydrophobicContact CZ-CE2 4.2Å; F93-F142 AromaticContact CZ-CG 3.89Å; F93-F142 HydrophobicContact CZ-CG 3.89Å; E129-F142 CarbonylContact C-O 3.6Å; E129-F142 WeakPolarHBondContact CA-O 3.41Å; R130-F142 PolarHBondContact N-O 3.28Å; R130-F142 PolarHBondContact O-N 2.9Å; V132-F142 HydrophobicContact CB-CE2 4.18Å; V132-F142 HydrophobicContact CG2-CD2 4.06Å; V132-F142 HydrophobicContact CG2-CE2 4.09Å; I140-F142 HydrophobicContact CB-CE2 3.86Å; I140-F142 HydrophobicContact CB-CZ 4.37Å; I140-F142 HydrophobicContact CG2-CD2 4.1Å; I140-F142 HydrophobicContact CG2-CE1 4.31Å; I140-F142 HydrophobicContact CG2-CE2 3.37Å; I140-F142 HydrophobicContact CG2-CZ 3.5Å; I140-F142 WeakPolarHBondContact O-CD2 3.47Å; F142-F296 HydrophobicContact CD1-CB 4.27Å; F142-F296 HydrophobicContact CE1-CB 3.82Å; F142-F296 VanDerWaalsContact CE1-O 3.29Å; F142-F296 WeakPolarHBondContact CE1-O 3.3Å; F142-F296 HydrophobicContact CZ-CB 4.07Å; F142-F296 WeakPolarHBondContact CZ-O 3.25Å; F142-L297 HydrophobicContact CE2-CD2 4.34Å; F142-L297 HydrophobicContact CZ-CD2 4.31Å; F142-A300 HydrophobicContact CE1-CB 3.87Å; F142-A300 HydrophobicContact CZ-CB 3.85Å
143	R	96.3	Very high	90.2	Very high	36 Å²	36	38 Å²	38	14%	0.136	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	124.7	166.8	-177.5	177.3	-68.1	160.9	8.5	108.3	F64 F65 T66 I67 Y126 E129	F64-R143 HydrophobicContact CB-CB 4.23Å; F64-R143 HydrophobicContact CD1-CB 4.38Å; F65-R143 PolarHBondContact O-N 2.89Å; T66-R143 CarbonylContact C-O 3.57Å; T66-R143 WeakPolarHBondContact CA-O 3.4Å; I67-R143 PolarHBondContact N-O 3.37Å; Y126-R143 HydrophobicContact CE2-CG 3.93Å; E129-R143 HydrophobicContact CG-CB 4.11Å; E129-R143 HydrophobicContact CG-CG 4.04Å; E129-R143 IonicContact OE1-CZ 3.88Å; E129-R143 IonicContact OE1-NE 2.7Å; E129-R143 PolarHBondContact OE1-NE 3.25Å; E129-R143 IonicContact OE1-NH2 3.92Å; E129-R143 PolarHBondContact OE1-NH2 3.05Å
144	L	97.6	Very high	90.6	Very high	2 Å²	2	42.7 Å²	42.7	1%	0.01	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	131.9	-169	-167.7	66	0	0	0	112.9	I67 V69 C90 F93 V94 W127 G128 F296	I67-L144 HydrophobicContact CB-CD1 4.18Å; I67-L144 HydrophobicContact CG2-CD1 4.36Å; V69-L144 HydrophobicContact CG2-CD1 3.69Å; V69-L144 HydrophobicContact CG2-CG 4.48Å; C90-L144 HydrophobicContact CB-CD2 3.6Å; F93-L144 HydrophobicContact CD1-CD2 4.12Å; V94-L144 HydrophobicContact CG2-CB 4.19Å; V94-L144 HydrophobicContact CG2-CD2 3.72Å; W127-L144 HydrophobicContact CB-CB 3.93Å; W127-L144 HydrophobicContact CB-CD2 3.9Å; W127-L144 HydrophobicContact CB-CG 4Å; W127-L144 HydrophobicContact CG-CD2 4.31Å; W127-L144 PolarHBondContact N-O 2.74Å; G128-L144 PolarHBondContact O-N 3.22Å; L144-F296 HydrophobicContact CD1-CD1 4.25Å; L144-F296 HydrophobicContact CD1-CE1 3.45Å; L144-F296 VanDerWaalsContact CD1-CE1 3.45Å; L144-F296 HydrophobicContact CD1-CZ 4.11Å
145	V	97.7	Very high	91.3	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	140.2	172.8	168.5	0	0	0	0	109.8	I67 A68 V69 W124 L125 L178 A208	I67-V145 PolarHBondContact O-N 2.88Å; A68-V145 CarbonylContact C-O 3.55Å; A68-V145 WeakPolarHBondContact CA-O 3.44Å; V69-V145 PolarHBondContact N-O 3.1Å; W124-V145 HydrophobicContact CB-CG1 4.3Å; W124-V145 HydrophobicContact CD2-CG1 4.23Å; W124-V145 HydrophobicContact CE3-CB 4.45Å; W124-V145 HydrophobicContact CE3-CG1 3.57Å; W124-V145 HydrophobicContact CE3-CG2 4.09Å; W124-V145 HydrophobicContact CZ3-CG1 4.24Å; W124-V145 HydrophobicContact CZ3-CG2 3.91Å; L125-V145 CarbonylContact O-C 3.56Å; L125-V145 WeakPolarHBondContact O-CA 3.39Å; V145-L178 HydrophobicContact CB-CD1 4.44Å; V145-L178 HydrophobicContact CG1-CD1 3.71Å; V145-L178 HydrophobicContact CG2-CD1 4.33Å; V145-A208 HydrophobicContact CG2-CB 4.44Å
146	E	98.1	Very high	92.2	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	122.8	167.5	-179.8	-173	168.2	0	0	110.1	K86 S87 W124 L125 W127	K86-E146 HydrophobicContact CB-CG 3.98Å; K86-E146 VanDerWaalsContact CB-OE1 3.25Å; K86-E146 WeakPolarHBondContact CB-OE1 3.12Å; K86-E146 HydrophobicContact CD-CG 4.46Å; K86-E146 WeakPolarHBondContact CE-OE1 3.33Å; K86-E146 IonicContact NZ-OE1 2.69Å; K86-E146 PolarHBondContact NZ-OE1 3.44Å; S87-E146 WeakPolarHBondContact CA-OE2 3.45Å; S87-E146 WeakPolarHBondContact CB-OE2 3.43Å; S87-E146 PolarHBondContact N-OE2 3.03Å; S87-E146 VanDerWaalsContact OG-CD 3.24Å; S87-E146 PolarHBondContact OG-OE1 3.49Å; S87-E146 PolarHBondContact OG-OE2 3.42Å; W124-E146 CarbonylContact C-O 3.49Å; W124-E146 WeakPolarHBondContact CA-O 3.47Å; W124-E146 WeakPolarHBondContact CB-O 3.5Å; L125-E146 HydrophobicContact CB-CB 4.47Å; L125-E146 PolarHBondContact N-O 2.91Å; L125-E146 PolarHBondContact O-N 2.91Å; W127-E146 PolarHBondContact NE1-OE2 2.87Å
147	Q	97.5	Very high	93.1	Very high	2 Å²	2	44.3 Å²	44.3	1%	0.009	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	117.5	168.8	-71.6	-80.7	-2.2	0	0	109.3	V69 I70 K86 Y169 C173	V69-Q147 PolarHBondContact O-N 3.09Å; I70-Q147 HydrophobicContact CG2-CB 4.04Å; I70-Q147 HydrophobicContact CG2-CG 4.21Å; K86-Q147 WeakPolarHBondContact CE-O 3.32Å; Q147-Y169 HydrophobicContact CB-CE2 4.3Å; Q147-Y169 WeakPolarHBondContact O-CE2 3.33Å; Q147-Y169 PolarHBondContact O-OH 3.36Å; Q147-C173 HydrophobicContact CB-CB 3.78Å; Q147-C173 HydrophobicContact CG-CB 4.19Å
148	T	95.9	Very high	93.9	Very high	7 Å²	7	44 Å²	44	4%	0.043	23%	0.228	C	C	.	.			trans	-132	-164.2	-175.7	-161.8	0	0	0	0	110.6	K86 H123 F150 Y169 R172	K86-T148 PolarHBondContact NZ-OG1 3.13Å; H123-T148 CarbonylContact O-C 3.42Å; H123-T148 PolarHBondContact O-N 2.9Å; T148-F150 HydrophobicContact CG2-CD2 4.2Å; T148-F150 HydrophobicContact CG2-CE1 4.08Å; T148-F150 HydrophobicContact CG2-CE2 3.68Å; T148-F150 HydrophobicContact CG2-CZ 3.6Å; T148-Y169 VanDerWaalsContact O-CD2 3.28Å; T148-Y169 WeakPolarHBondContact O-CD2 3.26Å; T148-Y169 WeakPolarHBondContact O-CE2 3.37Å; T148-R172 PolarHBondContact O-NH2 3.1Å
149	E	95.5	Very high	94.5	Very high	15 Å²	15	42.1 Å²	42.1	7%	0.07	21%	0.21	C	C	.	.			trans	-142.7	115.6	168.2	-172.1	139	82.9	0	0	108.7	P158 Y169 R172	E149-P158 HydrophobicContact CG-CB 4.09Å; E149-P158 HydrophobicContact CG-CG 4.36Å; E149-Y169 HydrophobicContact CB-CD2 4.42Å; E149-R172 IonicContact OE2-CZ 3.31Å; E149-R172 IonicContact OE2-NH1 3.74Å; E149-R172 PolarHBondContact OE2-NH1 2.79Å; E149-R172 IonicContact OE2-NH2 2.65Å; E149-R172 PolarHBondContact OE2-NH2 3.09Å
150	F	95.6	Very high	94.6	Very high	5 Å²	5	43.3 Å²	43.3	2%	0.022	21%	0.213	C	C	.	.			trans	-82.8	136.6	174	-64.1	-66.8	0	0	0	110.6	S107 L109 F114 V119 D122 H123 L125 T148 P158 L159	S107-F150 WeakPolarHBondContact O-CA 3.17Å; L109-F150 HydrophobicContact CD1-CB 4.26Å; L109-F150 HydrophobicContact CD1-CD1 3.41Å; L109-F150 VanDerWaalsContact CD1-CD1 3.41Å; L109-F150 HydrophobicContact CD1-CD2 4.42Å; L109-F150 HydrophobicContact CD1-CE1 3.79Å; L109-F150 HydrophobicContact CD1-CG 3.78Å; L109-F150 HydrophobicContact CD1-CZ 4.44Å; L109-F150 HydrophobicContact CG-CD1 3.91Å; L109-F150 HydrophobicContact CG-CE1 4.45Å; F114-F150 HydrophobicContact CD2-CB 3.87Å; F114-F150 HydrophobicContact CD2-CD2 4.1Å; F114-F150 HydrophobicContact CD2-CG 4.24Å; F114-F150 HydrophobicContact CE2-CB 4Å; F114-F150 HydrophobicContact CE2-CD2 4.03Å; F114-F150 HydrophobicContact CE2-CG 4.43Å; V119-F150 HydrophobicContact CG1-CD2 3.72Å; V119-F150 HydrophobicContact CG1-CE2 3.64Å; V119-F150 HydrophobicContact CG1-CG 4.49Å; V119-F150 HydrophobicContact CG1-CZ 4.35Å; D122-F150 VanDerWaalsContact O-CD2 3.31Å; D122-F150 WeakPolarHBondContact O-CD2 3.34Å; D122-F150 WeakPolarHBondContact O-CE2 3.28Å; H123-F150 PolarHBondContact CE1-O 2.63Å; H123-F150 PolarHBondContact ND1-N 2.83Å; L125-F150 HydrophobicContact CD1-CZ 4.06Å; L125-F150 HydrophobicContact CD2-CE2 4.23Å; L125-F150 HydrophobicContact CD2-CZ 3.72Å; L125-F150 HydrophobicContact CG-CE2 4.38Å; L125-F150 HydrophobicContact CG-CZ 3.77Å; T148-F150 HydrophobicContact CG2-CD2 4.2Å; T148-F150 HydrophobicContact CG2-CE1 4.08Å; T148-F150 HydrophobicContact CG2-CE2 3.68Å; T148-F150 HydrophobicContact CG2-CZ 3.6Å; F150-P158 WeakPolarHBondContact O-CA 3.47Å; F150-L159 HydrophobicContact CB-CD1 3.87Å; F150-L159 PolarHBondContact O-N 3.27Å
151	V	94.9	Very high	94.3	Very high	5 Å²	5	41.8 Å²	41.8	3%	0.03	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	140.3	-177.3	-178.5	0	0	0	0	107.9	T75 S107 T108 L109 Q157 L159	T75-V151 HydrophobicContact CG2-CG2 4.32Å; S107-V151 PolarHBondContact O-N 2.84Å; T108-V151 CarbonylContact C-O 3.55Å; T108-V151 WeakPolarHBondContact CA-O 3.28Å; T108-V151 HydrophobicContact CG2-CB 4.48Å; L109-V151 PolarHBondContact N-O 3.37Å; V151-Q157 CarbonylContact C-O 3.52Å; V151-Q157 WeakPolarHBondContact CA-O 3.49Å; V151-L159 WeakPolarHBondContact O-CD1 3.48Å
152	D	95	Very high	93.8	Very high	23 Å²	23	44.3 Å²	44.3	12%	0.123	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	134	176.5	-175.5	74.2	0	0	0	110.1	S155 F156 Q157 L159	D152-S155 WeakPolarHBondContact CB-OG 3.47Å; D152-S155 WeakPolarHBondContact OD2-CB 3.43Å; D152-S155 PolarHBondContact OD2-N 2.68Å; D152-S155 PolarHBondContact OD2-OG 2.85Å; D152-F156 VanDerWaalsContact O-CA 3.24Å; D152-F156 WeakPolarHBondContact O-CA 3.49Å; D152-F156 PolarHBondContact O-N 2.78Å; D152-Q157 WeakPolarHBondContact CB-O 3.48Å; D152-Q157 PolarHBondContact N-O 3.39Å; D152-L159 HydrophobicContact CB-CD2 3.91Å; D152-L159 HydrophobicContact CB-CG 3.91Å; D152-L159 WeakPolarHBondContact OD1-CD2 3.29Å
153	D	94.2	Very high	93	Very high	73 Å²	73	48.1 Å²	48.1	39%	0.39	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-24.4	-176.7	58.3	-9.7	0	0	0	114.2	T108 L109 S110	T108-D153 HydrophobicContact CG2-CB 3.91Å; L109-D153 PolarHBondContact O-N 3.14Å; S110-D153 WeakPolarHBondContact CA-OD1 3.22Å; S110-D153 PolarHBondContact N-OD2 2.96Å
154	E	93.8	Very high	92.1	Very high	171 Å²	171	50.1 Å²	50.1	80%	0.799	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-48.7	174.2	-62.3	-172.5	169.7	0	0	112.8
155	S	92.6	Very high	91.6	Very high	63 Å²	63	50.6 Å²	50.6	44%	0.441	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.2	-10.6	-171.5	69.5	0	0	0	0	115.3	D152 Q157	D152-S155 WeakPolarHBondContact CB-OG 3.47Å; D152-S155 WeakPolarHBondContact OD2-CB 3.43Å; D152-S155 PolarHBondContact OD2-N 2.68Å; D152-S155 PolarHBondContact OD2-OG 2.85Å; S155-Q157 PolarHBondContact O-N 2.92Å; S155-Q157 VanDerWaalsContact O-N 3.09Å
156	F	92.3	Very high	91	Very high	125 Å²	125	59.5 Å²	59.5	55%	0.548	31%	0.311	S	S	.	.			trans	54.6	23.2	-175.8	-58.2	-88.1	0	0	0	114.3	D152	D152-F156 VanDerWaalsContact O-CA 3.24Å; D152-F156 WeakPolarHBondContact O-CA 3.49Å; D152-F156 PolarHBondContact O-N 2.78Å
157	Q	93.5	Very high	90.6	Very high	110 Å²	110	63 Å²	63	51%	0.514	33%	0.327	S	S	.	.	S	Bend	trans	-102.3	156.8	173.1	-63	-51.9	-64.2	0	0	110.9	V151 D152 S155 L159	V151-Q157 CarbonylContact C-O 3.52Å; V151-Q157 WeakPolarHBondContact CA-O 3.49Å; D152-Q157 WeakPolarHBondContact CB-O 3.48Å; D152-Q157 PolarHBondContact N-O 3.39Å; S155-Q157 PolarHBondContact O-N 2.92Å; S155-Q157 VanDerWaalsContact O-N 3.09Å; Q157-L159 PolarHBondContact O-N 3.46Å
158	P	93	Very high	90.3	Very high	48 Å²	48	67.5 Å²	67.5	31%	0.312	36%	0.357	S	S	.	.	B	Isolated β-bridge	trans	-56.1	130.3	171.3	-25.2	35.6	0	0	0	111.7	T75 E149 F150	T75-P158 HydrophobicContact CG2-CG 4.13Å; E149-P158 HydrophobicContact CG-CB 4.09Å; E149-P158 HydrophobicContact CG-CG 4.36Å; F150-P158 WeakPolarHBondContact O-CA 3.47Å
159	L	93.6	Very high	90.2	Very high	10 Å²	10	67.7 Å²	67.7	5%	0.052	36%	0.357	C	S	.	.	P	Polyproline II helix	trans	-59.7	153	178.2	-80.6	148.5	0	0	0	111.4	L109 Q111 F114 H123 F150 V151 D152 Q157 G161	L109-L159 HydrophobicContact CB-CD1 4.04Å; Q111-L159 HydrophobicContact CB-CD2 4.4Å; F114-L159 HydrophobicContact CB-CD1 3.88Å; F114-L159 HydrophobicContact CB-CD2 4.35Å; F114-L159 HydrophobicContact CD1-CB 4.03Å; F114-L159 HydrophobicContact CD1-CD2 4.36Å; F114-L159 HydrophobicContact CD2-CB 3.93Å; F114-L159 HydrophobicContact CD2-CD1 3.74Å; F114-L159 HydrophobicContact CD2-CG 4.37Å; F114-L159 HydrophobicContact CE1-CB 3.95Å; F114-L159 HydrophobicContact CE2-CB 3.87Å; F114-L159 HydrophobicContact CE2-CD1 4.44Å; F114-L159 HydrophobicContact CG-CB 4.01Å; F114-L159 HydrophobicContact CG-CD1 3.81Å; F114-L159 HydrophobicContact CG-CD2 4.3Å; F114-L159 HydrophobicContact CG-CG 4.25Å; F114-L159 HydrophobicContact CZ-CB 3.88Å; H123-L159 PolarHBondContact CE1-O 3.48Å; H123-L159 PolarHBondContact NE2-O 2.88Å; F150-L159 HydrophobicContact CB-CD1 3.87Å; F150-L159 PolarHBondContact O-N 3.27Å; V151-L159 WeakPolarHBondContact O-CD1 3.48Å; D152-L159 HydrophobicContact CB-CD2 3.91Å; D152-L159 HydrophobicContact CB-CG 3.91Å; D152-L159 WeakPolarHBondContact OD1-CD2 3.29Å; Q157-L159 PolarHBondContact O-N 3.46Å; L159-G161 PolarHBondContact O-N 3.44Å
160	K	89.8	Confident	90.2	Very high	172 Å²	172	69.3 Å²	69.3	75%	0.748	37%	0.366	S	S	*	.			trans	-93.6	80.6	-175.1	-70.9	176.3	-174.1	163.6	0	111.2
161	G	84.5	Confident	90.1	Very high	4 Å²	4	74.6 Å²	74.6	4%	0.041	39%	0.389	C	S	.	.			trans	-63.1	-178.3	173.7	0	0	0	0	0	115.7	N121 L159 R166	N121-G161 WeakPolarHBondContact O-CA 3.23Å; L159-G161 PolarHBondContact O-N 3.44Å; G161-R166 PolarHBondContact O-NE 2.68Å
162	S	81.7	Confident	90.1	Very high	57 Å²	57	74.9 Å²	74.9	40%	0.399	39%	0.389	S	S	.	.			trans	-48.9	159.2	172.7	-71.2	0	0	0	0	112.7	N121 S164 Q165 R166	N121-S162 PolarHBondContact O-N 2.91Å; N121-S162 VanDerWaalsContact O-N 3.16Å; S162-S164 PolarHBondContact O-N 2.66Å; S162-Q165 WeakPolarHBondContact O-CA 3.46Å; S162-Q165 WeakPolarHBondContact O-CB 3.48Å; S162-Q165 PolarHBondContact O-N 2.92Å; S162-R166 PolarHBondContact O-N 3.13Å
163	A	79.1	Confident	90.1	Very high	83 Å²	83	73.8 Å²	73.8	69%	0.686	38%	0.384	S	S	*	.	G	3₁₀ helix	trans	-53.5	-36.1	-173.1	0	0	0	0	0	114.4	Q165	A163-Q165 VanDerWaalsContact C-N 3.31Å; A163-Q165 PolarHBondContact O-N 3.31Å
164	S	79.1	Confident	90.2	Very high	77 Å²	77	71 Å²	71	54%	0.538	37%	0.369	S	S	.	.	G	3₁₀ helix	trans	-68.3	-23	173.9	48	0	0	0	0	114.7	S162	S162-S164 PolarHBondContact O-N 2.66Å
165	Q	86.9	Confident	90.3	Very high	13 Å²	13	64.6 Å²	64.6	6%	0.061	35%	0.346	C	S	.	.	G	3₁₀ helix	trans	-89.1	-13.5	-175.7	-56.4	-68	-21.7	0	0	112.7	D122 W124 S162 A163 E167 R172	D122-Q165 PolarHBondContact OD1-NE2 2.75Å; W124-Q165 VanDerWaalsContact NE1-NE2 3.2Å; S162-Q165 WeakPolarHBondContact O-CA 3.46Å; S162-Q165 WeakPolarHBondContact O-CB 3.48Å; S162-Q165 PolarHBondContact O-N 2.92Å; A163-Q165 VanDerWaalsContact C-N 3.31Å; A163-Q165 PolarHBondContact O-N 3.31Å; Q165-E167 PolarHBondContact O-N 2.89Å; Q165-R172 VanDerWaalsContact O-CD 3.29Å; Q165-R172 WeakPolarHBondContact O-CD 3.43Å; Q165-R172 PolarHBondContact O-NH1 3.15Å
166	R	84.3	Confident	90.5	Very high	186 Å²	186	63.6 Å²	63.6	70%	0.702	34%	0.335	S	S	*	.	G	3₁₀ helix	trans	-73.3	-5.8	179.6	-60.9	-178.4	-175.1	-177.2	-0	114.4	G161 S162	G161-R166 PolarHBondContact O-NE 2.68Å; S162-R166 PolarHBondContact O-N 3.13Å
167	E	88.8	Confident	90.6	Very high	73 Å²	73	66 Å²	66	34%	0.341	35%	0.345	S	S	.	.	S	Bend	trans	-71.6	146.1	173.6	-58	-156.7	140	0	0	111.1	Q165 K171 R172	Q165-E167 PolarHBondContact O-N 2.89Å; E167-K171 VanDerWaalsContact CD-NZ 3.32Å; E167-K171 WeakPolarHBondContact OE1-CE 3.49Å; E167-K171 IonicContact OE1-NZ 3.98Å; E167-K171 PolarHBondContact OE1-NZ 2.8Å; E167-K171 WeakPolarHBondContact OE2-CD 3.29Å; E167-K171 WeakPolarHBondContact OE2-CE 3.49Å; E167-K171 WeakPolarHBondContact OE2-CG 3.28Å; E167-K171 IonicContact OE2-NZ 2.71Å; E167-K171 PolarHBondContact OE2-NZ 2.92Å; E167-R172 HydrophobicContact CB-CB 4.42Å; E167-R172 PolarHBondContact O-NH1 3.46Å
168	P	91.8	Very high	90.7	Very high	98 Å²	98	61.3 Å²	61.3	64%	0.636	32%	0.323	S	S	*	.			trans	-55.2	143.1	175.5	-25.4	34.1	0	0	0	112.4	L170 K171 R172	P168-L170 VanDerWaalsContact C-N 3.28Å; P168-L170 PolarHBondContact O-N 2.79Å; P168-L170 VanDerWaalsContact O-N 3.09Å; P168-K171 PolarHBondContact O-N 3.42Å; P168-R172 PolarHBondContact O-N 2.77Å; P168-R172 VanDerWaalsContact O-N 3.13Å
169	Y	95	Very high	90.7	Very high	10 Å²	10	63.9 Å²	63.9	4%	0.039	33%	0.331	C	S	.	.	H	α-helix	trans	-45.8	-48.6	-174.2	178.8	-87.4	0	0	0	113.4	G71 S73 Q147 T148 E149 K171 R172 C173 F233	G71-Y169 PolarHBondContact N-OH 3.46Å; G71-Y169 VanDerWaalsContact N-OH 3.13Å; G71-Y169 WeakPolarHBondContact O-CE1 3.46Å; G71-Y169 PolarHBondContact O-OH 3.49Å; S73-Y169 VanDerWaalsContact CB-CE2 3.43Å; S73-Y169 WeakPolarHBondContact OG-CE2 3.4Å; S73-Y169 PolarHBondContact OG-OH 3.45Å; Q147-Y169 HydrophobicContact CB-CE2 4.3Å; Q147-Y169 WeakPolarHBondContact O-CE2 3.33Å; Q147-Y169 PolarHBondContact O-OH 3.36Å; T148-Y169 VanDerWaalsContact O-CD2 3.28Å; T148-Y169 WeakPolarHBondContact O-CD2 3.26Å; T148-Y169 WeakPolarHBondContact O-CE2 3.37Å; E149-Y169 HydrophobicContact CB-CD2 4.42Å; Y169-K171 PolarHBondContact O-N 2.85Å; Y169-R172 PolarHBondContact O-N 3.06Å; Y169-R172 VanDerWaalsContact O-N 3.15Å; Y169-C173 HydrophobicContact CD1-CB 4.16Å; Y169-C173 HydrophobicContact CD2-CB 4.4Å; Y169-C173 HydrophobicContact CE1-CB 3.63Å; Y169-C173 HydrophobicContact CE2-CB 3.89Å; Y169-C173 VanDerWaalsContact CZ-CB 3.47Å; Y169-C173 WeakPolarHBondContact O-CB 3.19Å; Y169-C173 PolarHBondContact O-N 2.96Å; Y169-C173 PolarHBondContact O-SG 3.47Å; Y169-F233 HydrophobicContact CD1-CE1 4.49Å; Y169-F233 HydrophobicContact CD1-CE2 4.3Å; Y169-F233 AromaticContact CD1-CZ 3.55Å; Y169-F233 HydrophobicContact CD1-CZ 3.55Å; Y169-F233 HydrophobicContact CE1-CE1 4.3Å; Y169-F233 AromaticContact CE1-CZ 3.75Å; Y169-F233 HydrophobicContact CE1-CZ 3.75Å
170	L	94.2	Very high	90.8	Very high	50 Å²	50	63.6 Å²	63.6	26%	0.262	33%	0.33	S	S	.	.	H	α-helix	trans	-56.9	-25.6	-177.3	-79.9	172.8	0	0	0	114.4	P168 F233 A236 L237 N240	P168-L170 VanDerWaalsContact C-N 3.28Å; P168-L170 PolarHBondContact O-N 2.79Å; P168-L170 VanDerWaalsContact O-N 3.09Å; L170-F233 HydrophobicContact CD1-CD2 4.37Å; L170-F233 HydrophobicContact CD1-CE2 4.36Å; L170-F233 HydrophobicContact CD2-CD1 4.34Å; L170-F233 HydrophobicContact CD2-CD2 4.11Å; L170-F233 HydrophobicContact CD2-CE1 4.01Å; L170-F233 HydrophobicContact CD2-CE2 3.8Å; L170-F233 HydrophobicContact CD2-CG 4.39Å; L170-F233 HydrophobicContact CD2-CZ 3.76Å; L170-F233 HydrophobicContact CG-CD2 4.3Å; L170-F233 HydrophobicContact CG-CE2 3.86Å; L170-F233 HydrophobicContact CG-CZ 4.19Å; L170-A236 HydrophobicContact CD1-CB 4.08Å; L170-A236 HydrophobicContact CD2-CB 4.3Å; L170-L237 HydrophobicContact CD2-CB 3.96Å; L170-L237 HydrophobicContact CD2-CD1 4.22Å; L170-N240 PolarHBondContact O-ND2 3.4Å
171	K	93.5	Very high	91	Very high	116 Å²	116	58.6 Å²	58.6	50%	0.504	32%	0.315	S	S	.	.	H	α-helix	trans	-89.1	-52.6	173.2	-171.4	179.3	172.1	-161.5	0	110	E167 P168 Y169 C173 T174	E167-K171 VanDerWaalsContact CD-NZ 3.32Å; E167-K171 WeakPolarHBondContact OE1-CE 3.49Å; E167-K171 IonicContact OE1-NZ 3.98Å; E167-K171 PolarHBondContact OE1-NZ 2.8Å; E167-K171 WeakPolarHBondContact OE2-CD 3.29Å; E167-K171 WeakPolarHBondContact OE2-CE 3.49Å; E167-K171 WeakPolarHBondContact OE2-CG 3.28Å; E167-K171 IonicContact OE2-NZ 2.71Å; E167-K171 PolarHBondContact OE2-NZ 2.92Å; P168-K171 PolarHBondContact O-N 3.42Å; Y169-K171 PolarHBondContact O-N 2.85Å; K171-C173 PolarHBondContact O-N 3.07Å; K171-T174 PolarHBondContact O-N 2.92Å; K171-T174 VanDerWaalsContact O-N 3.15Å; K171-T174 PolarHBondContact O-OG1 2.88Å
172	R	94.5	Very high	91.3	Very high	11 Å²	11	64.5 Å²	64.5	4%	0.042	35%	0.345	C	S	.	.	H	α-helix	trans	-54.9	-43.3	-176.5	-170.7	177.9	72.3	-130.2	6.3	113.6	H123 T148 E149 Q165 E167 P168 Y169 T174 A175	H123-R172 VanDerWaalsContact CB-NH2 3.29Å; T148-R172 PolarHBondContact O-NH2 3.1Å; E149-R172 IonicContact OE2-CZ 3.31Å; E149-R172 IonicContact OE2-NH1 3.74Å; E149-R172 PolarHBondContact OE2-NH1 2.79Å; E149-R172 IonicContact OE2-NH2 2.65Å; E149-R172 PolarHBondContact OE2-NH2 3.09Å; Q165-R172 VanDerWaalsContact O-CD 3.29Å; Q165-R172 WeakPolarHBondContact O-CD 3.43Å; Q165-R172 PolarHBondContact O-NH1 3.15Å; E167-R172 HydrophobicContact CB-CB 4.42Å; E167-R172 PolarHBondContact O-NH1 3.46Å; P168-R172 PolarHBondContact O-N 2.77Å; P168-R172 VanDerWaalsContact O-N 3.13Å; Y169-R172 PolarHBondContact O-N 3.06Å; Y169-R172 VanDerWaalsContact O-N 3.15Å; R172-T174 PolarHBondContact O-N 2.88Å; R172-T174 VanDerWaalsContact O-N 3.13Å; R172-A175 WeakPolarHBondContact O-CB 3.31Å; R172-A175 PolarHBondContact O-N 3.02Å
173	C	96	Very high	92	Very high	0 Å²	0	61.8 Å²	61.8	0%	0	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-18.6	-177.5	66.1	0	0	0	0	114.3	I70 Q147 Y169 K171 F213 L237	I70-C173 HydrophobicContact CB-CB 4.43Å; I70-C173 HydrophobicContact CG2-CB 4.24Å; I70-C173 WeakPolarHBondContact CG2-O 3.31Å; Q147-C173 HydrophobicContact CB-CB 3.78Å; Q147-C173 HydrophobicContact CG-CB 4.19Å; Y169-C173 HydrophobicContact CD1-CB 4.16Å; Y169-C173 HydrophobicContact CD2-CB 4.4Å; Y169-C173 HydrophobicContact CE1-CB 3.63Å; Y169-C173 HydrophobicContact CE2-CB 3.89Å; Y169-C173 VanDerWaalsContact CZ-CB 3.47Å; Y169-C173 WeakPolarHBondContact O-CB 3.19Å; Y169-C173 PolarHBondContact O-N 2.96Å; Y169-C173 PolarHBondContact O-SG 3.47Å; K171-C173 PolarHBondContact O-N 3.07Å; C173-F213 WeakPolarHBondContact O-CE1 3.48Å; C173-L237 WeakPolarHBondContact SG-CD1 3.33Å
174	T	96.3	Very high	92.9	Very high	14 Å²	14	58.2 Å²	58.2	9%	0.086	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.2	6.5	176.9	64.2	0	0	0	0	113.7	K171 R172 I176 N240 V241	K171-T174 PolarHBondContact O-N 2.92Å; K171-T174 VanDerWaalsContact O-N 3.15Å; K171-T174 PolarHBondContact O-OG1 2.88Å; R172-T174 PolarHBondContact O-N 2.88Å; R172-T174 VanDerWaalsContact O-N 3.13Å; T174-I176 PolarHBondContact O-N 3.37Å; T174-N240 HydrophobicContact CG2-CB 3.86Å; T174-V241 HydrophobicContact CG2-CG2 3.96Å
175	A	94.9	Very high	93.7	Very high	37 Å²	37	54.9 Å²	54.9	31%	0.306	27%	0.272	S	S	.	.			trans	-62.7	121.1	178.7	0	0	0	0	0	112	R172 L178	R172-A175 WeakPolarHBondContact O-CB 3.31Å; R172-A175 PolarHBondContact O-N 3.02Å; A175-L178 HydrophobicContact CB-CD2 3.88Å
176	I	96.7	Very high	94.2	Very high	41 Å²	41	54.4 Å²	54.4	21%	0.21	27%	0.27	C	S	.	.	S	Bend	trans	-77.8	-33.2	-178.7	-59	-56.8	0	0	0	112.6	T174 V209 V210 F213 V244 K246	T174-I176 PolarHBondContact O-N 3.37Å; I176-V209 HydrophobicContact CG2-CG1 4.22Å; I176-V209 CarbonylContact O-C 2.99Å; I176-V209 VanDerWaalsContact O-CA 3.28Å; I176-V209 WeakPolarHBondContact O-CA 3.11Å; I176-V210 HydrophobicContact CD1-CB 4.45Å; I176-V210 PolarHBondContact O-N 3.49Å; I176-F213 HydrophobicContact CD1-CE2 3.86Å; I176-F213 HydrophobicContact CD1-CZ 3.75Å; I176-V244 HydrophobicContact CD1-CB 4.16Å; I176-V244 HydrophobicContact CD1-CG2 4.1Å; I176-V244 HydrophobicContact CG1-CB 4.32Å; I176-K246 HydrophobicContact CD1-CD 4.48Å; I176-K246 HydrophobicContact CD1-CG 3.56Å
177	K	95.6	Very high	94.7	Very high	177 Å²	177	46.8 Å²	46.8	77%	0.77	24%	0.243	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-108.8	113.9	179.9	-66.7	-179.5	179.2	-179.5	0	108.7
178	L	94.7	Very high	95	Very high	11 Å²	11	43.4 Å²	43.4	6%	0.058	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	136.7	175	-50.9	178.8	0	0	0	108.5	W124 V145 A175 R207 A208 V210	W124-L178 HydrophobicContact CD2-CD1 4.18Å; W124-L178 HydrophobicContact CE3-CD1 4.25Å; W124-L178 HydrophobicContact CH2-CB 4.12Å; W124-L178 HydrophobicContact CZ2-CB 3.79Å; W124-L178 HydrophobicContact CZ3-CD1 4.42Å; V145-L178 HydrophobicContact CB-CD1 4.44Å; V145-L178 HydrophobicContact CG1-CD1 3.71Å; V145-L178 HydrophobicContact CG2-CD1 4.33Å; A175-L178 HydrophobicContact CB-CD2 3.88Å; L178-R207 WeakPolarHBondContact O-CA 3.46Å; L178-A208 HydrophobicContact CB-CB 4.28Å; L178-A208 PolarHBondContact N-O 3.48Å; L178-A208 PolarHBondContact O-N 3.24Å; L178-V210 HydrophobicContact CD1-CG2 4.25Å
179	H	94.6	Very high	95.1	Very high	102 Å²	102	42.1 Å²	42.1	47%	0.472	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	124.5	178.8	-175.5	33.2	0	0	0	109.2	G206 R207	H179-G206 WeakPolarHBondContact CA-O 3.19Å; H179-G206 PolarHBondContact ND1-O 3.36Å; H179-R207 WeakPolarHBondContact ND1-CG 3.29Å
180	S	94.5	Very high	95	Very high	4 Å²	4	45.2 Å²	45.2	3%	0.028	23%	0.228	C	C	.	.			trans	-156.8	93.9	179.6	-172.2	0	0	0	0	106.7	N120 D122 G206	N120-S180 PolarHBondContact ND2-OG 2.97Å; D122-S180 WeakPolarHBondContact OD2-CB 3.26Å; D122-S180 PolarHBondContact OD2-OG 3.05Å; S180-G206 CarbonylContact C-O 3.54Å; S180-G206 PolarHBondContact N-O 2.98Å; S180-G206 CarbonylContact O-C 3.55Å; S180-G206 VanDerWaalsContact O-CA 3.25Å; S180-G206 WeakPolarHBondContact O-CA 3.47Å
181	P	93.4	Very high	95.1	Very high	67 Å²	67	42.9 Å²	42.9	44%	0.435	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.9	142	174.9	-24.2	33.8	0	0	0	111.2	N120 K183	N120-P181 PolarHBondContact ND2-O 2.79Å; P181-K183 PolarHBondContact O-N 2.89Å
182	D	92.7	Very high	95.1	Very high	127 Å²	127	38.3 Å²	38.3	68%	0.679	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.6	11.3	173	-48.8	-47.6	0	0	0	116.5	L184	D182-L184 PolarHBondContact O-N 2.87Å
183	K	96.2	Very high	94.9	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	22%	0.22	C	C	.	.	P	Polyproline II helix	trans	-58.9	122.2	-179.4	-163.4	-176.3	-171.6	70.6	0	111.7	P117 V118 V119 N120 D122 W124 P181 T202 L203	P117-K183 WeakPolarHBondContact O-CA 3.37Å; V118-K183 PolarHBondContact O-NZ 2.85Å; V119-K183 PolarHBondContact O-NZ 2.89Å; N120-K183 HydrophobicContact CB-CG 4.22Å; D122-K183 IonicContact OD2-NZ 3.87Å; D122-K183 PolarHBondContact OD2-NZ 3.05Å; W124-K183 HydrophobicContact CE3-CD 4.08Å; W124-K183 HydrophobicContact CH2-CD 3.45Å; W124-K183 VanDerWaalsContact CH2-CD 3.45Å; W124-K183 HydrophobicContact CZ2-CD 3.91Å; W124-K183 HydrophobicContact CZ3-CD 3.54Å; W124-K183 WeakPolarHBondContact O-CE 3.15Å; W124-K183 PolarHBondContact O-NZ 2.88Å; P181-K183 PolarHBondContact O-N 2.89Å; K183-T202 CarbonylContact O-C 3.44Å; K183-T202 WeakPolarHBondContact O-CA 3.21Å; K183-L203 HydrophobicContact CB-CB 4.3Å; K183-L203 PolarHBondContact O-N 3.33Å
184	L	97	Very high	94.9	Very high	8 Å²	8	42.9 Å²	42.9	4%	0.042	24%	0.236	C	C	.	.	B	Isolated β-bridge	trans	-83.1	153.2	176.5	-71.4	176.5	0	0	0	112.7	P117 V118 D182 E195 Q200 T202	P117-L184 HydrophobicContact CB-CD1 3.92Å; P117-L184 HydrophobicContact CB-CG 4.17Å; P117-L184 HydrophobicContact CG-CD1 3.8Å; P117-L184 PolarHBondContact O-N 2.8Å; V118-L184 HydrophobicContact CG2-CB 3.82Å; V118-L184 HydrophobicContact CG2-CD1 4.36Å; D182-L184 PolarHBondContact O-N 2.87Å; L184-E195 HydrophobicContact CD1-CB 4.34Å; L184-Q200 VanDerWaalsContact CD1-OE1 3.26Å; L184-Q200 HydrophobicContact CD2-CB 4.44Å; L184-T202 HydrophobicContact CD2-CG2 3.73Å
185	M	96.9	Very high	94.8	Very high	7 Å²	7	43.3 Å²	43.3	3%	0.034	24%	0.237	C	C	.	.	B	Isolated β-bridge	trans	-64.9	128.7	170.4	176.1	178.8	67.5	0	0	110.7	R95 Y126 G128 I187 Q191 E199 K201	R95-M185 PolarHBondContact NH2-SD 2.87Å; R95-M185 VanDerWaalsContact NH2-SD 3.43Å; Y126-M185 HydrophobicContact CD1-CB 4.06Å; Y126-M185 HydrophobicContact CE1-CB 3.97Å; Y126-M185 CarbonylContact O-C 3.52Å; Y126-M185 WeakPolarHBondContact O-CA 3.09Å; G128-M185 VanDerWaalsContact CA-SD 3.6Å; M185-I187 HydrophobicContact CE-CD1 4.1Å; M185-I187 HydrophobicContact CE-CG1 4.27Å; M185-Q191 PolarHBondContact O-NE2 3.01Å; M185-Q191 PolarHBondContact O-OE1 3.23Å; M185-E199 HydrophobicContact CE-CB 4.27Å; M185-E199 HydrophobicContact CE-CG 4.25Å; M185-E199 WeakPolarHBondContact CE-OE2 3.45Å; M185-K201 HydrophobicContact CB-CB 4.05Å; M185-K201 VanDerWaalsContact CB-O 3.25Å; M185-K201 WeakPolarHBondContact CB-O 3.27Å; M185-K201 HydrophobicContact CE-CB 3.91Å; M185-K201 PolarHBondContact N-O 3.16Å; M185-K201 HydrophobicContact SD-CB 4.33Å; M185-K201 HydrophobicContact SD-CD 4.27Å
186	Y	97.5	Very high	94.8	Very high	4 Å²	4	48.2 Å²	48.2	2%	0.016	25%	0.253	C	S	.	.	P	Polyproline II helix	trans	-78.7	136.5	171.8	-179.6	-93.7	0	0	0	111.8	R95 H105 V118 L125 Y126 W127 C188 K189	R95-Y186 PolarHBondContact NH1-O 2.93Å; H105-Y186 AromaticContact CE1-CE1 3.85Å; H105-Y186 AromaticContact ND1-CE1 3.39Å; H105-Y186 WeakPolarHBondContact ND1-CE1 3.48Å; H105-Y186 AromaticContact ND1-CZ 3.63Å; H105-Y186 PolarHBondContact ND1-OH 3.37Å; V118-Y186 HydrophobicContact CG1-CD2 3.66Å; V118-Y186 HydrophobicContact CG1-CG 4.17Å; L125-Y186 HydrophobicContact CD1-CD1 3.87Å; L125-Y186 HydrophobicContact CD1-CD2 4.06Å; L125-Y186 HydrophobicContact CD1-CE1 4.11Å; L125-Y186 HydrophobicContact CD1-CE2 4.31Å; L125-Y186 HydrophobicContact CD1-CG 3.84Å; L125-Y186 HydrophobicContact CD2-CD2 3.92Å; L125-Y186 HydrophobicContact CD2-CG 4.05Å; L125-Y186 HydrophobicContact CG-CG 4.39Å; Y126-Y186 PolarHBondContact O-N 2.81Å; W127-Y186 HydrophobicContact CD2-CD1 4.22Å; W127-Y186 AromaticContact CE2-CD1 3.96Å; W127-Y186 HydrophobicContact CE3-CD1 4.03Å; W127-Y186 AromaticContact CH2-CD1 3.42Å; W127-Y186 HydrophobicContact CH2-CD1 3.42Å; W127-Y186 VanDerWaalsContact CH2-CD1 3.42Å; W127-Y186 AromaticContact CH2-CE1 3.35Å; W127-Y186 HydrophobicContact CH2-CE1 3.35Å; W127-Y186 AromaticContact CZ2-CD1 3.58Å; W127-Y186 HydrophobicContact CZ2-CD1 3.58Å; W127-Y186 AromaticContact CZ2-CE1 3.64Å; W127-Y186 HydrophobicContact CZ2-CE1 3.64Å; W127-Y186 AromaticContact CZ3-CD1 3.62Å; W127-Y186 HydrophobicContact CZ3-CD1 3.62Å; W127-Y186 AromaticContact CZ3-CE1 3.93Å; W127-Y186 HydrophobicContact CZ3-CE1 3.93Å; Y186-C188 VanDerWaalsContact CE2-O 3.27Å; Y186-C188 WeakPolarHBondContact CE2-O 3.42Å; Y186-C188 VanDerWaalsContact CZ-C 3.42Å; Y186-K189 PolarHBondContact OH-N 3.04Å; Y186-K189 VanDerWaalsContact OH-N 3.08Å
187	I	94.5	Very high	94.7	Very high	26 Å²	26	51.9 Å²	51.9	13%	0.133	27%	0.273	C	S	.	.			trans	-116.5	-59.5	-178.8	-51.7	-165	0	0	0	110.4	M185 Y198 E199	M185-I187 HydrophobicContact CE-CD1 4.1Å; M185-I187 HydrophobicContact CE-CG1 4.27Å; I187-Y198 HydrophobicContact CB-CD1 4.49Å; I187-Y198 HydrophobicContact CD1-CD1 4.14Å; I187-Y198 HydrophobicContact CG2-CD1 4.42Å; I187-E199 HydrophobicContact CD1-CB 4.1Å
188	C	93.7	Very high	94.6	Very high	1 Å²	1	46.8 Å²	46.8	1%	0.007	25%	0.25	C	C	.	.			trans	-156.5	176.3	177.3	63.4	0	0	0	0	110.4	R102 Y186 D190 Q191	R102-C188 HydrophobicContact CG-CB 4.03Å; Y186-C188 VanDerWaalsContact CE2-O 3.27Å; Y186-C188 WeakPolarHBondContact CE2-O 3.42Å; Y186-C188 VanDerWaalsContact CZ-C 3.42Å; C188-D190 PolarHBondContact O-N 3.37Å; C188-D190 PolarHBondContact SG-OD2 3.46Å; C188-D190 VanDerWaalsContact SG-OD2 3.38Å; C188-Q191 WeakPolarHBondContact O-CB 3.43Å; C188-Q191 PolarHBondContact O-N 2.84Å
189	K	94	Very high	94.5	Very high	72 Å²	72	51.9 Å²	51.9	31%	0.313	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	-62.6	-33.5	176.7	68.5	179	-171	171.1	0	112.1	D104 I106 Y186 Q191 L192	D104-K189 WeakPolarHBondContact OD2-CE 3.09Å; D104-K189 IonicContact OD2-NZ 3.17Å; D104-K189 PolarHBondContact OD2-NZ 3.22Å; I106-K189 HydrophobicContact CB-CB 4.07Å; I106-K189 HydrophobicContact CG2-CB 3.64Å; Y186-K189 PolarHBondContact OH-N 3.04Å; Y186-K189 VanDerWaalsContact OH-N 3.08Å; K189-Q191 PolarHBondContact O-N 2.95Å; K189-Q191 VanDerWaalsContact O-N 3.09Å; K189-L192 PolarHBondContact O-N 3.35Å
190	D	94.2	Very high	94.4	Very high	75 Å²	75	51.9 Å²	51.9	40%	0.401	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	-75.8	4.7	-174.9	-31	-69.6	0	0	0	113.3	C188 V194 Y198	C188-D190 PolarHBondContact O-N 3.37Å; C188-D190 PolarHBondContact SG-OD2 3.46Å; C188-D190 VanDerWaalsContact SG-OD2 3.38Å; D190-V194 VanDerWaalsContact O-CG2 3.23Å; D190-V194 WeakPolarHBondContact O-CG2 3.48Å; D190-Y198 VanDerWaalsContact O-CE2 3.25Å; D190-Y198 WeakPolarHBondContact O-CE2 3.37Å; D190-Y198 PolarHBondContact O-OH 3.11Å
191	Q	95.2	Very high	94.5	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-86.8	-26.8	172.1	-177.6	-174.5	11.3	0	0	112.4	V118 M185 C188 K189 V194 E195 Y198	V118-Q191 HydrophobicContact CG2-CG 4.24Å; M185-Q191 PolarHBondContact O-NE2 3.01Å; M185-Q191 PolarHBondContact O-OE1 3.23Å; C188-Q191 WeakPolarHBondContact O-CB 3.43Å; C188-Q191 PolarHBondContact O-N 2.84Å; K189-Q191 PolarHBondContact O-N 2.95Å; K189-Q191 VanDerWaalsContact O-N 3.09Å; Q191-V194 CarbonylContact O-C 3.33Å; Q191-V194 PolarHBondContact O-N 2.85Å; Q191-E195 WeakPolarHBondContact O-CA 3.18Å; Q191-E195 PolarHBondContact O-N 3.28Å; Q191-E195 VanDerWaalsContact O-N 3.13Å; Q191-Y198 HydrophobicContact CB-CD1 4.45Å; Q191-Y198 HydrophobicContact CB-CD2 4.06Å; Q191-Y198 HydrophobicContact CB-CE2 4.17Å; Q191-Y198 HydrophobicContact CB-CG 4.2Å; Q191-Y198 HydrophobicContact CG-CD1 4.49Å; Q191-Y198 HydrophobicContact CG-CD2 3.94Å; Q191-Y198 HydrophobicContact CG-CG 3.9Å
192	L	94.1	Very high	94.6	Very high	21 Å²	21	54.8 Å²	54.8	11%	0.11	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.2	132.1	-172.5	-55.2	178	0	0	0	110	I106 L109 D113 V118 V119 K189 V194	I106-L192 HydrophobicContact CG2-CD1 4.35Å; L109-L192 HydrophobicContact CD1-CD1 4.5Å; L109-L192 HydrophobicContact CD2-CD1 3.51Å; D113-L192 HydrophobicContact CB-CB 4.24Å; D113-L192 HydrophobicContact CB-CD1 4.3Å; V118-L192 HydrophobicContact CB-CD2 3.92Å; V118-L192 HydrophobicContact CG1-CD2 4.06Å; V118-L192 HydrophobicContact CG2-CD2 4.48Å; V119-L192 HydrophobicContact CG2-CD2 4.02Å; K189-L192 PolarHBondContact O-N 3.35Å; L192-V194 PolarHBondContact O-N 2.68Å
193	G	91.1	Very high	94.7	Very high	50 Å²	50	48.9 Å²	48.9	52%	0.515	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.7	-11.3	-175.5	0	0	0	0	0	115.6	E195	G193-E195 VanDerWaalsContact N-CD 3.34Å; G193-E195 PolarHBondContact N-OE1 3.21Å; G193-E195 PolarHBondContact N-OE2 3Å
194	V	95.3	Very high	94.4	Very high	56 Å²	56	51 Å²	51	34%	0.339	27%	0.267	S	S	.	.			trans	-130.7	37.1	175.6	-68.2	0	0	0	0	110.7	D190 Q191 L192 H196 D197 Y198	D190-V194 VanDerWaalsContact O-CG2 3.23Å; D190-V194 WeakPolarHBondContact O-CG2 3.48Å; Q191-V194 CarbonylContact O-C 3.33Å; Q191-V194 PolarHBondContact O-N 2.85Å; L192-V194 PolarHBondContact O-N 2.68Å; V194-H196 PolarHBondContact O-N 2.74Å; V194-D197 PolarHBondContact O-N 2.78Å; V194-D197 VanDerWaalsContact O-N 3.11Å; V194-Y198 HydrophobicContact CG2-CE2 4.15Å
195	E	94.7	Very high	94.1	Very high	24 Å²	24	57.7 Å²	57.7	11%	0.112	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-57.6	-34.5	-167.3	-67.3	79.2	-179	0	0	112.2	P117 V118 L184 Q191 G193 D197 Y198 Q200	P117-E195 HydrophobicContact CG-CG 4.15Å; V118-E195 HydrophobicContact CG2-CG 3.71Å; L184-E195 HydrophobicContact CD1-CB 4.34Å; Q191-E195 WeakPolarHBondContact O-CA 3.18Å; Q191-E195 PolarHBondContact O-N 3.28Å; Q191-E195 VanDerWaalsContact O-N 3.13Å; G193-E195 VanDerWaalsContact N-CD 3.34Å; G193-E195 PolarHBondContact N-OE1 3.21Å; G193-E195 PolarHBondContact N-OE2 3Å; E195-D197 VanDerWaalsContact C-N 3.25Å; E195-D197 PolarHBondContact O-N 2.97Å; E195-Y198 WeakPolarHBondContact O-CB 3.38Å; E195-Y198 PolarHBondContact O-N 2.81Å; E195-Q200 PolarHBondContact O-NE2 2.77Å
196	H	93.9	Very high	93.9	Very high	139 Å²	139	57.6 Å²	57.6	64%	0.644	30%	0.304	S	S	*	.	G	3₁₀ helix	trans	-63	-21.9	-177.4	61	-84.1	0	0	0	115	V194 Y198	V194-H196 PolarHBondContact O-N 2.74Å; H196-Y198 PolarHBondContact O-N 3.48Å
197	D	95.2	Very high	93.7	Very high	118 Å²	118	64.7 Å²	64.7	63%	0.631	33%	0.33	S	S	*	.	G	3₁₀ helix	trans	-77.4	-7.3	175.1	-70.1	-24.2	0	0	0	112.7	V194 E195	V194-D197 PolarHBondContact O-N 2.78Å; V194-D197 VanDerWaalsContact O-N 3.11Å; E195-D197 VanDerWaalsContact C-N 3.25Å; E195-D197 PolarHBondContact O-N 2.97Å
198	Y	94	Very high	93.7	Very high	70 Å²	70	63.5 Å²	63.5	28%	0.275	33%	0.325	S	S	.	.	S	Bend	trans	-115.9	171.1	-175.7	-70.4	-95.5	0	0	0	112.8	I187 D190 Q191 V194 E195 H196 Q200	I187-Y198 HydrophobicContact CB-CD1 4.49Å; I187-Y198 HydrophobicContact CD1-CD1 4.14Å; I187-Y198 HydrophobicContact CG2-CD1 4.42Å; D190-Y198 VanDerWaalsContact O-CE2 3.25Å; D190-Y198 WeakPolarHBondContact O-CE2 3.37Å; D190-Y198 PolarHBondContact O-OH 3.11Å; Q191-Y198 HydrophobicContact CB-CD1 4.45Å; Q191-Y198 HydrophobicContact CB-CD2 4.06Å; Q191-Y198 HydrophobicContact CB-CE2 4.17Å; Q191-Y198 HydrophobicContact CB-CG 4.2Å; Q191-Y198 HydrophobicContact CG-CD1 4.49Å; Q191-Y198 HydrophobicContact CG-CD2 3.94Å; Q191-Y198 HydrophobicContact CG-CG 3.9Å; V194-Y198 HydrophobicContact CG2-CE2 4.15Å; E195-Y198 WeakPolarHBondContact O-CB 3.38Å; E195-Y198 PolarHBondContact O-N 2.81Å; H196-Y198 PolarHBondContact O-N 3.48Å; Y198-Q200 PolarHBondContact O-N 3.37Å; Y198-Q200 PolarHBondContact O-NE2 3.44Å
199	E	92.6	Very high	93.8	Very high	119 Å²	119	67.3 Å²	67.3	56%	0.556	35%	0.348	S	S	*	.			trans	-63.7	113.7	-179.1	-172.7	-170.3	163.9	0	0	112.5	M185 I187 K201	M185-E199 HydrophobicContact CE-CB 4.27Å; M185-E199 HydrophobicContact CE-CG 4.25Å; M185-E199 WeakPolarHBondContact CE-OE2 3.45Å; I187-E199 HydrophobicContact CD1-CB 4.1Å; E199-K201 VanDerWaalsContact C-N 3.26Å; E199-K201 PolarHBondContact O-N 2.9Å
200	Q	92.8	Very high	93.9	Very high	101 Å²	101	63.9 Å²	63.9	47%	0.472	33%	0.333	S	S	.	.			trans	-78.2	59.6	-178.4	-59.6	-53.1	-73.1	0	0	113.5	L184 E195 Y198	L184-Q200 VanDerWaalsContact CD1-OE1 3.26Å; L184-Q200 HydrophobicContact CD2-CB 4.44Å; E195-Q200 PolarHBondContact O-NE2 2.77Å; Y198-Q200 PolarHBondContact O-N 3.37Å; Y198-Q200 PolarHBondContact O-NE2 3.44Å
201	K	94.6	Very high	94	Very high	62 Å²	62	61.5 Å²	61.5	27%	0.27	32%	0.32	S	S	.	.			trans	-89.7	105.6	176.6	-171.8	168.8	-179.8	171.5	0	111.3	E129 M185 E199	E129-K201 WeakPolarHBondContact OE2-CE 3.38Å; E129-K201 IonicContact OE2-NZ 3.72Å; E129-K201 PolarHBondContact OE2-NZ 2.92Å; M185-K201 HydrophobicContact CB-CB 4.05Å; M185-K201 VanDerWaalsContact CB-O 3.25Å; M185-K201 WeakPolarHBondContact CB-O 3.27Å; M185-K201 HydrophobicContact CE-CB 3.91Å; M185-K201 PolarHBondContact N-O 3.16Å; M185-K201 HydrophobicContact SD-CB 4.33Å; M185-K201 HydrophobicContact SD-CD 4.27Å; E199-K201 VanDerWaalsContact C-N 3.26Å; E199-K201 PolarHBondContact O-N 2.9Å
202	T	95.5	Very high	94.1	Very high	70 Å²	70	61.5 Å²	61.5	43%	0.429	32%	0.32	S	S	.	.	B	Isolated β-bridge	trans	-74.2	158.8	174.4	51.1	0	0	0	0	112.7	Y126 K183 L184 P204	Y126-T202 WeakPolarHBondContact CE1-O 3.46Å; K183-T202 CarbonylContact O-C 3.44Å; K183-T202 WeakPolarHBondContact O-CA 3.21Å; L184-T202 HydrophobicContact CD2-CG2 3.73Å; T202-P204 WeakPolarHBondContact O-CD 3.24Å
203	L	95.3	Very high	94.3	Very high	4 Å²	4	60.5 Å²	60.5	2%	0.021	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-72.5	121.6	166.4	176.7	66.4	0	0	0	109.6	W124 Y126 K183 D205 G206 A208	W124-L203 HydrophobicContact CH2-CD2 3.64Å; W124-L203 HydrophobicContact CZ3-CD2 4.24Å; Y126-L203 HydrophobicContact CD1-CB 3.83Å; Y126-L203 HydrophobicContact CD1-CD1 4.42Å; Y126-L203 HydrophobicContact CD2-CD1 3.92Å; Y126-L203 HydrophobicContact CE1-CB 3.98Å; Y126-L203 HydrophobicContact CE1-CD1 4.44Å; Y126-L203 HydrophobicContact CE2-CD1 3.94Å; Y126-L203 HydrophobicContact CG-CB 4.25Å; Y126-L203 HydrophobicContact CG-CD1 4.17Å; K183-L203 HydrophobicContact CB-CB 4.3Å; K183-L203 PolarHBondContact O-N 3.33Å; L203-D205 PolarHBondContact O-N 2.61Å; L203-G206 PolarHBondContact O-N 2.7Å; L203-A208 HydrophobicContact CD1-CB 4.38Å; L203-A208 HydrophobicContact CD2-CB 4.48Å
204	P	90.7	Very high	94.6	Very high	44 Å²	44	58.1 Å²	58.1	29%	0.286	29%	0.29	S	S	.	.	G	3₁₀ helix	trans	-55.7	135	179.9	-31.1	40.5	0	0	0	112.8	T202 G206 R207	T202-P204 WeakPolarHBondContact O-CD 3.24Å; P204-G206 PolarHBondContact O-N 2.87Å; P204-R207 PolarHBondContact O-N 2.93Å
205	D	90.3	Very high	94.8	Very high	149 Å²	149	55.4 Å²	55.4	80%	0.797	27%	0.274	S	S	*	.	G	3₁₀ helix	trans	54.4	12.2	-175.3	-49.5	-41.2	0	0	0	115.7	L203 R207	L203-D205 PolarHBondContact O-N 2.61Å; D205-R207 WeakPolarHBondContact O-CG 3.41Å; D205-R207 PolarHBondContact O-N 3.1Å
206	G	92.7	Very high	94.9	Very high	5 Å²	5	54.3 Å²	54.3	5%	0.052	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	58.2	26.1	-171.4	0	0	0	0	0	113.3	H179 S180 L203 P204	H179-G206 WeakPolarHBondContact CA-O 3.19Å; H179-G206 PolarHBondContact ND1-O 3.36Å; S180-G206 CarbonylContact C-O 3.54Å; S180-G206 PolarHBondContact N-O 2.98Å; S180-G206 CarbonylContact O-C 3.55Å; S180-G206 VanDerWaalsContact O-CA 3.25Å; S180-G206 WeakPolarHBondContact O-CA 3.47Å; L203-G206 PolarHBondContact O-N 2.7Å; P204-G206 PolarHBondContact O-N 2.87Å
207	R	93.8	Very high	95	Very high	152 Å²	152	47.7 Å²	47.7	57%	0.574	24%	0.238	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-141	142.7	-169.8	-72	171.5	-176.3	174.1	5.4	112.2	L178 H179 P204 D205	L178-R207 WeakPolarHBondContact O-CA 3.46Å; H179-R207 WeakPolarHBondContact ND1-CG 3.29Å; P204-R207 PolarHBondContact O-N 2.93Å; D205-R207 WeakPolarHBondContact O-CG 3.41Å; D205-R207 PolarHBondContact O-N 3.1Å
208	A	93.4	Very high	95.1	Very high	2 Å²	2	42 Å²	42	2%	0.017	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	138	171.7	0	0	0	0	0	110.3	T66 V145 L178 L203	T66-A208 HydrophobicContact CG2-CB 4Å; V145-A208 HydrophobicContact CG2-CB 4.44Å; L178-A208 HydrophobicContact CB-CB 4.28Å; L178-A208 PolarHBondContact N-O 3.48Å; L178-A208 PolarHBondContact O-N 3.24Å; L203-A208 HydrophobicContact CD1-CB 4.38Å; L203-A208 HydrophobicContact CD2-CB 4.48Å
209	V	96.2	Very high	95.2	Very high	81 Å²	81	38.7 Å²	38.7	49%	0.491	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	104.2	178.2	-179.5	0	0	0	0	108.6	T66 I176 D211	T66-V209 VanDerWaalsContact CB-O 3.22Å; T66-V209 WeakPolarHBondContact CB-O 3.3Å; I176-V209 HydrophobicContact CG2-CG1 4.22Å; I176-V209 CarbonylContact O-C 2.99Å; I176-V209 VanDerWaalsContact O-CA 3.28Å; I176-V209 WeakPolarHBondContact O-CA 3.11Å; V209-D211 PolarHBondContact O-N 2.54Å
210	V	97.1	Very high	95.4	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.171	C	C	.	.			trans	-66	121	-171.2	-177.8	0	0	0	0	111.4	T66 A68 I176 L178 G212 F213 K246	T66-V210 CarbonylContact O-C 3.21Å; T66-V210 WeakPolarHBondContact O-CA 3.29Å; A68-V210 HydrophobicContact CB-CB 4.49Å; A68-V210 HydrophobicContact CB-CG1 3.67Å; A68-V210 HydrophobicContact CB-CG2 3.94Å; I176-V210 HydrophobicContact CD1-CB 4.45Å; I176-V210 PolarHBondContact O-N 3.49Å; L178-V210 HydrophobicContact CD1-CG2 4.25Å; V210-G212 VanDerWaalsContact CG1-O 3.28Å; V210-G212 WeakPolarHBondContact CG1-O 3.41Å; V210-F213 HydrophobicContact CG1-CD1 4.27Å; V210-F213 HydrophobicContact CG1-CE1 3.92Å; V210-F213 HydrophobicContact CG1-CE2 4.26Å; V210-F213 HydrophobicContact CG1-CZ 3.92Å; V210-K246 WeakPolarHBondContact O-CE 3.5Å; V210-K246 PolarHBondContact O-NZ 2.72Å
211	D	96.5	Very high	95.4	Very high	24 Å²	24	36.2 Å²	36.2	13%	0.128	18%	0.184	C	C	.	.			trans	-83.4	-35.2	175.4	-69.7	-70.1	0	0	0	112.4	R63 T66 V209 K246 I303	R63-D211 IonicContact NH2-OD1 2.93Å; R63-D211 PolarHBondContact NH2-OD1 3.35Å; T66-D211 PolarHBondContact N-OD2 3.4Å; T66-D211 PolarHBondContact O-N 3.16Å; V209-D211 PolarHBondContact O-N 2.54Å; D211-K246 WeakPolarHBondContact O-CD 3.45Å; D211-I303 HydrophobicContact CB-CD1 3.73Å; D211-I303 HydrophobicContact CB-CG1 4.35Å; D211-I303 HydrophobicContact CB-CG2 4.31Å
212	G	96.6	Very high	95.3	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.9	171.1	-179.5	0	0	0	0	0	113.8	A68 V210 P247	A68-G212 PolarHBondContact N-O 3.47Å; A68-G212 VanDerWaalsContact N-O 3.11Å; V210-G212 VanDerWaalsContact CG1-O 3.28Å; V210-G212 WeakPolarHBondContact CG1-O 3.41Å; G212-P247 VanDerWaalsContact CA-O 3.31Å; G212-P247 WeakPolarHBondContact CA-O 3.42Å
213	F	98.3	Very high	94.9	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	138.5	-173.7	-62.8	-85.6	0	0	0	114.2	A68 I70 C173 I176 V210 V241 V244 K246 P247 F248 V249 L299	A68-F213 HydrophobicContact CB-CD1 3.73Å; A68-F213 HydrophobicContact CB-CE1 3.86Å; A68-F213 CarbonylContact O-C 3.57Å; A68-F213 WeakPolarHBondContact O-CA 3.45Å; I70-F213 HydrophobicContact CD1-CB 4.12Å; I70-F213 HydrophobicContact CD1-CD1 3.88Å; I70-F213 HydrophobicContact CD1-CG 4.21Å; I70-F213 HydrophobicContact CG2-CD1 3.79Å; I70-F213 HydrophobicContact CG2-CE1 4.3Å; C173-F213 WeakPolarHBondContact O-CE1 3.48Å; I176-F213 HydrophobicContact CD1-CE2 3.86Å; I176-F213 HydrophobicContact CD1-CZ 3.75Å; V210-F213 HydrophobicContact CG1-CD1 4.27Å; V210-F213 HydrophobicContact CG1-CE1 3.92Å; V210-F213 HydrophobicContact CG1-CE2 4.26Å; V210-F213 HydrophobicContact CG1-CZ 3.92Å; F213-V241 HydrophobicContact CB-CG1 4.32Å; F213-V241 HydrophobicContact CD2-CG1 3.84Å; F213-V241 HydrophobicContact CG-CG1 4.27Å; F213-V244 HydrophobicContact CE2-CG2 3.69Å; F213-V244 HydrophobicContact CZ-CG2 4.2Å; F213-K246 HydrophobicContact CD2-CB 3.93Å; F213-K246 HydrophobicContact CE2-CB 3.79Å; F213-K246 HydrophobicContact CE2-CG 4.07Å; F213-P247 PolarHBondContact N-O 2.72Å; F213-F248 HydrophobicContact CB-CB 3.91Å; F213-F248 CarbonylContact O-C 3.25Å; F213-F248 WeakPolarHBondContact O-CA 3.49Å; F213-F248 VanDerWaalsContact O-CB 3.27Å; F213-F248 WeakPolarHBondContact O-CB 3.19Å; F213-V249 PolarHBondContact O-N 2.68Å; F213-L299 WeakPolarHBondContact O-CD2 3.37Å
214	V	98.2	Very high	94.5	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	110.6	164.4	172.6	0	0	0	0	107.7	I67 A68 V69 I70 L89 V216 T251 P295 F296 L299	I67-V214 HydrophobicContact CG2-CG2 3.78Å; A68-V214 PolarHBondContact O-N 3.43Å; V69-V214 WeakPolarHBondContact CA-O 3.47Å; V69-V214 HydrophobicContact CG1-CG1 4.42Å; V69-V214 HydrophobicContact CG2-CB 4.22Å; I70-V214 PolarHBondContact N-O 3.32Å; L89-V214 HydrophobicContact CD2-CG1 4.07Å; V214-V216 HydrophobicContact CG1-CG2 4.34Å; V214-T251 WeakPolarHBondContact CG1-OG1 3.32Å; V214-P295 HydrophobicContact CG1-CB 4.31Å; V214-P295 HydrophobicContact CG2-CB 4.21Å; V214-F296 HydrophobicContact CG2-CD1 4.11Å; V214-F296 HydrophobicContact CG2-CE1 3.82Å; V214-F296 HydrophobicContact CG2-CZ 4.33Å; V214-L299 HydrophobicContact CG2-CD2 3.82Å
215	C	97.6	Very high	94.6	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	111.7	-178.2	-59	0	0	0	0	109.2	I70 L238 V249 L250 T251	I70-C215 HydrophobicContact CG1-CB 4.41Å; C215-L238 HydrophobicContact CB-CD2 4.21Å; C215-V249 PolarHBondContact N-O 3.44Å; C215-L250 HydrophobicContact CB-CD1 4.14Å; C215-T251 PolarHBondContact O-N 2.94Å
216	V	97.7	Very high	94.6	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	131	-174.5	175.6	0	0	0	0	111.7	V69 I70 V84 K86 L89 V214 I234 T251 T253	V69-V216 HydrophobicContact CG1-CG2 3.59Å; I70-V216 PolarHBondContact O-N 3.31Å; V84-V216 HydrophobicContact CB-CG1 4.13Å; V84-V216 HydrophobicContact CG2-CB 4.33Å; V84-V216 HydrophobicContact CG2-CG1 3.76Å; V84-V216 WeakPolarHBondContact O-CG1 3.39Å; K86-V216 HydrophobicContact CG-CB 4.19Å; K86-V216 HydrophobicContact CG-CG1 4.37Å; K86-V216 HydrophobicContact CG-CG2 4.24Å; L89-V216 HydrophobicContact CD2-CG2 3.96Å; V214-V216 HydrophobicContact CG1-CG2 4.34Å; V216-I234 WeakPolarHBondContact O-CD1 3.42Å; V216-T251 CarbonylContact C-O 3.6Å; V216-T251 WeakPolarHBondContact CA-O 3.08Å; V216-T253 HydrophobicContact CG1-CG2 3.56Å; V216-T253 VanDerWaalsContact CG1-OG1 3.29Å; V216-T253 WeakPolarHBondContact CG1-OG1 3.35Å
217	Y	96.7	Very high	94.5	Very high	0 Å²	0	34 Å²	34	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	121.4	173.6	-169.9	-78.9	0	0	0	110.1	V219 Q230 N231 I234 T251 T252 T253 I262 L266	Y217-V219 HydrophobicContact CD1-CG1 3.98Å; Y217-V219 HydrophobicContact CE1-CG1 4.28Å; Y217-Q230 VanDerWaalsContact CD1-NE2 3.32Å; Y217-Q230 HydrophobicContact CD2-CG 4.47Å; Y217-Q230 HydrophobicContact CE2-CG 4.04Å; Y217-Q230 VanDerWaalsContact CZ-NE2 3.35Å; Y217-N231 VanDerWaalsContact CE2-OD1 3.3Å; Y217-N231 WeakPolarHBondContact CE2-OD1 3.42Å; Y217-N231 PolarHBondContact OH-OD1 3.26Å; Y217-I234 HydrophobicContact CD2-CB 4.34Å; Y217-I234 HydrophobicContact CD2-CD1 4.26Å; Y217-I234 HydrophobicContact CD2-CG1 3.79Å; Y217-I234 HydrophobicContact CD2-CG2 4.15Å; Y217-I234 HydrophobicContact CE2-CG1 4.18Å; Y217-T251 PolarHBondContact N-O 3.11Å; Y217-T252 CarbonylContact O-C 3.12Å; Y217-T252 WeakPolarHBondContact O-CA 3.31Å; Y217-T253 PolarHBondContact O-N 3.37Å; Y217-T253 PolarHBondContact O-OG1 3.39Å; Y217-I262 HydrophobicContact CE1-CG2 3.76Å; Y217-L266 HydrophobicContact CD1-CB 4.42Å; Y217-L266 HydrophobicContact CD1-CD1 3.99Å; Y217-L266 HydrophobicContact CD1-CD2 3.85Å; Y217-L266 HydrophobicContact CD1-CG 4.3Å; Y217-L266 HydrophobicContact CD2-CD1 3.78Å; Y217-L266 HydrophobicContact CE1-CB 3.83Å; Y217-L266 HydrophobicContact CE1-CD1 4.04Å; Y217-L266 HydrophobicContact CE1-CD2 4.09Å; Y217-L266 HydrophobicContact CE1-CG 4.2Å; Y217-L266 HydrophobicContact CE2-CD1 3.84Å; Y217-L266 HydrophobicContact CG-CD1 3.85Å; Y217-L266 HydrophobicContact CG-CD2 4.35Å
218	D	96.9	Very high	94.4	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	124.8	179.3	-166.7	-22.1	0	0	0	110.3	V84 S220 R225 Q230 K254	V84-D218 HydrophobicContact CB-CB 3.82Å; V84-D218 HydrophobicContact CG1-CB 3.78Å; D218-S220 WeakPolarHBondContact OD1-CB 3.39Å; D218-S220 PolarHBondContact OD1-N 2.91Å; D218-S220 PolarHBondContact OD1-OG 3.35Å; D218-R225 VanDerWaalsContact CB-NH2 3.32Å; D218-R225 IonicContact OD1-NH2 2.96Å; D218-R225 IonicContact OD2-CZ 3.32Å; D218-R225 IonicContact OD2-NH1 3.25Å; D218-R225 IonicContact OD2-NH2 3.95Å; D218-R225 PolarHBondContact OD2-NH2 2.92Å; D218-Q230 VanDerWaalsContact N-NE2 3.2Å; D218-Q230 PolarHBondContact O-NE2 3.42Å; D218-K254 WeakPolarHBondContact OD1-CD 3.25Å; D218-K254 IonicContact OD1-NZ 3.21Å; D218-K254 WeakPolarHBondContact OD2-CE 3.34Å; D218-K254 IonicContact OD2-NZ 2.68Å; D218-K254 PolarHBondContact OD2-NZ 3.21Å
219	V	96.6	Very high	94.3	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	21%	0.205	C	C	.	.			trans	-98.8	5	176.7	-65.9	0	0	0	0	113.8	Y217 T252 T253 Q255 D259 V263 L266	Y217-V219 HydrophobicContact CD1-CG1 3.98Å; Y217-V219 HydrophobicContact CE1-CG1 4.28Å; V219-T252 HydrophobicContact CG1-CG2 3.8Å; V219-T253 VanDerWaalsContact CG2-O 3.31Å; V219-T253 WeakPolarHBondContact CG2-O 3.34Å; V219-T253 PolarHBondContact N-O 3.42Å; V219-T253 VanDerWaalsContact N-O 3.13Å; V219-Q255 HydrophobicContact CG2-CG 4.03Å; V219-D259 PolarHBondContact O-N 3.24Å; V219-V263 HydrophobicContact CB-CG2 4.07Å; V219-V263 HydrophobicContact CG1-CG2 4.06Å; V219-L266 HydrophobicContact CG1-CD2 4.11Å
220	S	95.4	Very high	94.2	Very high	8 Å²	8	34.1 Å²	34.1	6%	0.056	18%	0.182	C	C	.	.	B	Isolated β-bridge	trans	-90	149.7	174.9	68.9	0	0	0	0	113.1	D218 V222 K254 A257 I262	D218-S220 WeakPolarHBondContact OD1-CB 3.39Å; D218-S220 PolarHBondContact OD1-N 2.91Å; D218-S220 PolarHBondContact OD1-OG 3.35Å; S220-V222 PolarHBondContact O-N 2.89Å; S220-K254 VanDerWaalsContact OG-CD 3.27Å; S220-K254 WeakPolarHBondContact OG-CD 3.35Å; S220-A257 VanDerWaalsContact CA-O 3.25Å; S220-A257 WeakPolarHBondContact CA-O 3.37Å; S220-A257 VanDerWaalsContact CB-O 3.25Å; S220-A257 WeakPolarHBondContact CB-O 3.43Å; S220-I262 VanDerWaalsContact O-CD1 3.23Å; S220-I262 WeakPolarHBondContact O-CD1 3.41Å
221	E	93.1	Very high	94.1	Very high	159 Å²	159	35.2 Å²	35.2	74%	0.743	19%	0.188	S	C	*	.			trans	-66	127.3	169.7	-172.8	176.9	-166.2	0	0	110.1	D259	E221-D259 HydrophobicContact CB-CB 4.36Å
222	V	92.2	Very high	94	Very high	10 Å²	10	40.6 Å²	40.6	6%	0.061	21%	0.212	C	C	.	.			trans	-129.3	123.6	176.3	173.7	0	0	0	0	109.2	V82 S220 S224 R225	V82-V222 HydrophobicContact CB-CG1 4.46Å; S220-V222 PolarHBondContact O-N 2.89Å; V222-S224 PolarHBondContact O-N 2.7Å; V222-R225 HydrophobicContact CB-CB 4.37Å; V222-R225 HydrophobicContact CG1-CB 4.34Å; V222-R225 PolarHBondContact O-N 3.16Å; V222-R225 VanDerWaalsContact O-N 3.11Å
223	P	88.4	Confident	93.9	Very high	84 Å²	84	42.2 Å²	42.2	55%	0.545	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.8	139.5	176.1	-27.8	34.9	0	0	0	112.1	L81 R225	L81-P223 HydrophobicContact CD1-CB 4.39Å; P223-R225 PolarHBondContact O-N 3.03Å
224	S	87.1	Confident	93.7	Very high	104 Å²	104	42.2 Å²	42.2	73%	0.727	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.1	8.5	-178	-52.8	0	0	0	0	116.3	V222	V222-S224 PolarHBondContact O-N 2.7Å
225	R	92.2	Very high	93.5	Very high	10 Å²	10	43.7 Å²	43.7	4%	0.038	23%	0.227	C	C	.	.			trans	-121.8	87.6	172.8	-170.3	178.4	67.3	-138.8	5.1	112.4	L72 K79 V82 D218 V222 P223	L72-R225 HydrophobicContact CD2-CG 4.32Å; K79-R225 WeakPolarHBondContact O-CD 3.45Å; K79-R225 PolarHBondContact O-NH1 3.45Å; V82-R225 PolarHBondContact O-NH1 3.04Å; D218-R225 VanDerWaalsContact CB-NH2 3.32Å; D218-R225 IonicContact OD1-NH2 2.96Å; D218-R225 IonicContact OD2-CZ 3.32Å; D218-R225 IonicContact OD2-NH1 3.25Å; D218-R225 IonicContact OD2-NH2 3.95Å; D218-R225 PolarHBondContact OD2-NH2 2.92Å; V222-R225 HydrophobicContact CB-CB 4.37Å; V222-R225 HydrophobicContact CG1-CB 4.34Å; V222-R225 PolarHBondContact O-N 3.16Å; V222-R225 VanDerWaalsContact O-N 3.11Å; P223-R225 PolarHBondContact O-N 3.03Å
226	P	90.4	Very high	93.4	Very high	66 Å²	66	45.3 Å²	45.3	43%	0.429	24%	0.241	S	C	.	.			trans	-67.7	152.1	175.4	28.8	-34.6	0	0	0	112.1	E228 R229 Q230	P226-E228 PolarHBondContact O-N 2.91Å; P226-R229 HydrophobicContact CG-CB 4.04Å; P226-R229 PolarHBondContact O-N 2.91Å; P226-Q230 PolarHBondContact O-N 3.09Å
227	S	90.8	Very high	93.3	Very high	14 Å²	14	45.3 Å²	45.3	10%	0.098	24%	0.241	C	C	.	.	H	α-helix	trans	-60.8	-30.3	-174.4	86.8	0	0	0	0	112.8	Q230 N231 S265	S227-Q230 PolarHBondContact O-N 3.15Å; S227-N231 VanDerWaalsContact O-CB 3.31Å; S227-N231 WeakPolarHBondContact O-CB 3.27Å; S227-N231 VanDerWaalsContact O-CG 3.28Å; S227-N231 PolarHBondContact O-N 3Å; S227-S265 WeakPolarHBondContact OG-CB 3.45Å; S227-S265 PolarHBondContact OG-OG 3.23Å
228	E	91.5	Very high	93.2	Very high	114 Å²	114	45.5 Å²	45.5	53%	0.533	24%	0.241	S	C	.	.	H	α-helix	trans	-64.4	-49.5	179.2	-65.3	64.5	-144.5	0	0	110.8	P226 Q230 N231 E232	P226-E228 PolarHBondContact O-N 2.91Å; E228-Q230 VanDerWaalsContact C-N 3.35Å; E228-Q230 PolarHBondContact O-N 3.36Å; E228-N231 WeakPolarHBondContact O-CB 3.1Å; E228-N231 PolarHBondContact O-N 3.39Å; E228-E232 WeakPolarHBondContact O-CG 3.25Å; E228-E232 PolarHBondContact O-N 2.94Å
229	R	91.7	Very high	93.1	Very high	121 Å²	121	48.5 Å²	48.5	46%	0.457	26%	0.256	S	S	.	.	H	α-helix	trans	-63.9	-40.3	178	177.8	-179.4	-77.7	-172.9	-3.6	111.4	R77 P226 F233	R77-R229 PolarHBondContact O-NH1 2.9Å; P226-R229 HydrophobicContact CG-CB 4.04Å; P226-R229 PolarHBondContact O-N 2.91Å; R229-F233 PolarHBondContact O-N 3.37Å
230	Q	94.1	Very high	93	Very high	3 Å²	3	50.1 Å²	50.1	1%	0.014	26%	0.264	C	S	.	.	H	α-helix	trans	-64.6	-42	174.9	-176.2	170.2	-48.6	0	0	111	Y217 D218 P226 S227 E228 F233 I234	Y217-Q230 VanDerWaalsContact CD1-NE2 3.32Å; Y217-Q230 HydrophobicContact CD2-CG 4.47Å; Y217-Q230 HydrophobicContact CE2-CG 4.04Å; Y217-Q230 VanDerWaalsContact CZ-NE2 3.35Å; D218-Q230 VanDerWaalsContact N-NE2 3.2Å; D218-Q230 PolarHBondContact O-NE2 3.42Å; P226-Q230 PolarHBondContact O-N 3.09Å; S227-Q230 PolarHBondContact O-N 3.15Å; E228-Q230 VanDerWaalsContact C-N 3.35Å; E228-Q230 PolarHBondContact O-N 3.36Å; Q230-F233 PolarHBondContact O-N 3.45Å; Q230-I234 HydrophobicContact CG-CG1 4.3Å; Q230-I234 WeakPolarHBondContact O-CB 3.4Å; Q230-I234 WeakPolarHBondContact O-CG1 3.29Å; Q230-I234 PolarHBondContact O-N 2.92Å
231	N	93.6	Very high	93	Very high	22 Å²	22	49.7 Å²	49.7	12%	0.118	26%	0.261	C	S	.	.	H	α-helix	trans	-62.6	-46	176	-82.7	-5.8	0	0	0	112.7	Y217 S227 E228 F233 I234 I235 S265 L269	Y217-N231 VanDerWaalsContact CE2-OD1 3.3Å; Y217-N231 WeakPolarHBondContact CE2-OD1 3.42Å; Y217-N231 PolarHBondContact OH-OD1 3.26Å; S227-N231 VanDerWaalsContact O-CB 3.31Å; S227-N231 WeakPolarHBondContact O-CB 3.27Å; S227-N231 VanDerWaalsContact O-CG 3.28Å; S227-N231 PolarHBondContact O-N 3Å; E228-N231 WeakPolarHBondContact O-CB 3.1Å; E228-N231 PolarHBondContact O-N 3.39Å; N231-F233 VanDerWaalsContact C-N 3.35Å; N231-F233 PolarHBondContact O-N 2.8Å; N231-I234 PolarHBondContact O-N 2.59Å; N231-I235 WeakPolarHBondContact O-CB 3.49Å; N231-I235 WeakPolarHBondContact O-CD1 3.2Å; N231-I235 WeakPolarHBondContact O-CG1 3.38Å; N231-I235 PolarHBondContact O-N 2.85Å; N231-S265 PolarHBondContact ND2-O 2.74Å; N231-S265 VanDerWaalsContact ND2-O 3.16Å; N231-L269 HydrophobicContact CB-CD1 3.93Å; N231-L269 WeakPolarHBondContact OD1-CD1 3.25Å
232	E	93.9	Very high	93	Very high	138 Å²	138	45.6 Å²	45.6	65%	0.645	24%	0.243	S	C	*	.	H	α-helix	trans	-55.2	-48.9	176.1	-75.3	172.7	176.9	0	0	111.8	E228 I235 A236	E228-E232 WeakPolarHBondContact O-CG 3.25Å; E228-E232 PolarHBondContact O-N 2.94Å; E232-I235 PolarHBondContact O-N 2.92Å; E232-A236 PolarHBondContact O-N 3.48Å
233	F	94.9	Very high	93.1	Very high	33 Å²	33	52 Å²	52	15%	0.145	27%	0.27	C	S	.	.	H	α-helix	trans	-62.5	-45.8	177.4	-177.5	-82.4	0	0	0	112.2	L72 Y169 L170 R229 Q230 N231 I235 A236 L237	L72-F233 VanDerWaalsContact CA-CE1 3.43Å; L72-F233 HydrophobicContact CB-CD1 4.03Å; L72-F233 HydrophobicContact CB-CE1 4.03Å; L72-F233 HydrophobicContact CD1-CB 4.18Å; L72-F233 HydrophobicContact CD1-CD1 3.84Å; L72-F233 HydrophobicContact CD1-CD2 3.51Å; L72-F233 HydrophobicContact CD1-CE1 4.03Å; L72-F233 HydrophobicContact CD1-CE2 3.68Å; L72-F233 HydrophobicContact CD1-CG 3.57Å; L72-F233 HydrophobicContact CD1-CZ 3.92Å; Y169-F233 HydrophobicContact CD1-CE1 4.49Å; Y169-F233 HydrophobicContact CD1-CE2 4.3Å; Y169-F233 AromaticContact CD1-CZ 3.55Å; Y169-F233 HydrophobicContact CD1-CZ 3.55Å; Y169-F233 HydrophobicContact CE1-CE1 4.3Å; Y169-F233 AromaticContact CE1-CZ 3.75Å; Y169-F233 HydrophobicContact CE1-CZ 3.75Å; L170-F233 HydrophobicContact CD1-CD2 4.37Å; L170-F233 HydrophobicContact CD1-CE2 4.36Å; L170-F233 HydrophobicContact CD2-CD1 4.34Å; L170-F233 HydrophobicContact CD2-CD2 4.11Å; L170-F233 HydrophobicContact CD2-CE1 4.01Å; L170-F233 HydrophobicContact CD2-CE2 3.8Å; L170-F233 HydrophobicContact CD2-CG 4.39Å; L170-F233 HydrophobicContact CD2-CZ 3.76Å; L170-F233 HydrophobicContact CG-CD2 4.3Å; L170-F233 HydrophobicContact CG-CE2 3.86Å; L170-F233 HydrophobicContact CG-CZ 4.19Å; R229-F233 PolarHBondContact O-N 3.37Å; Q230-F233 PolarHBondContact O-N 3.45Å; N231-F233 VanDerWaalsContact C-N 3.35Å; N231-F233 PolarHBondContact O-N 2.8Å; F233-I235 PolarHBondContact O-N 2.89Å; F233-A236 PolarHBondContact O-N 3.05Å; F233-L237 HydrophobicContact CE1-CB 4.44Å; F233-L237 HydrophobicContact CE1-CD2 4.24Å; F233-L237 WeakPolarHBondContact O-CB 3.45Å; F233-L237 PolarHBondContact O-N 3.38Å
234	I	95.1	Very high	93.4	Very high	1 Å²	1	50.2 Å²	50.2	1%	0.005	26%	0.257	C	S	.	.	H	α-helix	trans	-66.8	-37.4	-178.1	-68.1	-75.3	0	0	0	110.9	V216 Y217 Q230 N231 A236 L237 L238 L269	V216-I234 WeakPolarHBondContact O-CD1 3.42Å; Y217-I234 HydrophobicContact CD2-CB 4.34Å; Y217-I234 HydrophobicContact CD2-CD1 4.26Å; Y217-I234 HydrophobicContact CD2-CG1 3.79Å; Y217-I234 HydrophobicContact CD2-CG2 4.15Å; Y217-I234 HydrophobicContact CE2-CG1 4.18Å; Q230-I234 HydrophobicContact CG-CG1 4.3Å; Q230-I234 WeakPolarHBondContact O-CB 3.4Å; Q230-I234 WeakPolarHBondContact O-CG1 3.29Å; Q230-I234 PolarHBondContact O-N 2.92Å; N231-I234 PolarHBondContact O-N 2.59Å; I234-A236 PolarHBondContact O-N 2.91Å; I234-L237 HydrophobicContact CD1-CD2 4.09Å; I234-L237 WeakPolarHBondContact O-CB 3.27Å; I234-L237 PolarHBondContact O-N 3.49Å; I234-L238 HydrophobicContact CG2-CD1 3.94Å; I234-L238 HydrophobicContact CG2-CG 4.13Å; I234-L238 WeakPolarHBondContact O-CB 3.41Å; I234-L238 VanDerWaalsContact O-CG 3.22Å; I234-L238 WeakPolarHBondContact O-CG 3.43Å; I234-L238 PolarHBondContact O-N 3.07Å; I234-L269 HydrophobicContact CB-CD1 4.37Å; I234-L269 HydrophobicContact CG2-CD1 4.1Å
235	I	94.5	Very high	93.7	Very high	30 Å²	30	54.4 Å²	54.4	15%	0.154	26%	0.262	C	S	.	.	H	α-helix	trans	-58.4	-49.4	173	-70.7	162.5	0	0	0	110.4	N231 E232 F233 L237 L238 H239 L269 F275	N231-I235 WeakPolarHBondContact O-CB 3.49Å; N231-I235 WeakPolarHBondContact O-CD1 3.2Å; N231-I235 WeakPolarHBondContact O-CG1 3.38Å; N231-I235 PolarHBondContact O-N 2.85Å; E232-I235 PolarHBondContact O-N 2.92Å; F233-I235 PolarHBondContact O-N 2.89Å; I235-L237 VanDerWaalsContact C-N 3.35Å; I235-L237 PolarHBondContact O-N 3.3Å; I235-L238 PolarHBondContact O-N 2.95Å; I235-H239 PolarHBondContact O-N 2.95Å; I235-L269 HydrophobicContact CD1-CD1 4.29Å; I235-L269 HydrophobicContact CD1-CG 4.49Å; I235-L269 HydrophobicContact CG1-CD1 3.86Å; I235-L269 HydrophobicContact CG1-CG 4.09Å; I235-F275 HydrophobicContact CB-CE2 4.48Å; I235-F275 HydrophobicContact CB-CZ 4.43Å; I235-F275 HydrophobicContact CG1-CE2 4Å; I235-F275 HydrophobicContact CG1-CZ 4.43Å; I235-F275 HydrophobicContact CG2-CE2 4.25Å; I235-F275 HydrophobicContact CG2-CZ 4.07Å
236	A	95.5	Very high	93.8	Very high	35 Å²	35	56.6 Å²	56.6	29%	0.289	27%	0.272	S	S	.	.	H	α-helix	trans	-63.4	-38.9	178.2	0	0	0	0	0	112.7	L170 E232 F233 I234 N240	L170-A236 HydrophobicContact CD1-CB 4.08Å; L170-A236 HydrophobicContact CD2-CB 4.3Å; E232-A236 PolarHBondContact O-N 3.48Å; F233-A236 PolarHBondContact O-N 3.05Å; I234-A236 PolarHBondContact O-N 2.91Å; A236-N240 PolarHBondContact O-N 3.42Å; A236-N240 VanDerWaalsContact O-N 3.16Å
237	L	95.5	Very high	94	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-61.6	-52	175	-176.8	67.6	0	0	0	111.3	I70 L170 C173 F233 I234 I235 H239 N240 V241	I70-L237 HydrophobicContact CD1-CD1 3.92Å; I70-L237 HydrophobicContact CD1-CD2 4.24Å; I70-L237 HydrophobicContact CD1-CG 4.1Å; I70-L237 HydrophobicContact CG1-CD1 4.45Å; I70-L237 HydrophobicContact CG1-CD2 4.17Å; L170-L237 HydrophobicContact CD2-CB 3.96Å; L170-L237 HydrophobicContact CD2-CD1 4.22Å; C173-L237 WeakPolarHBondContact SG-CD1 3.33Å; F233-L237 HydrophobicContact CE1-CB 4.44Å; F233-L237 HydrophobicContact CE1-CD2 4.24Å; F233-L237 WeakPolarHBondContact O-CB 3.45Å; F233-L237 PolarHBondContact O-N 3.38Å; I234-L237 HydrophobicContact CD1-CD2 4.09Å; I234-L237 WeakPolarHBondContact O-CB 3.27Å; I234-L237 PolarHBondContact O-N 3.49Å; I235-L237 VanDerWaalsContact C-N 3.35Å; I235-L237 PolarHBondContact O-N 3.3Å; L237-H239 VanDerWaalsContact C-N 3.35Å; L237-H239 PolarHBondContact O-N 2.92Å; L237-N240 PolarHBondContact O-N 2.87Å; L237-V241 WeakPolarHBondContact O-CG2 3.13Å; L237-V241 PolarHBondContact O-N 2.73Å
238	L	94	Very high	94.2	Very high	3 Å²	3	55 Å²	55	2%	0.016	26%	0.26	C	S	.	.	H	α-helix	trans	-61.1	-41.6	-180	-69.3	179.6	0	0	0	111.7	C215 I234 I235 N240 V241 M242 F248 L269 F275	C215-L238 HydrophobicContact CB-CD2 4.21Å; I234-L238 HydrophobicContact CG2-CD1 3.94Å; I234-L238 HydrophobicContact CG2-CG 4.13Å; I234-L238 WeakPolarHBondContact O-CB 3.41Å; I234-L238 VanDerWaalsContact O-CG 3.22Å; I234-L238 WeakPolarHBondContact O-CG 3.43Å; I234-L238 PolarHBondContact O-N 3.07Å; I235-L238 PolarHBondContact O-N 2.95Å; L238-N240 VanDerWaalsContact C-N 3.28Å; L238-N240 PolarHBondContact O-N 2.85Å; L238-V241 PolarHBondContact O-N 2.69Å; L238-M242 VanDerWaalsContact O-CG 3.27Å; L238-M242 WeakPolarHBondContact O-CG 3.33Å; L238-M242 PolarHBondContact O-N 2.73Å; L238-F248 HydrophobicContact CD2-CD2 4.04Å; L238-F248 HydrophobicContact CD2-CE2 3.43Å; L238-F248 VanDerWaalsContact CD2-CE2 3.43Å; L238-F248 HydrophobicContact CD2-CZ 3.96Å; L238-L269 HydrophobicContact CD1-CD2 4.21Å; L238-F275 HydrophobicContact CB-CD1 4.11Å; L238-F275 HydrophobicContact CB-CE1 3.54Å; L238-F275 HydrophobicContact CB-CZ 4.17Å; L238-F275 HydrophobicContact CD1-CD1 3.9Å; L238-F275 HydrophobicContact CD1-CE1 3.99Å; L238-F275 HydrophobicContact CD1-CG 4.26Å; L238-F275 HydrophobicContact CD1-CZ 4.41Å; L238-F275 HydrophobicContact CG-CE1 4.43Å
239	H	94.4	Very high	94.4	Very high	64 Å²	64	49.6 Å²	49.6	30%	0.296	24%	0.235	S	C	.	.	H	α-helix	trans	-59.4	-36.5	172.7	-72.3	161.5	0	0	0	112.6	I235 L237 K243 E274 F275	I235-H239 PolarHBondContact O-N 2.95Å; L237-H239 VanDerWaalsContact C-N 3.35Å; L237-H239 PolarHBondContact O-N 2.92Å; H239-K243 VanDerWaalsContact O-CG 3.29Å; H239-K243 WeakPolarHBondContact O-CG 3.16Å; H239-K243 PolarHBondContact O-N 2.9Å; H239-E274 IonicContact CE1-OE2 3.34Å; H239-E274 PolarHBondContact CE1-OE2 3.05Å; H239-E274 IonicContact NE2-OE2 2.75Å; H239-E274 PolarHBondContact NE2-OE2 3.45Å; H239-F275 AromaticContact CD2-CE1 3.85Å; H239-F275 AromaticContact CD2-CZ 3.74Å; H239-F275 AromaticContact NE2-CZ 3.61Å
240	N	95.1	Very high	94.6	Very high	33 Å²	33	44.1 Å²	44.1	18%	0.176	22%	0.215	C	C	.	.	H	α-helix	trans	-73.4	-38.2	176.1	-73.5	-11.1	0	0	0	112.6	L170 T174 A236 L237 L238 M242 K243 V244	L170-N240 PolarHBondContact O-ND2 3.4Å; T174-N240 HydrophobicContact CG2-CB 3.86Å; A236-N240 PolarHBondContact O-N 3.42Å; A236-N240 VanDerWaalsContact O-N 3.16Å; L237-N240 PolarHBondContact O-N 2.87Å; L238-N240 VanDerWaalsContact C-N 3.28Å; L238-N240 PolarHBondContact O-N 2.85Å; N240-M242 VanDerWaalsContact C-N 3.34Å; N240-M242 PolarHBondContact O-N 3.45Å; N240-K243 WeakPolarHBondContact O-CB 3.47Å; N240-K243 PolarHBondContact O-N 2.97Å; N240-K243 PolarHBondContact OD1-NZ 2.88Å; N240-V244 PolarHBondContact O-N 3.07Å
241	V	94.8	Very high	94.8	Very high	0 Å²	0	44 Å²	44	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-61.8	-42.2	173.2	178	0	0	0	0	111.2	I70 T174 F213 L237 L238 K243 V244 F248	I70-V241 HydrophobicContact CD1-CG2 3.4Å; T174-V241 HydrophobicContact CG2-CG2 3.96Å; F213-V241 HydrophobicContact CB-CG1 4.32Å; F213-V241 HydrophobicContact CD2-CG1 3.84Å; F213-V241 HydrophobicContact CG-CG1 4.27Å; L237-V241 WeakPolarHBondContact O-CG2 3.13Å; L237-V241 PolarHBondContact O-N 2.73Å; L238-V241 PolarHBondContact O-N 2.69Å; V241-K243 VanDerWaalsContact C-N 3.31Å; V241-K243 PolarHBondContact O-N 2.92Å; V241-V244 WeakPolarHBondContact O-CG2 3.25Å; V241-V244 PolarHBondContact O-N 3.18Å; V241-F248 HydrophobicContact CB-CD1 4.44Å; V241-F248 HydrophobicContact CG1-CB 3.81Å; V241-F248 HydrophobicContact CG1-CD1 3.43Å; V241-F248 VanDerWaalsContact CG1-CD1 3.43Å; V241-F248 HydrophobicContact CG1-CE1 4.11Å; V241-F248 HydrophobicContact CG1-CG 3.73Å
242	M	92.5	Very high	95	Very high	73 Å²	73	43 Å²	43	36%	0.36	21%	0.209	S	C	.	.	H	α-helix	trans	-63	-35.3	176.7	-69.9	170.4	75.1	0	0	112.3	L238 N240 V244 K245 F248 F275 V278	L238-M242 VanDerWaalsContact O-CG 3.27Å; L238-M242 WeakPolarHBondContact O-CG 3.33Å; L238-M242 PolarHBondContact O-N 2.73Å; N240-M242 VanDerWaalsContact C-N 3.34Å; N240-M242 PolarHBondContact O-N 3.45Å; M242-V244 VanDerWaalsContact C-N 3.34Å; M242-V244 PolarHBondContact O-N 2.98Å; M242-K245 PolarHBondContact O-N 3.38Å; M242-F248 HydrophobicContact CG-CE1 3.99Å; M242-F248 HydrophobicContact CG-CZ 4.44Å; M242-F275 HydrophobicContact SD-CD1 4.21Å; M242-F275 HydrophobicContact SD-CE1 4.07Å; M242-V278 HydrophobicContact CE-CG1 4.19Å; M242-V278 HydrophobicContact CE-CG2 4.18Å; M242-V278 HydrophobicContact CG-CG1 4.32Å; M242-V278 HydrophobicContact SD-CG1 4.27Å
243	K	94.8	Very high	95.2	Very high	144 Å²	144	36.7 Å²	36.7	63%	0.626	18%	0.18	S	C	*	.	H	α-helix	trans	-63.2	-34.9	176.4	-71.6	165.1	-159.9	164.9	0	113	H239 N240 V241 K245	H239-K243 VanDerWaalsContact O-CG 3.29Å; H239-K243 WeakPolarHBondContact O-CG 3.16Å; H239-K243 PolarHBondContact O-N 2.9Å; N240-K243 WeakPolarHBondContact O-CB 3.47Å; N240-K243 PolarHBondContact O-N 2.97Å; N240-K243 PolarHBondContact OD1-NZ 2.88Å; V241-K243 VanDerWaalsContact C-N 3.31Å; V241-K243 PolarHBondContact O-N 2.92Å; K243-K245 VanDerWaalsContact C-N 3.28Å; K243-K245 PolarHBondContact O-N 3.22Å
244	V	94.7	Very high	95.2	Very high	46 Å²	46	36.3 Å²	36.3	28%	0.279	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-1.8	179.9	-59.6	0	0	0	0	114	I176 F213 N240 V241 M242 K246	I176-V244 HydrophobicContact CD1-CB 4.16Å; I176-V244 HydrophobicContact CD1-CG2 4.1Å; I176-V244 HydrophobicContact CG1-CB 4.32Å; F213-V244 HydrophobicContact CE2-CG2 3.69Å; F213-V244 HydrophobicContact CZ-CG2 4.2Å; N240-V244 PolarHBondContact O-N 3.07Å; V241-V244 WeakPolarHBondContact O-CG2 3.25Å; V241-V244 PolarHBondContact O-N 3.18Å; M242-V244 VanDerWaalsContact C-N 3.34Å; M242-V244 PolarHBondContact O-N 2.98Å; V244-K246 PolarHBondContact O-N 3.03Å
245	K	93.4	Very high	95.3	Very high	192 Å²	192	36.8 Å²	36.8	84%	0.835	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.5	31.3	173.2	-57.8	179.8	-179.6	179.1	0	114.6	M242 K243	M242-K245 PolarHBondContact O-N 3.38Å; K243-K245 VanDerWaalsContact C-N 3.28Å; K243-K245 PolarHBondContact O-N 3.22Å
246	K	94.5	Very high	95.3	Very high	56 Å²	56	37.8 Å²	37.8	24%	0.243	19%	0.186	C	C	.	.			trans	-99.2	147.8	169.5	-65.3	-51.2	-167.7	111.7	0	110.5	I176 V210 D211 F213 V244	I176-K246 HydrophobicContact CD1-CD 4.48Å; I176-K246 HydrophobicContact CD1-CG 3.56Å; V210-K246 WeakPolarHBondContact O-CE 3.5Å; V210-K246 PolarHBondContact O-NZ 2.72Å; D211-K246 WeakPolarHBondContact O-CD 3.45Å; F213-K246 HydrophobicContact CD2-CB 3.93Å; F213-K246 HydrophobicContact CE2-CB 3.79Å; F213-K246 HydrophobicContact CE2-CG 4.07Å; V244-K246 PolarHBondContact O-N 3.03Å
247	P	94.4	Very high	95.3	Very high	35 Å²	35	38.6 Å²	38.6	23%	0.227	19%	0.193	C	C	.	.			trans	-63.9	152.2	172.4	28.7	-34.8	0	0	0	110.6	G212 F213 L299 M302 I303	G212-P247 VanDerWaalsContact CA-O 3.31Å; G212-P247 WeakPolarHBondContact CA-O 3.42Å; F213-P247 PolarHBondContact N-O 2.72Å; P247-L299 HydrophobicContact CB-CD1 3.96Å; P247-L299 HydrophobicContact CG-CD1 4.04Å; P247-L299 WeakPolarHBondContact O-CD1 3.37Å; P247-M302 HydrophobicContact CB-CB 3.91Å; P247-M302 HydrophobicContact CB-CE 4.06Å; P247-I303 HydrophobicContact CG-CB 4.45Å; P247-I303 HydrophobicContact CG-CG1 3.46Å; P247-I303 VanDerWaalsContact CG-CG1 3.46Å
248	F	95.9	Very high	95.2	Very high	12 Å²	12	42.7 Å²	42.7	5%	0.053	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	158.9	174.6	69.9	-88.1	0	0	0	112.3	F213 L238 V241 M242 V278 A279 M302	F213-F248 HydrophobicContact CB-CB 3.91Å; F213-F248 CarbonylContact O-C 3.25Å; F213-F248 WeakPolarHBondContact O-CA 3.49Å; F213-F248 VanDerWaalsContact O-CB 3.27Å; F213-F248 WeakPolarHBondContact O-CB 3.19Å; L238-F248 HydrophobicContact CD2-CD2 4.04Å; L238-F248 HydrophobicContact CD2-CE2 3.43Å; L238-F248 VanDerWaalsContact CD2-CE2 3.43Å; L238-F248 HydrophobicContact CD2-CZ 3.96Å; V241-F248 HydrophobicContact CB-CD1 4.44Å; V241-F248 HydrophobicContact CG1-CB 3.81Å; V241-F248 HydrophobicContact CG1-CD1 3.43Å; V241-F248 VanDerWaalsContact CG1-CD1 3.43Å; V241-F248 HydrophobicContact CG1-CE1 4.11Å; V241-F248 HydrophobicContact CG1-CG 3.73Å; M242-F248 HydrophobicContact CG-CE1 3.99Å; M242-F248 HydrophobicContact CG-CZ 4.44Å; F248-V278 HydrophobicContact CE1-CG1 3.58Å; F248-V278 HydrophobicContact CZ-CB 4.34Å; F248-V278 HydrophobicContact CZ-CG1 3.53Å; F248-A279 HydrophobicContact CD2-CB 3.57Å; F248-A279 HydrophobicContact CE2-CB 3.28Å; F248-A279 HydrophobicContact CG-CB 4.3Å; F248-A279 HydrophobicContact CZ-CB 3.84Å; F248-A279 VanDerWaalsContact O-CB 3.27Å; F248-A279 WeakPolarHBondContact O-CB 3.11Å; F248-M302 WeakPolarHBondContact O-CE 3.18Å
249	V	95.8	Very high	95.2	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	134.4	173.5	176.6	0	0	0	0	108.4	F213 C215 P280 V282 P295 L298 L299 M302	F213-V249 PolarHBondContact O-N 2.68Å; C215-V249 PolarHBondContact N-O 3.44Å; V249-P280 HydrophobicContact CB-CG 4.49Å; V249-P280 HydrophobicContact CG1-CG 4.2Å; V249-P280 HydrophobicContact CG2-CG 3.97Å; V249-V282 HydrophobicContact CG1-CB 4.41Å; V249-V282 HydrophobicContact CG1-CG2 3.61Å; V249-P295 HydrophobicContact CG1-CB 4.19Å; V249-L298 HydrophobicContact CG2-CB 4.15Å; V249-L299 HydrophobicContact CG2-CB 3.93Å; V249-L299 HydrophobicContact CG2-CD1 4.39Å; V249-M302 HydrophobicContact CG2-SD 4.1Å
250	L	95.8	Very high	95.1	Very high	7 Å²	7	42.9 Å²	42.9	4%	0.037	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	117.4	172.7	-175.2	62.2	0	0	0	108.3	C215 L266 I270 P280 V281 V282	C215-L250 HydrophobicContact CB-CD1 4.14Å; L250-L266 HydrophobicContact CD2-CD1 4.22Å; L250-I270 HydrophobicContact CD2-CD1 3.77Å; L250-I270 HydrophobicContact CD2-CG1 3.73Å; L250-P280 PolarHBondContact N-O 3.45Å; L250-V281 CarbonylContact O-C 3.49Å; L250-V281 VanDerWaalsContact O-CA 3.26Å; L250-V281 WeakPolarHBondContact O-CA 3.38Å; L250-V282 PolarHBondContact O-N 2.87Å
251	T	97.4	Very high	95	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	118.1	-173.4	-59.4	0	0	0	0	109.6	L89 V214 C215 V216 Y217 V282 T284 P295	L89-T251 HydrophobicContact CD2-CG2 3.88Å; V214-T251 WeakPolarHBondContact CG1-OG1 3.32Å; C215-T251 PolarHBondContact O-N 2.94Å; V216-T251 CarbonylContact C-O 3.6Å; V216-T251 WeakPolarHBondContact CA-O 3.08Å; Y217-T251 PolarHBondContact N-O 3.11Å; T251-V282 CarbonylContact C-O 3.58Å; T251-V282 WeakPolarHBondContact CA-O 3.26Å; T251-T284 HydrophobicContact CG2-CG2 3.58Å; T251-T284 WeakPolarHBondContact CG2-OG1 3.42Å; T251-P295 HydrophobicContact CG2-CB 4.42Å; T251-P295 HydrophobicContact CG2-CG 3.68Å; T251-P295 WeakPolarHBondContact OG1-CB 3.12Å; T251-P295 WeakPolarHBondContact OG1-CG 3.09Å
252	T	97.3	Very high	95	Very high	2 Å²	2	48.4 Å²	48.4	1%	0.012	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	137.5	170.9	64.5	0	0	0	0	110.1	Y217 V219 Q255 L266 V281 V282 E283 T284	Y217-T252 CarbonylContact O-C 3.12Å; Y217-T252 WeakPolarHBondContact O-CA 3.31Å; V219-T252 HydrophobicContact CG1-CG2 3.8Å; T252-Q255 PolarHBondContact OG1-NE2 2.58Å; T252-L266 HydrophobicContact CG2-CD2 3.27Å; T252-V281 HydrophobicContact CG2-CG1 4.42Å; T252-V282 PolarHBondContact N-O 3.32Å; T252-V282 PolarHBondContact OG1-O 3.23Å; T252-E283 VanDerWaalsContact OG1-CA 3.31Å; T252-E283 WeakPolarHBondContact OG1-CA 3.49Å; T252-T284 WeakPolarHBondContact O-CA 3.41Å; T252-T284 WeakPolarHBondContact O-CB 3.49Å; T252-T284 PolarHBondContact O-N 2.76Å; T252-T284 PolarHBondContact O-OG1 2.98Å
253	T	97.9	Very high	95	Very high	4 Å²	4	46.4 Å²	46.4	3%	0.025	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	156.4	179.9	44.3	0	0	0	0	110.7	V84 L89 V216 Y217 V219 Q255	V84-T253 WeakPolarHBondContact O-CB 3.42Å; V84-T253 PolarHBondContact O-OG1 2.9Å; L89-T253 HydrophobicContact CB-CG2 4.45Å; L89-T253 HydrophobicContact CD2-CG2 4.26Å; V216-T253 HydrophobicContact CG1-CG2 3.56Å; V216-T253 VanDerWaalsContact CG1-OG1 3.29Å; V216-T253 WeakPolarHBondContact CG1-OG1 3.35Å; Y217-T253 PolarHBondContact O-N 3.37Å; Y217-T253 PolarHBondContact O-OG1 3.39Å; V219-T253 VanDerWaalsContact CG2-O 3.31Å; V219-T253 WeakPolarHBondContact CG2-O 3.34Å; V219-T253 PolarHBondContact N-O 3.42Å; V219-T253 VanDerWaalsContact N-O 3.13Å; T253-Q255 VanDerWaalsContact C-N 3.33Å
254	K	96.7	Very high	94.9	Very high	26 Å²	26	46.5 Å²	46.5	11%	0.113	24%	0.238	C	C	.	.			trans	61	37.6	-177.9	-51.3	-179.6	-167.9	159.5	0	113.7	G83 D218 S220 D256 A257 L258 T284	G83-K254 WeakPolarHBondContact O-CE 3.46Å; G83-K254 PolarHBondContact O-NZ 3.33Å; D218-K254 WeakPolarHBondContact OD1-CD 3.25Å; D218-K254 IonicContact OD1-NZ 3.21Å; D218-K254 WeakPolarHBondContact OD2-CE 3.34Å; D218-K254 IonicContact OD2-NZ 2.68Å; D218-K254 PolarHBondContact OD2-NZ 3.21Å; S220-K254 VanDerWaalsContact OG-CD 3.27Å; S220-K254 WeakPolarHBondContact OG-CD 3.35Å; K254-D256 WeakPolarHBondContact CA-OD1 2.91Å; K254-D256 PolarHBondContact O-N 2.85Å; K254-D256 VanDerWaalsContact O-N 3.16Å; K254-A257 CarbonylContact O-C 3.57Å; K254-A257 PolarHBondContact O-N 3.32Å; K254-L258 PolarHBondContact O-N 2.81Å; K254-T284 PolarHBondContact N-O 3.49Å
255	Q	96.5	Very high	94.8	Very high	10 Å²	10	45 Å²	45	5%	0.047	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-57.3	-22.5	171.5	-78.6	-78.7	-3.5	0	0	113.5	V219 T252 T253 A257 L258 E283 T284 F315	V219-Q255 HydrophobicContact CG2-CG 4.03Å; T252-Q255 PolarHBondContact OG1-NE2 2.58Å; T253-Q255 VanDerWaalsContact C-N 3.33Å; Q255-A257 PolarHBondContact O-N 3.01Å; Q255-L258 WeakPolarHBondContact O-CB 3.35Å; Q255-L258 PolarHBondContact O-N 2.94Å; Q255-E283 HydrophobicContact CG-CB 4.07Å; Q255-T284 WeakPolarHBondContact CB-O 3.45Å; Q255-T284 WeakPolarHBondContact CG-O 3.26Å; Q255-T284 PolarHBondContact N-O 3.09Å; Q255-F315 HydrophobicContact CB-CB 4.29Å; Q255-F315 HydrophobicContact CB-CD1 3.86Å; Q255-F315 HydrophobicContact CB-CD2 3.49Å; Q255-F315 VanDerWaalsContact CB-CD2 3.49Å; Q255-F315 HydrophobicContact CB-CE1 3.99Å; Q255-F315 HydrophobicContact CB-CE2 3.65Å; Q255-F315 HydrophobicContact CB-CG 3.61Å; Q255-F315 HydrophobicContact CB-CZ 3.89Å; Q255-F315 HydrophobicContact CG-CB 4.29Å; Q255-F315 HydrophobicContact CG-CD2 4.23Å; Q255-F315 HydrophobicContact CG-CG 4.14Å; Q255-F315 WeakPolarHBondContact O-CE1 3.19Å
256	D	94.5	Very high	94.8	Very high	51 Å²	51	36.2 Å²	36.2	27%	0.273	19%	0.192	S	C	.	.	G	3₁₀ helix	trans	-64.8	-18.8	169.5	49.2	-68.5	0	0	0	114.6	K254 S285 H287 F288	K254-D256 WeakPolarHBondContact CA-OD1 2.91Å; K254-D256 PolarHBondContact O-N 2.85Å; K254-D256 VanDerWaalsContact O-N 3.16Å; D256-S285 WeakPolarHBondContact OD1-CB 3.18Å; D256-S285 PolarHBondContact OD1-OG 2.81Å; D256-H287 IonicContact OD2-CD2 3.42Å; D256-F288 HydrophobicContact CB-CD1 4.35Å; D256-F288 HydrophobicContact CB-CD2 3.77Å; D256-F288 HydrophobicContact CB-CE1 4.09Å; D256-F288 HydrophobicContact CB-CE2 3.49Å; D256-F288 VanDerWaalsContact CB-CE2 3.49Å; D256-F288 HydrophobicContact CB-CG 4.2Å; D256-F288 HydrophobicContact CB-CZ 3.66Å
257	A	94.9	Very high	94.6	Very high	53 Å²	53	39.2 Å²	39.2	44%	0.438	21%	0.207	S	C	.	.	G	3₁₀ helix	trans	-127.2	33.6	178	0	0	0	0	0	111.7	S220 K254 Q255 D259	S220-A257 VanDerWaalsContact CA-O 3.25Å; S220-A257 WeakPolarHBondContact CA-O 3.37Å; S220-A257 VanDerWaalsContact CB-O 3.25Å; S220-A257 WeakPolarHBondContact CB-O 3.43Å; K254-A257 CarbonylContact O-C 3.57Å; K254-A257 PolarHBondContact O-N 3.32Å; Q255-A257 PolarHBondContact O-N 3.01Å; A257-D259 PolarHBondContact O-N 3.49Å
258	L	93.8	Very high	94.5	Very high	85 Å²	85	44.3 Å²	44.3	45%	0.445	23%	0.226	S	C	.	.	B	Isolated β-bridge	trans	-54.1	132.1	-177.7	171.7	153.9	0	0	0	112.9	K254 Q255 V263	K254-L258 PolarHBondContact O-N 2.81Å; Q255-L258 WeakPolarHBondContact O-CB 3.35Å; Q255-L258 PolarHBondContact O-N 2.94Å; L258-V263 HydrophobicContact CD1-CG2 3.65Å; L258-V263 HydrophobicContact CD2-CG2 4.38Å; L258-V263 HydrophobicContact CG-CG2 3.74Å
259	D	94.7	Very high	94.3	Very high	40 Å²	40	44 Å²	44	21%	0.214	22%	0.224	C	C	.	.			trans	-101.5	132.7	160.6	169.9	-104.9	0	0	0	111.6	V219 E221 A257 Q261 I262 V263	V219-D259 PolarHBondContact O-N 3.24Å; E221-D259 HydrophobicContact CB-CB 4.36Å; A257-D259 PolarHBondContact O-N 3.49Å; D259-Q261 VanDerWaalsContact C-N 3.31Å; D259-Q261 PolarHBondContact O-N 3.49Å; D259-Q261 VanDerWaalsContact OD1-CA 3.26Å; D259-Q261 WeakPolarHBondContact OD1-CA 3.43Å; D259-Q261 WeakPolarHBondContact OD1-CB 3.24Å; D259-Q261 PolarHBondContact OD1-N 2.85Å; D259-Q261 PolarHBondContact OD2-N 3.06Å; D259-I262 HydrophobicContact CB-CB 4.42Å; D259-I262 HydrophobicContact CB-CD1 4.17Å; D259-I262 HydrophobicContact CB-CG1 4.32Å; D259-I262 PolarHBondContact O-N 3.3Å; D259-I262 WeakPolarHBondContact OD1-CG1 3.2Å; D259-I262 PolarHBondContact OD1-N 3.35Å; D259-V263 WeakPolarHBondContact O-CG2 3.21Å; D259-V263 PolarHBondContact O-N 2.9Å; D259-V263 VanDerWaalsContact O-N 3.16Å
260	G	91.8	Very high	94	Very high	32 Å²	32	45.8 Å²	45.8	33%	0.33	23%	0.234	S	C	.	.	H	α-helix	trans	-73.4	-14.2	-178.1	0	0	0	0	0	114.7	R264	G260-R264 WeakPolarHBondContact O-CG 3.24Å; G260-R264 PolarHBondContact O-NE 2.9Å; G260-R264 PolarHBondContact O-NH2 3.41Å
261	Q	92.8	Very high	93.7	Very high	136 Å²	136	48.8 Å²	48.8	64%	0.636	26%	0.255	S	S	*	.	H	α-helix	trans	-81.8	-45.3	171.4	-46.6	-169.9	21.6	0	0	110.7	D259 V263 R264 S265	D259-Q261 VanDerWaalsContact C-N 3.31Å; D259-Q261 PolarHBondContact O-N 3.49Å; D259-Q261 VanDerWaalsContact OD1-CA 3.26Å; D259-Q261 WeakPolarHBondContact OD1-CA 3.43Å; D259-Q261 WeakPolarHBondContact OD1-CB 3.24Å; D259-Q261 PolarHBondContact OD1-N 2.85Å; D259-Q261 PolarHBondContact OD2-N 3.06Å; Q261-V263 VanDerWaalsContact C-N 3.34Å; Q261-V263 PolarHBondContact O-N 3.22Å; Q261-R264 PolarHBondContact O-N 2.86Å; Q261-R264 VanDerWaalsContact O-N 3.16Å; Q261-S265 PolarHBondContact O-N 2.81Å
262	I	94.3	Very high	93.4	Very high	13 Å²	13	53.8 Å²	53.8	7%	0.067	27%	0.274	C	S	.	.	H	α-helix	trans	-60.3	-42.6	178	-65.7	174.6	0	0	0	111	Y217 S220 D259 R264 S265 L266	Y217-I262 HydrophobicContact CE1-CG2 3.76Å; S220-I262 VanDerWaalsContact O-CD1 3.23Å; S220-I262 WeakPolarHBondContact O-CD1 3.41Å; D259-I262 HydrophobicContact CB-CB 4.42Å; D259-I262 HydrophobicContact CB-CD1 4.17Å; D259-I262 HydrophobicContact CB-CG1 4.32Å; D259-I262 PolarHBondContact O-N 3.3Å; D259-I262 WeakPolarHBondContact OD1-CG1 3.2Å; D259-I262 PolarHBondContact OD1-N 3.35Å; I262-R264 PolarHBondContact O-N 3.46Å; I262-S265 CarbonylContact O-C 3.58Å; I262-S265 WeakPolarHBondContact O-CB 3.39Å; I262-S265 PolarHBondContact O-N 2.78Å; I262-S265 VanDerWaalsContact O-N 3.14Å; I262-L266 PolarHBondContact O-N 3.34Å
263	V	92.7	Very high	92.9	Very high	31 Å²	31	65.4 Å²	65.4	19%	0.188	32%	0.318	C	S	.	.	H	α-helix	trans	-61	-44.7	174.4	173.4	0	0	0	0	111.9	V219 L258 D259 Q261 S265 L266 E267	V219-V263 HydrophobicContact CB-CG2 4.07Å; V219-V263 HydrophobicContact CG1-CG2 4.06Å; L258-V263 HydrophobicContact CD1-CG2 3.65Å; L258-V263 HydrophobicContact CD2-CG2 4.38Å; L258-V263 HydrophobicContact CG-CG2 3.74Å; D259-V263 WeakPolarHBondContact O-CG2 3.21Å; D259-V263 PolarHBondContact O-N 2.9Å; D259-V263 VanDerWaalsContact O-N 3.16Å; Q261-V263 VanDerWaalsContact C-N 3.34Å; Q261-V263 PolarHBondContact O-N 3.22Å; V263-S265 VanDerWaalsContact C-N 3.26Å; V263-S265 PolarHBondContact O-N 3.35Å; V263-L266 WeakPolarHBondContact O-CB 3.39Å; V263-L266 PolarHBondContact O-N 2.78Å; V263-L266 VanDerWaalsContact O-N 3.09Å; V263-E267 HydrophobicContact CG1-CG 4.48Å; V263-E267 WeakPolarHBondContact O-CG 3.43Å; V263-E267 PolarHBondContact O-N 3Å
264	R	93.3	Very high	92.4	Very high	145 Å²	145	68.9 Å²	68.9	55%	0.547	33%	0.334	S	S	.	.	H	α-helix	trans	-63.3	-31.7	174.9	-77.1	179.7	-74.2	179.4	-4.3	112.6	G260 Q261 I262 K268	G260-R264 WeakPolarHBondContact O-CG 3.24Å; G260-R264 PolarHBondContact O-NE 2.9Å; G260-R264 PolarHBondContact O-NH2 3.41Å; Q261-R264 PolarHBondContact O-N 2.86Å; Q261-R264 VanDerWaalsContact O-N 3.16Å; I262-R264 PolarHBondContact O-N 3.46Å; R264-K268 WeakPolarHBondContact O-CD 3.36Å; R264-K268 VanDerWaalsContact O-CG 3.24Å; R264-K268 WeakPolarHBondContact O-CG 3.41Å; R264-K268 PolarHBondContact O-N 3.49Å
265	S	92.6	Very high	91.9	Very high	14 Å²	14	68.1 Å²	68.1	10%	0.098	33%	0.331	C	S	.	.	H	α-helix	trans	-70.2	-35	172.3	-81	0	0	0	0	112.8	S227 N231 Q261 I262 V263 L269	S227-S265 WeakPolarHBondContact OG-CB 3.45Å; S227-S265 PolarHBondContact OG-OG 3.23Å; N231-S265 PolarHBondContact ND2-O 2.74Å; N231-S265 VanDerWaalsContact ND2-O 3.16Å; Q261-S265 PolarHBondContact O-N 2.81Å; I262-S265 CarbonylContact O-C 3.58Å; I262-S265 WeakPolarHBondContact O-CB 3.39Å; I262-S265 PolarHBondContact O-N 2.78Å; I262-S265 VanDerWaalsContact O-N 3.14Å; V263-S265 VanDerWaalsContact C-N 3.26Å; V263-S265 PolarHBondContact O-N 3.35Å; S265-L269 PolarHBondContact O-N 2.77Å; S265-L269 VanDerWaalsContact O-N 3.15Å
266	L	92.6	Very high	91.1	Very high	9 Å²	9	75.8 Å²	75.8	5%	0.047	36%	0.359	C	S	.	.	H	α-helix	trans	-70.4	-45.2	174.2	176.1	62.1	0	0	0	112.3	Y217 V219 L250 T252 I262 V263 K268 L269 I270	Y217-L266 HydrophobicContact CD1-CB 4.42Å; Y217-L266 HydrophobicContact CD1-CD1 3.99Å; Y217-L266 HydrophobicContact CD1-CD2 3.85Å; Y217-L266 HydrophobicContact CD1-CG 4.3Å; Y217-L266 HydrophobicContact CD2-CD1 3.78Å; Y217-L266 HydrophobicContact CE1-CB 3.83Å; Y217-L266 HydrophobicContact CE1-CD1 4.04Å; Y217-L266 HydrophobicContact CE1-CD2 4.09Å; Y217-L266 HydrophobicContact CE1-CG 4.2Å; Y217-L266 HydrophobicContact CE2-CD1 3.84Å; Y217-L266 HydrophobicContact CG-CD1 3.85Å; Y217-L266 HydrophobicContact CG-CD2 4.35Å; V219-L266 HydrophobicContact CG1-CD2 4.11Å; L250-L266 HydrophobicContact CD2-CD1 4.22Å; T252-L266 HydrophobicContact CG2-CD2 3.27Å; I262-L266 PolarHBondContact O-N 3.34Å; V263-L266 WeakPolarHBondContact O-CB 3.39Å; V263-L266 PolarHBondContact O-N 2.78Å; V263-L266 VanDerWaalsContact O-N 3.09Å; L266-K268 VanDerWaalsContact C-N 3.29Å; L266-K268 PolarHBondContact O-N 3.11Å; L266-L269 WeakPolarHBondContact O-CB 3.2Å; L266-L269 PolarHBondContact O-N 2.72Å; L266-L269 VanDerWaalsContact O-N 3.09Å; L266-I270 HydrophobicContact CD1-CD1 3.61Å; L266-I270 HydrophobicContact CD1-CG1 4.07Å; L266-I270 HydrophobicContact CD2-CD1 4.35Å; L266-I270 HydrophobicContact CG-CD1 3.63Å; L266-I270 HydrophobicContact CG-CG1 4.49Å; L266-I270 WeakPolarHBondContact O-CG1 3.49Å; L266-I270 PolarHBondContact O-N 3.33Å
267	E	91.6	Very high	90.3	Very high	118 Å²	118	79.3 Å²	79.3	55%	0.551	39%	0.387	S	S	*	.	H	α-helix	trans	-55.2	-45.5	174.2	-71.6	175	150.5	0	0	111.1	V263 L269 I270 S271	V263-E267 HydrophobicContact CG1-CG 4.48Å; V263-E267 WeakPolarHBondContact O-CG 3.43Å; V263-E267 PolarHBondContact O-N 3Å; E267-L269 PolarHBondContact O-N 3.23Å; E267-I270 PolarHBondContact O-N 3.44Å; E267-S271 VanDerWaalsContact O-CB 3.32Å; E267-S271 WeakPolarHBondContact O-CB 3.41Å; E267-S271 PolarHBondContact O-N 2.69Å
268	K	91.8	Very high	89.5	Confident	142 Å²	142	79.3 Å²	79.3	62%	0.617	38%	0.382	S	S	*	.	H	α-helix	trans	-58.4	-45.8	174	-73.8	168.7	-173.8	172.9	0	111.9	R264 L266 S271	R264-K268 WeakPolarHBondContact O-CD 3.36Å; R264-K268 VanDerWaalsContact O-CG 3.24Å; R264-K268 WeakPolarHBondContact O-CG 3.41Å; R264-K268 PolarHBondContact O-N 3.49Å; L266-K268 VanDerWaalsContact C-N 3.29Å; L266-K268 PolarHBondContact O-N 3.11Å; K268-S271 PolarHBondContact O-N 2.92Å; K268-S271 PolarHBondContact O-OG 3.32Å
269	L	91.1	Very high	88.9	Confident	5 Å²	5	76.2 Å²	76.2	3%	0.026	37%	0.369	C	S	.	.	H	α-helix	trans	-59.1	-49.3	177.4	-177.3	158.6	0	0	0	111.4	N231 I234 I235 L238 S265 L266 E267 S271 R272 F275	N231-L269 HydrophobicContact CB-CD1 3.93Å; N231-L269 WeakPolarHBondContact OD1-CD1 3.25Å; I234-L269 HydrophobicContact CB-CD1 4.37Å; I234-L269 HydrophobicContact CG2-CD1 4.1Å; I235-L269 HydrophobicContact CD1-CD1 4.29Å; I235-L269 HydrophobicContact CD1-CG 4.49Å; I235-L269 HydrophobicContact CG1-CD1 3.86Å; I235-L269 HydrophobicContact CG1-CG 4.09Å; L238-L269 HydrophobicContact CD1-CD2 4.21Å; S265-L269 PolarHBondContact O-N 2.77Å; S265-L269 VanDerWaalsContact O-N 3.15Å; L266-L269 WeakPolarHBondContact O-CB 3.2Å; L266-L269 PolarHBondContact O-N 2.72Å; L266-L269 VanDerWaalsContact O-N 3.09Å; E267-L269 PolarHBondContact O-N 3.23Å; L269-S271 VanDerWaalsContact C-N 3.31Å; L269-S271 PolarHBondContact O-N 3.49Å; L269-R272 WeakPolarHBondContact O-CB 3.5Å; L269-R272 VanDerWaalsContact O-CG 3.31Å; L269-R272 WeakPolarHBondContact O-CG 3.44Å; L269-R272 PolarHBondContact O-N 2.78Å; L269-F275 HydrophobicContact CD2-CD2 4.15Å
270	I	90.6	Very high	88.7	Confident	38 Å²	38	75.1 Å²	75.1	20%	0.195	36%	0.364	C	S	.	.	H	α-helix	trans	-70.1	-29.2	-177.8	-61.8	157.5	0	0	0	111.5	L250 L266 E267 R272 R276 V281	L250-I270 HydrophobicContact CD2-CD1 3.77Å; L250-I270 HydrophobicContact CD2-CG1 3.73Å; L266-I270 HydrophobicContact CD1-CD1 3.61Å; L266-I270 HydrophobicContact CD1-CG1 4.07Å; L266-I270 HydrophobicContact CD2-CD1 4.35Å; L266-I270 HydrophobicContact CG-CD1 3.63Å; L266-I270 HydrophobicContact CG-CG1 4.49Å; L266-I270 WeakPolarHBondContact O-CG1 3.49Å; L266-I270 PolarHBondContact O-N 3.33Å; E267-I270 PolarHBondContact O-N 3.44Å; I270-R272 PolarHBondContact O-N 2.82Å; I270-R276 PolarHBondContact O-N 3.03Å; I270-V281 HydrophobicContact CD1-CG1 4.39Å; I270-V281 HydrophobicContact CD1-CG2 3.76Å; I270-V281 HydrophobicContact CG2-CG2 4.34Å
271	S	89.4	Confident	88.8	Confident	71 Å²	71	75.8 Å²	75.8	50%	0.497	36%	0.361	S	S	.	.	H	α-helix	trans	-67.2	-18	177.8	78.8	0	0	0	0	114	E267 K268 L269	E267-S271 VanDerWaalsContact O-CB 3.32Å; E267-S271 WeakPolarHBondContact O-CB 3.41Å; E267-S271 PolarHBondContact O-N 2.69Å; K268-S271 PolarHBondContact O-N 2.92Å; K268-S271 PolarHBondContact O-OG 3.32Å; L269-S271 VanDerWaalsContact C-N 3.31Å; L269-S271 PolarHBondContact O-N 3.49Å
272	R	89.9	Confident	89	Confident	104 Å²	104	69.3 Å²	69.3	39%	0.392	33%	0.331	S	S	.	.	S	Bend	trans	-57.1	136.8	175.6	-65.9	175.6	68.2	138.1	-2.5	110.5	L269 I270 E274 F275 R276	L269-R272 WeakPolarHBondContact O-CB 3.5Å; L269-R272 VanDerWaalsContact O-CG 3.31Å; L269-R272 WeakPolarHBondContact O-CG 3.44Å; L269-R272 PolarHBondContact O-N 2.78Å; I270-R272 PolarHBondContact O-N 2.82Å; R272-E274 IonicContact CZ-OE1 3.45Å; R272-E274 VanDerWaalsContact CZ-OE1 3.27Å; R272-E274 IonicContact NE-OE1 2.85Å; R272-E274 PolarHBondContact NE-OE1 3.23Å; R272-E274 IonicContact NH2-OE1 3.27Å; R272-E274 PolarHBondContact NH2-OE1 2.81Å; R272-E274 IonicContact NH2-OE2 2.98Å; R272-E274 PolarHBondContact O-N 2.93Å; R272-F275 HydrophobicContact CB-CD2 4.19Å; R272-F275 PolarHBondContact O-N 2.8Å; R272-R276 WeakPolarHBondContact O-CB 3.31Å; R272-R276 PolarHBondContact O-N 2.88Å
273	R	87	Confident	89.1	Confident	246 Å²	246	71.8 Å²	71.8	93%	0.928	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	-27	-179.4	-66.5	-174.7	178.7	-168.1	-0	113.9
274	E	88.1	Confident	89.4	Confident	77 Å²	77	70.3 Å²	70.3	36%	0.36	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-30.1	179.2	-57.9	165.3	-101.8	0	0	114	H239 R272 V278	H239-E274 IonicContact CE1-OE2 3.34Å; H239-E274 PolarHBondContact CE1-OE2 3.05Å; H239-E274 IonicContact NE2-OE2 2.75Å; H239-E274 PolarHBondContact NE2-OE2 3.45Å; R272-E274 IonicContact CZ-OE1 3.45Å; R272-E274 VanDerWaalsContact CZ-OE1 3.27Å; R272-E274 IonicContact NE-OE1 2.85Å; R272-E274 PolarHBondContact NE-OE1 3.23Å; R272-E274 IonicContact NH2-OE1 3.27Å; R272-E274 PolarHBondContact NH2-OE1 2.81Å; R272-E274 IonicContact NH2-OE2 2.98Å; R272-E274 PolarHBondContact O-N 2.93Å; E274-V278 VanDerWaalsContact O-CG2 3.29Å; E274-V278 WeakPolarHBondContact O-CG2 3.45Å
275	F	86.2	Confident	89.6	Confident	11 Å²	11	63.4 Å²	63.4	5%	0.048	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.7	-22.9	-173.1	-56.8	-55.7	0	0	0	113.1	I235 L238 H239 M242 L269 R272 S277 V278	I235-F275 HydrophobicContact CB-CE2 4.48Å; I235-F275 HydrophobicContact CB-CZ 4.43Å; I235-F275 HydrophobicContact CG1-CE2 4Å; I235-F275 HydrophobicContact CG1-CZ 4.43Å; I235-F275 HydrophobicContact CG2-CE2 4.25Å; I235-F275 HydrophobicContact CG2-CZ 4.07Å; L238-F275 HydrophobicContact CB-CD1 4.11Å; L238-F275 HydrophobicContact CB-CE1 3.54Å; L238-F275 HydrophobicContact CB-CZ 4.17Å; L238-F275 HydrophobicContact CD1-CD1 3.9Å; L238-F275 HydrophobicContact CD1-CE1 3.99Å; L238-F275 HydrophobicContact CD1-CG 4.26Å; L238-F275 HydrophobicContact CD1-CZ 4.41Å; L238-F275 HydrophobicContact CG-CE1 4.43Å; H239-F275 AromaticContact CD2-CE1 3.85Å; H239-F275 AromaticContact CD2-CZ 3.74Å; H239-F275 AromaticContact NE2-CZ 3.61Å; M242-F275 HydrophobicContact SD-CD1 4.21Å; M242-F275 HydrophobicContact SD-CE1 4.07Å; L269-F275 HydrophobicContact CD2-CD2 4.15Å; R272-F275 HydrophobicContact CB-CD2 4.19Å; R272-F275 PolarHBondContact O-N 2.8Å; F275-S277 PolarHBondContact O-N 3.06Å; F275-V278 WeakPolarHBondContact O-CB 3.49Å; F275-V278 PolarHBondContact O-N 3.31Å
276	R	79.9	Confident	89.8	Confident	171 Å²	171	63.1 Å²	63.1	65%	0.645	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.3	123.7	173	-172.7	173.8	-175.7	146.6	0.7	109.8	I270 R272 V278	I270-R276 PolarHBondContact O-N 3.03Å; R272-R276 WeakPolarHBondContact O-CB 3.31Å; R272-R276 PolarHBondContact O-N 2.88Å; R276-V278 VanDerWaalsContact C-N 3.29Å; R276-V278 PolarHBondContact O-N 2.8Å
277	S	77.1	Confident	89.9	Confident	124 Å²	124	65.9 Å²	65.9	87%	0.867	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.7	1.3	-176	73.9	0	0	0	0	117.9	F275	F275-S277 PolarHBondContact O-N 3.06Å
278	V	77.6	Confident	90	Very high	53 Å²	53	65.2 Å²	65.2	32%	0.321	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-38.8	-179.5	-176.9	0	0	0	0	112.6	M242 F248 E274 F275 R276	M242-V278 HydrophobicContact CE-CG1 4.19Å; M242-V278 HydrophobicContact CE-CG2 4.18Å; M242-V278 HydrophobicContact CG-CG1 4.32Å; M242-V278 HydrophobicContact SD-CG1 4.27Å; F248-V278 HydrophobicContact CE1-CG1 3.58Å; F248-V278 HydrophobicContact CZ-CB 4.34Å; F248-V278 HydrophobicContact CZ-CG1 3.53Å; E274-V278 VanDerWaalsContact O-CG2 3.29Å; E274-V278 WeakPolarHBondContact O-CG2 3.45Å; F275-V278 WeakPolarHBondContact O-CB 3.49Å; F275-V278 PolarHBondContact O-N 3.31Å; R276-V278 VanDerWaalsContact C-N 3.29Å; R276-V278 PolarHBondContact O-N 2.8Å
279	A	81.7	Confident	90.1	Very high	20 Å²	20	59.2 Å²	59.2	17%	0.165	29%	0.292	C	S	.	.	S	Bend	trans	-143	149.3	179.2	0	0	0	0	0	111.6	F248	F248-A279 HydrophobicContact CD2-CB 3.57Å; F248-A279 HydrophobicContact CE2-CB 3.28Å; F248-A279 HydrophobicContact CG-CB 4.3Å; F248-A279 HydrophobicContact CZ-CB 3.84Å; F248-A279 VanDerWaalsContact O-CB 3.27Å; F248-A279 WeakPolarHBondContact O-CB 3.11Å
280	P	91.3	Very high	90.3	Very high	18 Å²	18	59.1 Å²	59.1	12%	0.117	29%	0.291	C	S	.	.			trans	-68.9	151.3	167.2	30.5	-32.6	0	0	0	110.7	V249 L250 M302 I312	V249-P280 HydrophobicContact CB-CG 4.49Å; V249-P280 HydrophobicContact CG1-CG 4.2Å; V249-P280 HydrophobicContact CG2-CG 3.97Å; L250-P280 PolarHBondContact N-O 3.45Å; P280-M302 HydrophobicContact CG-SD 3.91Å; P280-I312 HydrophobicContact CB-CD1 3.67Å
281	V	93.8	Very high	90.6	Very high	45 Å²	45	58.5 Å²	58.5	27%	0.273	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	133.5	172.7	-169.1	0	0	0	0	107.9	L250 T252 I270	L250-V281 CarbonylContact O-C 3.49Å; L250-V281 VanDerWaalsContact O-CA 3.26Å; L250-V281 WeakPolarHBondContact O-CA 3.38Å; T252-V281 HydrophobicContact CG2-CG1 4.42Å; I270-V281 HydrophobicContact CD1-CG1 4.39Å; I270-V281 HydrophobicContact CD1-CG2 3.76Å; I270-V281 HydrophobicContact CG2-CG2 4.34Å
282	V	96.2	Very high	90.8	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	131.8	177.2	-173.1	0	0	0	0	109.8	V249 L250 T251 T252 T284 N291 L294 P295 L298	V249-V282 HydrophobicContact CG1-CB 4.41Å; V249-V282 HydrophobicContact CG1-CG2 3.61Å; L250-V282 PolarHBondContact O-N 2.87Å; T251-V282 CarbonylContact C-O 3.58Å; T251-V282 WeakPolarHBondContact CA-O 3.26Å; T252-V282 PolarHBondContact N-O 3.32Å; T252-V282 PolarHBondContact OG1-O 3.23Å; V282-T284 HydrophobicContact CG1-CG2 3.92Å; V282-N291 HydrophobicContact CG1-CB 4.32Å; V282-L294 HydrophobicContact CG1-CB 4.04Å; V282-L294 HydrophobicContact CG1-CD2 3.77Å; V282-L294 HydrophobicContact CG1-CG 3.86Å; V282-L294 HydrophobicContact CG2-CG 4.47Å; V282-P295 HydrophobicContact CB-CG 4.09Å; V282-P295 HydrophobicContact CG1-CG 3.89Å; V282-P295 HydrophobicContact CG2-CG 4.48Å; V282-L298 HydrophobicContact CG2-CD1 3.45Å; V282-L298 VanDerWaalsContact CG2-CD1 3.45Å
283	E	96.8	Very high	91.1	Very high	66 Å²	66	53.3 Å²	53.3	31%	0.308	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	114.8	-176.7	-56.5	178.1	150.7	0	0	110.8	T252 Q255 N291 S314 F315	T252-E283 VanDerWaalsContact OG1-CA 3.31Å; T252-E283 WeakPolarHBondContact OG1-CA 3.49Å; Q255-E283 HydrophobicContact CG-CB 4.07Å; E283-N291 WeakPolarHBondContact O-CB 3.42Å; E283-N291 PolarHBondContact O-ND2 3.47Å; E283-S314 WeakPolarHBondContact OE2-CA 3.2Å; E283-F315 HydrophobicContact CB-CB 3.7Å; E283-F315 PolarHBondContact OE2-N 3.26Å
284	T	98.1	Very high	91.4	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.222	C	C	.	.			trans	-128.7	149.9	-171.7	72.6	0	0	0	0	114.1	T251 T252 K254 Q255 V282 V290 N291 P295	T251-T284 HydrophobicContact CG2-CG2 3.58Å; T251-T284 WeakPolarHBondContact CG2-OG1 3.42Å; T252-T284 WeakPolarHBondContact O-CA 3.41Å; T252-T284 WeakPolarHBondContact O-CB 3.49Å; T252-T284 PolarHBondContact O-N 2.76Å; T252-T284 PolarHBondContact O-OG1 2.98Å; K254-T284 PolarHBondContact N-O 3.49Å; Q255-T284 WeakPolarHBondContact CB-O 3.45Å; Q255-T284 WeakPolarHBondContact CG-O 3.26Å; Q255-T284 PolarHBondContact N-O 3.09Å; V282-T284 HydrophobicContact CG1-CG2 3.92Å; T284-V290 WeakPolarHBondContact CA-O 3.44Å; T284-N291 HydrophobicContact CG2-CB 3.98Å; T284-P295 HydrophobicContact CG2-CG 3.94Å
285	S	97.5	Very high	91.8	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.205	C	C	.	.	B	Isolated β-bridge	trans	-129.8	117.6	164.2	172.9	0	0	0	0	109	D256 H287 F288 G289 V290 T292	D256-S285 WeakPolarHBondContact OD1-CB 3.18Å; D256-S285 PolarHBondContact OD1-OG 2.81Å; S285-H287 PolarHBondContact OG-N 3.27Å; S285-F288 PolarHBondContact OG-N 3.03Å; S285-G289 CarbonylContact O-C 3.59Å; S285-G289 WeakPolarHBondContact O-CA 3.31Å; S285-G289 PolarHBondContact O-N 3.25Å; S285-V290 PolarHBondContact N-O 3.37Å; S285-V290 VanDerWaalsContact N-O 3.09Å; S285-V290 PolarHBondContact O-N 3.47Å; S285-T292 WeakPolarHBondContact O-CG2 3.48Å
286	A	97	Very high	92.2	Very high	7 Å²	7	38.3 Å²	38.3	6%	0.058	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-32.7	173.5	0	0	0	0	0	112	C88 R92 Y101 G289	C88-A286 HydrophobicContact CB-CB 3.71Å; R92-A286 HydrophobicContact CB-CB 4.21Å; R92-A286 PolarHBondContact NE-O 3.34Å; R92-A286 PolarHBondContact NH2-O 2.92Å; Y101-A286 HydrophobicContact CE2-CB 4.28Å; Y101-A286 WeakPolarHBondContact OH-CB 3.46Å; Y101-A286 PolarHBondContact OH-O 3.42Å; A286-G289 PolarHBondContact O-N 2.91Å
287	H	94.7	Very high	92.9	Very high	67 Å²	67	31.3 Å²	31.3	31%	0.31	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-43.3	177.8	-63.1	-62	0	0	0	112	R92 Y101 D256 S285	R92-H287 PolarHBondContact NH2-O 3.46Å; Y101-H287 AromaticContact CE1-ND1 3.94Å; Y101-H287 PolarHBondContact OH-CE1 3.23Å; Y101-H287 PolarHBondContact OH-ND1 2.89Å; D256-H287 IonicContact OD2-CD2 3.42Å; S285-H287 PolarHBondContact OG-N 3.27Å
288	F	93.7	Very high	93.6	Very high	105 Å²	105	25.4 Å²	25.4	46%	0.461	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.6	-3.8	176.5	-64.7	-7.5	0	0	0	113.9	D256 S285 V290 F315	D256-F288 HydrophobicContact CB-CD1 4.35Å; D256-F288 HydrophobicContact CB-CD2 3.77Å; D256-F288 HydrophobicContact CB-CE1 4.09Å; D256-F288 HydrophobicContact CB-CE2 3.49Å; D256-F288 VanDerWaalsContact CB-CE2 3.49Å; D256-F288 HydrophobicContact CB-CG 4.2Å; D256-F288 HydrophobicContact CB-CZ 3.66Å; S285-F288 PolarHBondContact OG-N 3.03Å; F288-V290 VanDerWaalsContact C-N 3.28Å; F288-V290 HydrophobicContact CB-CG2 3.73Å; F288-V290 PolarHBondContact O-N 3.26Å; F288-F315 HydrophobicContact CD2-CZ 4.2Å
289	G	94.1	Very high	94.4	Very high	15 Å²	15	22.9 Å²	22.9	16%	0.155	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.3	30.8	-175.7	0	0	0	0	0	113.5	S285 A286	S285-G289 CarbonylContact O-C 3.59Å; S285-G289 WeakPolarHBondContact O-CA 3.31Å; S285-G289 PolarHBondContact O-N 3.25Å; A286-G289 PolarHBondContact O-N 2.91Å
290	V	96	Very high	94.9	Very high	3 Å²	3	22.1 Å²	22.1	2%	0.018	12%	0.115	C	C	.	.	B	Isolated β-bridge	trans	-96.1	126.2	-174.7	178.7	0	0	0	0	110.2	T284 S285 F288 T292 F315 A318 A319 R322	T284-V290 WeakPolarHBondContact CA-O 3.44Å; S285-V290 PolarHBondContact N-O 3.37Å; S285-V290 VanDerWaalsContact N-O 3.09Å; S285-V290 PolarHBondContact O-N 3.47Å; F288-V290 VanDerWaalsContact C-N 3.28Å; F288-V290 HydrophobicContact CB-CG2 3.73Å; F288-V290 PolarHBondContact O-N 3.26Å; V290-T292 PolarHBondContact O-N 2.81Å; V290-F315 HydrophobicContact CB-CD2 4.12Å; V290-F315 HydrophobicContact CB-CE2 4.03Å; V290-F315 HydrophobicContact CG1-CD2 3.63Å; V290-F315 HydrophobicContact CG1-CE2 3.99Å; V290-F315 HydrophobicContact CG2-CE2 4.22Å; V290-A318 HydrophobicContact CG1-CB 3.58Å; V290-A319 HydrophobicContact CG1-CB 4.38Å; V290-A319 HydrophobicContact CG2-CB 4.01Å; V290-R322 HydrophobicContact CG2-CB 4.26Å; V290-R322 HydrophobicContact CG2-CG 4.32Å
291	N	95.7	Very high	94.8	Very high	26 Å²	26	22.1 Å²	22.1	14%	0.139	11%	0.114	C	C	.	.	S	Bend	trans	56	13.3	178.1	-71.9	-25.3	0	0	0	115.8	V282 E283 T284 E293 L294 P295 V313 A318	V282-N291 HydrophobicContact CG1-CB 4.32Å; E283-N291 WeakPolarHBondContact O-CB 3.42Å; E283-N291 PolarHBondContact O-ND2 3.47Å; T284-N291 HydrophobicContact CG2-CB 3.98Å; N291-E293 PolarHBondContact O-N 3.08Å; N291-E293 VanDerWaalsContact O-N 3.09Å; N291-L294 HydrophobicContact CB-CB 4.4Å; N291-L294 HydrophobicContact CB-CD2 4.44Å; N291-L294 WeakPolarHBondContact O-CB 3.4Å; N291-L294 PolarHBondContact O-N 2.97Å; N291-L294 VanDerWaalsContact O-N 3.1Å; N291-P295 WeakPolarHBondContact O-CD 3.29Å; N291-V313 PolarHBondContact ND2-O 2.85Å; N291-V313 VanDerWaalsContact ND2-O 3.14Å; N291-A318 VanDerWaalsContact OD1-CB 3.24Å; N291-A318 WeakPolarHBondContact OD1-CB 3.39Å
292	T	95.6	Very high	94.7	Very high	9 Å²	9	22.6 Å²	22.6	6%	0.055	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-16.5	-171.2	48.7	0	0	0	0	115.4	L89 R92 S285 V290 F296	L89-T292 HydrophobicContact CD1-CG2 3.99Å; R92-T292 HydrophobicContact CB-CG2 4.31Å; R92-T292 HydrophobicContact CG-CG2 3.81Å; S285-T292 WeakPolarHBondContact O-CG2 3.48Å; V290-T292 PolarHBondContact O-N 2.81Å; T292-F296 VanDerWaalsContact O-CD2 3.29Å; T292-F296 WeakPolarHBondContact O-CD2 3.44Å; T292-F296 VanDerWaalsContact O-CE2 3.3Å; T292-F296 WeakPolarHBondContact O-CE2 3.41Å
293	E	94.5	Very high	94.5	Very high	57 Å²	57	24 Å²	24	27%	0.266	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.3	-26.3	175.3	-55	-171.8	172.4	0	0	112.9	F93 R130 N291 F296 L297	F93-E293 HydrophobicContact CD2-CB 4.41Å; F93-E293 HydrophobicContact CD2-CG 4.19Å; F93-E293 HydrophobicContact CE2-CB 4.29Å; F93-E293 HydrophobicContact CE2-CG 4.32Å; R130-E293 IonicContact CZ-OE1 3.05Å; R130-E293 IonicContact NH1-OE1 2.73Å; R130-E293 PolarHBondContact NH1-OE1 3.21Å; R130-E293 IonicContact NH2-OE1 3.95Å; R130-E293 PolarHBondContact NH2-OE1 3.13Å; N291-E293 PolarHBondContact O-N 3.08Å; N291-E293 VanDerWaalsContact O-N 3.09Å; E293-F296 PolarHBondContact O-N 3.45Å; E293-L297 HydrophobicContact CB-CD1 4.26Å; E293-L297 PolarHBondContact O-N 3.32Å
294	L	94.3	Very high	94	Very high	18 Å²	18	24.5 Å²	24.5	9%	0.094	13%	0.126	C	C	.	.	H	α-helix	trans	-59.7	-39	-172.7	-178.9	58.7	0	0	0	113.7	V282 N291 F296 L298 P310	V282-L294 HydrophobicContact CG1-CB 4.04Å; V282-L294 HydrophobicContact CG1-CD2 3.77Å; V282-L294 HydrophobicContact CG1-CG 3.86Å; V282-L294 HydrophobicContact CG2-CG 4.47Å; N291-L294 HydrophobicContact CB-CB 4.4Å; N291-L294 HydrophobicContact CB-CD2 4.44Å; N291-L294 WeakPolarHBondContact O-CB 3.4Å; N291-L294 PolarHBondContact O-N 2.97Å; N291-L294 VanDerWaalsContact O-N 3.1Å; L294-F296 VanDerWaalsContact C-N 3.31Å; L294-F296 PolarHBondContact O-N 3.27Å; L294-L298 HydrophobicContact CD1-CD1 3.75Å; L294-L298 HydrophobicContact CD1-CG 3.95Å; L294-L298 HydrophobicContact CG-CD1 3.8Å; L294-L298 HydrophobicContact CG-CG 4.46Å; L294-L298 VanDerWaalsContact O-CB 3.32Å; L294-L298 WeakPolarHBondContact O-CB 3.45Å; L294-L298 WeakPolarHBondContact O-CD1 3.49Å; L294-L298 WeakPolarHBondContact O-CG 3.38Å; L294-L298 PolarHBondContact O-N 3.06Å; L294-P310 HydrophobicContact CD1-CB 3.87Å
295	P	96	Very high	93.3	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-59.2	-40.4	173.7	-24.6	33.4	0	0	0	113.2	V214 V249 T251 V282 T284 N291 L299	V214-P295 HydrophobicContact CG1-CB 4.31Å; V214-P295 HydrophobicContact CG2-CB 4.21Å; V249-P295 HydrophobicContact CG1-CB 4.19Å; T251-P295 HydrophobicContact CG2-CB 4.42Å; T251-P295 HydrophobicContact CG2-CG 3.68Å; T251-P295 WeakPolarHBondContact OG1-CB 3.12Å; T251-P295 WeakPolarHBondContact OG1-CG 3.09Å; V282-P295 HydrophobicContact CB-CG 4.09Å; V282-P295 HydrophobicContact CG1-CG 3.89Å; V282-P295 HydrophobicContact CG2-CG 4.48Å; T284-P295 HydrophobicContact CG2-CG 3.94Å; N291-P295 WeakPolarHBondContact O-CD 3.29Å; P295-L299 WeakPolarHBondContact O-CB 3.41Å; P295-L299 PolarHBondContact O-N 3.45Å
296	F	95.7	Very high	92.1	Very high	0 Å²	0	38 Å²	38	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-74.1	-42.6	-176.7	-58.6	-80	0	0	0	111.1	I67 V69 L89 F93 F142 L144 V214 T292 E293 L294 L299 A300	I67-F296 HydrophobicContact CB-CD1 4.34Å; I67-F296 HydrophobicContact CG1-CD1 4.39Å; I67-F296 HydrophobicContact CG2-CD1 3.92Å; I67-F296 HydrophobicContact CG2-CE1 3.9Å; V69-F296 HydrophobicContact CG2-CE1 4.08Å; V69-F296 HydrophobicContact CG2-CZ 4.14Å; L89-F296 HydrophobicContact CD1-CE2 4.48Å; L89-F296 HydrophobicContact CG-CE2 4.42Å; L89-F296 HydrophobicContact CG-CZ 4.48Å; F93-F296 HydrophobicContact CB-CD2 4.21Å; F93-F296 HydrophobicContact CB-CE2 3.7Å; F93-F296 HydrophobicContact CB-CZ 4.18Å; F93-F296 HydrophobicContact CD1-CD1 4.49Å; F93-F296 HydrophobicContact CD1-CD2 4.25Å; F93-F296 HydrophobicContact CD1-CE2 4.29Å; F93-F296 HydrophobicContact CD1-CG 4.35Å; F93-F296 HydrophobicContact CD1-CZ 4.44Å; F93-F296 HydrophobicContact CD2-CB 4.28Å; F93-F296 AromaticContact CD2-CD2 3.21Å; F93-F296 HydrophobicContact CD2-CD2 3.21Å; F93-F296 AromaticContact CD2-CE2 3.65Å; F93-F296 HydrophobicContact CD2-CE2 3.65Å; F93-F296 AromaticContact CD2-CG 3.81Å; F93-F296 HydrophobicContact CD2-CG 3.81Å; F93-F296 HydrophobicContact CE1-CD1 4.4Å; F93-F296 HydrophobicContact CE1-CD2 4.48Å; F93-F296 HydrophobicContact CE1-CG 4.2Å; F93-F296 HydrophobicContact CE2-CB 3.64Å; F93-F296 AromaticContact CE2-CD2 3.52Å; F93-F296 HydrophobicContact CE2-CD2 3.52Å; F93-F296 HydrophobicContact CE2-CE2 4.35Å; F93-F296 AromaticContact CE2-CG 3.65Å; F93-F296 HydrophobicContact CE2-CG 3.65Å; F93-F296 AromaticContact CG-CD2 3.61Å; F93-F296 HydrophobicContact CG-CD2 3.61Å; F93-F296 AromaticContact CG-CE2 3.59Å; F93-F296 HydrophobicContact CG-CE2 3.59Å; F93-F296 HydrophobicContact CG-CG 4.15Å; F93-F296 HydrophobicContact CG-CZ 4.12Å; F93-F296 HydrophobicContact CZ-CB 3.78Å; F93-F296 HydrophobicContact CZ-CD1 4.44Å; F93-F296 HydrophobicContact CZ-CD2 4.14Å; F93-F296 AromaticContact CZ-CG 3.85Å; F93-F296 HydrophobicContact CZ-CG 3.85Å; F142-F296 HydrophobicContact CD1-CB 4.27Å; F142-F296 HydrophobicContact CE1-CB 3.82Å; F142-F296 VanDerWaalsContact CE1-O 3.29Å; F142-F296 WeakPolarHBondContact CE1-O 3.3Å; F142-F296 HydrophobicContact CZ-CB 4.07Å; F142-F296 WeakPolarHBondContact CZ-O 3.25Å; L144-F296 HydrophobicContact CD1-CD1 4.25Å; L144-F296 HydrophobicContact CD1-CE1 3.45Å; L144-F296 VanDerWaalsContact CD1-CE1 3.45Å; L144-F296 HydrophobicContact CD1-CZ 4.11Å; V214-F296 HydrophobicContact CG2-CD1 4.11Å; V214-F296 HydrophobicContact CG2-CE1 3.82Å; V214-F296 HydrophobicContact CG2-CZ 4.33Å; T292-F296 VanDerWaalsContact O-CD2 3.29Å; T292-F296 WeakPolarHBondContact O-CD2 3.44Å; T292-F296 VanDerWaalsContact O-CE2 3.3Å; T292-F296 WeakPolarHBondContact O-CE2 3.41Å; E293-F296 PolarHBondContact O-N 3.45Å; L294-F296 VanDerWaalsContact C-N 3.31Å; L294-F296 PolarHBondContact O-N 3.27Å; F296-L299 PolarHBondContact O-N 2.97Å; F296-A300 PolarHBondContact O-N 3.24Å
297	L	93	Very high	90.4	Very high	24 Å²	24	45.8 Å²	45.8	13%	0.126	23%	0.225	C	C	.	.	H	α-helix	trans	-64	-43.5	175.1	-66.6	172.4	0	0	0	112.3	V132 I140 F142 E293 L299 N301 P310	V132-L297 HydrophobicContact CB-CD2 4.46Å; V132-L297 HydrophobicContact CG1-CD2 4.04Å; I140-L297 HydrophobicContact CD1-CD2 4.16Å; F142-L297 HydrophobicContact CE2-CD2 4.34Å; F142-L297 HydrophobicContact CZ-CD2 4.31Å; E293-L297 HydrophobicContact CB-CD1 4.26Å; E293-L297 PolarHBondContact O-N 3.32Å; L297-L299 VanDerWaalsContact C-N 3.33Å; L297-L299 PolarHBondContact O-N 3.25Å; L297-N301 WeakPolarHBondContact O-CB 3.49Å; L297-N301 PolarHBondContact O-N 2.98Å; L297-P310 HydrophobicContact CB-CG 4.14Å
298	L	92.5	Very high	89.1	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-62.2	-40.8	173.2	-78.5	163.5	0	0	0	111.7	V249 V282 L294 N301 M302 K309 P310 I312	V249-L298 HydrophobicContact CG2-CB 4.15Å; V282-L298 HydrophobicContact CG2-CD1 3.45Å; V282-L298 VanDerWaalsContact CG2-CD1 3.45Å; L294-L298 HydrophobicContact CD1-CD1 3.75Å; L294-L298 HydrophobicContact CD1-CG 3.95Å; L294-L298 HydrophobicContact CG-CD1 3.8Å; L294-L298 HydrophobicContact CG-CG 4.46Å; L294-L298 VanDerWaalsContact O-CB 3.32Å; L294-L298 WeakPolarHBondContact O-CB 3.45Å; L294-L298 WeakPolarHBondContact O-CD1 3.49Å; L294-L298 WeakPolarHBondContact O-CG 3.38Å; L294-L298 PolarHBondContact O-N 3.06Å; L298-N301 WeakPolarHBondContact O-CB 3.42Å; L298-N301 PolarHBondContact O-N 3.42Å; L298-M302 VanDerWaalsContact O-CG 3.28Å; L298-M302 WeakPolarHBondContact O-CG 3.48Å; L298-M302 PolarHBondContact O-N 3.02Å; L298-K309 HydrophobicContact CD2-CG 4.1Å; L298-P310 HydrophobicContact CD2-CB 4.09Å; L298-P310 HydrophobicContact CD2-CG 4.33Å; L298-P310 HydrophobicContact CG-CB 4.22Å; L298-P310 HydrophobicContact CG-CG 4.45Å; L298-I312 HydrophobicContact CD1-CG1 4Å; L298-I312 HydrophobicContact CD2-CG1 4.46Å
299	L	94.2	Very high	88.1	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-68.7	-41.2	-179.9	-174.2	53.7	0	0	0	112.2	I67 F213 V214 P247 V249 P295 F296 L297 M302 I303	I67-L299 HydrophobicContact CD1-CD2 3.68Å; I67-L299 HydrophobicContact CD1-CG 3.96Å; I67-L299 HydrophobicContact CG1-CD2 4.26Å; I67-L299 HydrophobicContact CG2-CD2 3.63Å; F213-L299 WeakPolarHBondContact O-CD2 3.37Å; V214-L299 HydrophobicContact CG2-CD2 3.82Å; P247-L299 HydrophobicContact CB-CD1 3.96Å; P247-L299 HydrophobicContact CG-CD1 4.04Å; P247-L299 WeakPolarHBondContact O-CD1 3.37Å; V249-L299 HydrophobicContact CG2-CB 3.93Å; V249-L299 HydrophobicContact CG2-CD1 4.39Å; P295-L299 WeakPolarHBondContact O-CB 3.41Å; P295-L299 PolarHBondContact O-N 3.45Å; F296-L299 PolarHBondContact O-N 2.97Å; L297-L299 VanDerWaalsContact C-N 3.33Å; L297-L299 PolarHBondContact O-N 3.25Å; L299-M302 PolarHBondContact O-N 3.39Å; L299-M302 VanDerWaalsContact O-N 3.16Å; L299-I303 HydrophobicContact CD1-CD1 4.33Å; L299-I303 HydrophobicContact CD1-CG1 4.48Å; L299-I303 HydrophobicContact CG-CD1 4Å; L299-I303 WeakPolarHBondContact O-CD1 3.47Å; L299-I303 VanDerWaalsContact O-CG1 3.23Å; L299-I303 WeakPolarHBondContact O-CG1 3.31Å; L299-I303 PolarHBondContact O-N 2.97Å
300	A	92.1	Very high	87.6	Confident	4 Å²	4	47.8 Å²	47.8	3%	0.033	24%	0.24	C	C	.	.	H	α-helix	trans	-59.7	-45.2	172	0	0	0	0	0	111.7	F65 I140 F142 F296 M302 I303 D304	F65-A300 HydrophobicContact CD1-CB 4.25Å; F65-A300 HydrophobicContact CD2-CB 4.12Å; F65-A300 HydrophobicContact CE1-CB 4.26Å; F65-A300 HydrophobicContact CE2-CB 4.16Å; F65-A300 HydrophobicContact CG-CB 4.18Å; F65-A300 HydrophobicContact CZ-CB 4.21Å; I140-A300 HydrophobicContact CG2-CB 4.12Å; F142-A300 HydrophobicContact CE1-CB 3.87Å; F142-A300 HydrophobicContact CZ-CB 3.85Å; F296-A300 PolarHBondContact O-N 3.24Å; A300-M302 VanDerWaalsContact C-N 3.29Å; A300-M302 PolarHBondContact O-N 3.09Å; A300-I303 PolarHBondContact O-N 3.41Å; A300-I303 VanDerWaalsContact O-N 3.15Å; A300-D304 PolarHBondContact O-N 2.86Å
301	N	89.7	Confident	87.3	Confident	18 Å²	18	55.6 Å²	55.6	10%	0.096	27%	0.274	C	S	.	.	H	α-helix	trans	-57.7	-39.1	173	171.5	-108.4	0	0	0	112.6	L297 L298 R305 T306 S308	L297-N301 WeakPolarHBondContact O-CB 3.49Å; L297-N301 PolarHBondContact O-N 2.98Å; L298-N301 WeakPolarHBondContact O-CB 3.42Å; L298-N301 PolarHBondContact O-N 3.42Å; N301-R305 VanDerWaalsContact O-CA 3.26Å; N301-R305 WeakPolarHBondContact O-CA 3.49Å; N301-R305 PolarHBondContact O-N 3.08Å; N301-T306 PolarHBondContact ND2-O 3.02Å; N301-T306 PolarHBondContact ND2-OG1 3.04Å; N301-T306 PolarHBondContact O-N 3.43Å; N301-S308 PolarHBondContact ND2-O 3.43Å
302	M	91.1	Very high	87.1	Confident	55 Å²	55	57.8 Å²	57.8	27%	0.271	29%	0.285	S	S	.	.	H	α-helix	trans	-72.5	-30	175.7	-71.1	172.2	66.9	0	0	113.9	P247 F248 V249 P280 L298 L299 A300	P247-M302 HydrophobicContact CB-CB 3.91Å; P247-M302 HydrophobicContact CB-CE 4.06Å; F248-M302 WeakPolarHBondContact O-CE 3.18Å; V249-M302 HydrophobicContact CG2-SD 4.1Å; P280-M302 HydrophobicContact CG-SD 3.91Å; L298-M302 VanDerWaalsContact O-CG 3.28Å; L298-M302 WeakPolarHBondContact O-CG 3.48Å; L298-M302 PolarHBondContact O-N 3.02Å; L299-M302 PolarHBondContact O-N 3.39Å; L299-M302 VanDerWaalsContact O-N 3.16Å; A300-M302 VanDerWaalsContact C-N 3.29Å; A300-M302 PolarHBondContact O-N 3.09Å
303	I	91.7	Very high	86.9	Confident	29 Å²	29	58.6 Å²	58.6	15%	0.149	29%	0.29	C	S	.	.	H	α-helix	trans	-72.1	-50.9	177.3	-68.9	157.9	0	0	0	110.3	F65 I67 D211 P247 L299 A300	F65-I303 HydrophobicContact CD1-CB 4.07Å; F65-I303 HydrophobicContact CD1-CD1 3.82Å; F65-I303 HydrophobicContact CD1-CG2 3.86Å; F65-I303 HydrophobicContact CE1-CB 3.97Å; F65-I303 HydrophobicContact CE1-CG2 3.73Å; I67-I303 HydrophobicContact CD1-CD1 3.75Å; D211-I303 HydrophobicContact CB-CD1 3.73Å; D211-I303 HydrophobicContact CB-CG1 4.35Å; D211-I303 HydrophobicContact CB-CG2 4.31Å; P247-I303 HydrophobicContact CG-CB 4.45Å; P247-I303 HydrophobicContact CG-CG1 3.46Å; P247-I303 VanDerWaalsContact CG-CG1 3.46Å; L299-I303 HydrophobicContact CD1-CD1 4.33Å; L299-I303 HydrophobicContact CD1-CG1 4.48Å; L299-I303 HydrophobicContact CG-CD1 4Å; L299-I303 WeakPolarHBondContact O-CD1 3.47Å; L299-I303 VanDerWaalsContact O-CG1 3.23Å; L299-I303 WeakPolarHBondContact O-CG1 3.31Å; L299-I303 PolarHBondContact O-N 2.97Å; A300-I303 PolarHBondContact O-N 3.41Å; A300-I303 VanDerWaalsContact O-N 3.15Å
304	D	86.3	Confident	86.9	Confident	78 Å²	78	57.8 Å²	57.8	42%	0.417	29%	0.291	S	S	.	.	H	α-helix	trans	-87.4	-7.6	-177.3	-86.2	11.8	0	0	0	113.8	R63 F65 A300 T306	R63-D304 IonicContact CZ-OD1 3.82Å; R63-D304 IonicContact NH1-OD1 3.83Å; R63-D304 PolarHBondContact NH1-OD1 3.04Å; F65-D304 HydrophobicContact CE1-CB 4.48Å; F65-D304 WeakPolarHBondContact CE1-OD1 3.44Å; F65-D304 HydrophobicContact CZ-CB 4.45Å; F65-D304 WeakPolarHBondContact CZ-OD2 3.21Å; A300-D304 PolarHBondContact O-N 2.86Å; D304-T306 VanDerWaalsContact C-N 3.31Å; D304-T306 HydrophobicContact CB-CG2 4.14Å; D304-T306 PolarHBondContact O-N 3.21Å
305	R	83.4	Confident	86.9	Confident	215 Å²	215	58.2 Å²	58.2	81%	0.811	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	58	38.4	178.2	-52.5	177.4	178.7	179.7	-1.6	113.4	N301	N301-R305 VanDerWaalsContact O-CA 3.26Å; N301-R305 WeakPolarHBondContact O-CA 3.49Å; N301-R305 PolarHBondContact O-N 3.08Å
306	T	72.8	Confident	86.9	Confident	67 Å²	67	63.3 Å²	63.3	41%	0.411	32%	0.323	S	S	.	.			trans	-74.2	148.2	179.1	56.8	0	0	0	0	111.9	N301 D304 S308	N301-T306 PolarHBondContact ND2-O 3.02Å; N301-T306 PolarHBondContact ND2-OG1 3.04Å; N301-T306 PolarHBondContact O-N 3.43Å; D304-T306 VanDerWaalsContact C-N 3.31Å; D304-T306 HydrophobicContact CB-CG2 4.14Å; D304-T306 PolarHBondContact O-N 3.21Å; T306-S308 VanDerWaalsContact C-N 3.28Å; T306-S308 PolarHBondContact O-N 3.32Å
307	N	61	Low	86.8	Confident	171 Å²	171	67.2 Å²	67.2	91%	0.914	34%	0.344	S	S	*	.	S	Bend	trans	-71.6	-21.2	-176.9	-70.9	-28.4	0	0	0	113.5	K309	N307-K309 PolarHBondContact O-N 3.42Å; N307-K309 VanDerWaalsContact O-N 3.09Å
308	S	67.3	Low	86.9	Confident	80 Å²	80	66.7 Å²	66.7	56%	0.559	34%	0.343	S	S	*	.			trans	-83.1	76.1	-179.2	55.1	0	0	0	0	111.5	N301 T306 P310	N301-S308 PolarHBondContact ND2-O 3.43Å; T306-S308 VanDerWaalsContact C-N 3.28Å; T306-S308 PolarHBondContact O-N 3.32Å; S308-P310 WeakPolarHBondContact O-CD 3.45Å
309	K	73.8	Confident	86.9	Confident	130 Å²	130	67.5 Å²	67.5	57%	0.565	35%	0.35	S	S	*	.	P	Polyproline II helix	trans	-72.9	122.8	177.7	-175.1	175.4	-179.5	178.5	0	111.2	L298 N307	L298-K309 HydrophobicContact CD2-CG 4.1Å; N307-K309 PolarHBondContact O-N 3.42Å; N307-K309 VanDerWaalsContact O-N 3.09Å
310	P	83.3	Confident	87	Confident	19 Å²	19	72.8 Å²	72.8	12%	0.123	37%	0.374	C	S	.	.	P	Polyproline II helix	trans	-54.1	138.8	172.5	-26.4	34.1	0	0	0	112.2	L294 L297 L298 S308 I312	L294-P310 HydrophobicContact CD1-CB 3.87Å; L297-P310 HydrophobicContact CB-CG 4.14Å; L298-P310 HydrophobicContact CD2-CB 4.09Å; L298-P310 HydrophobicContact CD2-CG 4.33Å; L298-P310 HydrophobicContact CG-CB 4.22Å; L298-P310 HydrophobicContact CG-CG 4.45Å; S308-P310 WeakPolarHBondContact O-CD 3.45Å; P310-I312 PolarHBondContact O-N 3.43Å
311	K	88.5	Confident	86.9	Confident	168 Å²	168	78.8 Å²	78.8	73%	0.73	40%	0.396	S	S	*	.	P	Polyproline II helix	trans	-72.9	125.5	178.9	-175.6	175.2	178.7	179.4	0	109.8	V313	K311-V313 PolarHBondContact O-N 2.94Å
312	I	91.9	Very high	86.9	Confident	72 Å²	72	80.8 Å²	80.8	37%	0.369	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-70.8	127.3	170	-56.2	172.9	0	0	0	108.1	P280 L298 P310	P280-I312 HydrophobicContact CB-CD1 3.67Å; L298-I312 HydrophobicContact CD1-CG1 4Å; L298-I312 HydrophobicContact CD2-CG1 4.46Å; P310-I312 PolarHBondContact O-N 3.43Å
313	V	92.3	Very high	87	Confident	25 Å²	25	85.6 Å²	85.6	15%	0.152	42%	0.417	C	S	.	.			trans	-116.8	137.3	178.8	-176	0	0	0	0	107.9	N291 K311 D317 A318	N291-V313 PolarHBondContact ND2-O 2.85Å; N291-V313 VanDerWaalsContact ND2-O 3.14Å; K311-V313 PolarHBondContact O-N 2.94Å; V313-D317 HydrophobicContact CG1-CB 3.67Å; V313-A318 HydrophobicContact CG1-CB 3.95Å
314	S	93.8	Very high	87	Confident	40 Å²	40	88.1 Å²	88.1	28%	0.28	43%	0.428	S	S	.	.			trans	-61.2	155	176.4	75.2	0	0	0	0	110.9	E283 V316 D317 A318	E283-S314 WeakPolarHBondContact OE2-CA 3.2Å; S314-V316 PolarHBondContact O-N 2.8Å; S314-D317 PolarHBondContact O-N 3.21Å; S314-D317 WeakPolarHBondContact OG-CB 3.47Å; S314-D317 PolarHBondContact OG-N 3.42Å; S314-D317 PolarHBondContact OG-OD2 3.49Å; S314-A318 VanDerWaalsContact O-CB 3.27Å; S314-A318 WeakPolarHBondContact O-CB 3.27Å; S314-A318 PolarHBondContact O-N 3.27Å
315	F	95.3	Very high	87.1	Confident	27 Å²	27	86.9 Å²	86.9	12%	0.118	42%	0.421	C	S	.	.	H	α-helix	trans	-57	-40.4	172.8	169.1	-107.6	0	0	0	111.5	Q255 E283 F288 V290 A318 A319	Q255-F315 HydrophobicContact CB-CB 4.29Å; Q255-F315 HydrophobicContact CB-CD1 3.86Å; Q255-F315 HydrophobicContact CB-CD2 3.49Å; Q255-F315 VanDerWaalsContact CB-CD2 3.49Å; Q255-F315 HydrophobicContact CB-CE1 3.99Å; Q255-F315 HydrophobicContact CB-CE2 3.65Å; Q255-F315 HydrophobicContact CB-CG 3.61Å; Q255-F315 HydrophobicContact CB-CZ 3.89Å; Q255-F315 HydrophobicContact CG-CB 4.29Å; Q255-F315 HydrophobicContact CG-CD2 4.23Å; Q255-F315 HydrophobicContact CG-CG 4.14Å; Q255-F315 WeakPolarHBondContact O-CE1 3.19Å; E283-F315 HydrophobicContact CB-CB 3.7Å; E283-F315 PolarHBondContact OE2-N 3.26Å; F288-F315 HydrophobicContact CD2-CZ 4.2Å; V290-F315 HydrophobicContact CB-CD2 4.12Å; V290-F315 HydrophobicContact CB-CE2 4.03Å; V290-F315 HydrophobicContact CG1-CD2 3.63Å; V290-F315 HydrophobicContact CG1-CE2 3.99Å; V290-F315 HydrophobicContact CG2-CE2 4.22Å; F315-A318 PolarHBondContact O-N 3.21Å; F315-A319 HydrophobicContact CE2-CB 4.23Å; F315-A319 HydrophobicContact CZ-CB 4.28Å; F315-A319 WeakPolarHBondContact O-CB 3.1Å; F315-A319 PolarHBondContact O-N 2.67Å
316	V	94.5	Very high	87.5	Confident	107 Å²	107	78.7 Å²	78.7	65%	0.648	39%	0.393	S	S	*	.	H	α-helix	trans	-62.9	-50.5	-178.7	-177.9	0	0	0	0	111.3	S314 A318 A319 H320	S314-V316 PolarHBondContact O-N 2.8Å; V316-A318 VanDerWaalsContact C-N 3.35Å; V316-A318 PolarHBondContact O-N 3.46Å; V316-A319 PolarHBondContact O-N 3.29Å; V316-H320 WeakPolarHBondContact O-CB 3.44Å; V316-H320 PolarHBondContact O-N 2.87Å
317	D	95.1	Very high	88.4	Confident	83 Å²	83	79.6 Å²	79.6	44%	0.444	40%	0.395	S	S	.	.	H	α-helix	trans	-64.9	-39.2	179.2	-61.5	-50.2	0	0	0	111.8	V313 S314 R321	V313-D317 HydrophobicContact CG1-CB 3.67Å; S314-D317 PolarHBondContact O-N 3.21Å; S314-D317 WeakPolarHBondContact OG-CB 3.47Å; S314-D317 PolarHBondContact OG-N 3.42Å; S314-D317 PolarHBondContact OG-OD2 3.49Å; D317-R321 WeakPolarHBondContact O-CG 3.42Å; D317-R321 PolarHBondContact O-N 3.28Å; D317-R321 VanDerWaalsContact O-N 3.15Å
318	A	93.6	Very high	89.8	Confident	13 Å²	13	72.7 Å²	72.7	11%	0.107	36%	0.359	C	S	.	.	H	α-helix	trans	-73.1	-38.3	-179.5	0	0	0	0	0	112.1	V290 N291 V313 S314 F315 V316 R321 R322	V290-A318 HydrophobicContact CG1-CB 3.58Å; N291-A318 VanDerWaalsContact OD1-CB 3.24Å; N291-A318 WeakPolarHBondContact OD1-CB 3.39Å; V313-A318 HydrophobicContact CG1-CB 3.95Å; S314-A318 VanDerWaalsContact O-CB 3.27Å; S314-A318 WeakPolarHBondContact O-CB 3.27Å; S314-A318 PolarHBondContact O-N 3.27Å; F315-A318 PolarHBondContact O-N 3.21Å; V316-A318 VanDerWaalsContact C-N 3.35Å; V316-A318 PolarHBondContact O-N 3.46Å; A318-R321 PolarHBondContact O-N 3.5Å; A318-R322 WeakPolarHBondContact O-CB 3.41Å; A318-R322 PolarHBondContact O-N 3.09Å
319	A	94.1	Very high	90.9	Very high	17 Å²	17	68.9 Å²	68.9	14%	0.14	33%	0.333	C	S	.	.	H	α-helix	trans	-67.2	-37.4	174.1	0	0	0	0	0	111.7	V290 F315 V316 R322 R323	V290-A319 HydrophobicContact CG1-CB 4.38Å; V290-A319 HydrophobicContact CG2-CB 4.01Å; F315-A319 HydrophobicContact CE2-CB 4.23Å; F315-A319 HydrophobicContact CZ-CB 4.28Å; F315-A319 WeakPolarHBondContact O-CB 3.1Å; F315-A319 PolarHBondContact O-N 2.67Å; V316-A319 PolarHBondContact O-N 3.29Å; A319-R322 PolarHBondContact O-N 2.68Å; A319-R323 WeakPolarHBondContact O-CB 3.27Å; A319-R323 PolarHBondContact O-N 3.12Å
320	H	94.5	Very high	91.9	Very high	110 Å²	110	64 Å²	64	51%	0.509	31%	0.314	S	S	.	.	H	α-helix	trans	-59.1	-53.8	172.4	-168.8	-78.9	0	0	0	111	V316 R322 R323 E324	V316-H320 WeakPolarHBondContact O-CB 3.44Å; V316-H320 PolarHBondContact O-N 2.87Å; H320-R322 VanDerWaalsContact C-N 3.34Å; H320-R322 PolarHBondContact O-N 3.09Å; H320-R323 WeakPolarHBondContact O-CA 3.35Å; H320-R323 WeakPolarHBondContact O-CB 3.46Å; H320-R323 PolarHBondContact O-N 2.91Å; H320-R323 VanDerWaalsContact O-N 3.07Å; H320-E324 IonicContact CE1-OE1 3.72Å; H320-E324 PolarHBondContact CE1-OE1 3.29Å; H320-E324 VanDerWaalsContact CE1-OE1 3.26Å; H320-E324 IonicContact CE1-OE2 2.78Å; H320-E324 IonicContact ND1-OE1 3.92Å; H320-E324 PolarHBondContact ND1-OE1 2.65Å; H320-E324 IonicContact ND1-OE2 2.74Å; H320-E324 PolarHBondContact ND1-OE2 2.94Å; H320-E324 WeakPolarHBondContact O-CG 3.32Å; H320-E324 PolarHBondContact O-N 3.06Å
321	R	90.2	Very high	92.3	Very high	130 Å²	130	67.8 Å²	67.8	49%	0.491	34%	0.336	S	S	.	.	H	α-helix	trans	-60.6	-40.1	177.5	-69.3	-180	-166.7	136.2	14.1	113.1	D317 A318 R323 E324 I325	D317-R321 WeakPolarHBondContact O-CG 3.42Å; D317-R321 PolarHBondContact O-N 3.28Å; D317-R321 VanDerWaalsContact O-N 3.15Å; A318-R321 PolarHBondContact O-N 3.5Å; R321-R323 VanDerWaalsContact C-N 3.28Å; R321-R323 PolarHBondContact O-N 3.24Å; R321-E324 WeakPolarHBondContact CA-OE2 3.44Å; R321-E324 PolarHBondContact O-N 2.6Å; R321-I325 WeakPolarHBondContact O-CD1 3.11Å; R321-I325 VanDerWaalsContact O-CG1 3.26Å; R321-I325 WeakPolarHBondContact O-CG1 3.47Å; R321-I325 PolarHBondContact O-N 3.33Å; R321-I325 VanDerWaalsContact O-N 3.07Å
322	R	90.2	Very high	92.4	Very high	60 Å²	60	60.5 Å²	60.5	23%	0.226	31%	0.308	C	S	.	.	H	α-helix	trans	-61	-40	175.5	-178.6	63.8	-178.2	175.4	9.5	110.9	V290 A318 A319 H320 I326 M367	V290-R322 HydrophobicContact CG2-CB 4.26Å; V290-R322 HydrophobicContact CG2-CG 4.32Å; A318-R322 WeakPolarHBondContact O-CB 3.41Å; A318-R322 PolarHBondContact O-N 3.09Å; A319-R322 PolarHBondContact O-N 2.68Å; H320-R322 VanDerWaalsContact C-N 3.34Å; H320-R322 PolarHBondContact O-N 3.09Å; R322-I326 HydrophobicContact CG-CD1 4.15Å; R322-I326 VanDerWaalsContact O-CG1 3.31Å; R322-I326 WeakPolarHBondContact O-CG1 3.42Å; R322-I326 PolarHBondContact O-N 3.23Å; R322-I326 VanDerWaalsContact O-N 3.11Å; R322-M367 PolarHBondContact NH1-SD 3.28Å; R322-M367 PolarHBondContact NH2-O 3.42Å
323	R	93.3	Very high	92.5	Very high	157 Å²	157	57.1 Å²	57.1	59%	0.592	29%	0.29	S	S	*	.	H	α-helix	trans	-67.3	-48.3	175.2	-172.5	175.8	-64.3	158.8	2.6	112	A319 H320 R321 I325 I326 D327	A319-R323 WeakPolarHBondContact O-CB 3.27Å; A319-R323 PolarHBondContact O-N 3.12Å; H320-R323 WeakPolarHBondContact O-CA 3.35Å; H320-R323 WeakPolarHBondContact O-CB 3.46Å; H320-R323 PolarHBondContact O-N 2.91Å; H320-R323 VanDerWaalsContact O-N 3.07Å; R321-R323 VanDerWaalsContact C-N 3.28Å; R321-R323 PolarHBondContact O-N 3.24Å; R323-I325 PolarHBondContact O-N 3.38Å; R323-I326 CarbonylContact O-C 3.57Å; R323-I326 WeakPolarHBondContact O-CA 3.41Å; R323-I326 WeakPolarHBondContact O-CB 3.41Å; R323-I326 PolarHBondContact O-N 3.04Å; R323-D327 VanDerWaalsContact O-CG 3.24Å; R323-D327 PolarHBondContact O-N 3.3Å
324	E	91.3	Very high	92.6	Very high	82 Å²	82	58.3 Å²	58.3	38%	0.383	30%	0.295	S	S	.	.	H	α-helix	trans	-53.5	-42.5	176.3	-70.7	170.6	122.7	0	0	112	H320 R321 D327 V328	H320-E324 IonicContact CE1-OE1 3.72Å; H320-E324 PolarHBondContact CE1-OE1 3.29Å; H320-E324 VanDerWaalsContact CE1-OE1 3.26Å; H320-E324 IonicContact CE1-OE2 2.78Å; H320-E324 IonicContact ND1-OE1 3.92Å; H320-E324 PolarHBondContact ND1-OE1 2.65Å; H320-E324 IonicContact ND1-OE2 2.74Å; H320-E324 PolarHBondContact ND1-OE2 2.94Å; H320-E324 WeakPolarHBondContact O-CG 3.32Å; H320-E324 PolarHBondContact O-N 3.06Å; R321-E324 WeakPolarHBondContact CA-OE2 3.44Å; R321-E324 PolarHBondContact O-N 2.6Å; E324-D327 PolarHBondContact O-N 3.13Å; E324-V328 VanDerWaalsContact O-CG2 3.3Å; E324-V328 WeakPolarHBondContact O-CG2 3.16Å; E324-V328 PolarHBondContact O-N 3.44Å
325	I	87.9	Confident	92.5	Very high	51 Å²	51	62.4 Å²	62.4	26%	0.262	31%	0.31	S	S	.	.	H	α-helix	trans	-67.4	-41	177	-64	164.1	0	0	0	111.6	S13 R321 R323 A329 M367	S13-I325 VanDerWaalsContact CB-CG2 3.43Å; R321-I325 WeakPolarHBondContact O-CD1 3.11Å; R321-I325 VanDerWaalsContact O-CG1 3.26Å; R321-I325 WeakPolarHBondContact O-CG1 3.47Å; R321-I325 PolarHBondContact O-N 3.33Å; R321-I325 VanDerWaalsContact O-N 3.07Å; R323-I325 PolarHBondContact O-N 3.38Å; I325-A329 PolarHBondContact O-N 2.93Å; I325-M367 HydrophobicContact CB-CE 4.31Å; I325-M367 HydrophobicContact CG2-CE 3.58Å
326	I	91.8	Very high	92.3	Very high	44 Å²	44	64 Å²	64	23%	0.226	32%	0.317	C	S	.	.	H	α-helix	trans	-64.2	-43.2	175.3	-74.9	168.5	0	0	0	110.9	R322 R323 V328 A329 T330 M367	R322-I326 HydrophobicContact CG-CD1 4.15Å; R322-I326 VanDerWaalsContact O-CG1 3.31Å; R322-I326 WeakPolarHBondContact O-CG1 3.42Å; R322-I326 PolarHBondContact O-N 3.23Å; R322-I326 VanDerWaalsContact O-N 3.11Å; R323-I326 CarbonylContact O-C 3.57Å; R323-I326 WeakPolarHBondContact O-CA 3.41Å; R323-I326 WeakPolarHBondContact O-CB 3.41Å; R323-I326 PolarHBondContact O-N 3.04Å; I326-V328 PolarHBondContact O-N 3.27Å; I326-A329 PolarHBondContact O-N 3.12Å; I326-T330 VanDerWaalsContact O-CB 3.32Å; I326-T330 WeakPolarHBondContact O-CB 3.37Å; I326-T330 PolarHBondContact O-N 2.81Å; I326-T330 PolarHBondContact O-OG1 3.27Å; I326-M367 HydrophobicContact CG1-CE 3.65Å
327	D	92.8	Very high	92.1	Very high	85 Å²	85	59 Å²	59	46%	0.455	29%	0.286	S	S	.	.	H	α-helix	trans	-62.7	-44.2	179.9	-66	-22.4	0	0	0	110.5	R323 E324 T330 V331	R323-D327 VanDerWaalsContact O-CG 3.24Å; R323-D327 PolarHBondContact O-N 3.3Å; E324-D327 PolarHBondContact O-N 3.13Å; D327-T330 WeakPolarHBondContact O-CB 3.25Å; D327-T330 PolarHBondContact O-N 3.09Å; D327-V331 WeakPolarHBondContact O-CG2 3.32Å; D327-V331 PolarHBondContact O-N 2.69Å
328	V	91	Very high	92	Very high	27 Å²	27	60.3 Å²	60.3	16%	0.164	29%	0.288	C	S	.	.	H	α-helix	trans	-60.2	-46.5	174.5	166.9	0	0	0	0	112	L9 L10 E324 I326 T330 V331 A332	L9-V328 HydrophobicContact CB-CG1 4.48Å; L9-V328 HydrophobicContact CB-CG2 4.27Å; L9-V328 HydrophobicContact CD1-CG2 4.23Å; L10-V328 HydrophobicContact CD2-CG1 3.49Å; L10-V328 VanDerWaalsContact CD2-CG1 3.49Å; L10-V328 HydrophobicContact CG-CG1 3.53Å; E324-V328 VanDerWaalsContact O-CG2 3.3Å; E324-V328 WeakPolarHBondContact O-CG2 3.16Å; E324-V328 PolarHBondContact O-N 3.44Å; I326-V328 PolarHBondContact O-N 3.27Å; V328-T330 VanDerWaalsContact C-N 3.32Å; V328-T330 PolarHBondContact O-N 3.06Å; V328-V331 PolarHBondContact O-N 2.83Å; V328-A332 PolarHBondContact O-N 2.84Å
329	A	89.9	Confident	91.9	Very high	0 Å²	0	66.7 Å²	66.7	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-64.4	-36.7	175.4	0	0	0	0	0	112.2	I325 I326 A332 Y333	I325-A329 PolarHBondContact O-N 2.93Å; I326-A329 PolarHBondContact O-N 3.12Å; A329-A332 PolarHBondContact O-N 3.42Å; A329-Y333 WeakPolarHBondContact O-CB 3.5Å; A329-Y333 PolarHBondContact O-N 3.19Å
330	T	93.8	Very high	91.8	Very high	28 Å²	28	67.2 Å²	67.2	17%	0.172	32%	0.315	C	S	.	.	H	α-helix	trans	-66.1	-44	177.3	-55.4	0	0	0	0	111.1	I326 D327 V328 Y333 L334 F364 L376	I326-T330 VanDerWaalsContact O-CB 3.32Å; I326-T330 WeakPolarHBondContact O-CB 3.37Å; I326-T330 PolarHBondContact O-N 2.81Å; I326-T330 PolarHBondContact O-OG1 3.27Å; D327-T330 WeakPolarHBondContact O-CB 3.25Å; D327-T330 PolarHBondContact O-N 3.09Å; V328-T330 VanDerWaalsContact C-N 3.32Å; V328-T330 PolarHBondContact O-N 3.06Å; T330-Y333 PolarHBondContact O-N 3.4Å; T330-L334 HydrophobicContact CG2-CD1 3.94Å; T330-L334 HydrophobicContact CG2-CG 4.29Å; T330-L334 WeakPolarHBondContact O-CB 3.09Å; T330-L334 VanDerWaalsContact O-CG 3.27Å; T330-L334 WeakPolarHBondContact O-CG 3.16Å; T330-L334 PolarHBondContact O-N 3.18Å; T330-F364 HydrophobicContact CG2-CE2 4.12Å; T330-F364 WeakPolarHBondContact OG1-CE2 3.23Å; T330-L376 HydrophobicContact CG2-CD1 4.19Å
331	V	93.1	Very high	91.6	Very high	97 Å²	97	62 Å²	62	59%	0.588	29%	0.291	S	S	*	.	H	α-helix	trans	-64.1	-43.7	176.8	169.7	0	0	0	0	111	D327 V328 L334 H335	D327-V331 WeakPolarHBondContact O-CG2 3.32Å; D327-V331 PolarHBondContact O-N 2.69Å; V328-V331 PolarHBondContact O-N 2.83Å; V331-L334 PolarHBondContact O-N 2.98Å; V331-H335 WeakPolarHBondContact O-CB 3.49Å; V331-H335 PolarHBondContact O-N 3.23Å
332	A	90.2	Very high	91.6	Very high	16 Å²	16	61.8 Å²	61.8	13%	0.132	30%	0.295	C	S	.	.	H	α-helix	trans	-60.8	-46.1	175.8	0	0	0	0	0	111.8	L10 V328 A329 H335 K336 D360	L10-A332 HydrophobicContact CD2-CB 4.28Å; V328-A332 PolarHBondContact O-N 2.84Å; A329-A332 PolarHBondContact O-N 3.42Å; A332-H335 PolarHBondContact O-N 2.84Å; A332-K336 PolarHBondContact O-N 3.4Å; A332-D360 HydrophobicContact CB-CB 4.04Å
333	Y	94.1	Very high	91.4	Very high	0 Å²	0	63.4 Å²	63.4	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-62.6	-47.3	175.5	173	-118.4	0	0	0	112.8	A329 T330 H335 K336 L337 F351 F361 F364 A373 L376	A329-Y333 WeakPolarHBondContact O-CB 3.5Å; A329-Y333 PolarHBondContact O-N 3.19Å; T330-Y333 PolarHBondContact O-N 3.4Å; Y333-H335 VanDerWaalsContact C-N 3.31Å; Y333-H335 PolarHBondContact O-N 3.44Å; Y333-K336 PolarHBondContact O-N 2.83Å; Y333-L337 HydrophobicContact CE1-CD2 4.4Å; Y333-L337 WeakPolarHBondContact O-CB 3.39Å; Y333-L337 PolarHBondContact O-N 3.01Å; Y333-F351 AromaticContact CE2-CE1 3.71Å; Y333-F351 HydrophobicContact CE2-CE1 3.71Å; Y333-F351 AromaticContact CE2-CZ 3.69Å; Y333-F351 HydrophobicContact CE2-CZ 3.69Å; Y333-F351 WeakPolarHBondContact OH-CE1 3.13Å; Y333-F361 AromaticContact CD2-CD2 3.89Å; Y333-F361 HydrophobicContact CD2-CD2 3.89Å; Y333-F361 AromaticContact CE2-CD2 3.55Å; Y333-F361 HydrophobicContact CE2-CD2 3.55Å; Y333-F361 HydrophobicContact CE2-CE2 4.08Å; Y333-F364 AromaticContact CD1-CD1 3.94Å; Y333-F364 HydrophobicContact CD1-CD1 3.94Å; Y333-F364 HydrophobicContact CD1-CD2 4.21Å; Y333-F364 HydrophobicContact CD1-CE1 4.14Å; Y333-F364 HydrophobicContact CD1-CE2 4.36Å; Y333-F364 HydrophobicContact CD1-CG 4Å; Y333-F364 HydrophobicContact CD1-CZ 4.34Å; Y333-F364 HydrophobicContact CE1-CD1 4.44Å; Y333-F364 HydrophobicContact CE1-CE1 4.42Å; Y333-F364 HydrophobicContact CG-CB 4.18Å; Y333-F364 HydrophobicContact CG-CD1 4.13Å; Y333-F364 HydrophobicContact CG-CD2 4.33Å; Y333-F364 AromaticContact CG-CG 3.91Å; Y333-F364 HydrophobicContact CG-CG 3.91Å; Y333-A373 HydrophobicContact CE1-CB 4.35Å; Y333-A373 PolarHBondContact OH-O 2.88Å; Y333-L376 HydrophobicContact CD1-CD1 3.97Å; Y333-L376 HydrophobicContact CE1-CB 3.93Å; Y333-L376 HydrophobicContact CE1-CD1 4.02Å
334	L	93.5	Very high	91.1	Very high	50 Å²	50	58.5 Å²	58.5	26%	0.262	29%	0.288	S	S	.	.	H	α-helix	trans	-64	-34.5	177.7	-72.9	176.1	0	0	0	112.3	T330 V331 L337 K338	T330-L334 HydrophobicContact CG2-CD1 3.94Å; T330-L334 HydrophobicContact CG2-CG 4.29Å; T330-L334 WeakPolarHBondContact O-CB 3.09Å; T330-L334 VanDerWaalsContact O-CG 3.27Å; T330-L334 WeakPolarHBondContact O-CG 3.16Å; T330-L334 PolarHBondContact O-N 3.18Å; V331-L334 PolarHBondContact O-N 2.98Å; L334-L337 HydrophobicContact CD2-CD2 4.07Å; L334-K338 WeakPolarHBondContact O-CB 3.37Å; L334-K338 VanDerWaalsContact O-CG 3.29Å; L334-K338 WeakPolarHBondContact O-CG 3.19Å; L334-K338 PolarHBondContact O-N 3.5Å
335	H	92	Very high	91	Very high	127 Å²	127	60.4 Å²	60.4	59%	0.588	29%	0.292	S	S	*	.	H	α-helix	trans	-64.3	-46.5	172.5	-179.4	84.7	0	0	0	111.1	V331 A332 Y333 K338 K339	V331-H335 WeakPolarHBondContact O-CB 3.49Å; V331-H335 PolarHBondContact O-N 3.23Å; A332-H335 PolarHBondContact O-N 2.84Å; Y333-H335 VanDerWaalsContact C-N 3.31Å; Y333-H335 PolarHBondContact O-N 3.44Å; H335-K338 PolarHBondContact O-N 2.98Å; H335-K339 WeakPolarHBondContact O-CB 3.27Å; H335-K339 PolarHBondContact O-N 3.18Å
336	K	90.5	Very high	91.1	Very high	61 Å²	61	60.3 Å²	60.3	27%	0.265	29%	0.288	S	S	.	.	H	α-helix	trans	-60.9	-45.8	175.7	-169.9	76.2	-168.8	-147.1	0	111.5	A332 Y333 K339 T340 L355 D358	A332-K336 PolarHBondContact O-N 3.4Å; Y333-K336 PolarHBondContact O-N 2.83Å; K336-K339 PolarHBondContact O-N 3.38Å; K336-T340 WeakPolarHBondContact O-CB 3.34Å; K336-T340 PolarHBondContact O-N 2.87Å; K336-T340 PolarHBondContact O-OG1 3.4Å; K336-L355 HydrophobicContact CD-CD2 4.41Å; K336-L355 VanDerWaalsContact CE-CD2 3.47Å; K336-L355 HydrophobicContact CG-CD1 3.89Å; K336-L355 HydrophobicContact CG-CD2 4.08Å; K336-D358 WeakPolarHBondContact CE-OD2 3.38Å; K336-D358 IonicContact NZ-OD2 3.55Å; K336-D358 PolarHBondContact NZ-OD2 2.83Å
337	L	92.2	Very high	91.1	Very high	0 Å²	0	61.6 Å²	61.6	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-56.2	-52.3	176.9	177.4	61.5	0	0	0	111.5	Y333 L334 K339 T340 V341 F351 F377 Y380	Y333-L337 HydrophobicContact CE1-CD2 4.4Å; Y333-L337 WeakPolarHBondContact O-CB 3.39Å; Y333-L337 PolarHBondContact O-N 3.01Å; L334-L337 HydrophobicContact CD2-CD2 4.07Å; L337-K339 VanDerWaalsContact C-N 3.3Å; L337-K339 PolarHBondContact O-N 2.96Å; L337-T340 PolarHBondContact O-N 3.45Å; L337-V341 HydrophobicContact CD1-CB 4.25Å; L337-V341 HydrophobicContact CD1-CG2 3.83Å; L337-V341 WeakPolarHBondContact O-CB 3.39Å; L337-V341 PolarHBondContact O-N 3.33Å; L337-F351 HydrophobicContact CB-CZ 4.31Å; L337-F351 HydrophobicContact CD1-CD2 4.26Å; L337-F351 HydrophobicContact CD1-CE1 4.42Å; L337-F351 HydrophobicContact CD1-CE2 3.54Å; L337-F351 HydrophobicContact CD1-CZ 3.61Å; L337-F377 HydrophobicContact CD1-CD2 3.64Å; L337-F377 HydrophobicContact CD1-CE2 4.39Å; L337-Y380 HydrophobicContact CD1-CD1 3.9Å; L337-Y380 HydrophobicContact CD1-CE1 4.48Å; L337-Y380 HydrophobicContact CD2-CD1 3.84Å; L337-Y380 HydrophobicContact CD2-CG 3.9Å; L337-Y380 HydrophobicContact CG-CD1 3.54Å; L337-Y380 HydrophobicContact CG-CE1 4.07Å; L337-Y380 HydrophobicContact CG-CG 4.09Å
338	K	92.3	Very high	91.1	Very high	111 Å²	111	60.1 Å²	60.1	48%	0.483	29%	0.286	S	S	.	.	H	α-helix	trans	-63.5	-30.6	177.4	-74.1	173.8	178.1	-176.3	0	113.8	L334 H335 Q342 Y380	L334-K338 WeakPolarHBondContact O-CB 3.37Å; L334-K338 VanDerWaalsContact O-CG 3.29Å; L334-K338 WeakPolarHBondContact O-CG 3.19Å; L334-K338 PolarHBondContact O-N 3.5Å; H335-K338 PolarHBondContact O-N 2.98Å; K338-Q342 PolarHBondContact O-NE2 3.13Å; K338-Y380 HydrophobicContact CD-CE2 4.47Å; K338-Y380 HydrophobicContact CG-CD2 4.39Å; K338-Y380 HydrophobicContact CG-CE1 4.41Å; K338-Y380 HydrophobicContact CG-CE2 3.66Å
339	K	91.8	Very high	91.1	Very high	148 Å²	148	60.7 Å²	60.7	64%	0.643	30%	0.298	S	S	*	.	H	α-helix	trans	-75.6	-35.3	176.3	-172.5	174.2	-178.1	174.1	0	112.4	H335 K336 L337 Q342	H335-K339 WeakPolarHBondContact O-CB 3.27Å; H335-K339 PolarHBondContact O-N 3.18Å; K336-K339 PolarHBondContact O-N 3.38Å; L337-K339 VanDerWaalsContact C-N 3.3Å; L337-K339 PolarHBondContact O-N 2.96Å; K339-Q342 PolarHBondContact O-NE2 3.05Å
340	T	91.4	Very high	91.2	Very high	28 Å²	28	64.8 Å²	64.8	17%	0.172	32%	0.317	C	S	.	.	H	α-helix	trans	-89.8	-41.8	-175.1	-71.2	0	0	0	0	113.3	K336 L337 W346 F351 L354	K336-T340 WeakPolarHBondContact O-CB 3.34Å; K336-T340 PolarHBondContact O-N 2.87Å; K336-T340 PolarHBondContact O-OG1 3.4Å; L337-T340 PolarHBondContact O-N 3.45Å; T340-W346 HydrophobicContact CG2-CH2 3.72Å; T340-W346 HydrophobicContact CG2-CZ2 4.34Å; T340-W346 HydrophobicContact CG2-CZ3 3.97Å; T340-W346 WeakPolarHBondContact O-CZ2 3.33Å; T340-F351 HydrophobicContact CG2-CD2 4.23Å; T340-F351 HydrophobicContact CG2-CE2 4.25Å; T340-L354 HydrophobicContact CG2-CD2 3.55Å
341	V	91.2	Very high	91.1	Very high	0 Å²	0	63.4 Å²	63.4	0%	0	31%	0.309	C	S	.	.			trans	-99.2	95.4	-172.7	176.1	0	0	0	0	109.6	L337 W346 F351 F377 Y380 L381 L384	L337-V341 HydrophobicContact CD1-CB 4.25Å; L337-V341 HydrophobicContact CD1-CG2 3.83Å; L337-V341 WeakPolarHBondContact O-CB 3.39Å; L337-V341 PolarHBondContact O-N 3.33Å; V341-W346 HydrophobicContact CB-CD2 4.44Å; V341-W346 HydrophobicContact CB-CG 4.32Å; V341-W346 HydrophobicContact CG1-CB 3.89Å; V341-W346 HydrophobicContact CG1-CD2 4.4Å; V341-W346 HydrophobicContact CG1-CG 3.78Å; V341-W346 HydrophobicContact CG2-CB 4.39Å; V341-W346 HydrophobicContact CG2-CD2 3.84Å; V341-W346 HydrophobicContact CG2-CE3 3.95Å; V341-W346 HydrophobicContact CG2-CG 4.04Å; V341-F351 HydrophobicContact CG2-CD2 3.57Å; V341-F351 HydrophobicContact CG2-CE2 3.82Å; V341-F377 HydrophobicContact CG2-CE2 4.04Å; V341-Y380 HydrophobicContact CB-CD1 4.42Å; V341-Y380 HydrophobicContact CB-CE1 3.98Å; V341-Y380 HydrophobicContact CG1-CD1 4.28Å; V341-Y380 HydrophobicContact CG1-CE1 4.02Å; V341-Y380 WeakPolarHBondContact O-CE1 3.4Å; V341-Y380 PolarHBondContact O-OH 3.48Å; V341-L381 HydrophobicContact CG1-CD2 3.71Å; V341-L384 HydrophobicContact CG1-CD1 3.93Å
342	Q	88.9	Confident	91	Very high	126 Å²	126	60.5 Å²	60.5	59%	0.589	29%	0.292	S	S	*	.			trans	-92.8	-8.3	-176	-61.3	-58.1	-29.7	0	0	114.4	K338 K339	K338-Q342 PolarHBondContact O-NE2 3.13Å; K339-Q342 PolarHBondContact O-NE2 3.05Å
343	H	87.2	Confident	90.9	Very high	94 Å²	94	68.6 Å²	68.6	44%	0.435	32%	0.319	S	S	.	.	S	Bend	trans	-147	153.3	-178.9	56.5	90	0	0	0	111.5	R345 W346	H343-R345 PolarHBondContact O-N 3Å; H343-R345 VanDerWaalsContact O-N 3.15Å; H343-W346 AromaticContact CD2-CD1 3.85Å; H343-W346 AromaticContact CD2-NE1 3.56Å; H343-W346 AromaticContact CE1-CD1 3.25Å; H343-W346 AromaticContact CE1-NE1 3.36Å; H343-W346 PolarHBondContact CE1-NE1 3.06Å; H343-W346 AromaticContact CG-CD1 3.91Å; H343-W346 AromaticContact ND1-CD1 3.55Å; H343-W346 AromaticContact ND1-NE1 3.97Å; H343-W346 AromaticContact NE2-CD1 3.42Å; H343-W346 AromaticContact NE2-NE1 3.01Å; H343-W346 PolarHBondContact NE2-NE1 3.35Å; H343-W346 VanDerWaalsContact O-CD1 3.28Å
344	F	87	Confident	90.7	Very high	53 Å²	53	73.7 Å²	73.7	23%	0.232	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-7.6	-173.7	62.2	-95.2	0	0	0	114.8	W346 L384 R385 H388	F344-W346 VanDerWaalsContact C-N 3.3Å; F344-W346 PolarHBondContact O-N 2.74Å; F344-L384 HydrophobicContact CB-CB 4.12Å; F344-R385 HydrophobicContact CB-CB 3.88Å; F344-R385 HydrophobicContact CD1-CB 4.42Å; F344-R385 HydrophobicContact CD2-CB 4.39Å; F344-R385 HydrophobicContact CD2-CG 4.25Å; F344-R385 HydrophobicContact CG-CB 3.97Å; F344-R385 HydrophobicContact CG-CG 4.23Å; F344-H388 HydrophobicContact CD1-CB 4.22Å; F344-H388 HydrophobicContact CE1-CB 4.19Å; F344-H388 AromaticContact CE1-CD2 3.63Å; F344-H388 AromaticContact CE1-CG 3.83Å
345	R	88	Confident	90.4	Very high	122 Å²	122	71.4 Å²	71.4	46%	0.46	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.5	1.7	178.9	-54.7	-174.6	177.9	-161.6	5.8	115.1	H343 D446 D448	H343-R345 PolarHBondContact O-N 3Å; H343-R345 VanDerWaalsContact O-N 3.15Å; R345-D446 IonicContact NH1-OD1 3.33Å; R345-D448 IonicContact CZ-OD2 2.99Å; R345-D448 IonicContact NE-OD2 3.73Å; R345-D448 VanDerWaalsContact NH2-CB 3.33Å; R345-D448 IonicContact NH2-OD2 2.72Å; R345-D448 PolarHBondContact NH2-OD2 2.98Å
346	W	91	Very high	89.7	Confident	49 Å²	49	71.6 Å²	71.6	19%	0.186	34%	0.335	C	S	.	.			trans	-67.9	147.6	178	-84.7	68.9	0	0	0	112.4	T340 V341 H343 F344 Q350 F351 L354 F377 L381	T340-W346 HydrophobicContact CG2-CH2 3.72Å; T340-W346 HydrophobicContact CG2-CZ2 4.34Å; T340-W346 HydrophobicContact CG2-CZ3 3.97Å; T340-W346 WeakPolarHBondContact O-CZ2 3.33Å; V341-W346 HydrophobicContact CB-CD2 4.44Å; V341-W346 HydrophobicContact CB-CG 4.32Å; V341-W346 HydrophobicContact CG1-CB 3.89Å; V341-W346 HydrophobicContact CG1-CD2 4.4Å; V341-W346 HydrophobicContact CG1-CG 3.78Å; V341-W346 HydrophobicContact CG2-CB 4.39Å; V341-W346 HydrophobicContact CG2-CD2 3.84Å; V341-W346 HydrophobicContact CG2-CE3 3.95Å; V341-W346 HydrophobicContact CG2-CG 4.04Å; H343-W346 AromaticContact CD2-CD1 3.85Å; H343-W346 AromaticContact CD2-NE1 3.56Å; H343-W346 AromaticContact CE1-CD1 3.25Å; H343-W346 AromaticContact CE1-NE1 3.36Å; H343-W346 PolarHBondContact CE1-NE1 3.06Å; H343-W346 AromaticContact CG-CD1 3.91Å; H343-W346 AromaticContact ND1-CD1 3.55Å; H343-W346 AromaticContact ND1-NE1 3.97Å; H343-W346 AromaticContact NE2-CD1 3.42Å; H343-W346 AromaticContact NE2-NE1 3.01Å; H343-W346 PolarHBondContact NE2-NE1 3.35Å; H343-W346 VanDerWaalsContact O-CD1 3.28Å; F344-W346 VanDerWaalsContact C-N 3.3Å; F344-W346 PolarHBondContact O-N 2.74Å; W346-Q350 HydrophobicContact CE3-CB 4.19Å; W346-Q350 HydrophobicContact CZ3-CB 4.4Å; W346-F351 HydrophobicContact CE3-CB 4.3Å; W346-L354 HydrophobicContact CH2-CD2 3.71Å; W346-L354 HydrophobicContact CZ3-CD2 4.1Å; W346-F377 HydrophobicContact CB-CE2 4.39Å; W346-F377 HydrophobicContact CB-CZ 4.11Å; W346-L381 HydrophobicContact CB-CD2 4.13Å; W346-L381 VanDerWaalsContact O-CD1 3.26Å; W346-L381 WeakPolarHBondContact O-CD1 3.49Å
347	T	92.2	Very high	89.3	Confident	71 Å²	71	76 Å²	76	44%	0.436	36%	0.361	S	S	.	.			trans	-111.2	151.2	173.3	64.9	0	0	0	0	111.8	G349 Q350 F351 F377	T347-G349 PolarHBondContact O-N 2.95Å; T347-Q350 PolarHBondContact O-N 2.84Å; T347-Q350 VanDerWaalsContact OG1-CG 3.27Å; T347-Q350 WeakPolarHBondContact OG1-CG 3.29Å; T347-Q350 PolarHBondContact OG1-N 3.44Å; T347-Q350 PolarHBondContact OG1-OE1 3.44Å; T347-F351 PolarHBondContact O-N 2.89Å; T347-F377 VanDerWaalsContact C-CZ 3.47Å
348	W	92.8	Very high	89.2	Confident	54 Å²	54	76.9 Å²	76.9	21%	0.205	37%	0.366	C	S	.	.	H	α-helix	trans	-55.5	-38.6	177.2	-177.9	-120.3	0	0	0	112.3	F351 C352 F361 A373 Q374 F377	W348-F351 AromaticContact CE3-CD1 3.95Å; W348-F351 HydrophobicContact CE3-CD1 3.95Å; W348-F351 AromaticContact CZ3-CD1 3.67Å; W348-F351 HydrophobicContact CZ3-CD1 3.67Å; W348-F351 AromaticContact CZ3-CE1 3.98Å; W348-F351 HydrophobicContact CZ3-CE1 3.98Å; W348-F351 PolarHBondContact O-N 2.91Å; W348-C352 WeakPolarHBondContact CZ2-SG 3.41Å; W348-C352 WeakPolarHBondContact O-CB 3.28Å; W348-C352 PolarHBondContact O-N 3.35Å; W348-C352 PolarHBondContact O-SG 3.06Å; W348-C352 VanDerWaalsContact O-SG 3.34Å; W348-F361 AromaticContact CH2-CE2 3.94Å; W348-F361 HydrophobicContact CH2-CE2 3.94Å; W348-F361 HydrophobicContact CH2-CZ 4.13Å; W348-A373 HydrophobicContact CH2-CB 3.67Å; W348-A373 HydrophobicContact CZ2-CB 4.46Å; W348-Q374 HydrophobicContact CD2-CB 4.02Å; W348-Q374 HydrophobicContact CD2-CG 3.8Å; W348-Q374 HydrophobicContact CE3-CB 4.27Å; W348-Q374 HydrophobicContact CE3-CG 4.26Å; W348-Q374 HydrophobicContact CG-CG 3.98Å; W348-Q374 HydrophobicContact CH2-CB 4.05Å; W348-Q374 HydrophobicContact CZ2-CB 3.74Å; W348-Q374 HydrophobicContact CZ2-CG 4.41Å; W348-Q374 HydrophobicContact CZ3-CB 4.29Å; W348-F377 HydrophobicContact CB-CD1 4.37Å; W348-F377 HydrophobicContact CB-CE1 4.08Å; W348-F377 HydrophobicContact CE3-CB 3.8Å; W348-F377 AromaticContact CE3-CD1 3.74Å; W348-F377 HydrophobicContact CE3-CD1 3.74Å; W348-F377 HydrophobicContact CE3-CD2 4.1Å; W348-F377 HydrophobicContact CE3-CE1 4.34Å; W348-F377 AromaticContact CE3-CG 3.62Å; W348-F377 HydrophobicContact CE3-CG 3.62Å; W348-F377 HydrophobicContact CZ3-CB 3.7Å; W348-F377 HydrophobicContact CZ3-CD2 4.39Å; W348-F377 AromaticContact CZ3-CG 3.97Å; W348-F377 HydrophobicContact CZ3-CG 3.97Å
349	G	91.1	Very high	89.1	Confident	39 Å²	39	74.5 Å²	74.5	40%	0.402	36%	0.362	S	S	.	.	H	α-helix	trans	-72.3	-23.3	177.4	0	0	0	0	0	115.1	T347 R353	T347-G349 PolarHBondContact O-N 2.95Å; G349-R353 WeakPolarHBondContact O-CG 3.36Å; G349-R353 PolarHBondContact O-NE 3.11Å
350	Q	90.6	Very high	89	Confident	86 Å²	86	69.3 Å²	69.3	40%	0.402	34%	0.341	S	S	.	.	H	α-helix	trans	-74.7	-46.1	167	-74.2	156.9	-29.6	0	0	110.3	W346 T347 R353 L354	W346-Q350 HydrophobicContact CE3-CB 4.19Å; W346-Q350 HydrophobicContact CZ3-CB 4.4Å; T347-Q350 PolarHBondContact O-N 2.84Å; T347-Q350 VanDerWaalsContact OG1-CG 3.27Å; T347-Q350 WeakPolarHBondContact OG1-CG 3.29Å; T347-Q350 PolarHBondContact OG1-N 3.44Å; T347-Q350 PolarHBondContact OG1-OE1 3.44Å; Q350-R353 PolarHBondContact O-N 2.85Å; Q350-L354 PolarHBondContact O-N 2.84Å
351	F	91.8	Very high	89.1	Confident	0 Å²	0	68 Å²	68	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-61	-50.2	-178	-175.5	-102.8	0	0	0	112.9	Y333 L337 T340 V341 W346 T347 W348 R353 L354 L355 F361 F377	Y333-F351 AromaticContact CE2-CE1 3.71Å; Y333-F351 HydrophobicContact CE2-CE1 3.71Å; Y333-F351 AromaticContact CE2-CZ 3.69Å; Y333-F351 HydrophobicContact CE2-CZ 3.69Å; Y333-F351 WeakPolarHBondContact OH-CE1 3.13Å; L337-F351 HydrophobicContact CB-CZ 4.31Å; L337-F351 HydrophobicContact CD1-CD2 4.26Å; L337-F351 HydrophobicContact CD1-CE1 4.42Å; L337-F351 HydrophobicContact CD1-CE2 3.54Å; L337-F351 HydrophobicContact CD1-CZ 3.61Å; T340-F351 HydrophobicContact CG2-CD2 4.23Å; T340-F351 HydrophobicContact CG2-CE2 4.25Å; V341-F351 HydrophobicContact CG2-CD2 3.57Å; V341-F351 HydrophobicContact CG2-CE2 3.82Å; W346-F351 HydrophobicContact CE3-CB 4.3Å; T347-F351 PolarHBondContact O-N 2.89Å; W348-F351 AromaticContact CE3-CD1 3.95Å; W348-F351 HydrophobicContact CE3-CD1 3.95Å; W348-F351 AromaticContact CZ3-CD1 3.67Å; W348-F351 HydrophobicContact CZ3-CD1 3.67Å; W348-F351 AromaticContact CZ3-CE1 3.98Å; W348-F351 HydrophobicContact CZ3-CE1 3.98Å; W348-F351 PolarHBondContact O-N 2.91Å; F351-R353 VanDerWaalsContact C-N 3.32Å; F351-R353 PolarHBondContact O-N 3.36Å; F351-L354 PolarHBondContact O-N 3.28Å; F351-L354 VanDerWaalsContact O-N 3.13Å; F351-L355 HydrophobicContact CD1-CD1 4.42Å; F351-L355 HydrophobicContact CD2-CD1 4.36Å; F351-L355 HydrophobicContact CE1-CD1 3.69Å; F351-L355 HydrophobicContact CE2-CD1 3.62Å; F351-L355 HydrophobicContact CE2-CG 4.32Å; F351-L355 HydrophobicContact CZ-CD1 3.24Å; F351-L355 HydrophobicContact CZ-CG 4.28Å; F351-L355 PolarHBondContact O-N 3.2Å; F351-L355 VanDerWaalsContact O-N 3.12Å; F351-F361 HydrophobicContact CE1-CD2 4.27Å; F351-F361 HydrophobicContact CE1-CE2 4.08Å; F351-F377 HydrophobicContact CB-CD2 4.12Å; F351-F377 HydrophobicContact CB-CE2 3.58Å; F351-F377 HydrophobicContact CB-CZ 4.18Å; F351-F377 AromaticContact CD1-CD2 3.86Å; F351-F377 HydrophobicContact CD1-CD2 3.86Å; F351-F377 HydrophobicContact CD1-CE2 4.2Å; F351-F377 HydrophobicContact CD2-CD2 4.07Å; F351-F377 AromaticContact CD2-CE2 3.92Å; F351-F377 HydrophobicContact CD2-CE2 3.92Å; F351-F377 HydrophobicContact CE1-CD2 4.26Å; F351-F377 HydrophobicContact CE2-CD2 4.44Å; F351-F377 AromaticContact CG-CD2 3.74Å; F351-F377 HydrophobicContact CG-CD2 3.74Å; F351-F377 AromaticContact CG-CE2 3.64Å; F351-F377 HydrophobicContact CG-CE2 3.64Å
352	C	90.6	Very high	89.1	Confident	35 Å²	35	69.7 Å²	69.7	24%	0.236	34%	0.341	C	S	.	.	H	α-helix	trans	-62.2	-35.2	178.6	-69.2	0	0	0	0	113.4	W348 L354 L355 Q356	W348-C352 WeakPolarHBondContact CZ2-SG 3.41Å; W348-C352 WeakPolarHBondContact O-CB 3.28Å; W348-C352 PolarHBondContact O-N 3.35Å; W348-C352 PolarHBondContact O-SG 3.06Å; W348-C352 VanDerWaalsContact O-SG 3.34Å; C352-L354 VanDerWaalsContact C-N 3.29Å; C352-L354 PolarHBondContact O-N 3.46Å; C352-L355 PolarHBondContact O-N 3.24Å; C352-Q356 PolarHBondContact O-N 3.48Å; C352-Q356 VanDerWaalsContact O-N 3.12Å
353	R	88.7	Confident	89.2	Confident	186 Å²	186	64 Å²	64	70%	0.702	32%	0.315	S	S	*	.	H	α-helix	trans	-67.8	-29.4	176.5	-79.4	-174.9	-69.4	168.2	-1.5	112.7	G349 Q350 F351	G349-R353 WeakPolarHBondContact O-CG 3.36Å; G349-R353 PolarHBondContact O-NE 3.11Å; Q350-R353 PolarHBondContact O-N 2.85Å; F351-R353 VanDerWaalsContact C-N 3.32Å; F351-R353 PolarHBondContact O-N 3.36Å
354	L	90.2	Very high	89.5	Confident	107 Å²	107	59.7 Å²	59.7	56%	0.56	30%	0.295	S	S	*	.	H	α-helix	trans	-82.2	-28.3	178.3	-176.1	58.3	0	0	0	112.8	T340 W346 Q350 F351 C352	T340-L354 HydrophobicContact CG2-CD2 3.55Å; W346-L354 HydrophobicContact CH2-CD2 3.71Å; W346-L354 HydrophobicContact CZ3-CD2 4.1Å; Q350-L354 PolarHBondContact O-N 2.84Å; F351-L354 PolarHBondContact O-N 3.28Å; F351-L354 VanDerWaalsContact O-N 3.13Å; C352-L354 VanDerWaalsContact C-N 3.29Å; C352-L354 PolarHBondContact O-N 3.46Å
355	L	86.5	Confident	89.7	Confident	2 Å²	2	57.2 Å²	57.2	1%	0.01	28%	0.284	C	S	.	.	S	Bend	trans	-105.2	11.5	-177.5	-60.1	-164.5	0	0	0	114.6	K336 F351 C352 D357 D358 F361	K336-L355 HydrophobicContact CD-CD2 4.41Å; K336-L355 VanDerWaalsContact CE-CD2 3.47Å; K336-L355 HydrophobicContact CG-CD1 3.89Å; K336-L355 HydrophobicContact CG-CD2 4.08Å; F351-L355 HydrophobicContact CD1-CD1 4.42Å; F351-L355 HydrophobicContact CD2-CD1 4.36Å; F351-L355 HydrophobicContact CE1-CD1 3.69Å; F351-L355 HydrophobicContact CE2-CD1 3.62Å; F351-L355 HydrophobicContact CE2-CG 4.32Å; F351-L355 HydrophobicContact CZ-CD1 3.24Å; F351-L355 HydrophobicContact CZ-CG 4.28Å; F351-L355 PolarHBondContact O-N 3.2Å; F351-L355 VanDerWaalsContact O-N 3.12Å; C352-L355 PolarHBondContact O-N 3.24Å; L355-D357 PolarHBondContact O-N 3.05Å; L355-D357 VanDerWaalsContact O-N 3.1Å; L355-D358 HydrophobicContact CB-CB 3.97Å; L355-D358 HydrophobicContact CD2-CB 4.09Å; L355-D358 WeakPolarHBondContact O-CB 3.37Å; L355-D358 PolarHBondContact O-N 3.45Å; L355-F361 HydrophobicContact CB-CB 4.06Å; L355-F361 HydrophobicContact CB-CD1 3.79Å; L355-F361 HydrophobicContact CB-CE1 4.39Å; L355-F361 HydrophobicContact CB-CG 3.91Å; L355-F361 HydrophobicContact CD1-CB 4.03Å; L355-F361 HydrophobicContact CD1-CD2 4.32Å; L355-F361 HydrophobicContact CD1-CG 4.15Å; L355-F361 WeakPolarHBondContact O-CD1 3.29Å
356	Q	77.7	Confident	89.9	Confident	131 Å²	131	52.9 Å²	52.9	61%	0.612	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-33.1	-174	-177.3	171.1	-8.2	0	0	114.3	C352	C352-Q356 PolarHBondContact O-N 3.48Å; C352-Q356 VanDerWaalsContact O-N 3.12Å
357	D	82.4	Confident	89.9	Confident	153 Å²	153	51.1 Å²	51.1	82%	0.818	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.1	11.7	177.4	-61.8	-57	0	0	0	112.8	L355	L355-D357 PolarHBondContact O-N 3.05Å; L355-D357 VanDerWaalsContact O-N 3.1Å
358	D	90.3	Very high	89.9	Confident	19 Å²	19	49 Å²	49	10%	0.102	25%	0.252	C	S	.	.			trans	-78.7	122.9	-178.3	-173.9	-84.8	0	0	0	111.5	K336 L355 D360 F361 E362	K336-D358 WeakPolarHBondContact CE-OD2 3.38Å; K336-D358 IonicContact NZ-OD2 3.55Å; K336-D358 PolarHBondContact NZ-OD2 2.83Å; L355-D358 HydrophobicContact CB-CB 3.97Å; L355-D358 HydrophobicContact CD2-CB 4.09Å; L355-D358 WeakPolarHBondContact O-CB 3.37Å; L355-D358 PolarHBondContact O-N 3.45Å; D358-D360 VanDerWaalsContact C-N 3.32Å; D358-D360 PolarHBondContact O-N 2.94Å; D358-D360 PolarHBondContact OD1-N 2.96Å; D358-F361 HydrophobicContact CB-CB 4.05Å; D358-F361 PolarHBondContact OD1-N 3.19Å; D358-E362 PolarHBondContact O-N 2.98Å
359	P	90.4	Very high	89.8	Confident	62 Å²	62	46.6 Å²	46.6	40%	0.403	24%	0.243	S	C	.	.	H	α-helix	trans	-72.1	-23.5	-171.2	29.8	-36.5	0	0	0	113.6	H363	P359-H363 WeakPolarHBondContact O-CB 3.33Å; P359-H363 PolarHBondContact O-N 2.7Å; P359-H363 VanDerWaalsContact O-N 3.13Å
360	D	89.6	Confident	89.9	Confident	38 Å²	38	49.1 Å²	49.1	20%	0.203	24%	0.241	C	C	.	.	H	α-helix	trans	-84.8	-38.2	179.6	-66.3	-48.9	0	0	0	111	R14 A332 D358 F364	R14-D360 IonicContact CZ-OD1 3.29Å; R14-D360 IonicContact NH2-OD1 3.5Å; R14-D360 PolarHBondContact NH2-OD1 3.34Å; R14-D360 IonicContact NH2-OD2 3.48Å; A332-D360 HydrophobicContact CB-CB 4.04Å; D358-D360 VanDerWaalsContact C-N 3.32Å; D358-D360 PolarHBondContact O-N 2.94Å; D358-D360 PolarHBondContact OD1-N 2.96Å; D360-F364 WeakPolarHBondContact O-CB 3.38Å; D360-F364 PolarHBondContact O-N 3.22Å
361	F	92.2	Very high	90	Very high	1 Å²	1	48.8 Å²	48.8	0%	0.004	24%	0.244	C	C	.	.	H	α-helix	trans	-60.8	-51.1	170	175.7	-116.1	0	0	0	112.4	Y333 W348 F351 L355 D358 F364 C365 A373	Y333-F361 AromaticContact CD2-CD2 3.89Å; Y333-F361 HydrophobicContact CD2-CD2 3.89Å; Y333-F361 AromaticContact CE2-CD2 3.55Å; Y333-F361 HydrophobicContact CE2-CD2 3.55Å; Y333-F361 HydrophobicContact CE2-CE2 4.08Å; W348-F361 AromaticContact CH2-CE2 3.94Å; W348-F361 HydrophobicContact CH2-CE2 3.94Å; W348-F361 HydrophobicContact CH2-CZ 4.13Å; F351-F361 HydrophobicContact CE1-CD2 4.27Å; F351-F361 HydrophobicContact CE1-CE2 4.08Å; L355-F361 HydrophobicContact CB-CB 4.06Å; L355-F361 HydrophobicContact CB-CD1 3.79Å; L355-F361 HydrophobicContact CB-CE1 4.39Å; L355-F361 HydrophobicContact CB-CG 3.91Å; L355-F361 HydrophobicContact CD1-CB 4.03Å; L355-F361 HydrophobicContact CD1-CD2 4.32Å; L355-F361 HydrophobicContact CD1-CG 4.15Å; L355-F361 WeakPolarHBondContact O-CD1 3.29Å; D358-F361 HydrophobicContact CB-CB 4.05Å; D358-F361 PolarHBondContact OD1-N 3.19Å; F361-F364 PolarHBondContact O-N 3.15Å; F361-C365 PolarHBondContact O-N 2.93Å; F361-C365 PolarHBondContact O-SG 2.98Å; F361-A373 HydrophobicContact CE2-CB 4.19Å
362	E	91.1	Very high	90.1	Very high	35 Å²	35	50.1 Å²	50.1	16%	0.164	26%	0.255	C	S	.	.	H	α-helix	trans	-66.3	-39	-179.9	-71.8	-66.3	115.8	0	0	111.3	D358 F364 C365 D366 R370	D358-E362 PolarHBondContact O-N 2.98Å; E362-F364 PolarHBondContact O-N 2.64Å; E362-C365 PolarHBondContact O-N 3.1Å; E362-D366 PolarHBondContact O-N 3.11Å; E362-R370 VanDerWaalsContact CD-NH2 3.26Å; E362-R370 IonicContact OE1-CZ 2.73Å; E362-R370 VanDerWaalsContact OE1-CZ 3.29Å; E362-R370 IonicContact OE1-NH1 3.22Å; E362-R370 PolarHBondContact OE1-NH1 3.37Å; E362-R370 IonicContact OE1-NH2 2.69Å; E362-R370 PolarHBondContact OE1-NH2 3.34Å; E362-R370 IonicContact OE2-CZ 3.33Å; E362-R370 IonicContact OE2-NH1 3.53Å; E362-R370 IonicContact OE2-NH2 2.95Å; E362-R370 PolarHBondContact OE2-NH2 2.97Å
363	H	90.8	Very high	90.3	Very high	8 Å²	8	48.4 Å²	48.4	4%	0.037	24%	0.244	C	C	.	.	H	α-helix	trans	-64.4	-38.1	175.5	-176.6	53.1	0	0	0	112.9	S13 P359 M367	S13-H363 VanDerWaalsContact CB-NE2 3.31Å; S13-H363 WeakPolarHBondContact CB-NE2 3.36Å; S13-H363 PolarHBondContact OG-CE1 3.24Å; S13-H363 PolarHBondContact OG-NE2 3.38Å; P359-H363 WeakPolarHBondContact O-CB 3.33Å; P359-H363 PolarHBondContact O-N 2.7Å; P359-H363 VanDerWaalsContact O-N 3.13Å; H363-M367 WeakPolarHBondContact O-CB 3.37Å; H363-M367 WeakPolarHBondContact O-CG 3.39Å; H363-M367 PolarHBondContact O-N 2.68Å
364	F	93.8	Very high	90.6	Very high	3 Å²	3	42.7 Å²	42.7	1%	0.013	23%	0.225	C	C	.	.	H	α-helix	trans	-63.4	-43.4	171.8	177.4	-86.7	0	0	0	111.6	T330 Y333 D360 F361 E362 M367 C368 A372 A373 L376	T330-F364 HydrophobicContact CG2-CE2 4.12Å; T330-F364 WeakPolarHBondContact OG1-CE2 3.23Å; Y333-F364 AromaticContact CD1-CD1 3.94Å; Y333-F364 HydrophobicContact CD1-CD1 3.94Å; Y333-F364 HydrophobicContact CD1-CD2 4.21Å; Y333-F364 HydrophobicContact CD1-CE1 4.14Å; Y333-F364 HydrophobicContact CD1-CE2 4.36Å; Y333-F364 HydrophobicContact CD1-CG 4Å; Y333-F364 HydrophobicContact CD1-CZ 4.34Å; Y333-F364 HydrophobicContact CE1-CD1 4.44Å; Y333-F364 HydrophobicContact CE1-CE1 4.42Å; Y333-F364 HydrophobicContact CG-CB 4.18Å; Y333-F364 HydrophobicContact CG-CD1 4.13Å; Y333-F364 HydrophobicContact CG-CD2 4.33Å; Y333-F364 AromaticContact CG-CG 3.91Å; Y333-F364 HydrophobicContact CG-CG 3.91Å; D360-F364 WeakPolarHBondContact O-CB 3.38Å; D360-F364 PolarHBondContact O-N 3.22Å; F361-F364 PolarHBondContact O-N 3.15Å; E362-F364 PolarHBondContact O-N 2.64Å; F364-M367 PolarHBondContact O-N 3.42Å; F364-C368 HydrophobicContact CD1-CB 4.48Å; F364-C368 HydrophobicContact CE1-CB 3.88Å; F364-C368 HydrophobicContact CE2-CB 3.97Å; F364-C368 HydrophobicContact CZ-CB 3.6Å; F364-C368 PolarHBondContact O-N 2.95Å; F364-A372 HydrophobicContact CE1-CB 4.33Å; F364-A372 HydrophobicContact CZ-CB 4.32Å; F364-A373 HydrophobicContact CD1-CB 3.83Å; F364-A373 HydrophobicContact CE1-CB 3.66Å; F364-L376 HydrophobicContact CE1-CD1 4.19Å; F364-L376 HydrophobicContact CE2-CD1 3.89Å; F364-L376 HydrophobicContact CZ-CD1 3.44Å; F364-L376 VanDerWaalsContact CZ-CD1 3.44Å
365	C	92.9	Very high	90.9	Very high	1 Å²	1	45 Å²	45	1%	0.007	23%	0.226	C	C	.	.	H	α-helix	trans	-64.1	-40.8	177.8	-66.4	0	0	0	0	112.6	F361 E362 M367 G369 R370	F361-C365 PolarHBondContact O-N 2.93Å; F361-C365 PolarHBondContact O-SG 2.98Å; E362-C365 PolarHBondContact O-N 3.1Å; C365-M367 PolarHBondContact O-N 2.85Å; C365-G369 WeakPolarHBondContact O-CA 3.35Å; C365-G369 PolarHBondContact O-N 2.83Å; C365-R370 HydrophobicContact CB-CG 3.89Å
366	D	90.9	Very high	91.2	Very high	30 Å²	30	46.9 Å²	46.9	16%	0.16	24%	0.236	C	C	.	.	H	α-helix	trans	-57.4	-35.9	174.4	-79.9	-24.2	0	0	0	112.1	L97 E98 E362	L97-D366 HydrophobicContact CD2-CB 3.87Å; E98-D366 PolarHBondContact N-O 2.63Å; E98-D366 VanDerWaalsContact N-O 3.12Å; E362-D366 PolarHBondContact O-N 3.11Å
367	M	90.4	Very high	92	Very high	12 Å²	12	40.8 Å²	40.8	6%	0.059	21%	0.207	C	C	.	.	H	α-helix	trans	-91.3	-35.2	-172.3	-69.3	-72.7	-63.1	0	0	114.5	R322 I325 I326 H363 F364 C365	R322-M367 PolarHBondContact NH1-SD 3.28Å; R322-M367 PolarHBondContact NH2-O 3.42Å; I325-M367 HydrophobicContact CB-CE 4.31Å; I325-M367 HydrophobicContact CG2-CE 3.58Å; I326-M367 HydrophobicContact CG1-CE 3.65Å; H363-M367 WeakPolarHBondContact O-CB 3.37Å; H363-M367 WeakPolarHBondContact O-CG 3.39Å; H363-M367 PolarHBondContact O-N 2.68Å; F364-M367 PolarHBondContact O-N 3.42Å; C365-M367 PolarHBondContact O-N 2.85Å
368	C	92.9	Very high	92.6	Very high	28 Å²	28	38 Å²	38	19%	0.189	19%	0.189	C	C	.	.	H	α-helix	trans	-127.4	-10	-171.1	-56.2	0	0	0	0	114.3	F364 A372	F364-C368 HydrophobicContact CD1-CB 4.48Å; F364-C368 HydrophobicContact CE1-CB 3.88Å; F364-C368 HydrophobicContact CE2-CB 3.97Å; F364-C368 HydrophobicContact CZ-CB 3.6Å; F364-C368 PolarHBondContact O-N 2.95Å; C368-A372 HydrophobicContact CB-CB 4.05Å; C368-A372 WeakPolarHBondContact O-CB 3.36Å
369	G	91.8	Very high	92.8	Very high	2 Å²	2	42.1 Å²	42.1	2%	0.021	21%	0.208	C	C	.	.			trans	85	150.4	179.6	0	0	0	0	0	114.4	D99 C365 V371 A372 A373	D99-G369 WeakPolarHBondContact OD1-CA 3.35Å; C365-G369 WeakPolarHBondContact O-CA 3.35Å; C365-G369 PolarHBondContact O-N 2.83Å; G369-V371 PolarHBondContact O-N 3.31Å; G369-A372 WeakPolarHBondContact O-CB 3.48Å; G369-A372 PolarHBondContact O-N 3.13Å; G369-A372 VanDerWaalsContact O-N 3.09Å; G369-A373 PolarHBondContact O-N 2.99Å; G369-A373 VanDerWaalsContact O-N 3.12Å
370	R	93.2	Very high	92.9	Very high	93 Å²	93	40.4 Å²	40.4	35%	0.351	19%	0.194	S	C	.	.	H	α-helix	trans	-63.9	-26.1	178.3	-74.3	170.1	-157.2	-78.6	-0.6	112.8	D99 E362 C365 A373 Q374	D99-R370 PolarHBondContact OD1-N 3.4Å; D99-R370 WeakPolarHBondContact OD2-CD 3.49Å; D99-R370 WeakPolarHBondContact OD2-CG 3.31Å; D99-R370 PolarHBondContact OD2-N 2.88Å; D99-R370 IonicContact OD2-NE 2.75Å; D99-R370 PolarHBondContact OD2-NE 2.77Å; E362-R370 VanDerWaalsContact CD-NH2 3.26Å; E362-R370 IonicContact OE1-CZ 2.73Å; E362-R370 VanDerWaalsContact OE1-CZ 3.29Å; E362-R370 IonicContact OE1-NH1 3.22Å; E362-R370 PolarHBondContact OE1-NH1 3.37Å; E362-R370 IonicContact OE1-NH2 2.69Å; E362-R370 PolarHBondContact OE1-NH2 3.34Å; E362-R370 IonicContact OE2-CZ 3.33Å; E362-R370 IonicContact OE2-NH1 3.53Å; E362-R370 IonicContact OE2-NH2 2.95Å; E362-R370 PolarHBondContact OE2-NH2 2.97Å; C365-R370 HydrophobicContact CB-CG 3.89Å; R370-A373 PolarHBondContact O-N 3Å; R370-Q374 WeakPolarHBondContact O-CB 3.2Å; R370-Q374 PolarHBondContact O-N 3.25Å
371	V	92.4	Very high	93.1	Very high	79 Å²	79	39.9 Å²	39.9	48%	0.479	19%	0.191	S	C	.	.	H	α-helix	trans	-66.8	-39.1	173.3	-179.3	0	0	0	0	111.3	G369 R375	G369-V371 PolarHBondContact O-N 3.31Å; V371-R375 VanDerWaalsContact O-CG 3.28Å; V371-R375 WeakPolarHBondContact O-CG 3.41Å; V371-R375 PolarHBondContact O-N 3.37Å
372	A	93.5	Very high	93	Very high	27 Å²	27	45.4 Å²	45.4	22%	0.223	22%	0.219	C	C	.	.	H	α-helix	trans	-68.1	-40.1	173.3	0	0	0	0	0	111.2	F364 C368 G369 Q374 R375 L376	F364-A372 HydrophobicContact CE1-CB 4.33Å; F364-A372 HydrophobicContact CZ-CB 4.32Å; C368-A372 HydrophobicContact CB-CB 4.05Å; C368-A372 WeakPolarHBondContact O-CB 3.36Å; G369-A372 WeakPolarHBondContact O-CB 3.48Å; G369-A372 PolarHBondContact O-N 3.13Å; G369-A372 VanDerWaalsContact O-N 3.09Å; A372-Q374 PolarHBondContact O-N 3.32Å; A372-R375 PolarHBondContact O-N 2.91Å; A372-L376 PolarHBondContact O-N 3.12Å
373	A	93.9	Very high	93	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-61.5	-44.6	176.6	0	0	0	0	0	111.3	Y333 W348 F361 F364 G369 R370 R375 L376 F377	Y333-A373 HydrophobicContact CE1-CB 4.35Å; Y333-A373 PolarHBondContact OH-O 2.88Å; W348-A373 HydrophobicContact CH2-CB 3.67Å; W348-A373 HydrophobicContact CZ2-CB 4.46Å; F361-A373 HydrophobicContact CE2-CB 4.19Å; F364-A373 HydrophobicContact CD1-CB 3.83Å; F364-A373 HydrophobicContact CE1-CB 3.66Å; G369-A373 PolarHBondContact O-N 2.99Å; G369-A373 VanDerWaalsContact O-N 3.12Å; R370-A373 PolarHBondContact O-N 3Å; A373-R375 PolarHBondContact O-N 2.86Å; A373-L376 PolarHBondContact O-N 3.13Å; A373-F377 WeakPolarHBondContact O-CB 3.43Å; A373-F377 PolarHBondContact O-N 3.12Å
374	Q	95.8	Very high	93	Very high	66 Å²	66	50.7 Å²	50.7	31%	0.308	25%	0.245	S	C	.	.	H	α-helix	trans	-62.4	-40	175.6	-171.3	179.2	16.5	0	0	112.2	W348 R370 A372 F377 Q378	W348-Q374 HydrophobicContact CD2-CB 4.02Å; W348-Q374 HydrophobicContact CD2-CG 3.8Å; W348-Q374 HydrophobicContact CE3-CB 4.27Å; W348-Q374 HydrophobicContact CE3-CG 4.26Å; W348-Q374 HydrophobicContact CG-CG 3.98Å; W348-Q374 HydrophobicContact CH2-CB 4.05Å; W348-Q374 HydrophobicContact CZ2-CB 3.74Å; W348-Q374 HydrophobicContact CZ2-CG 4.41Å; W348-Q374 HydrophobicContact CZ3-CB 4.29Å; R370-Q374 WeakPolarHBondContact O-CB 3.2Å; R370-Q374 PolarHBondContact O-N 3.25Å; A372-Q374 PolarHBondContact O-N 3.32Å; Q374-F377 PolarHBondContact O-N 3.26Å; Q374-Q378 WeakPolarHBondContact O-CB 3.4Å; Q374-Q378 VanDerWaalsContact O-CG 3.27Å; Q374-Q378 WeakPolarHBondContact O-CG 3.43Å; Q374-Q378 PolarHBondContact O-N 2.75Å
375	R	95.7	Very high	92.7	Very high	156 Å²	156	57.9 Å²	57.9	59%	0.589	27%	0.272	S	S	*	.	H	α-helix	trans	-63.8	-46.2	175.7	-74.3	170.3	-176.1	169.4	2.9	111.8	V371 A372 A373 Q378 Q379	V371-R375 VanDerWaalsContact O-CG 3.28Å; V371-R375 WeakPolarHBondContact O-CG 3.41Å; V371-R375 PolarHBondContact O-N 3.37Å; A372-R375 PolarHBondContact O-N 2.91Å; A373-R375 PolarHBondContact O-N 2.86Å; R375-Q378 PolarHBondContact O-N 3.35Å; R375-Q379 WeakPolarHBondContact O-CB 3.49Å; R375-Q379 VanDerWaalsContact O-CG 3.29Å; R375-Q379 WeakPolarHBondContact O-CG 3.46Å; R375-Q379 PolarHBondContact O-N 3.37Å
376	L	93.9	Very high	92.4	Very high	40 Å²	40	61.2 Å²	61.2	21%	0.209	30%	0.295	C	S	.	.	H	α-helix	trans	-62.7	-41.6	175.7	-73.5	178.7	0	0	0	111.8	T330 Y333 F364 A372 A373 Q379 Y380	T330-L376 HydrophobicContact CG2-CD1 4.19Å; Y333-L376 HydrophobicContact CD1-CD1 3.97Å; Y333-L376 HydrophobicContact CE1-CB 3.93Å; Y333-L376 HydrophobicContact CE1-CD1 4.02Å; F364-L376 HydrophobicContact CE1-CD1 4.19Å; F364-L376 HydrophobicContact CE2-CD1 3.89Å; F364-L376 HydrophobicContact CZ-CD1 3.44Å; F364-L376 VanDerWaalsContact CZ-CD1 3.44Å; A372-L376 PolarHBondContact O-N 3.12Å; A373-L376 PolarHBondContact O-N 3.13Å; L376-Q379 PolarHBondContact O-N 3.45Å; L376-Y380 WeakPolarHBondContact O-CB 3.4Å; L376-Y380 PolarHBondContact O-N 3.46Å
377	F	95	Very high	92.3	Very high	4 Å²	4	63.2 Å²	63.2	2%	0.018	31%	0.311	C	S	.	.	H	α-helix	trans	-58.4	-48.4	172.4	171.6	-90.2	0	0	0	111.8	L337 V341 W346 T347 W348 F351 A373 Q374 Y380 L381	L337-F377 HydrophobicContact CD1-CD2 3.64Å; L337-F377 HydrophobicContact CD1-CE2 4.39Å; V341-F377 HydrophobicContact CG2-CE2 4.04Å; W346-F377 HydrophobicContact CB-CE2 4.39Å; W346-F377 HydrophobicContact CB-CZ 4.11Å; T347-F377 VanDerWaalsContact C-CZ 3.47Å; W348-F377 HydrophobicContact CB-CD1 4.37Å; W348-F377 HydrophobicContact CB-CE1 4.08Å; W348-F377 HydrophobicContact CE3-CB 3.8Å; W348-F377 AromaticContact CE3-CD1 3.74Å; W348-F377 HydrophobicContact CE3-CD1 3.74Å; W348-F377 HydrophobicContact CE3-CD2 4.1Å; W348-F377 HydrophobicContact CE3-CE1 4.34Å; W348-F377 AromaticContact CE3-CG 3.62Å; W348-F377 HydrophobicContact CE3-CG 3.62Å; W348-F377 HydrophobicContact CZ3-CB 3.7Å; W348-F377 HydrophobicContact CZ3-CD2 4.39Å; W348-F377 AromaticContact CZ3-CG 3.97Å; W348-F377 HydrophobicContact CZ3-CG 3.97Å; F351-F377 HydrophobicContact CB-CD2 4.12Å; F351-F377 HydrophobicContact CB-CE2 3.58Å; F351-F377 HydrophobicContact CB-CZ 4.18Å; F351-F377 AromaticContact CD1-CD2 3.86Å; F351-F377 HydrophobicContact CD1-CD2 3.86Å; F351-F377 HydrophobicContact CD1-CE2 4.2Å; F351-F377 HydrophobicContact CD2-CD2 4.07Å; F351-F377 AromaticContact CD2-CE2 3.92Å; F351-F377 HydrophobicContact CD2-CE2 3.92Å; F351-F377 HydrophobicContact CE1-CD2 4.26Å; F351-F377 HydrophobicContact CE2-CD2 4.44Å; F351-F377 AromaticContact CG-CD2 3.74Å; F351-F377 HydrophobicContact CG-CD2 3.74Å; F351-F377 AromaticContact CG-CE2 3.64Å; F351-F377 HydrophobicContact CG-CE2 3.64Å; A373-F377 WeakPolarHBondContact O-CB 3.43Å; A373-F377 PolarHBondContact O-N 3.12Å; Q374-F377 PolarHBondContact O-N 3.26Å; F377-Y380 PolarHBondContact O-N 2.95Å; F377-L381 HydrophobicContact CD1-CD1 4.06Å; F377-L381 HydrophobicContact CD1-CG 4.45Å; F377-L381 HydrophobicContact CE1-CD1 3.37Å; F377-L381 HydrophobicContact CE1-CG 4.09Å; F377-L381 HydrophobicContact CZ-CD1 3.66Å; F377-L381 HydrophobicContact CZ-CD2 4.37Å; F377-L381 HydrophobicContact CZ-CG 4.17Å; F377-L381 WeakPolarHBondContact O-CG 3.27Å; F377-L381 PolarHBondContact O-N 3.24Å
378	Q	94.5	Very high	91.9	Very high	93 Å²	93	66.2 Å²	66.2	44%	0.435	32%	0.324	S	S	.	.	H	α-helix	trans	-64.5	-42.2	178.1	-75.4	171.6	-19.2	0	0	112.5	Q374 R375 Y380 L381 I382	Q374-Q378 WeakPolarHBondContact O-CB 3.4Å; Q374-Q378 VanDerWaalsContact O-CG 3.27Å; Q374-Q378 WeakPolarHBondContact O-CG 3.43Å; Q374-Q378 PolarHBondContact O-N 2.75Å; R375-Q378 PolarHBondContact O-N 3.35Å; Q378-Y380 VanDerWaalsContact C-N 3.34Å; Q378-L381 PolarHBondContact O-N 3.17Å; Q378-I382 VanDerWaalsContact O-CG1 3.31Å; Q378-I382 WeakPolarHBondContact O-CG1 3.39Å; Q378-I382 PolarHBondContact O-N 2.88Å
379	Q	93.3	Very high	91.4	Very high	107 Å²	107	69.9 Å²	69.9	50%	0.5	34%	0.34	S	S	.	.	H	α-helix	trans	-58.9	-46.4	173.7	-75.9	171.1	-17.8	0	0	110.8	R375 L376 L381 I382 E383	R375-Q379 WeakPolarHBondContact O-CB 3.49Å; R375-Q379 VanDerWaalsContact O-CG 3.29Å; R375-Q379 WeakPolarHBondContact O-CG 3.46Å; R375-Q379 PolarHBondContact O-N 3.37Å; L376-Q379 PolarHBondContact O-N 3.45Å; Q379-L381 PolarHBondContact O-N 2.85Å; Q379-I382 WeakPolarHBondContact O-CB 3.35Å; Q379-I382 PolarHBondContact O-N 3.24Å; Q379-I382 VanDerWaalsContact O-N 3.13Å; Q379-E383 WeakPolarHBondContact O-CG 3.47Å; Q379-E383 PolarHBondContact O-N 2.82Å
380	Y	94.3	Very high	91.1	Very high	26 Å²	26	74.9 Å²	74.9	10%	0.102	36%	0.363	C	S	.	.	H	α-helix	trans	-63.9	-35.9	176.7	-177.7	-117.2	0	0	0	113.4	L337 K338 V341 L376 F377 Q378 E383 L384	L337-Y380 HydrophobicContact CD1-CD1 3.9Å; L337-Y380 HydrophobicContact CD1-CE1 4.48Å; L337-Y380 HydrophobicContact CD2-CD1 3.84Å; L337-Y380 HydrophobicContact CD2-CG 3.9Å; L337-Y380 HydrophobicContact CG-CD1 3.54Å; L337-Y380 HydrophobicContact CG-CE1 4.07Å; L337-Y380 HydrophobicContact CG-CG 4.09Å; K338-Y380 HydrophobicContact CD-CE2 4.47Å; K338-Y380 HydrophobicContact CG-CD2 4.39Å; K338-Y380 HydrophobicContact CG-CE1 4.41Å; K338-Y380 HydrophobicContact CG-CE2 3.66Å; V341-Y380 HydrophobicContact CB-CD1 4.42Å; V341-Y380 HydrophobicContact CB-CE1 3.98Å; V341-Y380 HydrophobicContact CG1-CD1 4.28Å; V341-Y380 HydrophobicContact CG1-CE1 4.02Å; V341-Y380 WeakPolarHBondContact O-CE1 3.4Å; V341-Y380 PolarHBondContact O-OH 3.48Å; L376-Y380 WeakPolarHBondContact O-CB 3.4Å; L376-Y380 PolarHBondContact O-N 3.46Å; F377-Y380 PolarHBondContact O-N 2.95Å; Q378-Y380 VanDerWaalsContact C-N 3.34Å; Y380-E383 PolarHBondContact O-N 3.16Å; Y380-L384 HydrophobicContact CD1-CD1 3.98Å; Y380-L384 HydrophobicContact CD1-CG 4.43Å; Y380-L384 HydrophobicContact CD2-CG 4.46Å; Y380-L384 HydrophobicContact CE1-CD1 3.45Å; Y380-L384 VanDerWaalsContact CE1-CD1 3.45Å; Y380-L384 HydrophobicContact CE1-CG 3.99Å; Y380-L384 HydrophobicContact CE2-CD1 4.37Å; Y380-L384 HydrophobicContact CE2-CD2 4.27Å; Y380-L384 HydrophobicContact CE2-CG 3.98Å; Y380-L384 WeakPolarHBondContact O-CB 3.47Å; Y380-L384 WeakPolarHBondContact O-CG 3.45Å; Y380-L384 PolarHBondContact O-N 3.44Å
381	L	93.5	Very high	90.7	Very high	27 Å²	27	75.8 Å²	75.8	14%	0.141	37%	0.371	C	S	.	.	H	α-helix	trans	-66.1	-37.5	171.9	-67.6	-176.6	0	0	0	112.6	V341 W346 F377 Q378 Q379 R385	V341-L381 HydrophobicContact CG1-CD2 3.71Å; W346-L381 HydrophobicContact CB-CD2 4.13Å; W346-L381 VanDerWaalsContact O-CD1 3.26Å; W346-L381 WeakPolarHBondContact O-CD1 3.49Å; F377-L381 HydrophobicContact CD1-CD1 4.06Å; F377-L381 HydrophobicContact CD1-CG 4.45Å; F377-L381 HydrophobicContact CE1-CD1 3.37Å; F377-L381 HydrophobicContact CE1-CG 4.09Å; F377-L381 HydrophobicContact CZ-CD1 3.66Å; F377-L381 HydrophobicContact CZ-CD2 4.37Å; F377-L381 HydrophobicContact CZ-CG 4.17Å; F377-L381 WeakPolarHBondContact O-CG 3.27Å; F377-L381 PolarHBondContact O-N 3.24Å; Q378-L381 PolarHBondContact O-N 3.17Å; Q379-L381 PolarHBondContact O-N 2.85Å; L381-R385 WeakPolarHBondContact O-CB 3.47Å; L381-R385 PolarHBondContact O-N 3Å
382	I	89.9	Confident	90.3	Very high	117 Å²	117	76.1 Å²	76.1	60%	0.6	36%	0.364	S	S	*	.	H	α-helix	trans	-66.2	-43	174.9	-67.5	163.3	0	0	0	110	Q378 Q379 R385 S386	Q378-I382 VanDerWaalsContact O-CG1 3.31Å; Q378-I382 WeakPolarHBondContact O-CG1 3.39Å; Q378-I382 PolarHBondContact O-N 2.88Å; Q379-I382 WeakPolarHBondContact O-CB 3.35Å; Q379-I382 PolarHBondContact O-N 3.24Å; Q379-I382 VanDerWaalsContact O-N 3.13Å; I382-R385 PolarHBondContact O-N 3.08Å; I382-S386 VanDerWaalsContact O-CB 3.25Å; I382-S386 WeakPolarHBondContact O-CB 3.41Å; I382-S386 PolarHBondContact O-N 3.16Å
383	E	90.7	Very high	89.8	Confident	118 Å²	118	79.8 Å²	79.8	55%	0.551	37%	0.372	S	S	*	.	H	α-helix	trans	-60.7	-48	173.3	-73.3	174.7	-170.8	0	0	111.7	Q379 Y380 R385 S386 C387	Q379-E383 WeakPolarHBondContact O-CG 3.47Å; Q379-E383 PolarHBondContact O-N 2.82Å; Y380-E383 PolarHBondContact O-N 3.16Å; E383-R385 PolarHBondContact O-N 3.3Å; E383-S386 PolarHBondContact O-N 3.14Å; E383-C387 VanDerWaalsContact O-CB 3.25Å; E383-C387 WeakPolarHBondContact O-CB 3.44Å; E383-C387 PolarHBondContact O-N 3.07Å
384	L	89.9	Confident	89.5	Confident	35 Å²	35	85.2 Å²	85.2	18%	0.183	40%	0.397	C	S	.	.	H	α-helix	trans	-60	-44.5	175.9	-81.3	177.9	0	0	0	112.1	V341 F344 Y380 C387 H388	V341-L384 HydrophobicContact CG1-CD1 3.93Å; F344-L384 HydrophobicContact CB-CB 4.12Å; Y380-L384 HydrophobicContact CD1-CD1 3.98Å; Y380-L384 HydrophobicContact CD1-CG 4.43Å; Y380-L384 HydrophobicContact CD2-CG 4.46Å; Y380-L384 HydrophobicContact CE1-CD1 3.45Å; Y380-L384 VanDerWaalsContact CE1-CD1 3.45Å; Y380-L384 HydrophobicContact CE1-CG 3.99Å; Y380-L384 HydrophobicContact CE2-CD1 4.37Å; Y380-L384 HydrophobicContact CE2-CD2 4.27Å; Y380-L384 HydrophobicContact CE2-CG 3.98Å; Y380-L384 WeakPolarHBondContact O-CB 3.47Å; Y380-L384 WeakPolarHBondContact O-CG 3.45Å; Y380-L384 PolarHBondContact O-N 3.44Å; L384-C387 PolarHBondContact O-N 2.83Å; L384-H388 WeakPolarHBondContact O-CB 3.37Å; L384-H388 PolarHBondContact O-N 2.83Å
385	R	89.4	Confident	89	Confident	155 Å²	155	87.3 Å²	87.3	59%	0.585	41%	0.41	S	S	*	.	H	α-helix	trans	-65	-43.1	177	-171.9	179.7	-179.8	-172.6	1	110.9	F344 L381 I382 E383 H388 M389	F344-R385 HydrophobicContact CB-CB 3.88Å; F344-R385 HydrophobicContact CD1-CB 4.42Å; F344-R385 HydrophobicContact CD2-CB 4.39Å; F344-R385 HydrophobicContact CD2-CG 4.25Å; F344-R385 HydrophobicContact CG-CB 3.97Å; F344-R385 HydrophobicContact CG-CG 4.23Å; L381-R385 WeakPolarHBondContact O-CB 3.47Å; L381-R385 PolarHBondContact O-N 3Å; I382-R385 PolarHBondContact O-N 3.08Å; E383-R385 PolarHBondContact O-N 3.3Å; R385-H388 PolarHBondContact O-N 3.42Å; R385-M389 HydrophobicContact CG-CG 4.38Å; R385-M389 WeakPolarHBondContact O-CB 3.44Å; R385-M389 WeakPolarHBondContact O-CG 3.28Å; R385-M389 PolarHBondContact O-N 2.82Å
386	S	86.5	Confident	88.7	Confident	70 Å²	70	81 Å²	81	49%	0.49	39%	0.387	S	S	.	.	H	α-helix	trans	-63.3	-44.7	177.2	-174.4	0	0	0	0	111.3	I382 E383 M389 Q390	I382-S386 VanDerWaalsContact O-CB 3.25Å; I382-S386 WeakPolarHBondContact O-CB 3.41Å; I382-S386 PolarHBondContact O-N 3.16Å; E383-S386 PolarHBondContact O-N 3.14Å; S386-M389 PolarHBondContact O-N 2.83Å; S386-Q390 WeakPolarHBondContact O-CB 3.44Å; S386-Q390 PolarHBondContact O-N 2.8Å
387	C	86.9	Confident	88.4	Confident	73 Å²	73	80.7 Å²	80.7	49%	0.493	39%	0.385	S	S	.	.	H	α-helix	trans	-62.2	-45	176	-171.7	0	0	0	0	111.8	E383 L384 Q390 Q391	E383-C387 VanDerWaalsContact O-CB 3.25Å; E383-C387 WeakPolarHBondContact O-CB 3.44Å; E383-C387 PolarHBondContact O-N 3.07Å; L384-C387 PolarHBondContact O-N 2.83Å; C387-Q390 PolarHBondContact O-N 3.44Å; C387-Q391 VanDerWaalsContact O-CB 3.31Å; C387-Q391 WeakPolarHBondContact O-CB 3.49Å; C387-Q391 PolarHBondContact O-N 3.45Å
388	H	83.8	Confident	88.1	Confident	74 Å²	74	83.8 Å²	83.8	34%	0.343	41%	0.412	S	S	.	.	H	α-helix	trans	-64	-46.7	177.2	179.4	82.4	0	0	0	111.9	F344 L384 R385 Q390 Q391 R392	F344-H388 HydrophobicContact CD1-CB 4.22Å; F344-H388 HydrophobicContact CE1-CB 4.19Å; F344-H388 AromaticContact CE1-CD2 3.63Å; F344-H388 AromaticContact CE1-CG 3.83Å; L384-H388 WeakPolarHBondContact O-CB 3.37Å; L384-H388 PolarHBondContact O-N 2.83Å; R385-H388 PolarHBondContact O-N 3.42Å; H388-Q390 VanDerWaalsContact C-N 3.32Å; H388-Q390 PolarHBondContact O-N 2.89Å; H388-Q391 PolarHBondContact O-N 2.82Å; H388-R392 WeakPolarHBondContact O-CB 3.49Å; H388-R392 PolarHBondContact O-N 3.47Å
389	M	81.3	Confident	87.9	Confident	106 Å²	106	83.2 Å²	83.2	52%	0.522	41%	0.408	S	S	.	.	H	α-helix	trans	-64	-36	176	-68	-65.8	-67.7	0	0	112	R385 S386 R393	R385-M389 HydrophobicContact CG-CG 4.38Å; R385-M389 WeakPolarHBondContact O-CB 3.44Å; R385-M389 WeakPolarHBondContact O-CG 3.28Å; R385-M389 PolarHBondContact O-N 2.82Å; S386-M389 PolarHBondContact O-N 2.83Å; M389-R393 VanDerWaalsContact O-CB 3.28Å; M389-R393 WeakPolarHBondContact O-CB 3.37Å; M389-R393 PolarHBondContact O-N 2.8Å
390	Q	85.9	Confident	87.8	Confident	107 Å²	107	78.2 Å²	78.2	50%	0.5	38%	0.384	S	S	.	.	H	α-helix	trans	-70.2	-41.4	175.6	-175.3	176.8	9.8	0	0	111.8	S386 C387 H388 R393 Q394	S386-Q390 WeakPolarHBondContact O-CB 3.44Å; S386-Q390 PolarHBondContact O-N 2.8Å; C387-Q390 PolarHBondContact O-N 3.44Å; H388-Q390 VanDerWaalsContact C-N 3.32Å; H388-Q390 PolarHBondContact O-N 2.89Å; Q390-R393 PolarHBondContact O-N 3.29Å; Q390-Q394 WeakPolarHBondContact O-CB 3.38Å; Q390-Q394 VanDerWaalsContact O-CG 3.29Å; Q390-Q394 WeakPolarHBondContact O-CG 3.28Å; Q390-Q394 PolarHBondContact O-N 3.41Å
391	Q	84.4	Confident	87.6	Confident	111 Å²	111	79.4 Å²	79.4	52%	0.519	40%	0.396	S	S	.	.	H	α-helix	trans	-64.1	-45.3	175.5	-174.9	178.5	7.7	0	0	110.9	C387 H388 Q394 L395	C387-Q391 VanDerWaalsContact O-CB 3.31Å; C387-Q391 WeakPolarHBondContact O-CB 3.49Å; C387-Q391 PolarHBondContact O-N 3.45Å; H388-Q391 PolarHBondContact O-N 2.82Å; Q391-Q394 PolarHBondContact O-N 3.15Å; Q391-L395 HydrophobicContact CG-CD1 4.46Å; Q391-L395 WeakPolarHBondContact O-CG 3.41Å; Q391-L395 PolarHBondContact O-N 3.02Å
392	R	84.3	Confident	87.4	Confident	87 Å²	87	83.2 Å²	83.2	33%	0.328	42%	0.416	S	S	.	.	H	α-helix	trans	-58.8	-47.8	172.7	-178.9	177.6	176.6	152.5	5.8	111.6	H388 Q394 L395 E396 Y437	H388-R392 WeakPolarHBondContact O-CB 3.49Å; H388-R392 PolarHBondContact O-N 3.47Å; R392-Q394 VanDerWaalsContact C-N 3.3Å; R392-Q394 PolarHBondContact O-N 3.24Å; R392-L395 PolarHBondContact O-N 3.05Å; R392-E396 WeakPolarHBondContact CG-OE1 3.25Å; R392-E396 IonicContact CZ-OE1 3.73Å; R392-E396 IonicContact NE-OE1 3.62Å; R392-E396 PolarHBondContact NE-OE1 3.27Å; R392-E396 IonicContact NH2-OE1 3.24Å; R392-E396 WeakPolarHBondContact O-CG 3.19Å; R392-E396 PolarHBondContact O-N 3.01Å; R392-Y437 PolarHBondContact NH2-OH 2.84Å
393	R	83.9	Confident	87.4	Confident	104 Å²	104	78 Å²	78	39%	0.392	39%	0.39	S	S	.	.	H	α-helix	trans	-58	-41	174.2	-173.2	-169.9	-66.8	-166.4	-3.8	111.8	M389 Q390 E396 L397 I460 E465	M389-R393 VanDerWaalsContact O-CB 3.28Å; M389-R393 WeakPolarHBondContact O-CB 3.37Å; M389-R393 PolarHBondContact O-N 2.8Å; Q390-R393 PolarHBondContact O-N 3.29Å; R393-E396 PolarHBondContact O-N 3.47Å; R393-L397 HydrophobicContact CG-CD1 3.87Å; R393-L397 HydrophobicContact CG-CG 4.22Å; R393-L397 VanDerWaalsContact O-CB 3.26Å; R393-L397 WeakPolarHBondContact O-CB 3.29Å; R393-L397 VanDerWaalsContact O-CG 3.26Å; R393-L397 WeakPolarHBondContact O-CG 3.25Å; R393-L397 PolarHBondContact O-N 2.9Å; R393-I460 HydrophobicContact CB-CD1 4.45Å; R393-I460 HydrophobicContact CG-CD1 3.63Å; R393-E465 IonicContact CZ-OE1 3.77Å; R393-E465 IonicContact NH1-OE1 3.14Å; R393-E465 PolarHBondContact NH1-OE1 2.72Å; R393-E465 IonicContact NH1-OE2 2.68Å
394	Q	86.5	Confident	87.5	Confident	114 Å²	114	72.3 Å²	72.3	53%	0.533	36%	0.364	S	S	.	.	H	α-helix	trans	-65.7	-39.5	177.4	-77.6	172.8	-1.1	0	0	112.2	Q390 Q391 R392 A398	Q390-Q394 WeakPolarHBondContact O-CB 3.38Å; Q390-Q394 VanDerWaalsContact O-CG 3.29Å; Q390-Q394 WeakPolarHBondContact O-CG 3.28Å; Q390-Q394 PolarHBondContact O-N 3.41Å; Q391-Q394 PolarHBondContact O-N 3.15Å; R392-Q394 VanDerWaalsContact C-N 3.3Å; R392-Q394 PolarHBondContact O-N 3.24Å; Q394-A398 VanDerWaalsContact O-CB 3.25Å; Q394-A398 WeakPolarHBondContact O-CB 3.34Å; Q394-A398 PolarHBondContact O-N 2.86Å
395	L	86.1	Confident	87.4	Confident	110 Å²	110	74 Å²	74	58%	0.576	37%	0.371	S	S	*	.	H	α-helix	trans	-66.7	-42.6	174.5	-67.8	168.7	0	0	0	111.8	Q391 R392 A398 K399	Q391-L395 HydrophobicContact CG-CD1 4.46Å; Q391-L395 WeakPolarHBondContact O-CG 3.41Å; Q391-L395 PolarHBondContact O-N 3.02Å; R392-L395 PolarHBondContact O-N 3.05Å; L395-A398 PolarHBondContact O-N 2.77Å; L395-K399 PolarHBondContact O-N 2.55Å
396	E	87.9	Confident	87.4	Confident	23 Å²	23	73.5 Å²	73.5	11%	0.107	37%	0.373	C	S	.	.	H	α-helix	trans	-65.7	-43.6	175.2	-70.7	176.3	-161.1	0	0	111.5	R392 R393 A398 K399 L400 L456 S457 I460	R392-E396 WeakPolarHBondContact CG-OE1 3.25Å; R392-E396 IonicContact CZ-OE1 3.73Å; R392-E396 IonicContact NE-OE1 3.62Å; R392-E396 PolarHBondContact NE-OE1 3.27Å; R392-E396 IonicContact NH2-OE1 3.24Å; R392-E396 WeakPolarHBondContact O-CG 3.19Å; R392-E396 PolarHBondContact O-N 3.01Å; R393-E396 PolarHBondContact O-N 3.47Å; E396-A398 VanDerWaalsContact C-N 3.33Å; E396-A398 PolarHBondContact O-N 2.85Å; E396-K399 PolarHBondContact O-N 3.36Å; E396-L400 PolarHBondContact O-N 2.84Å; E396-L400 VanDerWaalsContact O-N 3.09Å; E396-L456 HydrophobicContact CB-CD2 3.89Å; E396-L456 HydrophobicContact CG-CD2 4.17Å; E396-L456 WeakPolarHBondContact O-CD2 3.18Å; E396-S457 WeakPolarHBondContact OE2-CB 3.31Å; E396-I460 HydrophobicContact CB-CD1 3.88Å; E396-I460 HydrophobicContact CB-CG1 4Å
397	L	89.1	Confident	87.5	Confident	33 Å²	33	71.2 Å²	71.2	17%	0.173	36%	0.355	C	S	.	.	H	α-helix	trans	-66.3	-29.8	174	-75	172.1	0	0	0	113.2	R393 L400 P401 I460 E465 A466	R393-L397 HydrophobicContact CG-CD1 3.87Å; R393-L397 HydrophobicContact CG-CG 4.22Å; R393-L397 VanDerWaalsContact O-CB 3.26Å; R393-L397 WeakPolarHBondContact O-CB 3.29Å; R393-L397 VanDerWaalsContact O-CG 3.26Å; R393-L397 WeakPolarHBondContact O-CG 3.25Å; R393-L397 PolarHBondContact O-N 2.9Å; L397-L400 HydrophobicContact CD2-CD2 3.96Å; L397-L400 WeakPolarHBondContact O-CB 3.31Å; L397-L400 PolarHBondContact O-N 3.23Å; L397-P401 VanDerWaalsContact O-CD 3.23Å; L397-P401 WeakPolarHBondContact O-CD 3.32Å; L397-I460 HydrophobicContact CD2-CD1 4.28Å; L397-I460 HydrophobicContact CD2-CG1 4.14Å; L397-I460 HydrophobicContact CG-CD1 4.07Å; L397-I460 HydrophobicContact CG-CG1 4.35Å; L397-E465 HydrophobicContact CD1-CB 3.62Å; L397-E465 HydrophobicContact CD1-CG 4.24Å; L397-E465 HydrophobicContact CD2-CB 4.06Å; L397-A466 HydrophobicContact CD2-CB 4.28Å
398	A	88.4	Confident	87.6	Confident	69 Å²	69	68.2 Å²	68.2	57%	0.57	34%	0.335	S	S	*	.	H	α-helix	trans	-70.7	-32.2	175.6	0	0	0	0	0	112.3	Q394 L395 E396	Q394-A398 VanDerWaalsContact O-CB 3.25Å; Q394-A398 WeakPolarHBondContact O-CB 3.34Å; Q394-A398 PolarHBondContact O-N 2.86Å; L395-A398 PolarHBondContact O-N 2.77Å; E396-A398 VanDerWaalsContact C-N 3.33Å; E396-A398 PolarHBondContact O-N 2.85Å
399	K	89.6	Confident	87.6	Confident	82 Å²	82	68.8 Å²	68.8	36%	0.357	35%	0.345	S	S	.	.	H	α-helix	trans	-80.6	-15.7	172.2	-70.3	-174.1	-176.4	-169.9	0	113.3	L395 E396 D402 A403 D454 L456	L395-K399 PolarHBondContact O-N 2.55Å; E396-K399 PolarHBondContact O-N 3.36Å; K399-D402 PolarHBondContact O-N 3.33Å; K399-A403 PolarHBondContact O-N 3.5Å; K399-D454 IonicContact NZ-OD1 2.72Å; K399-D454 PolarHBondContact NZ-OD1 3.07Å; K399-L456 HydrophobicContact CB-CD2 3.9Å
400	L	91.6	Very high	87.7	Confident	1 Å²	1	67 Å²	67	1%	0.005	34%	0.337	C	S	.	.	H	α-helix	trans	-65	-38.7	-175.1	-175.3	63.8	0	0	0	114.8	E396 L397 D402 A403 L404 F436 L456 L461 A466 C469	E396-L400 PolarHBondContact O-N 2.84Å; E396-L400 VanDerWaalsContact O-N 3.09Å; L397-L400 HydrophobicContact CD2-CD2 3.96Å; L397-L400 WeakPolarHBondContact O-CB 3.31Å; L397-L400 PolarHBondContact O-N 3.23Å; L400-D402 VanDerWaalsContact C-N 3.31Å; L400-D402 PolarHBondContact O-N 2.98Å; L400-A403 HydrophobicContact CD1-CB 4.45Å; L400-A403 WeakPolarHBondContact O-CB 3.34Å; L400-A403 PolarHBondContact O-N 2.88Å; L400-L404 HydrophobicContact CD1-CG 4.22Å; L400-L404 HydrophobicContact CG-CD1 4.11Å; L400-L404 HydrophobicContact CG-CG 4.22Å; L400-L404 WeakPolarHBondContact O-CB 3.39Å; L400-L404 WeakPolarHBondContact O-CG 3.3Å; L400-L404 PolarHBondContact O-N 3.24Å; L400-F436 HydrophobicContact CD1-CZ 4.1Å; L400-L456 HydrophobicContact CD1-CD1 4.15Å; L400-L461 HydrophobicContact CD1-CD2 4.03Å; L400-A466 HydrophobicContact CD2-CB 3.55Å; L400-C469 HydrophobicContact CD2-CB 4.02Å
401	P	90.2	Very high	87.6	Confident	52 Å²	52	62.5 Å²	62.5	34%	0.338	32%	0.318	S	S	.	.	H	α-helix	trans	-57.4	-40.6	174.1	-26.8	34.6	0	0	0	113.5	L397 L404 M405	L397-P401 VanDerWaalsContact O-CD 3.23Å; L397-P401 WeakPolarHBondContact O-CD 3.32Å; P401-L404 PolarHBondContact O-N 3.33Å; P401-M405 WeakPolarHBondContact O-CB 3.45Å; P401-M405 WeakPolarHBondContact O-CG 3.32Å; P401-M405 PolarHBondContact O-N 3.36Å
402	D	89.1	Confident	87.6	Confident	107 Å²	107	61 Å²	61	57%	0.572	32%	0.319	S	S	*	.	H	α-helix	trans	-69.9	-36.4	178.5	-61.4	-34.6	0	0	0	111.5	K399 L400 K406	K399-D402 PolarHBondContact O-N 3.33Å; L400-D402 VanDerWaalsContact C-N 3.31Å; L400-D402 PolarHBondContact O-N 2.98Å; D402-K406 WeakPolarHBondContact O-CG 3.26Å; D402-K406 PolarHBondContact O-N 2.86Å
403	A	90.7	Very high	87.4	Confident	6 Å²	6	60.3 Å²	60.3	5%	0.05	33%	0.325	C	S	.	.	H	α-helix	trans	-63.3	-44	170.5	0	0	0	0	0	112.1	K399 L400 K406 L407 I435 L456	K399-A403 PolarHBondContact O-N 3.5Å; L400-A403 HydrophobicContact CD1-CB 4.45Å; L400-A403 WeakPolarHBondContact O-CB 3.34Å; L400-A403 PolarHBondContact O-N 2.88Å; A403-K406 PolarHBondContact O-N 3.31Å; A403-L407 WeakPolarHBondContact O-CB 3.05Å; A403-L407 WeakPolarHBondContact O-CG 3.15Å; A403-L407 PolarHBondContact O-N 2.72Å; A403-I435 HydrophobicContact CB-CG2 3.58Å; A403-L456 HydrophobicContact CB-CD1 3.73Å
404	L	91.5	Very high	87.3	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-65.5	-39	176.7	-72.1	173.9	0	0	0	111.8	L400 P401 K406 L407 I408 M426 F470 H473	L400-L404 HydrophobicContact CD1-CG 4.22Å; L400-L404 HydrophobicContact CG-CD1 4.11Å; L400-L404 HydrophobicContact CG-CG 4.22Å; L400-L404 WeakPolarHBondContact O-CB 3.39Å; L400-L404 WeakPolarHBondContact O-CG 3.3Å; L400-L404 PolarHBondContact O-N 3.24Å; P401-L404 PolarHBondContact O-N 3.33Å; L404-K406 VanDerWaalsContact C-N 3.28Å; L404-K406 PolarHBondContact O-N 3.39Å; L404-L407 PolarHBondContact O-N 2.93Å; L404-I408 HydrophobicContact CD2-CD1 4.36Å; L404-I408 CarbonylContact O-C 3.58Å; L404-I408 VanDerWaalsContact O-C 3.29Å; L404-I408 WeakPolarHBondContact O-CA 3.39Å; L404-I408 PolarHBondContact O-N 3.01Å; L404-I408 VanDerWaalsContact O-O 3.05Å; L404-M426 HydrophobicContact CD2-CE 4.47Å; L404-M426 HydrophobicContact CD2-SD 3.61Å; L404-F470 HydrophobicContact CD1-CB 4.37Å; L404-F470 HydrophobicContact CD2-CD2 4.41Å; L404-H473 HydrophobicContact CD1-CB 4.02Å; L404-H473 PolarHBondContact O-NE2 2.76Å
405	M	88.5	Confident	87	Confident	70 Å²	70	54.5 Å²	54.5	35%	0.345	31%	0.312	S	S	.	.	H	α-helix	trans	-60.6	-34.3	172.6	-82	-64.6	-42.7	0	0	113	P401 Y476	P401-M405 WeakPolarHBondContact O-CB 3.45Å; P401-M405 WeakPolarHBondContact O-CG 3.32Å; P401-M405 PolarHBondContact O-N 3.36Å; M405-Y476 HydrophobicContact SD-CE1 4.18Å
406	K	88.2	Confident	86.9	Confident	145 Å²	145	53.4 Å²	53.4	63%	0.63	33%	0.327	S	S	*	.	H	α-helix	trans	-79.3	-39.6	177.1	-70.8	175.4	-178.4	-176.9	0	113.3	D402 A403 L404 I435	D402-K406 WeakPolarHBondContact O-CG 3.26Å; D402-K406 PolarHBondContact O-N 2.86Å; A403-K406 PolarHBondContact O-N 3.31Å; L404-K406 VanDerWaalsContact C-N 3.28Å; L404-K406 PolarHBondContact O-N 3.39Å; K406-I435 HydrophobicContact CB-CD1 4.08Å; K406-I435 HydrophobicContact CD-CD1 4.23Å
407	L	90.4	Very high	86.8	Confident	21 Å²	21	56.5 Å²	56.5	11%	0.11	34%	0.34	C	S	.	.	H	α-helix	trans	-85.6	-30.4	-176.2	-67.9	168.8	0	0	0	113.1	A403 L404 M426 S429 M431 F432 I435 F436	A403-L407 WeakPolarHBondContact O-CB 3.05Å; A403-L407 WeakPolarHBondContact O-CG 3.15Å; A403-L407 PolarHBondContact O-N 2.72Å; L404-L407 PolarHBondContact O-N 2.93Å; L407-M426 HydrophobicContact CB-CG 4.19Å; L407-M426 HydrophobicContact CD1-CB 4.34Å; L407-M426 HydrophobicContact CD1-CG 4.25Å; L407-M426 HydrophobicContact CD1-SD 4.21Å; L407-S429 WeakPolarHBondContact CD2-OG 3.31Å; L407-M431 HydrophobicContact CD2-CB 4.01Å; L407-F432 HydrophobicContact CD1-CD2 4.19Å; L407-I435 HydrophobicContact CD1-CD1 4.12Å; L407-I435 HydrophobicContact CD2-CD1 4.05Å; L407-I435 HydrophobicContact CG-CD1 3.83Å; L407-F436 HydrophobicContact CD1-CD2 4.3Å; L407-F436 HydrophobicContact CD1-CE2 3.65Å
408	I	89	Confident	86.9	Confident	11 Å²	11	57.5 Å²	57.5	6%	0.056	35%	0.35	C	S	.	.			trans	-139.3	80.1	-174.6	-52.7	179.7	0	0	0	109.3	L404 C414 I422 M426 F470 H473 L477	L404-I408 HydrophobicContact CD2-CD1 4.36Å; L404-I408 CarbonylContact O-C 3.58Å; L404-I408 VanDerWaalsContact O-C 3.29Å; L404-I408 WeakPolarHBondContact O-CA 3.39Å; L404-I408 PolarHBondContact O-N 3.01Å; L404-I408 VanDerWaalsContact O-O 3.05Å; I408-C414 WeakPolarHBondContact CG2-SG 3.44Å; I408-I422 HydrophobicContact CD1-CG2 3.51Å; I408-M426 HydrophobicContact CD1-CG 3.8Å; I408-M426 HydrophobicContact CD1-SD 3.95Å; I408-M426 HydrophobicContact CG1-CG 4.1Å; I408-F470 HydrophobicContact CD1-CD2 4.33Å; I408-F470 HydrophobicContact CD1-CE2 4.01Å; I408-H473 PolarHBondContact O-NE2 3.33Å; I408-L477 HydrophobicContact CG2-CD1 4.47Å
409	P	82.9	Confident	87	Confident	86 Å²	86	55.9 Å²	55.9	56%	0.558	33%	0.329	S	S	*	.			trans	-82.3	-15.2	178.7	31.9	-35.6	0	0	0	114.2
410	D	82.7	Confident	87	Confident	67 Å²	67	59.3 Å²	59.3	36%	0.358	35%	0.346	S	S	.	.			trans	-129.5	128.3	-175.2	-178.7	9.8	0	0	0	112.6	S412 V413	D410-S412 VanDerWaalsContact CG-OG 3.25Å; D410-S412 PolarHBondContact O-N 2.66Å; D410-S412 PolarHBondContact OD1-N 3.03Å; D410-S412 WeakPolarHBondContact OD2-CB 3.28Å; D410-S412 PolarHBondContact OD2-OG 3.36Å; D410-V413 HydrophobicContact CB-CG2 4.46Å; D410-V413 PolarHBondContact O-N 3.47Å
411	S	85	Confident	87	Confident	13 Å²	13	63 Å²	63	9%	0.091	37%	0.366	C	S	.	.	G	3₁₀ helix	trans	-55.9	-29.9	172.5	61.8	0	0	0	0	114.2	V413 C414 C415	S411-V413 PolarHBondContact O-N 2.78Å; S411-C414 PolarHBondContact O-N 3.43Å; S411-C415 PolarHBondContact O-N 2.8Å
412	S	83.3	Confident	87	Confident	79 Å²	79	60.6 Å²	60.6	55%	0.552	35%	0.35	S	S	*	.	G	3₁₀ helix	trans	-61.2	-32.4	-176.6	80.9	0	0	0	0	112.7	D410 C414	D410-S412 VanDerWaalsContact CG-OG 3.25Å; D410-S412 PolarHBondContact O-N 2.66Å; D410-S412 PolarHBondContact OD1-N 3.03Å; D410-S412 WeakPolarHBondContact OD2-CB 3.28Å; D410-S412 PolarHBondContact OD2-OG 3.36Å; S412-C414 VanDerWaalsContact C-N 3.26Å; S412-C414 PolarHBondContact O-N 2.76Å
413	V	81.5	Confident	87.1	Confident	73 Å²	73	56.5 Å²	56.5	44%	0.442	33%	0.329	S	S	.	.	G	3₁₀ helix	trans	-71.1	-24	-180	-173.1	0	0	0	0	111.7	D410 S411 K417	D410-V413 HydrophobicContact CB-CG2 4.46Å; D410-V413 PolarHBondContact O-N 3.47Å; S411-V413 PolarHBondContact O-N 2.78Å; V413-K417 WeakPolarHBondContact O-CD 3.44Å; V413-K417 VanDerWaalsContact O-CE 3.28Å; V413-K417 WeakPolarHBondContact O-CE 3.41Å; V413-K417 PolarHBondContact O-NZ 3.18Å
414	C	81.3	Confident	87.1	Confident	5 Å²	5	60.6 Å²	60.6	3%	0.034	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.8	-19	-174.7	-63.6	0	0	0	0	114.6	I408 S411 S412 G416 K417 I422 F470 F474	I408-C414 WeakPolarHBondContact CG2-SG 3.44Å; S411-C414 PolarHBondContact O-N 3.43Å; S412-C414 VanDerWaalsContact C-N 3.26Å; S412-C414 PolarHBondContact O-N 2.76Å; C414-G416 PolarHBondContact O-N 2.7Å; C414-K417 WeakPolarHBondContact O-CB 3.45Å; C414-K417 PolarHBondContact O-N 2.87Å; C414-K417 VanDerWaalsContact O-N 3.12Å; C414-I422 HydrophobicContact CB-CD1 3.78Å; C414-F470 HydrophobicContact CB-CZ 4.06Å; C414-F474 HydrophobicContact CB-CD2 3.73Å; C414-F474 HydrophobicContact CB-CE2 3.64Å
415	C	80.1	Confident	87	Confident	92 Å²	92	63.6 Å²	63.6	62%	0.622	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	123	-173	-170.2	0	0	0	0	111.8	S411	S411-C415 PolarHBondContact O-N 2.8Å
416	G	83.2	Confident	87.1	Confident	87 Å²	87	60.4 Å²	60.4	90%	0.897	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.5	8	178.7	0	0	0	0	0	116.5	C414	C414-G416 PolarHBondContact O-N 2.7Å
417	K	87	Confident	87.1	Confident	88 Å²	88	57.5 Å²	57.5	38%	0.383	34%	0.339	S	S	.	.			trans	-101.2	148.2	180	-63.1	-173.6	-178.4	162.9	0	112.1	V413 C414 D421 I422 L425	V413-K417 WeakPolarHBondContact O-CD 3.44Å; V413-K417 VanDerWaalsContact O-CE 3.28Å; V413-K417 WeakPolarHBondContact O-CE 3.41Å; V413-K417 PolarHBondContact O-NZ 3.18Å; C414-K417 WeakPolarHBondContact O-CB 3.45Å; C414-K417 PolarHBondContact O-N 2.87Å; C414-K417 VanDerWaalsContact O-N 3.12Å; K417-D421 HydrophobicContact CB-CB 3.94Å; K417-I422 HydrophobicContact CB-CD1 3.74Å; K417-I422 HydrophobicContact CB-CG1 4.3Å; K417-I422 HydrophobicContact CD-CD1 4.12Å; K417-L425 HydrophobicContact CD-CD1 3.39Å
418	S	90.2	Very high	86.9	Confident	54 Å²	54	63.9 Å²	63.9	38%	0.378	37%	0.37	S	S	.	.			trans	-76.5	161.9	175.4	71.9	0	0	0	0	111.7	E420 D421 I422	S418-E420 PolarHBondContact O-N 3.16Å; S418-D421 VanDerWaalsContact CB-OD2 3.29Å; S418-D421 WeakPolarHBondContact CB-OD2 3.45Å; S418-D421 PolarHBondContact N-OD2 2.77Å; S418-D421 WeakPolarHBondContact O-CB 2.98Å; S418-D421 PolarHBondContact O-N 3.45Å; S418-D421 VanDerWaalsContact O-N 3.11Å; S418-D421 PolarHBondContact OG-N 2.71Å; S418-D421 PolarHBondContact OG-OD2 3.37Å; S418-I422 WeakPolarHBondContact O-CG1 3.48Å; S418-I422 PolarHBondContact O-N 3.2Å
419	W	90.2	Very high	86.8	Confident	35 Å²	35	64.8 Å²	64.8	13%	0.133	38%	0.377	C	S	.	.	H	α-helix	trans	-57.5	-33.3	175.6	177.4	-126.4	0	0	0	112.6	I422 V423 M426 L461 A466 E467 F470	W419-I422 HydrophobicContact CE3-CB 3.99Å; W419-I422 HydrophobicContact CE3-CG2 3.9Å; W419-I422 HydrophobicContact CZ3-CB 4.34Å; W419-I422 HydrophobicContact CZ3-CG2 3.74Å; W419-I422 PolarHBondContact O-N 2.83Å; W419-V423 HydrophobicContact CD2-CG2 3.93Å; W419-V423 HydrophobicContact CE3-CG2 4.22Å; W419-V423 HydrophobicContact CH2-CG2 4.01Å; W419-V423 HydrophobicContact CZ2-CG2 3.68Å; W419-V423 HydrophobicContact CZ3-CG2 4.23Å; W419-V423 WeakPolarHBondContact O-CG2 3.47Å; W419-V423 PolarHBondContact O-N 2.7Å; W419-M426 HydrophobicContact CH2-CE 3.72Å; W419-M426 HydrophobicContact CZ3-CE 3.88Å; W419-L461 HydrophobicContact CH2-CD2 4.34Å; W419-L461 HydrophobicContact CZ2-CD2 4.4Å; W419-L461 WeakPolarHBondContact CZ2-O 3.23Å; W419-L461 PolarHBondContact NE1-O 3.4Å; W419-L461 VanDerWaalsContact NE1-O 3.16Å; W419-A466 HydrophobicContact CZ2-CB 4.18Å; W419-E467 HydrophobicContact CB-CG 4.15Å; W419-E467 HydrophobicContact CD2-CB 4.17Å; W419-E467 HydrophobicContact CD2-CG 4.13Å; W419-E467 HydrophobicContact CG-CB 4.11Å; W419-E467 HydrophobicContact CG-CG 3.78Å; W419-F470 HydrophobicContact CE3-CB 3.83Å; W419-F470 AromaticContact CE3-CD1 3.53Å; W419-F470 HydrophobicContact CE3-CD1 3.53Å; W419-F470 HydrophobicContact CE3-CD2 4.43Å; W419-F470 HydrophobicContact CE3-CE1 4.24Å; W419-F470 AromaticContact CE3-CG 3.64Å; W419-F470 HydrophobicContact CE3-CG 3.64Å; W419-F470 HydrophobicContact CH2-CB 3.66Å; W419-F470 HydrophobicContact CH2-CG 4.21Å; W419-F470 HydrophobicContact CZ3-CB 3.21Å; W419-F470 AromaticContact CZ3-CD1 3.71Å; W419-F470 HydrophobicContact CZ3-CD1 3.71Å; W419-F470 AromaticContact CZ3-CD2 3.83Å; W419-F470 HydrophobicContact CZ3-CD2 3.83Å; W419-F470 AromaticContact CZ3-CG 3.26Å; W419-F470 HydrophobicContact CZ3-CG 3.26Å
420	E	90.8	Very high	86.9	Confident	154 Å²	154	66.1 Å²	66.1	72%	0.72	39%	0.386	S	S	*	.	H	α-helix	trans	-64.4	-48.3	174.4	-61.7	-177.1	164.4	0	0	111.3	S418 I422 V423 D424	S418-E420 PolarHBondContact O-N 3.16Å; E420-I422 VanDerWaalsContact C-N 3.25Å; E420-I422 PolarHBondContact O-N 2.8Å; E420-V423 PolarHBondContact O-N 2.78Å; E420-V423 VanDerWaalsContact O-N 3.12Å; E420-D424 PolarHBondContact O-N 2.9Å
421	D	90.9	Very high	87	Confident	78 Å²	78	66.7 Å²	66.7	42%	0.417	39%	0.387	S	S	.	.	H	α-helix	trans	-58.4	-37.3	174.3	-60	-62.2	0	0	0	112.1	K417 S418 D424 L425	K417-D421 HydrophobicContact CB-CB 3.94Å; S418-D421 VanDerWaalsContact CB-OD2 3.29Å; S418-D421 WeakPolarHBondContact CB-OD2 3.45Å; S418-D421 PolarHBondContact N-OD2 2.77Å; S418-D421 WeakPolarHBondContact O-CB 2.98Å; S418-D421 PolarHBondContact O-N 3.45Å; S418-D421 VanDerWaalsContact O-N 3.11Å; S418-D421 PolarHBondContact OG-N 2.71Å; S418-D421 PolarHBondContact OG-OD2 3.37Å; D421-D424 PolarHBondContact O-N 3.43Å; D421-L425 WeakPolarHBondContact O-CB 3.31Å; D421-L425 WeakPolarHBondContact O-CD1 3.27Å; D421-L425 VanDerWaalsContact O-CG 3.22Å; D421-L425 WeakPolarHBondContact O-CG 3.14Å; D421-L425 PolarHBondContact O-N 3.3Å
422	I	90.4	Very high	87.2	Confident	1 Å²	1	66.8 Å²	66.8	1%	0.005	39%	0.386	C	S	.	.	H	α-helix	trans	-68.2	-40.9	177.1	-64.2	-49.5	0	0	0	111.3	I408 C414 K417 S418 W419 E420 D424 L425 M426 F470	I408-I422 HydrophobicContact CD1-CG2 3.51Å; C414-I422 HydrophobicContact CB-CD1 3.78Å; K417-I422 HydrophobicContact CB-CD1 3.74Å; K417-I422 HydrophobicContact CB-CG1 4.3Å; K417-I422 HydrophobicContact CD-CD1 4.12Å; S418-I422 WeakPolarHBondContact O-CG1 3.48Å; S418-I422 PolarHBondContact O-N 3.2Å; W419-I422 HydrophobicContact CE3-CB 3.99Å; W419-I422 HydrophobicContact CE3-CG2 3.9Å; W419-I422 HydrophobicContact CZ3-CB 4.34Å; W419-I422 HydrophobicContact CZ3-CG2 3.74Å; W419-I422 PolarHBondContact O-N 2.83Å; E420-I422 VanDerWaalsContact C-N 3.25Å; E420-I422 PolarHBondContact O-N 2.8Å; I422-D424 VanDerWaalsContact C-N 3.34Å; I422-L425 HydrophobicContact CD1-CD1 4.2Å; I422-L425 PolarHBondContact O-N 3.29Å; I422-M426 HydrophobicContact CG2-CE 4.16Å; I422-M426 WeakPolarHBondContact O-CG 3.44Å; I422-M426 PolarHBondContact O-N 3.44Å; I422-F470 HydrophobicContact CB-CZ 4.43Å; I422-F470 HydrophobicContact CD1-CZ 4.29Å; I422-F470 HydrophobicContact CG1-CE1 4.08Å; I422-F470 HydrophobicContact CG1-CE2 4.43Å; I422-F470 HydrophobicContact CG1-CZ 3.79Å; I422-F470 HydrophobicContact CG2-CD2 4.04Å; I422-F470 HydrophobicContact CG2-CE1 4.39Å; I422-F470 HydrophobicContact CG2-CE2 3.72Å; I422-F470 HydrophobicContact CG2-CZ 3.91Å
423	V	91.6	Very high	87.3	Confident	22 Å²	22	73.4 Å²	73.4	13%	0.133	40%	0.399	C	S	.	.	H	α-helix	trans	-66.1	-36	175.6	167.3	0	0	0	0	111.7	W419 E420 M426 Q427 L461	W419-V423 HydrophobicContact CD2-CG2 3.93Å; W419-V423 HydrophobicContact CE3-CG2 4.22Å; W419-V423 HydrophobicContact CH2-CG2 4.01Å; W419-V423 HydrophobicContact CZ2-CG2 3.68Å; W419-V423 HydrophobicContact CZ3-CG2 4.23Å; W419-V423 WeakPolarHBondContact O-CG2 3.47Å; W419-V423 PolarHBondContact O-N 2.7Å; E420-V423 PolarHBondContact O-N 2.78Å; E420-V423 VanDerWaalsContact O-N 3.12Å; V423-M426 HydrophobicContact CB-CE 4.32Å; V423-M426 HydrophobicContact CG2-CE 3.77Å; V423-Q427 WeakPolarHBondContact O-CG 3.43Å; V423-Q427 PolarHBondContact O-N 2.95Å; V423-Q427 PolarHBondContact O-NE2 3.37Å; V423-Q427 VanDerWaalsContact O-NE2 3.16Å; V423-L461 HydrophobicContact CG1-CB 4.46Å; V423-L461 HydrophobicContact CG1-CD1 4.33Å; V423-L461 HydrophobicContact CG2-CB 4.21Å
424	D	90.3	Very high	87.4	Confident	92 Å²	92	76 Å²	76	49%	0.492	41%	0.406	S	S	.	.	H	α-helix	trans	-70.3	-40.9	173.6	-75.8	-10.5	0	0	0	112	E420 D421 I422 M426 Q427 M428	E420-D424 PolarHBondContact O-N 2.9Å; D421-D424 PolarHBondContact O-N 3.43Å; I422-D424 VanDerWaalsContact C-N 3.34Å; D424-M426 VanDerWaalsContact C-N 3.33Å; D424-M426 PolarHBondContact O-N 2.86Å; D424-Q427 WeakPolarHBondContact O-CB 3.4Å; D424-Q427 PolarHBondContact O-N 2.96Å; D424-Q427 VanDerWaalsContact O-N 3.14Å; D424-Q427 PolarHBondContact OD1-NE2 3.36Å; D424-M428 WeakPolarHBondContact O-CG 3.32Å; D424-M428 PolarHBondContact O-N 2.94Å
425	L	89.3	Confident	87.7	Confident	63 Å²	63	76.9 Å²	76.9	33%	0.33	41%	0.41	S	S	.	.	H	α-helix	trans	-61.8	-39.2	173	-75.8	161.1	0	0	0	112.7	K417 D421 I422 M428 S429	K417-L425 HydrophobicContact CD-CD1 3.39Å; D421-L425 WeakPolarHBondContact O-CB 3.31Å; D421-L425 WeakPolarHBondContact O-CD1 3.27Å; D421-L425 VanDerWaalsContact O-CG 3.22Å; D421-L425 WeakPolarHBondContact O-CG 3.14Å; D421-L425 PolarHBondContact O-N 3.3Å; I422-L425 HydrophobicContact CD1-CD1 4.2Å; I422-L425 PolarHBondContact O-N 3.29Å; L425-M428 PolarHBondContact O-N 3.4Å; L425-S429 PolarHBondContact O-N 3.34Å
426	M	90.2	Very high	88.2	Confident	2 Å²	2	72.8 Å²	72.8	1%	0.01	38%	0.382	C	S	.	.	H	α-helix	trans	-60.9	-47.2	171.8	-74.5	-171.9	-68.2	0	0	110.7	L404 L407 I408 W419 I422 V423 D424 M428 S429 F432 L461	L404-M426 HydrophobicContact CD2-CE 4.47Å; L404-M426 HydrophobicContact CD2-SD 3.61Å; L407-M426 HydrophobicContact CB-CG 4.19Å; L407-M426 HydrophobicContact CD1-CB 4.34Å; L407-M426 HydrophobicContact CD1-CG 4.25Å; L407-M426 HydrophobicContact CD1-SD 4.21Å; I408-M426 HydrophobicContact CD1-CG 3.8Å; I408-M426 HydrophobicContact CD1-SD 3.95Å; I408-M426 HydrophobicContact CG1-CG 4.1Å; W419-M426 HydrophobicContact CH2-CE 3.72Å; W419-M426 HydrophobicContact CZ3-CE 3.88Å; I422-M426 HydrophobicContact CG2-CE 4.16Å; I422-M426 WeakPolarHBondContact O-CG 3.44Å; I422-M426 PolarHBondContact O-N 3.44Å; V423-M426 HydrophobicContact CB-CE 4.32Å; V423-M426 HydrophobicContact CG2-CE 3.77Å; D424-M426 VanDerWaalsContact C-N 3.33Å; D424-M426 PolarHBondContact O-N 2.86Å; M426-M428 PolarHBondContact O-N 3.11Å; M426-S429 VanDerWaalsContact O-CB 3.26Å; M426-S429 WeakPolarHBondContact O-CB 3.35Å; M426-S429 PolarHBondContact O-N 3.31Å; M426-F432 HydrophobicContact CB-CD2 4.02Å; M426-F432 HydrophobicContact CB-CE2 3.96Å; M426-F432 VanDerWaalsContact O-CB 3.3Å; M426-F432 WeakPolarHBondContact O-CB 2.97Å; M426-F432 WeakPolarHBondContact O-CD2 3.37Å; M426-F432 WeakPolarHBondContact O-CG 3.45Å; M426-L461 HydrophobicContact CE-CD1 4.17Å; M426-L461 HydrophobicContact CE-CD2 3.84Å
427	Q	89.5	Confident	88.2	Confident	85 Å²	85	70.7 Å²	70.7	40%	0.397	35%	0.348	S	S	.	.	H	α-helix	trans	-61.8	-27.8	178.3	-76.6	172.5	83.5	0	0	114.2	V423 D424 S429 F432	V423-Q427 WeakPolarHBondContact O-CG 3.43Å; V423-Q427 PolarHBondContact O-N 2.95Å; V423-Q427 PolarHBondContact O-NE2 3.37Å; V423-Q427 VanDerWaalsContact O-NE2 3.16Å; D424-Q427 WeakPolarHBondContact O-CB 3.4Å; D424-Q427 PolarHBondContact O-N 2.96Å; D424-Q427 VanDerWaalsContact O-N 3.14Å; D424-Q427 PolarHBondContact OD1-NE2 3.36Å; Q427-S429 VanDerWaalsContact C-N 3.32Å; Q427-F432 HydrophobicContact CB-CE1 4.39Å; Q427-F432 HydrophobicContact CB-CZ 4.45Å; Q427-F432 HydrophobicContact CG-CD1 4.23Å; Q427-F432 HydrophobicContact CG-CE1 3.65Å; Q427-F432 HydrophobicContact CG-CE2 3.98Å; Q427-F432 HydrophobicContact CG-CZ 3.5Å; Q427-F432 VanDerWaalsContact CG-CZ 3.5Å
428	M	86.6	Confident	87.4	Confident	155 Å²	155	70.9 Å²	70.9	76%	0.764	36%	0.356	S	S	*	.	H	α-helix	trans	-76.8	-14.1	174.6	-69.3	-177.5	75.9	0	0	113.9	D424 L425 M426	D424-M428 WeakPolarHBondContact O-CG 3.32Å; D424-M428 PolarHBondContact O-N 2.94Å; L425-M428 PolarHBondContact O-N 3.4Å; M426-M428 PolarHBondContact O-N 3.11Å
429	S	85.7	Confident	86	Confident	29 Å²	29	71.1 Å²	71.1	20%	0.203	36%	0.356	C	S	.	.	S	Bend	trans	-70.3	136.1	179.3	-176.1	0	0	0	0	111.7	L407 L425 M426 Q427 M431 F432	L407-S429 WeakPolarHBondContact CD2-OG 3.31Å; L425-S429 PolarHBondContact O-N 3.34Å; M426-S429 VanDerWaalsContact O-CB 3.26Å; M426-S429 WeakPolarHBondContact O-CB 3.35Å; M426-S429 PolarHBondContact O-N 3.31Å; Q427-S429 VanDerWaalsContact C-N 3.32Å; S429-M431 PolarHBondContact O-N 3.19Å; S429-F432 WeakPolarHBondContact O-CB 3.18Å; S429-F432 PolarHBondContact O-N 2.94Å
430	P	85	Confident	84.5	Confident	115 Å²	115	77.2 Å²	77.2	75%	0.747	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	-39.6	174	-26.1	34.8	0	0	0	112.8	F432	P430-F432 PolarHBondContact O-N 2.89Å; P430-F432 VanDerWaalsContact O-N 3.14Å
431	M	85	Confident	82.5	Confident	79 Å²	79	79.6 Å²	79.6	39%	0.389	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-14	179.6	-52.5	-57.5	-66	0	0	113.3	L407 S429 R433 E434 I435	L407-M431 HydrophobicContact CD2-CB 4.01Å; S429-M431 PolarHBondContact O-N 3.19Å; M431-R433 VanDerWaalsContact C-N 3.33Å; M431-R433 PolarHBondContact O-N 2.92Å; M431-E434 VanDerWaalsContact CE-OE2 3.23Å; M431-E434 WeakPolarHBondContact CE-OE2 2.97Å; M431-E434 PolarHBondContact O-N 3.16Å; M431-I435 HydrophobicContact CB-CD1 4.18Å; M431-I435 WeakPolarHBondContact O-CG1 3.28Å; M431-I435 PolarHBondContact O-N 2.79Å; M431-I435 VanDerWaalsContact O-N 3.14Å
432	F	89	Confident	80.2	Confident	15 Å²	15	79.8 Å²	79.8	7%	0.066	41%	0.405	C	S	.	.	H	α-helix	trans	-62.8	-38.4	-172.9	-168.7	-96.7	0	0	0	112.9	L407 M426 Q427 S429 P430 E434 I435 F436 L458 L461	L407-F432 HydrophobicContact CD1-CD2 4.19Å; M426-F432 HydrophobicContact CB-CD2 4.02Å; M426-F432 HydrophobicContact CB-CE2 3.96Å; M426-F432 VanDerWaalsContact O-CB 3.3Å; M426-F432 WeakPolarHBondContact O-CB 2.97Å; M426-F432 WeakPolarHBondContact O-CD2 3.37Å; M426-F432 WeakPolarHBondContact O-CG 3.45Å; Q427-F432 HydrophobicContact CB-CE1 4.39Å; Q427-F432 HydrophobicContact CB-CZ 4.45Å; Q427-F432 HydrophobicContact CG-CD1 4.23Å; Q427-F432 HydrophobicContact CG-CE1 3.65Å; Q427-F432 HydrophobicContact CG-CE2 3.98Å; Q427-F432 HydrophobicContact CG-CZ 3.5Å; Q427-F432 VanDerWaalsContact CG-CZ 3.5Å; S429-F432 WeakPolarHBondContact O-CB 3.18Å; S429-F432 PolarHBondContact O-N 2.94Å; P430-F432 PolarHBondContact O-N 2.89Å; P430-F432 VanDerWaalsContact O-N 3.14Å; F432-E434 VanDerWaalsContact C-N 3.28Å; F432-E434 PolarHBondContact O-N 3.33Å; F432-I435 PolarHBondContact O-N 3.08Å; F432-F436 HydrophobicContact CD1-CB 4.21Å; F432-F436 AromaticContact CD2-CD2 3.57Å; F432-F436 HydrophobicContact CD2-CD2 3.57Å; F432-F436 HydrophobicContact CD2-CE2 4.09Å; F432-F436 HydrophobicContact CD2-CG 4.35Å; F432-F436 HydrophobicContact CE1-CB 3.78Å; F432-F436 HydrophobicContact CE1-CD2 4.34Å; F432-F436 HydrophobicContact CE1-CG 4.2Å; F432-F436 HydrophobicContact CE2-CB 4.28Å; F432-F436 AromaticContact CE2-CD2 3.31Å; F432-F436 HydrophobicContact CE2-CD2 3.31Å; F432-F436 AromaticContact CE2-CE2 3.73Å; F432-F436 HydrophobicContact CE2-CE2 3.73Å; F432-F436 AromaticContact CE2-CG 3.81Å; F432-F436 HydrophobicContact CE2-CG 3.81Å; F432-F436 HydrophobicContact CG-CD2 4.22Å; F432-F436 HydrophobicContact CZ-CB 3.82Å; F432-F436 HydrophobicContact CZ-CD1 4.39Å; F432-F436 AromaticContact CZ-CD2 3.74Å; F432-F436 HydrophobicContact CZ-CD2 3.74Å; F432-F436 HydrophobicContact CZ-CE2 4.43Å; F432-F436 AromaticContact CZ-CG 3.72Å; F432-F436 HydrophobicContact CZ-CG 3.72Å; F432-F436 WeakPolarHBondContact O-CB 3.01Å; F432-F436 PolarHBondContact O-N 2.89Å; F432-L458 HydrophobicContact CE1-CD1 4.03Å; F432-L458 HydrophobicContact CZ-CD1 3.67Å; F432-L461 HydrophobicContact CE2-CD1 3.87Å; F432-L461 HydrophobicContact CZ-CD1 3.95Å
433	R	84.5	Confident	77.7	Confident	218 Å²	218	86.1 Å²	86.1	82%	0.823	44%	0.439	S	S	*	.	H	α-helix	trans	-74.6	-18.7	-179.2	-65	-176.8	178	-175.6	0.1	113.7	M431	M431-R433 VanDerWaalsContact C-N 3.33Å; M431-R433 PolarHBondContact O-N 2.92Å
434	E	85	Confident	75	Confident	127 Å²	127	91 Å²	91	59%	0.593	47%	0.474	S	S	*	.	H	α-helix	trans	-81.5	-36.8	173.4	-61.1	176.7	-173	0	0	110.9	M431 F432 R455	M431-E434 VanDerWaalsContact CE-OE2 3.23Å; M431-E434 WeakPolarHBondContact CE-OE2 2.97Å; M431-E434 PolarHBondContact O-N 3.16Å; F432-E434 VanDerWaalsContact C-N 3.28Å; F432-E434 PolarHBondContact O-N 3.33Å; E434-R455 WeakPolarHBondContact O-CD 3.26Å; E434-R455 VanDerWaalsContact O-CG 3.27Å; E434-R455 WeakPolarHBondContact O-CG 2.99Å
435	I	87.8	Confident	72.4	Confident	23 Å²	23	89.6 Å²	89.6	12%	0.118	48%	0.481	C	S	.	.	H	α-helix	trans	-86.7	-41.9	-176.9	-63.4	170.1	0	0	0	112	A403 K406 L407 M431 F432 R455 L456	A403-I435 HydrophobicContact CB-CG2 3.58Å; K406-I435 HydrophobicContact CB-CD1 4.08Å; K406-I435 HydrophobicContact CD-CD1 4.23Å; L407-I435 HydrophobicContact CD1-CD1 4.12Å; L407-I435 HydrophobicContact CD2-CD1 4.05Å; L407-I435 HydrophobicContact CG-CD1 3.83Å; M431-I435 HydrophobicContact CB-CD1 4.18Å; M431-I435 WeakPolarHBondContact O-CG1 3.28Å; M431-I435 PolarHBondContact O-N 2.79Å; M431-I435 VanDerWaalsContact O-N 3.14Å; F432-I435 PolarHBondContact O-N 3.08Å; I435-R455 CarbonylContact O-C 3.59Å; I435-R455 WeakPolarHBondContact O-CA 3.26Å; I435-L456 HydrophobicContact CG2-CD1 4.06Å; I435-L456 PolarHBondContact O-N 3.2Å
436	F	89.7	Confident	70	Confident	6 Å²	6	93.3 Å²	93.3	3%	0.026	50%	0.502	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	149.2	-175.4	-69.7	-89.5	0	0	0	112.5	L400 L407 F432 L456 I460 L461	L400-F436 HydrophobicContact CD1-CZ 4.1Å; L407-F436 HydrophobicContact CD1-CD2 4.3Å; L407-F436 HydrophobicContact CD1-CE2 3.65Å; F432-F436 HydrophobicContact CD1-CB 4.21Å; F432-F436 AromaticContact CD2-CD2 3.57Å; F432-F436 HydrophobicContact CD2-CD2 3.57Å; F432-F436 HydrophobicContact CD2-CE2 4.09Å; F432-F436 HydrophobicContact CD2-CG 4.35Å; F432-F436 HydrophobicContact CE1-CB 3.78Å; F432-F436 HydrophobicContact CE1-CD2 4.34Å; F432-F436 HydrophobicContact CE1-CG 4.2Å; F432-F436 HydrophobicContact CE2-CB 4.28Å; F432-F436 AromaticContact CE2-CD2 3.31Å; F432-F436 HydrophobicContact CE2-CD2 3.31Å; F432-F436 AromaticContact CE2-CE2 3.73Å; F432-F436 HydrophobicContact CE2-CE2 3.73Å; F432-F436 AromaticContact CE2-CG 3.81Å; F432-F436 HydrophobicContact CE2-CG 3.81Å; F432-F436 HydrophobicContact CG-CD2 4.22Å; F432-F436 HydrophobicContact CZ-CB 3.82Å; F432-F436 HydrophobicContact CZ-CD1 4.39Å; F432-F436 AromaticContact CZ-CD2 3.74Å; F432-F436 HydrophobicContact CZ-CD2 3.74Å; F432-F436 HydrophobicContact CZ-CE2 4.43Å; F432-F436 AromaticContact CZ-CG 3.72Å; F432-F436 HydrophobicContact CZ-CG 3.72Å; F432-F436 WeakPolarHBondContact O-CB 3.01Å; F432-F436 PolarHBondContact O-N 2.89Å; F436-L456 CarbonylContact C-O 3.55Å; F436-L456 VanDerWaalsContact CA-O 3.28Å; F436-L456 WeakPolarHBondContact CA-O 3.37Å; F436-L456 HydrophobicContact CD1-CB 3.48Å; F436-L456 VanDerWaalsContact CD1-CB 3.48Å; F436-L456 HydrophobicContact CD1-CD1 4.43Å; F436-L456 HydrophobicContact CE1-CB 3.49Å; F436-L456 VanDerWaalsContact CE1-CB 3.49Å; F436-L456 HydrophobicContact CE1-CD1 3.71Å; F436-L456 HydrophobicContact CE1-CG 4.25Å; F436-L456 HydrophobicContact CE2-CD1 4.3Å; F436-L456 HydrophobicContact CG-CB 4.19Å; F436-L456 HydrophobicContact CZ-CB 4.22Å; F436-L456 HydrophobicContact CZ-CD1 3.63Å; F436-I460 HydrophobicContact CE1-CG2 3.7Å; F436-L461 HydrophobicContact CD1-CD1 4.32Å; F436-L461 HydrophobicContact CD1-CG 4.48Å; F436-L461 HydrophobicContact CE1-CD1 3.85Å; F436-L461 HydrophobicContact CE1-CD2 3.97Å; F436-L461 HydrophobicContact CE1-CG 3.71Å; F436-L461 HydrophobicContact CE2-CD1 4.39Å; F436-L461 HydrophobicContact CZ-CD1 3.91Å; F436-L461 HydrophobicContact CZ-CD2 3.76Å; F436-L461 HydrophobicContact CZ-CG 3.94Å
437	Y	84.3	Confident	67.6	Low	44 Å²	44	96.2 Å²	96.2	17%	0.173	53%	0.526	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	147.8	168.2	81.6	-88.6	0	0	0	110.9	R392 P439 V452 R455 L456 S457 L458	R392-Y437 PolarHBondContact NH2-OH 2.84Å; Y437-P439 HydrophobicContact CE2-CG 3.92Å; Y437-V452 HydrophobicContact CD1-CG1 3.84Å; Y437-V452 HydrophobicContact CE1-CG1 4.23Å; Y437-V452 HydrophobicContact CG-CG1 4.12Å; Y437-R455 HydrophobicContact CD1-CB 3.93Å; Y437-L456 WeakPolarHBondContact CD1-O 3.19Å; Y437-L456 PolarHBondContact N-O 3.44Å; Y437-S457 VanDerWaalsContact CE1-CA 3.45Å; Y437-S457 WeakPolarHBondContact OH-CB 3.41Å; Y437-S457 PolarHBondContact OH-OG 3.43Å; Y437-L458 PolarHBondContact O-N 2.83Å
438	T	69.4	Low	65.5	Low	92 Å²	92	95.6 Å²	95.6	56%	0.564	53%	0.525	S	S	*	.	P	Polyproline II helix	trans	-102.6	120.9	176.2	-54.1	0	0	0	0	109.7	Q440 L458	T438-Q440 PolarHBondContact O-N 3.33Å; T438-L458 HydrophobicContact CG2-CD2 4.01Å
439	P	61	Low	63.4	Low	59 Å²	59	93.4 Å²	93.4	38%	0.383	52%	0.516	S	S	.	.	P	Polyproline II helix	trans	-63.1	119	169	-14.3	26.7	0	0	0	109.9	Y437	Y437-P439 HydrophobicContact CE2-CG 3.92Å
440	Q	57.6	Low	61.6	Low	162 Å²	162	101.1 Å²	101.1	76%	0.757	55%	0.549	S	S	*	.	P	Polyproline II helix	trans	-75.2	134.4	174.4	-66.9	-173.5	1.2	0	0	109.8	T438 S442	T438-Q440 PolarHBondContact O-N 3.33Å; Q440-S442 PolarHBondContact O-N 3.04Å
441	Q	49.6	Very low	59.7	Low	204 Å²	204	100.3 Å²	100.3	95%	0.953	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	1.4	-168.3	-69.9	-177.8	-6.1	0	0	115.4
442	S	43.4	Very low	58.1	Low	83 Å²	83	99.1 Å²	99.1	58%	0.58	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.5	-20.2	-171.1	49.1	0	0	0	0	115.8	Q440 S444	Q440-S442 PolarHBondContact O-N 3.04Å; S442-S444 PolarHBondContact O-N 3.32Å; S442-S444 VanDerWaalsContact O-N 3.1Å
443	D	36.3	Very low	56.5	Low	133 Å²	133	101.2 Å²	101.2	71%	0.711	57%	0.569	S	S	*	*			trans	-90.9	71.2	-176.7	-76.2	-8.4	0	0	0	112.2	G445	D443-G445 PolarHBondContact O-N 3.42Å; D443-G445 VanDerWaalsContact O-N 3.07Å
444	S	36.4	Very low	55.8	Low	124 Å²	124	97 Å²	97	87%	0.867	56%	0.563	S	S	*	*			trans	-72.4	90.3	169.7	59.8	0	0	0	0	111.2	S442	S442-S444 PolarHBondContact O-N 3.32Å; S442-S444 VanDerWaalsContact O-N 3.1Å
445	G	35.9	Very low	55.7	Low	63 Å²	63	96.5 Å²	96.5	65%	0.649	56%	0.556	S	S	*	*	S	Bend	trans	168	-79.2	169.9	0	0	0	0	0	115.9	D443	D443-G445 PolarHBondContact O-N 3.42Å; D443-G445 VanDerWaalsContact O-N 3.07Å
446	D	37.5	Very low	55.7	Low	142 Å²	142	95.7 Å²	95.7	76%	0.759	55%	0.551	S	S	*	*			trans	-141.2	64.6	-151.3	-78.3	-65.6	0	0	0	113.6	R345	R345-D446 IonicContact NH1-OD1 3.33Å
447	A	39.5	Very low	55.5	Low	63 Å²	63	95.9 Å²	95.9	52%	0.521	55%	0.554	S	S	.	*			trans	-136.3	51.9	-180	0	0	0	0	0	114.8	N449	A447-N449 PolarHBondContact O-N 2.78Å
448	D	47.3	Very low	55.6	Low	71 Å²	71	94.9 Å²	94.9	38%	0.38	55%	0.551	S	S	.	*			trans	-73	70.5	147.3	-65.2	-47.7	0	0	0	107.9	R345 E450	R345-D448 IonicContact CZ-OD2 2.99Å; R345-D448 IonicContact NE-OD2 3.73Å; R345-D448 VanDerWaalsContact NH2-CB 3.33Å; R345-D448 IonicContact NH2-OD2 2.72Å; R345-D448 PolarHBondContact NH2-OD2 2.98Å; D448-E450 PolarHBondContact O-N 3.28Å; D448-E450 VanDerWaalsContact O-N 3.12Å
449	N	42	Very low	56.4	Low	109 Å²	109	94 Å²	94	58%	0.583	54%	0.543	S	S	*	.			trans	-73.5	98.3	166.8	-94.2	-22	0	0	0	107.6	A447 S451 V452	A447-N449 PolarHBondContact O-N 2.78Å; N449-S451 PolarHBondContact O-N 2.9Å; N449-V452 HydrophobicContact CB-CG2 4.44Å; N449-V452 PolarHBondContact O-N 3.37Å
450	E	47.3	Very low	57.7	Low	191 Å²	191	91.5 Å²	91.5	89%	0.893	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-6.8	171.5	-66.3	-176.8	131.8	0	0	113	D448	D448-E450 PolarHBondContact O-N 3.28Å; D448-E450 VanDerWaalsContact O-N 3.12Å
451	S	45	Very low	59.3	Low	99 Å²	99	83.9 Å²	83.9	69%	0.692	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-5.2	175.7	60.8	0	0	0	0	115.8	N449 G453	N449-S451 PolarHBondContact O-N 2.9Å; S451-G453 PolarHBondContact O-N 2.87Å; S451-G453 VanDerWaalsContact O-N 3.07Å
452	V	51.9	Low	61.1	Low	54 Å²	54	83 Å²	83	33%	0.327	48%	0.479	S	S	.	.			trans	-84.7	44.4	172.8	-162.5	0	0	0	0	111	Y437 N449 D454 R455	Y437-V452 HydrophobicContact CD1-CG1 3.84Å; Y437-V452 HydrophobicContact CE1-CG1 4.23Å; Y437-V452 HydrophobicContact CG-CG1 4.12Å; N449-V452 HydrophobicContact CB-CG2 4.44Å; N449-V452 PolarHBondContact O-N 3.37Å; V452-D454 VanDerWaalsContact C-N 3.31Å; V452-D454 PolarHBondContact O-N 3.25Å; V452-R455 HydrophobicContact CG1-CB 4.33Å
453	G	54.7	Low	63.3	Low	58 Å²	58	79.7 Å²	79.7	60%	0.598	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-22.7	-157	0	0	0	0	0	118	S451	S451-G453 PolarHBondContact O-N 2.87Å; S451-G453 VanDerWaalsContact O-N 3.07Å
454	D	70	Confident	65.9	Low	129 Å²	129	77.5 Å²	77.5	69%	0.69	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.4	-8	-174.1	-95	-42.7	0	0	0	117.6	K399 V452	K399-D454 IonicContact NZ-OD1 2.72Å; K399-D454 PolarHBondContact NZ-OD1 3.07Å; V452-D454 VanDerWaalsContact C-N 3.31Å; V452-D454 PolarHBondContact O-N 3.25Å
455	R	83.6	Confident	68.4	Low	118 Å²	118	75.1 Å²	75.1	45%	0.445	42%	0.423	S	S	.	.	P	Polyproline II helix	trans	-92.3	141.6	-175.9	-67.4	-171	-69.9	179.8	-4.9	113.2	E434 I435 Y437 V452	E434-R455 WeakPolarHBondContact O-CD 3.26Å; E434-R455 VanDerWaalsContact O-CG 3.27Å; E434-R455 WeakPolarHBondContact O-CG 2.99Å; I435-R455 CarbonylContact O-C 3.59Å; I435-R455 WeakPolarHBondContact O-CA 3.26Å; Y437-R455 HydrophobicContact CD1-CB 3.93Å; V452-R455 HydrophobicContact CG1-CB 4.33Å
456	L	87	Confident	71.1	Confident	5 Å²	5	72.1 Å²	72.1	3%	0.026	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	142.5	176.2	-64.5	-179.4	0	0	0	111.5	E396 K399 L400 A403 I435 F436 Y437 I460	E396-L456 HydrophobicContact CB-CD2 3.89Å; E396-L456 HydrophobicContact CG-CD2 4.17Å; E396-L456 WeakPolarHBondContact O-CD2 3.18Å; K399-L456 HydrophobicContact CB-CD2 3.9Å; L400-L456 HydrophobicContact CD1-CD1 4.15Å; A403-L456 HydrophobicContact CB-CD1 3.73Å; I435-L456 HydrophobicContact CG2-CD1 4.06Å; I435-L456 PolarHBondContact O-N 3.2Å; F436-L456 CarbonylContact C-O 3.55Å; F436-L456 VanDerWaalsContact CA-O 3.28Å; F436-L456 WeakPolarHBondContact CA-O 3.37Å; F436-L456 HydrophobicContact CD1-CB 3.48Å; F436-L456 VanDerWaalsContact CD1-CB 3.48Å; F436-L456 HydrophobicContact CD1-CD1 4.43Å; F436-L456 HydrophobicContact CE1-CB 3.49Å; F436-L456 VanDerWaalsContact CE1-CB 3.49Å; F436-L456 HydrophobicContact CE1-CD1 3.71Å; F436-L456 HydrophobicContact CE1-CG 4.25Å; F436-L456 HydrophobicContact CE2-CD1 4.3Å; F436-L456 HydrophobicContact CG-CB 4.19Å; F436-L456 HydrophobicContact CZ-CB 4.22Å; F436-L456 HydrophobicContact CZ-CD1 3.63Å; Y437-L456 WeakPolarHBondContact CD1-O 3.19Å; Y437-L456 PolarHBondContact N-O 3.44Å; L456-I460 HydrophobicContact CB-CG2 4.49Å
457	S	85.4	Confident	73.8	Confident	11 Å²	11	68.9 Å²	68.9	8%	0.077	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	133.7	170.8	-175.1	0	0	0	0	110.2	E396 Y437 D459 I460	E396-S457 WeakPolarHBondContact OE2-CB 3.31Å; Y437-S457 VanDerWaalsContact CE1-CA 3.45Å; Y437-S457 WeakPolarHBondContact OH-CB 3.41Å; Y437-S457 PolarHBondContact OH-OG 3.43Å; S457-D459 PolarHBondContact O-N 3.38Å; S457-D459 VanDerWaalsContact O-N 3.12Å; S457-D459 PolarHBondContact OG-N 3.17Å; S457-I460 WeakPolarHBondContact O-CB 3.14Å; S457-I460 WeakPolarHBondContact O-CG2 3.27Å; S457-I460 PolarHBondContact O-N 3.09Å
458	L	86.5	Confident	76.3	Confident	23 Å²	23	69.5 Å²	69.5	12%	0.12	37%	0.37	C	S	.	.	G	3₁₀ helix	trans	-52.4	-34.1	172.8	179.6	62.9	0	0	0	112.6	F432 Y437 T438 I460 L461	F432-L458 HydrophobicContact CE1-CD1 4.03Å; F432-L458 HydrophobicContact CZ-CD1 3.67Å; Y437-L458 PolarHBondContact O-N 2.83Å; T438-L458 HydrophobicContact CG2-CD2 4.01Å; L458-I460 PolarHBondContact O-N 3Å; L458-L461 HydrophobicContact CD1-CD1 4.36Å; L458-L461 PolarHBondContact O-N 3.41Å
459	D	86.4	Confident	78.4	Confident	74 Å²	74	67.2 Å²	67.2	40%	0.396	36%	0.359	S	S	.	.	G	3₁₀ helix	trans	-66.9	-14.2	179.3	-69.8	-47	0	0	0	113.7	S457 L461 R462	S457-D459 PolarHBondContact O-N 3.38Å; S457-D459 VanDerWaalsContact O-N 3.12Å; S457-D459 PolarHBondContact OG-N 3.17Å; D459-L461 VanDerWaalsContact C-N 3.27Å; D459-L461 PolarHBondContact O-N 2.76Å; D459-R462 PolarHBondContact O-N 3.36Å; D459-R462 IonicContact OD1-CZ 2.69Å; D459-R462 IonicContact OD1-NH1 3.77Å; D459-R462 PolarHBondContact OD1-NH1 3.39Å
460	I	89.3	Confident	80.8	Confident	5 Å²	5	62.5 Å²	62.5	3%	0.026	33%	0.334	C	S	.	.	G	3₁₀ helix	trans	-63.5	-35.6	175.3	-155.2	64.1	0	0	0	111.3	R393 E396 L397 F436 L456 S457 L458 R462 T463 A466	R393-I460 HydrophobicContact CB-CD1 4.45Å; R393-I460 HydrophobicContact CG-CD1 3.63Å; E396-I460 HydrophobicContact CB-CD1 3.88Å; E396-I460 HydrophobicContact CB-CG1 4Å; L397-I460 HydrophobicContact CD2-CD1 4.28Å; L397-I460 HydrophobicContact CD2-CG1 4.14Å; L397-I460 HydrophobicContact CG-CD1 4.07Å; L397-I460 HydrophobicContact CG-CG1 4.35Å; F436-I460 HydrophobicContact CE1-CG2 3.7Å; L456-I460 HydrophobicContact CB-CG2 4.49Å; S457-I460 WeakPolarHBondContact O-CB 3.14Å; S457-I460 WeakPolarHBondContact O-CG2 3.27Å; S457-I460 PolarHBondContact O-N 3.09Å; L458-I460 PolarHBondContact O-N 3Å; I460-R462 PolarHBondContact O-N 2.8Å; I460-T463 HydrophobicContact CD1-CG2 4.44Å; I460-T463 WeakPolarHBondContact O-CB 3.46Å; I460-T463 WeakPolarHBondContact O-CG2 3.25Å; I460-T463 PolarHBondContact O-N 2.82Å; I460-T463 VanDerWaalsContact O-N 3.08Å; I460-T463 PolarHBondContact O-OG1 2.76Å; I460-A466 WeakPolarHBondContact O-CB 3.38Å
461	L	90.5	Very high	82.8	Confident	3 Å²	3	58 Å²	58	2%	0.016	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-68	-18.7	179.8	-63.9	178.7	0	0	0	112.8	L400 W419 V423 M426 F432 F436 L458 D459 T463	L400-L461 HydrophobicContact CD1-CD2 4.03Å; W419-L461 HydrophobicContact CH2-CD2 4.34Å; W419-L461 HydrophobicContact CZ2-CD2 4.4Å; W419-L461 WeakPolarHBondContact CZ2-O 3.23Å; W419-L461 PolarHBondContact NE1-O 3.4Å; W419-L461 VanDerWaalsContact NE1-O 3.16Å; V423-L461 HydrophobicContact CG1-CB 4.46Å; V423-L461 HydrophobicContact CG1-CD1 4.33Å; V423-L461 HydrophobicContact CG2-CB 4.21Å; M426-L461 HydrophobicContact CE-CD1 4.17Å; M426-L461 HydrophobicContact CE-CD2 3.84Å; F432-L461 HydrophobicContact CE2-CD1 3.87Å; F432-L461 HydrophobicContact CZ-CD1 3.95Å; F436-L461 HydrophobicContact CD1-CD1 4.32Å; F436-L461 HydrophobicContact CD1-CG 4.48Å; F436-L461 HydrophobicContact CE1-CD1 3.85Å; F436-L461 HydrophobicContact CE1-CD2 3.97Å; F436-L461 HydrophobicContact CE1-CG 3.71Å; F436-L461 HydrophobicContact CE2-CD1 4.39Å; F436-L461 HydrophobicContact CZ-CD1 3.91Å; F436-L461 HydrophobicContact CZ-CD2 3.76Å; F436-L461 HydrophobicContact CZ-CG 3.94Å; L458-L461 HydrophobicContact CD1-CD1 4.36Å; L458-L461 PolarHBondContact O-N 3.41Å; D459-L461 VanDerWaalsContact C-N 3.27Å; D459-L461 PolarHBondContact O-N 2.76Å; L461-T463 VanDerWaalsContact C-N 3.29Å
462	R	87.1	Confident	85	Confident	185 Å²	185	60.3 Å²	60.3	70%	0.698	31%	0.31	S	S	*	.	G	3₁₀ helix	trans	-85.7	2.4	175.5	-62.3	175.3	168.9	160.8	-8.1	113.2	D459 I460	D459-R462 PolarHBondContact O-N 3.36Å; D459-R462 IonicContact OD1-CZ 2.69Å; D459-R462 IonicContact OD1-NH1 3.77Å; D459-R462 PolarHBondContact OD1-NH1 3.39Å; I460-R462 PolarHBondContact O-N 2.8Å
463	T	89	Confident	86.8	Confident	14 Å²	14	58.4 Å²	58.4	9%	0.086	30%	0.297	C	S	.	.	S	Bend	trans	-89.5	139.6	177.6	67.5	0	0	0	0	111.1	I460 L461 E465 A466 E467	I460-T463 HydrophobicContact CD1-CG2 4.44Å; I460-T463 WeakPolarHBondContact O-CB 3.46Å; I460-T463 WeakPolarHBondContact O-CG2 3.25Å; I460-T463 PolarHBondContact O-N 2.82Å; I460-T463 VanDerWaalsContact O-N 3.08Å; I460-T463 PolarHBondContact O-OG1 2.76Å; L461-T463 VanDerWaalsContact C-N 3.29Å; T463-E465 WeakPolarHBondContact CB-OE2 3.37Å; T463-E465 PolarHBondContact O-N 2.81Å; T463-A466 WeakPolarHBondContact O-CB 3.44Å; T463-A466 PolarHBondContact O-N 3.23Å; T463-A466 WeakPolarHBondContact OG1-CB 3.34Å; T463-A466 PolarHBondContact OG1-N 3.01Å; T463-E467 PolarHBondContact O-N 2.79Å
464	P	90.7	Very high	88.5	Confident	86 Å²	86	57.3 Å²	57.3	56%	0.558	28%	0.276	S	S	*	.	H	α-helix	trans	-63.5	-24.1	173.6	27.2	-34.6	0	0	0	111.6	A466 E467 V468	P464-A466 VanDerWaalsContact C-N 3.32Å; P464-E467 PolarHBondContact O-N 3.17Å; P464-V468 WeakPolarHBondContact O-CB 3.46Å; P464-V468 VanDerWaalsContact O-CG2 3.31Å; P464-V468 WeakPolarHBondContact O-CG2 3.31Å; P464-V468 PolarHBondContact O-N 3.32Å
465	E	90.7	Very high	89.4	Confident	75 Å²	75	53.5 Å²	53.5	35%	0.35	26%	0.263	S	S	.	.	H	α-helix	trans	-63.9	-35	170.6	-58	98.9	124.4	0	0	112.6	R393 L397 T463 C469	R393-E465 IonicContact CZ-OE1 3.77Å; R393-E465 IonicContact NH1-OE1 3.14Å; R393-E465 PolarHBondContact NH1-OE1 2.72Å; R393-E465 IonicContact NH1-OE2 2.68Å; L397-E465 HydrophobicContact CD1-CB 3.62Å; L397-E465 HydrophobicContact CD1-CG 4.24Å; L397-E465 HydrophobicContact CD2-CB 4.06Å; T463-E465 WeakPolarHBondContact CB-OE2 3.37Å; T463-E465 PolarHBondContact O-N 2.81Å; E465-C469 VanDerWaalsContact O-CB 3.27Å; E465-C469 WeakPolarHBondContact O-CB 3.43Å; E465-C469 PolarHBondContact O-N 3.27Å
466	A	92.1	Very high	89.6	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-71.9	-39	173.6	0	0	0	0	0	112.1	L397 L400 W419 I460 T463 P464 C469 F470	L397-A466 HydrophobicContact CD2-CB 4.28Å; L400-A466 HydrophobicContact CD2-CB 3.55Å; W419-A466 HydrophobicContact CZ2-CB 4.18Å; I460-A466 WeakPolarHBondContact O-CB 3.38Å; T463-A466 WeakPolarHBondContact O-CB 3.44Å; T463-A466 PolarHBondContact O-N 3.23Å; T463-A466 WeakPolarHBondContact OG1-CB 3.34Å; T463-A466 PolarHBondContact OG1-N 3.01Å; P464-A466 VanDerWaalsContact C-N 3.32Å; A466-C469 CarbonylContact O-C 3.43Å; A466-C469 WeakPolarHBondContact O-CB 3.33Å; A466-C469 PolarHBondContact O-N 3.31Å; A466-F470 PolarHBondContact O-N 2.72Å
467	E	93.1	Very high	89.6	Confident	73 Å²	73	53.8 Å²	53.8	34%	0.341	27%	0.265	S	S	.	.	H	α-helix	trans	-63.3	-41.6	172.4	-177	176	-170.6	0	0	111.6	W419 T463 P464 C469 F470 H471	W419-E467 HydrophobicContact CB-CG 4.15Å; W419-E467 HydrophobicContact CD2-CB 4.17Å; W419-E467 HydrophobicContact CD2-CG 4.13Å; W419-E467 HydrophobicContact CG-CB 4.11Å; W419-E467 HydrophobicContact CG-CG 3.78Å; T463-E467 PolarHBondContact O-N 2.79Å; P464-E467 PolarHBondContact O-N 3.17Å; E467-C469 VanDerWaalsContact C-N 3.33Å; E467-F470 PolarHBondContact O-N 3.28Å; E467-H471 PolarHBondContact O-N 3.44Å; E467-H471 PolarHBondContact O-ND1 2.76Å; E467-H471 IonicContact OE1-CE1 2.72Å
468	V	92.3	Very high	89.7	Confident	76 Å²	76	57.6 Å²	57.6	46%	0.461	28%	0.281	S	S	.	.	H	α-helix	trans	-67.2	-34.5	173.1	169.4	0	0	0	0	111.5	P464 H471 K472	P464-V468 WeakPolarHBondContact O-CB 3.46Å; P464-V468 VanDerWaalsContact O-CG2 3.31Å; P464-V468 WeakPolarHBondContact O-CG2 3.31Å; P464-V468 PolarHBondContact O-N 3.32Å; V468-H471 PolarHBondContact O-N 2.8Å; V468-K472 HydrophobicContact CG1-CD 4.29Å; V468-K472 WeakPolarHBondContact O-CB 3.41Å; V468-K472 VanDerWaalsContact O-CG 3.28Å; V468-K472 WeakPolarHBondContact O-CG 3.2Å; V468-K472 PolarHBondContact O-N 2.82Å
469	C	92	Very high	89.5	Confident	23 Å²	23	59.3 Å²	59.3	16%	0.155	30%	0.299	C	S	.	.	H	α-helix	trans	-63.2	-44.5	172.1	-166.2	0	0	0	0	110.7	L400 E465 A466 E467 K472 H473	L400-C469 HydrophobicContact CD2-CB 4.02Å; E465-C469 VanDerWaalsContact O-CB 3.27Å; E465-C469 WeakPolarHBondContact O-CB 3.43Å; E465-C469 PolarHBondContact O-N 3.27Å; A466-C469 CarbonylContact O-C 3.43Å; A466-C469 WeakPolarHBondContact O-CB 3.33Å; A466-C469 PolarHBondContact O-N 3.31Å; E467-C469 VanDerWaalsContact C-N 3.33Å; C469-K472 PolarHBondContact O-N 3.23Å; C469-H473 WeakPolarHBondContact O-CB 3.47Å; C469-H473 PolarHBondContact O-N 3.09Å
470	F	91.6	Very high	89.4	Confident	11 Å²	11	59.4 Å²	59.4	5%	0.048	30%	0.296	C	S	.	.	H	α-helix	trans	-63.7	-45.1	173.6	170.5	-103.2	0	0	0	112.6	L404 I408 C414 W419 I422 A466 E467 K472 H473 F474	L404-F470 HydrophobicContact CD1-CB 4.37Å; L404-F470 HydrophobicContact CD2-CD2 4.41Å; I408-F470 HydrophobicContact CD1-CD2 4.33Å; I408-F470 HydrophobicContact CD1-CE2 4.01Å; C414-F470 HydrophobicContact CB-CZ 4.06Å; W419-F470 HydrophobicContact CE3-CB 3.83Å; W419-F470 AromaticContact CE3-CD1 3.53Å; W419-F470 HydrophobicContact CE3-CD1 3.53Å; W419-F470 HydrophobicContact CE3-CD2 4.43Å; W419-F470 HydrophobicContact CE3-CE1 4.24Å; W419-F470 AromaticContact CE3-CG 3.64Å; W419-F470 HydrophobicContact CE3-CG 3.64Å; W419-F470 HydrophobicContact CH2-CB 3.66Å; W419-F470 HydrophobicContact CH2-CG 4.21Å; W419-F470 HydrophobicContact CZ3-CB 3.21Å; W419-F470 AromaticContact CZ3-CD1 3.71Å; W419-F470 HydrophobicContact CZ3-CD1 3.71Å; W419-F470 AromaticContact CZ3-CD2 3.83Å; W419-F470 HydrophobicContact CZ3-CD2 3.83Å; W419-F470 AromaticContact CZ3-CG 3.26Å; W419-F470 HydrophobicContact CZ3-CG 3.26Å; I422-F470 HydrophobicContact CB-CZ 4.43Å; I422-F470 HydrophobicContact CD1-CZ 4.29Å; I422-F470 HydrophobicContact CG1-CE1 4.08Å; I422-F470 HydrophobicContact CG1-CE2 4.43Å; I422-F470 HydrophobicContact CG1-CZ 3.79Å; I422-F470 HydrophobicContact CG2-CD2 4.04Å; I422-F470 HydrophobicContact CG2-CE1 4.39Å; I422-F470 HydrophobicContact CG2-CE2 3.72Å; I422-F470 HydrophobicContact CG2-CZ 3.91Å; A466-F470 PolarHBondContact O-N 2.72Å; E467-F470 PolarHBondContact O-N 3.28Å; F470-K472 VanDerWaalsContact C-N 3.27Å; F470-K472 PolarHBondContact O-N 2.74Å; F470-H473 CarbonylContact O-C 3.49Å; F470-H473 WeakPolarHBondContact O-CA 3.23Å; F470-H473 WeakPolarHBondContact O-CB 3.27Å; F470-H473 PolarHBondContact O-N 2.77Å; F470-H473 VanDerWaalsContact O-N 3.08Å; F470-F474 HydrophobicContact CE1-CB 4.32Å; F470-F474 HydrophobicContact CE2-CB 4.24Å; F470-F474 HydrophobicContact CZ-CB 4.01Å; F470-F474 HydrophobicContact CZ-CD2 4.26Å; F470-F474 HydrophobicContact CZ-CG 4.29Å; F470-F474 VanDerWaalsContact O-CB 3.32Å; F470-F474 WeakPolarHBondContact O-CB 3.18Å; F470-F474 PolarHBondContact O-N 2.82Å
471	H	90.8	Very high	89.1	Confident	97 Å²	97	60.4 Å²	60.4	45%	0.449	30%	0.303	S	S	.	.	H	α-helix	trans	-62.9	-34.5	176.6	-77.5	90.3	0	0	0	112.1	E467 V468 A475	E467-H471 PolarHBondContact O-N 3.44Å; E467-H471 PolarHBondContact O-ND1 2.76Å; E467-H471 IonicContact OE1-CE1 2.72Å; V468-H471 PolarHBondContact O-N 2.8Å; H471-A475 WeakPolarHBondContact O-CB 3.2Å; H471-A475 PolarHBondContact O-N 3.34Å
472	K	90.4	Very high	88.8	Confident	147 Å²	147	62.3 Å²	62.3	64%	0.639	32%	0.319	S	S	*	.	H	α-helix	trans	-68.3	-40.3	170.7	-73.9	171.5	-178.2	176.7	0	112.3	V468 C469 F470 Y476	V468-K472 HydrophobicContact CG1-CD 4.29Å; V468-K472 WeakPolarHBondContact O-CB 3.41Å; V468-K472 VanDerWaalsContact O-CG 3.28Å; V468-K472 WeakPolarHBondContact O-CG 3.2Å; V468-K472 PolarHBondContact O-N 2.82Å; C469-K472 PolarHBondContact O-N 3.23Å; F470-K472 VanDerWaalsContact C-N 3.27Å; F470-K472 PolarHBondContact O-N 2.74Å; K472-Y476 WeakPolarHBondContact O-CB 3.16Å; K472-Y476 PolarHBondContact O-N 3.22Å
473	H	90.2	Very high	88.7	Confident	14 Å²	14	58.9 Å²	58.9	7%	0.065	31%	0.306	C	S	.	.	H	α-helix	trans	-64.7	-46.3	175.4	-179.9	75.1	0	0	0	111.3	L404 I408 C469 F470 Y476 L477	L404-H473 HydrophobicContact CD1-CB 4.02Å; L404-H473 PolarHBondContact O-NE2 2.76Å; I408-H473 PolarHBondContact O-NE2 3.33Å; C469-H473 WeakPolarHBondContact O-CB 3.47Å; C469-H473 PolarHBondContact O-N 3.09Å; F470-H473 CarbonylContact O-C 3.49Å; F470-H473 WeakPolarHBondContact O-CA 3.23Å; F470-H473 WeakPolarHBondContact O-CB 3.27Å; F470-H473 PolarHBondContact O-N 2.77Å; F470-H473 VanDerWaalsContact O-N 3.08Å; H473-Y476 CarbonylContact O-C 3.48Å; H473-Y476 WeakPolarHBondContact O-CB 3.28Å; H473-Y476 PolarHBondContact O-N 2.71Å; H473-L477 WeakPolarHBondContact O-CG 3.35Å; H473-L477 PolarHBondContact O-N 2.82Å
474	F	90.2	Very high	88.4	Confident	34 Å²	34	63.3 Å²	63.3	15%	0.149	33%	0.326	C	S	.	.	H	α-helix	trans	-64.4	-48.2	176.3	-177	-102.6	0	0	0	111.1	C414 F470 Y476 L477 E478	C414-F474 HydrophobicContact CB-CD2 3.73Å; C414-F474 HydrophobicContact CB-CE2 3.64Å; F470-F474 HydrophobicContact CE1-CB 4.32Å; F470-F474 HydrophobicContact CE2-CB 4.24Å; F470-F474 HydrophobicContact CZ-CB 4.01Å; F470-F474 HydrophobicContact CZ-CD2 4.26Å; F470-F474 HydrophobicContact CZ-CG 4.29Å; F470-F474 VanDerWaalsContact O-CB 3.32Å; F470-F474 WeakPolarHBondContact O-CB 3.18Å; F470-F474 PolarHBondContact O-N 2.82Å; F474-Y476 VanDerWaalsContact C-N 3.26Å; F474-Y476 PolarHBondContact O-N 3.08Å; F474-L477 CarbonylContact O-C 3.22Å; F474-L477 PolarHBondContact O-N 3.3Å; F474-L477 VanDerWaalsContact O-N 3.09Å; F474-E478 HydrophobicContact CD1-CG 4.16Å; F474-E478 HydrophobicContact CE1-CG 3.73Å; F474-E478 WeakPolarHBondContact CE1-OE1 3.47Å; F474-E478 WeakPolarHBondContact CE1-OE2 3.25Å; F474-E478 HydrophobicContact CE2-CG 4.23Å; F474-E478 VanDerWaalsContact CZ-CD 3.48Å; F474-E478 HydrophobicContact CZ-CG 3.76Å; F474-E478 WeakPolarHBondContact CZ-OE1 3.4Å; F474-E478 WeakPolarHBondContact O-CB 3.44Å; F474-E478 WeakPolarHBondContact O-CG 3.47Å; F474-E478 PolarHBondContact O-N 3.21Å
475	A	87.5	Confident	88.1	Confident	50 Å²	50	67 Å²	67	41%	0.413	33%	0.328	S	S	.	.	H	α-helix	trans	-62.9	-31.6	173.1	0	0	0	0	0	112.5	H471 A479	H471-A475 WeakPolarHBondContact O-CB 3.2Å; H471-A475 PolarHBondContact O-N 3.34Å; A475-A479 WeakPolarHBondContact O-CB 3.25Å; A475-A479 PolarHBondContact O-N 3.21Å
476	Y	88.3	Confident	88	Confident	124 Å²	124	65.2 Å²	65.2	49%	0.486	32%	0.321	S	S	.	.	H	α-helix	trans	-68.6	-42.1	170.5	163.8	-105.3	0	0	0	111.8	M405 K472 H473 F474 K480	M405-Y476 HydrophobicContact SD-CE1 4.18Å; K472-Y476 WeakPolarHBondContact O-CB 3.16Å; K472-Y476 PolarHBondContact O-N 3.22Å; H473-Y476 CarbonylContact O-C 3.48Å; H473-Y476 WeakPolarHBondContact O-CB 3.28Å; H473-Y476 PolarHBondContact O-N 2.71Å; F474-Y476 VanDerWaalsContact C-N 3.26Å; F474-Y476 PolarHBondContact O-N 3.08Å; Y476-K480 HydrophobicContact CE1-CD 4.39Å; Y476-K480 WeakPolarHBondContact O-CA 3.21Å; Y476-K480 WeakPolarHBondContact O-CB 3.4Å; Y476-K480 PolarHBondContact O-N 2.99Å
477	L	87.1	Confident	87.7	Confident	4 Å²	4	67 Å²	67	2%	0.021	33%	0.33	C	S	.	.	H	α-helix	trans	-65.9	-44.4	174.7	-70.3	-179.8	0	0	0	111.2	I408 H473 F474 K480 C481	I408-L477 HydrophobicContact CG2-CD1 4.47Å; H473-L477 WeakPolarHBondContact O-CG 3.35Å; H473-L477 PolarHBondContact O-N 2.82Å; F474-L477 CarbonylContact O-C 3.22Å; F474-L477 PolarHBondContact O-N 3.3Å; F474-L477 VanDerWaalsContact O-N 3.09Å; L477-K480 PolarHBondContact O-N 3.16Å; L477-C481 VanDerWaalsContact O-CB 3.3Å; L477-C481 WeakPolarHBondContact O-CB 3.46Å; L477-C481 PolarHBondContact O-N 3.24Å; L477-C481 PolarHBondContact O-SG 2.81Å
478	E	87.2	Confident	87	Confident	92 Å²	92	66.1 Å²	66.1	43%	0.43	33%	0.333	S	S	.	.	H	α-helix	trans	-63.7	-47.3	174.7	-74.3	-165.8	126	0	0	111.5	F474 K480 C481 A482	F474-E478 HydrophobicContact CD1-CG 4.16Å; F474-E478 HydrophobicContact CE1-CG 3.73Å; F474-E478 WeakPolarHBondContact CE1-OE1 3.47Å; F474-E478 WeakPolarHBondContact CE1-OE2 3.25Å; F474-E478 HydrophobicContact CE2-CG 4.23Å; F474-E478 VanDerWaalsContact CZ-CD 3.48Å; F474-E478 HydrophobicContact CZ-CG 3.76Å; F474-E478 WeakPolarHBondContact CZ-OE1 3.4Å; F474-E478 WeakPolarHBondContact O-CB 3.44Å; F474-E478 WeakPolarHBondContact O-CG 3.47Å; F474-E478 PolarHBondContact O-N 3.21Å; E478-K480 VanDerWaalsContact C-N 3.31Å; E478-K480 PolarHBondContact O-N 3.08Å; E478-C481 PolarHBondContact O-N 3.21Å; E478-A482 WeakPolarHBondContact O-CB 3.19Å; E478-A482 PolarHBondContact O-N 3.09Å
479	A	83.8	Confident	86.7	Confident	59 Å²	59	65.7 Å²	65.7	49%	0.488	33%	0.328	S	S	.	.	H	α-helix	trans	-64.9	-35.6	175.6	0	0	0	0	0	111.6	A475 R483	A475-A479 WeakPolarHBondContact O-CB 3.25Å; A475-A479 PolarHBondContact O-N 3.21Å; A479-R483 WeakPolarHBondContact O-CA 3.49Å; A479-R483 WeakPolarHBondContact O-CB 3.33Å; A479-R483 PolarHBondContact O-N 3.36Å
480	K	82.5	Confident	86.6	Confident	75 Å²	75	64.6 Å²	64.6	33%	0.326	32%	0.32	S	S	.	.	H	α-helix	trans	-66.4	-43.7	173.5	-179.9	-178.4	176.8	-172.9	0	111	Y476 L477 E478 Q484	Y476-K480 HydrophobicContact CE1-CD 4.39Å; Y476-K480 WeakPolarHBondContact O-CA 3.21Å; Y476-K480 WeakPolarHBondContact O-CB 3.4Å; Y476-K480 PolarHBondContact O-N 2.99Å; L477-K480 PolarHBondContact O-N 3.16Å; E478-K480 VanDerWaalsContact C-N 3.31Å; E478-K480 PolarHBondContact O-N 3.08Å; K480-Q484 VanDerWaalsContact O-CB 3.22Å; K480-Q484 WeakPolarHBondContact O-CB 3.24Å; K480-Q484 WeakPolarHBondContact O-CG 3.43Å; K480-Q484 PolarHBondContact O-N 2.83Å
481	C	84.1	Confident	86.1	Confident	26 Å²	26	65.9 Å²	65.9	18%	0.176	33%	0.331	C	S	.	.	H	α-helix	trans	-68.5	-43.9	176.2	-72.9	0	0	0	0	112.1	L477 E478 Q484 R485	L477-C481 VanDerWaalsContact O-CB 3.3Å; L477-C481 WeakPolarHBondContact O-CB 3.46Å; L477-C481 PolarHBondContact O-N 3.24Å; L477-C481 PolarHBondContact O-SG 2.81Å; E478-C481 PolarHBondContact O-N 3.21Å; C481-Q484 PolarHBondContact O-N 2.69Å; C481-R485 VanDerWaalsContact O-CG 3.31Å; C481-R485 WeakPolarHBondContact O-CG 3.46Å; C481-R485 PolarHBondContact O-N 3.19Å
482	A	84.4	Confident	85.7	Confident	43 Å²	43	66.6 Å²	66.6	36%	0.355	33%	0.334	S	S	.	.	H	α-helix	trans	-66.1	-44.2	176.7	0	0	0	0	0	111	E478 R485 L486	E478-A482 WeakPolarHBondContact O-CB 3.19Å; E478-A482 PolarHBondContact O-N 3.09Å; A482-R485 WeakPolarHBondContact O-CB 3.14Å; A482-R485 PolarHBondContact O-N 3.35Å; A482-L486 VanDerWaalsContact O-CG 3.31Å; A482-L486 WeakPolarHBondContact O-CG 3.22Å; A482-L486 PolarHBondContact O-N 3.26Å
483	R	83.9	Confident	85.5	Confident	113 Å²	113	60.9 Å²	60.9	43%	0.426	31%	0.311	S	S	.	.	H	α-helix	trans	-58.4	-49.5	169.2	179.1	-175.1	170.5	89.6	5.7	110.5	A479 R485 L486 L487 D526	A479-R483 WeakPolarHBondContact O-CA 3.49Å; A479-R483 WeakPolarHBondContact O-CB 3.33Å; A479-R483 PolarHBondContact O-N 3.36Å; R483-R485 VanDerWaalsContact C-N 3.28Å; R483-R485 PolarHBondContact O-N 2.66Å; R483-L486 CarbonylContact O-C 3.56Å; R483-L486 PolarHBondContact O-N 3.11Å; R483-L487 HydrophobicContact CG-CD1 3.77Å; R483-L487 HydrophobicContact CG-CG 4.04Å; R483-L487 WeakPolarHBondContact O-CB 3.43Å; R483-L487 WeakPolarHBondContact O-CG 3.31Å; R483-L487 PolarHBondContact O-N 3.25Å; R483-D526 IonicContact CZ-OD1 2.97Å; R483-D526 VanDerWaalsContact CZ-OD1 3.25Å; R483-D526 IonicContact CZ-OD2 3.35Å; R483-D526 IonicContact NH1-OD1 3.71Å; R483-D526 PolarHBondContact NH1-OD1 3.29Å; R483-D526 IonicContact NH1-OD2 2.71Å; R483-D526 PolarHBondContact NH1-OD2 3.11Å; R483-D526 IonicContact NH2-OD1 3.54Å; R483-D526 PolarHBondContact NH2-OD1 3.33Å; R483-D526 IonicContact NH2-OD2 3.71Å
484	Q	82.5	Confident	85.3	Confident	108 Å²	108	60.3 Å²	60.3	51%	0.505	31%	0.308	S	S	.	.	H	α-helix	trans	-58.7	-38.1	177.1	-80.6	174.5	-24.4	0	0	112.6	K480 C481 S488	K480-Q484 VanDerWaalsContact O-CB 3.22Å; K480-Q484 WeakPolarHBondContact O-CB 3.24Å; K480-Q484 WeakPolarHBondContact O-CG 3.43Å; K480-Q484 PolarHBondContact O-N 2.83Å; C481-Q484 PolarHBondContact O-N 2.69Å; Q484-S488 WeakPolarHBondContact O-CB 3.3Å; Q484-S488 PolarHBondContact O-N 3.48Å
485	R	86	Confident	84.5	Confident	162 Å²	162	61.2 Å²	61.2	61%	0.611	32%	0.322	S	S	*	.	H	α-helix	trans	-62	-56.9	169.7	-70.8	170.9	-166.8	154.1	5.9	110.7	C481 A482 R483 L487 S488 D489	C481-R485 VanDerWaalsContact O-CG 3.31Å; C481-R485 WeakPolarHBondContact O-CG 3.46Å; C481-R485 PolarHBondContact O-N 3.19Å; A482-R485 WeakPolarHBondContact O-CB 3.14Å; A482-R485 PolarHBondContact O-N 3.35Å; R483-R485 VanDerWaalsContact C-N 3.28Å; R483-R485 PolarHBondContact O-N 2.66Å; R485-L487 VanDerWaalsContact C-N 3.31Å; R485-L487 PolarHBondContact O-N 2.84Å; R485-S488 CarbonylContact O-C 3.58Å; R485-S488 WeakPolarHBondContact O-CA 3.42Å; R485-S488 WeakPolarHBondContact O-CB 2.94Å; R485-S488 PolarHBondContact O-N 2.96Å; R485-D489 WeakPolarHBondContact O-CB 3.34Å; R485-D489 PolarHBondContact O-N 3.4Å
486	L	87.2	Confident	84.1	Confident	39 Å²	39	65.3 Å²	65.3	20%	0.204	34%	0.337	C	S	.	.	H	α-helix	trans	-56	-39.3	178	-66.4	172.1	0	0	0	113.1	A482 R483 F490 P518 L522	A482-L486 VanDerWaalsContact O-CG 3.31Å; A482-L486 WeakPolarHBondContact O-CG 3.22Å; A482-L486 PolarHBondContact O-N 3.26Å; R483-L486 CarbonylContact O-C 3.56Å; R483-L486 PolarHBondContact O-N 3.11Å; L486-F490 WeakPolarHBondContact O-CB 3.39Å; L486-F490 PolarHBondContact O-N 2.76Å; L486-P518 HydrophobicContact CB-CB 3.97Å; L486-P518 HydrophobicContact CD2-CB 3.47Å; L486-P518 VanDerWaalsContact CD2-CB 3.47Å; L486-P518 HydrophobicContact CG-CB 4.31Å; L486-P518 VanDerWaalsContact O-CG 3.24Å; L486-P518 WeakPolarHBondContact O-CG 3.39Å; L486-L522 HydrophobicContact CB-CD2 3.72Å; L486-L522 HydrophobicContact CB-CG 4.04Å; L486-L522 HydrophobicContact CD1-CD2 4.43Å
487	L	85.4	Confident	83.7	Confident	36 Å²	36	59.9 Å²	59.9	19%	0.188	32%	0.317	C	S	.	.	H	α-helix	trans	-68.6	-39.6	175.7	-61.2	170.1	0	0	0	111.4	R483 R485 S491 L522 D526 V530	R483-L487 HydrophobicContact CG-CD1 3.77Å; R483-L487 HydrophobicContact CG-CG 4.04Å; R483-L487 WeakPolarHBondContact O-CB 3.43Å; R483-L487 WeakPolarHBondContact O-CG 3.31Å; R483-L487 PolarHBondContact O-N 3.25Å; R485-L487 VanDerWaalsContact C-N 3.31Å; R485-L487 PolarHBondContact O-N 2.84Å; L487-S491 WeakPolarHBondContact O-CB 3.18Å; L487-S491 PolarHBondContact O-N 3.07Å; L487-S491 PolarHBondContact O-OG 3.5Å; L487-L522 HydrophobicContact CD2-CD1 4.06Å; L487-L522 HydrophobicContact CD2-CD2 3.69Å; L487-L522 HydrophobicContact CG-CD2 4.2Å; L487-D526 HydrophobicContact CD2-CB 4.03Å; L487-V530 HydrophobicContact CB-CG2 3.99Å; L487-V530 HydrophobicContact CD2-CG2 3.3Å; L487-V530 HydrophobicContact CG-CG2 4.13Å
488	S	79.7	Confident	83.1	Confident	56 Å²	56	65.3 Å²	65.3	39%	0.392	36%	0.355	S	S	.	.	H	α-helix	trans	-64.1	-49.7	172.6	162.8	0	0	0	0	111.1	Q484 R485 F490 S491 Q492	Q484-S488 WeakPolarHBondContact O-CB 3.3Å; Q484-S488 PolarHBondContact O-N 3.48Å; R485-S488 CarbonylContact O-C 3.58Å; R485-S488 WeakPolarHBondContact O-CA 3.42Å; R485-S488 WeakPolarHBondContact O-CB 2.94Å; R485-S488 PolarHBondContact O-N 2.96Å; S488-F490 VanDerWaalsContact C-N 3.25Å; S488-F490 PolarHBondContact O-N 3.4Å; S488-S491 CarbonylContact O-C 3.57Å; S488-S491 WeakPolarHBondContact O-CA 3.43Å; S488-S491 VanDerWaalsContact O-CB 3.28Å; S488-S491 WeakPolarHBondContact O-CB 3.32Å; S488-S491 PolarHBondContact O-N 3.33Å; S488-S491 VanDerWaalsContact O-N 3.09Å; S488-Q492 WeakPolarHBondContact O-CG 3.41Å; S488-Q492 PolarHBondContact O-N 2.76Å
489	D	86.1	Confident	82.7	Confident	66 Å²	66	64.3 Å²	64.3	35%	0.353	35%	0.35	S	S	.	.	H	α-helix	trans	-67.3	-29.1	-179.4	-60.4	-17.9	0	0	0	110.5	R485 Q492 L493 P518	R485-D489 WeakPolarHBondContact O-CB 3.34Å; R485-D489 PolarHBondContact O-N 3.4Å; D489-Q492 PolarHBondContact O-N 3.16Å; D489-L493 VanDerWaalsContact O-CB 3.28Å; D489-L493 WeakPolarHBondContact O-CB 3.46Å; D489-L493 PolarHBondContact O-N 3.36Å; D489-P518 HydrophobicContact CB-CG 3.95Å
490	F	89.4	Confident	82.1	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-73.4	-39.7	172.9	-168.7	-134.2	0	0	0	110.2	L486 S488 Q492 L493 L494 L513 P518 F519 L522 L527 V530	L486-F490 WeakPolarHBondContact O-CB 3.39Å; L486-F490 PolarHBondContact O-N 2.76Å; S488-F490 VanDerWaalsContact C-N 3.25Å; S488-F490 PolarHBondContact O-N 3.4Å; F490-Q492 VanDerWaalsContact C-N 3.28Å; F490-Q492 PolarHBondContact O-N 2.91Å; F490-L493 HydrophobicContact CD2-CB 4.31Å; F490-L493 HydrophobicContact CD2-CD2 3.96Å; F490-L493 HydrophobicContact CE2-CD2 4.17Å; F490-L493 WeakPolarHBondContact O-CB 3.41Å; F490-L493 PolarHBondContact O-N 3.09Å; F490-L493 VanDerWaalsContact O-N 3.17Å; F490-L494 HydrophobicContact CD1-CD1 4.04Å; F490-L494 HydrophobicContact CD2-CG 4.25Å; F490-L494 HydrophobicContact CE1-CD1 3.71Å; F490-L494 HydrophobicContact CE1-CG 4.24Å; F490-L494 HydrophobicContact CE2-CD1 4.33Å; F490-L494 HydrophobicContact CE2-CD2 3.9Å; F490-L494 HydrophobicContact CE2-CG 3.94Å; F490-L494 HydrophobicContact CG-CD1 4.46Å; F490-L494 HydrophobicContact CG-CG 4.5Å; F490-L494 HydrophobicContact CZ-CD1 3.86Å; F490-L494 HydrophobicContact CZ-CD2 3.8Å; F490-L494 HydrophobicContact CZ-CG 3.93Å; F490-L494 WeakPolarHBondContact O-CB 2.94Å; F490-L494 WeakPolarHBondContact O-CG 3.4Å; F490-L494 PolarHBondContact O-N 3.37Å; F490-L513 HydrophobicContact CE2-CD1 4.21Å; F490-L513 HydrophobicContact CZ-CD1 4.24Å; F490-P518 VanDerWaalsContact CA-CG 3.42Å; F490-P518 HydrophobicContact CB-CG 3.54Å; F490-P518 HydrophobicContact CD2-CG 4.25Å; F490-P518 HydrophobicContact CG-CG 4.31Å; F490-F519 HydrophobicContact CD2-CB 4.29Å; F490-F519 HydrophobicContact CE2-CB 3.87Å; F490-F519 AromaticContact CE2-CD2 3.73Å; F490-F519 HydrophobicContact CE2-CD2 3.73Å; F490-F519 HydrophobicContact CE2-CG 4.29Å; F490-F519 AromaticContact CZ-CD2 3.85Å; F490-F519 HydrophobicContact CZ-CD2 3.85Å; F490-L522 HydrophobicContact CB-CD1 3.63Å; F490-L522 HydrophobicContact CD1-CD1 3.89Å; F490-L522 HydrophobicContact CG-CD1 3.88Å; F490-L527 HydrophobicContact CD1-CD2 4.05Å; F490-L527 HydrophobicContact CD2-CD2 4.38Å; F490-L527 HydrophobicContact CE1-CB 4.31Å; F490-L527 HydrophobicContact CE1-CD2 3.69Å; F490-L527 WeakPolarHBondContact CE1-O 3.23Å; F490-L527 HydrophobicContact CE2-CD2 4.06Å; F490-L527 HydrophobicContact CG-CD2 4.42Å; F490-L527 HydrophobicContact CZ-CD2 3.71Å; F490-V530 HydrophobicContact CB-CG1 4.23Å; F490-V530 HydrophobicContact CD1-CB 3.75Å; F490-V530 HydrophobicContact CD1-CG1 3.51Å; F490-V530 HydrophobicContact CE1-CB 4.29Å; F490-V530 HydrophobicContact CE1-CG1 4.28Å; F490-V530 HydrophobicContact CG-CG1 4.28Å
491	S	81.2	Confident	81.1	Confident	39 Å²	39	61 Å²	61	27%	0.273	33%	0.331	S	S	.	.	H	α-helix	trans	-60.2	-39	170.9	-56.7	0	0	0	0	111.5	L487 S488 A495 V530 Y534	L487-S491 WeakPolarHBondContact O-CB 3.18Å; L487-S491 PolarHBondContact O-N 3.07Å; L487-S491 PolarHBondContact O-OG 3.5Å; S488-S491 CarbonylContact O-C 3.57Å; S488-S491 WeakPolarHBondContact O-CA 3.43Å; S488-S491 VanDerWaalsContact O-CB 3.28Å; S488-S491 WeakPolarHBondContact O-CB 3.32Å; S488-S491 PolarHBondContact O-N 3.33Å; S488-S491 VanDerWaalsContact O-N 3.09Å; S491-A495 WeakPolarHBondContact O-CB 3.01Å; S491-A495 PolarHBondContact O-N 2.87Å; S491-V530 WeakPolarHBondContact OG-CG1 3.06Å; S491-Y534 WeakPolarHBondContact O-CD2 3.49Å; S491-Y534 WeakPolarHBondContact O-CE2 3.34Å
492	Q	81.9	Confident	79.6	Confident	111 Å²	111	62.4 Å²	62.4	52%	0.519	34%	0.339	S	S	.	.	H	α-helix	trans	-68.4	-40.7	171.9	-66.6	-175.2	26.9	0	0	112.4	S488 D489 F490 L494 A495 N496	S488-Q492 WeakPolarHBondContact O-CG 3.41Å; S488-Q492 PolarHBondContact O-N 2.76Å; D489-Q492 PolarHBondContact O-N 3.16Å; F490-Q492 VanDerWaalsContact C-N 3.28Å; F490-Q492 PolarHBondContact O-N 2.91Å; Q492-L494 VanDerWaalsContact C-N 3.31Å; Q492-L494 PolarHBondContact O-N 2.89Å; Q492-A495 WeakPolarHBondContact O-CB 3.47Å; Q492-A495 PolarHBondContact O-N 3.34Å; Q492-N496 WeakPolarHBondContact O-CB 3.37Å; Q492-N496 VanDerWaalsContact O-CG 3.27Å; Q492-N496 PolarHBondContact O-N 3.23Å; Q492-N496 PolarHBondContact O-ND2 2.94Å
493	L	86.2	Confident	78.6	Confident	28 Å²	28	61.6 Å²	61.6	15%	0.147	34%	0.336	C	S	.	.	H	α-helix	trans	-61.5	-42	177.3	-173.6	71.4	0	0	0	111.3	D489 F490 N496 C497 L513 K516 F519	D489-L493 VanDerWaalsContact O-CB 3.28Å; D489-L493 WeakPolarHBondContact O-CB 3.46Å; D489-L493 PolarHBondContact O-N 3.36Å; F490-L493 HydrophobicContact CD2-CB 4.31Å; F490-L493 HydrophobicContact CD2-CD2 3.96Å; F490-L493 HydrophobicContact CE2-CD2 4.17Å; F490-L493 WeakPolarHBondContact O-CB 3.41Å; F490-L493 PolarHBondContact O-N 3.09Å; F490-L493 VanDerWaalsContact O-N 3.17Å; L493-N496 PolarHBondContact O-N 3.44Å; L493-C497 VanDerWaalsContact O-CB 3.25Å; L493-C497 WeakPolarHBondContact O-CB 3.11Å; L493-C497 PolarHBondContact O-N 3.42Å; L493-L513 HydrophobicContact CD2-CD2 4.15Å; L493-L513 HydrophobicContact CG-CD2 4.31Å; L493-K516 HydrophobicContact CD1-CB 4.11Å; L493-K516 HydrophobicContact CD1-CD 3.72Å; L493-K516 HydrophobicContact CD2-CB 3.93Å; L493-K516 HydrophobicContact CD2-CD 4.44Å; L493-F519 HydrophobicContact CD2-CB 4.04Å
494	L	85.6	Confident	78.1	Confident	1 Å²	1	58.2 Å²	58.2	1%	0.005	32%	0.324	C	S	.	.	H	α-helix	trans	-68.2	-37.9	175.3	-66.8	177.1	0	0	0	111.8	F490 Q492 N496 C497 V500 L513 Y531 Y534	F490-L494 HydrophobicContact CD1-CD1 4.04Å; F490-L494 HydrophobicContact CD2-CG 4.25Å; F490-L494 HydrophobicContact CE1-CD1 3.71Å; F490-L494 HydrophobicContact CE1-CG 4.24Å; F490-L494 HydrophobicContact CE2-CD1 4.33Å; F490-L494 HydrophobicContact CE2-CD2 3.9Å; F490-L494 HydrophobicContact CE2-CG 3.94Å; F490-L494 HydrophobicContact CG-CD1 4.46Å; F490-L494 HydrophobicContact CG-CG 4.5Å; F490-L494 HydrophobicContact CZ-CD1 3.86Å; F490-L494 HydrophobicContact CZ-CD2 3.8Å; F490-L494 HydrophobicContact CZ-CG 3.93Å; F490-L494 WeakPolarHBondContact O-CB 2.94Å; F490-L494 WeakPolarHBondContact O-CG 3.4Å; F490-L494 PolarHBondContact O-N 3.37Å; Q492-L494 VanDerWaalsContact C-N 3.31Å; Q492-L494 PolarHBondContact O-N 2.89Å; L494-N496 VanDerWaalsContact C-N 3.3Å; L494-N496 PolarHBondContact O-N 3.29Å; L494-C497 PolarHBondContact O-N 3.1Å; L494-V500 HydrophobicContact CB-CG1 4.41Å; L494-V500 HydrophobicContact CB-CG2 4.45Å; L494-V500 HydrophobicContact CD2-CG1 4.39Å; L494-V500 HydrophobicContact CD2-CG2 3.69Å; L494-L513 HydrophobicContact CD2-CD1 3.66Å; L494-L513 HydrophobicContact CD2-CD2 3.93Å; L494-L513 HydrophobicContact CD2-CG 4.47Å; L494-Y531 HydrophobicContact CD1-CD2 3.83Å; L494-Y531 HydrophobicContact CD1-CG 4.48Å; L494-Y531 HydrophobicContact CD2-CD2 3.62Å; L494-Y531 HydrophobicContact CD2-CE2 4.01Å; L494-Y531 HydrophobicContact CG-CD2 4.39Å; L494-Y534 HydrophobicContact CB-CD1 3.36Å; L494-Y534 HydrophobicContact CB-CD2 4.22Å; L494-Y534 HydrophobicContact CB-CE1 3.6Å; L494-Y534 HydrophobicContact CB-CE2 4.45Å; L494-Y534 HydrophobicContact CB-CG 3.73Å; L494-Y534 HydrophobicContact CD1-CD1 3.87Å; L494-Y534 HydrophobicContact CD1-CG 3.74Å; L494-Y534 HydrophobicContact CG-CD1 4.25Å; L494-Y534 HydrophobicContact CG-CG 4.41Å
495	A	75	Confident	77.8	Confident	54 Å²	54	55.3 Å²	55.3	45%	0.446	31%	0.314	S	S	.	.	H	α-helix	trans	-61.9	-36.9	172.6	0	0	0	0	0	113.2	S491 Q492 Y534	S491-A495 WeakPolarHBondContact O-CB 3.01Å; S491-A495 PolarHBondContact O-N 2.87Å; Q492-A495 WeakPolarHBondContact O-CB 3.47Å; Q492-A495 PolarHBondContact O-N 3.34Å; A495-Y534 WeakPolarHBondContact CA-OH 3.34Å; A495-Y534 HydrophobicContact CB-CE2 4.11Å; A495-Y534 WeakPolarHBondContact CB-OH 3.37Å
496	N	78.2	Confident	77.6	Confident	135 Å²	135	47.6 Å²	47.6	72%	0.722	29%	0.285	S	S	*	.	H	α-helix	trans	-84.4	-8.4	179.4	-65.9	-28.4	0	0	0	113.2	Q492 L493 L494	Q492-N496 WeakPolarHBondContact O-CB 3.37Å; Q492-N496 VanDerWaalsContact O-CG 3.27Å; Q492-N496 PolarHBondContact O-N 3.23Å; Q492-N496 PolarHBondContact O-ND2 2.94Å; L493-N496 PolarHBondContact O-N 3.44Å; L494-N496 VanDerWaalsContact C-N 3.3Å; L494-N496 PolarHBondContact O-N 3.29Å
497	C	79.9	Confident	77.5	Confident	11 Å²	11	49.3 Å²	49.3	7%	0.074	30%	0.301	C	S	.	.			trans	-96.7	95.6	-177.4	-171.2	0	0	0	0	111.5	L493 L494 Q499 V500 L513	L493-C497 VanDerWaalsContact O-CB 3.25Å; L493-C497 WeakPolarHBondContact O-CB 3.11Å; L493-C497 PolarHBondContact O-N 3.42Å; L494-C497 PolarHBondContact O-N 3.1Å; C497-Q499 PolarHBondContact O-N 3.07Å; C497-V500 HydrophobicContact CB-CG2 3.66Å; C497-V500 VanDerWaalsContact O-CB 3.25Å; C497-V500 WeakPolarHBondContact O-CB 3.47Å; C497-V500 WeakPolarHBondContact O-CG2 3.36Å; C497-V500 PolarHBondContact O-N 3.39Å; C497-L513 HydrophobicContact CB-CD2 4.05Å
498	S	74.6	Confident	77.4	Confident	117 Å²	117	51.2 Å²	51.2	82%	0.818	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-13.2	-178.6	60.6	0	0	0	0	116
499	Q	79.1	Confident	77.7	Confident	71 Å²	71	48.6 Å²	48.6	33%	0.332	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-13.8	174.4	-70.1	-82.3	1.2	0	0	113.3	C497 T501 K504 V509 F512	C497-Q499 PolarHBondContact O-N 3.07Å; Q499-T501 VanDerWaalsContact C-N 3.3Å; Q499-T501 PolarHBondContact O-N 2.9Å; Q499-K504 WeakPolarHBondContact O-CD 3.24Å; Q499-K504 PolarHBondContact O-NZ 2.89Å; Q499-V509 HydrophobicContact CB-CG1 3.76Å; Q499-F512 HydrophobicContact CB-CB 4.29Å; Q499-F512 HydrophobicContact CB-CD1 4.48Å; Q499-F512 HydrophobicContact CB-CD2 3.6Å; Q499-F512 HydrophobicContact CB-CE2 3.99Å; Q499-F512 HydrophobicContact CB-CG 3.87Å; Q499-F512 VanDerWaalsContact CD-CZ 3.44Å; Q499-F512 HydrophobicContact CG-CB 4.39Å; Q499-F512 HydrophobicContact CG-CD1 3.76Å; Q499-F512 HydrophobicContact CG-CD2 3.67Å; Q499-F512 HydrophobicContact CG-CE1 3.85Å; Q499-F512 HydrophobicContact CG-CE2 3.78Å; Q499-F512 HydrophobicContact CG-CG 3.66Å; Q499-F512 HydrophobicContact CG-CZ 3.86Å
500	V	71.6	Confident	77.9	Confident	9 Å²	9	49.5 Å²	49.5	6%	0.055	29%	0.291	C	S	.	.			trans	-76.3	77.6	176.2	179.5	0	0	0	0	109.1	L494 C497 V509 Y531 Y534 Q535 M538	L494-V500 HydrophobicContact CB-CG1 4.41Å; L494-V500 HydrophobicContact CB-CG2 4.45Å; L494-V500 HydrophobicContact CD2-CG1 4.39Å; L494-V500 HydrophobicContact CD2-CG2 3.69Å; C497-V500 HydrophobicContact CB-CG2 3.66Å; C497-V500 VanDerWaalsContact O-CB 3.25Å; C497-V500 WeakPolarHBondContact O-CB 3.47Å; C497-V500 WeakPolarHBondContact O-CG2 3.36Å; C497-V500 PolarHBondContact O-N 3.39Å; V500-V509 HydrophobicContact CG2-CG1 3.7Å; V500-Y531 HydrophobicContact CG1-CE2 3.85Å; V500-Y531 HydrophobicContact CG2-CE2 4.3Å; V500-Y534 HydrophobicContact CG1-CD1 4.13Å; V500-Y534 HydrophobicContact CG1-CE1 4.15Å; V500-Q535 HydrophobicContact CG1-CG 4.25Å; V500-M538 HydrophobicContact CG1-SD 4.47Å
501	T	61.6	Low	77.8	Confident	57 Å²	57	56.2 Å²	56.2	35%	0.35	33%	0.326	S	S	.	.			trans	-99	142.2	179.6	54.8	0	0	0	0	111.5	Q499 G503 K504 Q535	Q499-T501 VanDerWaalsContact C-N 3.3Å; Q499-T501 PolarHBondContact O-N 2.9Å; T501-G503 PolarHBondContact O-N 3.49Å; T501-G503 VanDerWaalsContact O-N 3.16Å; T501-K504 PolarHBondContact O-N 3.11Å; T501-K504 VanDerWaalsContact O-N 3.16Å; T501-K504 WeakPolarHBondContact OG1-CD 3.02Å; T501-K504 WeakPolarHBondContact OG1-CG 3.46Å; T501-Q535 VanDerWaalsContact C-NE2 3.27Å; T501-Q535 PolarHBondContact O-NE2 3.12Å; T501-Q535 VanDerWaalsContact O-NE2 3.09Å; T501-Q535 PolarHBondContact O-OE1 2.86Å
502	P	52.7	Low	78	Confident	54 Å²	54	58.3 Å²	58.3	35%	0.351	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.6	120.5	177.5	-30.7	36.6	0	0	0	113.2	I539 L560	P502-I539 HydrophobicContact CB-CD1 4.34Å; P502-L560 HydrophobicContact CB-CD2 3.87Å
503	G	62.4	Low	78.3	Confident	27 Å²	27	53 Å²	53	28%	0.278	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	103.3	-11.5	177.1	0	0	0	0	0	115.5	T501 L560	T501-G503 PolarHBondContact O-N 3.49Å; T501-G503 VanDerWaalsContact O-N 3.16Å; G503-L560 VanDerWaalsContact N-CD2 3.28Å
504	K	73.2	Confident	78.3	Confident	42 Å²	42	56.5 Å²	56.5	18%	0.183	32%	0.322	C	S	.	.			trans	-75.1	130.1	169	-83.8	-171.6	-171.5	173.9	0	109.8	Q499 T501 D508 V509 Y531 Q535	Q499-K504 WeakPolarHBondContact O-CD 3.24Å; Q499-K504 PolarHBondContact O-NZ 2.89Å; T501-K504 PolarHBondContact O-N 3.11Å; T501-K504 VanDerWaalsContact O-N 3.16Å; T501-K504 WeakPolarHBondContact OG1-CD 3.02Å; T501-K504 WeakPolarHBondContact OG1-CG 3.46Å; K504-D508 HydrophobicContact CB-CB 4.24Å; K504-D508 HydrophobicContact CD-CB 4.12Å; K504-D508 HydrophobicContact CG-CB 4.2Å; K504-V509 HydrophobicContact CB-CG2 3.88Å; K504-V509 HydrophobicContact CD-CG2 3.9Å; K504-Y531 VanDerWaalsContact O-CE1 3.32Å; K504-Y531 WeakPolarHBondContact O-CE1 3.27Å; K504-Y531 PolarHBondContact O-OH 2.78Å; K504-Q535 PolarHBondContact O-OE1 3.22Å
505	P	76.2	Confident	78.2	Confident	46 Å²	46	59.4 Å²	59.4	30%	0.299	35%	0.353	S	S	.	.			trans	-66.3	158.9	168	31.3	-36.4	0	0	0	110.6	S507 D508	P505-S507 VanDerWaalsContact CG-OG 3.28Å; P505-S507 WeakPolarHBondContact CG-OG 2.85Å; P505-S507 PolarHBondContact O-N 2.88Å; P505-S507 VanDerWaalsContact O-N 3.14Å; P505-D508 HydrophobicContact CG-CB 4.14Å; P505-D508 WeakPolarHBondContact CG-OD1 3.02Å; P505-D508 PolarHBondContact O-N 2.86Å
506	L	83.1	Confident	78.8	Confident	0 Å²	0	61 Å²	61	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-54.4	-34.8	177.4	-179.9	59.4	0	0	0	111.8	D508 V509 R510 L513 F519 L527 Y531	L506-D508 VanDerWaalsContact C-N 3.3Å; L506-D508 PolarHBondContact O-N 2.97Å; L506-V509 CarbonylContact O-C 3.48Å; L506-V509 PolarHBondContact O-N 3.28Å; L506-V509 VanDerWaalsContact O-N 3.16Å; L506-R510 WeakPolarHBondContact O-CA 3.25Å; L506-R510 WeakPolarHBondContact O-CB 3.32Å; L506-R510 PolarHBondContact O-N 3.47Å; L506-L513 HydrophobicContact CD1-CD1 3.81Å; L506-F519 HydrophobicContact CD1-CE2 4.11Å; L506-L527 HydrophobicContact CD2-CB 3.9Å; L506-Y531 HydrophobicContact CB-CD1 3.81Å; L506-Y531 HydrophobicContact CB-CE1 4.15Å; L506-Y531 HydrophobicContact CB-CG 4.08Å; L506-Y531 HydrophobicContact CD1-CD1 4.38Å; L506-Y531 HydrophobicContact CD1-CD2 3.69Å; L506-Y531 HydrophobicContact CD1-CE2 4.21Å; L506-Y531 HydrophobicContact CD1-CG 3.8Å; L506-Y531 HydrophobicContact CG-CG 4.41Å
507	S	85.4	Confident	79.1	Confident	76 Å²	76	59.8 Å²	59.8	53%	0.531	34%	0.34	S	S	.	.	H	α-helix	trans	-54.3	-39.2	174.6	57.5	0	0	0	0	114.3	P505 V509 R510	P505-S507 VanDerWaalsContact CG-OG 3.28Å; P505-S507 WeakPolarHBondContact CG-OG 2.85Å; P505-S507 PolarHBondContact O-N 2.88Å; P505-S507 VanDerWaalsContact O-N 3.14Å; S507-V509 VanDerWaalsContact C-N 3.33Å; S507-R510 WeakPolarHBondContact O-CB 3.09Å
508	D	83	Confident	79.2	Confident	76 Å²	76	59.6 Å²	59.6	41%	0.406	34%	0.338	S	S	.	.	H	α-helix	trans	-77.6	-23.6	-177.1	-72.7	18.8	0	0	0	111.9	K504 P505 L506	K504-D508 HydrophobicContact CB-CB 4.24Å; K504-D508 HydrophobicContact CD-CB 4.12Å; K504-D508 HydrophobicContact CG-CB 4.2Å; P505-D508 HydrophobicContact CG-CB 4.14Å; P505-D508 WeakPolarHBondContact CG-OD1 3.02Å; P505-D508 PolarHBondContact O-N 2.86Å; L506-D508 VanDerWaalsContact C-N 3.3Å; L506-D508 PolarHBondContact O-N 2.97Å
509	V	85.9	Confident	79.9	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-99.7	-13.7	178.5	-147.3	0	0	0	0	112.6	Q499 V500 K504 L506 S507 L511 F512 L513 Y531	Q499-V509 HydrophobicContact CB-CG1 3.76Å; V500-V509 HydrophobicContact CG2-CG1 3.7Å; K504-V509 HydrophobicContact CB-CG2 3.88Å; K504-V509 HydrophobicContact CD-CG2 3.9Å; L506-V509 CarbonylContact O-C 3.48Å; L506-V509 PolarHBondContact O-N 3.28Å; L506-V509 VanDerWaalsContact O-N 3.16Å; S507-V509 VanDerWaalsContact C-N 3.33Å; V509-L511 VanDerWaalsContact C-N 3.27Å; V509-L511 PolarHBondContact O-N 3.49Å; V509-L511 VanDerWaalsContact O-N 3.16Å; V509-F512 HydrophobicContact CG1-CB 4.46Å; V509-F512 HydrophobicContact CG1-CD2 4.06Å; V509-F512 WeakPolarHBondContact O-CA 3.34Å; V509-F512 WeakPolarHBondContact O-CB 3.03Å; V509-F512 PolarHBondContact O-N 2.93Å; V509-L513 HydrophobicContact CB-CD1 4.44Å; V509-L513 PolarHBondContact O-N 2.7Å; V509-Y531 HydrophobicContact CG2-CE2 4.16Å; V509-Y531 VanDerWaalsContact CG2-OH 3.23Å; V509-Y531 WeakPolarHBondContact CG2-OH 3.29Å
510	R	90.2	Very high	80.4	Confident	86 Å²	86	56.9 Å²	56.9	33%	0.325	31%	0.313	S	S	.	.	G	3₁₀ helix	trans	-48.2	-46.1	-176.5	-151.1	-174.2	-118.5	-97.1	5.7	113	L506 S507 F512 L513 M514 F519 E524	L506-R510 WeakPolarHBondContact O-CA 3.25Å; L506-R510 WeakPolarHBondContact O-CB 3.32Å; L506-R510 PolarHBondContact O-N 3.47Å; S507-R510 WeakPolarHBondContact O-CB 3.09Å; R510-F512 PolarHBondContact O-N 2.83Å; R510-F512 VanDerWaalsContact O-N 3.08Å; R510-L513 PolarHBondContact O-N 2.93Å; R510-M514 HydrophobicContact CG-CG 4.37Å; R510-M514 HydrophobicContact CG-SD 4.44Å; R510-M514 WeakPolarHBondContact O-CG 3.32Å; R510-M514 PolarHBondContact O-N 3.48Å; R510-F519 HydrophobicContact CG-CE1 4.16Å; R510-F519 HydrophobicContact CG-CE2 4.26Å; R510-F519 HydrophobicContact CG-CZ 3.47Å; R510-F519 VanDerWaalsContact CG-CZ 3.47Å; R510-E524 IonicContact CZ-OE1 2.72Å; R510-E524 IonicContact CZ-OE2 2.72Å; R510-E524 IonicContact NH1-OE2 2.88Å; R510-E524 IonicContact NH2-OE1 3.16Å; R510-E524 PolarHBondContact NH2-OE1 2.9Å; R510-E524 IonicContact NH2-OE2 3.57Å; R510-E524 PolarHBondContact NH2-OE2 3.16Å
511	L	86.5	Confident	81.1	Confident	140 Å²	140	59.4 Å²	59.4	73%	0.733	33%	0.33	S	S	*	.	G	3₁₀ helix	trans	-59.8	-19	178.6	-71	168.1	0	0	0	114.3	V509	V509-L511 VanDerWaalsContact C-N 3.27Å; V509-L511 PolarHBondContact O-N 3.49Å; V509-L511 VanDerWaalsContact O-N 3.16Å
512	F	86.8	Confident	82.3	Confident	83 Å²	83	57.2 Å²	57.2	36%	0.364	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	-101	-4.5	176.5	-50	-77.7	0	0	0	113.4	Q499 V509 R510 K516	Q499-F512 HydrophobicContact CB-CB 4.29Å; Q499-F512 HydrophobicContact CB-CD1 4.48Å; Q499-F512 HydrophobicContact CB-CD2 3.6Å; Q499-F512 HydrophobicContact CB-CE2 3.99Å; Q499-F512 HydrophobicContact CB-CG 3.87Å; Q499-F512 VanDerWaalsContact CD-CZ 3.44Å; Q499-F512 HydrophobicContact CG-CB 4.39Å; Q499-F512 HydrophobicContact CG-CD1 3.76Å; Q499-F512 HydrophobicContact CG-CD2 3.67Å; Q499-F512 HydrophobicContact CG-CE1 3.85Å; Q499-F512 HydrophobicContact CG-CE2 3.78Å; Q499-F512 HydrophobicContact CG-CG 3.66Å; Q499-F512 HydrophobicContact CG-CZ 3.86Å; V509-F512 HydrophobicContact CG1-CB 4.46Å; V509-F512 HydrophobicContact CG1-CD2 4.06Å; V509-F512 WeakPolarHBondContact O-CA 3.34Å; V509-F512 WeakPolarHBondContact O-CB 3.03Å; V509-F512 PolarHBondContact O-N 2.93Å; R510-F512 PolarHBondContact O-N 2.83Å; R510-F512 VanDerWaalsContact O-N 3.08Å; F512-K516 WeakPolarHBondContact O-CE 3.23Å; F512-K516 PolarHBondContact O-NZ 3.33Å
513	L	87.7	Confident	83.9	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111	-28.4	179.5	-58.5	174.4	0	0	0	112.1	F490 L493 L494 C497 L506 V509 R510 K516 F519	F490-L513 HydrophobicContact CE2-CD1 4.21Å; F490-L513 HydrophobicContact CZ-CD1 4.24Å; L493-L513 HydrophobicContact CD2-CD2 4.15Å; L493-L513 HydrophobicContact CG-CD2 4.31Å; L494-L513 HydrophobicContact CD2-CD1 3.66Å; L494-L513 HydrophobicContact CD2-CD2 3.93Å; L494-L513 HydrophobicContact CD2-CG 4.47Å; C497-L513 HydrophobicContact CB-CD2 4.05Å; L506-L513 HydrophobicContact CD1-CD1 3.81Å; V509-L513 HydrophobicContact CB-CD1 4.44Å; V509-L513 PolarHBondContact O-N 2.7Å; R510-L513 PolarHBondContact O-N 2.93Å; L513-K516 WeakPolarHBondContact O-CB 3.49Å; L513-K516 PolarHBondContact O-N 2.76Å; L513-F519 VanDerWaalsContact C-CD1 3.45Å; L513-F519 HydrophobicContact CB-CB 4.02Å; L513-F519 HydrophobicContact CB-CD1 3.95Å; L513-F519 HydrophobicContact CB-CD2 3.56Å; L513-F519 HydrophobicContact CB-CE1 4.43Å; L513-F519 HydrophobicContact CB-CE2 4.09Å; L513-F519 HydrophobicContact CB-CG 3.52Å; L513-F519 HydrophobicContact CD1-CD2 3.96Å; L513-F519 HydrophobicContact CD1-CE2 4.26Å; L513-F519 HydrophobicContact CG-CD2 4.4Å; L513-F519 WeakPolarHBondContact O-CB 3.32Å; L513-F519 WeakPolarHBondContact O-CD1 3.34Å
514	M	84.9	Confident	85	Confident	101 Å²	101	60 Å²	60	50%	0.498	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.9	143.8	170.1	-72.8	175.3	74.3	0	0	111.8	R510 K516 F519	R510-M514 HydrophobicContact CG-CG 4.37Å; R510-M514 HydrophobicContact CG-SD 4.44Å; R510-M514 WeakPolarHBondContact O-CG 3.32Å; R510-M514 PolarHBondContact O-N 3.48Å; M514-K516 VanDerWaalsContact C-N 3.28Å; M514-F519 HydrophobicContact CB-CE1 4.49Å; M514-F519 HydrophobicContact CG-CD1 4.38Å; M514-F519 HydrophobicContact CG-CE1 3.71Å
515	G	84.6	Confident	85.5	Confident	62 Å²	62	62.9 Å²	62.9	64%	0.639	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	75	9	-174.1	0	0	0	0	0	114.9	E520	G515-E520 WeakPolarHBondContact CA-OE1 3.45Å; G515-E520 PolarHBondContact N-OE1 2.84Å
516	K	87.2	Confident	85.9	Confident	88 Å²	88	61.7 Å²	61.7	38%	0.383	34%	0.339	S	S	.	.	S	Bend	trans	-122.3	119.8	177.6	-53.6	-177.3	-170.6	160.9	0	110.1	L493 F512 L513 M514 F519 E520	L493-K516 HydrophobicContact CD1-CB 4.11Å; L493-K516 HydrophobicContact CD1-CD 3.72Å; L493-K516 HydrophobicContact CD2-CB 3.93Å; L493-K516 HydrophobicContact CD2-CD 4.44Å; F512-K516 WeakPolarHBondContact O-CE 3.23Å; F512-K516 PolarHBondContact O-NZ 3.33Å; L513-K516 WeakPolarHBondContact O-CB 3.49Å; L513-K516 PolarHBondContact O-N 2.76Å; M514-K516 VanDerWaalsContact C-N 3.28Å; K516-F519 WeakPolarHBondContact O-CA 3.43Å; K516-F519 VanDerWaalsContact O-CB 3.3Å; K516-F519 WeakPolarHBondContact O-CB 3.34Å; K516-F519 PolarHBondContact O-N 3.38Å; K516-E520 PolarHBondContact O-N 3.48Å
517	E	83.9	Confident	86.2	Confident	110 Å²	110	61.9 Å²	61.9	51%	0.514	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	142.6	154.1	-93.8	-131.3	115.6	0	0	109.3	S521	E517-S521 WeakPolarHBondContact OE1-CB 3.44Å; E517-S521 PolarHBondContact OE1-OG 2.85Å
518	P	83.4	Confident	86.2	Confident	7 Å²	7	59.4 Å²	59.4	5%	0.045	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	cis	-91.9	10.8	-0.6	36.3	-40	0	0	0	115.1	L486 D489 F490 E520 S521 L522	L486-P518 HydrophobicContact CB-CB 3.97Å; L486-P518 HydrophobicContact CD2-CB 3.47Å; L486-P518 VanDerWaalsContact CD2-CB 3.47Å; L486-P518 HydrophobicContact CG-CB 4.31Å; L486-P518 VanDerWaalsContact O-CG 3.24Å; L486-P518 WeakPolarHBondContact O-CG 3.39Å; D489-P518 HydrophobicContact CB-CG 3.95Å; F490-P518 VanDerWaalsContact CA-CG 3.42Å; F490-P518 HydrophobicContact CB-CG 3.54Å; F490-P518 HydrophobicContact CD2-CG 4.25Å; F490-P518 HydrophobicContact CG-CG 4.31Å; P518-E520 PolarHBondContact O-N 3.12Å; P518-S521 PolarHBondContact O-N 3.2Å; P518-S521 VanDerWaalsContact O-N 3.17Å; P518-L522 PolarHBondContact O-N 2.6Å
519	F	89.4	Confident	86	Confident	8 Å²	8	57.8 Å²	57.8	4%	0.035	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-28.5	-179.8	174.1	-93.1	0	0	0	112.9	F490 L493 L506 R510 L513 M514 K516 L527	F490-F519 HydrophobicContact CD2-CB 4.29Å; F490-F519 HydrophobicContact CE2-CB 3.87Å; F490-F519 AromaticContact CE2-CD2 3.73Å; F490-F519 HydrophobicContact CE2-CD2 3.73Å; F490-F519 HydrophobicContact CE2-CG 4.29Å; F490-F519 AromaticContact CZ-CD2 3.85Å; F490-F519 HydrophobicContact CZ-CD2 3.85Å; L493-F519 HydrophobicContact CD2-CB 4.04Å; L506-F519 HydrophobicContact CD1-CE2 4.11Å; R510-F519 HydrophobicContact CG-CE1 4.16Å; R510-F519 HydrophobicContact CG-CE2 4.26Å; R510-F519 HydrophobicContact CG-CZ 3.47Å; R510-F519 VanDerWaalsContact CG-CZ 3.47Å; L513-F519 VanDerWaalsContact C-CD1 3.45Å; L513-F519 HydrophobicContact CB-CB 4.02Å; L513-F519 HydrophobicContact CB-CD1 3.95Å; L513-F519 HydrophobicContact CB-CD2 3.56Å; L513-F519 HydrophobicContact CB-CE1 4.43Å; L513-F519 HydrophobicContact CB-CE2 4.09Å; L513-F519 HydrophobicContact CB-CG 3.52Å; L513-F519 HydrophobicContact CD1-CD2 3.96Å; L513-F519 HydrophobicContact CD1-CE2 4.26Å; L513-F519 HydrophobicContact CG-CD2 4.4Å; L513-F519 WeakPolarHBondContact O-CB 3.32Å; L513-F519 WeakPolarHBondContact O-CD1 3.34Å; M514-F519 HydrophobicContact CB-CE1 4.49Å; M514-F519 HydrophobicContact CG-CD1 4.38Å; M514-F519 HydrophobicContact CG-CE1 3.71Å; K516-F519 WeakPolarHBondContact O-CA 3.43Å; K516-F519 VanDerWaalsContact O-CB 3.3Å; K516-F519 WeakPolarHBondContact O-CB 3.34Å; K516-F519 PolarHBondContact O-N 3.38Å; F519-L527 HydrophobicContact CB-CD2 4.47Å; F519-L527 HydrophobicContact CD2-CD1 4.11Å; F519-L527 HydrophobicContact CD2-CD2 3.73Å; F519-L527 HydrophobicContact CD2-CG 4.48Å; F519-L527 HydrophobicContact CE2-CD1 3.85Å; F519-L527 HydrophobicContact CE2-CD2 4.23Å; F519-L527 HydrophobicContact CG-CD2 4.35Å; F519-L527 HydrophobicContact CZ-CD1 4.24Å; F519-L527 VanDerWaalsContact O-CD1 3.28Å; F519-L527 WeakPolarHBondContact O-CD1 3.48Å; F519-L527 WeakPolarHBondContact O-CD2 3.33Å
520	E	88.6	Confident	85.8	Confident	123 Å²	123	58 Å²	58	58%	0.575	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87	-17.3	178.1	-53.4	-152.7	149.2	0	0	114	G515 K516 P518	G515-E520 WeakPolarHBondContact CA-OE1 3.45Å; G515-E520 PolarHBondContact N-OE1 2.84Å; K516-E520 PolarHBondContact O-N 3.48Å; P518-E520 PolarHBondContact O-N 3.12Å
521	S	86.7	Confident	85.5	Confident	61 Å²	61	54 Å²	54	43%	0.427	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.1	-22.2	-171.6	-52.9	0	0	0	0	113.9	E517 P518	E517-S521 WeakPolarHBondContact OE1-CB 3.44Å; E517-S521 PolarHBondContact OE1-OG 2.85Å; P518-S521 PolarHBondContact O-N 3.2Å; P518-S521 VanDerWaalsContact O-N 3.17Å
522	L	86.7	Confident	85	Confident	12 Å²	12	47.9 Å²	47.9	6%	0.063	27%	0.271	C	S	.	.	S	Bend	trans	-83.5	143	174.5	-72.8	174.6	0	0	0	111	L486 L487 F490 P518 D526 L527	L486-L522 HydrophobicContact CB-CD2 3.72Å; L486-L522 HydrophobicContact CB-CG 4.04Å; L486-L522 HydrophobicContact CD1-CD2 4.43Å; L487-L522 HydrophobicContact CD2-CD1 4.06Å; L487-L522 HydrophobicContact CD2-CD2 3.69Å; L487-L522 HydrophobicContact CG-CD2 4.2Å; F490-L522 HydrophobicContact CB-CD1 3.63Å; F490-L522 HydrophobicContact CD1-CD1 3.89Å; F490-L522 HydrophobicContact CG-CD1 3.88Å; P518-L522 PolarHBondContact O-N 2.6Å; L522-D526 HydrophobicContact CB-CB 4.13Å; L522-D526 HydrophobicContact CD2-CB 4.18Å; L522-L527 HydrophobicContact CB-CD2 3.58Å; L522-L527 HydrophobicContact CB-CG 3.82Å; L522-L527 HydrophobicContact CD1-CD2 4.11Å; L522-L527 HydrophobicContact CG-CD2 4.46Å; L522-L527 WeakPolarHBondContact O-CD1 3.32Å
523	A	85.4	Confident	84	Confident	54 Å²	54	49.5 Å²	49.5	45%	0.446	28%	0.28	S	S	.	.			trans	-66.4	155.5	175.5	0	0	0	0	0	111.1	V525 D526 L527	A523-V525 PolarHBondContact O-N 3.23Å; A523-V525 VanDerWaalsContact O-N 3.07Å; A523-D526 CarbonylContact O-C 3.59Å; A523-D526 WeakPolarHBondContact O-CA 3.43Å; A523-D526 WeakPolarHBondContact O-CB 3.46Å; A523-D526 PolarHBondContact O-N 3.21Å; A523-L527 WeakPolarHBondContact O-CG 3.18Å; A523-L527 PolarHBondContact O-N 3.23Å
524	E	86.3	Confident	83.2	Confident	86 Å²	86	51.3 Å²	51.3	40%	0.402	29%	0.287	S	S	.	.	H	α-helix	trans	-54.8	-34.9	-179.1	-169	65	-167.4	0	0	113.3	R510 D526 Q528	R510-E524 IonicContact CZ-OE1 2.72Å; R510-E524 IonicContact CZ-OE2 2.72Å; R510-E524 IonicContact NH1-OE2 2.88Å; R510-E524 IonicContact NH2-OE1 3.16Å; R510-E524 PolarHBondContact NH2-OE1 2.9Å; R510-E524 IonicContact NH2-OE2 3.57Å; R510-E524 PolarHBondContact NH2-OE2 3.16Å; E524-D526 VanDerWaalsContact C-N 3.3Å; E524-D526 PolarHBondContact O-N 3.05Å; E524-Q528 WeakPolarHBondContact O-CB 3.21Å; E524-Q528 PolarHBondContact O-N 3.22Å
525	V	83.7	Confident	82.1	Confident	101 Å²	101	46.5 Å²	46.5	61%	0.612	26%	0.263	S	S	*	.	H	α-helix	trans	-66.5	-33.2	175.8	-176.9	0	0	0	0	111.4	A523 A529	A523-V525 PolarHBondContact O-N 3.23Å; A523-V525 VanDerWaalsContact O-N 3.07Å; V525-A529 WeakPolarHBondContact O-CA 3.24Å; V525-A529 WeakPolarHBondContact O-CB 3.37Å; V525-A529 PolarHBondContact O-N 2.92Å
526	D	85.3	Confident	80.7	Confident	21 Å²	21	44.8 Å²	44.8	11%	0.112	24%	0.24	C	C	.	.	H	α-helix	trans	-82.3	-38.6	178.5	-55.8	-34.5	0	0	0	111.8	R483 L487 L522 A523 E524 Q528 A529 V530	R483-D526 IonicContact CZ-OD1 2.97Å; R483-D526 VanDerWaalsContact CZ-OD1 3.25Å; R483-D526 IonicContact CZ-OD2 3.35Å; R483-D526 IonicContact NH1-OD1 3.71Å; R483-D526 PolarHBondContact NH1-OD1 3.29Å; R483-D526 IonicContact NH1-OD2 2.71Å; R483-D526 PolarHBondContact NH1-OD2 3.11Å; R483-D526 IonicContact NH2-OD1 3.54Å; R483-D526 PolarHBondContact NH2-OD1 3.33Å; R483-D526 IonicContact NH2-OD2 3.71Å; L487-D526 HydrophobicContact CD2-CB 4.03Å; L522-D526 HydrophobicContact CB-CB 4.13Å; L522-D526 HydrophobicContact CD2-CB 4.18Å; A523-D526 CarbonylContact O-C 3.59Å; A523-D526 WeakPolarHBondContact O-CA 3.43Å; A523-D526 WeakPolarHBondContact O-CB 3.46Å; A523-D526 PolarHBondContact O-N 3.21Å; E524-D526 VanDerWaalsContact C-N 3.3Å; E524-D526 PolarHBondContact O-N 3.05Å; D526-Q528 VanDerWaalsContact C-N 3.34Å; D526-A529 PolarHBondContact O-N 3.19Å; D526-V530 VanDerWaalsContact O-CB 3.31Å; D526-V530 WeakPolarHBondContact O-CB 3.48Å; D526-V530 WeakPolarHBondContact O-CG2 3.1Å; D526-V530 PolarHBondContact O-N 2.98Å
527	L	88.7	Confident	78.9	Confident	5 Å²	5	42.3 Å²	42.3	3%	0.026	24%	0.24	C	C	.	.	H	α-helix	trans	-60.8	-46.7	170.7	-66.7	174.1	0	0	0	110.1	F490 L506 F519 L522 A523 Y531	F490-L527 HydrophobicContact CD1-CD2 4.05Å; F490-L527 HydrophobicContact CD2-CD2 4.38Å; F490-L527 HydrophobicContact CE1-CB 4.31Å; F490-L527 HydrophobicContact CE1-CD2 3.69Å; F490-L527 WeakPolarHBondContact CE1-O 3.23Å; F490-L527 HydrophobicContact CE2-CD2 4.06Å; F490-L527 HydrophobicContact CG-CD2 4.42Å; F490-L527 HydrophobicContact CZ-CD2 3.71Å; L506-L527 HydrophobicContact CD2-CB 3.9Å; F519-L527 HydrophobicContact CB-CD2 4.47Å; F519-L527 HydrophobicContact CD2-CD1 4.11Å; F519-L527 HydrophobicContact CD2-CD2 3.73Å; F519-L527 HydrophobicContact CD2-CG 4.48Å; F519-L527 HydrophobicContact CE2-CD1 3.85Å; F519-L527 HydrophobicContact CE2-CD2 4.23Å; F519-L527 HydrophobicContact CG-CD2 4.35Å; F519-L527 HydrophobicContact CZ-CD1 4.24Å; F519-L527 VanDerWaalsContact O-CD1 3.28Å; F519-L527 WeakPolarHBondContact O-CD1 3.48Å; F519-L527 WeakPolarHBondContact O-CD2 3.33Å; L522-L527 HydrophobicContact CB-CD2 3.58Å; L522-L527 HydrophobicContact CB-CG 3.82Å; L522-L527 HydrophobicContact CD1-CD2 4.11Å; L522-L527 HydrophobicContact CG-CD2 4.46Å; L522-L527 WeakPolarHBondContact O-CD1 3.32Å; A523-L527 WeakPolarHBondContact O-CG 3.18Å; A523-L527 PolarHBondContact O-N 3.23Å; L527-Y531 WeakPolarHBondContact O-CA 3.31Å; L527-Y531 WeakPolarHBondContact O-CB 3.48Å; L527-Y531 PolarHBondContact O-N 2.95Å
528	Q	85.1	Confident	77.4	Confident	24 Å²	24	40.6 Å²	40.6	11%	0.112	23%	0.233	C	C	.	.	H	α-helix	trans	-67.9	-45.1	174.5	-166	66.7	61.4	0	0	110.2	E524 D526 V530 Y531 D532 L553	E524-Q528 WeakPolarHBondContact O-CB 3.21Å; E524-Q528 PolarHBondContact O-N 3.22Å; D526-Q528 VanDerWaalsContact C-N 3.34Å; Q528-V530 PolarHBondContact O-N 2.93Å; Q528-Y531 PolarHBondContact O-N 2.82Å; Q528-D532 PolarHBondContact NE2-OD1 2.79Å; Q528-D532 WeakPolarHBondContact O-CA 3.27Å; Q528-D532 WeakPolarHBondContact O-CB 3.45Å; Q528-D532 PolarHBondContact O-N 3.42Å; Q528-L553 HydrophobicContact CG-CD1 3.99Å
529	A	79.7	Confident	75.6	Confident	42 Å²	42	41 Å²	41	35%	0.347	23%	0.234	S	C	.	.	H	α-helix	trans	-66.7	-32.1	-179	0	0	0	0	0	114	V525 D526 Q533	V525-A529 WeakPolarHBondContact O-CA 3.24Å; V525-A529 WeakPolarHBondContact O-CB 3.37Å; V525-A529 PolarHBondContact O-N 2.92Å; D526-A529 PolarHBondContact O-N 3.19Å; A529-Q533 WeakPolarHBondContact O-CB 3.43Å; A529-Q533 PolarHBondContact O-N 3.38Å
530	V	81.5	Confident	73.3	Confident	5 Å²	5	42.4 Å²	42.4	3%	0.03	25%	0.251	C	S	.	.	H	α-helix	trans	-86.4	-36.1	174	173.2	0	0	0	0	111.6	L487 F490 S491 D526 Q528 D532 Q533 Y534	L487-V530 HydrophobicContact CB-CG2 3.99Å; L487-V530 HydrophobicContact CD2-CG2 3.3Å; L487-V530 HydrophobicContact CG-CG2 4.13Å; F490-V530 HydrophobicContact CB-CG1 4.23Å; F490-V530 HydrophobicContact CD1-CB 3.75Å; F490-V530 HydrophobicContact CD1-CG1 3.51Å; F490-V530 HydrophobicContact CE1-CB 4.29Å; F490-V530 HydrophobicContact CE1-CG1 4.28Å; F490-V530 HydrophobicContact CG-CG1 4.28Å; S491-V530 WeakPolarHBondContact OG-CG1 3.06Å; D526-V530 VanDerWaalsContact O-CB 3.31Å; D526-V530 WeakPolarHBondContact O-CB 3.48Å; D526-V530 WeakPolarHBondContact O-CG2 3.1Å; D526-V530 PolarHBondContact O-N 2.98Å; Q528-V530 PolarHBondContact O-N 2.93Å; V530-D532 PolarHBondContact O-N 3.19Å; V530-Q533 CarbonylContact O-C 3.52Å; V530-Q533 PolarHBondContact O-N 3.01Å; V530-Y534 WeakPolarHBondContact O-CA 3.2Å; V530-Y534 WeakPolarHBondContact O-CB 3.43Å; V530-Y534 PolarHBondContact O-N 2.85Å
531	Y	84.2	Confident	70.9	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-59.4	-39	167.7	-172.4	-98.5	0	0	0	109.8	L494 V500 K504 L506 V509 L527 Q528 Y534 Q535 F556	L494-Y531 HydrophobicContact CD1-CD2 3.83Å; L494-Y531 HydrophobicContact CD1-CG 4.48Å; L494-Y531 HydrophobicContact CD2-CD2 3.62Å; L494-Y531 HydrophobicContact CD2-CE2 4.01Å; L494-Y531 HydrophobicContact CG-CD2 4.39Å; V500-Y531 HydrophobicContact CG1-CE2 3.85Å; V500-Y531 HydrophobicContact CG2-CE2 4.3Å; K504-Y531 VanDerWaalsContact O-CE1 3.32Å; K504-Y531 WeakPolarHBondContact O-CE1 3.27Å; K504-Y531 PolarHBondContact O-OH 2.78Å; L506-Y531 HydrophobicContact CB-CD1 3.81Å; L506-Y531 HydrophobicContact CB-CE1 4.15Å; L506-Y531 HydrophobicContact CB-CG 4.08Å; L506-Y531 HydrophobicContact CD1-CD1 4.38Å; L506-Y531 HydrophobicContact CD1-CD2 3.69Å; L506-Y531 HydrophobicContact CD1-CE2 4.21Å; L506-Y531 HydrophobicContact CD1-CG 3.8Å; L506-Y531 HydrophobicContact CG-CG 4.41Å; V509-Y531 HydrophobicContact CG2-CE2 4.16Å; V509-Y531 VanDerWaalsContact CG2-OH 3.23Å; V509-Y531 WeakPolarHBondContact CG2-OH 3.29Å; L527-Y531 WeakPolarHBondContact O-CA 3.31Å; L527-Y531 WeakPolarHBondContact O-CB 3.48Å; L527-Y531 PolarHBondContact O-N 2.95Å; Q528-Y531 PolarHBondContact O-N 2.82Å; Y531-Y534 PolarHBondContact O-N 3.44Å; Y531-Q535 HydrophobicContact CE1-CG 4.32Å; Y531-Q535 HydrophobicContact CE2-CG 4.49Å; Y531-Q535 PolarHBondContact O-N 2.99Å; Y531-Q535 PolarHBondContact OH-NE2 2.75Å; Y531-Q535 PolarHBondContact OH-OE1 2.91Å; Y531-F556 HydrophobicContact CD1-CD1 4.05Å; Y531-F556 AromaticContact CD1-CE1 3.46Å; Y531-F556 HydrophobicContact CD1-CE1 3.46Å; Y531-F556 VanDerWaalsContact CD1-CE1 3.46Å; Y531-F556 HydrophobicContact CD1-CZ 4.44Å; Y531-F556 HydrophobicContact CE1-CD1 4.25Å; Y531-F556 AromaticContact CE1-CE1 3.59Å; Y531-F556 HydrophobicContact CE1-CE1 3.59Å; Y531-F556 HydrophobicContact CG-CE1 4.45Å; Y531-F556 WeakPolarHBondContact O-CE1 3.14Å; Y531-F556 WeakPolarHBondContact O-CZ 3.43Å
532	D	74.7	Confident	68.7	Low	13 Å²	13	48.9 Å²	48.9	7%	0.07	27%	0.271	C	S	.	.	H	α-helix	trans	-61.7	-60.2	171.5	-73.2	12.3	0	0	0	110.4	Q528 V530 Y534 Q535 V536 F556	Q528-D532 PolarHBondContact NE2-OD1 2.79Å; Q528-D532 WeakPolarHBondContact O-CA 3.27Å; Q528-D532 WeakPolarHBondContact O-CB 3.45Å; Q528-D532 PolarHBondContact O-N 3.42Å; V530-D532 PolarHBondContact O-N 3.19Å; D532-Y534 PolarHBondContact O-N 3.29Å; D532-Q535 CarbonylContact O-C 3.58Å; D532-Q535 PolarHBondContact O-N 3.47Å; D532-V536 WeakPolarHBondContact O-CB 3.31Å; D532-V536 WeakPolarHBondContact O-CG2 3.46Å; D532-V536 PolarHBondContact O-N 3.19Å; D532-F556 VanDerWaalsContact C-CE2 3.5Å; D532-F556 VanDerWaalsContact CA-CD2 3.46Å; D532-F556 HydrophobicContact CB-CB 4.32Å; D532-F556 HydrophobicContact CB-CD1 4.35Å; D532-F556 HydrophobicContact CB-CD2 3.74Å; D532-F556 HydrophobicContact CB-CE2 4.15Å; D532-F556 HydrophobicContact CB-CG 3.87Å; D532-F556 HydrophobicContact CB-CZ 4.45Å; D532-F556 VanDerWaalsContact CG-CB 3.4Å; D532-F556 WeakPolarHBondContact O-CE2 3.37Å; D532-F556 VanDerWaalsContact O-CZ 3.24Å; D532-F556 WeakPolarHBondContact O-CZ 3.34Å; D532-F556 WeakPolarHBondContact OD1-CB 3.34Å; D532-F556 WeakPolarHBondContact OD1-CD1 3.49Å; D532-F556 WeakPolarHBondContact OD1-CG 3.33Å; D532-F556 WeakPolarHBondContact OD2-CB 3.33Å
533	Q	67.2	Low	66.4	Low	116 Å²	116	55.3 Å²	55.3	54%	0.542	31%	0.305	S	S	.	.	H	α-helix	trans	-58.1	-25.8	175.8	-106.5	-177	-10.7	0	0	113	A529 V530 V536 G537 L544	A529-Q533 WeakPolarHBondContact O-CB 3.43Å; A529-Q533 PolarHBondContact O-N 3.38Å; V530-Q533 CarbonylContact O-C 3.52Å; V530-Q533 PolarHBondContact O-N 3.01Å; Q533-V536 CarbonylContact O-C 3.55Å; Q533-G537 WeakPolarHBondContact O-CA 3.47Å; Q533-G537 PolarHBondContact O-N 3.19Å; Q533-L544 HydrophobicContact CG-CD1 4.18Å
534	Y	70	Confident	63.9	Low	38 Å²	38	58.3 Å²	58.3	15%	0.149	31%	0.313	C	S	.	.	H	α-helix	trans	-82.6	-42.6	-176.8	-171.6	-96.8	0	0	0	112	S491 L494 A495 V500 V530 Y531 D532 V536 G537 M538	S491-Y534 WeakPolarHBondContact O-CD2 3.49Å; S491-Y534 WeakPolarHBondContact O-CE2 3.34Å; L494-Y534 HydrophobicContact CB-CD1 3.36Å; L494-Y534 HydrophobicContact CB-CD2 4.22Å; L494-Y534 HydrophobicContact CB-CE1 3.6Å; L494-Y534 HydrophobicContact CB-CE2 4.45Å; L494-Y534 HydrophobicContact CB-CG 3.73Å; L494-Y534 HydrophobicContact CD1-CD1 3.87Å; L494-Y534 HydrophobicContact CD1-CG 3.74Å; L494-Y534 HydrophobicContact CG-CD1 4.25Å; L494-Y534 HydrophobicContact CG-CG 4.41Å; A495-Y534 WeakPolarHBondContact CA-OH 3.34Å; A495-Y534 HydrophobicContact CB-CE2 4.11Å; A495-Y534 WeakPolarHBondContact CB-OH 3.37Å; V500-Y534 HydrophobicContact CG1-CD1 4.13Å; V500-Y534 HydrophobicContact CG1-CE1 4.15Å; V530-Y534 WeakPolarHBondContact O-CA 3.2Å; V530-Y534 WeakPolarHBondContact O-CB 3.43Å; V530-Y534 PolarHBondContact O-N 2.85Å; Y531-Y534 PolarHBondContact O-N 3.44Å; D532-Y534 PolarHBondContact O-N 3.29Å; Y534-V536 VanDerWaalsContact C-N 3.31Å; Y534-G537 CarbonylContact O-C 3.57Å; Y534-G537 PolarHBondContact O-N 3.43Å; Y534-G537 VanDerWaalsContact O-N 3.13Å; Y534-M538 HydrophobicContact CD1-CG 3.85Å; Y534-M538 HydrophobicContact CD1-SD 4.04Å; Y534-M538 HydrophobicContact CE1-CE 4.39Å; Y534-M538 HydrophobicContact CE1-CG 3.25Å; Y534-M538 HydrophobicContact CE1-SD 3.41Å; Y534-M538 WeakPolarHBondContact CE1-SD 3.17Å; Y534-M538 HydrophobicContact CE2-CG 4.25Å; Y534-M538 VanDerWaalsContact CZ-CG 3.42Å; Y534-M538 VanDerWaalsContact O-CB 3.3Å; Y534-M538 WeakPolarHBondContact O-CB 3.28Å; Y534-M538 VanDerWaalsContact O-CG 3.27Å; Y534-M538 WeakPolarHBondContact O-CG 3.21Å; Y534-M538 PolarHBondContact O-N 3.08Å; Y534-M538 WeakPolarHBondContact OH-CG 3.27Å
535	Q	62.5	Low	61.3	Low	0 Å²	0	60.4 Å²	60.4	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-89.3	10.3	165.5	-17.1	-171.3	-59.8	0	0	113.6	V500 T501 K504 Y531 D532 I539 F556 L560	V500-Q535 HydrophobicContact CG1-CG 4.25Å; T501-Q535 VanDerWaalsContact C-NE2 3.27Å; T501-Q535 PolarHBondContact O-NE2 3.12Å; T501-Q535 VanDerWaalsContact O-NE2 3.09Å; T501-Q535 PolarHBondContact O-OE1 2.86Å; K504-Q535 PolarHBondContact O-OE1 3.22Å; Y531-Q535 HydrophobicContact CE1-CG 4.32Å; Y531-Q535 HydrophobicContact CE2-CG 4.49Å; Y531-Q535 PolarHBondContact O-N 2.99Å; Y531-Q535 PolarHBondContact OH-NE2 2.75Å; Y531-Q535 PolarHBondContact OH-OE1 2.91Å; D532-Q535 CarbonylContact O-C 3.58Å; D532-Q535 PolarHBondContact O-N 3.47Å; Q535-I539 VanDerWaalsContact O-CB 3.25Å; Q535-I539 WeakPolarHBondContact O-CB 3.08Å; Q535-I539 WeakPolarHBondContact O-CD1 3.5Å; Q535-I539 WeakPolarHBondContact O-CG1 3.15Å; Q535-F556 VanDerWaalsContact C-CE2 3.43Å; Q535-F556 VanDerWaalsContact CA-CZ 3.48Å; Q535-F556 HydrophobicContact CB-CE1 4.02Å; Q535-F556 HydrophobicContact CB-CE2 4Å; Q535-F556 HydrophobicContact CB-CZ 3.22Å; Q535-F556 HydrophobicContact CG-CE1 3.92Å; Q535-F556 HydrophobicContact CG-CZ 3.56Å; Q535-L560 HydrophobicContact CB-CD1 4.41Å; Q535-L560 HydrophobicContact CB-CD2 3.36Å; Q535-L560 HydrophobicContact CB-CG 4.2Å; Q535-L560 HydrophobicContact CG-CD2 4.28Å
536	V	53.9	Low	59	Low	26 Å²	26	61.4 Å²	61.4	16%	0.158	35%	0.347	C	S	.	.	H	α-helix	trans	-88	-29.5	149.5	176.1	0	0	0	0	109.9	D532 Q533 Y534 I539 G540 F556 V559	D532-V536 WeakPolarHBondContact O-CB 3.31Å; D532-V536 WeakPolarHBondContact O-CG2 3.46Å; D532-V536 PolarHBondContact O-N 3.19Å; Q533-V536 CarbonylContact O-C 3.55Å; Y534-V536 VanDerWaalsContact C-N 3.31Å; V536-I539 CarbonylContact O-C 3.58Å; V536-I539 VanDerWaalsContact O-C 3.25Å; V536-I539 VanDerWaalsContact O-CA 3.24Å; V536-I539 WeakPolarHBondContact O-CA 3.27Å; V536-I539 WeakPolarHBondContact O-CB 3.41Å; V536-I539 PolarHBondContact O-N 3.24Å; V536-G540 PolarHBondContact O-N 3.32Å; V536-F556 HydrophobicContact CG2-CD2 4.07Å; V536-F556 HydrophobicContact CG2-CE2 3.79Å; V536-V559 HydrophobicContact CB-CG1 4.26Å; V536-V559 HydrophobicContact CG1-CG1 4.45Å; V536-V559 HydrophobicContact CG2-CB 4.05Å; V536-V559 HydrophobicContact CG2-CG1 3.64Å; V536-V559 HydrophobicContact CG2-CG2 3.98Å
537	G	51.1	Low	56.5	Low	36 Å²	36	68.2 Å²	68.2	37%	0.371	38%	0.384	S	S	.	.	H	α-helix	trans	-95.6	-40.9	-167.2	0	0	0	0	0	115.4	Q533 Y534 I539 G540	Q533-G537 WeakPolarHBondContact O-CA 3.47Å; Q533-G537 PolarHBondContact O-N 3.19Å; Y534-G537 CarbonylContact O-C 3.57Å; Y534-G537 PolarHBondContact O-N 3.43Å; Y534-G537 VanDerWaalsContact O-N 3.13Å; G537-I539 PolarHBondContact O-N 3.21Å; G537-G540 PolarHBondContact O-N 2.77Å
538	M	51.5	Low	54	Low	74 Å²	74	76.7 Å²	76.7	37%	0.365	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-46.2	-25.4	151.3	-72.5	-171.9	96.4	0	0	110.6	V500 Y534 R563	V500-M538 HydrophobicContact CG1-SD 4.47Å; Y534-M538 HydrophobicContact CD1-CG 3.85Å; Y534-M538 HydrophobicContact CD1-SD 4.04Å; Y534-M538 HydrophobicContact CE1-CE 4.39Å; Y534-M538 HydrophobicContact CE1-CG 3.25Å; Y534-M538 HydrophobicContact CE1-SD 3.41Å; Y534-M538 WeakPolarHBondContact CE1-SD 3.17Å; Y534-M538 HydrophobicContact CE2-CG 4.25Å; Y534-M538 VanDerWaalsContact CZ-CG 3.42Å; Y534-M538 VanDerWaalsContact O-CB 3.3Å; Y534-M538 WeakPolarHBondContact O-CB 3.28Å; Y534-M538 VanDerWaalsContact O-CG 3.27Å; Y534-M538 WeakPolarHBondContact O-CG 3.21Å; Y534-M538 PolarHBondContact O-N 3.08Å; Y534-M538 WeakPolarHBondContact OH-CG 3.27Å; M538-R563 PolarHBondContact O-NH1 2.82Å; M538-R563 PolarHBondContact O-NH2 3.39Å
539	I	46.4	Very low	51.5	Low	15 Å²	15	82.6 Å²	82.6	8%	0.077	46%	0.455	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.5	-19.6	-168.5	-67.9	-153.8	0	0	0	115	P502 Q535 V536 G537 V559 L560 R563	P502-I539 HydrophobicContact CB-CD1 4.34Å; Q535-I539 VanDerWaalsContact O-CB 3.25Å; Q535-I539 WeakPolarHBondContact O-CB 3.08Å; Q535-I539 WeakPolarHBondContact O-CD1 3.5Å; Q535-I539 WeakPolarHBondContact O-CG1 3.15Å; V536-I539 CarbonylContact O-C 3.58Å; V536-I539 VanDerWaalsContact O-C 3.25Å; V536-I539 VanDerWaalsContact O-CA 3.24Å; V536-I539 WeakPolarHBondContact O-CA 3.27Å; V536-I539 WeakPolarHBondContact O-CB 3.41Å; V536-I539 PolarHBondContact O-N 3.24Å; G537-I539 PolarHBondContact O-N 3.21Å; I539-V559 HydrophobicContact CG2-CG1 4.16Å; I539-L560 HydrophobicContact CD1-CD2 3.53Å; I539-R563 HydrophobicContact CB-CB 4.4Å; I539-R563 HydrophobicContact CB-CG 4.37Å; I539-R563 HydrophobicContact CD1-CB 3.76Å; I539-R563 HydrophobicContact CD1-CG 4.33Å; I539-R563 HydrophobicContact CG1-CB 4.37Å; I539-R563 HydrophobicContact CG1-CG 4.48Å; I539-R563 HydrophobicContact CG2-CB 3.46Å; I539-R563 VanDerWaalsContact CG2-CB 3.46Å; I539-R563 HydrophobicContact CG2-CG 3.6Å; I539-R563 VanDerWaalsContact O-CZ 3.3Å; I539-R563 PolarHBondContact O-NE 3.4Å; I539-R563 VanDerWaalsContact O-NE 3.09Å; I539-R563 PolarHBondContact O-NH2 2.9Å; I539-R563 VanDerWaalsContact O-NH2 3.11Å
540	G	39.9	Very low	49.3	Very low	38 Å²	38	89.2 Å²	89.2	39%	0.392	48%	0.478	S	S	.	.			trans	156	125.5	168.9	0	0	0	0	0	113.6	V536 G537 E542	V536-G540 PolarHBondContact O-N 3.32Å; G537-G540 PolarHBondContact O-N 2.77Å; G540-E542 PolarHBondContact O-N 3.48Å; G540-E542 VanDerWaalsContact O-N 3.14Å
541	K	37.9	Very low	46.9	Very low	212 Å²	212	91.5 Å²	91.5	92%	0.922	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	14.7	179.6	-91.3	-174.9	171.5	-177.6	0	115.4
542	E	41	Very low	44.6	Very low	108 Å²	108	95.3 Å²	95.3	51%	0.505	53%	0.529	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123	6.7	-160.6	-95.9	179.6	173.1	0	0	116.5	G540 K1032 R1113	G540-E542 PolarHBondContact O-N 3.48Å; G540-E542 VanDerWaalsContact O-N 3.14Å; E542-K1032 IonicContact OE1-NZ 3.68Å; E542-R1113 IonicContact OE1-NH1 3.19Å
543	L	37.7	Very low	42.8	Very low	147 Å²	147	100.5 Å²	100.5	77%	0.77	56%	0.556	S	S	*	*			trans	-148.3	71.6	-175.6	-131.2	101.1	0	0	0	115
544	L	32.9	Very low	41.7	Very low	118 Å²	118	100.5 Å²	100.5	62%	0.618	56%	0.56	S	S	*	*			trans	-144.9	101.1	169	-86	173.9	0	0	0	111.1	Q533	Q533-L544 HydrophobicContact CG-CD1 4.18Å
545	C	32.9	Very low	40.2	Very low	129 Å²	129	104.3 Å²	104.3	87%	0.872	58%	0.577	S	S	*	*			trans	-173.3	87.1	150.5	-104.8	0	0	0	0	108.7
546	S	34.5	Very low	39	Very low	122 Å²	122	104.5 Å²	104.5	85%	0.853	58%	0.578	S	S	*	*			trans	-154.8	105	164.3	-54.2	0	0	0	0	106.2
547	D	32.9	Very low	38.7	Very low	165 Å²	165	108.3 Å²	108.3	88%	0.882	59%	0.594	S	S	*	*			trans	-67.9	129.9	174.5	-68.4	-60.7	0	0	0	109.8
548	E	36.1	Very low	38.9	Very low	183 Å²	183	114.5 Å²	114.5	86%	0.855	61%	0.606	S	S	*	*			trans	175.5	108.8	135	-98	-179.8	-176.2	0	0	111.7
549	L	34.1	Very low	38.8	Very low	148 Å²	148	112 Å²	112	78%	0.775	60%	0.595	S	S	*	*			trans	39.2	133.3	131.8	-101.8	64.6	0	0	0	122.2
550	H	32.9	Very low	39.2	Very low	181 Å²	181	111.3 Å²	111.3	84%	0.838	59%	0.592	S	S	*	*			trans	74.5	87.4	157.9	-65.8	83.7	0	0	0	119.5
551	G	31.7	Very low	40.5	Very low	52 Å²	52	111.7 Å²	111.7	54%	0.536	59%	0.585	S	S	.	*			trans	172.6	24.5	164.3	0	0	0	0	0	118.3	L553 N554	G551-L553 VanDerWaalsContact C-N 3.29Å; G551-L553 PolarHBondContact O-N 2.74Å; G551-N554 PolarHBondContact O-N 2.97Å
552	S	34.5	Very low	42	Very low	80 Å²	80	108.4 Å²	108.4	56%	0.559	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.8	53.5	-159.1	-162.9	0	0	0	0	116.5
553	L	36.9	Very low	43.3	Very low	122 Å²	122	106.8 Å²	106.8	64%	0.639	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-157.1	-31.6	159	-141.4	80.7	0	0	0	111.9	Q528 G551	Q528-L553 HydrophobicContact CG-CD1 3.99Å; G551-L553 VanDerWaalsContact C-N 3.29Å; G551-L553 PolarHBondContact O-N 2.74Å
554	N	45.1	Very low	45.1	Very low	117 Å²	117	101 Å²	101	63%	0.626	53%	0.533	S	S	*	.	H	α-helix	trans	-82.3	-19.4	177.2	-83	-56.7	0	0	0	113.6	G551 F556 R558	G551-N554 PolarHBondContact O-N 2.97Å; N554-F556 PolarHBondContact O-N 3.04Å; N554-R558 VanDerWaalsContact O-CD 3.23Å; N554-R558 WeakPolarHBondContact O-CD 3.46Å; N554-R558 WeakPolarHBondContact O-CG 3.18Å
555	F	37.4	Very low	47.5	Very low	117 Å²	117	99.5 Å²	99.5	51%	0.513	52%	0.519	S	S	.	.	H	α-helix	trans	-60	-35.4	179.5	-172.4	-104.1	0	0	0	111.5	R558 V559	F555-R558 VanDerWaalsContact O-CB 3.31Å; F555-R558 WeakPolarHBondContact O-CB 3.3Å; F555-R558 PolarHBondContact O-N 3.19Å; F555-V559 HydrophobicContact CD1-CG2 3.92Å; F555-V559 HydrophobicContact CE1-CG2 3.55Å; F555-V559 HydrophobicContact CZ-CG2 3.99Å; F555-V559 PolarHBondContact O-N 3.25Å
556	F	38.5	Very low	49.8	Very low	4 Å²	4	99.5 Å²	99.5	2%	0.018	50%	0.501	C	S	.	.	H	α-helix	trans	-87	-45.3	-159.2	-168.5	-129.7	0	0	0	115.9	Y531 D532 Q535 V536 N554 R558 V559 L560	Y531-F556 HydrophobicContact CD1-CD1 4.05Å; Y531-F556 AromaticContact CD1-CE1 3.46Å; Y531-F556 HydrophobicContact CD1-CE1 3.46Å; Y531-F556 VanDerWaalsContact CD1-CE1 3.46Å; Y531-F556 HydrophobicContact CD1-CZ 4.44Å; Y531-F556 HydrophobicContact CE1-CD1 4.25Å; Y531-F556 AromaticContact CE1-CE1 3.59Å; Y531-F556 HydrophobicContact CE1-CE1 3.59Å; Y531-F556 HydrophobicContact CG-CE1 4.45Å; Y531-F556 WeakPolarHBondContact O-CE1 3.14Å; Y531-F556 WeakPolarHBondContact O-CZ 3.43Å; D532-F556 VanDerWaalsContact C-CE2 3.5Å; D532-F556 VanDerWaalsContact CA-CD2 3.46Å; D532-F556 HydrophobicContact CB-CB 4.32Å; D532-F556 HydrophobicContact CB-CD1 4.35Å; D532-F556 HydrophobicContact CB-CD2 3.74Å; D532-F556 HydrophobicContact CB-CE2 4.15Å; D532-F556 HydrophobicContact CB-CG 3.87Å; D532-F556 HydrophobicContact CB-CZ 4.45Å; D532-F556 VanDerWaalsContact CG-CB 3.4Å; D532-F556 WeakPolarHBondContact O-CE2 3.37Å; D532-F556 VanDerWaalsContact O-CZ 3.24Å; D532-F556 WeakPolarHBondContact O-CZ 3.34Å; D532-F556 WeakPolarHBondContact OD1-CB 3.34Å; D532-F556 WeakPolarHBondContact OD1-CD1 3.49Å; D532-F556 WeakPolarHBondContact OD1-CG 3.33Å; D532-F556 WeakPolarHBondContact OD2-CB 3.33Å; Q535-F556 VanDerWaalsContact C-CE2 3.43Å; Q535-F556 VanDerWaalsContact CA-CZ 3.48Å; Q535-F556 HydrophobicContact CB-CE1 4.02Å; Q535-F556 HydrophobicContact CB-CE2 4Å; Q535-F556 HydrophobicContact CB-CZ 3.22Å; Q535-F556 HydrophobicContact CG-CE1 3.92Å; Q535-F556 HydrophobicContact CG-CZ 3.56Å; V536-F556 HydrophobicContact CG2-CD2 4.07Å; V536-F556 HydrophobicContact CG2-CE2 3.79Å; N554-F556 PolarHBondContact O-N 3.04Å; F556-R558 PolarHBondContact O-N 2.71Å; F556-R558 VanDerWaalsContact O-N 3.11Å; F556-V559 HydrophobicContact CD2-CB 4.37Å; F556-V559 PolarHBondContact O-N 3.13Å; F556-L560 HydrophobicContact CD1-CD1 3.72Å; F556-L560 HydrophobicContact CD2-CD1 4.5Å; F556-L560 HydrophobicContact CE1-CD1 3.52Å; F556-L560 HydrophobicContact CE1-CG 4.33Å; F556-L560 HydrophobicContact CE2-CD1 4.21Å; F556-L560 HydrophobicContact CE2-CG 4.2Å; F556-L560 HydrophobicContact CG-CD1 4.24Å; F556-L560 HydrophobicContact CZ-CD1 3.81Å; F556-L560 HydrophobicContact CZ-CD2 4.46Å; F556-L560 HydrophobicContact CZ-CG 4.13Å; F556-L560 WeakPolarHBondContact O-CG 3.35Å; F556-L560 PolarHBondContact O-N 2.68Å
557	Q	46.9	Very low	52.2	Low	106 Å²	106	95.7 Å²	95.7	50%	0.495	47%	0.471	S	S	.	.	H	α-helix	trans	-57	-27.9	167.5	-153.5	174.2	33.7	0	0	110.8	I561	Q557-I561 HydrophobicContact CG-CD1 4.16Å; Q557-I561 VanDerWaalsContact O-CB 3.27Å; Q557-I561 WeakPolarHBondContact O-CB 3.41Å; Q557-I561 WeakPolarHBondContact O-CD1 3.24Å; Q557-I561 WeakPolarHBondContact O-CG1 3.48Å; Q557-I561 PolarHBondContact O-N 2.86Å
558	R	54.5	Low	54.9	Low	166 Å²	166	87.8 Å²	87.8	63%	0.626	43%	0.429	S	S	*	.	H	α-helix	trans	-70.3	-39.6	171.1	-65.6	172.2	-178.7	-142.7	-1.2	113.3	N554 F555 F556 K562	N554-R558 VanDerWaalsContact O-CD 3.23Å; N554-R558 WeakPolarHBondContact O-CD 3.46Å; N554-R558 WeakPolarHBondContact O-CG 3.18Å; F555-R558 VanDerWaalsContact O-CB 3.31Å; F555-R558 WeakPolarHBondContact O-CB 3.3Å; F555-R558 PolarHBondContact O-N 3.19Å; F556-R558 PolarHBondContact O-N 2.71Å; F556-R558 VanDerWaalsContact O-N 3.11Å; R558-K562 WeakPolarHBondContact O-CB 3.44Å; R558-K562 WeakPolarHBondContact O-CG 3.19Å; R558-K562 PolarHBondContact O-N 2.85Å
559	V	50.6	Low	57.4	Low	21 Å²	21	80.2 Å²	80.2	13%	0.127	39%	0.394	C	S	.	.	H	α-helix	trans	-65.2	-44.1	174	177	0	0	0	0	110.9	V536 I539 F555 F556 K562 R563	V536-V559 HydrophobicContact CB-CG1 4.26Å; V536-V559 HydrophobicContact CG1-CG1 4.45Å; V536-V559 HydrophobicContact CG2-CB 4.05Å; V536-V559 HydrophobicContact CG2-CG1 3.64Å; V536-V559 HydrophobicContact CG2-CG2 3.98Å; I539-V559 HydrophobicContact CG2-CG1 4.16Å; F555-V559 HydrophobicContact CD1-CG2 3.92Å; F555-V559 HydrophobicContact CE1-CG2 3.55Å; F555-V559 HydrophobicContact CZ-CG2 3.99Å; F555-V559 PolarHBondContact O-N 3.25Å; F556-V559 HydrophobicContact CD2-CB 4.37Å; F556-V559 PolarHBondContact O-N 3.13Å; V559-K562 CarbonylContact O-C 3.44Å; V559-K562 WeakPolarHBondContact O-CA 3.5Å; V559-K562 WeakPolarHBondContact O-CB 3.39Å; V559-K562 PolarHBondContact O-N 3.31Å; V559-K562 VanDerWaalsContact O-N 3.11Å; V559-R563 PolarHBondContact O-N 2.84Å
560	L	55.4	Low	60	Low	2 Å²	2	73.9 Å²	73.9	1%	0.01	36%	0.36	C	S	.	.	H	α-helix	trans	-59.7	-49.5	177.7	-73.8	164	0	0	0	112.4	P502 G503 Q535 I539 F556 K562 R563 A564	P502-L560 HydrophobicContact CB-CD2 3.87Å; G503-L560 VanDerWaalsContact N-CD2 3.28Å; Q535-L560 HydrophobicContact CB-CD1 4.41Å; Q535-L560 HydrophobicContact CB-CD2 3.36Å; Q535-L560 HydrophobicContact CB-CG 4.2Å; Q535-L560 HydrophobicContact CG-CD2 4.28Å; I539-L560 HydrophobicContact CD1-CD2 3.53Å; F556-L560 HydrophobicContact CD1-CD1 3.72Å; F556-L560 HydrophobicContact CD2-CD1 4.5Å; F556-L560 HydrophobicContact CE1-CD1 3.52Å; F556-L560 HydrophobicContact CE1-CG 4.33Å; F556-L560 HydrophobicContact CE2-CD1 4.21Å; F556-L560 HydrophobicContact CE2-CG 4.2Å; F556-L560 HydrophobicContact CG-CD1 4.24Å; F556-L560 HydrophobicContact CZ-CD1 3.81Å; F556-L560 HydrophobicContact CZ-CD2 4.46Å; F556-L560 HydrophobicContact CZ-CG 4.13Å; F556-L560 WeakPolarHBondContact O-CG 3.35Å; F556-L560 PolarHBondContact O-N 2.68Å; L560-K562 VanDerWaalsContact C-N 3.34Å; L560-K562 PolarHBondContact O-N 3.24Å; L560-R563 PolarHBondContact O-N 3.22Å; L560-A564 WeakPolarHBondContact O-CB 3.41Å; L560-A564 PolarHBondContact O-N 3.39Å
561	I	67.2	Low	62.7	Low	46 Å²	46	65.3 Å²	65.3	24%	0.236	32%	0.32	C	S	.	.	H	α-helix	trans	-64.3	-38.2	173.5	-68.5	169.3	0	0	0	110.7	Q557 R565 L629	Q557-I561 HydrophobicContact CG-CD1 4.16Å; Q557-I561 VanDerWaalsContact O-CB 3.27Å; Q557-I561 WeakPolarHBondContact O-CB 3.41Å; Q557-I561 WeakPolarHBondContact O-CD1 3.24Å; Q557-I561 WeakPolarHBondContact O-CG1 3.48Å; Q557-I561 PolarHBondContact O-N 2.86Å; I561-R565 HydrophobicContact CG2-CG 4.26Å; I561-R565 VanDerWaalsContact O-CB 3.23Å; I561-R565 WeakPolarHBondContact O-CB 3.32Å; I561-R565 WeakPolarHBondContact O-CD 3.25Å; I561-R565 WeakPolarHBondContact O-CG 3.36Å; I561-R565 PolarHBondContact O-N 3.38Å; I561-L629 HydrophobicContact CG1-CD1 4.28Å; I561-L629 HydrophobicContact CG2-CD1 4.1Å
562	K	69	Low	65.5	Low	143 Å²	143	63 Å²	63	62%	0.622	30%	0.296	S	S	*	.	H	α-helix	trans	-60.9	-44.4	175.6	-84.2	174.9	176.1	-175	0	111.9	R558 V559 L560 R566	R558-K562 WeakPolarHBondContact O-CB 3.44Å; R558-K562 WeakPolarHBondContact O-CG 3.19Å; R558-K562 PolarHBondContact O-N 2.85Å; V559-K562 CarbonylContact O-C 3.44Å; V559-K562 WeakPolarHBondContact O-CA 3.5Å; V559-K562 WeakPolarHBondContact O-CB 3.39Å; V559-K562 PolarHBondContact O-N 3.31Å; V559-K562 VanDerWaalsContact O-N 3.11Å; L560-K562 VanDerWaalsContact C-N 3.34Å; L560-K562 PolarHBondContact O-N 3.24Å; K562-R566 WeakPolarHBondContact O-CB 3.44Å; K562-R566 PolarHBondContact O-N 2.75Å
563	R	68.3	Low	67.9	Low	74 Å²	74	59.1 Å²	59.1	28%	0.279	27%	0.269	S	S	.	.	H	α-helix	trans	-76	-38.2	177	-157.7	-141.2	-156.5	167.8	12.9	113	M538 I539 V559 L560 R565 R566 N567	M538-R563 PolarHBondContact O-NH1 2.82Å; M538-R563 PolarHBondContact O-NH2 3.39Å; I539-R563 HydrophobicContact CB-CB 4.4Å; I539-R563 HydrophobicContact CB-CG 4.37Å; I539-R563 HydrophobicContact CD1-CB 3.76Å; I539-R563 HydrophobicContact CD1-CG 4.33Å; I539-R563 HydrophobicContact CG1-CB 4.37Å; I539-R563 HydrophobicContact CG1-CG 4.48Å; I539-R563 HydrophobicContact CG2-CB 3.46Å; I539-R563 VanDerWaalsContact CG2-CB 3.46Å; I539-R563 HydrophobicContact CG2-CG 3.6Å; I539-R563 VanDerWaalsContact O-CZ 3.3Å; I539-R563 PolarHBondContact O-NE 3.4Å; I539-R563 VanDerWaalsContact O-NE 3.09Å; I539-R563 PolarHBondContact O-NH2 2.9Å; I539-R563 VanDerWaalsContact O-NH2 3.11Å; V559-R563 PolarHBondContact O-N 2.84Å; L560-R563 PolarHBondContact O-N 3.22Å; R563-R565 PolarHBondContact O-N 3.48Å; R563-R566 CarbonylContact O-C 3.53Å; R563-R566 PolarHBondContact O-N 2.81Å; R563-R566 VanDerWaalsContact O-N 3.07Å; R563-N567 WeakPolarHBondContact CG-OD1 3.28Å; R563-N567 WeakPolarHBondContact O-CB 3.2Å; R563-N567 PolarHBondContact O-N 2.99Å; R563-N567 PolarHBondContact O-OD1 3.07Å
564	A	74.6	Confident	70.2	Confident	26 Å²	26	54.9 Å²	54.9	22%	0.215	25%	0.246	C	C	.	.	H	α-helix	trans	-56.7	-41.8	173.5	0	0	0	0	0	110.4	L560 F568 M626	L560-A564 WeakPolarHBondContact O-CB 3.41Å; L560-A564 PolarHBondContact O-N 3.39Å; A564-F568 VanDerWaalsContact O-CB 3.25Å; A564-F568 WeakPolarHBondContact O-CB 3.49Å; A564-F568 PolarHBondContact O-N 3.3Å; A564-M626 HydrophobicContact CB-SD 3.71Å
565	R	83.3	Confident	72.1	Confident	86 Å²	86	52.7 Å²	52.7	33%	0.325	23%	0.231	S	C	.	.	H	α-helix	trans	-64.4	-44.9	170.6	-70.8	175	172.7	163.6	1.4	113.3	I561 R563 F568 I569 M626 W632	I561-R565 HydrophobicContact CG2-CG 4.26Å; I561-R565 VanDerWaalsContact O-CB 3.23Å; I561-R565 WeakPolarHBondContact O-CB 3.32Å; I561-R565 WeakPolarHBondContact O-CD 3.25Å; I561-R565 WeakPolarHBondContact O-CG 3.36Å; I561-R565 PolarHBondContact O-N 3.38Å; R563-R565 PolarHBondContact O-N 3.48Å; R565-F568 PolarHBondContact O-N 3.3Å; R565-I569 VanDerWaalsContact O-CG1 3.28Å; R565-I569 WeakPolarHBondContact O-CG1 3.05Å; R565-I569 PolarHBondContact O-N 3.47Å; R565-M626 HydrophobicContact CG-CE 4.04Å; R565-W632 HydrophobicContact CB-CH2 3.55Å; R565-W632 HydrophobicContact CB-CZ2 3.87Å; R565-W632 HydrophobicContact CB-CZ3 3.95Å; R565-W632 HydrophobicContact CG-CD2 3.86Å; R565-W632 HydrophobicContact CG-CE3 3.8Å; R565-W632 HydrophobicContact CG-CH2 3.54Å; R565-W632 HydrophobicContact CG-CZ2 3.6Å; R565-W632 HydrophobicContact CG-CZ3 3.64Å
566	R	82.3	Confident	74.1	Confident	128 Å²	128	47.7 Å²	47.7	48%	0.483	21%	0.21	S	C	.	.	H	α-helix	trans	-60	-55.6	176.4	179.1	176.7	160.8	-168.5	-7.4	110.8	K562 R563 F568 I569 E570	K562-R566 WeakPolarHBondContact O-CB 3.44Å; K562-R566 PolarHBondContact O-N 2.75Å; R563-R566 CarbonylContact O-C 3.53Å; R563-R566 PolarHBondContact O-N 2.81Å; R563-R566 VanDerWaalsContact O-N 3.07Å; R566-F568 PolarHBondContact O-N 3.09Å; R566-I569 CarbonylContact O-C 3.53Å; R566-I569 WeakPolarHBondContact O-CA 3.26Å; R566-I569 WeakPolarHBondContact O-CB 3.29Å; R566-I569 PolarHBondContact O-N 2.96Å; R566-E570 HydrophobicContact CG-CG 4.44Å; R566-E570 IonicContact NE-OE1 3.28Å; R566-E570 WeakPolarHBondContact O-CG 3.49Å; R566-E570 PolarHBondContact O-N 2.89Å
567	N	84.7	Confident	75.8	Confident	42 Å²	42	51.2 Å²	51.2	23%	0.225	22%	0.223	C	C	.	.	H	α-helix	trans	-57.1	-33.5	176.8	-71.5	14.9	0	0	0	112.5	R563 E570 L571 R622	R563-N567 WeakPolarHBondContact CG-OD1 3.28Å; R563-N567 WeakPolarHBondContact O-CB 3.2Å; R563-N567 PolarHBondContact O-N 2.99Å; R563-N567 PolarHBondContact O-OD1 3.07Å; N567-E570 PolarHBondContact O-N 3.47Å; N567-L571 WeakPolarHBondContact O-CB 3.49Å; N567-L571 PolarHBondContact O-N 3.07Å; N567-R622 HydrophobicContact CB-CG 4.38Å
568	F	89.9	Confident	77.5	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-69.1	-35.2	172.4	-170.4	-100.1	0	0	0	112.8	A564 R565 R566 L571 M572 Y623 M626 W632 R633 A636 V637	A564-F568 VanDerWaalsContact O-CB 3.25Å; A564-F568 WeakPolarHBondContact O-CB 3.49Å; A564-F568 PolarHBondContact O-N 3.3Å; R565-F568 PolarHBondContact O-N 3.3Å; R566-F568 PolarHBondContact O-N 3.09Å; F568-L571 HydrophobicContact CD2-CD2 4.31Å; F568-L571 HydrophobicContact CE2-CD2 4.31Å; F568-M572 HydrophobicContact CD1-CE 3.87Å; F568-M572 HydrophobicContact CD1-CG 4.42Å; F568-M572 HydrophobicContact CD1-SD 4.14Å; F568-M572 HydrophobicContact CE1-CE 3.92Å; F568-M572 HydrophobicContact CE1-CG 4.08Å; F568-M572 HydrophobicContact CE1-SD 3.61Å; F568-M572 HydrophobicContact CZ-CG 4.45Å; F568-M572 HydrophobicContact CZ-SD 4.34Å; F568-M572 WeakPolarHBondContact O-CG 3.45Å; F568-M572 PolarHBondContact O-N 2.94Å; F568-M572 VanDerWaalsContact O-N 3.08Å; F568-Y623 AromaticContact CE2-CD2 3.47Å; F568-Y623 HydrophobicContact CE2-CD2 3.47Å; F568-Y623 VanDerWaalsContact CE2-CD2 3.47Å; F568-Y623 HydrophobicContact CE2-CE2 4.03Å; F568-Y623 HydrophobicContact CE2-CG 4.18Å; F568-Y623 AromaticContact CZ-CD2 3.96Å; F568-Y623 HydrophobicContact CZ-CD2 3.96Å; F568-Y623 HydrophobicContact CZ-CE2 4.07Å; F568-M626 HydrophobicContact CB-CE 4.42Å; F568-M626 HydrophobicContact CB-CG 3.92Å; F568-M626 HydrophobicContact CB-SD 4.43Å; F568-M626 HydrophobicContact CD2-CB 4.2Å; F568-M626 HydrophobicContact CD2-CG 3.63Å; F568-M626 HydrophobicContact CE2-CG 4.43Å; F568-M626 HydrophobicContact CG-CG 3.9Å; F568-W632 AromaticContact CD1-CZ3 3.88Å; F568-W632 HydrophobicContact CD1-CZ3 3.88Å; F568-W632 HydrophobicContact CG-CZ3 4.5Å; F568-R633 HydrophobicContact CD2-CG 4.28Å; F568-R633 HydrophobicContact CE1-CG 3.91Å; F568-R633 HydrophobicContact CE2-CG 3.49Å; F568-R633 VanDerWaalsContact CE2-CG 3.49Å; F568-R633 HydrophobicContact CZ-CB 4.38Å; F568-R633 HydrophobicContact CZ-CG 3.28Å; F568-A636 HydrophobicContact CD1-CB 4.3Å; F568-A636 HydrophobicContact CE1-CB 4.11Å; F568-V637 HydrophobicContact CE1-CG2 3.97Å; F568-V637 HydrophobicContact CZ-CG2 3.76Å
569	I	88.1	Confident	78.9	Confident	24 Å²	24	38.5 Å²	38.5	12%	0.123	17%	0.171	C	C	.	.	H	α-helix	trans	-70.7	-38.6	171.4	-61.3	161.7	0	0	0	110.7	R565 R566 L571 M572 L573 W632 P653 F654	R565-I569 VanDerWaalsContact O-CG1 3.28Å; R565-I569 WeakPolarHBondContact O-CG1 3.05Å; R565-I569 PolarHBondContact O-N 3.47Å; R566-I569 CarbonylContact O-C 3.53Å; R566-I569 WeakPolarHBondContact O-CA 3.26Å; R566-I569 WeakPolarHBondContact O-CB 3.29Å; R566-I569 PolarHBondContact O-N 2.96Å; I569-L571 PolarHBondContact O-N 3.09Å; I569-M572 HydrophobicContact CB-CE 4.34Å; I569-M572 HydrophobicContact CG1-CE 3.92Å; I569-M572 PolarHBondContact O-N 3.35Å; I569-M572 VanDerWaalsContact O-N 3.14Å; I569-L573 PolarHBondContact O-N 3.47Å; I569-W632 HydrophobicContact CD1-CH2 4.28Å; I569-W632 HydrophobicContact CG1-CH2 4.32Å; I569-P653 HydrophobicContact CD1-CB 4.31Å; I569-P653 HydrophobicContact CG2-CB 3.58Å; I569-P653 HydrophobicContact CG2-CG 4.36Å; I569-F654 HydrophobicContact CB-CZ 4.2Å; I569-F654 HydrophobicContact CG2-CD2 4.32Å; I569-F654 HydrophobicContact CG2-CE1 4.43Å; I569-F654 HydrophobicContact CG2-CE2 3.3Å; I569-F654 HydrophobicContact CG2-CZ 3.37Å
570	E	88.1	Confident	80	Confident	14 Å²	14	38.6 Å²	38.6	7%	0.065	17%	0.172	C	C	.	.	H	α-helix	trans	-59.7	-45.5	173.1	-50.6	-55.2	-174.2	0	0	110.7	R566 N567 M572 L573 E574 F654 R1033 S1035	R566-E570 HydrophobicContact CG-CG 4.44Å; R566-E570 IonicContact NE-OE1 3.28Å; R566-E570 WeakPolarHBondContact O-CG 3.49Å; R566-E570 PolarHBondContact O-N 2.89Å; N567-E570 PolarHBondContact O-N 3.47Å; E570-M572 VanDerWaalsContact C-N 3.32Å; E570-M572 PolarHBondContact O-N 3.21Å; E570-L573 WeakPolarHBondContact O-CB 3.38Å; E570-L573 PolarHBondContact O-N 3.35Å; E570-L573 VanDerWaalsContact O-N 3.1Å; E570-E574 WeakPolarHBondContact O-CG 3.37Å; E570-E574 PolarHBondContact O-N 2.64Å; E570-F654 WeakPolarHBondContact OE2-CZ 3.48Å; E570-R1033 IonicContact OE1-CZ 3.81Å; E570-R1033 IonicContact OE1-NE 3.35Å; E570-R1033 PolarHBondContact OE1-NE 3.23Å; E570-R1033 IonicContact OE1-NH2 2.74Å; E570-R1033 IonicContact OE2-CZ 3.29Å; E570-R1033 IonicContact OE2-NE 3.93Å; E570-R1033 PolarHBondContact OE2-NE 3.26Å; E570-R1033 VanDerWaalsContact OE2-NE 3.14Å; E570-R1033 IonicContact OE2-NH2 2.7Å; E570-R1033 PolarHBondContact OE2-NH2 3.33Å; E570-S1035 PolarHBondContact OE2-OG 2.83Å
571	L	90.1	Very high	81	Confident	1 Å²	1	39.4 Å²	39.4	1%	0.005	18%	0.177	C	C	.	.	H	α-helix	trans	-54.9	-45.6	172	169.9	61	0	0	0	111.9	N567 F568 I569 L573 E574 K575 L617 D620 R622	N567-L571 WeakPolarHBondContact O-CB 3.49Å; N567-L571 PolarHBondContact O-N 3.07Å; F568-L571 HydrophobicContact CD2-CD2 4.31Å; F568-L571 HydrophobicContact CE2-CD2 4.31Å; I569-L571 PolarHBondContact O-N 3.09Å; L571-L573 VanDerWaalsContact C-N 3.3Å; L571-L573 PolarHBondContact O-N 2.87Å; L571-E574 PolarHBondContact O-N 3.4Å; L571-K575 HydrophobicContact CD1-CG 3.74Å; L571-K575 WeakPolarHBondContact O-CB 3.15Å; L571-K575 WeakPolarHBondContact O-CG 3.2Å; L571-K575 PolarHBondContact O-N 3.37Å; L571-L617 HydrophobicContact CD1-CD2 4.31Å; L571-L617 HydrophobicContact CD2-CD2 4.48Å; L571-L617 HydrophobicContact CG-CD2 4.21Å; L571-D620 HydrophobicContact CD1-CB 3.64Å; L571-D620 WeakPolarHBondContact CD1-OD2 3.39Å; L571-D620 HydrophobicContact CD2-CB 3.92Å; L571-D620 HydrophobicContact CG-CB 4.45Å; L571-R622 HydrophobicContact CB-CB 4.4Å; L571-R622 HydrophobicContact CD2-CB 4.15Å
572	M	89.5	Confident	81.6	Confident	3 Å²	3	37.2 Å²	37.2	2%	0.015	17%	0.166	C	C	.	.	H	α-helix	trans	-66.4	-30.3	178.9	-71.3	-169.8	-60.6	0	0	113	F568 I569 E570 K575 V576 F579 A636 V637 F640	F568-M572 HydrophobicContact CD1-CE 3.87Å; F568-M572 HydrophobicContact CD1-CG 4.42Å; F568-M572 HydrophobicContact CD1-SD 4.14Å; F568-M572 HydrophobicContact CE1-CE 3.92Å; F568-M572 HydrophobicContact CE1-CG 4.08Å; F568-M572 HydrophobicContact CE1-SD 3.61Å; F568-M572 HydrophobicContact CZ-CG 4.45Å; F568-M572 HydrophobicContact CZ-SD 4.34Å; F568-M572 WeakPolarHBondContact O-CG 3.45Å; F568-M572 PolarHBondContact O-N 2.94Å; F568-M572 VanDerWaalsContact O-N 3.08Å; I569-M572 HydrophobicContact CB-CE 4.34Å; I569-M572 HydrophobicContact CG1-CE 3.92Å; I569-M572 PolarHBondContact O-N 3.35Å; I569-M572 VanDerWaalsContact O-N 3.14Å; E570-M572 VanDerWaalsContact C-N 3.32Å; E570-M572 PolarHBondContact O-N 3.21Å; M572-K575 CarbonylContact O-C 3.52Å; M572-V576 VanDerWaalsContact O-CA 3.28Å; M572-V576 WeakPolarHBondContact O-CA 3.44Å; M572-V576 PolarHBondContact O-N 2.94Å; M572-F579 HydrophobicContact CB-CE2 4.13Å; M572-F579 HydrophobicContact CB-CZ 4.07Å; M572-F579 HydrophobicContact CG-CE2 4.16Å; M572-F579 HydrophobicContact CG-CZ 3.72Å; M572-F579 HydrophobicContact SD-CE1 4.31Å; M572-F579 HydrophobicContact SD-CZ 3.89Å; M572-A636 HydrophobicContact CE-CB 4.23Å; M572-V637 HydrophobicContact SD-CG2 4.07Å; M572-F640 HydrophobicContact CB-CD1 3.67Å; M572-F640 HydrophobicContact CB-CE1 3.76Å; M572-F640 HydrophobicContact CB-CG 4.33Å; M572-F640 HydrophobicContact CB-CZ 4.48Å; M572-F640 HydrophobicContact CE-CB 3.99Å; M572-F640 HydrophobicContact CE-CG 4.23Å; M572-F640 HydrophobicContact CG-CD1 4.32Å; M572-F640 VanDerWaalsContact O-CE1 3.26Å; M572-F640 WeakPolarHBondContact O-CE1 3.28Å; M572-F640 HydrophobicContact SD-CB 3.85Å; M572-F640 HydrophobicContact SD-CD1 4.06Å; M572-F640 HydrophobicContact SD-CG 4.17Å
573	L	84.8	Confident	81.9	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-73.9	-46.8	171.5	-71.1	179.1	0	0	0	112.1	I569 E570 L571 K575 V576 F640 F654 Y1009 H1039	I569-L573 PolarHBondContact O-N 3.47Å; E570-L573 WeakPolarHBondContact O-CB 3.38Å; E570-L573 PolarHBondContact O-N 3.35Å; E570-L573 VanDerWaalsContact O-N 3.1Å; L571-L573 VanDerWaalsContact C-N 3.3Å; L571-L573 PolarHBondContact O-N 2.87Å; L573-K575 PolarHBondContact O-N 3.04Å; L573-V576 WeakPolarHBondContact O-CB 3.39Å; L573-V576 VanDerWaalsContact O-CG1 3.23Å; L573-V576 WeakPolarHBondContact O-CG1 3.28Å; L573-V576 PolarHBondContact O-N 3.12Å; L573-F640 HydrophobicContact CD2-CE2 4.08Å; L573-F640 HydrophobicContact CD2-CZ 3.83Å; L573-F654 HydrophobicContact CD1-CD2 4.4Å; L573-F654 HydrophobicContact CD1-CE2 3.39Å; L573-F654 HydrophobicContact CD1-CZ 3.65Å; L573-F654 HydrophobicContact CG-CE2 4.13Å; L573-Y1009 HydrophobicContact CD2-CE1 4.36Å; L573-Y1009 HydrophobicContact CD2-CE2 3.99Å; L573-Y1009 WeakPolarHBondContact CD2-OH 3.22Å; L573-H1039 VanDerWaalsContact CD2-NE2 3.31Å; L573-H1039 WeakPolarHBondContact CD2-NE2 3.18Å; L573-H1039 PolarHBondContact O-CD2 2.85Å; L573-H1039 PolarHBondContact O-NE2 3Å
574	E	85.3	Confident	81.9	Confident	33 Å²	33	27.7 Å²	27.7	15%	0.154	13%	0.127	C	C	.	.	H	α-helix	trans	-60.2	-29.6	175.8	-71.5	165.2	-137.2	0	0	112.3	E570 L571 R622 R1034 A1038	E570-E574 WeakPolarHBondContact O-CG 3.37Å; E570-E574 PolarHBondContact O-N 2.64Å; L571-E574 PolarHBondContact O-N 3.4Å; E574-R622 IonicContact OE1-CZ 3.6Å; E574-R622 IonicContact OE1-NH1 2.74Å; E574-R622 PolarHBondContact OE1-NH1 3.05Å; E574-R622 IonicContact OE1-NH2 3.44Å; E574-R622 IonicContact OE2-CZ 2.65Å; E574-R622 VanDerWaalsContact OE2-CZ 3.31Å; E574-R622 IonicContact OE2-NH1 3.78Å; E574-R622 PolarHBondContact OE2-NH1 2.99Å; E574-R622 IonicContact OE2-NH2 2.68Å; E574-R622 PolarHBondContact OE2-NH2 3.23Å; E574-R1034 HydrophobicContact CG-CG 4.39Å; E574-A1038 HydrophobicContact CB-CB 4.29Å; E574-A1038 HydrophobicContact CG-CB 4.15Å
575	K	85	Confident	81.7	Confident	70 Å²	70	29.4 Å²	29.4	30%	0.304	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.2	22.2	174.7	-55.4	-58.2	-176.3	-175.2	0	112.8	L571 M572 L573 Y577 I578 L617	L571-K575 HydrophobicContact CD1-CG 3.74Å; L571-K575 WeakPolarHBondContact O-CB 3.15Å; L571-K575 WeakPolarHBondContact O-CG 3.2Å; L571-K575 PolarHBondContact O-N 3.37Å; M572-K575 CarbonylContact O-C 3.52Å; L573-K575 PolarHBondContact O-N 3.04Å; K575-Y577 HydrophobicContact CB-CE1 4.38Å; K575-Y577 HydrophobicContact CD-CE1 3.74Å; K575-Y577 PolarHBondContact O-N 3.25Å; K575-Y577 VanDerWaalsContact O-N 3.08Å; K575-I578 HydrophobicContact CB-CD1 3.91Å; K575-I578 HydrophobicContact CB-CG1 4.31Å; K575-I578 HydrophobicContact CG-CD1 4.49Å; K575-I578 WeakPolarHBondContact O-CB 3.28Å; K575-I578 WeakPolarHBondContact O-CG1 3.45Å; K575-I578 PolarHBondContact O-N 3.35Å; K575-L617 HydrophobicContact CB-CD2 3.79Å; K575-L617 HydrophobicContact CG-CD2 4Å
576	V	80.1	Confident	81.1	Confident	12 Å²	12	26.1 Å²	26.1	7%	0.073	12%	0.121	C	C	.	.	H	α-helix	trans	-55.9	-31.2	-177.9	69.7	0	0	0	0	112.4	M572 L573 I578 F579 V580 F640 L644	M572-V576 VanDerWaalsContact O-CA 3.28Å; M572-V576 WeakPolarHBondContact O-CA 3.44Å; M572-V576 PolarHBondContact O-N 2.94Å; L573-V576 WeakPolarHBondContact O-CB 3.39Å; L573-V576 VanDerWaalsContact O-CG1 3.23Å; L573-V576 WeakPolarHBondContact O-CG1 3.28Å; L573-V576 PolarHBondContact O-N 3.12Å; V576-I578 PolarHBondContact O-N 3.17Å; V576-F579 WeakPolarHBondContact O-CB 3.33Å; V576-F579 PolarHBondContact O-N 3.23Å; V576-V580 HydrophobicContact CG2-CG2 4.11Å; V576-V580 WeakPolarHBondContact O-CG2 3.22Å; V576-V580 PolarHBondContact O-N 2.96Å; V576-F640 HydrophobicContact CG2-CE1 4.34Å; V576-F640 HydrophobicContact CG2-CZ 4.18Å; V576-L644 HydrophobicContact CG2-CD1 4.01Å; V576-L644 HydrophobicContact CG2-CD2 4.13Å
577	Y	74.7	Confident	80.2	Confident	79 Å²	79	25.1 Å²	25.1	31%	0.31	12%	0.117	S	C	.	.	H	α-helix	trans	-56.4	-33.8	178	72.3	-89.3	0	0	0	112.7	K575 V580 C581 Y1042	K575-Y577 HydrophobicContact CB-CE1 4.38Å; K575-Y577 HydrophobicContact CD-CE1 3.74Å; K575-Y577 PolarHBondContact O-N 3.25Å; K575-Y577 VanDerWaalsContact O-N 3.08Å; Y577-V580 PolarHBondContact O-N 3.29Å; Y577-C581 VanDerWaalsContact O-CB 3.3Å; Y577-C581 WeakPolarHBondContact O-CB 3.42Å; Y577-C581 PolarHBondContact O-N 3.43Å; Y577-C581 PolarHBondContact O-SG 2.78Å; Y577-Y1042 VanDerWaalsContact CB-CE2 3.41Å; Y577-Y1042 VanDerWaalsContact CB-CZ 3.42Å; Y577-Y1042 HydrophobicContact CD1-CD2 4.35Å; Y577-Y1042 HydrophobicContact CD1-CE2 4.25Å; Y577-Y1042 AromaticContact CD2-CE2 3.73Å; Y577-Y1042 HydrophobicContact CD2-CE2 3.73Å; Y577-Y1042 AromaticContact CD2-CZ 3.88Å; Y577-Y1042 AromaticContact CG-CD2 3.96Å; Y577-Y1042 HydrophobicContact CG-CD2 3.96Å; Y577-Y1042 AromaticContact CG-CE2 3.54Å; Y577-Y1042 HydrophobicContact CG-CE2 3.54Å; Y577-Y1042 AromaticContact CG-CZ 3.89Å
578	I	82.4	Confident	79.2	Confident	5 Å²	5	28.1 Å²	28.1	3%	0.026	13%	0.133	C	C	.	.	H	α-helix	trans	-63.6	-47.5	177.5	-54.3	-176.8	0	0	0	109.6	K575 V576 C581 I582 Y612 M613 C616	K575-I578 HydrophobicContact CB-CD1 3.91Å; K575-I578 HydrophobicContact CB-CG1 4.31Å; K575-I578 HydrophobicContact CG-CD1 4.49Å; K575-I578 WeakPolarHBondContact O-CB 3.28Å; K575-I578 WeakPolarHBondContact O-CG1 3.45Å; K575-I578 PolarHBondContact O-N 3.35Å; V576-I578 PolarHBondContact O-N 3.17Å; I578-C581 PolarHBondContact O-N 2.8Å; I578-I582 HydrophobicContact CG2-CD1 4.06Å; I578-I582 WeakPolarHBondContact O-CD1 3.49Å; I578-I582 VanDerWaalsContact O-CG1 3.26Å; I578-I582 WeakPolarHBondContact O-CG1 3.37Å; I578-I582 PolarHBondContact O-N 3.43Å; I578-I582 VanDerWaalsContact O-N 3.12Å; I578-Y612 HydrophobicContact CG2-CE1 4.26Å; I578-M613 HydrophobicContact CG2-CG 4.16Å; I578-C616 HydrophobicContact CD1-CB 3.54Å
579	F	83.9	Confident	78.1	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-64.3	-41.3	177.6	-62.4	-105.7	0	0	0	111.7	M572 V576 M583 M613 L617 V637 F640 F641 L644	M572-F579 HydrophobicContact CB-CE2 4.13Å; M572-F579 HydrophobicContact CB-CZ 4.07Å; M572-F579 HydrophobicContact CG-CE2 4.16Å; M572-F579 HydrophobicContact CG-CZ 3.72Å; M572-F579 HydrophobicContact SD-CE1 4.31Å; M572-F579 HydrophobicContact SD-CZ 3.89Å; V576-F579 WeakPolarHBondContact O-CB 3.33Å; V576-F579 PolarHBondContact O-N 3.23Å; F579-M583 WeakPolarHBondContact O-CB 3.43Å; F579-M583 PolarHBondContact O-N 2.88Å; F579-M613 HydrophobicContact CB-CE 4.49Å; F579-M613 HydrophobicContact CD1-CE 3.07Å; F579-M613 HydrophobicContact CD2-CE 4.2Å; F579-M613 HydrophobicContact CE1-CE 3.02Å; F579-M613 HydrophobicContact CE2-CE 4.16Å; F579-M613 HydrophobicContact CG-CE 3.68Å; F579-M613 HydrophobicContact CZ-CE 3.6Å; F579-L617 HydrophobicContact CE2-CD1 4.33Å; F579-L617 HydrophobicContact CZ-CD1 4.09Å; F579-V637 HydrophobicContact CE1-CG1 4.02Å; F579-V637 HydrophobicContact CZ-CG1 4.37Å; F579-F640 AromaticContact CD1-CD1 3.56Å; F579-F640 HydrophobicContact CD1-CD1 3.56Å; F579-F640 HydrophobicContact CD1-CE1 4.15Å; F579-F640 HydrophobicContact CD2-CD1 4.12Å; F579-F640 HydrophobicContact CD2-CE1 4.02Å; F579-F640 HydrophobicContact CE1-CB 4.27Å; F579-F640 AromaticContact CE1-CD1 3.48Å; F579-F640 HydrophobicContact CE1-CD1 3.48Å; F579-F640 VanDerWaalsContact CE1-CD1 3.48Å; F579-F640 HydrophobicContact CE1-CE1 4.33Å; F579-F640 HydrophobicContact CE1-CG 4.36Å; F579-F640 HydrophobicContact CE2-CD1 4.05Å; F579-F640 HydrophobicContact CE2-CE1 4.19Å; F579-F640 AromaticContact CG-CD1 3.92Å; F579-F640 HydrophobicContact CG-CD1 3.92Å; F579-F640 HydrophobicContact CG-CE1 4.03Å; F579-F640 AromaticContact CZ-CD1 3.76Å; F579-F640 HydrophobicContact CZ-CD1 3.76Å; F579-F640 HydrophobicContact CZ-CE1 4.36Å; F579-F641 HydrophobicContact CD1-CB 4.16Å; F579-F641 HydrophobicContact CD1-CD2 4.47Å; F579-L644 HydrophobicContact CB-CD1 3.37Å; F579-L644 HydrophobicContact CD1-CD1 4.26Å; F579-L644 HydrophobicContact CG-CD1 3.97Å
580	V	74.4	Confident	76.6	Confident	23 Å²	23	39.6 Å²	39.6	14%	0.139	18%	0.181	C	C	.	.	H	α-helix	trans	-69.2	-42	179	174.4	0	0	0	0	111.6	V576 Y577 I582 M583 Q584 L1013	V576-V580 HydrophobicContact CG2-CG2 4.11Å; V576-V580 WeakPolarHBondContact O-CG2 3.22Å; V576-V580 PolarHBondContact O-N 2.96Å; Y577-V580 PolarHBondContact O-N 3.29Å; V580-I582 VanDerWaalsContact C-N 3.34Å; V580-I582 PolarHBondContact O-N 3.45Å; V580-M583 PolarHBondContact O-N 2.83Å; V580-Q584 HydrophobicContact CG1-CG 4.49Å; V580-Q584 WeakPolarHBondContact O-CG 3.35Å; V580-Q584 PolarHBondContact O-N 2.96Å; V580-L1013 HydrophobicContact CG2-CD2 4.24Å
581	C	75.7	Confident	74.6	Confident	18 Å²	18	50 Å²	50	12%	0.122	22%	0.219	C	C	.	.	H	α-helix	trans	-57.4	-47.7	174.8	-72.8	0	0	0	0	111.2	Y577 I578 Q584 Q585	Y577-C581 VanDerWaalsContact O-CB 3.3Å; Y577-C581 WeakPolarHBondContact O-CB 3.42Å; Y577-C581 PolarHBondContact O-N 3.43Å; Y577-C581 PolarHBondContact O-SG 2.78Å; I578-C581 PolarHBondContact O-N 2.8Å; C581-Q584 PolarHBondContact O-N 3.37Å; C581-Q585 WeakPolarHBondContact O-CG 3.17Å; C581-Q585 PolarHBondContact O-N 2.82Å
582	I	79	Confident	72.4	Confident	1 Å²	1	55.2 Å²	55.2	1%	0.005	25%	0.253	C	S	.	.	H	α-helix	trans	-65.2	-43	178.7	-67.1	166.1	0	0	0	110.8	I578 V580 Q584 Q585 S586 L605 D609 Y612 M613 F641	I578-I582 HydrophobicContact CG2-CD1 4.06Å; I578-I582 WeakPolarHBondContact O-CD1 3.49Å; I578-I582 VanDerWaalsContact O-CG1 3.26Å; I578-I582 WeakPolarHBondContact O-CG1 3.37Å; I578-I582 PolarHBondContact O-N 3.43Å; I578-I582 VanDerWaalsContact O-N 3.12Å; V580-I582 VanDerWaalsContact C-N 3.34Å; V580-I582 PolarHBondContact O-N 3.45Å; I582-Q584 VanDerWaalsContact C-N 3.32Å; I582-Q584 PolarHBondContact O-N 3.02Å; I582-Q585 CarbonylContact O-C 3.55Å; I582-Q585 WeakPolarHBondContact O-CB 3.47Å; I582-Q585 PolarHBondContact O-N 3.23Å; I582-Q585 VanDerWaalsContact O-N 3.15Å; I582-S586 WeakPolarHBondContact O-CB 3.49Å; I582-S586 PolarHBondContact O-N 2.9Å; I582-L605 HydrophobicContact CG2-CD1 3.95Å; I582-D609 HydrophobicContact CG2-CB 3.72Å; I582-D609 WeakPolarHBondContact CG2-OD2 3.37Å; I582-Y612 HydrophobicContact CD1-CD1 4Å; I582-Y612 HydrophobicContact CG1-CD1 4.38Å; I582-M613 HydrophobicContact CD1-CE 4.43Å; I582-M613 HydrophobicContact CD1-CG 3.12Å; I582-M613 HydrophobicContact CD1-SD 3.5Å; I582-M613 VanDerWaalsContact CD1-SD 3.5Å; I582-F641 HydrophobicContact CB-CE2 4.07Å; I582-F641 HydrophobicContact CG2-CE2 3.6Å; I582-F641 HydrophobicContact CG2-CZ 3.96Å
583	M	75.2	Confident	70.1	Confident	1 Å²	1	62 Å²	62	1%	0.005	29%	0.29	C	S	.	.	H	α-helix	trans	-63.9	-36.6	178.6	-166.3	-147.5	-47.1	0	0	112.5	F579 V580 S586 R587 F641 L644 H645 L1017	F579-M583 WeakPolarHBondContact O-CB 3.43Å; F579-M583 PolarHBondContact O-N 2.88Å; V580-M583 PolarHBondContact O-N 2.83Å; M583-S586 WeakPolarHBondContact CA-OG 3.33Å; M583-S586 PolarHBondContact O-N 3.28Å; M583-S586 PolarHBondContact O-OG 2.74Å; M583-S586 VanDerWaalsContact O-OG 3.05Å; M583-R587 WeakPolarHBondContact O-CB 3.38Å; M583-R587 WeakPolarHBondContact O-CG 3.43Å; M583-R587 PolarHBondContact O-N 3.46Å; M583-F641 HydrophobicContact CB-CE2 3.95Å; M583-F641 HydrophobicContact CB-CZ 4.31Å; M583-L644 HydrophobicContact CE-CB 3.48Å; M583-L644 VanDerWaalsContact CE-CB 3.48Å; M583-L644 VanDerWaalsContact CE-O 3.24Å; M583-L644 WeakPolarHBondContact CE-O 3.07Å; M583-H645 HydrophobicContact CG-CB 4.31Å; M583-H645 HydrophobicContact SD-CB 4.32Å; M583-L1017 HydrophobicContact SD-CD1 4.35Å
584	Q	69.1	Low	68.3	Low	15 Å²	15	70.2 Å²	70.2	7%	0.07	33%	0.328	C	S	.	.	H	α-helix	trans	-67.8	-41.2	173.3	-74.1	176.6	-15.2	0	0	111.1	V580 C581 I582 R587 L588 F1058	V580-Q584 HydrophobicContact CG1-CG 4.49Å; V580-Q584 WeakPolarHBondContact O-CG 3.35Å; V580-Q584 PolarHBondContact O-N 2.96Å; C581-Q584 PolarHBondContact O-N 3.37Å; I582-Q584 VanDerWaalsContact C-N 3.32Å; I582-Q584 PolarHBondContact O-N 3.02Å; Q584-R587 PolarHBondContact O-N 2.76Å; Q584-L588 WeakPolarHBondContact O-CG 3.38Å; Q584-L588 PolarHBondContact O-N 3.01Å; Q584-L588 VanDerWaalsContact O-N 3.11Å; Q584-F1058 HydrophobicContact CB-CE1 3.85Å; Q584-F1058 HydrophobicContact CB-CZ 4.01Å
585	Q	71.1	Confident	66	Low	62 Å²	62	76.6 Å²	76.6	29%	0.29	36%	0.363	S	S	.	.	H	α-helix	trans	-62.6	-42.8	172.4	-70.5	178.8	30.5	0	0	112.3	C581 I582 R587 L588 R589	C581-Q585 WeakPolarHBondContact O-CG 3.17Å; C581-Q585 PolarHBondContact O-N 2.82Å; I582-Q585 CarbonylContact O-C 3.55Å; I582-Q585 WeakPolarHBondContact O-CB 3.47Å; I582-Q585 PolarHBondContact O-N 3.23Å; I582-Q585 VanDerWaalsContact O-N 3.15Å; Q585-R587 PolarHBondContact O-N 3.41Å; Q585-L588 CarbonylContact O-C 3.34Å; Q585-L588 WeakPolarHBondContact O-CB 3.42Å; Q585-L588 PolarHBondContact O-N 2.56Å; Q585-L588 VanDerWaalsContact O-N 3.08Å; Q585-R589 WeakPolarHBondContact O-CG 3.38Å; Q585-R589 PolarHBondContact O-N 3.4Å
586	S	68.8	Low	63.8	Low	18 Å²	18	77.1 Å²	77.1	13%	0.126	38%	0.376	C	S	.	.	H	α-helix	trans	-67.8	-34.8	-179.8	74.8	0	0	0	0	112	I582 M583 L588 R589 H590	I582-S586 WeakPolarHBondContact O-CB 3.49Å; I582-S586 PolarHBondContact O-N 2.9Å; M583-S586 WeakPolarHBondContact CA-OG 3.33Å; M583-S586 PolarHBondContact O-N 3.28Å; M583-S586 PolarHBondContact O-OG 2.74Å; M583-S586 VanDerWaalsContact O-OG 3.05Å; S586-L588 VanDerWaalsContact C-N 3.3Å; S586-L588 PolarHBondContact O-N 2.93Å; S586-R589 PolarHBondContact O-N 3.38Å; S586-H590 PolarHBondContact O-N 3.49Å
587	R	64.2	Low	61.9	Low	107 Å²	107	84.7 Å²	84.7	40%	0.404	41%	0.408	S	S	.	.	H	α-helix	trans	-65.3	-30.3	169.7	-76.6	-176.3	-175.9	-174.8	5	113.1	M583 Q584 Q585	M583-R587 WeakPolarHBondContact O-CB 3.38Å; M583-R587 WeakPolarHBondContact O-CG 3.43Å; M583-R587 PolarHBondContact O-N 3.46Å; Q584-R587 PolarHBondContact O-N 2.76Å; Q585-R587 PolarHBondContact O-N 3.41Å
588	L	64.6	Low	60.2	Low	105 Å²	105	88.5 Å²	88.5	55%	0.55	43%	0.434	S	S	.	.	H	α-helix	trans	-79.5	-26.6	173.2	-68.8	168.1	0	0	0	112.9	Q584 Q585 S586 F1058	Q584-L588 WeakPolarHBondContact O-CG 3.38Å; Q584-L588 PolarHBondContact O-N 3.01Å; Q584-L588 VanDerWaalsContact O-N 3.11Å; Q585-L588 CarbonylContact O-C 3.34Å; Q585-L588 WeakPolarHBondContact O-CB 3.42Å; Q585-L588 PolarHBondContact O-N 2.56Å; Q585-L588 VanDerWaalsContact O-N 3.08Å; S586-L588 VanDerWaalsContact C-N 3.3Å; S586-L588 PolarHBondContact O-N 2.93Å; L588-F1058 HydrophobicContact CD1-CD2 4.48Å; L588-F1058 HydrophobicContact CD1-CE1 4.49Å; L588-F1058 HydrophobicContact CD1-CE2 3.51Å; L588-F1058 HydrophobicContact CD1-CZ 3.51Å
589	R	66.5	Low	57.8	Low	113 Å²	113	96.1 Å²	96.1	43%	0.426	47%	0.474	S	S	.	.	H	α-helix	trans	-76.1	-37.6	174.1	-67.5	178.4	-152.6	165.3	12.1	112.4	Q585 S586 D606 D609	Q585-R589 WeakPolarHBondContact O-CG 3.38Å; Q585-R589 PolarHBondContact O-N 3.4Å; S586-R589 PolarHBondContact O-N 3.38Å; R589-D606 IonicContact NH1-OD1 2.83Å; R589-D606 IonicContact NH1-OD2 3.78Å; R589-D606 PolarHBondContact NH1-OD2 2.91Å; R589-D609 IonicContact CZ-OD1 2.78Å; R589-D609 IonicContact CZ-OD2 3.81Å; R589-D609 VanDerWaalsContact NH1-CG 3.26Å; R589-D609 IonicContact NH1-OD1 3.67Å; R589-D609 PolarHBondContact NH1-OD1 3.22Å; R589-D609 IonicContact NH1-OD2 3.02Å; R589-D609 PolarHBondContact NH1-OD2 2.83Å; R589-D609 IonicContact NH2-OD1 3.81Å; R589-D609 PolarHBondContact NH2-OD1 2.81Å; R589-D609 IonicContact NH2-OD2 3.94Å
590	H	56.2	Low	55.6	Low	152 Å²	152	98.5 Å²	98.5	70%	0.704	49%	0.494	S	S	*	.	S	Bend	trans	-92.4	103.9	-179	-78.1	-51	0	0	0	113.2	S586	S586-H590 PolarHBondContact O-N 3.49Å
591	R	45.4	Very low	54.2	Low	232 Å²	232	102 Å²	102	88%	0.875	52%	0.52	S	S	*	.			trans	-63.6	137.1	170.1	-159.4	177.6	-164.5	168.1	3.3	110.4	D593	R591-D593 PolarHBondContact O-N 2.93Å
592	P	44.3	Very low	52.9	Low	110 Å²	110	105.4 Å²	105.4	71%	0.714	54%	0.543	S	S	*	.			trans	-77.8	112.4	178.2	29.8	-32.9	0	0	0	111.4
593	D	41.6	Very low	52	Low	147 Å²	147	107.1 Å²	107.1	79%	0.786	56%	0.555	S	S	*	*			trans	-90.2	126.3	153.8	-80.9	-35.1	0	0	0	107.9	R591 D595	R591-D593 PolarHBondContact O-N 2.93Å; D593-D595 PolarHBondContact O-N 3.12Å
594	E	46.5	Very low	51.4	Low	172 Å²	172	115.2 Å²	115.2	80%	0.804	59%	0.593	S	S	*	*	G	3₁₀ helix	trans	-74.4	-23.9	-161.5	-67.4	-153.1	114.5	0	0	115.7	S596	E594-S596 PolarHBondContact O-N 3.21Å
595	D	38.3	Very low	51.8	Low	166 Å²	166	115.4 Å²	115.4	89%	0.888	59%	0.594	S	S	*	*	G	3₁₀ helix	trans	-85.3	-6.2	-164.5	-75.7	-42.5	0	0	0	116.6	D593	D593-D595 PolarHBondContact O-N 3.12Å
596	S	38.3	Very low	52.2	Low	82 Å²	82	115.6 Å²	115.6	57%	0.573	60%	0.597	S	S	*	*	G	3₁₀ helix	trans	-96.9	7.1	-172.2	-70.5	0	0	0	0	116.1	E594 N598 N599	E594-S596 PolarHBondContact O-N 3.21Å; S596-N598 PolarHBondContact O-N 2.92Å; S596-N599 PolarHBondContact O-N 3.05Å
597	F	39.6	Very low	52.8	Low	171 Å²	171	121.1 Å²	121.1	75%	0.75	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.2	-18.4	-170.9	-108	-88	0	0	0	116.2
598	N	39.6	Very low	53.8	Low	159 Å²	159	124.1 Å²	124.1	85%	0.85	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.9	-10.7	-178.4	-75.9	-27.8	0	0	0	115.3	S596	S596-N598 PolarHBondContact O-N 2.92Å
599	N	31.4	Very low	54.8	Low	164 Å²	164	119.4 Å²	119.4	88%	0.877	61%	0.613	S	S	*	*	S	Bend	trans	-145.4	52.8	-179.1	-89.6	-33.8	0	0	0	111.7	S596	S596-N599 PolarHBondContact O-N 3.05Å
600	A	38.6	Very low	55.9	Low	50 Å²	50	115.1 Å²	115.1	41%	0.413	60%	0.597	S	S	.	*			trans	-112.6	120	179.4	0	0	0	0	0	112
601	S	43.2	Very low	57.4	Low	97 Å²	97	112.3 Å²	112.3	68%	0.678	58%	0.584	S	S	*	*			trans	-45.3	151.1	175.3	43.1	0	0	0	0	113.7
602	S	50.5	Low	59.4	Low	89 Å²	89	106.9 Å²	106.9	62%	0.622	56%	0.564	S	S	*	*	P	Polyproline II helix	trans	-46.5	136	170.8	-60.2	0	0	0	0	110.6	Q604	S602-Q604 PolarHBondContact O-N 3.14Å
603	P	58.8	Low	61.4	Low	37 Å²	37	101.7 Å²	101.7	24%	0.24	53%	0.53	C	S	.	.	P	Polyproline II helix	trans	-56.4	116.9	-179.1	23.9	-33.6	0	0	0	108.9	L605 H645	P603-L605 PolarHBondContact O-N 3.44Å; P603-H645 HydrophobicContact CG-CB 3.91Å
604	Q	63	Low	63.7	Low	172 Å²	172	96.6 Å²	96.6	80%	0.804	50%	0.502	S	S	*	.	P	Polyproline II helix	trans	-77.7	121.9	176.6	-67.1	-169.8	-0.3	0	0	107.7	S602 D606	S602-Q604 PolarHBondContact O-N 3.14Å; Q604-D606 PolarHBondContact O-N 3.16Å
605	L	76.5	Confident	65.8	Low	18 Å²	18	91.7 Å²	91.7	9%	0.094	48%	0.481	C	S	.	.	P	Polyproline II helix	trans	-71.3	118.5	166.3	-178	70.4	0	0	0	106.7	I582 P603 D609 Y610 M613 R638 F641	I582-L605 HydrophobicContact CG2-CD1 3.95Å; P603-L605 PolarHBondContact O-N 3.44Å; L605-D609 HydrophobicContact CD1-CB 3.7Å; L605-D609 HydrophobicContact CG-CB 4.39Å; L605-Y610 HydrophobicContact CD2-CD2 3.72Å; L605-Y610 HydrophobicContact CD2-CG 4.2Å; L605-M613 HydrophobicContact CD1-SD 3.69Å; L605-M613 HydrophobicContact CD2-CE 4.44Å; L605-M613 HydrophobicContact CD2-SD 3.57Å; L605-M613 VanDerWaalsContact CD2-SD 3.57Å; L605-M613 HydrophobicContact CG-SD 4.23Å; L605-R638 HydrophobicContact CD2-CG 4.4Å; L605-F641 HydrophobicContact CB-CD1 4.05Å; L605-F641 HydrophobicContact CB-CE1 4.28Å; L605-F641 HydrophobicContact CD1-CD1 3.95Å; L605-F641 HydrophobicContact CD1-CD2 4.06Å; L605-F641 HydrophobicContact CD1-CE1 3.88Å; L605-F641 HydrophobicContact CD1-CE2 4Å; L605-F641 HydrophobicContact CD1-CG 4.03Å; L605-F641 HydrophobicContact CD1-CZ 3.9Å
606	D	80.3	Confident	68.1	Low	66 Å²	66	85.6 Å²	85.6	35%	0.353	45%	0.451	S	S	.	.	P	Polyproline II helix	trans	-68.8	158.5	180	72.6	41.1	0	0	0	111.3	R589 Q604 Y608 D609 Y610	R589-D606 IonicContact NH1-OD1 2.83Å; R589-D606 IonicContact NH1-OD2 3.78Å; R589-D606 PolarHBondContact NH1-OD2 2.91Å; Q604-D606 PolarHBondContact O-N 3.16Å; D606-Y608 PolarHBondContact O-N 2.75Å; D606-Y608 WeakPolarHBondContact OD1-CB 3.25Å; D606-Y608 PolarHBondContact OD1-N 3.34Å; D606-D609 PolarHBondContact O-N 3.29Å; D606-D609 WeakPolarHBondContact OD1-CB 3.46Å; D606-D609 PolarHBondContact OD1-N 2.93Å; D606-Y610 WeakPolarHBondContact O-CB 3.5Å; D606-Y610 PolarHBondContact O-N 3.36Å
607	D	82.1	Confident	70.6	Confident	134 Å²	134	81.8 Å²	81.8	72%	0.717	42%	0.424	S	S	*	.	H	α-helix	trans	-64.6	-25	-174	-73.8	-33.3	0	0	0	112.5	Q611	D607-Q611 VanDerWaalsContact O-CB 3.26Å; D607-Q611 WeakPolarHBondContact O-CB 3.27Å; D607-Q611 PolarHBondContact O-N 3.44Å
608	Y	85	Confident	73	Confident	171 Å²	171	77.4 Å²	77.4	67%	0.671	41%	0.406	S	S	*	.	H	α-helix	trans	-74.1	-49.2	177.2	177	-90.4	0	0	0	111.2	D606 Y610 Q611 Y612	D606-Y608 PolarHBondContact O-N 2.75Å; D606-Y608 WeakPolarHBondContact OD1-CB 3.25Å; D606-Y608 PolarHBondContact OD1-N 3.34Å; Y608-Y610 VanDerWaalsContact C-N 3.32Å; Y608-Y610 PolarHBondContact O-N 2.93Å; Y608-Q611 PolarHBondContact O-N 3.11Å; Y608-Y612 PolarHBondContact O-N 3.11Å
609	D	86.1	Confident	75.3	Confident	5 Å²	5	77.2 Å²	77.2	3%	0.027	40%	0.4	C	S	.	.	H	α-helix	trans	-62.6	-40.7	175.5	-71.5	-11.5	0	0	0	110.5	I582 R589 L605 D606 Y612 M613	I582-D609 HydrophobicContact CG2-CB 3.72Å; I582-D609 WeakPolarHBondContact CG2-OD2 3.37Å; R589-D609 IonicContact CZ-OD1 2.78Å; R589-D609 IonicContact CZ-OD2 3.81Å; R589-D609 VanDerWaalsContact NH1-CG 3.26Å; R589-D609 IonicContact NH1-OD1 3.67Å; R589-D609 PolarHBondContact NH1-OD1 3.22Å; R589-D609 IonicContact NH1-OD2 3.02Å; R589-D609 PolarHBondContact NH1-OD2 2.83Å; R589-D609 IonicContact NH2-OD1 3.81Å; R589-D609 PolarHBondContact NH2-OD1 2.81Å; R589-D609 IonicContact NH2-OD2 3.94Å; L605-D609 HydrophobicContact CD1-CB 3.7Å; L605-D609 HydrophobicContact CG-CB 4.39Å; D606-D609 PolarHBondContact O-N 3.29Å; D606-D609 WeakPolarHBondContact OD1-CB 3.46Å; D606-D609 PolarHBondContact OD1-N 2.93Å; D609-Y612 PolarHBondContact O-N 3.31Å; D609-M613 WeakPolarHBondContact O-CG 3.39Å; D609-M613 PolarHBondContact O-N 3.06Å
610	Y	88.2	Confident	78	Confident	23 Å²	23	71.1 Å²	71.1	9%	0.09	37%	0.368	C	S	.	.	H	α-helix	trans	-64.3	-40.3	173.9	179.3	-104.1	0	0	0	112.6	L605 D606 Y608 M613 H614 D634 V637	L605-Y610 HydrophobicContact CD2-CD2 3.72Å; L605-Y610 HydrophobicContact CD2-CG 4.2Å; D606-Y610 WeakPolarHBondContact O-CB 3.5Å; D606-Y610 PolarHBondContact O-N 3.36Å; Y608-Y610 VanDerWaalsContact C-N 3.32Å; Y608-Y610 PolarHBondContact O-N 2.93Å; Y610-M613 PolarHBondContact O-N 3.14Å; Y610-H614 WeakPolarHBondContact O-CB 3.35Å; Y610-H614 PolarHBondContact O-N 3Å; Y610-D634 VanDerWaalsContact OH-CB 3.32Å; Y610-D634 WeakPolarHBondContact OH-CB 3.34Å; Y610-D634 PolarHBondContact OH-OD1 3.36Å; Y610-V637 HydrophobicContact CD2-CG1 4.16Å; Y610-V637 HydrophobicContact CE2-CB 4.36Å; Y610-V637 HydrophobicContact CE2-CG1 4.02Å
611	Q	87.4	Confident	80.3	Confident	93 Å²	93	72 Å²	72	44%	0.435	37%	0.371	S	S	.	.	H	α-helix	trans	-65.5	-42.8	175.1	-174.7	59.6	47.8	0	0	111.4	D607 Y608 M613 H614 D615	D607-Q611 VanDerWaalsContact O-CB 3.26Å; D607-Q611 WeakPolarHBondContact O-CB 3.27Å; D607-Q611 PolarHBondContact O-N 3.44Å; Y608-Q611 PolarHBondContact O-N 3.11Å; Q611-M613 VanDerWaalsContact C-N 3.3Å; Q611-M613 PolarHBondContact O-N 3.25Å; Q611-H614 WeakPolarHBondContact O-CA 3.2Å; Q611-H614 VanDerWaalsContact O-CB 3.29Å; Q611-H614 WeakPolarHBondContact O-CB 3.42Å; Q611-H614 PolarHBondContact O-N 2.69Å; Q611-H614 VanDerWaalsContact O-N 3.09Å; Q611-D615 PolarHBondContact NE2-OD1 3.04Å; Q611-D615 PolarHBondContact NE2-OD2 3.1Å; Q611-D615 WeakPolarHBondContact O-CB 3.39Å; Q611-D615 VanDerWaalsContact O-CG 3.28Å; Q611-D615 PolarHBondContact O-N 3.44Å
612	Y	87.6	Confident	82.4	Confident	119 Å²	119	69.4 Å²	69.4	47%	0.467	35%	0.346	S	S	.	.	H	α-helix	trans	-60.7	-38.6	174.4	178.8	-102.2	0	0	0	112.2	I578 I582 Y608 D609 D615 C616	I578-Y612 HydrophobicContact CG2-CE1 4.26Å; I582-Y612 HydrophobicContact CD1-CD1 4Å; I582-Y612 HydrophobicContact CG1-CD1 4.38Å; Y608-Y612 PolarHBondContact O-N 3.11Å; D609-Y612 PolarHBondContact O-N 3.31Å; Y612-D615 PolarHBondContact O-N 3.14Å; Y612-C616 PolarHBondContact O-N 2.96Å; Y612-C616 PolarHBondContact O-SG 3.36Å
613	M	87.7	Confident	84.3	Confident	0 Å²	0	65.2 Å²	65.2	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-66.3	-39.7	172.1	-66.6	167.3	84.1	0	0	112.5	I578 F579 I582 L605 D609 Y610 Q611 D615 L617 V637 F641	I578-M613 HydrophobicContact CG2-CG 4.16Å; F579-M613 HydrophobicContact CB-CE 4.49Å; F579-M613 HydrophobicContact CD1-CE 3.07Å; F579-M613 HydrophobicContact CD2-CE 4.2Å; F579-M613 HydrophobicContact CE1-CE 3.02Å; F579-M613 HydrophobicContact CE2-CE 4.16Å; F579-M613 HydrophobicContact CG-CE 3.68Å; F579-M613 HydrophobicContact CZ-CE 3.6Å; I582-M613 HydrophobicContact CD1-CE 4.43Å; I582-M613 HydrophobicContact CD1-CG 3.12Å; I582-M613 HydrophobicContact CD1-SD 3.5Å; I582-M613 VanDerWaalsContact CD1-SD 3.5Å; L605-M613 HydrophobicContact CD1-SD 3.69Å; L605-M613 HydrophobicContact CD2-CE 4.44Å; L605-M613 HydrophobicContact CD2-SD 3.57Å; L605-M613 VanDerWaalsContact CD2-SD 3.57Å; L605-M613 HydrophobicContact CG-SD 4.23Å; D609-M613 WeakPolarHBondContact O-CG 3.39Å; D609-M613 PolarHBondContact O-N 3.06Å; Y610-M613 PolarHBondContact O-N 3.14Å; Q611-M613 VanDerWaalsContact C-N 3.3Å; Q611-M613 PolarHBondContact O-N 3.25Å; M613-D615 VanDerWaalsContact C-N 3.32Å; M613-L617 VanDerWaalsContact O-CB 3.25Å; M613-L617 WeakPolarHBondContact O-CB 3.45Å; M613-L617 WeakPolarHBondContact O-CD1 3.36Å; M613-L617 WeakPolarHBondContact O-CG 3.34Å; M613-L617 PolarHBondContact O-N 3.14Å; M613-V637 HydrophobicContact CE-CG1 3.72Å; M613-V637 HydrophobicContact SD-CG1 4.39Å; M613-F641 HydrophobicContact CE-CD2 4.5Å
614	H	89.5	Confident	85.6	Confident	41 Å²	41	70 Å²	70	19%	0.19	33%	0.33	C	S	.	.	H	α-helix	trans	-59.2	-47.5	173.9	-164.7	114.8	0	0	0	110.3	Y610 Q611 C616 L617 Q618 Y623	Y610-H614 WeakPolarHBondContact O-CB 3.35Å; Y610-H614 PolarHBondContact O-N 3Å; Q611-H614 WeakPolarHBondContact O-CA 3.2Å; Q611-H614 VanDerWaalsContact O-CB 3.29Å; Q611-H614 WeakPolarHBondContact O-CB 3.42Å; Q611-H614 PolarHBondContact O-N 2.69Å; Q611-H614 VanDerWaalsContact O-N 3.09Å; H614-C616 PolarHBondContact O-N 3.05Å; H614-L617 PolarHBondContact O-N 2.73Å; H614-Q618 VanDerWaalsContact O-CB 3.32Å; H614-Q618 WeakPolarHBondContact O-CB 3.39Å; H614-Q618 WeakPolarHBondContact O-CG 3.33Å; H614-Q618 PolarHBondContact O-N 3.08Å; H614-Y623 AromaticContact CE1-CE1 3.95Å; H614-Y623 PolarHBondContact CE1-OH 2.93Å; H614-Y623 VanDerWaalsContact CE1-OH 3.23Å; H614-Y623 AromaticContact ND1-CZ 3.99Å; H614-Y623 PolarHBondContact ND1-OH 2.89Å; H614-Y623 AromaticContact NE2-CE1 3.86Å
615	D	89.1	Confident	86.4	Confident	68 Å²	68	66.3 Å²	66.3	36%	0.364	32%	0.315	S	S	.	.	H	α-helix	trans	-66.2	-38.2	-175.4	-69.6	-26.5	0	0	0	112.6	Q611 Y612 M613 Q618	Q611-D615 PolarHBondContact NE2-OD1 3.04Å; Q611-D615 PolarHBondContact NE2-OD2 3.1Å; Q611-D615 WeakPolarHBondContact O-CB 3.39Å; Q611-D615 VanDerWaalsContact O-CG 3.28Å; Q611-D615 PolarHBondContact O-N 3.44Å; Y612-D615 PolarHBondContact O-N 3.14Å; M613-D615 VanDerWaalsContact C-N 3.32Å; D615-Q618 WeakPolarHBondContact O-CG 3.44Å; D615-Q618 PolarHBondContact OD1-NE2 3.43Å
616	C	87.9	Confident	86.7	Confident	39 Å²	39	65.4 Å²	65.4	26%	0.264	31%	0.311	S	S	.	.	H	α-helix	trans	-76.6	-31.8	174.9	-64.6	0	0	0	0	113.9	I578 Y612 H614	I578-C616 HydrophobicContact CD1-CB 3.54Å; Y612-C616 PolarHBondContact O-N 2.96Å; Y612-C616 PolarHBondContact O-SG 3.36Å; H614-C616 PolarHBondContact O-N 3.05Å
617	L	90.1	Very high	86.8	Confident	1 Å²	1	66.2 Å²	66.2	1%	0.005	32%	0.315	C	S	.	.	H	α-helix	trans	-86.5	-27.4	-176.7	-65.4	172.2	0	0	0	113.1	L571 K575 F579 M613 H614 E619 D620 Y623 V637	L571-L617 HydrophobicContact CD1-CD2 4.31Å; L571-L617 HydrophobicContact CD2-CD2 4.48Å; L571-L617 HydrophobicContact CG-CD2 4.21Å; K575-L617 HydrophobicContact CB-CD2 3.79Å; K575-L617 HydrophobicContact CG-CD2 4Å; F579-L617 HydrophobicContact CE2-CD1 4.33Å; F579-L617 HydrophobicContact CZ-CD1 4.09Å; M613-L617 VanDerWaalsContact O-CB 3.25Å; M613-L617 WeakPolarHBondContact O-CB 3.45Å; M613-L617 WeakPolarHBondContact O-CD1 3.36Å; M613-L617 WeakPolarHBondContact O-CG 3.34Å; M613-L617 PolarHBondContact O-N 3.14Å; H614-L617 PolarHBondContact O-N 2.73Å; L617-E619 PolarHBondContact O-N 3.49Å; L617-D620 PolarHBondContact O-N 2.82Å; L617-D620 VanDerWaalsContact O-N 3.11Å; L617-Y623 HydrophobicContact CB-CD2 3.33Å; L617-Y623 HydrophobicContact CB-CE2 3.64Å; L617-Y623 HydrophobicContact CB-CG 4.08Å; L617-Y623 HydrophobicContact CD1-CD2 4.27Å; L617-Y623 HydrophobicContact CD1-CE2 4.11Å; L617-Y623 HydrophobicContact CG-CD2 4.41Å; L617-Y623 WeakPolarHBondContact O-CB 3.26Å; L617-V637 HydrophobicContact CD1-CG2 4.31Å
618	Q	90.7	Very high	86.5	Confident	80 Å²	80	70.6 Å²	70.6	37%	0.374	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-20.4	-178.2	68.7	-179.1	-24.5	0	0	114.4	H614 D615 D620 Y623 R624	H614-Q618 VanDerWaalsContact O-CB 3.32Å; H614-Q618 WeakPolarHBondContact O-CB 3.39Å; H614-Q618 WeakPolarHBondContact O-CG 3.33Å; H614-Q618 PolarHBondContact O-N 3.08Å; D615-Q618 WeakPolarHBondContact O-CG 3.44Å; D615-Q618 PolarHBondContact OD1-NE2 3.43Å; Q618-D620 VanDerWaalsContact C-N 3.26Å; Q618-D620 PolarHBondContact O-N 2.91Å; Q618-Y623 HydrophobicContact CB-CD1 4Å; Q618-Y623 HydrophobicContact CB-CE1 4.19Å; Q618-R624 WeakPolarHBondContact O-CD 3.49Å; Q618-R624 WeakPolarHBondContact O-CG 3.49Å; Q618-R624 PolarHBondContact O-NE 3.41Å; Q618-R624 VanDerWaalsContact O-NE 3.08Å
619	E	87.4	Confident	86.3	Confident	155 Å²	155	64.6 Å²	64.6	72%	0.724	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-36.3	174.1	-58.7	-165.1	151.2	0	0	111.3	L617 R624	L617-E619 PolarHBondContact O-N 3.49Å; E619-R624 PolarHBondContact O-NH2 3.48Å
620	D	88.6	Confident	86.3	Confident	35 Å²	35	68.7 Å²	68.7	19%	0.187	32%	0.32	C	S	.	.	S	Bend	trans	-74.2	138.2	-179.9	-165.8	-70.8	0	0	0	112.3	L571 L617 Q618 R622 Y623 R624	L571-D620 HydrophobicContact CD1-CB 3.64Å; L571-D620 WeakPolarHBondContact CD1-OD2 3.39Å; L571-D620 HydrophobicContact CD2-CB 3.92Å; L571-D620 HydrophobicContact CG-CB 4.45Å; L617-D620 PolarHBondContact O-N 2.82Å; L617-D620 VanDerWaalsContact O-N 3.11Å; Q618-D620 VanDerWaalsContact C-N 3.26Å; Q618-D620 PolarHBondContact O-N 2.91Å; D620-R622 VanDerWaalsContact C-N 3.26Å; D620-R622 PolarHBondContact O-N 2.95Å; D620-R622 WeakPolarHBondContact OD1-CA 3.2Å; D620-R622 WeakPolarHBondContact OD1-CB 3.42Å; D620-R622 WeakPolarHBondContact OD1-CG 3.29Å; D620-R622 IonicContact OD1-CZ 3.05Å; D620-R622 PolarHBondContact OD1-N 2.97Å; D620-R622 IonicContact OD1-NE 3.63Å; D620-R622 PolarHBondContact OD1-NE 3.29Å; D620-R622 IonicContact OD1-NH2 2.69Å; D620-R622 IonicContact OD2-CZ 2.81Å; D620-R622 IonicContact OD2-NE 3.29Å; D620-R622 PolarHBondContact OD2-NE 3.07Å; D620-R622 IonicContact OD2-NH2 3.91Å; D620-R622 PolarHBondContact OD2-NH2 2.75Å; D620-Y623 WeakPolarHBondContact O-CB 3.26Å; D620-Y623 PolarHBondContact O-N 2.87Å; D620-R624 PolarHBondContact O-N 3.12Å
621	S	86.5	Confident	86.1	Confident	69 Å²	69	75 Å²	75	48%	0.483	35%	0.35	S	S	.	.	H	α-helix	trans	-63.2	-31	-179.9	66.2	0	0	0	0	112.7	Y623 R624 L625	S621-Y623 VanDerWaalsContact C-N 3.32Å; S621-Y623 PolarHBondContact O-N 2.95Å; S621-R624 PolarHBondContact O-N 3.36Å; S621-L625 WeakPolarHBondContact O-CB 3.47Å; S621-L625 PolarHBondContact O-N 2.99Å
622	R	86.7	Confident	86.1	Confident	43 Å²	43	74.1 Å²	74.1	16%	0.162	34%	0.343	C	S	.	.	H	α-helix	trans	-68.2	-30.6	178	-60.1	169	-72	-179.1	-4.7	112	N567 L571 E574 D620 M626	N567-R622 HydrophobicContact CB-CG 4.38Å; L571-R622 HydrophobicContact CB-CB 4.4Å; L571-R622 HydrophobicContact CD2-CB 4.15Å; E574-R622 IonicContact OE1-CZ 3.6Å; E574-R622 IonicContact OE1-NH1 2.74Å; E574-R622 PolarHBondContact OE1-NH1 3.05Å; E574-R622 IonicContact OE1-NH2 3.44Å; E574-R622 IonicContact OE2-CZ 2.65Å; E574-R622 VanDerWaalsContact OE2-CZ 3.31Å; E574-R622 IonicContact OE2-NH1 3.78Å; E574-R622 PolarHBondContact OE2-NH1 2.99Å; E574-R622 IonicContact OE2-NH2 2.68Å; E574-R622 PolarHBondContact OE2-NH2 3.23Å; D620-R622 VanDerWaalsContact C-N 3.26Å; D620-R622 PolarHBondContact O-N 2.95Å; D620-R622 WeakPolarHBondContact OD1-CA 3.2Å; D620-R622 WeakPolarHBondContact OD1-CB 3.42Å; D620-R622 WeakPolarHBondContact OD1-CG 3.29Å; D620-R622 IonicContact OD1-CZ 3.05Å; D620-R622 PolarHBondContact OD1-N 2.97Å; D620-R622 IonicContact OD1-NE 3.63Å; D620-R622 PolarHBondContact OD1-NE 3.29Å; D620-R622 IonicContact OD1-NH2 2.69Å; D620-R622 IonicContact OD2-CZ 2.81Å; D620-R622 IonicContact OD2-NE 3.29Å; D620-R622 PolarHBondContact OD2-NE 3.07Å; D620-R622 IonicContact OD2-NH2 3.91Å; D620-R622 PolarHBondContact OD2-NH2 2.75Å; R622-M626 WeakPolarHBondContact O-CG 3.13Å
623	Y	90.1	Very high	86.2	Confident	1 Å²	1	69.2 Å²	69.2	0%	0.004	32%	0.323	C	S	.	.	H	α-helix	trans	-67.7	-46.3	170.9	-168	-85.4	0	0	0	111.2	F568 H614 L617 Q618 D620 S621 L625 M626 R633	F568-Y623 AromaticContact CE2-CD2 3.47Å; F568-Y623 HydrophobicContact CE2-CD2 3.47Å; F568-Y623 VanDerWaalsContact CE2-CD2 3.47Å; F568-Y623 HydrophobicContact CE2-CE2 4.03Å; F568-Y623 HydrophobicContact CE2-CG 4.18Å; F568-Y623 AromaticContact CZ-CD2 3.96Å; F568-Y623 HydrophobicContact CZ-CD2 3.96Å; F568-Y623 HydrophobicContact CZ-CE2 4.07Å; H614-Y623 AromaticContact CE1-CE1 3.95Å; H614-Y623 PolarHBondContact CE1-OH 2.93Å; H614-Y623 VanDerWaalsContact CE1-OH 3.23Å; H614-Y623 AromaticContact ND1-CZ 3.99Å; H614-Y623 PolarHBondContact ND1-OH 2.89Å; H614-Y623 AromaticContact NE2-CE1 3.86Å; L617-Y623 HydrophobicContact CB-CD2 3.33Å; L617-Y623 HydrophobicContact CB-CE2 3.64Å; L617-Y623 HydrophobicContact CB-CG 4.08Å; L617-Y623 HydrophobicContact CD1-CD2 4.27Å; L617-Y623 HydrophobicContact CD1-CE2 4.11Å; L617-Y623 HydrophobicContact CG-CD2 4.41Å; L617-Y623 WeakPolarHBondContact O-CB 3.26Å; Q618-Y623 HydrophobicContact CB-CD1 4Å; Q618-Y623 HydrophobicContact CB-CE1 4.19Å; D620-Y623 WeakPolarHBondContact O-CB 3.26Å; D620-Y623 PolarHBondContact O-N 2.87Å; S621-Y623 VanDerWaalsContact C-N 3.32Å; S621-Y623 PolarHBondContact O-N 2.95Å; Y623-L625 PolarHBondContact O-N 3.41Å; Y623-M626 WeakPolarHBondContact O-CB 3.32Å; Y623-M626 PolarHBondContact O-N 3.41Å; Y623-R633 HydrophobicContact CE2-CG 4.25Å; Y623-R633 PolarHBondContact OH-NE 3.33Å
624	R	87.7	Confident	86.3	Confident	136 Å²	136	70.3 Å²	70.3	51%	0.513	33%	0.329	S	S	.	.	H	α-helix	trans	-67.5	-34.1	-179.9	-68.8	-179.1	-84.8	145.4	-7.7	112.8	Q618 E619 D620 S621 M626 N627	Q618-R624 WeakPolarHBondContact O-CD 3.49Å; Q618-R624 WeakPolarHBondContact O-CG 3.49Å; Q618-R624 PolarHBondContact O-NE 3.41Å; Q618-R624 VanDerWaalsContact O-NE 3.08Å; E619-R624 PolarHBondContact O-NH2 3.48Å; D620-R624 PolarHBondContact O-N 3.12Å; S621-R624 PolarHBondContact O-N 3.36Å; R624-M626 PolarHBondContact O-N 2.82Å; R624-N627 VanDerWaalsContact O-CB 3.27Å; R624-N627 WeakPolarHBondContact O-CB 3.41Å; R624-N627 PolarHBondContact O-N 2.82Å; R624-N627 VanDerWaalsContact O-N 3.11Å; R624-N627 PolarHBondContact O-ND2 3.44Å
625	L	78.9	Confident	86.2	Confident	95 Å²	95	71.8 Å²	71.8	50%	0.497	34%	0.339	S	S	.	.	H	α-helix	trans	-55.8	-32.2	169.1	-89.7	154.9	0	0	0	112.5	S621 Y623 N627	S621-L625 WeakPolarHBondContact O-CB 3.47Å; S621-L625 PolarHBondContact O-N 2.99Å; Y623-L625 PolarHBondContact O-N 3.41Å; L625-N627 VanDerWaalsContact C-N 3.31Å; L625-N627 PolarHBondContact O-N 3.06Å
626	M	82.4	Confident	86.1	Confident	0 Å²	0	69 Å²	69	0%	0	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-84	5	179.6	-65.4	-64.2	-75	0	0	114.3	A564 R565 F568 R622 Y623 R624 R628 L629 H630 W632 R633	A564-M626 HydrophobicContact CB-SD 3.71Å; R565-M626 HydrophobicContact CG-CE 4.04Å; F568-M626 HydrophobicContact CB-CE 4.42Å; F568-M626 HydrophobicContact CB-CG 3.92Å; F568-M626 HydrophobicContact CB-SD 4.43Å; F568-M626 HydrophobicContact CD2-CB 4.2Å; F568-M626 HydrophobicContact CD2-CG 3.63Å; F568-M626 HydrophobicContact CE2-CG 4.43Å; F568-M626 HydrophobicContact CG-CG 3.9Å; R622-M626 WeakPolarHBondContact O-CG 3.13Å; Y623-M626 WeakPolarHBondContact O-CB 3.32Å; Y623-M626 PolarHBondContact O-N 3.41Å; R624-M626 PolarHBondContact O-N 2.82Å; M626-R628 VanDerWaalsContact C-N 3.31Å; M626-R628 PolarHBondContact O-N 2.74Å; M626-L629 HydrophobicContact CE-CB 3.91Å; M626-L629 HydrophobicContact CE-CD1 3.84Å; M626-L629 CarbonylContact O-C 3.52Å; M626-L629 WeakPolarHBondContact O-CA 3.14Å; M626-L629 PolarHBondContact O-N 3.06Å; M626-L629 HydrophobicContact SD-CB 4.43Å; M626-L629 HydrophobicContact SD-CD1 3.94Å; M626-H630 PolarHBondContact O-N 3.25Å; M626-H630 VanDerWaalsContact O-N 3.1Å; M626-W632 HydrophobicContact CE-CD2 4.31Å; M626-W632 HydrophobicContact CE-CE3 3.31Å; M626-W632 HydrophobicContact CE-CZ3 3.65Å; M626-R633 HydrophobicContact CB-CB 4.07Å; M626-R633 HydrophobicContact CB-CG 3.87Å
627	N	84.2	Confident	86.2	Confident	82 Å²	82	67.3 Å²	67.3	44%	0.439	31%	0.313	S	S	.	.	G	3₁₀ helix	trans	-59	-37	179.8	-75.2	-11.6	0	0	0	113.4	R624 L625 L629 H630 R633	R624-N627 VanDerWaalsContact O-CB 3.27Å; R624-N627 WeakPolarHBondContact O-CB 3.41Å; R624-N627 PolarHBondContact O-N 2.82Å; R624-N627 VanDerWaalsContact O-N 3.11Å; R624-N627 PolarHBondContact O-ND2 3.44Å; L625-N627 VanDerWaalsContact C-N 3.31Å; L625-N627 PolarHBondContact O-N 3.06Å; N627-L629 PolarHBondContact O-N 3.36Å; N627-H630 PolarHBondContact O-N 3.4Å; N627-H630 PolarHBondContact O-ND1 2.92Å; N627-R633 PolarHBondContact OD1-NH1 2.93Å
628	R	75.8	Confident	86.2	Confident	226 Å²	226	72.4 Å²	72.4	85%	0.853	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-70.5	-15.2	172.9	-75.1	-170.3	171.6	-163.9	-2.5	113.5	M626	M626-R628 VanDerWaalsContact C-N 3.31Å; M626-R628 PolarHBondContact O-N 2.74Å
629	L	80	Confident	86	Confident	46 Å²	46	74.9 Å²	74.9	24%	0.241	34%	0.342	C	S	.	.	G	3₁₀ helix	trans	-115	27.6	177.7	-64.2	176.4	0	0	0	111.6	I561 M626 N627 Q631 W632 R633	I561-L629 HydrophobicContact CG1-CD1 4.28Å; I561-L629 HydrophobicContact CG2-CD1 4.1Å; M626-L629 HydrophobicContact CE-CB 3.91Å; M626-L629 HydrophobicContact CE-CD1 3.84Å; M626-L629 CarbonylContact O-C 3.52Å; M626-L629 WeakPolarHBondContact O-CA 3.14Å; M626-L629 PolarHBondContact O-N 3.06Å; M626-L629 HydrophobicContact SD-CB 4.43Å; M626-L629 HydrophobicContact SD-CD1 3.94Å; N627-L629 PolarHBondContact O-N 3.36Å; L629-Q631 VanDerWaalsContact C-N 3.3Å; L629-Q631 PolarHBondContact O-N 2.76Å; L629-Q631 VanDerWaalsContact O-N 3.16Å; L629-W632 HydrophobicContact CB-CB 4.48Å; L629-W632 WeakPolarHBondContact O-CA 3.08Å; L629-W632 WeakPolarHBondContact O-CB 3.47Å; L629-W632 PolarHBondContact O-N 3.1Å; L629-R633 PolarHBondContact O-N 3.05Å
630	H	86.5	Confident	86.1	Confident	91 Å²	91	67.7 Å²	67.7	42%	0.421	31%	0.308	S	S	.	.	H	α-helix	trans	-50	-44.4	-173.3	61.9	-86.3	0	0	0	113.1	M626 N627 W632 R633 D634	M626-H630 PolarHBondContact O-N 3.25Å; M626-H630 VanDerWaalsContact O-N 3.1Å; N627-H630 PolarHBondContact O-N 3.4Å; N627-H630 PolarHBondContact O-ND1 2.92Å; H630-W632 VanDerWaalsContact C-N 3.26Å; H630-W632 PolarHBondContact O-N 3.09Å; H630-R633 WeakPolarHBondContact O-CB 3.39Å; H630-R633 PolarHBondContact O-N 3.08Å; H630-R633 VanDerWaalsContact O-N 3.08Å; H630-D634 WeakPolarHBondContact O-CB 3.48Å; H630-D634 PolarHBondContact O-N 3.19Å; H630-D634 VanDerWaalsContact O-OD2 3.08Å
631	Q	83.2	Confident	86	Confident	155 Å²	155	66.2 Å²	66.2	72%	0.724	30%	0.3	S	S	*	.	H	α-helix	trans	-57	-37.7	175.9	-61.5	-176	0.1	0	0	113.3	L629 N635	L629-Q631 VanDerWaalsContact C-N 3.3Å; L629-Q631 PolarHBondContact O-N 2.76Å; L629-Q631 VanDerWaalsContact O-N 3.16Å; Q631-N635 WeakPolarHBondContact O-CB 3.26Å; Q631-N635 PolarHBondContact O-N 2.93Å
632	W	87.9	Confident	85.9	Confident	75 Å²	75	64.3 Å²	64.3	28%	0.284	29%	0.289	S	S	.	.	H	α-helix	trans	-75.7	-42.8	174.6	-171.5	94.1	0	0	0	111.3	R565 F568 I569 M626 L629 H630 D634 N635 A636	R565-W632 HydrophobicContact CB-CH2 3.55Å; R565-W632 HydrophobicContact CB-CZ2 3.87Å; R565-W632 HydrophobicContact CB-CZ3 3.95Å; R565-W632 HydrophobicContact CG-CD2 3.86Å; R565-W632 HydrophobicContact CG-CE3 3.8Å; R565-W632 HydrophobicContact CG-CH2 3.54Å; R565-W632 HydrophobicContact CG-CZ2 3.6Å; R565-W632 HydrophobicContact CG-CZ3 3.64Å; F568-W632 AromaticContact CD1-CZ3 3.88Å; F568-W632 HydrophobicContact CD1-CZ3 3.88Å; F568-W632 HydrophobicContact CG-CZ3 4.5Å; I569-W632 HydrophobicContact CD1-CH2 4.28Å; I569-W632 HydrophobicContact CG1-CH2 4.32Å; M626-W632 HydrophobicContact CE-CD2 4.31Å; M626-W632 HydrophobicContact CE-CE3 3.31Å; M626-W632 HydrophobicContact CE-CZ3 3.65Å; L629-W632 HydrophobicContact CB-CB 4.48Å; L629-W632 WeakPolarHBondContact O-CA 3.08Å; L629-W632 WeakPolarHBondContact O-CB 3.47Å; L629-W632 PolarHBondContact O-N 3.1Å; H630-W632 VanDerWaalsContact C-N 3.26Å; H630-W632 PolarHBondContact O-N 3.09Å; W632-D634 PolarHBondContact O-N 3.43Å; W632-N635 PolarHBondContact O-N 3.03Å; W632-A636 HydrophobicContact CD2-CB 4.31Å; W632-A636 HydrophobicContact CE3-CB 3.79Å; W632-A636 HydrophobicContact CH2-CB 3.79Å; W632-A636 HydrophobicContact CZ2-CB 4.28Å; W632-A636 HydrophobicContact CZ3-CB 3.52Å; W632-A636 WeakPolarHBondContact O-CB 3.17Å; W632-A636 PolarHBondContact O-N 3.14Å
633	R	89.5	Confident	85.8	Confident	15 Å²	15	62.6 Å²	62.6	6%	0.057	28%	0.282	C	S	.	.	H	α-helix	trans	-54.1	-51.1	176.6	-172.5	-165	64.4	-170.3	-3.6	111.1	F568 Y623 M626 N627 L629 H630 N635 A636 V637	F568-R633 HydrophobicContact CD2-CG 4.28Å; F568-R633 HydrophobicContact CE1-CG 3.91Å; F568-R633 HydrophobicContact CE2-CG 3.49Å; F568-R633 VanDerWaalsContact CE2-CG 3.49Å; F568-R633 HydrophobicContact CZ-CB 4.38Å; F568-R633 HydrophobicContact CZ-CG 3.28Å; Y623-R633 HydrophobicContact CE2-CG 4.25Å; Y623-R633 PolarHBondContact OH-NE 3.33Å; M626-R633 HydrophobicContact CB-CB 4.07Å; M626-R633 HydrophobicContact CB-CG 3.87Å; N627-R633 PolarHBondContact OD1-NH1 2.93Å; L629-R633 PolarHBondContact O-N 3.05Å; H630-R633 WeakPolarHBondContact O-CB 3.39Å; H630-R633 PolarHBondContact O-N 3.08Å; H630-R633 VanDerWaalsContact O-N 3.08Å; R633-N635 PolarHBondContact O-N 3.35Å; R633-A636 WeakPolarHBondContact O-CB 3.3Å; R633-A636 PolarHBondContact O-N 3.02Å; R633-A636 VanDerWaalsContact O-N 3.16Å; R633-V637 WeakPolarHBondContact O-CG2 3.23Å; R633-V637 PolarHBondContact O-N 3.42Å
634	D	89.5	Confident	85.4	Confident	24 Å²	24	62.5 Å²	62.5	13%	0.128	28%	0.282	C	S	.	.	H	α-helix	trans	-74.4	-29.9	-173.8	-54.5	-20.8	0	0	0	111.3	Y610 H630 W632 R638	Y610-D634 VanDerWaalsContact OH-CB 3.32Å; Y610-D634 WeakPolarHBondContact OH-CB 3.34Å; Y610-D634 PolarHBondContact OH-OD1 3.36Å; H630-D634 WeakPolarHBondContact O-CB 3.48Å; H630-D634 PolarHBondContact O-N 3.19Å; H630-D634 VanDerWaalsContact O-OD2 3.08Å; W632-D634 PolarHBondContact O-N 3.43Å; D634-R638 WeakPolarHBondContact O-CG 3.45Å; D634-R638 PolarHBondContact O-N 3.43Å; D634-R638 PolarHBondContact O-NH1 3.08Å
635	N	88	Confident	84.9	Confident	72 Å²	72	58.1 Å²	58.1	39%	0.385	27%	0.267	S	S	.	.	H	α-helix	trans	-73.5	-36.9	169.5	-167.1	-10.8	0	0	0	111.2	Q631 W632 R633 R638 K639	Q631-N635 WeakPolarHBondContact O-CB 3.26Å; Q631-N635 PolarHBondContact O-N 2.93Å; W632-N635 PolarHBondContact O-N 3.03Å; R633-N635 PolarHBondContact O-N 3.35Å; N635-R638 PolarHBondContact O-N 2.98Å; N635-K639 VanDerWaalsContact O-CB 3.24Å; N635-K639 WeakPolarHBondContact O-CB 3.4Å; N635-K639 VanDerWaalsContact O-CG 3.27Å; N635-K639 WeakPolarHBondContact O-CG 3.45Å; N635-K639 PolarHBondContact O-N 3.28Å; N635-K639 VanDerWaalsContact OD1-CD 3.31Å; N635-K639 WeakPolarHBondContact OD1-CD 3.39Å; N635-K639 WeakPolarHBondContact OD1-CE 3.23Å; N635-K639 PolarHBondContact OD1-NZ 2.99Å
636	A	87	Confident	84.8	Confident	10 Å²	10	59.3 Å²	59.3	8%	0.083	27%	0.265	C	S	.	.	H	α-helix	trans	-67	-42	176.7	0	0	0	0	0	112	F568 M572 W632 R633 K639 F640	F568-A636 HydrophobicContact CD1-CB 4.3Å; F568-A636 HydrophobicContact CE1-CB 4.11Å; M572-A636 HydrophobicContact CE-CB 4.23Å; W632-A636 HydrophobicContact CD2-CB 4.31Å; W632-A636 HydrophobicContact CE3-CB 3.79Å; W632-A636 HydrophobicContact CH2-CB 3.79Å; W632-A636 HydrophobicContact CZ2-CB 4.28Å; W632-A636 HydrophobicContact CZ3-CB 3.52Å; W632-A636 WeakPolarHBondContact O-CB 3.17Å; W632-A636 PolarHBondContact O-N 3.14Å; R633-A636 WeakPolarHBondContact O-CB 3.3Å; R633-A636 PolarHBondContact O-N 3.02Å; R633-A636 VanDerWaalsContact O-N 3.16Å; A636-K639 PolarHBondContact O-N 3.23Å; A636-F640 VanDerWaalsContact O-CB 3.28Å; A636-F640 WeakPolarHBondContact O-CB 3.15Å; A636-F640 PolarHBondContact O-N 3.21Å
637	V	90.5	Very high	84.5	Confident	2 Å²	2	60.4 Å²	60.4	1%	0.012	27%	0.272	C	S	.	.	H	α-helix	trans	-58.2	-51.8	172.4	171.6	0	0	0	0	110.8	F568 M572 F579 Y610 M613 L617 R633 K639 F640 F641	F568-V637 HydrophobicContact CE1-CG2 3.97Å; F568-V637 HydrophobicContact CZ-CG2 3.76Å; M572-V637 HydrophobicContact SD-CG2 4.07Å; F579-V637 HydrophobicContact CE1-CG1 4.02Å; F579-V637 HydrophobicContact CZ-CG1 4.37Å; Y610-V637 HydrophobicContact CD2-CG1 4.16Å; Y610-V637 HydrophobicContact CE2-CB 4.36Å; Y610-V637 HydrophobicContact CE2-CG1 4.02Å; M613-V637 HydrophobicContact CE-CG1 3.72Å; M613-V637 HydrophobicContact SD-CG1 4.39Å; L617-V637 HydrophobicContact CD1-CG2 4.31Å; R633-V637 WeakPolarHBondContact O-CG2 3.23Å; R633-V637 PolarHBondContact O-N 3.42Å; V637-K639 PolarHBondContact O-N 3.34Å; V637-F640 PolarHBondContact O-N 3.11Å; V637-F641 PolarHBondContact O-N 3Å
638	R	88.6	Confident	84.2	Confident	108 Å²	108	58 Å²	58	41%	0.408	26%	0.262	S	S	.	.	H	α-helix	trans	-62.2	-40.5	178.1	-69.7	-179.6	-171.6	93.4	-6.2	112.5	L605 D634 N635 A642	L605-R638 HydrophobicContact CD2-CG 4.4Å; D634-R638 WeakPolarHBondContact O-CG 3.45Å; D634-R638 PolarHBondContact O-N 3.43Å; D634-R638 PolarHBondContact O-NH1 3.08Å; N635-R638 PolarHBondContact O-N 2.98Å; R638-A642 WeakPolarHBondContact O-CB 3.28Å; R638-A642 PolarHBondContact O-N 3.19Å
639	K	87.4	Confident	84.4	Confident	132 Å²	132	52 Å²	52	57%	0.574	24%	0.242	S	C	*	.	H	α-helix	trans	-66.8	-39.3	176.1	-80.6	174.2	173	171	0	112.7	N635 A636 V637 A642 F643	N635-K639 VanDerWaalsContact O-CB 3.24Å; N635-K639 WeakPolarHBondContact O-CB 3.4Å; N635-K639 VanDerWaalsContact O-CG 3.27Å; N635-K639 WeakPolarHBondContact O-CG 3.45Å; N635-K639 PolarHBondContact O-N 3.28Å; N635-K639 VanDerWaalsContact OD1-CD 3.31Å; N635-K639 WeakPolarHBondContact OD1-CD 3.39Å; N635-K639 WeakPolarHBondContact OD1-CE 3.23Å; N635-K639 PolarHBondContact OD1-NZ 2.99Å; A636-K639 PolarHBondContact O-N 3.23Å; V637-K639 PolarHBondContact O-N 3.34Å; K639-A642 PolarHBondContact O-N 2.97Å; K639-F643 VanDerWaalsContact O-CB 3.22Å; K639-F643 WeakPolarHBondContact O-CB 3.26Å; K639-F643 PolarHBondContact O-N 3.01Å
640	F	88.6	Confident	84.3	Confident	5 Å²	5	53.8 Å²	53.8	2%	0.022	26%	0.258	C	S	.	.	H	α-helix	trans	-69.5	-40.5	178	-173.1	-118.8	0	0	0	111.1	M572 L573 V576 F579 A636 V637 F643 L644 P653	M572-F640 HydrophobicContact CB-CD1 3.67Å; M572-F640 HydrophobicContact CB-CE1 3.76Å; M572-F640 HydrophobicContact CB-CG 4.33Å; M572-F640 HydrophobicContact CB-CZ 4.48Å; M572-F640 HydrophobicContact CE-CB 3.99Å; M572-F640 HydrophobicContact CE-CG 4.23Å; M572-F640 HydrophobicContact CG-CD1 4.32Å; M572-F640 VanDerWaalsContact O-CE1 3.26Å; M572-F640 WeakPolarHBondContact O-CE1 3.28Å; M572-F640 HydrophobicContact SD-CB 3.85Å; M572-F640 HydrophobicContact SD-CD1 4.06Å; M572-F640 HydrophobicContact SD-CG 4.17Å; L573-F640 HydrophobicContact CD2-CE2 4.08Å; L573-F640 HydrophobicContact CD2-CZ 3.83Å; V576-F640 HydrophobicContact CG2-CE1 4.34Å; V576-F640 HydrophobicContact CG2-CZ 4.18Å; F579-F640 AromaticContact CD1-CD1 3.56Å; F579-F640 HydrophobicContact CD1-CD1 3.56Å; F579-F640 HydrophobicContact CD1-CE1 4.15Å; F579-F640 HydrophobicContact CD2-CD1 4.12Å; F579-F640 HydrophobicContact CD2-CE1 4.02Å; F579-F640 HydrophobicContact CE1-CB 4.27Å; F579-F640 AromaticContact CE1-CD1 3.48Å; F579-F640 HydrophobicContact CE1-CD1 3.48Å; F579-F640 VanDerWaalsContact CE1-CD1 3.48Å; F579-F640 HydrophobicContact CE1-CE1 4.33Å; F579-F640 HydrophobicContact CE1-CG 4.36Å; F579-F640 HydrophobicContact CE2-CD1 4.05Å; F579-F640 HydrophobicContact CE2-CE1 4.19Å; F579-F640 AromaticContact CG-CD1 3.92Å; F579-F640 HydrophobicContact CG-CD1 3.92Å; F579-F640 HydrophobicContact CG-CE1 4.03Å; F579-F640 AromaticContact CZ-CD1 3.76Å; F579-F640 HydrophobicContact CZ-CD1 3.76Å; F579-F640 HydrophobicContact CZ-CE1 4.36Å; A636-F640 VanDerWaalsContact O-CB 3.28Å; A636-F640 WeakPolarHBondContact O-CB 3.15Å; A636-F640 PolarHBondContact O-N 3.21Å; V637-F640 PolarHBondContact O-N 3.11Å; F640-F643 AromaticContact CD2-CD1 3.68Å; F640-F643 HydrophobicContact CD2-CD1 3.68Å; F640-F643 HydrophobicContact CD2-CE1 4.19Å; F640-F643 AromaticContact CE2-CD1 3.79Å; F640-F643 HydrophobicContact CE2-CD1 3.79Å; F640-F643 AromaticContact CE2-CE1 3.84Å; F640-F643 HydrophobicContact CE2-CE1 3.84Å; F640-F643 PolarHBondContact O-N 2.82Å; F640-L644 HydrophobicContact CD1-CD1 3.91Å; F640-L644 HydrophobicContact CE1-CD1 3.55Å; F640-L644 HydrophobicContact CE1-CG 4.3Å; F640-L644 HydrophobicContact CE2-CD1 4.36Å; F640-L644 HydrophobicContact CE2-CD2 4.33Å; F640-L644 HydrophobicContact CE2-CG 4.24Å; F640-L644 HydrophobicContact CG-CD1 4.46Å; F640-L644 HydrophobicContact CZ-CD1 3.79Å; F640-L644 HydrophobicContact CZ-CD2 4.13Å; F640-L644 HydrophobicContact CZ-CG 4.1Å; F640-L644 WeakPolarHBondContact O-CG 3.49Å; F640-L644 PolarHBondContact O-N 3.1Å; F640-P653 HydrophobicContact CD2-CG 3.68Å; F640-P653 HydrophobicContact CE2-CG 3.96Å
641	F	87.8	Confident	84.1	Confident	4 Å²	4	51.9 Å²	51.9	2%	0.018	26%	0.255	C	S	.	.	H	α-helix	trans	-59	-49.3	170.2	-175	-101.4	0	0	0	112.4	F579 I582 M583 L605 M613 V637 F643 L644 H645	F579-F641 HydrophobicContact CD1-CB 4.16Å; F579-F641 HydrophobicContact CD1-CD2 4.47Å; I582-F641 HydrophobicContact CB-CE2 4.07Å; I582-F641 HydrophobicContact CG2-CE2 3.6Å; I582-F641 HydrophobicContact CG2-CZ 3.96Å; M583-F641 HydrophobicContact CB-CE2 3.95Å; M583-F641 HydrophobicContact CB-CZ 4.31Å; L605-F641 HydrophobicContact CB-CD1 4.05Å; L605-F641 HydrophobicContact CB-CE1 4.28Å; L605-F641 HydrophobicContact CD1-CD1 3.95Å; L605-F641 HydrophobicContact CD1-CD2 4.06Å; L605-F641 HydrophobicContact CD1-CE1 3.88Å; L605-F641 HydrophobicContact CD1-CE2 4Å; L605-F641 HydrophobicContact CD1-CG 4.03Å; L605-F641 HydrophobicContact CD1-CZ 3.9Å; M613-F641 HydrophobicContact CE-CD2 4.5Å; V637-F641 PolarHBondContact O-N 3Å; F641-F643 VanDerWaalsContact C-N 3.33Å; F641-F643 PolarHBondContact O-N 3.2Å; F641-L644 PolarHBondContact O-N 3.43Å; F641-H645 PolarHBondContact O-N 3.39Å
642	A	84.7	Confident	84.1	Confident	29 Å²	29	44.8 Å²	44.8	24%	0.24	22%	0.222	C	C	.	.	H	α-helix	trans	-63	-37	177.2	0	0	0	0	0	112.9	R638 K639 H645 R646	R638-A642 WeakPolarHBondContact O-CB 3.28Å; R638-A642 PolarHBondContact O-N 3.19Å; K639-A642 PolarHBondContact O-N 2.97Å; A642-H645 PolarHBondContact O-N 3.41Å; A642-R646 PolarHBondContact O-N 3.17Å
643	F	84.8	Confident	83.8	Confident	6 Å²	6	43.1 Å²	43.1	3%	0.026	22%	0.222	C	C	.	.	H	α-helix	trans	-62.6	-47.2	172.5	156.6	-101.2	0	0	0	111.5	K639 F640 F641 H645 R646 P647 S651 C652 P653 Y1009 H1010	K639-F643 VanDerWaalsContact O-CB 3.22Å; K639-F643 WeakPolarHBondContact O-CB 3.26Å; K639-F643 PolarHBondContact O-N 3.01Å; F640-F643 AromaticContact CD2-CD1 3.68Å; F640-F643 HydrophobicContact CD2-CD1 3.68Å; F640-F643 HydrophobicContact CD2-CE1 4.19Å; F640-F643 AromaticContact CE2-CD1 3.79Å; F640-F643 HydrophobicContact CE2-CD1 3.79Å; F640-F643 AromaticContact CE2-CE1 3.84Å; F640-F643 HydrophobicContact CE2-CE1 3.84Å; F640-F643 PolarHBondContact O-N 2.82Å; F641-F643 VanDerWaalsContact C-N 3.33Å; F641-F643 PolarHBondContact O-N 3.2Å; F643-H645 VanDerWaalsContact C-N 3.27Å; F643-H645 PolarHBondContact O-N 3.16Å; F643-R646 CarbonylContact O-C 3.49Å; F643-R646 PolarHBondContact O-N 2.71Å; F643-P647 HydrophobicContact CE2-CB 4.45Å; F643-P647 WeakPolarHBondContact O-CA 3.37Å; F643-P647 WeakPolarHBondContact O-CD 3.34Å; F643-P647 WeakPolarHBondContact O-CG 3.39Å; F643-S651 WeakPolarHBondContact CD2-OG 3.3Å; F643-C652 HydrophobicContact CE2-CB 4.12Å; F643-P653 HydrophobicContact CD1-CG 4.27Å; F643-P653 HydrophobicContact CE1-CG 4.3Å; F643-Y1009 VanDerWaalsContact CE1-OH 3.25Å; F643-Y1009 WeakPolarHBondContact CE1-OH 3.33Å; F643-H1010 HydrophobicContact CE1-CB 4.33Å; F643-H1010 HydrophobicContact CE2-CB 4.3Å; F643-H1010 HydrophobicContact CZ-CB 3.57Å; F643-H1010 AromaticContact CZ-CD2 3.58Å; F643-H1010 AromaticContact CZ-CG 3.62Å
644	L	79.9	Confident	83.5	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-64.4	-32.7	177.8	-68.9	168.5	0	0	0	111.8	V576 F579 M583 F640 F641 P647 L1013	V576-L644 HydrophobicContact CG2-CD1 4.01Å; V576-L644 HydrophobicContact CG2-CD2 4.13Å; F579-L644 HydrophobicContact CB-CD1 3.37Å; F579-L644 HydrophobicContact CD1-CD1 4.26Å; F579-L644 HydrophobicContact CG-CD1 3.97Å; M583-L644 HydrophobicContact CE-CB 3.48Å; M583-L644 VanDerWaalsContact CE-CB 3.48Å; M583-L644 VanDerWaalsContact CE-O 3.24Å; M583-L644 WeakPolarHBondContact CE-O 3.07Å; F640-L644 HydrophobicContact CD1-CD1 3.91Å; F640-L644 HydrophobicContact CE1-CD1 3.55Å; F640-L644 HydrophobicContact CE1-CG 4.3Å; F640-L644 HydrophobicContact CE2-CD1 4.36Å; F640-L644 HydrophobicContact CE2-CD2 4.33Å; F640-L644 HydrophobicContact CE2-CG 4.24Å; F640-L644 HydrophobicContact CG-CD1 4.46Å; F640-L644 HydrophobicContact CZ-CD1 3.79Å; F640-L644 HydrophobicContact CZ-CD2 4.13Å; F640-L644 HydrophobicContact CZ-CG 4.1Å; F640-L644 WeakPolarHBondContact O-CG 3.49Å; F640-L644 PolarHBondContact O-N 3.1Å; F641-L644 PolarHBondContact O-N 3.43Å; L644-P647 WeakPolarHBondContact O-CD 3.36Å; L644-P647 WeakPolarHBondContact O-CG 3.5Å; L644-L1013 HydrophobicContact CD2-CD2 3.98Å
645	H	77.2	Confident	82.8	Confident	43 Å²	43	47.9 Å²	47.9	20%	0.199	24%	0.242	C	C	.	.	H	α-helix	trans	-70.8	-34.8	175.4	-169.7	-66	0	0	0	113.3	M583 P603 F641 A642 F643	M583-H645 HydrophobicContact CG-CB 4.31Å; M583-H645 HydrophobicContact SD-CB 4.32Å; P603-H645 HydrophobicContact CG-CB 3.91Å; F641-H645 PolarHBondContact O-N 3.39Å; A642-H645 PolarHBondContact O-N 3.41Å; F643-H645 VanDerWaalsContact C-N 3.27Å; F643-H645 PolarHBondContact O-N 3.16Å
646	R	76.5	Confident	82.1	Confident	121 Å²	121	49.8 Å²	49.8	46%	0.457	26%	0.258	S	S	.	.	S	Bend	trans	-132.7	77.4	172.9	-71	-174.5	175.8	128	-3.4	110.6	A642 F643 S648	A642-R646 PolarHBondContact O-N 3.17Å; F643-R646 CarbonylContact O-C 3.49Å; F643-R646 PolarHBondContact O-N 2.71Å; R646-S648 PolarHBondContact O-N 3.27Å
647	P	76.6	Confident	81.6	Confident	23 Å²	23	54 Å²	54	15%	0.149	27%	0.271	C	S	.	.			trans	-62.7	133	-176.9	-27	38	0	0	0	111.6	F643 L644 H1010 A1014	F643-P647 HydrophobicContact CE2-CB 4.45Å; F643-P647 WeakPolarHBondContact O-CA 3.37Å; F643-P647 WeakPolarHBondContact O-CD 3.34Å; F643-P647 WeakPolarHBondContact O-CG 3.39Å; L644-P647 WeakPolarHBondContact O-CD 3.36Å; L644-P647 WeakPolarHBondContact O-CG 3.5Å; P647-H1010 HydrophobicContact CB-CB 4.15Å; P647-A1014 HydrophobicContact CB-CB 4.31Å; P647-A1014 HydrophobicContact CG-CB 4.12Å
648	S	78.3	Confident	81.4	Confident	31 Å²	31	53.9 Å²	53.9	22%	0.217	27%	0.271	C	S	.	.			trans	-148.4	151.7	170.2	84.4	0	0	0	0	111.2	R646 S650 S651 C652	R646-S648 PolarHBondContact O-N 3.27Å; S648-S650 PolarHBondContact O-N 2.68Å; S648-S650 VanDerWaalsContact O-N 3.08Å; S648-S650 PolarHBondContact OG-N 3.45Å; S648-S650 VanDerWaalsContact OG-N 3.1Å; S648-S650 PolarHBondContact OG-OG 3.12Å; S648-S651 PolarHBondContact O-N 2.8Å; S648-S651 VanDerWaalsContact O-N 3.09Å; S648-S651 PolarHBondContact O-OG 3.4Å; S648-S651 PolarHBondContact OG-N 2.98Å; S648-S651 PolarHBondContact OG-OG 3.49Å; S648-C652 PolarHBondContact O-N 3.14Å
649	K	79.8	Confident	81.2	Confident	100 Å²	100	49.1 Å²	49.1	44%	0.435	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-18.7	167.8	70.8	176.2	173.2	178.9	0	113.1	K655 D660 S664	K649-K655 WeakPolarHBondContact O-CE 3.43Å; K649-D660 HydrophobicContact CB-CB 3.77Å; K649-D660 HydrophobicContact CD-CB 4.45Å; K649-S664 PolarHBondContact NZ-OG 3.28Å
650	S	77.9	Confident	81.1	Confident	83 Å²	83	43.7 Å²	43.7	58%	0.58	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-20.9	176.7	66.6	0	0	0	0	114.4	S648 K655	S648-S650 PolarHBondContact O-N 2.68Å; S648-S650 VanDerWaalsContact O-N 3.08Å; S648-S650 PolarHBondContact OG-N 3.45Å; S648-S650 VanDerWaalsContact OG-N 3.1Å; S648-S650 PolarHBondContact OG-OG 3.12Å; S650-K655 WeakPolarHBondContact O-CE 3.43Å; S650-K655 PolarHBondContact O-NZ 2.94Å
651	S	82.5	Confident	80.7	Confident	52 Å²	52	44.9 Å²	44.9	36%	0.364	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-114.7	-2.3	179.6	53.2	0	0	0	0	114.7	F643 S648	F643-S651 WeakPolarHBondContact CD2-OG 3.3Å; S648-S651 PolarHBondContact O-N 2.8Å; S648-S651 VanDerWaalsContact O-N 3.09Å; S648-S651 PolarHBondContact O-OG 3.4Å; S648-S651 PolarHBondContact OG-N 2.98Å; S648-S651 PolarHBondContact OG-OG 3.49Å
652	C	83.1	Confident	80.5	Confident	5 Å²	5	46.7 Å²	46.7	3%	0.034	25%	0.249	C	C	.	.			trans	-52	129.2	176.6	-178.5	0	0	0	0	113.2	F643 S648 F654 K655 C658 H1010	F643-C652 HydrophobicContact CE2-CB 4.12Å; S648-C652 PolarHBondContact O-N 3.14Å; C652-F654 PolarHBondContact O-N 3.38Å; C652-F654 VanDerWaalsContact O-N 3.12Å; C652-K655 PolarHBondContact O-N 2.83Å; C652-C658 HydrophobicContact CB-CB 3.9Å; C652-C658 VanDerWaalsContact SG-SG 3.66Å; C652-H1010 PolarHBondContact SG-NE2 2.84Å
653	P	82.1	Confident	80.1	Confident	41 Å²	41	45.5 Å²	45.5	27%	0.266	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-22.3	-179.1	-25.5	33.7	0	0	0	115.4	I569 F640 F643	I569-P653 HydrophobicContact CD1-CB 4.31Å; I569-P653 HydrophobicContact CG2-CB 3.58Å; I569-P653 HydrophobicContact CG2-CG 4.36Å; F640-P653 HydrophobicContact CD2-CG 3.68Å; F640-P653 HydrophobicContact CE2-CG 3.96Å; F643-P653 HydrophobicContact CD1-CG 4.27Å; F643-P653 HydrophobicContact CE1-CG 4.3Å
654	F	83.4	Confident	79.4	Confident	25 Å²	25	46.2 Å²	46.2	11%	0.11	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.3	14	-173.7	-70.6	-87	0	0	0	114.4	I569 E570 L573 C652 P656 R657 C658 C919 G920	I569-F654 HydrophobicContact CB-CZ 4.2Å; I569-F654 HydrophobicContact CG2-CD2 4.32Å; I569-F654 HydrophobicContact CG2-CE1 4.43Å; I569-F654 HydrophobicContact CG2-CE2 3.3Å; I569-F654 HydrophobicContact CG2-CZ 3.37Å; E570-F654 WeakPolarHBondContact OE2-CZ 3.48Å; L573-F654 HydrophobicContact CD1-CD2 4.4Å; L573-F654 HydrophobicContact CD1-CE2 3.39Å; L573-F654 HydrophobicContact CD1-CZ 3.65Å; L573-F654 HydrophobicContact CG-CE2 4.13Å; C652-F654 PolarHBondContact O-N 3.38Å; C652-F654 VanDerWaalsContact O-N 3.12Å; F654-P656 CarbonylContact O-C 3.59Å; F654-R657 CarbonylContact O-C 3.5Å; F654-R657 VanDerWaalsContact O-CA 3.26Å; F654-R657 WeakPolarHBondContact O-CA 3.31Å; F654-R657 PolarHBondContact O-N 3.05Å; F654-C658 PolarHBondContact O-N 2.93Å; F654-C919 HydrophobicContact CB-CB 4.03Å; F654-C919 HydrophobicContact CD2-CB 4.49Å; F654-C919 HydrophobicContact CG-CB 4.48Å; F654-G920 VanDerWaalsContact CD1-CA 3.47Å
655	K	74	Confident	78.9	Confident	114 Å²	114	52.5 Å²	52.5	50%	0.496	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.9	133.4	170.7	-83	178.7	137.5	-169	0	111.5	K649 S650 C652	K649-K655 WeakPolarHBondContact O-CE 3.43Å; S650-K655 WeakPolarHBondContact O-CE 3.43Å; S650-K655 PolarHBondContact O-NZ 2.94Å; C652-K655 PolarHBondContact O-N 2.83Å
656	P	72.4	Confident	78.4	Confident	111 Å²	111	54.2 Å²	54.2	72%	0.721	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	cis	-82.1	-16.9	5.1	32	-35.4	0	0	0	115.5	F654 C658	F654-P656 CarbonylContact O-C 3.59Å; P656-C658 PolarHBondContact O-N 3.05Å
657	R	78.4	Confident	77.4	Confident	98 Å²	98	51.5 Å²	51.5	37%	0.37	27%	0.272	S	S	.	.	S	Bend	trans	-70.3	38.7	176.5	-72.7	-167.6	166.1	-172.4	-0.6	114.9	F654 L662 G920 D921	F654-R657 CarbonylContact O-C 3.5Å; F654-R657 VanDerWaalsContact O-CA 3.26Å; F654-R657 WeakPolarHBondContact O-CA 3.31Å; F654-R657 PolarHBondContact O-N 3.05Å; R657-L662 HydrophobicContact CB-CD1 4.42Å; R657-G920 PolarHBondContact O-N 2.84Å; R657-G920 VanDerWaalsContact O-N 3.15Å; R657-D921 PolarHBondContact NH1-O 2.76Å
658	C	85.7	Confident	76.1	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	29%	0.293	C	S	.	.			trans	-77.8	124	163.6	175.2	0	0	0	0	108.1	C652 F654 P656 D660 S661 L662 H1010	C652-C658 HydrophobicContact CB-CB 3.9Å; C652-C658 VanDerWaalsContact SG-SG 3.66Å; F654-C658 PolarHBondContact O-N 2.93Å; P656-C658 PolarHBondContact O-N 3.05Å; C658-D660 VanDerWaalsContact C-N 3.32Å; C658-D660 PolarHBondContact O-N 3.3Å; C658-S661 CarbonylContact O-C 3.59Å; C658-S661 WeakPolarHBondContact O-CA 3.48Å; C658-S661 WeakPolarHBondContact O-CB 3.47Å; C658-S661 PolarHBondContact O-N 3.15Å; C658-L662 PolarHBondContact O-N 3.49Å; C658-H1010 PolarHBondContact SG-NE2 3.35Å
659	I	85.1	Confident	74.5	Confident	9 Å²	9	56.3 Å²	56.3	5%	0.046	31%	0.31	C	S	.	.	H	α-helix	trans	-53.6	-47.7	-179.1	-67	-69.1	0	0	0	111.3	S661 L662 I663 L917 C919 P925	I659-S661 PolarHBondContact O-N 3.47Å; I659-S661 VanDerWaalsContact O-N 3.14Å; I659-L662 HydrophobicContact CD1-CD1 4.47Å; I659-L662 PolarHBondContact O-N 3.15Å; I659-L662 VanDerWaalsContact O-N 3.15Å; I659-I663 HydrophobicContact CG2-CD1 3.52Å; I659-I663 HydrophobicContact CG2-CG1 4.18Å; I659-I663 WeakPolarHBondContact O-CG1 3.37Å; I659-I663 PolarHBondContact O-N 2.76Å; I659-L917 HydrophobicContact CD1-CB 3.75Å; I659-L917 HydrophobicContact CD1-CD2 4.43Å; I659-L917 HydrophobicContact CG1-CB 3.82Å; I659-L917 HydrophobicContact CG2-CB 4.11Å; I659-L917 HydrophobicContact CG2-CD1 4.26Å; I659-C919 PolarHBondContact N-SG 3.35Å; I659-P925 HydrophobicContact CD1-CG 3.86Å
660	D	83.5	Confident	72.5	Confident	18 Å²	18	55.5 Å²	55.5	10%	0.096	31%	0.306	C	S	.	.	H	α-helix	trans	-56.1	-33	175.3	-67.7	5.5	0	0	0	112.7	K649 C658 S664 S1008 H1010	K649-D660 HydrophobicContact CB-CB 3.77Å; K649-D660 HydrophobicContact CD-CB 4.45Å; C658-D660 VanDerWaalsContact C-N 3.32Å; C658-D660 PolarHBondContact O-N 3.3Å; D660-S664 WeakPolarHBondContact O-CB 3.36Å; D660-S664 PolarHBondContact O-N 2.9Å; D660-S664 PolarHBondContact O-OG 3.08Å; D660-S1008 WeakPolarHBondContact OD1-CB 3.35Å; D660-S1008 PolarHBondContact OD1-N 2.85Å; D660-S1008 VanDerWaalsContact OD1-N 3.09Å; D660-S1008 PolarHBondContact OD1-OG 3.21Å; D660-S1008 PolarHBondContact OD2-OG 2.87Å; D660-H1010 IonicContact OD2-CE1 3.81Å; D660-H1010 PolarHBondContact OD2-CE1 2.97Å; D660-H1010 VanDerWaalsContact OD2-CE1 3.24Å; D660-H1010 IonicContact OD2-ND1 3.63Å
661	S	81.7	Confident	70.1	Confident	30 Å²	30	56.4 Å²	56.4	21%	0.21	31%	0.313	C	S	.	.	H	α-helix	trans	-80	-41.5	176.8	-68	0	0	0	0	112.4	C658 I659 S664 H665	C658-S661 CarbonylContact O-C 3.59Å; C658-S661 WeakPolarHBondContact O-CA 3.48Å; C658-S661 WeakPolarHBondContact O-CB 3.47Å; C658-S661 PolarHBondContact O-N 3.15Å; I659-S661 PolarHBondContact O-N 3.47Å; I659-S661 VanDerWaalsContact O-N 3.14Å; S661-S664 PolarHBondContact O-N 3.11Å; S661-H665 VanDerWaalsContact O-CB 3.22Å; S661-H665 WeakPolarHBondContact O-CB 3.41Å; S661-H665 PolarHBondContact O-N 3.46Å
662	L	82.3	Confident	67.6	Low	42 Å²	42	60.6 Å²	60.6	22%	0.22	34%	0.339	C	S	.	.	H	α-helix	trans	-61.1	-50.6	176.7	-69.9	173.2	0	0	0	110.1	R657 C658 I659 H665 R666	R657-L662 HydrophobicContact CB-CD1 4.42Å; C658-L662 PolarHBondContact O-N 3.49Å; I659-L662 HydrophobicContact CD1-CD1 4.47Å; I659-L662 PolarHBondContact O-N 3.15Å; I659-L662 VanDerWaalsContact O-N 3.15Å; L662-H665 PolarHBondContact O-N 3.39Å; L662-R666 WeakPolarHBondContact O-CG 3.25Å; L662-R666 PolarHBondContact O-N 3.28Å
663	I	77.3	Confident	65	Low	3 Å²	3	62.9 Å²	62.9	2%	0.015	36%	0.363	C	S	.	.	H	α-helix	trans	-61.8	-51	175.7	-55.8	167.8	0	0	0	109.4	I659 H665 R666 M667 W965 V985 V1006	I659-I663 HydrophobicContact CG2-CD1 3.52Å; I659-I663 HydrophobicContact CG2-CG1 4.18Å; I659-I663 WeakPolarHBondContact O-CG1 3.37Å; I659-I663 PolarHBondContact O-N 2.76Å; I663-H665 PolarHBondContact O-N 3.45Å; I663-H665 VanDerWaalsContact O-N 3.15Å; I663-R666 CarbonylContact O-C 3.59Å; I663-R666 WeakPolarHBondContact O-CA 3.24Å; I663-R666 PolarHBondContact O-N 3.3Å; I663-M667 HydrophobicContact CG2-CG 4.43Å; I663-M667 WeakPolarHBondContact O-CG 3.47Å; I663-M667 PolarHBondContact O-N 2.83Å; I663-W965 HydrophobicContact CG2-CH2 3.85Å; I663-W965 HydrophobicContact CG2-CZ2 4.29Å; I663-W965 HydrophobicContact CG2-CZ3 4.02Å; I663-V985 HydrophobicContact CG2-CB 3.86Å; I663-V985 HydrophobicContact CG2-CG1 4.08Å; I663-V985 HydrophobicContact CG2-CG2 3.63Å; I663-V1006 HydrophobicContact CD1-CB 3.89Å; I663-V1006 HydrophobicContact CD1-CG1 3.36Å
664	S	70.6	Confident	62.3	Low	22 Å²	22	67 Å²	67	15%	0.154	39%	0.387	C	S	.	.	H	α-helix	trans	-51.8	-40.7	176	-68.1	0	0	0	0	112.4	K649 D660 S661 M667 S668	K649-S664 PolarHBondContact NZ-OG 3.28Å; D660-S664 WeakPolarHBondContact O-CB 3.36Å; D660-S664 PolarHBondContact O-N 2.9Å; D660-S664 PolarHBondContact O-OG 3.08Å; S661-S664 PolarHBondContact O-N 3.11Å; S664-M667 WeakPolarHBondContact O-CB 3.48Å; S664-M667 PolarHBondContact O-N 2.92Å; S664-S668 VanDerWaalsContact O-CB 3.27Å; S664-S668 WeakPolarHBondContact O-CB 3.35Å; S664-S668 PolarHBondContact O-N 3Å; S664-S668 PolarHBondContact O-OG 2.85Å
665	H	69.5	Low	59.8	Low	131 Å²	131	73.8 Å²	73.8	61%	0.606	42%	0.419	S	S	*	.	H	α-helix	trans	-70.3	-40.5	179.7	-166	-65.1	0	0	0	111.4	S661 L662 I663 M667 S668 A669	S661-H665 VanDerWaalsContact O-CB 3.22Å; S661-H665 WeakPolarHBondContact O-CB 3.41Å; S661-H665 PolarHBondContact O-N 3.46Å; L662-H665 PolarHBondContact O-N 3.39Å; I663-H665 PolarHBondContact O-N 3.45Å; I663-H665 VanDerWaalsContact O-N 3.15Å; H665-M667 VanDerWaalsContact C-N 3.26Å; H665-M667 PolarHBondContact O-N 3.46Å; H665-S668 PolarHBondContact O-N 3.28Å; H665-S668 VanDerWaalsContact O-N 3.09Å; H665-A669 VanDerWaalsContact O-CB 3.25Å; H665-A669 WeakPolarHBondContact O-CB 3.35Å; H665-A669 PolarHBondContact O-N 3.43Å
666	R	65	Low	57.6	Low	80 Å²	80	71.4 Å²	71.4	30%	0.302	42%	0.417	S	S	.	.	H	α-helix	trans	-62.3	-31.6	170.1	-62.1	-79	-172.4	-142.1	-4.6	111.8	L662 I663 E924 D926 W965	L662-R666 WeakPolarHBondContact O-CG 3.25Å; L662-R666 PolarHBondContact O-N 3.28Å; I663-R666 CarbonylContact O-C 3.59Å; I663-R666 WeakPolarHBondContact O-CA 3.24Å; I663-R666 PolarHBondContact O-N 3.3Å; R666-E924 IonicContact CZ-OE2 2.74Å; R666-E924 IonicContact NH2-OE2 2.76Å; R666-E924 PolarHBondContact NH2-OE2 3.36Å; R666-D926 IonicContact NE-OD2 3.18Å; R666-W965 HydrophobicContact CB-CB 4.15Å; R666-W965 HydrophobicContact CB-CG 3.92Å
667	M	55.4	Low	55.4	Low	64 Å²	64	68 Å²	68	32%	0.315	40%	0.396	S	S	.	.	H	α-helix	trans	-70.7	-38.2	168.9	-39.5	-173.2	76.9	0	0	112.8	I663 S664 H665 L969 V985	I663-M667 HydrophobicContact CG2-CG 4.43Å; I663-M667 WeakPolarHBondContact O-CG 3.47Å; I663-M667 PolarHBondContact O-N 2.83Å; S664-M667 WeakPolarHBondContact O-CB 3.48Å; S664-M667 PolarHBondContact O-N 2.92Å; H665-M667 VanDerWaalsContact C-N 3.26Å; H665-M667 PolarHBondContact O-N 3.46Å; M667-L969 HydrophobicContact CB-CD1 3.98Å; M667-L969 HydrophobicContact CE-CB 4.12Å; M667-L969 HydrophobicContact CE-CD1 3.47Å; M667-L969 VanDerWaalsContact CE-CD1 3.47Å; M667-L969 HydrophobicContact CE-CD2 3.65Å; M667-L969 HydrophobicContact CE-CG 3.92Å; M667-L969 HydrophobicContact CG-CD1 3.55Å; M667-L969 HydrophobicContact SD-CD1 4.27Å; M667-V985 HydrophobicContact CE-CG1 3.82Å; M667-V985 HydrophobicContact CE-CG2 4.19Å; M667-V985 HydrophobicContact SD-CB 4.47Å; M667-V985 HydrophobicContact SD-CG1 4.09Å; M667-V985 HydrophobicContact SD-CG2 3.51Å; M667-V985 VanDerWaalsContact SD-CG2 3.51Å
668	S	51.2	Low	52.9	Low	85 Å²	85	68.2 Å²	68.2	59%	0.594	40%	0.404	S	S	*	.	H	α-helix	trans	-93.9	-15.5	-166.6	-51.2	0	0	0	0	114.5	S664 H665 K670	S664-S668 VanDerWaalsContact O-CB 3.27Å; S664-S668 WeakPolarHBondContact O-CB 3.35Å; S664-S668 PolarHBondContact O-N 3Å; S664-S668 PolarHBondContact O-OG 2.85Å; H665-S668 PolarHBondContact O-N 3.28Å; H665-S668 VanDerWaalsContact O-N 3.09Å; S668-K670 PolarHBondContact O-N 3.28Å
669	A	42.8	Very low	50.1	Low	69 Å²	69	72.7 Å²	72.7	57%	0.57	42%	0.424	S	S	*	.			trans	-72.7	41.5	-179.5	0	0	0	0	0	113	H665	H665-A669 VanDerWaalsContact O-CB 3.25Å; H665-A669 WeakPolarHBondContact O-CB 3.35Å; H665-A669 PolarHBondContact O-N 3.43Å
670	K	38.5	Very low	47.3	Very low	83 Å²	83	77.6 Å²	77.6	36%	0.361	45%	0.454	S	S	.	.			trans	-138.3	48.1	-173.5	-58.6	-166.6	84.3	-168.4	0	112.3	S668 S966 N970	S668-K670 PolarHBondContact O-N 3.28Å; K670-S966 WeakPolarHBondContact CE-OG 3.37Å; K670-S966 PolarHBondContact NZ-O 3.42Å; K670-S966 PolarHBondContact NZ-OG 2.92Å; K670-N970 PolarHBondContact NZ-ND2 3.09Å; K670-N970 PolarHBondContact NZ-OD1 2.9Å
671	S	27.5	Very low	44.8	Very low	102 Å²	102	81 Å²	81	71%	0.713	47%	0.472	S	S	*	.			trans	-122.2	97	150	56.3	0	0	0	0	106.6	G673	S671-G673 PolarHBondContact O-N 3.49Å
672	P	29.9	Very low	42.2	Very low	140 Å²	140	85 Å²	85	91%	0.909	50%	0.497	S	S	*	.			trans	-69.9	97.2	176.9	28.7	-32.1	0	0	0	108.4
673	G	28	Very low	39.9	Very low	53 Å²	53	91.5 Å²	91.5	55%	0.546	52%	0.52	S	S	.	.			trans	-150.4	117.1	179.9	0	0	0	0	0	109.6	S671	S671-G673 PolarHBondContact O-N 3.49Å
674	T	27	Very low	38.5	Very low	127 Å²	127	93.9 Å²	93.9	78%	0.779	53%	0.529	S	S	*	.	S	Bend	trans	65.2	137.2	176.6	55.1	0	0	0	0	117.1
675	H	30.9	Very low	37.7	Very low	168 Å²	168	97.9 Å²	97.9	78%	0.778	55%	0.549	S	S	*	.			trans	69.1	78.5	-177.3	-45.6	-67.2	0	0	0	112.6
676	S	26.9	Very low	37.8	Very low	65 Å²	65	92.8 Å²	92.8	46%	0.455	53%	0.526	S	S	.	.				67.2	136.8	81.5	78.6	0	0	0	0	112.8
677	S	25.9	Very low	38.4	Very low	38 Å²	38	89.1 Å²	89.1	27%	0.266	51%	0.512	S	S	.	.			trans	70.8	40.2	150.3	74.6	0	0	0	0	123.3	S955 I956 A957 D958	S677-S955 VanDerWaalsContact CB-C 3.44Å; S677-S955 PolarHBondContact N-O 2.96Å; S677-I956 VanDerWaalsContact CB-N 3.32Å; S677-I956 WeakPolarHBondContact CB-O 3.11Å; S677-I956 CarbonylContact O-C 3.57Å; S677-A957 VanDerWaalsContact C-CA 3.45Å; S677-A957 CarbonylContact O-C 3.58Å; S677-A957 WeakPolarHBondContact O-CA 3.43Å; S677-A957 PolarHBondContact O-N 3.29Å; S677-D958 PolarHBondContact O-N 3.49Å
678	D	26.5	Very low	39.6	Very low	103 Å²	103	90 Å²	90	55%	0.551	51%	0.513	S	S	*	.			trans	-124.7	115.5	178.6	-83.4	-11.1	0	0	0	119.7	D958 S959	D678-D958 VanDerWaalsContact CA-N 3.26Å; D678-D958 VanDerWaalsContact OD1-CA 3.29Å; D678-D958 WeakPolarHBondContact OD1-CA 3.46Å; D678-D958 WeakPolarHBondContact OD1-CB 3.09Å; D678-D958 PolarHBondContact OD1-N 3.11Å; D678-S959 PolarHBondContact OD1-N 3.09Å
679	F	26.4	Very low	41	Very low	95 Å²	95	88.8 Å²	88.8	42%	0.417	50%	0.502	S	S	.	.			trans	-0.8	117.9	-173.5	-70	-47.6	0	0	0	120.3	A957 D958 S959 V960	F679-A957 HydrophobicContact CD1-CB 4.47Å; F679-A957 WeakPolarHBondContact CD1-O 3.44Å; F679-A957 WeakPolarHBondContact CE1-O 3.38Å; F679-D958 VanDerWaalsContact CD2-O 3.27Å; F679-D958 WeakPolarHBondContact CD2-O 3.31Å; F679-D958 HydrophobicContact CE2-CB 4.45Å; F679-D958 WeakPolarHBondContact CE2-O 3.3Å; F679-D958 VanDerWaalsContact CG-C 3.41Å; F679-D958 HydrophobicContact CZ-CB 4.27Å; F679-D958 WeakPolarHBondContact CZ-OD1 3.18Å; F679-S959 VanDerWaalsContact CG-N 3.25Å; F679-V960 HydrophobicContact CB-CG2 3.64Å; F679-V960 VanDerWaalsContact O-CG2 3.26Å; F679-V960 WeakPolarHBondContact O-CG2 3.48Å
680	V	27.7	Very low	42.7	Very low	112 Å²	112	86.9 Å²	86.9	68%	0.679	48%	0.483	S	S	*	.			trans	-128.5	125.9	139.2	179.5	0	0	0	0	106.7	P682	V680-P682 WeakPolarHBondContact O-CD 3.33Å
681	N	29.3	Very low	44.7	Very low	90 Å²	90	85.9 Å²	85.9	48%	0.481	48%	0.483	S	S	.	.			trans	-62.3	117.5	-176.8	-167.8	4.2	0	0	0	110.2	Y683	N681-Y683 PolarHBondContact O-N 3.24Å; N681-Y683 WeakPolarHBondContact OD1-CD2 3.27Å
682	P	28.7	Very low	47.2	Very low	112 Å²	112	88.1 Å²	88.1	73%	0.727	49%	0.487	S	S	*	.	G	3₁₀ helix	trans	-61.5	-17.4	-171.5	-25.8	35.3	0	0	0	115.1	V680 Y684	V680-P682 WeakPolarHBondContact O-CD 3.33Å; P682-Y684 VanDerWaalsContact C-N 3.26Å; P682-Y684 PolarHBondContact O-N 3.05Å
683	Y	32.6	Very low	49.7	Very low	180 Å²	180	85.6 Å²	85.6	71%	0.706	47%	0.466	S	S	*	.	G	3₁₀ helix	trans	-69	-11.4	-172.5	-76.5	-96.5	0	0	0	115.6	N681 I686	N681-Y683 PolarHBondContact O-N 3.24Å; N681-Y683 WeakPolarHBondContact OD1-CD2 3.27Å; Y683-I686 WeakPolarHBondContact O-CG2 3.37Å
684	Y	48.5	Very low	52.4	Low	53 Å²	53	86.3 Å²	86.3	21%	0.208	46%	0.455	C	S	.	.	G	3₁₀ helix	trans	-118	10.1	-171.1	-62.7	-70.3	0	0	0	116.2	P682 I686 L799 L802	P682-Y684 VanDerWaalsContact C-N 3.26Å; P682-Y684 PolarHBondContact O-N 3.05Å; Y684-I686 PolarHBondContact O-N 3.15Å; Y684-L799 HydrophobicContact CE1-CD2 4.37Å; Y684-L802 HydrophobicContact CD1-CD1 4.21Å; Y684-L802 WeakPolarHBondContact O-CD2 3.37Å
685	N	53.5	Low	55.4	Low	105 Å²	105	80.3 Å²	80.3	56%	0.561	42%	0.418	S	S	*	.			trans	-88	54.1	162.2	-83.2	2.6	0	0	0	110.5
686	I	70.8	Confident	58.4	Low	25 Å²	25	75.2 Å²	75.2	13%	0.128	39%	0.392	C	S	.	.			trans	-75.9	-29.9	-174.9	62.6	170.2	0	0	0	112.5	Y683 Y684 F744 F745 V748 L777 L802	Y683-I686 WeakPolarHBondContact O-CG2 3.37Å; Y684-I686 PolarHBondContact O-N 3.15Å; I686-F744 HydrophobicContact CD1-CE1 4.05Å; I686-F744 HydrophobicContact CD1-CZ 4.49Å; I686-F745 HydrophobicContact CB-CE1 4.47Å; I686-F745 HydrophobicContact CD1-CE1 4.15Å; I686-F745 HydrophobicContact CG2-CE1 3.99Å; I686-V748 WeakPolarHBondContact O-CG1 3.12Å; I686-L777 HydrophobicContact CD1-CD1 3.43Å; I686-L777 VanDerWaalsContact CD1-CD1 3.43Å; I686-L802 HydrophobicContact CD1-CD2 4.48Å; I686-L802 HydrophobicContact CG1-CD2 4.05Å
687	F	78	Confident	61.6	Low	3 Å²	3	72.1 Å²	72.1	1%	0.013	37%	0.371	C	S	.	.	S	Bend	trans	-90.7	147.7	-179	-63	-70.2	0	0	0	111.8	F744 V748 A753 V756 L802 P803 Y880	F687-F744 HydrophobicContact CE1-CZ 4.31Å; F687-F744 HydrophobicContact CZ-CZ 4.09Å; F687-V748 HydrophobicContact CD1-CG1 4.37Å; F687-V748 HydrophobicContact CE1-CG2 4.23Å; F687-A753 CarbonylContact C-O 3.52Å; F687-A753 VanDerWaalsContact CA-O 3.28Å; F687-A753 WeakPolarHBondContact CA-O 3.34Å; F687-A753 WeakPolarHBondContact CB-O 3.22Å; F687-A753 HydrophobicContact CD1-CB 4.12Å; F687-A753 WeakPolarHBondContact CD1-O 3.27Å; F687-A753 HydrophobicContact CE1-CB 4.44Å; F687-V756 HydrophobicContact CE1-CB 4.03Å; F687-V756 HydrophobicContact CE1-CG1 4.36Å; F687-V756 HydrophobicContact CE2-CG1 4.07Å; F687-V756 HydrophobicContact CZ-CB 3.63Å; F687-V756 HydrophobicContact CZ-CG1 3.46Å; F687-V756 VanDerWaalsContact CZ-CG1 3.46Å; F687-L802 HydrophobicContact CD2-CD2 3.86Å; F687-L802 HydrophobicContact CE2-CD2 3.96Å; F687-P803 HydrophobicContact CB-CG 4.49Å; F687-P803 HydrophobicContact CD2-CG 4.27Å; F687-Y880 VanDerWaalsContact O-CE2 3.23Å; F687-Y880 WeakPolarHBondContact O-CE2 3.4Å; F687-Y880 PolarHBondContact O-OH 3.42Å
688	Y	81.2	Confident	64.9	Low	83 Å²	83	70.3 Å²	70.3	33%	0.325	36%	0.358	S	S	.	.	P	Polyproline II helix	trans	-79.8	151.9	-178.7	-73.3	-108.3	0	0	0	111.7	N749 E752 A753 N754	Y688-N749 PolarHBondContact OH-OD1 3.23Å; Y688-E752 HydrophobicContact CD1-CB 4.18Å; Y688-E752 HydrophobicContact CD1-CG 4.25Å; Y688-E752 HydrophobicContact CD2-CB 4.36Å; Y688-E752 HydrophobicContact CE1-CB 4.48Å; Y688-E752 HydrophobicContact CE1-CG 4.13Å; Y688-E752 HydrophobicContact CG-CB 4.12Å; Y688-A753 PolarHBondContact N-O 2.96Å; Y688-N754 PolarHBondContact O-ND2 3.45Å
689	P	79.4	Confident	68.3	Low	58 Å²	58	65.4 Å²	65.4	38%	0.377	33%	0.332	S	S	.	.	P	Polyproline II helix	trans	-63.4	150.6	171.5	29.2	-36.5	0	0	0	111.4	T691 N754 Y880	P689-T691 PolarHBondContact O-N 3.14Å; P689-N754 VanDerWaalsContact C-ND2 3.27Å; P689-N754 PolarHBondContact O-ND2 3.32Å; P689-Y880 HydrophobicContact CB-CD1 4.19Å; P689-Y880 HydrophobicContact CB-CD2 4.1Å; P689-Y880 HydrophobicContact CB-CG 3.75Å
690	I	80.5	Confident	71.6	Confident	30 Å²	30	60.9 Å²	60.9	15%	0.154	31%	0.312	C	S	.	.	P	Polyproline II helix	trans	-68.8	122.8	172.4	-61.3	178.6	0	0	0	108.5	V695 N754 V873 A876	I690-V695 HydrophobicContact CB-CG2 4.49Å; I690-V695 HydrophobicContact CD1-CG2 3.62Å; I690-V695 HydrophobicContact CG1-CG2 3.88Å; I690-V695 HydrophobicContact CG2-CG2 3.83Å; I690-N754 HydrophobicContact CG1-CB 4.32Å; I690-V873 HydrophobicContact CD1-CG1 4.27Å; I690-A876 HydrophobicContact CD1-CB 3.74Å; I690-A876 HydrophobicContact CG1-CB 4Å
691	T	79.1	Confident	74.7	Confident	61 Å²	61	55.5 Å²	55.5	37%	0.374	28%	0.28	S	S	.	.	B	Isolated β-bridge	trans	-121.4	148	177.6	54.1	0	0	0	0	110	P689 N693 Q694	P689-T691 PolarHBondContact O-N 3.14Å; T691-N693 PolarHBondContact O-N 3.06Å; T691-Q694 WeakPolarHBondContact O-CB 3.41Å; T691-Q694 PolarHBondContact O-N 2.6Å
692	D	80.6	Confident	77.7	Confident	149 Å²	149	52.4 Å²	52.4	80%	0.797	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.8	28.2	172.5	-52.3	-37.4	0	0	0	116.2	Q694	D692-Q694 HydrophobicContact CB-CG 4.49Å; D692-Q694 PolarHBondContact O-N 3.41Å
693	N	82.3	Confident	80.6	Confident	87 Å²	87	50.4 Å²	50.4	47%	0.465	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	53	29.8	-170.9	-63	-7.1	0	0	0	113.6	T691 I729 S730	T691-N693 PolarHBondContact O-N 3.06Å; N693-I729 CarbonylContact O-C 3.54Å; N693-I729 WeakPolarHBondContact O-CA 3.25Å; N693-I729 WeakPolarHBondContact O-CG2 3.15Å; N693-S730 PolarHBondContact O-N 2.78Å
694	Q	85.6	Confident	83.3	Confident	69 Å²	69	48.6 Å²	48.6	32%	0.322	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	131.7	173.3	-66.9	-72	-29.9	0	0	109.5	T691 D692 S730 N732	T691-Q694 WeakPolarHBondContact O-CB 3.41Å; T691-Q694 PolarHBondContact O-N 2.6Å; D692-Q694 HydrophobicContact CB-CG 4.49Å; D692-Q694 PolarHBondContact O-N 3.41Å; Q694-S730 CarbonylContact C-O 3.57Å; Q694-S730 WeakPolarHBondContact CA-O 3.39Å; Q694-S730 VanDerWaalsContact NE2-CB 3.28Å; Q694-S730 PolarHBondContact NE2-OG 2.81Å; Q694-S730 PolarHBondContact OE1-OG 2.63Å; Q694-N732 PolarHBondContact OE1-ND2 2.91Å; Q694-N732 VanDerWaalsContact OE1-ND2 3.15Å
695	V	89.5	Confident	85.4	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	124.6	177.7	172.4	0	0	0	0	109.5	I690 I697 I729 S730 V731 N732 N754 V873	I690-V695 HydrophobicContact CB-CG2 4.49Å; I690-V695 HydrophobicContact CD1-CG2 3.62Å; I690-V695 HydrophobicContact CG1-CG2 3.88Å; I690-V695 HydrophobicContact CG2-CG2 3.83Å; V695-I697 HydrophobicContact CG1-CD1 3.92Å; V695-I697 HydrophobicContact CG1-CG1 3.71Å; V695-I729 HydrophobicContact CB-CG2 3.88Å; V695-I729 HydrophobicContact CG2-CG2 3.39Å; V695-S730 PolarHBondContact N-O 3.41Å; V695-V731 CarbonylContact O-C 3.13Å; V695-V731 WeakPolarHBondContact O-CA 3.43Å; V695-N732 PolarHBondContact O-N 3.15Å; V695-N754 WeakPolarHBondContact CA-OD1 3.49Å; V695-N754 HydrophobicContact CG1-CB 4.38Å; V695-V873 HydrophobicContact CG1-CG2 4.3Å; V695-V873 HydrophobicContact CG2-CG2 4.32Å
696	R	92.4	Very high	87.3	Confident	61 Å²	61	41.5 Å²	41.5	23%	0.23	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	112.8	-175.1	-57.8	-175.9	-166.6	123.3	-24.7	109	N732 Y751 E752 N754	R696-N732 CarbonylContact C-O 3.57Å; R696-N732 WeakPolarHBondContact CA-O 3.31Å; R696-Y751 HydrophobicContact CB-CD1 3.91Å; R696-Y751 HydrophobicContact CB-CE1 3.68Å; R696-Y751 WeakPolarHBondContact CD-O 3.27Å; R696-Y751 HydrophobicContact CG-CE1 4.47Å; R696-E752 IonicContact CZ-OE2 3.53Å; R696-E752 PolarHBondContact NH1-O 3.4Å; R696-E752 IonicContact NH1-OE2 2.64Å; R696-E752 PolarHBondContact NH1-OE2 2.95Å; R696-E752 IonicContact NH2-OE2 3.67Å; R696-E752 PolarHBondContact NH2-OE2 3.24Å; R696-N754 PolarHBondContact N-OD1 2.79Å; R696-N754 PolarHBondContact O-N 3.35Å
697	I	94.9	Very high	88.4	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	129.9	-170.5	-54.3	-177.6	0	0	0	110.1	V695 V731 N732 F733 R734 I757 I872	V695-I697 HydrophobicContact CG1-CD1 3.92Å; V695-I697 HydrophobicContact CG1-CG1 3.71Å; I697-V731 HydrophobicContact CD1-CG1 3.81Å; I697-V731 HydrophobicContact CG1-CG1 4.31Å; I697-N732 PolarHBondContact N-O 2.85Å; I697-F733 HydrophobicContact CB-CD1 3.85Å; I697-F733 HydrophobicContact CB-CE1 4.06Å; I697-F733 HydrophobicContact CD1-CE1 4.02Å; I697-F733 HydrophobicContact CG1-CE1 4.48Å; I697-F733 HydrophobicContact CG2-CD1 4.27Å; I697-F733 HydrophobicContact CG2-CE1 4.36Å; I697-F733 CarbonylContact O-C 3.53Å; I697-F733 WeakPolarHBondContact O-CA 3.34Å; I697-R734 PolarHBondContact O-N 2.57Å; I697-I757 HydrophobicContact CG2-CD1 3.77Å; I697-I757 HydrophobicContact CG2-CG1 3.77Å; I697-I872 HydrophobicContact CD1-CB 4.42Å; I697-I872 HydrophobicContact CD1-CD1 4.19Å; I697-I872 HydrophobicContact CD1-CG2 4.09Å; I697-I872 HydrophobicContact CG1-CG2 4.29Å; I697-I872 HydrophobicContact CG2-CD1 3.73Å
698	L	95.8	Very high	89.1	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	136.3	172.4	-58.4	177.7	0	0	0	110.1	V700 R734 I736 F744 V748 Y751 A753 G755 V756 I757	L698-V700 HydrophobicContact CB-CG2 4.47Å; L698-R734 WeakPolarHBondContact CA-O 3.38Å; L698-R734 HydrophobicContact CD2-CB 3.97Å; L698-I736 HydrophobicContact CB-CD1 4.14Å; L698-I736 HydrophobicContact CD1-CD1 3.81Å; L698-I736 HydrophobicContact CD2-CD1 4.01Å; L698-I736 HydrophobicContact CG-CD1 4.18Å; L698-F744 HydrophobicContact CD1-CD2 4.35Å; L698-F744 HydrophobicContact CD1-CE2 3.69Å; L698-F744 HydrophobicContact CD1-CZ 4.32Å; L698-V748 HydrophobicContact CD1-CB 4.38Å; L698-V748 HydrophobicContact CD1-CG2 3.49Å; L698-V748 VanDerWaalsContact CD1-CG2 3.49Å; L698-Y751 HydrophobicContact CD2-CD1 3.66Å; L698-Y751 HydrophobicContact CD2-CE1 4.38Å; L698-Y751 HydrophobicContact CD2-CG 4.34Å; L698-A753 HydrophobicContact CD1-CB 3.7Å; L698-A753 HydrophobicContact CD2-CB 4.12Å; L698-A753 HydrophobicContact CG-CB 3.63Å; L698-G755 PolarHBondContact N-O 2.93Å; L698-V756 HydrophobicContact CB-CB 4.44Å; L698-V756 HydrophobicContact CB-CG2 4.13Å; L698-V756 CarbonylContact O-C 3.6Å; L698-V756 WeakPolarHBondContact O-CA 3.34Å; L698-I757 PolarHBondContact O-N 3.44Å
699	I	96.9	Very high	89.7	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	118.1	173.9	-55.3	173.4	0	0	0	108	V706 V709 C710 L713 F733 R734 C735 I736 I757	I699-V706 HydrophobicContact CG2-CB 4.02Å; I699-V706 HydrophobicContact CG2-CG1 4.1Å; I699-V709 HydrophobicContact CG2-CB 4.48Å; I699-V709 HydrophobicContact CG2-CG1 4.07Å; I699-C710 HydrophobicContact CD1-CB 3.77Å; I699-L713 HydrophobicContact CD1-CD1 3.81Å; I699-F733 HydrophobicContact CD1-CB 3.95Å; I699-F733 HydrophobicContact CD1-CD1 3.81Å; I699-F733 HydrophobicContact CD1-CG 4.04Å; I699-F733 HydrophobicContact CG1-CD1 4.14Å; I699-R734 PolarHBondContact N-O 3.27Å; I699-C735 CarbonylContact O-C 3.53Å; I699-C735 WeakPolarHBondContact O-CA 3.31Å; I699-I736 PolarHBondContact O-N 2.9Å; I699-I757 HydrophobicContact CG1-CB 4.49Å; I699-I757 HydrophobicContact CG1-CD1 4.28Å
700	V	95.6	Very high	90.4	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	135	-169.1	-176.9	0	0	0	0	110.2	L698 I736 F741 F744 V756 I757 A759 F772	L698-V700 HydrophobicContact CB-CG2 4.47Å; V700-I736 HydrophobicContact CG2-CB 4.24Å; V700-I736 HydrophobicContact CG2-CD1 4.39Å; V700-F741 HydrophobicContact CG1-CD1 3.94Å; V700-F741 HydrophobicContact CG1-CE1 3.28Å; V700-F741 HydrophobicContact CG1-CZ 3.84Å; V700-F744 HydrophobicContact CG2-CD2 4.31Å; V700-F744 HydrophobicContact CG2-CE2 4.1Å; V700-V756 HydrophobicContact CB-CG2 4.14Å; V700-V756 HydrophobicContact CG2-CG2 3.39Å; V700-I757 PolarHBondContact N-O 3.39Å; V700-A759 PolarHBondContact O-N 2.87Å; V700-F772 HydrophobicContact CB-CE1 4.36Å; V700-F772 HydrophobicContact CB-CZ 4.5Å; V700-F772 HydrophobicContact CG1-CB 4.36Å; V700-F772 HydrophobicContact CG1-CD1 3.74Å; V700-F772 HydrophobicContact CG1-CD2 3.63Å; V700-F772 HydrophobicContact CG1-CE1 3.91Å; V700-F772 HydrophobicContact CG1-CE2 3.8Å; V700-F772 HydrophobicContact CG1-CG 3.61Å; V700-F772 HydrophobicContact CG1-CZ 3.95Å; V700-F772 HydrophobicContact CG2-CE1 4.46Å; V700-F772 HydrophobicContact CG2-CZ 4.21Å
701	G	93.5	Very high	90.9	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	159.2	-160.6	-179	0	0	0	0	0	112.6	V706 P737 D738	G701-V706 VanDerWaalsContact N-CG1 3.25Å; G701-P737 CarbonylContact O-C 3.6Å; G701-D738 PolarHBondContact O-N 3.05Å
702	A	92.4	Very high	91.5	Very high	24 Å²	24	43.1 Å²	43.1	20%	0.198	22%	0.224	C	C	.	.	S	Bend	trans	-65.5	142.1	178	0	0	0	0	0	112.1	M704 L705 V706	A702-M704 PolarHBondContact O-N 3.09Å; A702-L705 HydrophobicContact CB-CB 4.32Å; A702-L705 WeakPolarHBondContact O-CB 3.34Å; A702-L705 PolarHBondContact O-N 3.41Å; A702-V706 PolarHBondContact O-N 2.94Å; A702-V706 VanDerWaalsContact O-N 3.1Å
703	E	89.4	Confident	92.1	Very high	71 Å²	71	36 Å²	36	33%	0.332	19%	0.186	S	C	.	.	H	α-helix	trans	-48.3	-50	-169	-172.3	175.8	-172.7	0	0	115.3	V706 H707 P737 R739	E703-V706 WeakPolarHBondContact O-CG2 3.1Å; E703-H707 PolarHBondContact O-CD2 2.77Å; E703-P737 HydrophobicContact CB-CB 3.91Å; E703-P737 HydrophobicContact CG-CB 3.98Å; E703-R739 IonicContact OE1-CZ 2.88Å; E703-R739 IonicContact OE1-NE 3.81Å; E703-R739 IonicContact OE1-NH2 2.7Å; E703-R739 IonicContact OE2-CZ 3.76Å; E703-R739 IonicContact OE2-NE 3.51Å; E703-R739 PolarHBondContact OE2-NE 3.48Å; E703-R739 IonicContact OE2-NH2 3.52Å; E703-R739 PolarHBondContact OE2-NH2 2.88Å
704	M	89	Confident	92.6	Very high	142 Å²	142	36.8 Å²	36.8	70%	0.7	19%	0.187	S	C	*	.	H	α-helix	trans	-73.5	-31	178.6	-66	-60.8	-61.2	0	0	113.3	A702 Q708	A702-M704 PolarHBondContact O-N 3.09Å; M704-Q708 WeakPolarHBondContact O-CG 3.22Å; M704-Q708 PolarHBondContact O-N 2.79Å
705	L	92.9	Very high	92.7	Very high	9 Å²	9	37 Å²	37	5%	0.047	21%	0.207	C	C	.	.	H	α-helix	trans	-72.4	-42.2	-174.9	175.5	63.6	0	0	0	111.7	A702 H707 Q708 V709 A759 Y760 A809 V858	A702-L705 HydrophobicContact CB-CB 4.32Å; A702-L705 WeakPolarHBondContact O-CB 3.34Å; A702-L705 PolarHBondContact O-N 3.41Å; L705-H707 VanDerWaalsContact C-N 3.27Å; L705-H707 PolarHBondContact O-N 2.91Å; L705-Q708 PolarHBondContact O-N 3.42Å; L705-V709 HydrophobicContact CD1-CG2 3.95Å; L705-V709 HydrophobicContact CG-CG2 4.32Å; L705-V709 WeakPolarHBondContact O-CG2 3.39Å; L705-V709 PolarHBondContact O-N 3.43Å; L705-A759 HydrophobicContact CD2-CB 4.37Å; L705-Y760 VanDerWaalsContact CD2-CA 3.48Å; L705-A809 HydrophobicContact CD1-CB 4.48Å; L705-V858 HydrophobicContact CD1-CB 4.36Å; L705-V858 HydrophobicContact CD1-CG1 4.17Å; L705-V858 HydrophobicContact CD1-CG2 3.74Å
706	V	94.2	Very high	92.6	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-61	-38.4	-178.2	-65.1	0	0	0	0	111.8	I699 G701 A702 E703 C710 C735	I699-V706 HydrophobicContact CG2-CB 4.02Å; I699-V706 HydrophobicContact CG2-CG1 4.1Å; G701-V706 VanDerWaalsContact N-CG1 3.25Å; A702-V706 PolarHBondContact O-N 2.94Å; A702-V706 VanDerWaalsContact O-N 3.1Å; E703-V706 WeakPolarHBondContact O-CG2 3.1Å; V706-C710 VanDerWaalsContact O-CB 3.3Å; V706-C710 WeakPolarHBondContact O-CB 3.37Å; V706-C710 PolarHBondContact O-N 2.68Å; V706-C735 HydrophobicContact CB-CB 4.19Å; V706-C735 HydrophobicContact CG2-CB 3.89Å; V706-C735 PolarHBondContact O-SG 2.81Å
707	H	93.6	Very high	92.3	Very high	115 Å²	115	37.6 Å²	37.6	53%	0.532	22%	0.223	S	C	.	.	H	α-helix	trans	-70.4	-37.2	177.4	-68.7	-56.6	0	0	0	113.2	E703 L705 C710 G711	E703-H707 PolarHBondContact O-CD2 2.77Å; L705-H707 VanDerWaalsContact C-N 3.27Å; L705-H707 PolarHBondContact O-N 2.91Å; H707-C710 PolarHBondContact O-N 2.99Å; H707-G711 PolarHBondContact O-N 2.98Å; H707-G711 VanDerWaalsContact O-N 3.08Å
708	Q	92.1	Very high	91.8	Very high	57 Å²	57	44.7 Å²	44.7	27%	0.266	26%	0.261	S	S	.	.	H	α-helix	trans	-64.7	-47.9	173.7	-71.1	177.8	-21.5	0	0	111.3	M704 L705 C710 G711 E712 G856 V858	M704-Q708 WeakPolarHBondContact O-CG 3.22Å; M704-Q708 PolarHBondContact O-N 2.79Å; L705-Q708 PolarHBondContact O-N 3.42Å; Q708-C710 VanDerWaalsContact C-N 3.3Å; Q708-C710 PolarHBondContact O-N 2.72Å; Q708-G711 PolarHBondContact O-N 3.29Å; Q708-E712 WeakPolarHBondContact O-CG 3.38Å; Q708-E712 PolarHBondContact O-N 2.97Å; Q708-E712 VanDerWaalsContact O-N 3.1Å; Q708-G856 PolarHBondContact NE2-O 2.83Å; Q708-V858 HydrophobicContact CB-CB 4.35Å; Q708-V858 VanDerWaalsContact OE1-CG2 3.31Å
709	V	93.4	Very high	91.1	Very high	0 Å²	0	48 Å²	48	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-61.1	-38	176.4	168.1	0	0	0	0	111.7	I699 L705 L713 A759 L807 A809 V858 L860	I699-V709 HydrophobicContact CG2-CB 4.48Å; I699-V709 HydrophobicContact CG2-CG1 4.07Å; L705-V709 HydrophobicContact CD1-CG2 3.95Å; L705-V709 HydrophobicContact CG-CG2 4.32Å; L705-V709 WeakPolarHBondContact O-CG2 3.39Å; L705-V709 PolarHBondContact O-N 3.43Å; V709-L713 HydrophobicContact CG1-CD1 3.81Å; V709-L713 HydrophobicContact CG1-CG 4.43Å; V709-L713 WeakPolarHBondContact O-CB 3.21Å; V709-L713 WeakPolarHBondContact O-CD1 3.26Å; V709-L713 VanDerWaalsContact O-CG 3.23Å; V709-L713 WeakPolarHBondContact O-CG 3.46Å; V709-L713 PolarHBondContact O-N 2.91Å; V709-A759 HydrophobicContact CG1-CB 4.47Å; V709-A759 HydrophobicContact CG2-CB 4.21Å; V709-L807 HydrophobicContact CG1-CD2 3.87Å; V709-A809 HydrophobicContact CG2-CB 3.77Å; V709-V858 HydrophobicContact CG2-CG1 4.45Å; V709-L860 HydrophobicContact CG1-CD1 4.34Å
710	C	94.6	Very high	90.6	Very high	12 Å²	12	49 Å²	49	8%	0.081	31%	0.305	C	S	.	.	H	α-helix	trans	-62	-46.7	174.9	-160.7	0	0	0	0	111.9	I699 V706 H707 Q708 E712 L713 E714 C735	I699-C710 HydrophobicContact CD1-CB 3.77Å; V706-C710 VanDerWaalsContact O-CB 3.3Å; V706-C710 WeakPolarHBondContact O-CB 3.37Å; V706-C710 PolarHBondContact O-N 2.68Å; H707-C710 PolarHBondContact O-N 2.99Å; Q708-C710 VanDerWaalsContact C-N 3.3Å; Q708-C710 PolarHBondContact O-N 2.72Å; C710-E712 PolarHBondContact O-N 2.92Å; C710-L713 PolarHBondContact O-N 3.48Å; C710-E714 WeakPolarHBondContact O-CB 3.08Å; C710-E714 WeakPolarHBondContact O-CG 3.11Å; C710-E714 PolarHBondContact O-N 3.31Å; C710-C735 VanDerWaalsContact CB-SG 3.57Å
711	G	91.8	Very high	90.3	Very high	40 Å²	40	53.4 Å²	53.4	41%	0.412	33%	0.328	S	S	.	.	H	α-helix	trans	-62.3	-40.1	178.7	0	0	0	0	0	113.6	H707 Q708 G715	H707-G711 PolarHBondContact O-N 2.98Å; H707-G711 VanDerWaalsContact O-N 3.08Å; Q708-G711 PolarHBondContact O-N 3.29Å; G711-G715 PolarHBondContact O-N 2.72Å
712	E	91.1	Very high	90.2	Very high	69 Å²	69	54 Å²	54	32%	0.322	33%	0.331	S	S	.	.	H	α-helix	trans	-66.3	-39.7	175	-68.1	-74.8	115.4	0	0	112.1	Q708 C710 A716 L860	Q708-E712 WeakPolarHBondContact O-CG 3.38Å; Q708-E712 PolarHBondContact O-N 2.97Å; Q708-E712 VanDerWaalsContact O-N 3.1Å; C710-E712 PolarHBondContact O-N 2.92Å; E712-A716 WeakPolarHBondContact O-CB 3.44Å; E712-A716 PolarHBondContact O-N 3.4Å; E712-L860 HydrophobicContact CB-CB 4.35Å; E712-L860 HydrophobicContact CB-CD1 3.96Å; E712-L860 HydrophobicContact CB-CG 4.25Å; E712-L860 PolarHBondContact OE2-N 3.37Å
713	L	93	Very high	89.9	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-69.5	-41.1	176.9	-71.8	168.3	0	0	0	112.3	I699 V709 C710 L717 F733 I757 L860 V865	I699-L713 HydrophobicContact CD1-CD1 3.81Å; V709-L713 HydrophobicContact CG1-CD1 3.81Å; V709-L713 HydrophobicContact CG1-CG 4.43Å; V709-L713 WeakPolarHBondContact O-CB 3.21Å; V709-L713 WeakPolarHBondContact O-CD1 3.26Å; V709-L713 VanDerWaalsContact O-CG 3.23Å; V709-L713 WeakPolarHBondContact O-CG 3.46Å; V709-L713 PolarHBondContact O-N 2.91Å; C710-L713 PolarHBondContact O-N 3.48Å; L713-L717 WeakPolarHBondContact O-CG 3.07Å; L713-F733 HydrophobicContact CB-CD2 4.49Å; L713-F733 HydrophobicContact CB-CE1 4.34Å; L713-F733 HydrophobicContact CB-CE2 3.85Å; L713-F733 HydrophobicContact CB-CZ 3.77Å; L713-F733 HydrophobicContact CD1-CD1 4.38Å; L713-F733 HydrophobicContact CD1-CE1 3.94Å; L713-F733 HydrophobicContact CD1-CZ 4.2Å; L713-F733 HydrophobicContact CG-CZ 4.43Å; L713-I757 HydrophobicContact CD1-CD1 3.72Å; L713-L860 HydrophobicContact CD2-CD1 4.35Å; L713-L860 HydrophobicContact CG-CD1 4.27Å; L713-V865 HydrophobicContact CD2-CB 4.36Å; L713-V865 HydrophobicContact CD2-CG1 4Å; L713-V865 HydrophobicContact CD2-CG2 4.16Å
714	E	92.5	Very high	89.6	Confident	103 Å²	103	56.2 Å²	56.2	48%	0.481	34%	0.338	S	S	.	.	H	α-helix	trans	-69.5	-43.1	177	-72.7	176.5	170.6	0	0	111.7	C710 A716 L717 F733	C710-E714 WeakPolarHBondContact O-CB 3.08Å; C710-E714 WeakPolarHBondContact O-CG 3.11Å; C710-E714 PolarHBondContact O-N 3.31Å; E714-A716 PolarHBondContact O-N 3.19Å; E714-L717 PolarHBondContact O-N 3.18Å; E714-L717 VanDerWaalsContact O-N 3.16Å; E714-F733 HydrophobicContact CG-CD2 3.78Å; E714-F733 HydrophobicContact CG-CE2 4.24Å
715	G	88.1	Confident	88.9	Confident	73 Å²	73	51.6 Å²	51.6	75%	0.753	33%	0.327	S	S	*	.	H	α-helix	trans	-64.9	-20.3	178.6	0	0	0	0	0	114.4	G711	G711-G715 PolarHBondContact O-N 2.72Å
716	A	86.6	Confident	88.1	Confident	55 Å²	55	54.2 Å²	54.2	46%	0.455	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.3	-6.3	177	0	0	0	0	0	114.4	E712 E714 V865	E712-A716 WeakPolarHBondContact O-CB 3.44Å; E712-A716 PolarHBondContact O-N 3.4Å; E714-A716 PolarHBondContact O-N 3.19Å; A716-V865 HydrophobicContact CB-CB 4.35Å; A716-V865 HydrophobicContact CB-CG1 3.82Å; A716-V865 HydrophobicContact CB-CG2 4.03Å
717	L	87.8	Confident	87.3	Confident	20 Å²	20	57.1 Å²	57.1	11%	0.105	37%	0.374	C	S	.	.	S	Bend	trans	-106	119.9	178.4	-68.1	173.8	0	0	0	111.4	L713 E714 G719 G720 I721 F722 V731 F733 I869	L713-L717 WeakPolarHBondContact O-CG 3.07Å; E714-L717 PolarHBondContact O-N 3.18Å; E714-L717 VanDerWaalsContact O-N 3.16Å; L717-G719 PolarHBondContact O-N 2.8Å; L717-G720 PolarHBondContact O-N 3.27Å; L717-I721 WeakPolarHBondContact CD2-O 3.29Å; L717-F722 HydrophobicContact CD2-CB 4.06Å; L717-F722 HydrophobicContact CD2-CD2 4.1Å; L717-V731 HydrophobicContact CD1-CB 4.03Å; L717-V731 HydrophobicContact CD1-CG1 4.4Å; L717-F733 HydrophobicContact CD1-CE2 3.83Å; L717-F733 HydrophobicContact CD1-CZ 4.15Å; L717-I869 HydrophobicContact CD1-CD1 4.06Å; L717-I869 HydrophobicContact CD2-CD1 3.88Å; L717-I869 HydrophobicContact CG-CD1 4.24Å
718	D	84.1	Confident	86.8	Confident	148 Å²	148	55.7 Å²	55.7	79%	0.791	38%	0.376	S	S	*	.	G	3₁₀ helix	trans	-67.9	108.3	174	-170.8	14.6	0	0	0	110.1	G720 I721	D718-G720 PolarHBondContact O-N 3.29Å; D718-I721 WeakPolarHBondContact O-CB 3.25Å; D718-I721 PolarHBondContact O-N 3.29Å
719	G	81.3	Confident	86.6	Confident	70 Å²	70	53.4 Å²	53.4	72%	0.722	37%	0.365	S	S	*	.	G	3₁₀ helix	trans	60.8	21.9	-176.5	0	0	0	0	0	115.1	L717 I721	L717-G719 PolarHBondContact O-N 2.8Å; G719-I721 VanDerWaalsContact C-N 3.32Å
720	G	86.2	Confident	86.5	Confident	21 Å²	21	54.9 Å²	54.9	22%	0.216	38%	0.376	C	S	.	.	G	3₁₀ helix	trans	74.5	17.1	-174.5	0	0	0	0	0	114.4	L717 D718 V731	L717-G720 PolarHBondContact O-N 3.27Å; D718-G720 PolarHBondContact O-N 3.29Å; G720-V731 PolarHBondContact O-N 3.32Å
721	I	89.4	Confident	86.4	Confident	92 Å²	92	54.6 Å²	54.6	47%	0.472	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	134.3	-178.4	-60.8	163.1	0	0	0	111	L717 D718 G719 C728 I729	L717-I721 WeakPolarHBondContact CD2-O 3.29Å; D718-I721 WeakPolarHBondContact O-CB 3.25Å; D718-I721 PolarHBondContact O-N 3.29Å; G719-I721 VanDerWaalsContact C-N 3.32Å; I721-C728 HydrophobicContact CG2-CB 3.84Å; I721-I729 CarbonylContact C-O 3.29Å; I721-I729 WeakPolarHBondContact CA-O 3.44Å
722	F	90.5	Very high	86.5	Confident	13 Å²	13	55.8 Å²	55.8	6%	0.057	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	133.3	175	-176.5	-99.6	0	0	0	110.9	L717 Y724 I729 V731 Y866 I869 F870	L717-F722 HydrophobicContact CD2-CB 4.06Å; L717-F722 HydrophobicContact CD2-CD2 4.1Å; F722-Y724 HydrophobicContact CE1-CD2 4.38Å; F722-I729 PolarHBondContact N-O 3.37Å; F722-I729 PolarHBondContact O-N 3.31Å; F722-V731 HydrophobicContact CB-CG2 3.69Å; F722-Y866 AromaticContact CE2-CD2 3.62Å; F722-Y866 HydrophobicContact CE2-CD2 3.62Å; F722-Y866 AromaticContact CE2-CE2 3.95Å; F722-Y866 HydrophobicContact CE2-CE2 3.95Å; F722-Y866 HydrophobicContact CE2-CG 4.45Å; F722-Y866 AromaticContact CZ-CD2 3.82Å; F722-Y866 HydrophobicContact CZ-CD2 3.82Å; F722-Y866 AromaticContact CZ-CE2 3.73Å; F722-Y866 HydrophobicContact CZ-CE2 3.73Å; F722-I869 HydrophobicContact CB-CG2 4.23Å; F722-I869 HydrophobicContact CD1-CG2 3.69Å; F722-I869 HydrophobicContact CD2-CB 4.01Å; F722-I869 HydrophobicContact CD2-CD1 4.13Å; F722-I869 HydrophobicContact CD2-CG2 3.69Å; F722-I869 HydrophobicContact CE1-CB 4.46Å; F722-I869 HydrophobicContact CE1-CG2 3.89Å; F722-I869 HydrophobicContact CE2-CB 3.83Å; F722-I869 HydrophobicContact CE2-CG2 3.89Å; F722-I869 HydrophobicContact CG-CB 4.41Å; F722-I869 HydrophobicContact CG-CG2 3.59Å; F722-I869 HydrophobicContact CZ-CB 4.07Å; F722-I869 HydrophobicContact CZ-CG2 3.99Å; F722-F870 HydrophobicContact CZ-CB 4.05Å
723	D	87.2	Confident	86.7	Confident	92 Å²	92	53.4 Å²	53.4	49%	0.492	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	112.2	173.6	-179.6	4.7	0	0	0	111.1	G725 G726 T727	D723-G725 PolarHBondContact OD1-N 2.92Å; D723-G726 WeakPolarHBondContact OD1-CA 3.22Å; D723-G726 PolarHBondContact OD1-N 2.69Å; D723-T727 PolarHBondContact OD1-N 3.08Å
724	Y	83.2	Confident	86.8	Confident	49 Å²	49	56.9 Å²	56.9	19%	0.192	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	97.7	170	-174.6	-101.9	0	0	0	110.7	F722 G726 T727 I729 F870 V873 H874	F722-Y724 HydrophobicContact CE1-CD2 4.38Å; Y724-G726 VanDerWaalsContact C-N 3.31Å; Y724-G726 PolarHBondContact O-N 2.96Å; Y724-T727 PolarHBondContact N-O 3.4Å; Y724-T727 WeakPolarHBondContact O-CB 3.37Å; Y724-T727 PolarHBondContact O-N 2.83Å; Y724-T727 VanDerWaalsContact O-N 3.09Å; Y724-I729 HydrophobicContact CD1-CD1 4.47Å; Y724-I729 HydrophobicContact CG-CD1 4.35Å; Y724-F870 AromaticContact CD2-CD2 3.81Å; Y724-F870 HydrophobicContact CD2-CD2 3.81Å; Y724-F870 AromaticContact CD2-CE2 3.91Å; Y724-F870 HydrophobicContact CD2-CE2 3.91Å; Y724-F870 AromaticContact CE2-CD2 3.78Å; Y724-F870 HydrophobicContact CE2-CD2 3.78Å; Y724-F870 AromaticContact CE2-CE2 3.56Å; Y724-F870 HydrophobicContact CE2-CE2 3.56Å; Y724-F870 HydrophobicContact CE2-CG 4.4Å; Y724-F870 HydrophobicContact CE2-CZ 4Å; Y724-V873 HydrophobicContact CD1-CG1 3.85Å; Y724-V873 HydrophobicContact CD2-CB 4.16Å; Y724-V873 HydrophobicContact CD2-CG1 3.7Å; Y724-V873 HydrophobicContact CE1-CG1 4.18Å; Y724-V873 HydrophobicContact CE2-CB 4.42Å; Y724-V873 HydrophobicContact CE2-CG1 4.05Å; Y724-V873 HydrophobicContact CG-CB 4.49Å; Y724-V873 HydrophobicContact CG-CG1 3.59Å; Y724-H874 HydrophobicContact CE2-CB 4.04Å; Y724-H874 WeakPolarHBondContact OH-CA 2.98Å; Y724-H874 WeakPolarHBondContact OH-CB 3.39Å; Y724-H874 PolarHBondContact OH-CD2 2.95Å; Y724-H874 VanDerWaalsContact OH-CD2 3.29Å
725	G	73.8	Confident	86.9	Confident	45 Å²	45	53.1 Å²	53.1	46%	0.464	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.8	24.5	172	0	0	0	0	0	115.3	D723 C891	D723-G725 PolarHBondContact OD1-N 2.92Å; G725-C891 WeakPolarHBondContact O-CB 3.41Å
726	G	76.4	Confident	87.2	Confident	64 Å²	64	49.6 Å²	49.6	66%	0.66	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	95	6.5	-172.3	0	0	0	0	0	113.8	D723 Y724	D723-G726 WeakPolarHBondContact OD1-CA 3.22Å; D723-G726 PolarHBondContact OD1-N 2.69Å; Y724-G726 VanDerWaalsContact C-N 3.31Å; Y724-G726 PolarHBondContact O-N 2.96Å
727	T	76.5	Confident	87.6	Confident	61 Å²	61	47.8 Å²	47.8	37%	0.374	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	115.3	176.6	-51.4	0	0	0	0	109.5	D723 Y724 I729	D723-T727 PolarHBondContact OD1-N 3.08Å; Y724-T727 PolarHBondContact N-O 3.4Å; Y724-T727 WeakPolarHBondContact O-CB 3.37Å; Y724-T727 PolarHBondContact O-N 2.83Å; Y724-T727 VanDerWaalsContact O-N 3.09Å; T727-I729 HydrophobicContact CG2-CG1 4.29Å; T727-I729 PolarHBondContact O-N 3.12Å
728	C	84.3	Confident	87.8	Confident	86 Å²	86	49.8 Å²	49.8	58%	0.581	32%	0.316	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.6	120.3	171.8	-58.5	0	0	0	0	110	I721	I721-C728 HydrophobicContact CG2-CB 3.84Å
729	I	86.7	Confident	88.1	Confident	8 Å²	8	51.7 Å²	51.7	4%	0.041	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	132.5	179.6	-66.1	177	0	0	0	108.2	N693 V695 I721 F722 Y724 T727 V731 V873	N693-I729 CarbonylContact O-C 3.54Å; N693-I729 WeakPolarHBondContact O-CA 3.25Å; N693-I729 WeakPolarHBondContact O-CG2 3.15Å; V695-I729 HydrophobicContact CB-CG2 3.88Å; V695-I729 HydrophobicContact CG2-CG2 3.39Å; I721-I729 CarbonylContact C-O 3.29Å; I721-I729 WeakPolarHBondContact CA-O 3.44Å; F722-I729 PolarHBondContact N-O 3.37Å; F722-I729 PolarHBondContact O-N 3.31Å; Y724-I729 HydrophobicContact CD1-CD1 4.47Å; Y724-I729 HydrophobicContact CG-CD1 4.35Å; T727-I729 HydrophobicContact CG2-CG1 4.29Å; T727-I729 PolarHBondContact O-N 3.12Å; I729-V731 HydrophobicContact CG2-CG2 4.3Å; I729-V873 HydrophobicContact CD1-CG1 3.71Å
730	S	91	Very high	88.6	Confident	32 Å²	32	51.4 Å²	51.4	22%	0.224	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	125.1	173	178.3	0	0	0	0	109.2	N693 Q694 V695	N693-S730 PolarHBondContact O-N 2.78Å; Q694-S730 CarbonylContact C-O 3.57Å; Q694-S730 WeakPolarHBondContact CA-O 3.39Å; Q694-S730 VanDerWaalsContact NE2-CB 3.28Å; Q694-S730 PolarHBondContact NE2-OG 2.81Å; Q694-S730 PolarHBondContact OE1-OG 2.63Å; V695-S730 PolarHBondContact N-O 3.41Å
731	V	93.4	Very high	88.8	Confident	6 Å²	6	51.2 Å²	51.2	4%	0.036	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	126.8	-175.7	-174.4	0	0	0	0	109.6	V695 I697 L717 G720 F722 I729 F733 I869	V695-V731 CarbonylContact O-C 3.13Å; V695-V731 WeakPolarHBondContact O-CA 3.43Å; I697-V731 HydrophobicContact CD1-CG1 3.81Å; I697-V731 HydrophobicContact CG1-CG1 4.31Å; L717-V731 HydrophobicContact CD1-CB 4.03Å; L717-V731 HydrophobicContact CD1-CG1 4.4Å; G720-V731 PolarHBondContact O-N 3.32Å; F722-V731 HydrophobicContact CB-CG2 3.69Å; I729-V731 HydrophobicContact CG2-CG2 4.3Å; V731-F733 HydrophobicContact CG1-CE1 3.95Å; V731-F733 HydrophobicContact CG1-CE2 4.04Å; V731-F733 HydrophobicContact CG1-CZ 3.6Å; V731-I869 HydrophobicContact CG2-CG2 4.19Å
732	N	93.5	Very high	88.6	Confident	65 Å²	65	52.6 Å²	52.6	35%	0.348	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	139.8	177.2	-59.1	-88.6	0	0	0	109.8	Q694 V695 R696 I697 Y751	Q694-N732 PolarHBondContact OE1-ND2 2.91Å; Q694-N732 VanDerWaalsContact OE1-ND2 3.15Å; V695-N732 PolarHBondContact O-N 3.15Å; R696-N732 CarbonylContact C-O 3.57Å; R696-N732 WeakPolarHBondContact CA-O 3.31Å; I697-N732 PolarHBondContact N-O 2.85Å; N732-Y751 VanDerWaalsContact CB-OH 3.26Å; N732-Y751 WeakPolarHBondContact CB-OH 3.19Å
733	F	95	Very high	88.4	Confident	19 Å²	19	58.4 Å²	58.4	8%	0.083	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	149.1	-179.1	-59	-75.9	0	0	0	112.4	I697 I699 L713 E714 L717 V731 Y751 I757 I869	I697-F733 HydrophobicContact CB-CD1 3.85Å; I697-F733 HydrophobicContact CB-CE1 4.06Å; I697-F733 HydrophobicContact CD1-CE1 4.02Å; I697-F733 HydrophobicContact CG1-CE1 4.48Å; I697-F733 HydrophobicContact CG2-CD1 4.27Å; I697-F733 HydrophobicContact CG2-CE1 4.36Å; I697-F733 CarbonylContact O-C 3.53Å; I697-F733 WeakPolarHBondContact O-CA 3.34Å; I699-F733 HydrophobicContact CD1-CB 3.95Å; I699-F733 HydrophobicContact CD1-CD1 3.81Å; I699-F733 HydrophobicContact CD1-CG 4.04Å; I699-F733 HydrophobicContact CG1-CD1 4.14Å; L713-F733 HydrophobicContact CB-CD2 4.49Å; L713-F733 HydrophobicContact CB-CE1 4.34Å; L713-F733 HydrophobicContact CB-CE2 3.85Å; L713-F733 HydrophobicContact CB-CZ 3.77Å; L713-F733 HydrophobicContact CD1-CD1 4.38Å; L713-F733 HydrophobicContact CD1-CE1 3.94Å; L713-F733 HydrophobicContact CD1-CZ 4.2Å; L713-F733 HydrophobicContact CG-CZ 4.43Å; E714-F733 HydrophobicContact CG-CD2 3.78Å; E714-F733 HydrophobicContact CG-CE2 4.24Å; L717-F733 HydrophobicContact CD1-CE2 3.83Å; L717-F733 HydrophobicContact CD1-CZ 4.15Å; V731-F733 HydrophobicContact CG1-CE1 3.95Å; V731-F733 HydrophobicContact CG1-CE2 4.04Å; V731-F733 HydrophobicContact CG1-CZ 3.6Å; F733-Y751 VanDerWaalsContact C-OH 3.27Å; F733-Y751 PolarHBondContact N-OH 3.24Å; F733-Y751 PolarHBondContact O-OH 2.75Å; F733-Y751 VanDerWaalsContact O-OH 3.08Å; F733-I757 HydrophobicContact CE1-CD1 4.32Å; F733-I869 HydrophobicContact CZ-CD1 4.21Å
734	R	94.7	Very high	88.4	Confident	72 Å²	72	54 Å²	54	27%	0.272	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	121.2	167.1	-170.6	171.3	-174.3	-177	-1.4	109.9	I697 L698 I699 Y747 E750 Y751	I697-R734 PolarHBondContact O-N 2.57Å; L698-R734 WeakPolarHBondContact CA-O 3.38Å; L698-R734 HydrophobicContact CD2-CB 3.97Å; I699-R734 PolarHBondContact N-O 3.27Å; R734-Y747 VanDerWaalsContact CZ-CD1 3.4Å; R734-E750 IonicContact CZ-OE2 3.6Å; R734-E750 IonicContact NH1-OE2 3.84Å; R734-E750 IonicContact NH2-OE2 2.95Å; R734-E750 PolarHBondContact NH2-OE2 2.86Å; R734-Y751 HydrophobicContact CB-CD1 3.85Å; R734-Y751 HydrophobicContact CB-CD2 4.3Å; R734-Y751 HydrophobicContact CB-CE1 3.58Å; R734-Y751 HydrophobicContact CB-CE2 4.06Å; R734-Y751 HydrophobicContact CB-CG 4.2Å
735	C	95.9	Very high	88.5	Confident	24 Å²	24	56 Å²	56	16%	0.162	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	140	176.1	-66.5	0	0	0	0	111	I699 V706 C710	I699-C735 CarbonylContact O-C 3.53Å; I699-C735 WeakPolarHBondContact O-CA 3.31Å; V706-C735 HydrophobicContact CB-CB 4.19Å; V706-C735 HydrophobicContact CG2-CB 3.89Å; V706-C735 PolarHBondContact O-SG 2.81Å; C710-C735 VanDerWaalsContact CB-SG 3.57Å
736	I	94.3	Very high	88.8	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	106.4	171.2	-57	176.7	0	0	0	107.5	L698 I699 V700 E740 F741 F744 Y747	L698-I736 HydrophobicContact CB-CD1 4.14Å; L698-I736 HydrophobicContact CD1-CD1 3.81Å; L698-I736 HydrophobicContact CD2-CD1 4.01Å; L698-I736 HydrophobicContact CG-CD1 4.18Å; I699-I736 PolarHBondContact O-N 2.9Å; V700-I736 HydrophobicContact CG2-CB 4.24Å; V700-I736 HydrophobicContact CG2-CD1 4.39Å; I736-E740 HydrophobicContact CG2-CB 4.1Å; I736-F741 HydrophobicContact CG2-CD1 4.38Å; I736-F744 HydrophobicContact CD1-CD2 3.79Å; I736-F744 HydrophobicContact CD1-CE2 4.27Å; I736-Y747 HydrophobicContact CD1-CD2 3.9Å; I736-Y747 HydrophobicContact CD1-CG 3.84Å; I736-Y747 HydrophobicContact CG1-CD2 4.04Å; I736-Y747 HydrophobicContact CG1-CG 4.12Å; I736-Y747 HydrophobicContact CG2-CD2 4.19Å; I736-Y747 HydrophobicContact CG2-CE2 4.4Å
737	P	94.4	Very high	89.3	Confident	16 Å²	16	54.7 Å²	54.7	10%	0.104	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	160.9	177	33	-36.4	0	0	0	111.7	G701 E703 R739 E740 F741	G701-P737 CarbonylContact O-C 3.6Å; E703-P737 HydrophobicContact CB-CB 3.91Å; E703-P737 HydrophobicContact CG-CB 3.98Å; P737-R739 VanDerWaalsContact C-N 3.28Å; P737-R739 PolarHBondContact O-N 2.69Å; P737-E740 HydrophobicContact CG-CB 4.21Å; P737-E740 HydrophobicContact CG-CG 3.92Å; P737-E740 WeakPolarHBondContact O-CA 3.49Å; P737-E740 PolarHBondContact O-N 3.08Å; P737-F741 WeakPolarHBondContact O-CD1 3.07Å
738	D	91.6	Very high	89.7	Confident	63 Å²	63	51.8 Å²	51.8	34%	0.337	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-45.6	-42.3	175.8	54.4	7.7	0	0	0	115.7	G701 E740 F741	G701-D738 PolarHBondContact O-N 3.05Å; D738-E740 PolarHBondContact O-N 2.8Å; D738-E740 VanDerWaalsContact O-N 3.09Å; D738-F741 VanDerWaalsContact CA-CE1 3.41Å; D738-F741 HydrophobicContact CB-CE1 4.32Å; D738-F741 HydrophobicContact CB-CE2 4.04Å; D738-F741 HydrophobicContact CB-CZ 3.94Å; D738-F741 WeakPolarHBondContact O-CG 3.46Å; D738-F741 PolarHBondContact O-N 2.95Å
739	R	91.1	Very high	89.5	Confident	188 Å²	188	52.1 Å²	52.1	71%	0.709	26%	0.255	S	S	*	.	G	3₁₀ helix	trans	-60.7	-19.1	176.8	-49.4	-173.1	-162.4	-162.8	7.9	114	E703 P737	E703-R739 IonicContact OE1-CZ 2.88Å; E703-R739 IonicContact OE1-NE 3.81Å; E703-R739 IonicContact OE1-NH2 2.7Å; E703-R739 IonicContact OE2-CZ 3.76Å; E703-R739 IonicContact OE2-NE 3.51Å; E703-R739 PolarHBondContact OE2-NE 3.48Å; E703-R739 IonicContact OE2-NH2 3.52Å; E703-R739 PolarHBondContact OE2-NH2 2.88Å; P737-R739 VanDerWaalsContact C-N 3.28Å; P737-R739 PolarHBondContact O-N 2.69Å
740	E	91.2	Very high	89.5	Confident	64 Å²	64	57.2 Å²	57.2	30%	0.299	28%	0.279	S	S	.	.	G	3₁₀ helix	trans	-110.1	2.9	-174.1	-64.3	-168.7	166	0	0	113.9	I736 P737 D738 P742 R743 F744 Y747	I736-E740 HydrophobicContact CG2-CB 4.1Å; P737-E740 HydrophobicContact CG-CB 4.21Å; P737-E740 HydrophobicContact CG-CG 3.92Å; P737-E740 WeakPolarHBondContact O-CA 3.49Å; P737-E740 PolarHBondContact O-N 3.08Å; D738-E740 PolarHBondContact O-N 2.8Å; D738-E740 VanDerWaalsContact O-N 3.09Å; E740-P742 VanDerWaalsContact C-N 3.3Å; E740-R743 WeakPolarHBondContact O-CA 3.34Å; E740-R743 PolarHBondContact O-N 3Å; E740-F744 PolarHBondContact O-N 3.04Å; E740-Y747 HydrophobicContact CB-CE2 4.08Å; E740-Y747 VanDerWaalsContact CD-OH 3.28Å; E740-Y747 VanDerWaalsContact OE2-CE2 3.25Å; E740-Y747 WeakPolarHBondContact OE2-CE2 3.24Å; E740-Y747 PolarHBondContact OE2-OH 3.09Å
741	F	91.2	Very high	89.4	Confident	17 Å²	17	58 Å²	58	8%	0.075	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-49.6	-40.5	174.1	-67.2	-6.2	0	0	0	113.9	V700 I736 P737 D738 R743 F744 C768 F772 T776	V700-F741 HydrophobicContact CG1-CD1 3.94Å; V700-F741 HydrophobicContact CG1-CE1 3.28Å; V700-F741 HydrophobicContact CG1-CZ 3.84Å; I736-F741 HydrophobicContact CG2-CD1 4.38Å; P737-F741 WeakPolarHBondContact O-CD1 3.07Å; D738-F741 VanDerWaalsContact CA-CE1 3.41Å; D738-F741 HydrophobicContact CB-CE1 4.32Å; D738-F741 HydrophobicContact CB-CE2 4.04Å; D738-F741 HydrophobicContact CB-CZ 3.94Å; D738-F741 WeakPolarHBondContact O-CG 3.46Å; D738-F741 PolarHBondContact O-N 2.95Å; F741-R743 PolarHBondContact O-N 3.28Å; F741-F744 WeakPolarHBondContact O-CB 3.27Å; F741-F744 PolarHBondContact O-N 2.74Å; F741-C768 WeakPolarHBondContact CZ-SG 3.39Å; F741-F772 HydrophobicContact CB-CD2 4.48Å; F741-F772 HydrophobicContact CD1-CD2 4.05Å; F741-F772 HydrophobicContact CD2-CB 3.92Å; F741-F772 HydrophobicContact CD2-CD2 4.22Å; F741-F772 HydrophobicContact CE1-CD2 4.31Å; F741-F772 HydrophobicContact CE2-CB 3.58Å; F741-F772 HydrophobicContact CE2-CD2 4.48Å; F741-F772 HydrophobicContact CE2-CG 4.43Å; F741-F772 AromaticContact CG-CD2 4Å; F741-F772 HydrophobicContact CG-CD2 4Å; F741-F772 HydrophobicContact CZ-CB 3.89Å; F741-F772 HydrophobicContact CZ-CD2 4.5Å; F741-F772 HydrophobicContact CZ-CG 4.42Å; F741-T776 HydrophobicContact CB-CG2 4.43Å; F741-T776 WeakPolarHBondContact O-CG2 3.43Å
742	P	84.5	Confident	89	Confident	120 Å²	120	61.8 Å²	61.8	78%	0.779	29%	0.294	S	S	*	.	G	3₁₀ helix	trans	-61.1	-13.9	175.2	-24.5	35.9	0	0	0	115.1	E740	E740-P742 VanDerWaalsContact C-N 3.3Å
743	R	86.1	Confident	88.7	Confident	135 Å²	135	58.7 Å²	58.7	51%	0.509	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-105.9	7.2	176	-54.8	-172.3	73.6	-178.5	-0.6	112.8	E740 F741 F745 S746 Y747	E740-R743 WeakPolarHBondContact O-CA 3.34Å; E740-R743 PolarHBondContact O-N 3Å; F741-R743 PolarHBondContact O-N 3.28Å; R743-F745 PolarHBondContact O-N 2.86Å; R743-S746 WeakPolarHBondContact O-CA 3.38Å; R743-S746 VanDerWaalsContact O-CB 3.23Å; R743-S746 WeakPolarHBondContact O-CB 3.26Å; R743-S746 PolarHBondContact O-N 3.04Å; R743-Y747 HydrophobicContact CB-CD2 4.25Å; R743-Y747 HydrophobicContact CB-CE2 4.11Å; R743-Y747 WeakPolarHBondContact O-CD2 3.33Å; R743-Y747 PolarHBondContact O-N 3.08Å
744	F	88.2	Confident	88.5	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-50.9	-49.1	-176.9	172.3	-105.8	0	0	0	113	I686 F687 L698 V700 I736 E740 F741 S746 Y747 V748 V756 F772 T776 L777	I686-F744 HydrophobicContact CD1-CE1 4.05Å; I686-F744 HydrophobicContact CD1-CZ 4.49Å; F687-F744 HydrophobicContact CE1-CZ 4.31Å; F687-F744 HydrophobicContact CZ-CZ 4.09Å; L698-F744 HydrophobicContact CD1-CD2 4.35Å; L698-F744 HydrophobicContact CD1-CE2 3.69Å; L698-F744 HydrophobicContact CD1-CZ 4.32Å; V700-F744 HydrophobicContact CG2-CD2 4.31Å; V700-F744 HydrophobicContact CG2-CE2 4.1Å; I736-F744 HydrophobicContact CD1-CD2 3.79Å; I736-F744 HydrophobicContact CD1-CE2 4.27Å; E740-F744 PolarHBondContact O-N 3.04Å; F741-F744 WeakPolarHBondContact O-CB 3.27Å; F741-F744 PolarHBondContact O-N 2.74Å; F744-S746 VanDerWaalsContact C-N 3.28Å; F744-S746 PolarHBondContact O-N 3.22Å; F744-Y747 WeakPolarHBondContact O-CA 3.19Å; F744-Y747 WeakPolarHBondContact O-CB 3.24Å; F744-Y747 PolarHBondContact O-N 3.02Å; F744-V748 HydrophobicContact CD1-CG2 4.18Å; F744-V748 HydrophobicContact CD2-CG2 4.34Å; F744-V748 HydrophobicContact CE1-CG2 3.7Å; F744-V748 HydrophobicContact CE2-CG2 3.87Å; F744-V748 HydrophobicContact CG-CG2 4.48Å; F744-V748 HydrophobicContact CZ-CG2 3.51Å; F744-V748 WeakPolarHBondContact O-CG2 3.46Å; F744-V748 PolarHBondContact O-N 3.49Å; F744-V756 HydrophobicContact CE2-CG2 4.22Å; F744-F772 HydrophobicContact CB-CE2 4.16Å; F744-F772 AromaticContact CD1-CE2 4Å; F744-F772 HydrophobicContact CD1-CE2 4Å; F744-F772 HydrophobicContact CD1-CZ 4.11Å; F744-F772 AromaticContact CD2-CE2 3.63Å; F744-F772 HydrophobicContact CD2-CE2 3.63Å; F744-F772 AromaticContact CD2-CZ 3.75Å; F744-F772 HydrophobicContact CD2-CZ 3.75Å; F744-F772 HydrophobicContact CE1-CE2 4.33Å; F744-F772 AromaticContact CE1-CZ 3.97Å; F744-F772 HydrophobicContact CE1-CZ 3.97Å; F744-F772 HydrophobicContact CE2-CE2 4.01Å; F744-F772 AromaticContact CE2-CZ 3.6Å; F744-F772 HydrophobicContact CE2-CZ 3.6Å; F744-F772 AromaticContact CG-CE2 3.64Å; F744-F772 HydrophobicContact CG-CE2 3.64Å; F744-F772 HydrophobicContact CG-CZ 4.02Å; F744-F772 HydrophobicContact CZ-CE2 4.35Å; F744-F772 AromaticContact CZ-CZ 3.72Å; F744-F772 HydrophobicContact CZ-CZ 3.72Å; F744-T776 HydrophobicContact CB-CG2 3.6Å; F744-T776 HydrophobicContact CD1-CG2 4.12Å; F744-T776 HydrophobicContact CG-CG2 4.11Å; F744-L777 HydrophobicContact CE1-CD1 4.18Å
745	F	84.2	Confident	88.2	Confident	91 Å²	91	54.4 Å²	54.4	40%	0.399	26%	0.261	S	S	.	.	H	α-helix	trans	-65.8	-27.9	177.8	-63.5	-65.6	0	0	0	113.4	I686 R743 N749 T776	I686-F745 HydrophobicContact CB-CE1 4.47Å; I686-F745 HydrophobicContact CD1-CE1 4.15Å; I686-F745 HydrophobicContact CG2-CE1 3.99Å; R743-F745 PolarHBondContact O-N 2.86Å; F745-N749 PolarHBondContact O-N 2.8Å; F745-N749 PolarHBondContact O-ND2 3Å; F745-T776 WeakPolarHBondContact CE2-O 3.39Å; F745-T776 VanDerWaalsContact CZ-O 3.31Å; F745-T776 WeakPolarHBondContact CZ-O 3.46Å
746	S	80.8	Confident	88.1	Confident	51 Å²	51	53.2 Å²	53.2	36%	0.357	25%	0.253	S	S	.	.	H	α-helix	trans	-64.9	-44.5	169.3	-50	0	0	0	0	110.6	R743 F744 N749 E750	R743-S746 WeakPolarHBondContact O-CA 3.38Å; R743-S746 VanDerWaalsContact O-CB 3.23Å; R743-S746 WeakPolarHBondContact O-CB 3.26Å; R743-S746 PolarHBondContact O-N 3.04Å; F744-S746 VanDerWaalsContact C-N 3.28Å; F744-S746 PolarHBondContact O-N 3.22Å; S746-N749 PolarHBondContact O-N 2.88Å; S746-E750 VanDerWaalsContact O-CB 3.31Å; S746-E750 WeakPolarHBondContact O-CB 3.19Å; S746-E750 VanDerWaalsContact O-CG 3.3Å; S746-E750 WeakPolarHBondContact O-CG 3.48Å; S746-E750 PolarHBondContact O-N 3.38Å
747	Y	87.4	Confident	88.2	Confident	30 Å²	30	53.2 Å²	53.2	12%	0.118	25%	0.253	C	S	.	.	H	α-helix	trans	-64.4	-39.5	176.2	-76.3	-63.9	0	0	0	113.8	R734 I736 E740 R743 F744 N749 Y751	R734-Y747 VanDerWaalsContact CZ-CD1 3.4Å; I736-Y747 HydrophobicContact CD1-CD2 3.9Å; I736-Y747 HydrophobicContact CD1-CG 3.84Å; I736-Y747 HydrophobicContact CG1-CD2 4.04Å; I736-Y747 HydrophobicContact CG1-CG 4.12Å; I736-Y747 HydrophobicContact CG2-CD2 4.19Å; I736-Y747 HydrophobicContact CG2-CE2 4.4Å; E740-Y747 HydrophobicContact CB-CE2 4.08Å; E740-Y747 VanDerWaalsContact CD-OH 3.28Å; E740-Y747 VanDerWaalsContact OE2-CE2 3.25Å; E740-Y747 WeakPolarHBondContact OE2-CE2 3.24Å; E740-Y747 PolarHBondContact OE2-OH 3.09Å; R743-Y747 HydrophobicContact CB-CD2 4.25Å; R743-Y747 HydrophobicContact CB-CE2 4.11Å; R743-Y747 WeakPolarHBondContact O-CD2 3.33Å; R743-Y747 PolarHBondContact O-N 3.08Å; F744-Y747 WeakPolarHBondContact O-CA 3.19Å; F744-Y747 WeakPolarHBondContact O-CB 3.24Å; F744-Y747 PolarHBondContact O-N 3.02Å; Y747-N749 VanDerWaalsContact C-N 3.29Å; Y747-N749 PolarHBondContact O-N 2.9Å; Y747-Y751 WeakPolarHBondContact O-CB 3.25Å; Y747-Y751 PolarHBondContact O-N 2.6Å
748	V	84.9	Confident	88.3	Confident	1 Å²	1	52.5 Å²	52.5	1%	0.006	25%	0.249	C	C	.	.	H	α-helix	trans	-57.7	-43.2	174.7	172.8	0	0	0	0	111.1	I686 F687 L698 F744 E752 A753	I686-V748 WeakPolarHBondContact O-CG1 3.12Å; F687-V748 HydrophobicContact CD1-CG1 4.37Å; F687-V748 HydrophobicContact CE1-CG2 4.23Å; L698-V748 HydrophobicContact CD1-CB 4.38Å; L698-V748 HydrophobicContact CD1-CG2 3.49Å; L698-V748 VanDerWaalsContact CD1-CG2 3.49Å; F744-V748 HydrophobicContact CD1-CG2 4.18Å; F744-V748 HydrophobicContact CD2-CG2 4.34Å; F744-V748 HydrophobicContact CE1-CG2 3.7Å; F744-V748 HydrophobicContact CE2-CG2 3.87Å; F744-V748 HydrophobicContact CG-CG2 4.48Å; F744-V748 HydrophobicContact CZ-CG2 3.51Å; F744-V748 WeakPolarHBondContact O-CG2 3.46Å; F744-V748 PolarHBondContact O-N 3.49Å; V748-E752 WeakPolarHBondContact O-CA 3.34Å; V748-E752 PolarHBondContact O-N 2.77Å; V748-E752 VanDerWaalsContact O-N 3.09Å; V748-A753 PolarHBondContact O-N 3.17Å
749	N	80.4	Confident	88.5	Confident	93 Å²	93	49.5 Å²	49.5	50%	0.497	23%	0.233	S	C	.	.	H	α-helix	trans	-76.5	-47.4	178.8	-66.9	-18.9	0	0	0	112.9	Y688 F745 S746 Y747 Y751 E752	Y688-N749 PolarHBondContact OH-OD1 3.23Å; F745-N749 PolarHBondContact O-N 2.8Å; F745-N749 PolarHBondContact O-ND2 3Å; S746-N749 PolarHBondContact O-N 2.88Å; Y747-N749 VanDerWaalsContact C-N 3.29Å; Y747-N749 PolarHBondContact O-N 2.9Å; N749-Y751 VanDerWaalsContact C-N 3.26Å; N749-Y751 PolarHBondContact O-N 3.03Å; N749-E752 PolarHBondContact O-N 3.2Å
750	E	85.5	Confident	88.6	Confident	115 Å²	115	40.6 Å²	40.6	54%	0.537	20%	0.199	S	C	.	.	H	α-helix	trans	-62.1	-32.8	178.9	-77.9	178	-159	0	0	113.1	R734 S746	R734-E750 IonicContact CZ-OE2 3.6Å; R734-E750 IonicContact NH1-OE2 3.84Å; R734-E750 IonicContact NH2-OE2 2.95Å; R734-E750 PolarHBondContact NH2-OE2 2.86Å; S746-E750 VanDerWaalsContact O-CB 3.31Å; S746-E750 WeakPolarHBondContact O-CB 3.19Å; S746-E750 VanDerWaalsContact O-CG 3.3Å; S746-E750 WeakPolarHBondContact O-CG 3.48Å; S746-E750 PolarHBondContact O-N 3.38Å
751	Y	89.3	Confident	88.7	Confident	48 Å²	48	38 Å²	38	19%	0.188	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.4	-2.1	-179.1	-158.4	-125.3	0	0	0	112.8	R696 L698 N732 F733 R734 Y747 N749 A753	R696-Y751 HydrophobicContact CB-CD1 3.91Å; R696-Y751 HydrophobicContact CB-CE1 3.68Å; R696-Y751 WeakPolarHBondContact CD-O 3.27Å; R696-Y751 HydrophobicContact CG-CE1 4.47Å; L698-Y751 HydrophobicContact CD2-CD1 3.66Å; L698-Y751 HydrophobicContact CD2-CE1 4.38Å; L698-Y751 HydrophobicContact CD2-CG 4.34Å; N732-Y751 VanDerWaalsContact CB-OH 3.26Å; N732-Y751 WeakPolarHBondContact CB-OH 3.19Å; F733-Y751 VanDerWaalsContact C-OH 3.27Å; F733-Y751 PolarHBondContact N-OH 3.24Å; F733-Y751 PolarHBondContact O-OH 2.75Å; F733-Y751 VanDerWaalsContact O-OH 3.08Å; R734-Y751 HydrophobicContact CB-CD1 3.85Å; R734-Y751 HydrophobicContact CB-CD2 4.3Å; R734-Y751 HydrophobicContact CB-CE1 3.58Å; R734-Y751 HydrophobicContact CB-CE2 4.06Å; R734-Y751 HydrophobicContact CB-CG 4.2Å; Y747-Y751 WeakPolarHBondContact O-CB 3.25Å; Y747-Y751 PolarHBondContact O-N 2.6Å; N749-Y751 VanDerWaalsContact C-N 3.26Å; N749-Y751 PolarHBondContact O-N 3.03Å; Y751-A753 VanDerWaalsContact C-N 3.25Å; Y751-A753 HydrophobicContact CD1-CB 4.46Å; Y751-A753 PolarHBondContact O-N 3.19Å
752	E	85.4	Confident	88.7	Confident	85 Å²	85	37.8 Å²	37.8	40%	0.397	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	44.6	52.3	-173.7	-67.3	-179.9	161.7	0	0	111.6	Y688 R696 V748 N749	Y688-E752 HydrophobicContact CD1-CB 4.18Å; Y688-E752 HydrophobicContact CD1-CG 4.25Å; Y688-E752 HydrophobicContact CD2-CB 4.36Å; Y688-E752 HydrophobicContact CE1-CB 4.48Å; Y688-E752 HydrophobicContact CE1-CG 4.13Å; Y688-E752 HydrophobicContact CG-CB 4.12Å; R696-E752 IonicContact CZ-OE2 3.53Å; R696-E752 PolarHBondContact NH1-O 3.4Å; R696-E752 IonicContact NH1-OE2 2.64Å; R696-E752 PolarHBondContact NH1-OE2 2.95Å; R696-E752 IonicContact NH2-OE2 3.67Å; R696-E752 PolarHBondContact NH2-OE2 3.24Å; V748-E752 WeakPolarHBondContact O-CA 3.34Å; V748-E752 PolarHBondContact O-N 2.77Å; V748-E752 VanDerWaalsContact O-N 3.09Å; N749-E752 PolarHBondContact O-N 3.2Å
753	A	87.8	Confident	89	Confident	0 Å²	0	38 Å²	38	0%	0	17%	0.174	C	C	.	.			trans	-71	139.4	-167.1	0	0	0	0	0	112.6	F687 Y688 L698 V748 Y751	F687-A753 CarbonylContact C-O 3.52Å; F687-A753 VanDerWaalsContact CA-O 3.28Å; F687-A753 WeakPolarHBondContact CA-O 3.34Å; F687-A753 WeakPolarHBondContact CB-O 3.22Å; F687-A753 HydrophobicContact CD1-CB 4.12Å; F687-A753 WeakPolarHBondContact CD1-O 3.27Å; F687-A753 HydrophobicContact CE1-CB 4.44Å; Y688-A753 PolarHBondContact N-O 2.96Å; L698-A753 HydrophobicContact CD1-CB 3.7Å; L698-A753 HydrophobicContact CD2-CB 4.12Å; L698-A753 HydrophobicContact CG-CB 3.63Å; V748-A753 PolarHBondContact O-N 3.17Å; Y751-A753 VanDerWaalsContact C-N 3.25Å; Y751-A753 HydrophobicContact CD1-CB 4.46Å; Y751-A753 PolarHBondContact O-N 3.19Å
754	N	90.2	Very high	89.2	Confident	1 Å²	1	38 Å²	38	1%	0.005	18%	0.179	C	C	.	.			trans	-95.5	-11	179.4	-54.9	111.6	0	0	0	113.9	Y688 P689 I690 V695 R696 P803	Y688-N754 PolarHBondContact O-ND2 3.45Å; P689-N754 VanDerWaalsContact C-ND2 3.27Å; P689-N754 PolarHBondContact O-ND2 3.32Å; I690-N754 HydrophobicContact CG1-CB 4.32Å; V695-N754 WeakPolarHBondContact CA-OD1 3.49Å; V695-N754 HydrophobicContact CG1-CB 4.38Å; R696-N754 PolarHBondContact N-OD1 2.79Å; R696-N754 PolarHBondContact O-N 3.35Å; N754-P803 WeakPolarHBondContact O-CB 3.19Å; N754-P803 WeakPolarHBondContact O-CG 3.39Å
755	G	88.4	Confident	89.4	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	178.4	178.8	179.1	0	0	0	0	0	113.5	L698 P803	L698-G755 PolarHBondContact N-O 2.93Å; G755-P803 CarbonylContact C-O 3.55Å; G755-P803 VanDerWaalsContact CA-O 3.23Å; G755-P803 WeakPolarHBondContact CA-O 3.27Å
756	V	93.9	Very high	89.8	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	138.1	-176.2	67.7	0	0	0	0	113	F687 L698 V700 F744 V758 P803 L804 V805	F687-V756 HydrophobicContact CE1-CB 4.03Å; F687-V756 HydrophobicContact CE1-CG1 4.36Å; F687-V756 HydrophobicContact CE2-CG1 4.07Å; F687-V756 HydrophobicContact CZ-CB 3.63Å; F687-V756 HydrophobicContact CZ-CG1 3.46Å; F687-V756 VanDerWaalsContact CZ-CG1 3.46Å; L698-V756 HydrophobicContact CB-CB 4.44Å; L698-V756 HydrophobicContact CB-CG2 4.13Å; L698-V756 CarbonylContact O-C 3.6Å; L698-V756 WeakPolarHBondContact O-CA 3.34Å; V700-V756 HydrophobicContact CB-CG2 4.14Å; V700-V756 HydrophobicContact CG2-CG2 3.39Å; F744-V756 HydrophobicContact CE2-CG2 4.22Å; V756-V758 HydrophobicContact CG2-CG2 4.46Å; V756-P803 PolarHBondContact N-O 3.41Å; V756-L804 HydrophobicContact CG1-CB 3.98Å; V756-L804 HydrophobicContact CG1-CD1 3.69Å; V756-L804 HydrophobicContact CG1-CG 3.69Å; V756-L804 WeakPolarHBondContact O-CA 3.15Å; V756-V805 PolarHBondContact O-N 2.77Å
757	I	96.4	Very high	90.2	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	121.8	168	-61.1	169.1	0	0	0	107.3	I697 L698 I699 V700 L713 F733 V805 L807 T868 I872	I697-I757 HydrophobicContact CG2-CD1 3.77Å; I697-I757 HydrophobicContact CG2-CG1 3.77Å; L698-I757 PolarHBondContact O-N 3.44Å; I699-I757 HydrophobicContact CG1-CB 4.49Å; I699-I757 HydrophobicContact CG1-CD1 4.28Å; V700-I757 PolarHBondContact N-O 3.39Å; L713-I757 HydrophobicContact CD1-CD1 3.72Å; F733-I757 HydrophobicContact CE1-CD1 4.32Å; I757-V805 WeakPolarHBondContact CA-O 3.32Å; I757-L807 HydrophobicContact CG2-CB 3.8Å; I757-L807 HydrophobicContact CG2-CD2 3.86Å; I757-T868 HydrophobicContact CD1-CG2 3.56Å; I757-T868 HydrophobicContact CG1-CG2 3.81Å; I757-T868 HydrophobicContact CG2-CG2 4.46Å; I757-I872 HydrophobicContact CD1-CD1 4.13Å; I757-I872 HydrophobicContact CG1-CD1 3.4Å; I757-I872 VanDerWaalsContact CG1-CD1 3.4Å
758	V	95.7	Very high	90.3	Very high	1 Å²	1	34 Å²	34	1%	0.006	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	107.3	171.8	-174.8	0	0	0	0	107.9	V756 A769 F772 I773 L804 V805 M806 L807	V756-V758 HydrophobicContact CG2-CG2 4.46Å; V758-A769 HydrophobicContact CG1-CB 3.57Å; V758-F772 HydrophobicContact CG1-CD1 4.39Å; V758-F772 HydrophobicContact CG2-CD1 3.92Å; V758-F772 HydrophobicContact CG2-CE1 3.85Å; V758-I773 HydrophobicContact CG1-CD1 4.3Å; V758-I773 HydrophobicContact CG2-CD1 4.42Å; V758-L804 HydrophobicContact CG2-CD1 4.15Å; V758-L804 HydrophobicContact CG2-CD2 4.28Å; V758-L804 HydrophobicContact CG2-CG 4.22Å; V758-V805 PolarHBondContact N-O 2.97Å; V758-M806 WeakPolarHBondContact O-CA 3.36Å; V758-L807 PolarHBondContact O-N 3Å
759	A	95.5	Very high	90.6	Very high	0 Å²	0	34 Å²	34	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	138.7	-170.5	0	0	0	0	0	112.7	V700 L705 V709 L807	V700-A759 PolarHBondContact O-N 2.87Å; L705-A759 HydrophobicContact CD2-CB 4.37Å; V709-A759 HydrophobicContact CG1-CB 4.47Å; V709-A759 HydrophobicContact CG2-CB 4.21Å; A759-L807 WeakPolarHBondContact CA-O 3.45Å
760	Y	94.9	Very high	91	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	150.4	172.7	75.4	-73.9	0	0	0	111.9	L705 F766 M806 L807 Y808 A809 L821 G825 F836	L705-Y760 VanDerWaalsContact CD2-CA 3.48Å; Y760-F766 HydrophobicContact CD1-CD2 4.26Å; Y760-F766 HydrophobicContact CD2-CB 3.7Å; Y760-F766 AromaticContact CD2-CD2 3.58Å; Y760-F766 HydrophobicContact CD2-CD2 3.58Å; Y760-F766 HydrophobicContact CD2-CG 4.06Å; Y760-F766 HydrophobicContact CE1-CD2 4.34Å; Y760-F766 HydrophobicContact CE2-CB 4.36Å; Y760-F766 AromaticContact CE2-CD2 3.63Å; Y760-F766 HydrophobicContact CE2-CD2 3.63Å; Y760-F766 HydrophobicContact CE2-CE2 4.34Å; Y760-F766 HydrophobicContact CE2-CG 4.3Å; Y760-F766 HydrophobicContact CG-CB 4.24Å; Y760-F766 AromaticContact CG-CD2 3.9Å; Y760-F766 HydrophobicContact CG-CD2 3.9Å; Y760-M806 HydrophobicContact CD1-CE 3.9Å; Y760-M806 HydrophobicContact CD1-CG 4.34Å; Y760-M806 HydrophobicContact CE1-CE 4Å; Y760-M806 HydrophobicContact CE1-CG 4.09Å; Y760-L807 WeakPolarHBondContact CD1-O 3.44Å; Y760-L807 PolarHBondContact N-O 2.89Å; Y760-Y808 AromaticContact CD2-CD2 3.9Å; Y760-Y808 HydrophobicContact CD2-CD2 3.9Å; Y760-Y808 HydrophobicContact CD2-CE2 4.41Å; Y760-Y808 HydrophobicContact CE1-CD2 4.22Å; Y760-Y808 AromaticContact CE2-CD2 3.44Å; Y760-Y808 HydrophobicContact CE2-CD2 3.44Å; Y760-Y808 VanDerWaalsContact CE2-CD2 3.44Å; Y760-Y808 HydrophobicContact CE2-CE2 4.07Å; Y760-Y808 HydrophobicContact CE2-CG 4.35Å; Y760-Y808 HydrophobicContact CG-CD2 4.49Å; Y760-Y808 AromaticContact CZ-CD2 3.58Å; Y760-Y808 WeakPolarHBondContact O-CD2 3.37Å; Y760-A809 PolarHBondContact O-N 3.2Å; Y760-L821 HydrophobicContact CD2-CD2 4.48Å; Y760-L821 HydrophobicContact CE2-CB 4.09Å; Y760-L821 HydrophobicContact CE2-CD2 4.32Å; Y760-L821 WeakPolarHBondContact CE2-O 3.41Å; Y760-L821 PolarHBondContact OH-O 3.28Å; Y760-G825 VanDerWaalsContact OH-CA 3.3Å; Y760-G825 WeakPolarHBondContact OH-CA 3.3Å; Y760-F836 HydrophobicContact CE1-CE2 4.19Å; Y760-F836 WeakPolarHBondContact OH-CE2 3.45Å
761	S	92.5	Very high	90.9	Very high	9 Å²	9	31.4 Å²	31.4	6%	0.063	15%	0.148	C	C	.	.	S	Bend	trans	-132.5	-16.8	-179.3	63.8	0	0	0	0	114.1	S765 A809 L821	S761-S765 PolarHBondContact N-OG 2.63Å; S761-A809 VanDerWaalsContact CA-O 3.23Å; S761-A809 WeakPolarHBondContact CA-O 3.45Å; S761-A809 WeakPolarHBondContact CB-O 3.17Å; S761-L821 WeakPolarHBondContact O-CD1 3.21Å
762	S	91.3	Very high	90.9	Very high	13 Å²	13	29.1 Å²	29.1	9%	0.091	14%	0.139	C	C	.	.	S	Bend	trans	-143	169.5	-170.9	68.5	0	0	0	0	110.8	Q764 S765 F766 H814	S762-Q764 PolarHBondContact O-N 3.05Å; S762-S765 PolarHBondContact N-OG 3.21Å; S762-S765 PolarHBondContact O-N 2.9Å; S762-S765 PolarHBondContact O-OG 3.41Å; S762-S765 PolarHBondContact OG-N 3.1Å; S762-S765 PolarHBondContact OG-OG 3.1Å; S762-F766 WeakPolarHBondContact O-CB 3.38Å; S762-F766 PolarHBondContact O-N 2.84Å; S762-H814 WeakPolarHBondContact CB-NE2 3.3Å
763	R	90.6	Very high	90.8	Very high	126 Å²	126	25 Å²	25	48%	0.475	12%	0.12	S	C	.	.	H	α-helix	trans	-61.5	-35.2	177.6	-61	-177.7	-174.9	-140.5	-1.4	112.2	S767 D817 Y820 L821	R763-S767 PolarHBondContact O-N 3.26Å; R763-S767 VanDerWaalsContact O-N 3.13Å; R763-D817 IonicContact CZ-OD1 3.92Å; R763-D817 VanDerWaalsContact CZ-OD1 3.3Å; R763-D817 IonicContact CZ-OD2 2.64Å; R763-D817 VanDerWaalsContact NE-CG 3.28Å; R763-D817 IonicContact NE-OD1 3.5Å; R763-D817 PolarHBondContact NE-OD1 3.46Å; R763-D817 VanDerWaalsContact NE-OD1 3.11Å; R763-D817 IonicContact NE-OD2 2.82Å; R763-D817 PolarHBondContact NE-OD2 3.22Å; R763-D817 IonicContact NH2-OD1 2.89Å; R763-D817 PolarHBondContact NH2-OD1 3.35Å; R763-D817 IonicContact NH2-OD2 3.94Å; R763-Y820 HydrophobicContact CG-CE1 4.32Å; R763-L821 HydrophobicContact CG-CD2 4.08Å
764	Q	89.3	Confident	90.2	Very high	134 Å²	134	25.7 Å²	25.7	63%	0.626	12%	0.123	S	C	*	.	H	α-helix	trans	-70.4	-47.9	178.8	-67.5	78.5	-1.6	0	0	111.3	S762 F766 S767 C768	S762-Q764 PolarHBondContact O-N 3.05Å; Q764-F766 VanDerWaalsContact C-N 3.28Å; Q764-F766 PolarHBondContact O-N 3.39Å; Q764-S767 WeakPolarHBondContact O-CB 3.26Å; Q764-S767 PolarHBondContact O-N 2.75Å; Q764-S767 VanDerWaalsContact O-N 3.15Å; Q764-C768 PolarHBondContact O-N 3.46Å; Q764-C768 VanDerWaalsContact O-N 3.09Å
765	S	92.5	Very high	89.4	Confident	4 Å²	4	30 Å²	30	3%	0.028	14%	0.143	C	C	.	.	H	α-helix	trans	-67.8	-28.7	176.2	52.1	0	0	0	0	112.4	S761 S762 C768 A769	S761-S765 PolarHBondContact N-OG 2.63Å; S762-S765 PolarHBondContact N-OG 3.21Å; S762-S765 PolarHBondContact O-N 2.9Å; S762-S765 PolarHBondContact O-OG 3.41Å; S762-S765 PolarHBondContact OG-N 3.1Å; S762-S765 PolarHBondContact OG-OG 3.1Å; S765-C768 WeakPolarHBondContact O-CB 3.38Å; S765-C768 PolarHBondContact O-N 3.38Å; S765-A769 WeakPolarHBondContact O-CB 3.08Å; S765-A769 PolarHBondContact O-N 2.82Å
766	F	93.4	Very high	88.9	Confident	19 Å²	19	31.1 Å²	31.1	8%	0.083	15%	0.149	C	C	.	.	H	α-helix	trans	-66.5	-36.6	170.2	-174.4	-109.6	0	0	0	112.7	Y760 S762 Q764 A769 R770 M806 L821 Q824 F828	Y760-F766 HydrophobicContact CD1-CD2 4.26Å; Y760-F766 HydrophobicContact CD2-CB 3.7Å; Y760-F766 AromaticContact CD2-CD2 3.58Å; Y760-F766 HydrophobicContact CD2-CD2 3.58Å; Y760-F766 HydrophobicContact CD2-CG 4.06Å; Y760-F766 HydrophobicContact CE1-CD2 4.34Å; Y760-F766 HydrophobicContact CE2-CB 4.36Å; Y760-F766 AromaticContact CE2-CD2 3.63Å; Y760-F766 HydrophobicContact CE2-CD2 3.63Å; Y760-F766 HydrophobicContact CE2-CE2 4.34Å; Y760-F766 HydrophobicContact CE2-CG 4.3Å; Y760-F766 HydrophobicContact CG-CB 4.24Å; Y760-F766 AromaticContact CG-CD2 3.9Å; Y760-F766 HydrophobicContact CG-CD2 3.9Å; S762-F766 WeakPolarHBondContact O-CB 3.38Å; S762-F766 PolarHBondContact O-N 2.84Å; Q764-F766 VanDerWaalsContact C-N 3.28Å; Q764-F766 PolarHBondContact O-N 3.39Å; F766-A769 PolarHBondContact O-N 3.28Å; F766-R770 HydrophobicContact CE1-CG 4.25Å; F766-R770 HydrophobicContact CZ-CG 4.33Å; F766-R770 WeakPolarHBondContact O-CG 3.25Å; F766-R770 PolarHBondContact O-N 3.12Å; F766-R770 VanDerWaalsContact O-N 3.08Å; F766-M806 HydrophobicContact CD2-CE 3.82Å; F766-M806 HydrophobicContact CE2-CE 3.54Å; F766-L821 HydrophobicContact CB-CD2 4.4Å; F766-Q824 HydrophobicContact CE1-CB 3.91Å; F766-Q824 HydrophobicContact CE2-CB 4.43Å; F766-Q824 HydrophobicContact CZ-CB 3.81Å; F766-F828 HydrophobicContact CE2-CD1 4.41Å; F766-F828 HydrophobicContact CZ-CB 4.13Å; F766-F828 HydrophobicContact CZ-CD1 4.38Å; F766-F828 HydrophobicContact CZ-CG 4.41Å
767	S	89	Confident	88	Confident	50 Å²	50	31.4 Å²	31.4	35%	0.35	15%	0.151	S	C	.	.	H	α-helix	trans	-62.5	-51	171.9	-160.6	0	0	0	0	110.5	R763 Q764 A769 R770 D771	R763-S767 PolarHBondContact O-N 3.26Å; R763-S767 VanDerWaalsContact O-N 3.13Å; Q764-S767 WeakPolarHBondContact O-CB 3.26Å; Q764-S767 PolarHBondContact O-N 2.75Å; Q764-S767 VanDerWaalsContact O-N 3.15Å; S767-A769 VanDerWaalsContact C-N 3.27Å; S767-A769 PolarHBondContact O-N 2.97Å; S767-R770 CarbonylContact O-C 3.59Å; S767-R770 WeakPolarHBondContact O-CA 3.44Å; S767-R770 WeakPolarHBondContact O-CB 3.22Å; S767-R770 PolarHBondContact O-N 2.76Å; S767-D771 PolarHBondContact O-N 3.11Å
768	C	89.9	Confident	86.6	Confident	15 Å²	15	31.7 Å²	31.7	10%	0.101	15%	0.152	C	C	.	.	H	α-helix	trans	-52.8	-42	175.4	169.8	0	0	0	0	112.8	F741 Q764 S765 D771 F772	F741-C768 WeakPolarHBondContact CZ-SG 3.39Å; Q764-C768 PolarHBondContact O-N 3.46Å; Q764-C768 VanDerWaalsContact O-N 3.09Å; S765-C768 WeakPolarHBondContact O-CB 3.38Å; S765-C768 PolarHBondContact O-N 3.38Å; C768-D771 PolarHBondContact O-N 2.91Å; C768-F772 PolarHBondContact O-N 3.14Å
769	A	90.3	Very high	85	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-63.9	-37.7	174	0	0	0	0	0	113.8	V758 S765 F766 S767 I773 M806	V758-A769 HydrophobicContact CG1-CB 3.57Å; S765-A769 WeakPolarHBondContact O-CB 3.08Å; S765-A769 PolarHBondContact O-N 2.82Å; F766-A769 PolarHBondContact O-N 3.28Å; S767-A769 VanDerWaalsContact C-N 3.27Å; S767-A769 PolarHBondContact O-N 2.97Å; A769-I773 PolarHBondContact O-N 2.78Å; A769-M806 HydrophobicContact CB-CE 3.97Å
770	R	88.5	Confident	82.8	Confident	83 Å²	83	36.4 Å²	36.4	31%	0.313	18%	0.178	S	C	.	.	H	α-helix	trans	-68.7	-43.1	173.1	-70.4	178.7	66.2	-142.4	-0.8	111.4	F766 S767 F772 I773 F774 F828	F766-R770 HydrophobicContact CE1-CG 4.25Å; F766-R770 HydrophobicContact CZ-CG 4.33Å; F766-R770 WeakPolarHBondContact O-CG 3.25Å; F766-R770 PolarHBondContact O-N 3.12Å; F766-R770 VanDerWaalsContact O-N 3.08Å; S767-R770 CarbonylContact O-C 3.59Å; S767-R770 WeakPolarHBondContact O-CA 3.44Å; S767-R770 WeakPolarHBondContact O-CB 3.22Å; S767-R770 PolarHBondContact O-N 2.76Å; R770-F772 VanDerWaalsContact C-N 3.33Å; R770-F772 PolarHBondContact O-N 2.96Å; R770-I773 PolarHBondContact O-N 2.98Å; R770-I773 VanDerWaalsContact O-N 3.17Å; R770-F774 HydrophobicContact CB-CD2 4.3Å; R770-F774 HydrophobicContact CB-CE2 4.2Å; R770-F774 VanDerWaalsContact O-CD2 3.3Å; R770-F774 WeakPolarHBondContact O-CD2 3.19Å; R770-F774 PolarHBondContact O-N 2.97Å; R770-F828 HydrophobicContact CB-CE1 4.35Å; R770-F828 HydrophobicContact CB-CZ 4.27Å; R770-F828 HydrophobicContact CG-CD1 4.12Å; R770-F828 HydrophobicContact CG-CE1 3.64Å; R770-F828 HydrophobicContact CG-CE2 4.36Å; R770-F828 HydrophobicContact CG-CZ 3.78Å
771	D	85.2	Confident	80.2	Confident	71 Å²	71	40.9 Å²	40.9	38%	0.38	20%	0.202	S	C	.	.	H	α-helix	trans	-63.2	-41.2	-178.7	-57.9	-26.6	0	0	0	110.5	S767 C768 H775	S767-D771 PolarHBondContact O-N 3.11Å; C768-D771 PolarHBondContact O-N 2.91Å; D771-H775 WeakPolarHBondContact O-CB 3.07Å; D771-H775 PolarHBondContact O-N 3.06Å
772	F	89.3	Confident	77.4	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.225	C	C	.	.	I	π-helix	trans	-56.6	-52.8	169.4	173.6	-112	0	0	0	112.3	V700 F741 F744 V758 C768 R770 F774 T776 L777	V700-F772 HydrophobicContact CB-CE1 4.36Å; V700-F772 HydrophobicContact CB-CZ 4.5Å; V700-F772 HydrophobicContact CG1-CB 4.36Å; V700-F772 HydrophobicContact CG1-CD1 3.74Å; V700-F772 HydrophobicContact CG1-CD2 3.63Å; V700-F772 HydrophobicContact CG1-CE1 3.91Å; V700-F772 HydrophobicContact CG1-CE2 3.8Å; V700-F772 HydrophobicContact CG1-CG 3.61Å; V700-F772 HydrophobicContact CG1-CZ 3.95Å; V700-F772 HydrophobicContact CG2-CE1 4.46Å; V700-F772 HydrophobicContact CG2-CZ 4.21Å; F741-F772 HydrophobicContact CB-CD2 4.48Å; F741-F772 HydrophobicContact CD1-CD2 4.05Å; F741-F772 HydrophobicContact CD2-CB 3.92Å; F741-F772 HydrophobicContact CD2-CD2 4.22Å; F741-F772 HydrophobicContact CE1-CD2 4.31Å; F741-F772 HydrophobicContact CE2-CB 3.58Å; F741-F772 HydrophobicContact CE2-CD2 4.48Å; F741-F772 HydrophobicContact CE2-CG 4.43Å; F741-F772 AromaticContact CG-CD2 4Å; F741-F772 HydrophobicContact CG-CD2 4Å; F741-F772 HydrophobicContact CZ-CB 3.89Å; F741-F772 HydrophobicContact CZ-CD2 4.5Å; F741-F772 HydrophobicContact CZ-CG 4.42Å; F744-F772 HydrophobicContact CB-CE2 4.16Å; F744-F772 AromaticContact CD1-CE2 4Å; F744-F772 HydrophobicContact CD1-CE2 4Å; F744-F772 HydrophobicContact CD1-CZ 4.11Å; F744-F772 AromaticContact CD2-CE2 3.63Å; F744-F772 HydrophobicContact CD2-CE2 3.63Å; F744-F772 AromaticContact CD2-CZ 3.75Å; F744-F772 HydrophobicContact CD2-CZ 3.75Å; F744-F772 HydrophobicContact CE1-CE2 4.33Å; F744-F772 AromaticContact CE1-CZ 3.97Å; F744-F772 HydrophobicContact CE1-CZ 3.97Å; F744-F772 HydrophobicContact CE2-CE2 4.01Å; F744-F772 AromaticContact CE2-CZ 3.6Å; F744-F772 HydrophobicContact CE2-CZ 3.6Å; F744-F772 AromaticContact CG-CE2 3.64Å; F744-F772 HydrophobicContact CG-CE2 3.64Å; F744-F772 HydrophobicContact CG-CZ 4.02Å; F744-F772 HydrophobicContact CZ-CE2 4.35Å; F744-F772 AromaticContact CZ-CZ 3.72Å; F744-F772 HydrophobicContact CZ-CZ 3.72Å; V758-F772 HydrophobicContact CG1-CD1 4.39Å; V758-F772 HydrophobicContact CG2-CD1 3.92Å; V758-F772 HydrophobicContact CG2-CE1 3.85Å; C768-F772 PolarHBondContact O-N 3.14Å; R770-F772 VanDerWaalsContact C-N 3.33Å; R770-F772 PolarHBondContact O-N 2.96Å; F772-F774 PolarHBondContact O-N 2.93Å; F772-T776 HydrophobicContact CD2-CG2 3.93Å; F772-T776 HydrophobicContact CE2-CG2 3.73Å; F772-T776 WeakPolarHBondContact O-CA 3.27Å; F772-T776 WeakPolarHBondContact O-CB 3.31Å; F772-T776 PolarHBondContact O-N 2.79Å; F772-L777 PolarHBondContact O-N 2.96Å
773	I	83.2	Confident	74.7	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	24%	0.238	C	C	.	.	I	π-helix	trans	-63.7	-43.9	-176	-75.9	163.8	0	0	0	111.2	V758 A769 R770 L777 M778 L799 F828 L832	V758-I773 HydrophobicContact CG1-CD1 4.3Å; V758-I773 HydrophobicContact CG2-CD1 4.42Å; A769-I773 PolarHBondContact O-N 2.78Å; R770-I773 PolarHBondContact O-N 2.98Å; R770-I773 VanDerWaalsContact O-N 3.17Å; I773-L777 WeakPolarHBondContact O-CB 3.37Å; I773-M778 HydrophobicContact CG2-CG 4.44Å; I773-M778 HydrophobicContact CG2-SD 3.83Å; I773-M778 VanDerWaalsContact O-CB 3.29Å; I773-M778 WeakPolarHBondContact O-CB 3.46Å; I773-M778 VanDerWaalsContact O-CG 3.27Å; I773-M778 WeakPolarHBondContact O-CG 3.39Å; I773-M778 PolarHBondContact O-N 3.45Å; I773-L799 HydrophobicContact CG2-CD1 4.14Å; I773-F828 HydrophobicContact CB-CZ 4.44Å; I773-F828 HydrophobicContact CD1-CE1 3.79Å; I773-F828 HydrophobicContact CD1-CZ 4.45Å; I773-F828 HydrophobicContact CG2-CZ 4.2Å; I773-L832 HydrophobicContact CD1-CD1 3.95Å; I773-L832 HydrophobicContact CG2-CD1 3.89Å; I773-L832 HydrophobicContact CG2-CD2 4.14Å
774	F	75	Confident	72.1	Confident	14 Å²	14	44 Å²	44	6%	0.061	23%	0.231	C	C	.	.	I	π-helix	trans	-76.5	-54.3	-178.4	-64	-43.3	0	0	0	113.3	R770 F772 M778 D779 V780 M791 I794 F828	R770-F774 HydrophobicContact CB-CD2 4.3Å; R770-F774 HydrophobicContact CB-CE2 4.2Å; R770-F774 VanDerWaalsContact O-CD2 3.3Å; R770-F774 WeakPolarHBondContact O-CD2 3.19Å; R770-F774 PolarHBondContact O-N 2.97Å; F772-F774 PolarHBondContact O-N 2.93Å; F774-M778 HydrophobicContact CD1-SD 4.32Å; F774-D779 PolarHBondContact O-N 3.16Å; F774-V780 HydrophobicContact CB-CB 4.1Å; F774-V780 HydrophobicContact CB-CG2 3.95Å; F774-V780 HydrophobicContact CD1-CG2 4.06Å; F774-V780 HydrophobicContact CG-CG2 4.42Å; F774-V780 WeakPolarHBondContact O-CB 3.34Å; F774-V780 VanDerWaalsContact O-CG2 3.3Å; F774-V780 WeakPolarHBondContact O-CG2 3.42Å; F774-V780 PolarHBondContact O-N 3.36Å; F774-M791 HydrophobicContact CZ-SD 4.4Å; F774-I794 HydrophobicContact CD1-CD1 4.13Å; F774-I794 HydrophobicContact CE1-CD1 3.51Å; F774-I794 HydrophobicContact CZ-CD1 4.4Å; F774-F828 HydrophobicContact CE1-CE2 4.01Å; F774-F828 HydrophobicContact CE1-CZ 4.13Å; F774-F828 HydrophobicContact CE2-CE2 4.15Å; F774-F828 HydrophobicContact CE2-CZ 4.14Å; F774-F828 AromaticContact CZ-CE2 3.5Å; F774-F828 HydrophobicContact CZ-CE2 3.5Å; F774-F828 VanDerWaalsContact CZ-CE2 3.5Å; F774-F828 AromaticContact CZ-CZ 3.79Å; F774-F828 HydrophobicContact CZ-CZ 3.79Å
775	H	72.9	Confident	69.5	Low	92 Å²	92	42.3 Å²	42.3	43%	0.426	23%	0.234	S	C	.	.	I	π-helix	trans	-86.5	-23.3	-171.3	-64.3	-80.9	0	0	0	113.5	D771 D781	D771-H775 WeakPolarHBondContact O-CB 3.07Å; D771-H775 PolarHBondContact O-N 3.06Å; H775-D781 IonicContact CE1-OD1 2.92Å; H775-D781 PolarHBondContact CE1-OD1 3.07Å; H775-D781 IonicContact CE1-OD2 2.65Å; H775-D781 IonicContact CG-OD2 3.13Å; H775-D781 VanDerWaalsContact ND1-CG 3.33Å; H775-D781 IonicContact ND1-OD1 2.71Å; H775-D781 PolarHBondContact ND1-OD1 3.22Å; H775-D781 IonicContact ND1-OD2 3.82Å; H775-D781 PolarHBondContact ND1-OD2 3.17Å
776	T	78.7	Confident	66.8	Low	22 Å²	22	47.3 Å²	47.3	14%	0.135	26%	0.264	C	S	.	.	I	π-helix	trans	-105.4	-48.1	-178.9	-49.2	0	0	0	0	113	F741 F744 F745 F772	F741-T776 HydrophobicContact CB-CG2 4.43Å; F741-T776 WeakPolarHBondContact O-CG2 3.43Å; F744-T776 HydrophobicContact CB-CG2 3.6Å; F744-T776 HydrophobicContact CD1-CG2 4.12Å; F744-T776 HydrophobicContact CG-CG2 4.11Å; F745-T776 WeakPolarHBondContact CE2-O 3.39Å; F745-T776 VanDerWaalsContact CZ-O 3.31Å; F745-T776 WeakPolarHBondContact CZ-O 3.46Å; F772-T776 HydrophobicContact CD2-CG2 3.93Å; F772-T776 HydrophobicContact CE2-CG2 3.73Å; F772-T776 WeakPolarHBondContact O-CA 3.27Å; F772-T776 WeakPolarHBondContact O-CB 3.31Å; F772-T776 PolarHBondContact O-N 2.79Å
777	L	74.9	Confident	64	Low	6 Å²	6	49.8 Å²	49.8	3%	0.031	30%	0.296	C	S	.	.	I	π-helix	trans	-84.9	-35	-174.1	-174.4	65.1	0	0	0	113.3	I686 F744 F772 I773 L799 L804	I686-L777 HydrophobicContact CD1-CD1 3.43Å; I686-L777 VanDerWaalsContact CD1-CD1 3.43Å; F744-L777 HydrophobicContact CE1-CD1 4.18Å; F772-L777 PolarHBondContact O-N 2.96Å; I773-L777 WeakPolarHBondContact O-CB 3.37Å; L777-L799 HydrophobicContact CD2-CD1 3.93Å; L777-L799 HydrophobicContact CD2-CD2 3.99Å; L777-L799 HydrophobicContact CG-CD2 4.22Å; L777-L804 HydrophobicContact CD2-CD1 3.43Å; L777-L804 VanDerWaalsContact CD2-CD1 3.43Å
778	M	67.3	Low	61.3	Low	6 Å²	6	54 Å²	54	3%	0.03	31%	0.31	C	S	.	.	S	Bend	trans	-107	-8	-175	-68.8	179.3	60.1	0	0	114.7	I773 F774 V780 I794 A798 L799 L832	I773-M778 HydrophobicContact CG2-CG 4.44Å; I773-M778 HydrophobicContact CG2-SD 3.83Å; I773-M778 VanDerWaalsContact O-CB 3.29Å; I773-M778 WeakPolarHBondContact O-CB 3.46Å; I773-M778 VanDerWaalsContact O-CG 3.27Å; I773-M778 WeakPolarHBondContact O-CG 3.39Å; I773-M778 PolarHBondContact O-N 3.45Å; F774-M778 HydrophobicContact CD1-SD 4.32Å; M778-V780 VanDerWaalsContact C-N 3.33Å; M778-V780 HydrophobicContact CB-CG2 3.76Å; M778-V780 HydrophobicContact CE-CG2 4.35Å; M778-V780 PolarHBondContact O-N 3.34Å; M778-I794 HydrophobicContact CE-CB 4.35Å; M778-I794 HydrophobicContact CE-CD1 3.94Å; M778-I794 HydrophobicContact CE-CG1 3.86Å; M778-I794 HydrophobicContact CE-CG2 3.65Å; M778-A798 HydrophobicContact CE-CB 4.44Å; M778-L799 HydrophobicContact CG-CD2 3.94Å; M778-L799 HydrophobicContact CG-CG 4.5Å; M778-L799 HydrophobicContact SD-CD1 4.29Å; M778-L799 HydrophobicContact SD-CD2 4.44Å; M778-L799 HydrophobicContact SD-CG 4.38Å; M778-L832 HydrophobicContact SD-CD2 4.05Å
779	D	60.1	Low	58.7	Low	90 Å²	90	55.4 Å²	55.4	48%	0.481	33%	0.327	S	S	.	.			trans	48.9	50.6	-176.3	-159	-0	0	0	0	112.7	F774 D781 V782	F774-D779 PolarHBondContact O-N 3.16Å; D779-D781 PolarHBondContact O-N 3.01Å; D779-D781 VanDerWaalsContact O-N 3.16Å; D779-V782 WeakPolarHBondContact O-CB 3.41Å; D779-V782 PolarHBondContact O-N 3.33Å; D779-V782 WeakPolarHBondContact OD2-CG2 3.22Å
780	V	49.4	Very low	56.3	Low	11 Å²	11	59.8 Å²	59.8	7%	0.067	36%	0.355	C	S	.	.	H	α-helix	trans	-67	-15.1	-173.6	171.2	0	0	0	0	112.8	F774 M778 V782 L783 T784	F774-V780 HydrophobicContact CB-CB 4.1Å; F774-V780 HydrophobicContact CB-CG2 3.95Å; F774-V780 HydrophobicContact CD1-CG2 4.06Å; F774-V780 HydrophobicContact CG-CG2 4.42Å; F774-V780 WeakPolarHBondContact O-CB 3.34Å; F774-V780 VanDerWaalsContact O-CG2 3.3Å; F774-V780 WeakPolarHBondContact O-CG2 3.42Å; F774-V780 PolarHBondContact O-N 3.36Å; M778-V780 VanDerWaalsContact C-N 3.33Å; M778-V780 HydrophobicContact CB-CG2 3.76Å; M778-V780 HydrophobicContact CE-CG2 4.35Å; M778-V780 PolarHBondContact O-N 3.34Å; V780-V782 PolarHBondContact O-N 2.96Å; V780-L783 HydrophobicContact CG2-CD1 4.19Å; V780-L783 PolarHBondContact O-N 3.28Å; V780-T784 HydrophobicContact CG1-CG2 3.67Å; V780-T784 WeakPolarHBondContact O-CB 3.46Å; V780-T784 WeakPolarHBondContact O-CG2 3.34Å; V780-T784 PolarHBondContact O-N 3.48Å; V780-T784 PolarHBondContact O-OG1 2.88Å
781	D	41.6	Very low	53.9	Low	94 Å²	94	61.7 Å²	61.7	50%	0.503	37%	0.369	S	S	.	.	H	α-helix	trans	-66.6	-26.7	169.1	-65.7	-46.4	0	0	0	111.7	H775 D779	H775-D781 IonicContact CE1-OD1 2.92Å; H775-D781 PolarHBondContact CE1-OD1 3.07Å; H775-D781 IonicContact CE1-OD2 2.65Å; H775-D781 IonicContact CG-OD2 3.13Å; H775-D781 VanDerWaalsContact ND1-CG 3.33Å; H775-D781 IonicContact ND1-OD1 2.71Å; H775-D781 PolarHBondContact ND1-OD1 3.22Å; H775-D781 IonicContact ND1-OD2 3.82Å; H775-D781 PolarHBondContact ND1-OD2 3.17Å; D779-D781 PolarHBondContact O-N 3.01Å; D779-D781 VanDerWaalsContact O-N 3.16Å
782	V	34	Very low	51.7	Low	89 Å²	89	65 Å²	65	54%	0.539	39%	0.387	S	S	.	.	H	α-helix	trans	-73.9	-41.1	168.2	176.2	0	0	0	0	111.2	D779 V780 S785	D779-V782 WeakPolarHBondContact O-CB 3.41Å; D779-V782 PolarHBondContact O-N 3.33Å; D779-V782 WeakPolarHBondContact OD2-CG2 3.22Å; V780-V782 PolarHBondContact O-N 2.96Å; V782-S785 PolarHBondContact O-OG 2.82Å
783	L	32.9	Very low	49.3	Very low	70 Å²	70	67.3 Å²	67.3	37%	0.366	41%	0.411	S	S	.	.	H	α-helix	trans	-71.6	-35.6	-178.9	-69.6	167.1	0	0	0	113.5	V780 S785 T786	V780-L783 HydrophobicContact CG2-CD1 4.19Å; V780-L783 PolarHBondContact O-N 3.28Å; L783-S785 VanDerWaalsContact C-N 3.27Å; L783-S785 PolarHBondContact O-N 2.96Å; L783-T786 PolarHBondContact O-N 2.88Å; L783-T786 PolarHBondContact O-OG1 3.11Å
784	T	37.3	Very low	47.4	Very low	53 Å²	53	69.4 Å²	69.4	33%	0.325	42%	0.421	S	S	.	.	G	3₁₀ helix	trans	-77.6	-8.7	-178	51	0	0	0	0	114.1	V780 T786 G787	V780-T784 HydrophobicContact CG1-CG2 3.67Å; V780-T784 WeakPolarHBondContact O-CB 3.46Å; V780-T784 WeakPolarHBondContact O-CG2 3.34Å; V780-T784 PolarHBondContact O-N 3.48Å; V780-T784 PolarHBondContact O-OG1 2.88Å; T784-T786 PolarHBondContact O-N 3.27Å; T784-G787 PolarHBondContact O-N 3.46Å
785	S	35	Very low	45.8	Very low	100 Å²	100	72.7 Å²	72.7	70%	0.699	44%	0.444	S	S	*	.	G	3₁₀ helix	trans	-58.4	-14.8	168	70.2	0	0	0	0	113.9	V782 L783	V782-S785 PolarHBondContact O-OG 2.82Å; L783-S785 VanDerWaalsContact C-N 3.27Å; L783-S785 PolarHBondContact O-N 2.96Å
786	T	35.2	Very low	44.4	Very low	108 Å²	108	72.7 Å²	72.7	66%	0.663	46%	0.46	S	S	*	.	G	3₁₀ helix	trans	-86.7	-1.6	180	61	0	0	0	0	115	L783 T784 E788	L783-T786 PolarHBondContact O-N 2.88Å; L783-T786 PolarHBondContact O-OG1 3.11Å; T784-T786 PolarHBondContact O-N 3.27Å; T786-E788 PolarHBondContact O-N 3.46Å
787	G	33.5	Very low	42.9	Very low	72 Å²	72	72.4 Å²	72.4	74%	0.742	46%	0.462	S	S	*	.	S	Bend	trans	81.6	3.1	168.4	0	0	0	0	0	116.6	T784	T784-G787 PolarHBondContact O-N 3.46Å
788	E	32.5	Very low	41.4	Very low	138 Å²	138	73.5 Å²	73.5	65%	0.645	47%	0.472	S	S	*	.	S	Bend	trans	-101.9	144.4	172.8	-62.7	-165.2	166.2	0	0	111.9	T786	T786-E788 PolarHBondContact O-N 3.46Å
789	G	35.4	Very low	41	Very low	44 Å²	44	73.3 Å²	73.3	45%	0.454	47%	0.47	S	S	.	.			trans	-65.5	158.2	-164.4	0	0	0	0	0	115.7	M791 N792	G789-M791 PolarHBondContact O-N 2.74Å; G789-N792 PolarHBondContact O-N 2.74Å; G789-N792 VanDerWaalsContact O-N 3.17Å
790	P	40.8	Very low	40.6	Very low	93 Å²	93	76.8 Å²	76.8	60%	0.604	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	13.9	-160.2	28.6	-38.3	0	0	0	117.1
791	M	38.3	Very low	41	Very low	122 Å²	122	84.6 Å²	84.6	60%	0.601	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-129.8	-11.2	178.6	-71.6	-74.5	-70.5	0	0	114	F774 G789	F774-M791 HydrophobicContact CZ-SD 4.4Å; G789-M791 PolarHBondContact O-N 2.74Å
792	N	39.3	Very low	42.2	Very low	141 Å²	141	80.6 Å²	80.6	75%	0.754	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.2	-21.8	-174.2	-71	4.5	0	0	0	114	G789	G789-N792 PolarHBondContact O-N 2.74Å; G789-N792 VanDerWaalsContact O-N 3.17Å
793	G	37.3	Very low	44.5	Very low	48 Å²	48	76.3 Å²	76.3	50%	0.495	46%	0.458	S	S	.	.	S	Bend	trans	-87.7	5.4	-175.3	0	0	0	0	0	116.2	P795	G793-P795 WeakPolarHBondContact O-CD 3.2Å
794	I	43.4	Very low	47.2	Very low	44 Å²	44	73.2 Å²	73.2	23%	0.226	44%	0.442	C	S	.	.	S	Bend	trans	-88.1	120.9	-176.3	-65.4	172.7	0	0	0	110	F774 M778 A796 A798	F774-I794 HydrophobicContact CD1-CD1 4.13Å; F774-I794 HydrophobicContact CE1-CD1 3.51Å; F774-I794 HydrophobicContact CZ-CD1 4.4Å; M778-I794 HydrophobicContact CE-CB 4.35Å; M778-I794 HydrophobicContact CE-CD1 3.94Å; M778-I794 HydrophobicContact CE-CG1 3.86Å; M778-I794 HydrophobicContact CE-CG2 3.65Å; I794-A796 PolarHBondContact O-N 3Å; I794-A798 HydrophobicContact CG2-CB 4.46Å
795	P	41.7	Very low	49.8	Very low	84 Å²	84	70.8 Å²	70.8	55%	0.545	43%	0.426	S	S	.	.			trans	-60	125.1	173.5	-22.2	33.4	0	0	0	110.8	G793 G797 A798	G793-P795 WeakPolarHBondContact O-CD 3.2Å; P795-G797 PolarHBondContact O-N 2.76Å; P795-A798 HydrophobicContact CB-CB 4.46Å; P795-A798 WeakPolarHBondContact O-CB 3.4Å; P795-A798 PolarHBondContact O-N 3.2Å
796	A	43.3	Very low	52.6	Low	92 Å²	92	66 Å²	66	76%	0.76	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	111.3	-179.4	0	0	0	0	0	110.8	I794	I794-A796 PolarHBondContact O-N 3Å
797	G	47.3	Very low	55.5	Low	16 Å²	16	60.9 Å²	60.9	17%	0.165	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	88.7	24.4	-172.8	0	0	0	0	0	115.2	P795 L799 R800	P795-G797 PolarHBondContact O-N 2.76Å; G797-L799 PolarHBondContact O-N 2.98Å; G797-R800 WeakPolarHBondContact O-CB 3.46Å; G797-R800 PolarHBondContact O-N 3.42Å
798	A	44.7	Very low	58.4	Low	29 Å²	29	57.4 Å²	57.4	24%	0.24	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.1	-33.8	171.1	0	0	0	0	0	113.5	M778 I794 P795	M778-A798 HydrophobicContact CE-CB 4.44Å; I794-A798 HydrophobicContact CG2-CB 4.46Å; P795-A798 HydrophobicContact CB-CB 4.46Å; P795-A798 WeakPolarHBondContact O-CB 3.4Å; P795-A798 PolarHBondContact O-N 3.2Å
799	L	57.1	Low	61.2	Low	1 Å²	1	50.9 Å²	50.9	1%	0.005	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.8	9.7	176.1	-55	-176.6	0	0	0	113.5	Y684 I773 L777 M778 G797 R801 L802 L832 V834	Y684-L799 HydrophobicContact CE1-CD2 4.37Å; I773-L799 HydrophobicContact CG2-CD1 4.14Å; L777-L799 HydrophobicContact CD2-CD1 3.93Å; L777-L799 HydrophobicContact CD2-CD2 3.99Å; L777-L799 HydrophobicContact CG-CD2 4.22Å; M778-L799 HydrophobicContact CG-CD2 3.94Å; M778-L799 HydrophobicContact CG-CG 4.5Å; M778-L799 HydrophobicContact SD-CD1 4.29Å; M778-L799 HydrophobicContact SD-CD2 4.44Å; M778-L799 HydrophobicContact SD-CG 4.38Å; G797-L799 PolarHBondContact O-N 2.98Å; L799-R801 PolarHBondContact O-N 3.36Å; L799-L802 HydrophobicContact CB-CD1 3.99Å; L799-L802 HydrophobicContact CD2-CD1 3.53Å; L799-L802 HydrophobicContact CG-CD1 4.32Å; L799-L802 WeakPolarHBondContact O-CB 3.48Å; L799-L802 PolarHBondContact O-N 3.18Å; L799-L832 HydrophobicContact CD1-CB 4.3Å; L799-L832 HydrophobicContact CD1-CD1 4.32Å; L799-L832 HydrophobicContact CD1-CD2 3.97Å; L799-L832 HydrophobicContact CD1-CG 4.43Å; L799-V834 HydrophobicContact CB-CG1 3.76Å; L799-V834 HydrophobicContact CD1-CG1 4.23Å
800	R	52.5	Low	63.5	Low	164 Å²	164	49.3 Å²	49.3	62%	0.619	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	123.4	-173.3	-167.5	-174.9	-145.8	-160.1	4.1	110.6	G797	G797-R800 WeakPolarHBondContact O-CB 3.46Å; G797-R800 PolarHBondContact O-N 3.42Å
801	R	57.3	Low	65.6	Low	175 Å²	175	45.7 Å²	45.7	66%	0.66	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	82	-6.3	-175	-50.2	177.2	178.4	177.9	0.2	116.6	L799 S875 Q879	L799-R801 PolarHBondContact O-N 3.36Å; R801-S875 PolarHBondContact O-OG 3.36Å; R801-Q879 HydrophobicContact CB-CG 4.28Å; R801-Q879 WeakPolarHBondContact O-CG 3.03Å; R801-Q879 PolarHBondContact O-NE2 3.23Å; R801-Q879 VanDerWaalsContact O-NE2 3.15Å
802	L	68	Low	67.3	Low	9 Å²	9	43.2 Å²	43.2	5%	0.047	25%	0.245	C	C	.	.			trans	-58.5	142.8	171.2	-85	165.2	0	0	0	110.4	Y684 I686 F687 L799 L804 S875	Y684-L802 HydrophobicContact CD1-CD1 4.21Å; Y684-L802 WeakPolarHBondContact O-CD2 3.37Å; I686-L802 HydrophobicContact CD1-CD2 4.48Å; I686-L802 HydrophobicContact CG1-CD2 4.05Å; F687-L802 HydrophobicContact CD2-CD2 3.86Å; F687-L802 HydrophobicContact CE2-CD2 3.96Å; L799-L802 HydrophobicContact CB-CD1 3.99Å; L799-L802 HydrophobicContact CD2-CD1 3.53Å; L799-L802 HydrophobicContact CG-CD1 4.32Å; L799-L802 WeakPolarHBondContact O-CB 3.48Å; L799-L802 PolarHBondContact O-N 3.18Å; L802-L804 HydrophobicContact CB-CB 4.42Å; L802-L804 PolarHBondContact O-N 2.71Å; L802-S875 PolarHBondContact O-OG 2.75Å
803	P	82.4	Confident	69.2	Low	0 Å²	0	39.9 Å²	39.9	0%	0	24%	0.237	C	C	.	.	S	Bend	trans	-77.6	63.3	176.8	-8.1	29.3	0	0	0	110.1	F687 N754 G755 V756 I872 A876	F687-P803 HydrophobicContact CB-CG 4.49Å; F687-P803 HydrophobicContact CD2-CG 4.27Å; N754-P803 WeakPolarHBondContact O-CB 3.19Å; N754-P803 WeakPolarHBondContact O-CG 3.39Å; G755-P803 CarbonylContact C-O 3.55Å; G755-P803 VanDerWaalsContact CA-O 3.23Å; G755-P803 WeakPolarHBondContact CA-O 3.27Å; V756-P803 PolarHBondContact N-O 3.41Å; P803-I872 HydrophobicContact CB-CG2 4.28Å; P803-A876 HydrophobicContact CB-CB 4.22Å; P803-A876 HydrophobicContact CG-CB 4.13Å
804	L	88.7	Confident	71	Confident	5 Å²	5	40.4 Å²	40.4	3%	0.026	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	127.8	-177.6	-171.2	150.4	0	0	0	110.1	V756 V758 L777 L802 V834	V756-L804 HydrophobicContact CG1-CB 3.98Å; V756-L804 HydrophobicContact CG1-CD1 3.69Å; V756-L804 HydrophobicContact CG1-CG 3.69Å; V756-L804 WeakPolarHBondContact O-CA 3.15Å; V758-L804 HydrophobicContact CG2-CD1 4.15Å; V758-L804 HydrophobicContact CG2-CD2 4.28Å; V758-L804 HydrophobicContact CG2-CG 4.22Å; L777-L804 HydrophobicContact CD2-CD1 3.43Å; L777-L804 VanDerWaalsContact CD2-CD1 3.43Å; L802-L804 HydrophobicContact CB-CB 4.42Å; L802-L804 PolarHBondContact O-N 2.71Å; L804-V834 HydrophobicContact CB-CG1 4.42Å; L804-V834 HydrophobicContact CD2-CB 3.77Å; L804-V834 HydrophobicContact CD2-CG1 3.98Å; L804-V834 HydrophobicContact CD2-CG2 3.73Å
805	V	93	Very high	72.5	Confident	1 Å²	1	40.9 Å²	40.9	1%	0.006	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	131.8	171	174.1	0	0	0	0	109.4	V756 I757 V758 R835 V837 T868 I872	V756-V805 PolarHBondContact O-N 2.77Å; I757-V805 WeakPolarHBondContact CA-O 3.32Å; V758-V805 PolarHBondContact N-O 2.97Å; V805-R835 WeakPolarHBondContact CA-O 3.41Å; V805-R835 HydrophobicContact CG2-CB 4.25Å; V805-V837 HydrophobicContact CG1-CB 4.24Å; V805-V837 HydrophobicContact CG1-CG2 3.72Å; V805-T868 HydrophobicContact CB-CG2 4.48Å; V805-T868 HydrophobicContact CG1-CG2 4.07Å; V805-I872 HydrophobicContact CB-CD1 4.38Å; V805-I872 HydrophobicContact CB-CG1 4.28Å; V805-I872 HydrophobicContact CG2-CD1 4.15Å; V805-I872 HydrophobicContact CG2-CG1 3.53Å
806	M	93.6	Very high	74.4	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	114.5	168	-166.5	166.3	-161.7	0	0	109.1	V758 Y760 F766 A769 F828 A829 R835 F836 V837	V758-M806 WeakPolarHBondContact O-CA 3.36Å; Y760-M806 HydrophobicContact CD1-CE 3.9Å; Y760-M806 HydrophobicContact CD1-CG 4.34Å; Y760-M806 HydrophobicContact CE1-CE 4Å; Y760-M806 HydrophobicContact CE1-CG 4.09Å; F766-M806 HydrophobicContact CD2-CE 3.82Å; F766-M806 HydrophobicContact CE2-CE 3.54Å; A769-M806 HydrophobicContact CB-CE 3.97Å; M806-F828 HydrophobicContact CE-CD1 3.85Å; M806-F828 HydrophobicContact CE-CE1 4.37Å; M806-F828 HydrophobicContact SD-CD1 3.75Å; M806-A829 HydrophobicContact CB-CB 4.32Å; M806-R835 PolarHBondContact N-O 3.33Å; M806-F836 WeakPolarHBondContact O-CA 3.42Å; M806-F836 WeakPolarHBondContact O-CD2 3.33Å; M806-V837 PolarHBondContact O-N 3.46Å
807	L	95.7	Very high	76.3	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	119.7	-172.7	176.9	60.9	0	0	0	110.5	V709 I757 V758 A759 Y760 V837 L860 T868	V709-L807 HydrophobicContact CG1-CD2 3.87Å; I757-L807 HydrophobicContact CG2-CB 3.8Å; I757-L807 HydrophobicContact CG2-CD2 3.86Å; V758-L807 PolarHBondContact O-N 3Å; A759-L807 WeakPolarHBondContact CA-O 3.45Å; Y760-L807 WeakPolarHBondContact CD1-O 3.44Å; Y760-L807 PolarHBondContact N-O 2.89Å; L807-V837 HydrophobicContact CD1-CB 4.02Å; L807-V837 HydrophobicContact CD1-CG1 3.86Å; L807-L860 HydrophobicContact CD1-CD2 4.08Å; L807-L860 HydrophobicContact CD2-CD1 4.15Å; L807-L860 HydrophobicContact CD2-CD2 4.22Å; L807-L860 HydrophobicContact CG-CD2 4.37Å; L807-T868 HydrophobicContact CD2-CG2 4.5Å
808	Y	94.1	Very high	78	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	115.4	164.5	-178.2	-117.4	0	0	0	109.6	Y760 C810 V818 L821 Q822 V837 Q864	Y760-Y808 AromaticContact CD2-CD2 3.9Å; Y760-Y808 HydrophobicContact CD2-CD2 3.9Å; Y760-Y808 HydrophobicContact CD2-CE2 4.41Å; Y760-Y808 HydrophobicContact CE1-CD2 4.22Å; Y760-Y808 AromaticContact CE2-CD2 3.44Å; Y760-Y808 HydrophobicContact CE2-CD2 3.44Å; Y760-Y808 VanDerWaalsContact CE2-CD2 3.44Å; Y760-Y808 HydrophobicContact CE2-CE2 4.07Å; Y760-Y808 HydrophobicContact CE2-CG 4.35Å; Y760-Y808 HydrophobicContact CG-CD2 4.49Å; Y760-Y808 AromaticContact CZ-CD2 3.58Å; Y760-Y808 WeakPolarHBondContact O-CD2 3.37Å; Y808-C810 HydrophobicContact CE1-CB 4.34Å; Y808-V818 HydrophobicContact CE1-CG1 4.23Å; Y808-V818 WeakPolarHBondContact OH-CG2 3.12Å; Y808-L821 HydrophobicContact CD2-CB 4.31Å; Y808-L821 HydrophobicContact CE2-CB 3.67Å; Y808-L821 HydrophobicContact CE2-CD1 4.03Å; Y808-L821 HydrophobicContact CE2-CG 4.47Å; Y808-Q822 HydrophobicContact CD1-CG 3.43Å; Y808-Q822 VanDerWaalsContact CD1-CG 3.43Å; Y808-Q822 HydrophobicContact CE1-CG 3.65Å; Y808-Q822 HydrophobicContact CG-CG 4.11Å; Y808-V837 PolarHBondContact N-O 2.78Å; Y808-Q864 PolarHBondContact O-NE2 3.14Å
809	A	91	Very high	79.9	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.224	C	C	.	.			trans	-109.6	118	178.8	0	0	0	0	0	108.5	L705 V709 Y760 S761 V858 L860	L705-A809 HydrophobicContact CD1-CB 4.48Å; V709-A809 HydrophobicContact CG2-CB 3.77Å; Y760-A809 PolarHBondContact O-N 3.2Å; S761-A809 VanDerWaalsContact CA-O 3.23Å; S761-A809 WeakPolarHBondContact CA-O 3.45Å; S761-A809 WeakPolarHBondContact CB-O 3.17Å; A809-V858 HydrophobicContact CB-CG1 3.37Å; A809-L860 HydrophobicContact CB-CD2 3.74Å
810	C	85.3	Confident	81.4	Confident	11 Å²	11	48.2 Å²	48.2	7%	0.074	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	130.5	-165.9	-168.9	0	0	0	0	111.3	Y808 L839 V858 M859	Y808-C810 HydrophobicContact CE1-CB 4.34Å; C810-L839 HydrophobicContact CB-CD1 4.32Å; C810-V858 WeakPolarHBondContact O-CA 3.39Å; C810-M859 PolarHBondContact N-O 2.89Å; C810-M859 PolarHBondContact O-N 3.09Å; C810-M859 VanDerWaalsContact O-N 3.1Å
811	D	83.4	Confident	83.2	Confident	18 Å²	18	40.4 Å²	40.4	10%	0.096	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	123.5	171.8	-176.9	-8.9	0	0	0	109.5	A813 H814 V858	D811-A813 PolarHBondContact O-N 2.9Å; D811-A813 VanDerWaalsContact OD1-CB 3.29Å; D811-A813 WeakPolarHBondContact OD1-CB 3.24Å; D811-A813 PolarHBondContact OD1-N 2.91Å; D811-H814 CarbonylContact O-C 3.59Å; D811-H814 PolarHBondContact O-N 2.98Å; D811-H814 IonicContact OD2-CD2 3.47Å; D811-V858 HydrophobicContact CB-CG2 4.03Å
812	V	75.4	Confident	84.8	Confident	70 Å²	70	34 Å²	34	42%	0.424	19%	0.19	S	C	.	.	G	3₁₀ helix	trans	-60.5	-27.2	178.9	-173.4	0	0	0	0	111.7	H814 I815	V812-H814 PolarHBondContact O-N 3.08Å; V812-I815 PolarHBondContact O-N 3.07Å
813	A	77.7	Confident	85.7	Confident	71 Å²	71	39.5 Å²	39.5	59%	0.587	22%	0.215	S	C	*	.	G	3₁₀ helix	trans	-65.3	-22.6	174.1	0	0	0	0	0	113.3	D811	D811-A813 PolarHBondContact O-N 2.9Å; D811-A813 VanDerWaalsContact OD1-CB 3.29Å; D811-A813 WeakPolarHBondContact OD1-CB 3.24Å; D811-A813 PolarHBondContact OD1-N 2.91Å
814	H	76.4	Confident	86	Confident	59 Å²	59	42.5 Å²	42.5	27%	0.273	23%	0.229	S	C	.	.	G	3₁₀ helix	trans	-113.2	22.2	-177.2	-67.4	-63.3	0	0	0	113.2	S762 D811 V812 N816 D817	S762-H814 WeakPolarHBondContact CB-NE2 3.3Å; D811-H814 CarbonylContact O-C 3.59Å; D811-H814 PolarHBondContact O-N 2.98Å; D811-H814 IonicContact OD2-CD2 3.47Å; V812-H814 PolarHBondContact O-N 3.08Å; H814-N816 PolarHBondContact O-N 2.81Å; H814-D817 PolarHBondContact O-N 3.08Å
815	I	74.3	Confident	85.9	Confident	53 Å²	53	42.2 Å²	42.2	27%	0.272	23%	0.228	S	C	.	.	G	3₁₀ helix	trans	-50.7	-34.5	-176.1	-164.8	162.2	0	0	0	114.6	V812 D817 V818 F845 V849	V812-I815 PolarHBondContact O-N 3.07Å; I815-D817 VanDerWaalsContact C-N 3.31Å; I815-D817 PolarHBondContact O-N 3.21Å; I815-V818 WeakPolarHBondContact O-CG2 3.21Å; I815-V818 PolarHBondContact O-N 3.22Å; I815-F845 HydrophobicContact CD1-CE1 4.06Å; I815-F845 HydrophobicContact CD1-CE2 4.3Å; I815-F845 HydrophobicContact CD1-CZ 3.69Å; I815-F845 HydrophobicContact CG1-CE1 4.18Å; I815-F845 HydrophobicContact CG1-CE2 3.79Å; I815-F845 HydrophobicContact CG1-CZ 3.32Å; I815-V849 HydrophobicContact CD1-CG2 3.68Å
816	N	80.4	Confident	85.6	Confident	153 Å²	153	44.2 Å²	44.2	82%	0.818	24%	0.241	S	C	*	.	G	3₁₀ helix	trans	-71.4	-21.8	178	-63.8	-38.8	0	0	0	114	H814	H814-N816 PolarHBondContact O-N 2.81Å
817	D	83.9	Confident	85.1	Confident	32 Å²	32	48.1 Å²	48.1	17%	0.171	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-93.3	-7.7	-179.6	-85.8	-21.4	0	0	0	113	R763 H814 I815 Y820 L821	R763-D817 IonicContact CZ-OD1 3.92Å; R763-D817 VanDerWaalsContact CZ-OD1 3.3Å; R763-D817 IonicContact CZ-OD2 2.64Å; R763-D817 VanDerWaalsContact NE-CG 3.28Å; R763-D817 IonicContact NE-OD1 3.5Å; R763-D817 PolarHBondContact NE-OD1 3.46Å; R763-D817 VanDerWaalsContact NE-OD1 3.11Å; R763-D817 IonicContact NE-OD2 2.82Å; R763-D817 PolarHBondContact NE-OD2 3.22Å; R763-D817 IonicContact NH2-OD1 2.89Å; R763-D817 PolarHBondContact NH2-OD1 3.35Å; R763-D817 IonicContact NH2-OD2 3.94Å; H814-D817 PolarHBondContact O-N 3.08Å; I815-D817 VanDerWaalsContact C-N 3.31Å; I815-D817 PolarHBondContact O-N 3.21Å; D817-Y820 WeakPolarHBondContact O-CB 3.23Å; D817-Y820 PolarHBondContact O-N 2.63Å; D817-Y820 VanDerWaalsContact O-N 3.11Å; D817-L821 HydrophobicContact CB-CD1 3.7Å; D817-L821 HydrophobicContact CB-CG 4.07Å; D817-L821 WeakPolarHBondContact O-CB 3.19Å; D817-L821 WeakPolarHBondContact O-CG 3.44Å; D817-L821 PolarHBondContact O-N 3.16Å
818	V	84.2	Confident	84.5	Confident	4 Å²	4	49 Å²	49	2%	0.024	27%	0.266	C	S	.	.	H	α-helix	trans	-51.5	-47.8	-173.7	170.6	0	0	0	0	113.8	Y808 I815 Y820 L821 Q822 L839 F845	Y808-V818 HydrophobicContact CE1-CG1 4.23Å; Y808-V818 WeakPolarHBondContact OH-CG2 3.12Å; I815-V818 WeakPolarHBondContact O-CG2 3.21Å; I815-V818 PolarHBondContact O-N 3.22Å; V818-Y820 PolarHBondContact O-N 2.88Å; V818-L821 PolarHBondContact O-N 3.42Å; V818-Q822 WeakPolarHBondContact O-CB 2.97Å; V818-Q822 WeakPolarHBondContact O-CG 3.28Å; V818-Q822 PolarHBondContact O-N 3.32Å; V818-L839 HydrophobicContact CG1-CD1 4.37Å; V818-F845 HydrophobicContact CB-CE2 4.24Å; V818-F845 HydrophobicContact CG1-CD2 4.47Å; V818-F845 HydrophobicContact CG1-CE2 4.11Å; V818-F845 HydrophobicContact CG2-CE2 4.16Å
819	P	84.6	Confident	83.8	Confident	93 Å²	93	49 Å²	49	60%	0.604	27%	0.266	S	S	*	.	H	α-helix	trans	-65	-40.3	-179.8	-20.4	33.3	0	0	0	112.4	Q823	P819-Q823 WeakPolarHBondContact O-CB 3.26Å; P819-Q823 PolarHBondContact O-N 2.83Å; P819-Q823 VanDerWaalsContact O-N 3.07Å
820	Y	88.2	Confident	83.2	Confident	94 Å²	94	54 Å²	54	37%	0.369	29%	0.293	S	S	.	.	H	α-helix	trans	-66.8	-46	178.8	172.2	-98	0	0	0	111.4	R763 D817 V818 Q823 Q824	R763-Y820 HydrophobicContact CG-CE1 4.32Å; D817-Y820 WeakPolarHBondContact O-CB 3.23Å; D817-Y820 PolarHBondContact O-N 2.63Å; D817-Y820 VanDerWaalsContact O-N 3.11Å; V818-Y820 PolarHBondContact O-N 2.88Å; Y820-Q823 PolarHBondContact O-N 2.91Å; Y820-Q824 HydrophobicContact CD1-CG 4.37Å; Y820-Q824 HydrophobicContact CD2-CG 4.21Å; Y820-Q824 HydrophobicContact CE1-CG 3.97Å; Y820-Q824 HydrophobicContact CE2-CG 3.81Å; Y820-Q824 HydrophobicContact CG-CG 4.47Å; Y820-Q824 WeakPolarHBondContact O-CB 3.4Å; Y820-Q824 VanDerWaalsContact O-CG 3.26Å; Y820-Q824 WeakPolarHBondContact O-CG 3.49Å; Y820-Q824 PolarHBondContact O-N 3.15Å; Y820-Q824 PolarHBondContact OH-NE2 3.04Å
821	L	89.7	Confident	82.5	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-67.5	-38.9	-179.1	-72.6	173.1	0	0	0	112.3	Y760 S761 R763 F766 Y808 D817 V818 G825	Y760-L821 HydrophobicContact CD2-CD2 4.48Å; Y760-L821 HydrophobicContact CE2-CB 4.09Å; Y760-L821 HydrophobicContact CE2-CD2 4.32Å; Y760-L821 WeakPolarHBondContact CE2-O 3.41Å; Y760-L821 PolarHBondContact OH-O 3.28Å; S761-L821 WeakPolarHBondContact O-CD1 3.21Å; R763-L821 HydrophobicContact CG-CD2 4.08Å; F766-L821 HydrophobicContact CB-CD2 4.4Å; Y808-L821 HydrophobicContact CD2-CB 4.31Å; Y808-L821 HydrophobicContact CE2-CB 3.67Å; Y808-L821 HydrophobicContact CE2-CD1 4.03Å; Y808-L821 HydrophobicContact CE2-CG 4.47Å; D817-L821 HydrophobicContact CB-CD1 3.7Å; D817-L821 HydrophobicContact CB-CG 4.07Å; D817-L821 WeakPolarHBondContact O-CB 3.19Å; D817-L821 WeakPolarHBondContact O-CG 3.44Å; D817-L821 PolarHBondContact O-N 3.16Å; V818-L821 PolarHBondContact O-N 3.42Å; L821-G825 PolarHBondContact O-N 2.63Å; L821-G825 VanDerWaalsContact O-N 3.1Å
822	Q	90.5	Very high	81.7	Confident	42 Å²	42	56.1 Å²	56.1	20%	0.196	31%	0.312	C	S	.	.	H	α-helix	trans	-66.2	-43.3	173.6	-72.8	-164.5	89.6	0	0	112	Y808 V818 C826	Y808-Q822 HydrophobicContact CD1-CG 3.43Å; Y808-Q822 VanDerWaalsContact CD1-CG 3.43Å; Y808-Q822 HydrophobicContact CE1-CG 3.65Å; Y808-Q822 HydrophobicContact CG-CG 4.11Å; V818-Q822 WeakPolarHBondContact O-CB 2.97Å; V818-Q822 WeakPolarHBondContact O-CG 3.28Å; V818-Q822 PolarHBondContact O-N 3.32Å; Q822-C826 VanDerWaalsContact O-CB 3.3Å; Q822-C826 WeakPolarHBondContact O-CB 3.23Å; Q822-C826 PolarHBondContact O-N 3.34Å
823	Q	88.1	Confident	81.4	Confident	123 Å²	123	56.5 Å²	56.5	58%	0.575	31%	0.309	S	S	*	.	H	α-helix	trans	-63.1	-44.3	177.4	-171.8	179.4	20.9	0	0	112	P819 Y820 C826 N827	P819-Q823 WeakPolarHBondContact O-CB 3.26Å; P819-Q823 PolarHBondContact O-N 2.83Å; P819-Q823 VanDerWaalsContact O-N 3.07Å; Y820-Q823 PolarHBondContact O-N 2.91Å; Q823-C826 PolarHBondContact O-N 3.26Å; Q823-N827 WeakPolarHBondContact O-CB 3.43Å; Q823-N827 PolarHBondContact O-N 3.27Å; Q823-N827 PolarHBondContact O-ND2 2.92Å; Q823-N827 PolarHBondContact O-OD1 3.43Å
824	Q	88.6	Confident	81.2	Confident	63 Å²	63	53.9 Å²	53.9	29%	0.294	29%	0.286	S	S	.	.	H	α-helix	trans	-65.1	-43.1	179.9	-71.8	-72.1	22.8	0	0	112.6	F766 Y820 F828	F766-Q824 HydrophobicContact CE1-CB 3.91Å; F766-Q824 HydrophobicContact CE2-CB 4.43Å; F766-Q824 HydrophobicContact CZ-CB 3.81Å; Y820-Q824 HydrophobicContact CD1-CG 4.37Å; Y820-Q824 HydrophobicContact CD2-CG 4.21Å; Y820-Q824 HydrophobicContact CE1-CG 3.97Å; Y820-Q824 HydrophobicContact CE2-CG 3.81Å; Y820-Q824 HydrophobicContact CG-CG 4.47Å; Y820-Q824 WeakPolarHBondContact O-CB 3.4Å; Y820-Q824 VanDerWaalsContact O-CG 3.26Å; Y820-Q824 WeakPolarHBondContact O-CG 3.49Å; Y820-Q824 PolarHBondContact O-N 3.15Å; Y820-Q824 PolarHBondContact OH-NE2 3.04Å; Q824-F828 VanDerWaalsContact O-CB 3.24Å; Q824-F828 WeakPolarHBondContact O-CB 3.42Å; Q824-F828 PolarHBondContact O-N 3.38Å
825	G	85.7	Confident	81.7	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-68.8	-36.6	176.2	0	0	0	0	0	113.6	Y760 L821 F828 A829	Y760-G825 VanDerWaalsContact OH-CA 3.3Å; Y760-G825 WeakPolarHBondContact OH-CA 3.3Å; L821-G825 PolarHBondContact O-N 2.63Å; L821-G825 VanDerWaalsContact O-N 3.1Å; G825-F828 PolarHBondContact O-N 2.9Å; G825-A829 WeakPolarHBondContact O-CB 3.31Å; G825-A829 PolarHBondContact O-N 3.4Å
826	C	87.9	Confident	82.6	Confident	42 Å²	42	55.2 Å²	55.2	28%	0.284	29%	0.286	S	S	.	.	H	α-helix	trans	-61.5	-52.9	172.9	-168.3	0	0	0	0	111	Q822 Q823 F828 A829 D830 F836	Q822-C826 VanDerWaalsContact O-CB 3.3Å; Q822-C826 WeakPolarHBondContact O-CB 3.23Å; Q822-C826 PolarHBondContact O-N 3.34Å; Q823-C826 PolarHBondContact O-N 3.26Å; C826-F828 VanDerWaalsContact C-N 3.31Å; C826-F828 PolarHBondContact O-N 3.47Å; C826-A829 PolarHBondContact O-N 3.01Å; C826-D830 WeakPolarHBondContact O-CB 3.39Å; C826-D830 VanDerWaalsContact O-CG 3.28Å; C826-D830 PolarHBondContact O-N 3.41Å; C826-F836 HydrophobicContact CB-CD1 3.86Å; C826-F836 HydrophobicContact CB-CE1 4.05Å; C826-F836 HydrophobicContact CB-CG 4.35Å
827	N	82.9	Confident	83.2	Confident	82 Å²	82	48 Å²	48	44%	0.439	25%	0.247	S	C	.	.	H	α-helix	trans	-57.8	-41.9	178.1	-70.1	-12.3	0	0	0	112.4	Q823 A831	Q823-N827 WeakPolarHBondContact O-CB 3.43Å; Q823-N827 PolarHBondContact O-N 3.27Å; Q823-N827 PolarHBondContact O-ND2 2.92Å; Q823-N827 PolarHBondContact O-OD1 3.43Å; N827-A831 WeakPolarHBondContact O-CB 3.39Å; N827-A831 PolarHBondContact O-N 3.48Å
828	F	83.1	Confident	83.4	Confident	20 Å²	20	46.6 Å²	46.6	9%	0.088	24%	0.24	C	C	.	.	H	α-helix	trans	-71.4	-42.5	-178.7	-172.1	-125.5	0	0	0	111.8	F766 R770 I773 F774 M806 Q824 G825 C826 A831 L832	F766-F828 HydrophobicContact CE2-CD1 4.41Å; F766-F828 HydrophobicContact CZ-CB 4.13Å; F766-F828 HydrophobicContact CZ-CD1 4.38Å; F766-F828 HydrophobicContact CZ-CG 4.41Å; R770-F828 HydrophobicContact CB-CE1 4.35Å; R770-F828 HydrophobicContact CB-CZ 4.27Å; R770-F828 HydrophobicContact CG-CD1 4.12Å; R770-F828 HydrophobicContact CG-CE1 3.64Å; R770-F828 HydrophobicContact CG-CE2 4.36Å; R770-F828 HydrophobicContact CG-CZ 3.78Å; I773-F828 HydrophobicContact CB-CZ 4.44Å; I773-F828 HydrophobicContact CD1-CE1 3.79Å; I773-F828 HydrophobicContact CD1-CZ 4.45Å; I773-F828 HydrophobicContact CG2-CZ 4.2Å; F774-F828 HydrophobicContact CE1-CE2 4.01Å; F774-F828 HydrophobicContact CE1-CZ 4.13Å; F774-F828 HydrophobicContact CE2-CE2 4.15Å; F774-F828 HydrophobicContact CE2-CZ 4.14Å; F774-F828 AromaticContact CZ-CE2 3.5Å; F774-F828 HydrophobicContact CZ-CE2 3.5Å; F774-F828 VanDerWaalsContact CZ-CE2 3.5Å; F774-F828 AromaticContact CZ-CZ 3.79Å; F774-F828 HydrophobicContact CZ-CZ 3.79Å; M806-F828 HydrophobicContact CE-CD1 3.85Å; M806-F828 HydrophobicContact CE-CE1 4.37Å; M806-F828 HydrophobicContact SD-CD1 3.75Å; Q824-F828 VanDerWaalsContact O-CB 3.24Å; Q824-F828 WeakPolarHBondContact O-CB 3.42Å; Q824-F828 PolarHBondContact O-N 3.38Å; G825-F828 PolarHBondContact O-N 2.9Å; C826-F828 VanDerWaalsContact C-N 3.31Å; C826-F828 PolarHBondContact O-N 3.47Å; F828-A831 PolarHBondContact O-N 2.68Å; F828-L832 HydrophobicContact CD1-CD1 4.02Å; F828-L832 HydrophobicContact CD2-CD1 4.35Å; F828-L832 HydrophobicContact CE1-CD1 3.72Å; F828-L832 HydrophobicContact CE2-CD1 4.05Å; F828-L832 HydrophobicContact CE2-CG 4.37Å; F828-L832 HydrophobicContact CG-CD1 4.33Å; F828-L832 HydrophobicContact CZ-CD1 3.74Å; F828-L832 HydrophobicContact CZ-CG 4.49Å; F828-L832 VanDerWaalsContact O-CG 3.28Å; F828-L832 WeakPolarHBondContact O-CG 3.39Å; F828-L832 PolarHBondContact O-N 2.92Å; F828-L832 VanDerWaalsContact O-N 3.1Å
829	A	79.7	Confident	83.5	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-64.7	-39.8	174.5	0	0	0	0	0	112.5	M806 G825 C826 L832 Q833 V834 F836	M806-A829 HydrophobicContact CB-CB 4.32Å; G825-A829 WeakPolarHBondContact O-CB 3.31Å; G825-A829 PolarHBondContact O-N 3.4Å; C826-A829 PolarHBondContact O-N 3.01Å; A829-L832 CarbonylContact O-C 3.59Å; A829-L832 PolarHBondContact O-N 3.48Å; A829-Q833 PolarHBondContact O-N 3.42Å; A829-V834 HydrophobicContact CB-CG2 3.88Å; A829-V834 PolarHBondContact O-N 2.8Å; A829-F836 HydrophobicContact CB-CB 3.8Å
830	D	77.7	Confident	82.8	Confident	104 Å²	104	49 Å²	49	56%	0.556	24%	0.239	S	C	*	.	H	α-helix	trans	-63.6	-42.5	175.7	-75.9	-27.3	0	0	0	111.5	C826 L832 Q833	C826-D830 WeakPolarHBondContact O-CB 3.39Å; C826-D830 VanDerWaalsContact O-CG 3.28Å; C826-D830 PolarHBondContact O-N 3.41Å; D830-L832 VanDerWaalsContact C-N 3.31Å; D830-L832 PolarHBondContact O-N 3.36Å; D830-Q833 PolarHBondContact O-N 2.9Å; D830-Q833 VanDerWaalsContact O-N 3.16Å
831	A	69.6	Low	81.6	Confident	66 Å²	66	52.5 Å²	52.5	55%	0.545	26%	0.258	S	S	.	.	H	α-helix	trans	-61.8	-37.7	175.1	0	0	0	0	0	112.7	N827 F828 Q833	N827-A831 WeakPolarHBondContact O-CB 3.39Å; N827-A831 PolarHBondContact O-N 3.48Å; F828-A831 PolarHBondContact O-N 2.68Å; A831-Q833 VanDerWaalsContact C-N 3.34Å
832	L	66.8	Low	80	Confident	8 Å²	8	59.4 Å²	59.4	4%	0.042	30%	0.295	C	S	.	.	H	α-helix	trans	-80.5	-12.4	176.6	-65.5	170.8	0	0	0	113.8	I773 M778 L799 F828 A829 D830 V834	I773-L832 HydrophobicContact CD1-CD1 3.95Å; I773-L832 HydrophobicContact CG2-CD1 3.89Å; I773-L832 HydrophobicContact CG2-CD2 4.14Å; M778-L832 HydrophobicContact SD-CD2 4.05Å; L799-L832 HydrophobicContact CD1-CB 4.3Å; L799-L832 HydrophobicContact CD1-CD1 4.32Å; L799-L832 HydrophobicContact CD1-CD2 3.97Å; L799-L832 HydrophobicContact CD1-CG 4.43Å; F828-L832 HydrophobicContact CD1-CD1 4.02Å; F828-L832 HydrophobicContact CD2-CD1 4.35Å; F828-L832 HydrophobicContact CE1-CD1 3.72Å; F828-L832 HydrophobicContact CE2-CD1 4.05Å; F828-L832 HydrophobicContact CE2-CG 4.37Å; F828-L832 HydrophobicContact CG-CD1 4.33Å; F828-L832 HydrophobicContact CZ-CD1 3.74Å; F828-L832 HydrophobicContact CZ-CG 4.49Å; F828-L832 VanDerWaalsContact O-CG 3.28Å; F828-L832 WeakPolarHBondContact O-CG 3.39Å; F828-L832 PolarHBondContact O-N 2.92Å; F828-L832 VanDerWaalsContact O-N 3.1Å; A829-L832 CarbonylContact O-C 3.59Å; A829-L832 PolarHBondContact O-N 3.48Å; D830-L832 VanDerWaalsContact C-N 3.31Å; D830-L832 PolarHBondContact O-N 3.36Å; L832-V834 VanDerWaalsContact C-N 3.33Å; L832-V834 HydrophobicContact CB-CG1 4.09Å; L832-V834 HydrophobicContact CB-CG2 3.93Å; L832-V834 HydrophobicContact CD1-CG2 4.38Å
833	Q	70	Confident	78.2	Confident	77 Å²	77	63.4 Å²	63.4	36%	0.36	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.4	37.6	-170.2	-53.4	-175.6	19.1	0	0	114.1	A829 D830 A831	A829-Q833 PolarHBondContact O-N 3.42Å; D830-Q833 PolarHBondContact O-N 2.9Å; D830-Q833 VanDerWaalsContact O-N 3.16Å; A831-Q833 VanDerWaalsContact C-N 3.34Å
834	V	73.7	Confident	76.7	Confident	16 Å²	16	59.3 Å²	59.3	10%	0.097	30%	0.3	C	S	.	.			trans	-110.6	164.7	177.2	-57.3	0	0	0	0	110.9	L799 L804 A829 L832 F836	L799-V834 HydrophobicContact CB-CG1 3.76Å; L799-V834 HydrophobicContact CD1-CG1 4.23Å; L804-V834 HydrophobicContact CB-CG1 4.42Å; L804-V834 HydrophobicContact CD2-CB 3.77Å; L804-V834 HydrophobicContact CD2-CG1 3.98Å; L804-V834 HydrophobicContact CD2-CG2 3.73Å; A829-V834 HydrophobicContact CB-CG2 3.88Å; A829-V834 PolarHBondContact O-N 2.8Å; L832-V834 VanDerWaalsContact C-N 3.33Å; L832-V834 HydrophobicContact CB-CG1 4.09Å; L832-V834 HydrophobicContact CB-CG2 3.93Å; L832-V834 HydrophobicContact CD1-CG2 4.38Å; V834-F836 PolarHBondContact O-N 2.92Å
835	R	87.4	Confident	75.3	Confident	118 Å²	118	59.9 Å²	59.9	45%	0.445	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	119	-172.7	-170.3	77.6	-179.8	103	-5	111.8	V805 M806	V805-R835 WeakPolarHBondContact CA-O 3.41Å; V805-R835 HydrophobicContact CG2-CB 4.25Å; M806-R835 PolarHBondContact N-O 3.33Å
836	F	91.5	Very high	74.1	Confident	23 Å²	23	66 Å²	66	10%	0.101	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	136.4	166.6	-174.5	-118.9	0	0	0	113.2	Y760 M806 C826 A829 V834	Y760-F836 HydrophobicContact CE1-CE2 4.19Å; Y760-F836 WeakPolarHBondContact OH-CE2 3.45Å; M806-F836 WeakPolarHBondContact O-CA 3.42Å; M806-F836 WeakPolarHBondContact O-CD2 3.33Å; C826-F836 HydrophobicContact CB-CD1 3.86Å; C826-F836 HydrophobicContact CB-CE1 4.05Å; C826-F836 HydrophobicContact CB-CG 4.35Å; A829-F836 HydrophobicContact CB-CB 3.8Å; V834-F836 PolarHBondContact O-N 2.92Å
837	V	92.8	Very high	72.8	Confident	0 Å²	0	71 Å²	71	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	109.6	168.5	-179.2	0	0	0	0	109.6	V805 M806 L807 Y808 Q864 R867	V805-V837 HydrophobicContact CG1-CB 4.24Å; V805-V837 HydrophobicContact CG1-CG2 3.72Å; M806-V837 PolarHBondContact O-N 3.46Å; L807-V837 HydrophobicContact CD1-CB 4.02Å; L807-V837 HydrophobicContact CD1-CG1 3.86Å; Y808-V837 PolarHBondContact N-O 2.78Å; V837-Q864 HydrophobicContact CG1-CB 4.07Å; V837-Q864 HydrophobicContact CG1-CG 4.15Å; V837-R867 HydrophobicContact CG1-CB 4.31Å; V837-R867 HydrophobicContact CG2-CB 4.26Å
838	G	88.7	Confident	71.7	Confident	3 Å²	3	68 Å²	68	3%	0.031	33%	0.328	C	S	.	.			trans	-128.6	-171.6	167.5	0	0	0	0	0	111.3	R867	G838-R867 PolarHBondContact O-NH1 2.95Å; G838-R867 VanDerWaalsContact O-NH1 3.08Å
839	L	85.6	Confident	70.7	Confident	21 Å²	21	71 Å²	71	11%	0.11	35%	0.348	C	S	.	.			trans	-64.1	155.9	-178.2	-60.1	171.6	0	0	0	111.4	C810 V818 D844 L848 T861	C810-L839 HydrophobicContact CB-CD1 4.32Å; V818-L839 HydrophobicContact CG1-CD1 4.37Å; L839-D844 HydrophobicContact CD2-CB 4.43Å; L839-L848 HydrophobicContact CD2-CD1 3.77Å; L839-T861 HydrophobicContact CD2-CG2 4.25Å
840	R	70.5	Confident	69.8	Low	128 Å²	128	77.9 Å²	77.9	48%	0.483	38%	0.38	S	S	.	.			trans	-127.3	106.8	179.8	-89.5	-178.8	153.7	178.7	-11.4	110.9	D844 E863	R840-D844 PolarHBondContact N-OD2 3.12Å; R840-E863 WeakPolarHBondContact CD-OE1 3.45Å; R840-E863 IonicContact CZ-OE1 3.77Å; R840-E863 IonicContact NE-OE1 2.78Å; R840-E863 IonicContact NH1-OE1 3.83Å; R840-E863 PolarHBondContact NH1-OE1 3.2Å
841	Q	63.1	Low	68.8	Low	166 Å²	166	77 Å²	77	78%	0.776	37%	0.372	S	S	*	.	S	Bend	trans	74.5	159.3	176.1	-51.2	174.6	-43	0	0	113.5	D843 D844	Q841-D843 PolarHBondContact O-N 3.48Å; Q841-D844 PolarHBondContact O-N 2.85Å
842	D	55.5	Low	68	Low	145 Å²	145	80.8 Å²	80.8	78%	0.775	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-20.3	-169.5	-60.9	-60.6	0	0	0	113.3	D844 F845	D842-D844 PolarHBondContact O-N 3.32Å; D842-F845 VanDerWaalsContact O-CB 3.28Å; D842-F845 WeakPolarHBondContact O-CB 3.3Å; D842-F845 PolarHBondContact O-N 3.17Å; D842-F845 VanDerWaalsContact O-N 3.15Å
843	D	53.8	Low	67	Low	126 Å²	126	84.8 Å²	84.8	67%	0.674	42%	0.421	S	S	*	.	H	α-helix	trans	-68.8	-31.1	-179.1	-59.1	-35	0	0	0	113.1	Q841 F845 Y847	Q841-D843 PolarHBondContact O-N 3.48Å; D843-F845 PolarHBondContact O-N 3.35Å; D843-Y847 PolarHBondContact O-N 2.77Å
844	D	56.6	Low	66.3	Low	37 Å²	37	88.4 Å²	88.4	20%	0.198	44%	0.438	C	S	.	.	H	α-helix	trans	-57.8	-33.4	172.5	-87.9	-13.9	0	0	0	110.8	L839 R840 Q841 D842 L848	L839-D844 HydrophobicContact CD2-CB 4.43Å; R840-D844 PolarHBondContact N-OD2 3.12Å; Q841-D844 PolarHBondContact O-N 2.85Å; D842-D844 PolarHBondContact O-N 3.32Å; D844-L848 WeakPolarHBondContact O-CB 3.35Å; D844-L848 WeakPolarHBondContact O-CD1 3.37Å; D844-L848 WeakPolarHBondContact O-CG 3.38Å; D844-L848 PolarHBondContact O-N 2.79Å; D844-L848 VanDerWaalsContact O-N 3.14Å
845	F	59.4	Low	65.4	Low	75 Å²	75	97.4 Å²	97.4	33%	0.329	48%	0.479	S	S	.	.	H	α-helix	trans	-76.9	-42.1	-172.6	-168.9	-97.1	0	0	0	112.4	I815 V818 D842 D843 Y847 V849	I815-F845 HydrophobicContact CD1-CE1 4.06Å; I815-F845 HydrophobicContact CD1-CE2 4.3Å; I815-F845 HydrophobicContact CD1-CZ 3.69Å; I815-F845 HydrophobicContact CG1-CE1 4.18Å; I815-F845 HydrophobicContact CG1-CE2 3.79Å; I815-F845 HydrophobicContact CG1-CZ 3.32Å; V818-F845 HydrophobicContact CB-CE2 4.24Å; V818-F845 HydrophobicContact CG1-CD2 4.47Å; V818-F845 HydrophobicContact CG1-CE2 4.11Å; V818-F845 HydrophobicContact CG2-CE2 4.16Å; D842-F845 VanDerWaalsContact O-CB 3.28Å; D842-F845 WeakPolarHBondContact O-CB 3.3Å; D842-F845 PolarHBondContact O-N 3.17Å; D842-F845 VanDerWaalsContact O-N 3.15Å; D843-F845 PolarHBondContact O-N 3.35Å; F845-Y847 VanDerWaalsContact C-N 3.34Å; F845-V849 WeakPolarHBondContact O-CG2 3.38Å; F845-V849 PolarHBondContact O-N 3.28Å
846	E	59.4	Low	63.9	Low	129 Å²	129	93.7 Å²	93.7	60%	0.603	48%	0.478	S	S	*	.	H	α-helix	trans	-66.5	-36.7	173.5	-87.8	-163.9	154.1	0	0	112	V849 Q850	E846-V849 PolarHBondContact O-N 3.18Å; E846-Q850 VanDerWaalsContact O-CG 3.29Å; E846-Q850 WeakPolarHBondContact O-CG 3.26Å; E846-Q850 PolarHBondContact O-N 3.42Å
847	Y	61.4	Low	62.8	Low	148 Å²	148	94.9 Å²	94.9	58%	0.58	49%	0.489	S	S	*	.	H	α-helix	trans	-64.5	-46	178.3	-172.7	-98.8	0	0	0	112.3	D843 F845 V849 Q850 Q851	D843-Y847 PolarHBondContact O-N 2.77Å; F845-Y847 VanDerWaalsContact C-N 3.34Å; Y847-V849 VanDerWaalsContact C-N 3.28Å; Y847-V849 PolarHBondContact O-N 2.78Å; Y847-Q850 PolarHBondContact O-N 3.4Å; Y847-Q851 HydrophobicContact CE1-CG 4.13Å; Y847-Q851 HydrophobicContact CE2-CG 4.41Å; Y847-Q851 PolarHBondContact O-N 2.85Å
848	L	60	Low	62.1	Low	18 Å²	18	94.9 Å²	94.9	9%	0.094	49%	0.489	C	S	.	.	H	α-helix	trans	-65.6	-26.9	178.2	-72	171	0	0	0	113.5	L839 D844 M859 T861	L839-L848 HydrophobicContact CD2-CD1 3.77Å; D844-L848 WeakPolarHBondContact O-CB 3.35Å; D844-L848 WeakPolarHBondContact O-CD1 3.37Å; D844-L848 WeakPolarHBondContact O-CG 3.38Å; D844-L848 PolarHBondContact O-N 2.79Å; D844-L848 VanDerWaalsContact O-N 3.14Å; L848-M859 HydrophobicContact CD2-CB 3.6Å; L848-M859 HydrophobicContact CD2-CG 4.29Å; L848-M859 HydrophobicContact CD2-SD 3.71Å; L848-T861 HydrophobicContact CD1-CG2 4.37Å
849	V	62.2	Low	61.6	Low	83 Å²	83	96.6 Å²	96.6	50%	0.503	50%	0.497	S	S	.	.	H	α-helix	trans	-80.8	-24.8	175.6	172	0	0	0	0	112.3	I815 F845 E846 Y847	I815-V849 HydrophobicContact CD1-CG2 3.68Å; F845-V849 WeakPolarHBondContact O-CG2 3.38Å; F845-V849 PolarHBondContact O-N 3.28Å; E846-V849 PolarHBondContact O-N 3.18Å; Y847-V849 VanDerWaalsContact C-N 3.28Å; Y847-V849 PolarHBondContact O-N 2.78Å
850	Q	61.1	Low	61.6	Low	145 Å²	145	96.3 Å²	96.3	68%	0.678	50%	0.495	S	S	*	.	H	α-helix	trans	-87.9	-23.7	-179.1	-70.7	175.7	30.7	0	0	113.8	E846 Y847	E846-Q850 VanDerWaalsContact O-CG 3.29Å; E846-Q850 WeakPolarHBondContact O-CG 3.26Å; E846-Q850 PolarHBondContact O-N 3.42Å; Y847-Q850 PolarHBondContact O-N 3.4Å
851	Q	55.6	Low	62.3	Low	84 Å²	84	91.2 Å²	91.2	39%	0.393	48%	0.478	S	S	.	.	S	Bend	trans	-93.7	114.5	177.9	-70.4	-70	-24	0	0	111.5	Y847 M859	Y847-Q851 HydrophobicContact CE1-CG 4.13Å; Y847-Q851 HydrophobicContact CE2-CG 4.41Å; Y847-Q851 PolarHBondContact O-N 2.85Å; Q851-M859 WeakPolarHBondContact O-CE 3.42Å
852	H	52.1	Low	63.3	Low	147 Å²	147	87.2 Å²	87.2	68%	0.681	47%	0.474	S	S	*	.			trans	59.6	88.7	166.8	-68.8	-75.1	0	0	0	118.7	Q854 M859	H852-Q854 VanDerWaalsContact C-N 3.29Å; H852-Q854 PolarHBondContact O-N 2.92Å; H852-M859 HydrophobicContact CB-CE 4.19Å
853	G	47.6	Very low	64.7	Low	91 Å²	91	84.5 Å²	84.5	94%	0.938	46%	0.457	S	S	*	.			trans	-72.6	64.7	170.3	0	0	0	0	0	115.7
854	Q	53.7	Low	66.4	Low	154 Å²	154	78.6 Å²	78.6	72%	0.72	43%	0.425	S	S	*	.			trans	-99.9	113.7	157.8	-73.3	-167.1	-1.7	0	0	109.6	H852 G856	H852-Q854 VanDerWaalsContact C-N 3.29Å; H852-Q854 PolarHBondContact O-N 2.92Å; Q854-G856 PolarHBondContact O-N 2.87Å
855	Q	54.6	Low	68.1	Low	204 Å²	204	77.2 Å²	77.2	95%	0.953	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	127.1	175.3	-72.8	179.1	-31.4	0	0	110.3
856	G	56.6	Low	69.5	Low	40 Å²	40	79.2 Å²	79.2	41%	0.412	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	94.2	13.2	175.6	0	0	0	0	0	116	Q708 Q854	Q708-G856 PolarHBondContact NE2-O 2.83Å; Q854-G856 PolarHBondContact O-N 2.87Å
857	S	68.8	Low	71	Confident	48 Å²	48	74.5 Å²	74.5	34%	0.336	40%	0.401	S	S	.	.			trans	-99.2	134.8	165.3	-159.6	0	0	0	0	111
858	V	78.2	Confident	72.6	Confident	1 Å²	1	67.4 Å²	67.4	1%	0.006	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	149.8	170.8	167.7	0	0	0	0	109.5	L705 Q708 V709 A809 C810 D811	L705-V858 HydrophobicContact CD1-CB 4.36Å; L705-V858 HydrophobicContact CD1-CG1 4.17Å; L705-V858 HydrophobicContact CD1-CG2 3.74Å; Q708-V858 HydrophobicContact CB-CB 4.35Å; Q708-V858 VanDerWaalsContact OE1-CG2 3.31Å; V709-V858 HydrophobicContact CG2-CG1 4.45Å; A809-V858 HydrophobicContact CB-CG1 3.37Å; C810-V858 WeakPolarHBondContact O-CA 3.39Å; D811-V858 HydrophobicContact CB-CG2 4.03Å
859	M	77.3	Confident	74	Confident	39 Å²	39	66.6 Å²	66.6	19%	0.192	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	147.7	177.8	-73.1	-172.4	156.5	0	0	112.3	C810 L848 Q851 H852	C810-M859 PolarHBondContact N-O 2.89Å; C810-M859 PolarHBondContact O-N 3.09Å; C810-M859 VanDerWaalsContact O-N 3.1Å; L848-M859 HydrophobicContact CD2-CB 3.6Å; L848-M859 HydrophobicContact CD2-CG 4.29Å; L848-M859 HydrophobicContact CD2-SD 3.71Å; Q851-M859 WeakPolarHBondContact O-CE 3.42Å; H852-M859 HydrophobicContact CB-CE 4.19Å
860	L	86.7	Confident	75.4	Confident	15 Å²	15	66 Å²	66	8%	0.079	36%	0.359	C	S	.	.			trans	-124.5	135.3	172	-65.2	177.8	0	0	0	110.8	V709 E712 L713 L807 A809 V865	V709-L860 HydrophobicContact CG1-CD1 4.34Å; E712-L860 HydrophobicContact CB-CB 4.35Å; E712-L860 HydrophobicContact CB-CD1 3.96Å; E712-L860 HydrophobicContact CB-CG 4.25Å; E712-L860 PolarHBondContact OE2-N 3.37Å; L713-L860 HydrophobicContact CD2-CD1 4.35Å; L713-L860 HydrophobicContact CG-CD1 4.27Å; L807-L860 HydrophobicContact CD1-CD2 4.08Å; L807-L860 HydrophobicContact CD2-CD1 4.15Å; L807-L860 HydrophobicContact CD2-CD2 4.22Å; L807-L860 HydrophobicContact CG-CD2 4.37Å; A809-L860 HydrophobicContact CB-CD2 3.74Å; L860-V865 HydrophobicContact CB-CG2 4.15Å; L860-V865 HydrophobicContact CD1-CG2 4.48Å
861	T	85.1	Confident	76.7	Confident	20 Å²	20	60 Å²	60	12%	0.123	33%	0.334	C	S	.	.			trans	-73.8	152.3	171.1	77.4	0	0	0	0	110.8	L839 L848 E863 Q864 V865	L839-T861 HydrophobicContact CD2-CG2 4.25Å; L848-T861 HydrophobicContact CD1-CG2 4.37Å; T861-E863 PolarHBondContact O-N 2.88Å; T861-E863 VanDerWaalsContact O-N 3.12Å; T861-Q864 WeakPolarHBondContact O-CA 3.4Å; T861-Q864 WeakPolarHBondContact O-CB 3.27Å; T861-Q864 PolarHBondContact O-N 3.19Å; T861-Q864 PolarHBondContact OG1-N 3.44Å; T861-V865 PolarHBondContact O-N 3.12Å
862	A	83.8	Confident	78.3	Confident	83 Å²	83	56.1 Å²	56.1	69%	0.686	32%	0.315	S	S	*	.	H	α-helix	trans	-56.1	-30.9	176.7	0	0	0	0	0	112.5	Y866	A862-Y866 WeakPolarHBondContact O-CB 3.49Å; A862-Y866 PolarHBondContact O-N 2.81Å
863	E	85	Confident	79.9	Confident	88 Å²	88	49.1 Å²	49.1	41%	0.411	28%	0.283	S	S	.	.	H	α-helix	trans	-70.8	-38.3	173.1	-176.7	174.8	161.7	0	0	112.4	R840 T861 Y866 R867	R840-E863 WeakPolarHBondContact CD-OE1 3.45Å; R840-E863 IonicContact CZ-OE1 3.77Å; R840-E863 IonicContact NE-OE1 2.78Å; R840-E863 IonicContact NH1-OE1 3.83Å; R840-E863 PolarHBondContact NH1-OE1 3.2Å; T861-E863 PolarHBondContact O-N 2.88Å; T861-E863 VanDerWaalsContact O-N 3.12Å; E863-Y866 PolarHBondContact O-N 2.75Å; E863-R867 HydrophobicContact CG-CG 4.11Å; E863-R867 VanDerWaalsContact O-CB 3.26Å; E863-R867 WeakPolarHBondContact O-CB 3.19Å; E863-R867 WeakPolarHBondContact O-CG 3.31Å; E863-R867 PolarHBondContact O-N 3.25Å; E863-R867 WeakPolarHBondContact OE1-CD 3.21Å
864	Q	90.5	Very high	81.6	Confident	1 Å²	1	48.8 Å²	48.8	1%	0.005	26%	0.257	C	S	.	.	H	α-helix	trans	-61.7	-43.6	172.7	-71.5	179.8	-74.6	0	0	111.5	Y808 V837 T861 T868	Y808-Q864 PolarHBondContact O-NE2 3.14Å; V837-Q864 HydrophobicContact CG1-CB 4.07Å; V837-Q864 HydrophobicContact CG1-CG 4.15Å; T861-Q864 WeakPolarHBondContact O-CA 3.4Å; T861-Q864 WeakPolarHBondContact O-CB 3.27Å; T861-Q864 PolarHBondContact O-N 3.19Å; T861-Q864 PolarHBondContact OG1-N 3.44Å; Q864-T868 VanDerWaalsContact O-CB 3.31Å; Q864-T868 WeakPolarHBondContact O-CB 3.29Å; Q864-T868 PolarHBondContact O-N 2.99Å; Q864-T868 PolarHBondContact O-OG1 2.96Å
865	V	90.4	Very high	82.7	Confident	9 Å²	9	42.6 Å²	42.6	6%	0.055	23%	0.231	C	C	.	.	H	α-helix	trans	-57.5	-56.5	175	173.5	0	0	0	0	110.4	L713 A716 L860 T861 R867 T868 I869	L713-V865 HydrophobicContact CD2-CB 4.36Å; L713-V865 HydrophobicContact CD2-CG1 4Å; L713-V865 HydrophobicContact CD2-CG2 4.16Å; A716-V865 HydrophobicContact CB-CB 4.35Å; A716-V865 HydrophobicContact CB-CG1 3.82Å; A716-V865 HydrophobicContact CB-CG2 4.03Å; L860-V865 HydrophobicContact CB-CG2 4.15Å; L860-V865 HydrophobicContact CD1-CG2 4.48Å; T861-V865 PolarHBondContact O-N 3.12Å; V865-R867 PolarHBondContact O-N 2.88Å; V865-T868 PolarHBondContact O-N 2.96Å; V865-T868 VanDerWaalsContact O-N 3.14Å; V865-I869 HydrophobicContact CG1-CD1 4.02Å; V865-I869 PolarHBondContact O-N 2.85Å; V865-I869 VanDerWaalsContact O-N 3.12Å
866	Y	90.5	Very high	83.5	Confident	116 Å²	116	33 Å²	33	46%	0.455	19%	0.186	S	C	.	.	H	α-helix	trans	-57.2	-47.7	-178.3	-179.7	-94.9	0	0	0	111.9	F722 A862 E863 T868 F870	F722-Y866 AromaticContact CE2-CD2 3.62Å; F722-Y866 HydrophobicContact CE2-CD2 3.62Å; F722-Y866 AromaticContact CE2-CE2 3.95Å; F722-Y866 HydrophobicContact CE2-CE2 3.95Å; F722-Y866 HydrophobicContact CE2-CG 4.45Å; F722-Y866 AromaticContact CZ-CD2 3.82Å; F722-Y866 HydrophobicContact CZ-CD2 3.82Å; F722-Y866 AromaticContact CZ-CE2 3.73Å; F722-Y866 HydrophobicContact CZ-CE2 3.73Å; A862-Y866 WeakPolarHBondContact O-CB 3.49Å; A862-Y866 PolarHBondContact O-N 2.81Å; E863-Y866 PolarHBondContact O-N 2.75Å; Y866-T868 VanDerWaalsContact C-N 3.3Å; Y866-T868 PolarHBondContact O-N 2.98Å; Y866-F870 HydrophobicContact CE1-CB 4.34Å; Y866-F870 HydrophobicContact CE1-CD2 4.23Å; Y866-F870 HydrophobicContact CE1-CG 4.42Å; Y866-F870 WeakPolarHBondContact O-CB 3.18Å; Y866-F870 PolarHBondContact O-N 2.93Å
867	R	91.1	Very high	84.2	Confident	30 Å²	30	33.5 Å²	33.5	11%	0.113	18%	0.182	C	C	.	.	H	α-helix	trans	-63.6	-34.2	179.4	-74.6	170.7	58.6	-152	-6.3	113	V837 G838 E863 V865 S871	V837-R867 HydrophobicContact CG1-CB 4.31Å; V837-R867 HydrophobicContact CG2-CB 4.26Å; G838-R867 PolarHBondContact O-NH1 2.95Å; G838-R867 VanDerWaalsContact O-NH1 3.08Å; E863-R867 HydrophobicContact CG-CG 4.11Å; E863-R867 VanDerWaalsContact O-CB 3.26Å; E863-R867 WeakPolarHBondContact O-CB 3.19Å; E863-R867 WeakPolarHBondContact O-CG 3.31Å; E863-R867 PolarHBondContact O-N 3.25Å; E863-R867 WeakPolarHBondContact OE1-CD 3.21Å; V865-R867 PolarHBondContact O-N 2.88Å; R867-S871 VanDerWaalsContact O-CB 3.26Å; R867-S871 WeakPolarHBondContact O-CB 3.36Å; R867-S871 PolarHBondContact O-N 3.01Å; R867-S871 VanDerWaalsContact O-N 3.15Å; R867-S871 PolarHBondContact O-OG 2.87Å
868	T	93	Very high	84	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-67.5	-55.5	179.2	-61.1	0	0	0	0	110.3	I757 V805 L807 Q864 V865 Y866 S871 I872	I757-T868 HydrophobicContact CD1-CG2 3.56Å; I757-T868 HydrophobicContact CG1-CG2 3.81Å; I757-T868 HydrophobicContact CG2-CG2 4.46Å; V805-T868 HydrophobicContact CB-CG2 4.48Å; V805-T868 HydrophobicContact CG1-CG2 4.07Å; L807-T868 HydrophobicContact CD2-CG2 4.5Å; Q864-T868 VanDerWaalsContact O-CB 3.31Å; Q864-T868 WeakPolarHBondContact O-CB 3.29Å; Q864-T868 PolarHBondContact O-N 2.99Å; Q864-T868 PolarHBondContact O-OG1 2.96Å; V865-T868 PolarHBondContact O-N 2.96Å; V865-T868 VanDerWaalsContact O-N 3.14Å; Y866-T868 VanDerWaalsContact C-N 3.3Å; Y866-T868 PolarHBondContact O-N 2.98Å; T868-S871 PolarHBondContact O-N 2.99Å; T868-I872 PolarHBondContact O-N 2.9Å
869	I	91.4	Very high	83.2	Confident	0 Å²	0	37 Å²	37	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-65.4	-45.7	-178.3	-57.5	173.5	0	0	0	110.5	L717 F722 V731 F733 V865 S871 I872 V873	L717-I869 HydrophobicContact CD1-CD1 4.06Å; L717-I869 HydrophobicContact CD2-CD1 3.88Å; L717-I869 HydrophobicContact CG-CD1 4.24Å; F722-I869 HydrophobicContact CB-CG2 4.23Å; F722-I869 HydrophobicContact CD1-CG2 3.69Å; F722-I869 HydrophobicContact CD2-CB 4.01Å; F722-I869 HydrophobicContact CD2-CD1 4.13Å; F722-I869 HydrophobicContact CD2-CG2 3.69Å; F722-I869 HydrophobicContact CE1-CB 4.46Å; F722-I869 HydrophobicContact CE1-CG2 3.89Å; F722-I869 HydrophobicContact CE2-CB 3.83Å; F722-I869 HydrophobicContact CE2-CG2 3.89Å; F722-I869 HydrophobicContact CG-CB 4.41Å; F722-I869 HydrophobicContact CG-CG2 3.59Å; F722-I869 HydrophobicContact CZ-CB 4.07Å; F722-I869 HydrophobicContact CZ-CG2 3.99Å; V731-I869 HydrophobicContact CG2-CG2 4.19Å; F733-I869 HydrophobicContact CZ-CD1 4.21Å; V865-I869 HydrophobicContact CG1-CD1 4.02Å; V865-I869 PolarHBondContact O-N 2.85Å; V865-I869 VanDerWaalsContact O-N 3.12Å; I869-S871 VanDerWaalsContact C-N 3.26Å; I869-S871 PolarHBondContact O-N 3.41Å; I869-I872 PolarHBondContact O-N 2.93Å; I869-V873 HydrophobicContact CG2-CG2 4.14Å; I869-V873 WeakPolarHBondContact O-CG2 3.04Å; I869-V873 PolarHBondContact O-N 2.75Å
870	F	90.9	Very high	82.2	Confident	71 Å²	71	37.5 Å²	37.5	31%	0.311	20%	0.199	S	C	.	.	H	α-helix	trans	-54	-42.9	176.2	-177.4	-85.8	0	0	0	112.1	F722 Y724 Y866 H874	F722-F870 HydrophobicContact CZ-CB 4.05Å; Y724-F870 AromaticContact CD2-CD2 3.81Å; Y724-F870 HydrophobicContact CD2-CD2 3.81Å; Y724-F870 AromaticContact CD2-CE2 3.91Å; Y724-F870 HydrophobicContact CD2-CE2 3.91Å; Y724-F870 AromaticContact CE2-CD2 3.78Å; Y724-F870 HydrophobicContact CE2-CD2 3.78Å; Y724-F870 AromaticContact CE2-CE2 3.56Å; Y724-F870 HydrophobicContact CE2-CE2 3.56Å; Y724-F870 HydrophobicContact CE2-CG 4.4Å; Y724-F870 HydrophobicContact CE2-CZ 4Å; Y866-F870 HydrophobicContact CE1-CB 4.34Å; Y866-F870 HydrophobicContact CE1-CD2 4.23Å; Y866-F870 HydrophobicContact CE1-CG 4.42Å; Y866-F870 WeakPolarHBondContact O-CB 3.18Å; Y866-F870 PolarHBondContact O-N 2.93Å; F870-H874 HydrophobicContact CD1-CB 4.43Å; F870-H874 HydrophobicContact CE1-CB 4.21Å; F870-H874 AromaticContact CE1-CD2 3.97Å; F870-H874 WeakPolarHBondContact O-CB 3.33Å; F870-H874 PolarHBondContact O-N 3.19Å
871	S	87.9	Confident	80.6	Confident	20 Å²	20	41.7 Å²	41.7	14%	0.14	23%	0.227	C	C	.	.	H	α-helix	trans	-69.8	-36.4	-176.8	-60	0	0	0	0	112.5	R867 T868 I869 S875	R867-S871 VanDerWaalsContact O-CB 3.26Å; R867-S871 WeakPolarHBondContact O-CB 3.36Å; R867-S871 PolarHBondContact O-N 3.01Å; R867-S871 VanDerWaalsContact O-N 3.15Å; R867-S871 PolarHBondContact O-OG 2.87Å; T868-S871 PolarHBondContact O-N 2.99Å; I869-S871 VanDerWaalsContact C-N 3.26Å; I869-S871 PolarHBondContact O-N 3.41Å; S871-S875 WeakPolarHBondContact O-CB 3.42Å; S871-S875 PolarHBondContact O-N 2.86Å
872	I	88.4	Confident	78.3	Confident	1 Å²	1	44.4 Å²	44.4	1%	0.005	25%	0.247	C	C	.	.	H	α-helix	trans	-68.7	-51.6	175.4	-66.9	179.8	0	0	0	110.4	I697 I757 P803 V805 T868 I869 H874 S875 A876	I697-I872 HydrophobicContact CD1-CB 4.42Å; I697-I872 HydrophobicContact CD1-CD1 4.19Å; I697-I872 HydrophobicContact CD1-CG2 4.09Å; I697-I872 HydrophobicContact CG1-CG2 4.29Å; I697-I872 HydrophobicContact CG2-CD1 3.73Å; I757-I872 HydrophobicContact CD1-CD1 4.13Å; I757-I872 HydrophobicContact CG1-CD1 3.4Å; I757-I872 VanDerWaalsContact CG1-CD1 3.4Å; P803-I872 HydrophobicContact CB-CG2 4.28Å; V805-I872 HydrophobicContact CB-CD1 4.38Å; V805-I872 HydrophobicContact CB-CG1 4.28Å; V805-I872 HydrophobicContact CG2-CD1 4.15Å; V805-I872 HydrophobicContact CG2-CG1 3.53Å; T868-I872 PolarHBondContact O-N 2.9Å; I869-I872 PolarHBondContact O-N 2.93Å; I872-H874 PolarHBondContact O-N 3.23Å; I872-S875 PolarHBondContact O-N 3.22Å; I872-S875 VanDerWaalsContact O-N 3.16Å; I872-A876 WeakPolarHBondContact O-CB 3.42Å; I872-A876 PolarHBondContact O-N 2.92Å
873	V	85.9	Confident	75.8	Confident	0 Å²	0	46 Å²	46	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-58.7	-47.1	179.6	176.4	0	0	0	0	110.7	I690 V695 Y724 I729 I869 S875 A876 C877	I690-V873 HydrophobicContact CD1-CG1 4.27Å; V695-V873 HydrophobicContact CG1-CG2 4.3Å; V695-V873 HydrophobicContact CG2-CG2 4.32Å; Y724-V873 HydrophobicContact CD1-CG1 3.85Å; Y724-V873 HydrophobicContact CD2-CB 4.16Å; Y724-V873 HydrophobicContact CD2-CG1 3.7Å; Y724-V873 HydrophobicContact CE1-CG1 4.18Å; Y724-V873 HydrophobicContact CE2-CB 4.42Å; Y724-V873 HydrophobicContact CE2-CG1 4.05Å; Y724-V873 HydrophobicContact CG-CB 4.49Å; Y724-V873 HydrophobicContact CG-CG1 3.59Å; I729-V873 HydrophobicContact CD1-CG1 3.71Å; I869-V873 HydrophobicContact CG2-CG2 4.14Å; I869-V873 WeakPolarHBondContact O-CG2 3.04Å; I869-V873 PolarHBondContact O-N 2.75Å; V873-S875 PolarHBondContact O-N 3.33Å; V873-A876 PolarHBondContact O-N 3.28Å; V873-C877 WeakPolarHBondContact O-CB 3.19Å; V873-C877 PolarHBondContact O-N 2.91Å; V873-C877 PolarHBondContact O-SG 2.85Å
874	H	84.6	Confident	73.2	Confident	85 Å²	85	45.3 Å²	45.3	39%	0.394	28%	0.276	S	S	.	.	H	α-helix	trans	-60	-42.7	176.6	-176.4	-66.4	0	0	0	112.1	Y724 F870 I872 V878	Y724-H874 HydrophobicContact CE2-CB 4.04Å; Y724-H874 WeakPolarHBondContact OH-CA 2.98Å; Y724-H874 WeakPolarHBondContact OH-CB 3.39Å; Y724-H874 PolarHBondContact OH-CD2 2.95Å; Y724-H874 VanDerWaalsContact OH-CD2 3.29Å; F870-H874 HydrophobicContact CD1-CB 4.43Å; F870-H874 HydrophobicContact CE1-CB 4.21Å; F870-H874 AromaticContact CE1-CD2 3.97Å; F870-H874 WeakPolarHBondContact O-CB 3.33Å; F870-H874 PolarHBondContact O-N 3.19Å; I872-H874 PolarHBondContact O-N 3.23Å; H874-V878 WeakPolarHBondContact O-CB 3.36Å; H874-V878 VanDerWaalsContact O-CG2 3.24Å; H874-V878 WeakPolarHBondContact O-CG2 3.39Å; H874-V878 PolarHBondContact O-N 3.04Å; H874-V878 VanDerWaalsContact O-N 3.09Å
875	S	76.7	Confident	70.3	Confident	24 Å²	24	48.2 Å²	48.2	17%	0.168	30%	0.297	C	S	.	.	H	α-helix	trans	-68.7	-42	179.7	-157.8	0	0	0	0	112	R801 L802 S871 I872 V873 V878 Q879	R801-S875 PolarHBondContact O-OG 3.36Å; L802-S875 PolarHBondContact O-OG 2.75Å; S871-S875 WeakPolarHBondContact O-CB 3.42Å; S871-S875 PolarHBondContact O-N 2.86Å; I872-S875 PolarHBondContact O-N 3.22Å; I872-S875 VanDerWaalsContact O-N 3.16Å; V873-S875 PolarHBondContact O-N 3.33Å; S875-V878 PolarHBondContact O-N 3.04Å; S875-Q879 PolarHBondContact O-N 3.28Å
876	A	72	Confident	67.3	Low	1 Å²	1	53.6 Å²	53.6	1%	0.008	34%	0.335	C	S	.	.	H	α-helix	trans	-65.1	-42.1	177.1	0	0	0	0	0	112.2	I690 P803 I872 V873 V878 Q879 Y880	I690-A876 HydrophobicContact CD1-CB 3.74Å; I690-A876 HydrophobicContact CG1-CB 4Å; P803-A876 HydrophobicContact CB-CB 4.22Å; P803-A876 HydrophobicContact CG-CB 4.13Å; I872-A876 WeakPolarHBondContact O-CB 3.42Å; I872-A876 PolarHBondContact O-N 2.92Å; V873-A876 PolarHBondContact O-N 3.28Å; A876-V878 VanDerWaalsContact C-N 3.29Å; A876-V878 PolarHBondContact O-N 2.98Å; A876-Q879 PolarHBondContact O-N 2.78Å; A876-Y880 PolarHBondContact O-N 3.06Å
877	C	69.7	Low	64.4	Low	51 Å²	51	53.1 Å²	53.1	35%	0.345	34%	0.344	S	S	.	.	H	α-helix	trans	-62.8	-32.9	172.9	-70.7	0	0	0	0	113.2	V873 Y880	V873-C877 WeakPolarHBondContact O-CB 3.19Å; V873-C877 PolarHBondContact O-N 2.91Å; V873-C877 PolarHBondContact O-SG 2.85Å; C877-Y880 CarbonylContact O-C 3.55Å
878	V	66.1	Low	61.5	Low	85 Å²	85	55.4 Å²	55.4	52%	0.515	37%	0.369	S	S	.	.	H	α-helix	trans	-78.2	-32.1	176.8	168.6	0	0	0	0	112.3	H874 S875 A876	H874-V878 WeakPolarHBondContact O-CB 3.36Å; H874-V878 VanDerWaalsContact O-CG2 3.24Å; H874-V878 WeakPolarHBondContact O-CG2 3.39Å; H874-V878 PolarHBondContact O-N 3.04Å; H874-V878 VanDerWaalsContact O-N 3.09Å; S875-V878 PolarHBondContact O-N 3.04Å; A876-V878 VanDerWaalsContact C-N 3.29Å; A876-V878 PolarHBondContact O-N 2.98Å
879	Q	60.9	Low	58.4	Low	37 Å²	37	63.9 Å²	63.9	17%	0.173	42%	0.415	C	S	.	.	H	α-helix	trans	-70.4	-43.4	172.1	-79.2	-163.9	-42.1	0	0	112.4	R801 S875 A876 P881	R801-Q879 HydrophobicContact CB-CG 4.28Å; R801-Q879 WeakPolarHBondContact O-CG 3.03Å; R801-Q879 PolarHBondContact O-NE2 3.23Å; R801-Q879 VanDerWaalsContact O-NE2 3.15Å; S875-Q879 PolarHBondContact O-N 3.28Å; A876-Q879 PolarHBondContact O-N 2.78Å; Q879-P881 WeakPolarHBondContact O-CD 3.48Å
880	Y	56	Low	55.5	Low	51 Å²	51	67.8 Å²	67.8	20%	0.2	44%	0.442	C	S	.	.	S	Bend	trans	-119.3	70.9	-172.9	-60.2	-65.5	0	0	0	111.6	F687 P689 A876 C877 S882	F687-Y880 VanDerWaalsContact O-CE2 3.23Å; F687-Y880 WeakPolarHBondContact O-CE2 3.4Å; F687-Y880 PolarHBondContact O-OH 3.42Å; P689-Y880 HydrophobicContact CB-CD1 4.19Å; P689-Y880 HydrophobicContact CB-CD2 4.1Å; P689-Y880 HydrophobicContact CB-CG 3.75Å; A876-Y880 PolarHBondContact O-N 3.06Å; C877-Y880 CarbonylContact O-C 3.55Å; Y880-S882 PolarHBondContact O-N 3.31Å
881	P	52.7	Low	52.6	Low	103 Å²	103	68.4 Å²	68.4	67%	0.669	45%	0.454	S	S	*	.			trans	-63.8	108.6	172.5	27.4	-33.2	0	0	0	109.2	Q879 A883	Q879-P881 WeakPolarHBondContact O-CD 3.48Å; P881-A883 PolarHBondContact O-N 2.92Å
882	S	37.8	Very low	49.7	Very low	77 Å²	77	73.8 Å²	73.8	54%	0.538	48%	0.482	S	S	.	.			trans	-56.1	124.8	-178.6	-43.1	0	0	0	0	110.6	Y880 G884 S885	Y880-S882 PolarHBondContact O-N 3.31Å; S882-G884 PolarHBondContact O-N 3.02Å; S882-S885 PolarHBondContact O-N 2.81Å
883	A	30.1	Very low	47	Very low	117 Å²	117	76.5 Å²	76.5	97%	0.967	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	76.1	178.6	0	0	0	0	0	111.2	P881	P881-A883 PolarHBondContact O-N 2.92Å
884	G	30.3	Very low	44.4	Very low	72 Å²	72	80 Å²	80	74%	0.742	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	163.6	-19	179.8	0	0	0	0	0	116.3	S882 S886	S882-G884 PolarHBondContact O-N 3.02Å; G884-S886 PolarHBondContact O-N 3.31Å
885	S	29.2	Very low	42	Very low	62 Å²	62	84.1 Å²	84.1	43%	0.434	55%	0.548	S	S	.	.			trans	-99.1	65.9	-175.4	54.6	0	0	0	0	113.4	S882 T887	S882-S885 PolarHBondContact O-N 2.81Å; S885-T887 PolarHBondContact O-N 3.08Å
886	S	27.2	Very low	39.9	Very low	122 Å²	122	88 Å²	88	85%	0.853	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.3	29.6	175.6	61.9	0	0	0	0	114.7	G884	G884-S886 PolarHBondContact O-N 3.31Å
887	T	30.5	Very low	38	Very low	107 Å²	107	93.5 Å²	93.5	66%	0.656	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-135.3	-7.9	-167.2	47.5	0	0	0	0	114.6	S885 N889	S885-T887 PolarHBondContact O-N 3.08Å; T887-N889 VanDerWaalsContact C-N 3.28Å; T887-N889 PolarHBondContact O-N 3.41Å
888	A	30.5	Very low	36.1	Very low	77 Å²	77	97.4 Å²	97.4	64%	0.636	62%	0.617	S	S	*	*			trans	-71.7	-12.2	-176.8	0	0	0	0	0	115.2	S890	A888-S890 PolarHBondContact O-N 2.87Å
889	N	28.3	Very low	34.4	Very low	178 Å²	178	101.1 Å²	101.1	95%	0.952	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.9	25.3	177.8	-82	-16.8	0	0	0	114.2	T887	T887-N889 VanDerWaalsContact C-N 3.28Å; T887-N889 PolarHBondContact O-N 3.41Å
890	S	29.1	Very low	33	Very low	82 Å²	82	104.4 Å²	104.4	57%	0.573	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-136.9	33.2	-168.6	-173.6	0	0	0	0	114.2	A888 N892	A888-S890 PolarHBondContact O-N 2.87Å; S890-N892 PolarHBondContact O-N 3.34Å
891	C	30.4	Very low	31.7	Very low	85 Å²	85	107 Å²	107	57%	0.574	69%	0.687	S	S	*	*			trans	-74.5	85.9	170.1	58.4	0	0	0	0	111.4	G725 C893	G725-C891 WeakPolarHBondContact O-CB 3.41Å; C891-C893 PolarHBondContact O-N 2.93Å
892	N	28	Very low	30.5	Very low	133 Å²	133	112.4 Å²	112.4	71%	0.711	69%	0.694	S	S	*	*			trans	-74.6	52.8	174.4	-82.1	-30.9	0	0	0	112.4	S890 A894	S890-N892 PolarHBondContact O-N 3.34Å; N892-A894 PolarHBondContact O-N 2.92Å
893	C	31.7	Very low	30.1	Very low	57 Å²	57	117.7 Å²	117.7	39%	0.385	71%	0.71	S	S	.	*			trans	-71.9	116.3	173.5	-176.7	0	0	0	0	110.4	C891 Q895 C896	C891-C893 PolarHBondContact O-N 2.93Å; C893-Q895 PolarHBondContact O-N 3.15Å; C893-C896 PolarHBondContact O-N 3.03Å
894	A	30.4	Very low	29.9	Very low	73 Å²	73	121.5 Å²	121.5	60%	0.603	71%	0.707	S	S	*	*	G	3₁₀ helix	trans	-65.5	-17.9	-174.7	0	0	0	0	0	114.1	N892 C896	N892-A894 PolarHBondContact O-N 2.92Å; A894-C896 VanDerWaalsContact C-N 3.33Å
895	Q	33.9	Very low	29.8	Very low	173 Å²	173	123.5 Å²	123.5	81%	0.808	71%	0.71	S	S	*	*	G	3₁₀ helix	trans	-76.9	-17.1	178.9	-76	163.5	-34.5	0	0	113.5	C893 Q897	C893-Q895 PolarHBondContact O-N 3.15Å; Q895-Q897 VanDerWaalsContact C-N 3.31Å; Q895-Q897 PolarHBondContact O-N 2.79Å
896	C	32.6	Very low	29.7	Very low	106 Å²	106	123.6 Å²	123.6	72%	0.716	72%	0.721	S	S	*	*	G	3₁₀ helix	trans	-81.9	-5.8	176.5	-50.6	0	0	0	0	113.8	C893 A894	C893-C896 PolarHBondContact O-N 3.03Å; A894-C896 VanDerWaalsContact C-N 3.33Å
897	Q	32.6	Very low	29.8	Very low	116 Å²	116	123.5 Å²	123.5	54%	0.542	72%	0.72	S	S	.	*	S	Bend	trans	-99.9	-14.6	-169.8	-61.8	-169	2.4	0	0	114.6	Q895 D899 S900	Q895-Q897 VanDerWaalsContact C-N 3.31Å; Q895-Q897 PolarHBondContact O-N 2.79Å; Q897-D899 PolarHBondContact O-N 2.78Å; Q897-S900 WeakPolarHBondContact O-CB 3.41Å; Q897-S900 PolarHBondContact O-N 3.27Å
898	N	30.4	Very low	30.5	Very low	133 Å²	133	124.6 Å²	124.6	71%	0.711	72%	0.721	S	S	*	*	G	3₁₀ helix	trans	-75.4	-19.2	-168.4	-87.8	-12.8	0	0	0	116.2	S900 S901	N898-S900 VanDerWaalsContact C-N 3.25Å; N898-S900 PolarHBondContact O-N 3Å; N898-S901 PolarHBondContact O-OG 3.09Å
899	D	30.1	Very low	31.5	Very low	162 Å²	162	124 Å²	124	87%	0.866	71%	0.709	S	S	*	*	G	3₁₀ helix	trans	-79.4	-2.7	174.3	-84.1	-22.5	0	0	0	114	Q897 S901	Q897-D899 PolarHBondContact O-N 2.78Å; D899-S901 VanDerWaalsContact C-N 3.3Å; D899-S901 PolarHBondContact O-N 3.36Å
900	S	30.9	Very low	33.4	Very low	106 Å²	106	116.7 Å²	116.7	74%	0.741	67%	0.672	S	S	*	*	G	3₁₀ helix	trans	-85.4	9.2	-175.3	-57.6	0	0	0	0	114.9	Q897 N898	Q897-S900 WeakPolarHBondContact O-CB 3.41Å; Q897-S900 PolarHBondContact O-N 3.27Å; N898-S900 VanDerWaalsContact C-N 3.25Å; N898-S900 PolarHBondContact O-N 3Å
901	S	28.3	Very low	35.7	Very low	106 Å²	106	112.8 Å²	112.8	74%	0.741	64%	0.644	S	S	*	*	G	3₁₀ helix	trans	-103.5	-0	-170.6	62.8	0	0	0	0	115.6	N898 D899	N898-S901 PolarHBondContact O-OG 3.09Å; D899-S901 VanDerWaalsContact C-N 3.3Å; D899-S901 PolarHBondContact O-N 3.36Å
902	R	29	Very low	38.4	Very low	216 Å²	216	110.9 Å²	110.9	82%	0.815	63%	0.63	S	S	*	*	S	Bend	trans	-124.3	108.9	172.4	-74.4	-179.7	174	174.1	-1.2	110.6
903	H	29.3	Very low	41.2	Very low	189 Å²	189	104.5 Å²	104.5	88%	0.875	60%	0.596	S	S	*	*			trans	137.4	58.9	161.8	-72.8	-60.1	0	0	0	113.3	S905	H903-S905 PolarHBondContact O-N 3.32Å
904	Q	25.3	Very low	43.7	Very low	196 Å²	196	102.1 Å²	102.1	92%	0.916	58%	0.58	S	S	*	*			trans	-82.4	91.5	157.6	-75	-175.6	-3.8	0	0	110.2
905	S	27.1	Very low	46.5	Very low	115 Å²	115	98.7 Å²	98.7	80%	0.804	55%	0.551	S	S	*	*			trans	-168	126.1	158.7	-77.5	0	0	0	0	105.4	H903	H903-S905 PolarHBondContact O-N 3.32Å
906	G	27.5	Very low	49	Very low	64 Å²	64	91 Å²	91	66%	0.66	52%	0.516	S	S	*	.				95.9	83.5	53.5	0	0	0	0	0	107.7	I908	G906-I908 PolarHBondContact O-N 2.9Å
907	S	30.5	Very low	51.6	Low	119 Å²	119	85.9 Å²	85.9	83%	0.832	48%	0.482	S	S	*	.			trans	8.4	98.9	169.1	173.7	0	0	0	0	117.7
908	I	44.6	Very low	54.3	Low	130 Å²	130	80.7 Å²	80.7	67%	0.667	46%	0.458	S	S	*	.			trans	-133.5	75.5	158.6	-45.4	-179.2	0	0	0	110.8	G906 S910	G906-I908 PolarHBondContact O-N 2.9Å; I908-S910 PolarHBondContact O-N 3.4Å; I908-S910 VanDerWaalsContact O-N 3.12Å
909	V	50.7	Low	57	Low	66 Å²	66	74.3 Å²	74.3	40%	0.4	42%	0.424	S	S	.	.			trans	-60.8	110.6	151.7	170	0	0	0	0	106.6	G911 T912	V909-G911 VanDerWaalsContact CG1-O 3.28Å; V909-G911 WeakPolarHBondContact CG1-O 3.23Å; V909-T912 HydrophobicContact CG1-CG2 4.35Å
910	S	68.9	Low	59.4	Low	23 Å²	23	67.2 Å²	67.2	16%	0.161	39%	0.388	C	S	.	.			trans	-91.7	-20	-170.4	36.5	0	0	0	0	112.6	I908 F1000 S1001 K1133	I908-S910 PolarHBondContact O-N 3.4Å; I908-S910 VanDerWaalsContact O-N 3.12Å; S910-F1000 WeakPolarHBondContact O-CE2 3.28Å; S910-F1000 VanDerWaalsContact OG-CD2 3.29Å; S910-F1000 WeakPolarHBondContact OG-CD2 3.42Å; S910-S1001 PolarHBondContact N-O 3.23Å; S910-S1001 PolarHBondContact OG-N 3.13Å; S910-S1001 VanDerWaalsContact OG-N 3.16Å; S910-S1001 PolarHBondContact OG-O 3.2Å; S910-S1001 VanDerWaalsContact OG-O 3.04Å; S910-K1133 WeakPolarHBondContact O-CD 3.4Å; S910-K1133 WeakPolarHBondContact O-CE 3.45Å; S910-K1133 PolarHBondContact O-NZ 3.26Å
911	G	78	Confident	62	Low	0 Å²	0	62.6 Å²	62.6	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	153.1	171.9	0	0	0	0	0	113.1	V909 S1001 S1003	V909-G911 VanDerWaalsContact CG1-O 3.28Å; V909-G911 WeakPolarHBondContact CG1-O 3.23Å; G911-S1001 PolarHBondContact N-O 3.09Å; G911-S1003 PolarHBondContact O-N 3.08Å
912	T	86.7	Confident	64.6	Low	45 Å²	45	59.1 Å²	59.1	28%	0.276	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	127.2	169.6	58.3	0	0	0	0	110.5	V909 S1003 D1023 G1024	V909-T912 HydrophobicContact CG1-CG2 4.35Å; T912-S1003 WeakPolarHBondContact CA-O 3.39Å; T912-D1023 PolarHBondContact N-OD2 2.91Å; T912-D1023 CarbonylContact O-C 3.6Å; T912-D1023 VanDerWaalsContact O-CA 3.25Å; T912-D1023 WeakPolarHBondContact O-CA 3.49Å; T912-D1023 WeakPolarHBondContact O-CB 3.46Å; T912-D1023 PolarHBondContact O-N 3.49Å; T912-D1023 PolarHBondContact OG1-N 3.33Å; T912-D1023 VanDerWaalsContact OG1-N 3.09Å; T912-D1023 PolarHBondContact OG1-OD2 3.37Å; T912-G1024 PolarHBondContact O-N 3.04Å; T912-G1024 VanDerWaalsContact O-N 3.08Å
913	V	86.3	Confident	67.2	Low	0 Å²	0	49.7 Å²	49.7	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	137.5	179.8	171.8	0	0	0	0	109	I915 I1002 S1003 C1004 S1005 G1024 M1026 F1125 F1126 V1129	V913-I915 HydrophobicContact CG1-CG1 4.32Å; V913-I1002 HydrophobicContact CB-CG2 4.28Å; V913-I1002 HydrophobicContact CG2-CG2 3.71Å; V913-S1003 PolarHBondContact N-O 2.89Å; V913-C1004 CarbonylContact O-C 3.52Å; V913-C1004 WeakPolarHBondContact O-CA 3.45Å; V913-S1005 PolarHBondContact O-N 3.16Å; V913-G1024 VanDerWaalsContact CA-O 3.32Å; V913-G1024 WeakPolarHBondContact CA-O 3.48Å; V913-M1026 HydrophobicContact CG1-CG 3.97Å; V913-M1026 HydrophobicContact CG1-SD 3.9Å; V913-F1125 HydrophobicContact CG1-CE1 3.9Å; V913-F1125 HydrophobicContact CG1-CZ 4.18Å; V913-F1125 HydrophobicContact CG2-CE1 4.02Å; V913-F1125 HydrophobicContact CG2-CZ 4.4Å; V913-F1126 HydrophobicContact CG2-CE1 4.35Å; V913-V1129 HydrophobicContact CG2-CG1 4.38Å; V913-V1129 HydrophobicContact CG2-CG2 4.33Å
914	V	84.8	Confident	69.7	Low	6 Å²	6	44.1 Å²	44.1	4%	0.036	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	132.3	167.1	63.3	0	0	0	0	110.2	S1005 A1007 F1022 G1024 Y1025 M1026	V914-S1005 CarbonylContact C-O 3.59Å; V914-S1005 WeakPolarHBondContact CA-O 3.32Å; V914-S1005 WeakPolarHBondContact CG2-O 3.32Å; V914-A1007 HydrophobicContact CG2-CB 4.11Å; V914-F1022 HydrophobicContact CB-CB 4.36Å; V914-F1022 HydrophobicContact CB-CD1 3.9Å; V914-F1022 HydrophobicContact CB-CD2 3.62Å; V914-F1022 HydrophobicContact CB-CE1 4.07Å; V914-F1022 HydrophobicContact CB-CE2 3.81Å; V914-F1022 HydrophobicContact CB-CG 3.68Å; V914-F1022 HydrophobicContact CB-CZ 4.03Å; V914-F1022 HydrophobicContact CG1-CB 4.13Å; V914-F1022 HydrophobicContact CG1-CD2 3.61Å; V914-F1022 HydrophobicContact CG1-CE2 4.16Å; V914-F1022 HydrophobicContact CG1-CG 3.84Å; V914-F1022 HydrophobicContact CG2-CD2 4.41Å; V914-F1022 HydrophobicContact CG2-CE2 4.14Å; V914-F1022 HydrophobicContact CG2-CZ 4.27Å; V914-G1024 PolarHBondContact N-O 3.08Å; V914-Y1025 HydrophobicContact CG1-CD1 3.2Å; V914-Y1025 HydrophobicContact CG1-CE1 3.64Å; V914-Y1025 HydrophobicContact CG1-CG 3.97Å; V914-M1026 PolarHBondContact O-N 3.18Å
915	I	88.2	Confident	72.5	Confident	1 Å²	1	35 Å²	35	1%	0.005	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	104.7	174.9	-52.1	179.1	0	0	0	107.2	V913 L917 L929 L932 F987 C1004 S1005 V1006 A1007 M1026 I1028	V913-I915 HydrophobicContact CG1-CG1 4.32Å; I915-L917 HydrophobicContact CG2-CD1 4.09Å; I915-L929 HydrophobicContact CD1-CD2 3.7Å; I915-L929 HydrophobicContact CG2-CD2 4.17Å; I915-L932 HydrophobicContact CD1-CD1 3.44Å; I915-L932 VanDerWaalsContact CD1-CD1 3.44Å; I915-F987 HydrophobicContact CD1-CZ 4.37Å; I915-C1004 HydrophobicContact CD1-CB 4.1Å; I915-S1005 PolarHBondContact N-O 2.8Å; I915-V1006 HydrophobicContact CB-CG2 4.44Å; I915-V1006 HydrophobicContact CD1-CG2 4.49Å; I915-V1006 WeakPolarHBondContact O-CA 3.37Å; I915-A1007 PolarHBondContact O-N 2.95Å; I915-M1026 HydrophobicContact CD1-SD 4.25Å; I915-M1026 HydrophobicContact CG1-CB 4.29Å; I915-M1026 HydrophobicContact CG1-SD 4.02Å; I915-M1026 HydrophobicContact CG2-CB 4.36Å; I915-I1028 HydrophobicContact CG2-CD1 3.48Å; I915-I1028 VanDerWaalsContact CG2-CD1 3.48Å; I915-I1028 HydrophobicContact CG2-CG1 4.06Å
916	C	87.3	Confident	75.1	Confident	11 Å²	11	30.6 Å²	30.6	7%	0.074	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	119	-178.6	-176.7	0	0	0	0	109.9	A1007 A1012 M1026 F1027 I1028	C916-A1007 WeakPolarHBondContact CA-O 3.21Å; C916-A1012 HydrophobicContact CB-CB 4.46Å; C916-M1026 PolarHBondContact N-O 2.83Å; C916-F1027 HydrophobicContact CB-CD1 3.87Å; C916-F1027 HydrophobicContact CB-CE1 4.25Å; C916-I1028 PolarHBondContact O-N 3.05Å
917	L	87.3	Confident	77.8	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	146	172.5	-58.8	103.5	0	0	0	111.6	I659 I915 F923 P925 V928 V1006 A1007 S1008 Y1009 I1028	I659-L917 HydrophobicContact CD1-CB 3.75Å; I659-L917 HydrophobicContact CD1-CD2 4.43Å; I659-L917 HydrophobicContact CG1-CB 3.82Å; I659-L917 HydrophobicContact CG2-CB 4.11Å; I659-L917 HydrophobicContact CG2-CD1 4.26Å; I915-L917 HydrophobicContact CG2-CD1 4.09Å; L917-F923 HydrophobicContact CD2-CE2 3.85Å; L917-F923 HydrophobicContact CD2-CZ 4.3Å; L917-P925 HydrophobicContact CD2-CB 4.18Å; L917-V928 HydrophobicContact CD2-CG2 3.94Å; L917-V1006 HydrophobicContact CD1-CG1 3.29Å; L917-A1007 PolarHBondContact N-O 2.99Å; L917-S1008 CarbonylContact O-C 3.57Å; L917-S1008 WeakPolarHBondContact O-CA 3.41Å; L917-Y1009 PolarHBondContact O-N 3.21Å; L917-I1028 HydrophobicContact CD2-CB 4.41Å; L917-I1028 HydrophobicContact CD2-CD1 4.36Å; L917-I1028 HydrophobicContact CG-CB 4.27Å; L917-I1028 HydrophobicContact CG-CD1 4.37Å
918	M	87.9	Confident	80.5	Confident	6 Å²	6	22.8 Å²	22.8	3%	0.03	13%	0.127	C	C	.	.			trans	-83.8	130.6	179.1	-66.7	-61.7	-66	0	0	111.4	D921 Y1009 S1036 H1039	M918-D921 WeakPolarHBondContact CB-OD1 3.09Å; M918-Y1009 HydrophobicContact CE-CD1 4.34Å; M918-Y1009 HydrophobicContact CE-CG 4.1Å; M918-Y1009 WeakPolarHBondContact SD-CB 3.44Å; M918-Y1009 HydrophobicContact SD-CD1 4.44Å; M918-Y1009 HydrophobicContact SD-CG 4.02Å; M918-S1036 WeakPolarHBondContact CB-OG 3.11Å; M918-S1036 VanDerWaalsContact CG-OG 3.22Å; M918-S1036 WeakPolarHBondContact CG-OG 3.28Å; M918-H1039 HydrophobicContact CE-CB 3.76Å; M918-H1039 VanDerWaalsContact CE-CG 3.44Å; M918-H1039 HydrophobicContact SD-CB 4.08Å
919	C	87.1	Confident	82.4	Confident	0 Å²	0	16.6 Å²	16.6	0%	0	10%	0.095	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.5	134.1	176.8	-59.8	0	0	0	0	109.9	F654 I659 S1008 Y1009 R1033	F654-C919 HydrophobicContact CB-CB 4.03Å; F654-C919 HydrophobicContact CD2-CB 4.49Å; F654-C919 HydrophobicContact CG-CB 4.48Å; I659-C919 PolarHBondContact N-SG 3.35Å; C919-S1008 WeakPolarHBondContact SG-CB 3.46Å; C919-Y1009 HydrophobicContact CB-CD1 4.06Å; C919-Y1009 HydrophobicContact CB-CE1 3.86Å; C919-R1033 PolarHBondContact O-NH1 2.87Å; C919-R1033 PolarHBondContact O-NH2 2.89Å
920	G	80.6	Confident	83.8	Confident	12 Å²	12	14.6 Å²	14.6	12%	0.124	8%	0.082	C	C	.	.	T	Hydrogen-bonded Turn	trans	93.9	-3.2	-176.7	0	0	0	0	0	115.1	F654 R657	F654-G920 VanDerWaalsContact CD1-CA 3.47Å; R657-G920 PolarHBondContact O-N 2.84Å; R657-G920 VanDerWaalsContact O-N 3.15Å
921	D	86.7	Confident	84.2	Confident	9 Å²	9	13.8 Å²	13.8	5%	0.048	8%	0.076	C	C	.	.			trans	-63.3	160	172.4	-77.8	22.9	0	0	0	111.4	R657 M918 F923 S1030 R1033 S1036	R657-D921 PolarHBondContact NH1-O 2.76Å; M918-D921 WeakPolarHBondContact CB-OD1 3.09Å; D921-F923 HydrophobicContact CB-CD1 4.02Å; D921-F923 HydrophobicContact CB-CE1 3.67Å; D921-F923 HydrophobicContact CB-CZ 4.33Å; D921-F923 WeakPolarHBondContact OD2-CE1 3.3Å; D921-S1030 WeakPolarHBondContact OD2-CB 3.44Å; D921-S1030 PolarHBondContact OD2-N 2.87Å; D921-R1033 IonicContact OD1-CZ 2.97Å; D921-R1033 IonicContact OD1-NH1 2.64Å; D921-R1033 PolarHBondContact OD1-NH1 2.96Å; D921-S1036 PolarHBondContact OD1-OG 2.8Å; D921-S1036 PolarHBondContact OD2-OG 3.1Å
922	D	81.8	Confident	84.1	Confident	34 Å²	34	13.9 Å²	13.9	18%	0.182	8%	0.077	C	C	.	.	S	Bend	trans	-103.6	7.8	-164.8	54.6	-28.7	0	0	0	113.6	S1030 K1032 R1113	D922-S1030 WeakPolarHBondContact OD1-CB 3.39Å; D922-S1030 PolarHBondContact OD1-OG 3.05Å; D922-K1032 WeakPolarHBondContact OD2-CD 3.23Å; D922-R1113 VanDerWaalsContact CG-NH1 3.31Å; D922-R1113 IonicContact OD1-CZ 3.17Å; D922-R1113 IonicContact OD1-NH1 2.99Å; D922-R1113 IonicContact OD1-NH2 2.65Å; D922-R1113 PolarHBondContact OD1-NH2 3.01Å; D922-R1113 IonicContact OD2-CZ 3.58Å; D922-R1113 VanDerWaalsContact OD2-CZ 3.29Å; D922-R1113 IonicContact OD2-NH1 2.7Å; D922-R1113 PolarHBondContact OD2-NH1 3.32Å; D922-R1113 IonicContact OD2-NH2 3.78Å; D922-R1113 PolarHBondContact OD2-NH2 3.32Å
923	F	84.4	Confident	83.4	Confident	17 Å²	17	11.9 Å²	11.9	8%	0.075	6%	0.064	C	C	.	.	S	Bend	trans	-109.5	149.2	167.7	62.5	-87.7	0	0	0	111.5	L917 D921 L927 V928 I1028 V1078	L917-F923 HydrophobicContact CD2-CE2 3.85Å; L917-F923 HydrophobicContact CD2-CZ 4.3Å; D921-F923 HydrophobicContact CB-CD1 4.02Å; D921-F923 HydrophobicContact CB-CE1 3.67Å; D921-F923 HydrophobicContact CB-CZ 4.33Å; D921-F923 WeakPolarHBondContact OD2-CE1 3.3Å; F923-L927 HydrophobicContact CB-CD2 4.36Å; F923-V928 HydrophobicContact CE2-CG2 4.06Å; F923-I1028 HydrophobicContact CE2-CG2 3.86Å; F923-I1028 HydrophobicContact CZ-CG2 3.58Å; F923-V1078 HydrophobicContact CB-CG1 3.79Å; F923-V1078 HydrophobicContact CD1-CB 3.74Å; F923-V1078 HydrophobicContact CD1-CG1 3.82Å; F923-V1078 HydrophobicContact CD1-CG2 4.4Å; F923-V1078 HydrophobicContact CD2-CB 4.32Å; F923-V1078 HydrophobicContact CD2-CG1 3.92Å; F923-V1078 HydrophobicContact CD2-CG2 4.37Å; F923-V1078 HydrophobicContact CE1-CB 3.88Å; F923-V1078 HydrophobicContact CE1-CG1 4.39Å; F923-V1078 HydrophobicContact CE1-CG2 4.15Å; F923-V1078 HydrophobicContact CE2-CB 4.43Å; F923-V1078 HydrophobicContact CE2-CG1 4.47Å; F923-V1078 HydrophobicContact CE2-CG2 4.11Å; F923-V1078 HydrophobicContact CG-CB 3.99Å; F923-V1078 HydrophobicContact CG-CG1 3.57Å; F923-V1078 HydrophobicContact CZ-CB 4.24Å; F923-V1078 HydrophobicContact CZ-CG2 4.02Å
924	E	82.5	Confident	81.9	Confident	73 Å²	73	15.9 Å²	15.9	34%	0.341	9%	0.089	S	C	.	.			trans	-72.4	137.6	171.3	-76.8	-68.2	130.4	0	0	110.2	R666 D926 L927	R666-E924 IonicContact CZ-OE2 2.74Å; R666-E924 IonicContact NH2-OE2 2.76Å; R666-E924 PolarHBondContact NH2-OE2 3.36Å; E924-D926 PolarHBondContact O-N 3.26Å; E924-L927 WeakPolarHBondContact O-CB 3.31Å; E924-L927 PolarHBondContact O-N 2.77Å
925	P	83.1	Confident	80.3	Confident	4 Å²	4	18.7 Å²	18.7	3%	0.026	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-27.8	178.1	-25.9	35	0	0	0	113.6	I659 L917 L927 V928 L929	I659-P925 HydrophobicContact CD1-CG 3.86Å; L917-P925 HydrophobicContact CD2-CB 4.18Å; P925-L927 VanDerWaalsContact C-N 3.27Å; P925-L927 PolarHBondContact O-N 3.3Å; P925-V928 VanDerWaalsContact O-CG2 3.22Å; P925-V928 WeakPolarHBondContact O-CG2 3.3Å; P925-V928 PolarHBondContact O-N 2.9Å; P925-L929 HydrophobicContact CB-CD1 3.93Å; P925-L929 WeakPolarHBondContact O-CB 3.49Å; P925-L929 WeakPolarHBondContact O-CD1 3.39Å; P925-L929 VanDerWaalsContact O-CG 3.27Å; P925-L929 WeakPolarHBondContact O-CG 3.38Å; P925-L929 PolarHBondContact O-N 3.39Å; P925-L929 VanDerWaalsContact O-N 3.11Å
926	D	82.2	Confident	78	Confident	22 Å²	22	21.4 Å²	21.4	12%	0.118	11%	0.113	C	C	.	.	H	α-helix	trans	-60.3	-35.1	-178.4	-63.8	5.6	0	0	0	111.6	R666 E924 V928 L929 N930 W965	R666-D926 IonicContact NE-OD2 3.18Å; E924-D926 PolarHBondContact O-N 3.26Å; D926-V928 VanDerWaalsContact C-N 3.27Å; D926-V928 PolarHBondContact O-N 2.89Å; D926-L929 PolarHBondContact O-N 3.48Å; D926-N930 WeakPolarHBondContact O-CB 3.5Å; D926-N930 PolarHBondContact O-N 2.99Å; D926-N930 PolarHBondContact O-ND2 3.42Å; D926-N930 PolarHBondContact O-OD1 3.49Å; D926-W965 PolarHBondContact OD1-NE1 3.17Å
927	L	84.8	Confident	75.3	Confident	20 Å²	20	28.9 Å²	28.9	11%	0.105	14%	0.14	C	C	.	.	H	α-helix	trans	-55.3	-40.4	178.3	174.7	67.5	0	0	0	113.1	F923 E924 P925 V1078 V1111 R1113 P1117	F923-L927 HydrophobicContact CB-CD2 4.36Å; E924-L927 WeakPolarHBondContact O-CB 3.31Å; E924-L927 PolarHBondContact O-N 2.77Å; P925-L927 VanDerWaalsContact C-N 3.27Å; P925-L927 PolarHBondContact O-N 3.3Å; L927-V1078 HydrophobicContact CD2-CG1 3.49Å; L927-V1078 VanDerWaalsContact CD2-CG1 3.49Å; L927-V1111 HydrophobicContact CD2-CG1 4.4Å; L927-V1111 HydrophobicContact CG-CG1 4.32Å; L927-R1113 HydrophobicContact CD2-CB 4.33Å; L927-P1117 WeakPolarHBondContact O-CD 3.02Å
928	V	86	Confident	72.4	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-95.3	-16.5	-178.1	-72.4	0	0	0	0	113.2	L917 F923 P925 D926 I1028 V1076 V1078 V1111 Y1122	L917-V928 HydrophobicContact CD2-CG2 3.94Å; F923-V928 HydrophobicContact CE2-CG2 4.06Å; P925-V928 VanDerWaalsContact O-CG2 3.22Å; P925-V928 WeakPolarHBondContact O-CG2 3.3Å; P925-V928 PolarHBondContact O-N 2.9Å; D926-V928 VanDerWaalsContact C-N 3.27Å; D926-V928 PolarHBondContact O-N 2.89Å; V928-I1028 HydrophobicContact CB-CD1 3.81Å; V928-I1028 HydrophobicContact CB-CG2 4.49Å; V928-I1028 HydrophobicContact CG1-CD1 4.34Å; V928-I1028 HydrophobicContact CG1-CG2 4.03Å; V928-I1028 HydrophobicContact CG2-CD1 3.62Å; V928-I1028 HydrophobicContact CG2-CG2 4.2Å; V928-V1076 HydrophobicContact CG1-CG1 4.39Å; V928-V1078 HydrophobicContact CG1-CG2 3.62Å; V928-V1111 HydrophobicContact CG1-CG1 4.46Å; V928-Y1122 WeakPolarHBondContact O-CE2 3.5Å; V928-Y1122 PolarHBondContact O-OH 2.89Å
929	L	86	Confident	69.3	Low	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-99.9	-31	-178.2	-64.3	169.6	0	0	0	113	I915 P925 D926 P931 L932 L933 W965 F987 V1006	I915-L929 HydrophobicContact CD1-CD2 3.7Å; I915-L929 HydrophobicContact CG2-CD2 4.17Å; P925-L929 HydrophobicContact CB-CD1 3.93Å; P925-L929 WeakPolarHBondContact O-CB 3.49Å; P925-L929 WeakPolarHBondContact O-CD1 3.39Å; P925-L929 VanDerWaalsContact O-CG 3.27Å; P925-L929 WeakPolarHBondContact O-CG 3.38Å; P925-L929 PolarHBondContact O-N 3.39Å; P925-L929 VanDerWaalsContact O-N 3.11Å; D926-L929 PolarHBondContact O-N 3.48Å; L929-P931 VanDerWaalsContact C-N 3.33Å; L929-L932 HydrophobicContact CD2-CD1 4.38Å; L929-L932 WeakPolarHBondContact O-CA 3.31Å; L929-L932 WeakPolarHBondContact O-CB 3.14Å; L929-L932 PolarHBondContact O-N 3.06Å; L929-L933 WeakPolarHBondContact O-CG 3.43Å; L929-L933 PolarHBondContact O-N 3.45Å; L929-W965 HydrophobicContact CB-CZ2 4.44Å; L929-W965 HydrophobicContact CD1-CH2 3.93Å; L929-W965 HydrophobicContact CD1-CZ2 3.52Å; L929-F987 HydrophobicContact CD2-CE1 4.39Å; L929-F987 HydrophobicContact CD2-CZ 4.17Å; L929-V1006 HydrophobicContact CD1-CG1 4.05Å; L929-V1006 HydrophobicContact CD1-CG2 4.24Å; L929-V1006 HydrophobicContact CD2-CG2 3.96Å
930	N	79.3	Confident	66.5	Low	24 Å²	24	47.3 Å²	47.3	13%	0.128	24%	0.24	C	C	.	.	H	α-helix	trans	-51.7	-37.9	173.7	-75.8	-9	0	0	0	114.5	D926 L932 L933 T934 E1116	D926-N930 WeakPolarHBondContact O-CB 3.5Å; D926-N930 PolarHBondContact O-N 2.99Å; D926-N930 PolarHBondContact O-ND2 3.42Å; D926-N930 PolarHBondContact O-OD1 3.49Å; N930-L932 PolarHBondContact O-N 3.11Å; N930-L933 PolarHBondContact O-N 2.85Å; N930-T934 WeakPolarHBondContact O-CB 3.28Å; N930-T934 WeakPolarHBondContact O-CG2 3.35Å; N930-T934 PolarHBondContact O-N 2.77Å; N930-T934 PolarHBondContact O-OG1 2.87Å; N930-E1116 PolarHBondContact ND2-OE1 2.89Å
931	P	76.5	Confident	63.8	Low	5 Å²	5	57.4 Å²	57.4	3%	0.032	27%	0.274	C	S	.	.	H	α-helix	trans	-64.5	-20.1	175.1	-15	25.9	0	0	0	113.8	L929 T934 P1117 Y1122	L929-P931 VanDerWaalsContact C-N 3.33Å; P931-T934 PolarHBondContact O-OG1 2.89Å; P931-P1117 HydrophobicContact CG-CG 3.67Å; P931-P1117 WeakPolarHBondContact CG-O 2.95Å; P931-Y1122 HydrophobicContact CB-CD2 4.34Å; P931-Y1122 HydrophobicContact CB-CE2 3.97Å; P931-Y1122 HydrophobicContact CG-CE2 4.16Å
932	L	77.5	Confident	61.1	Low	3 Å²	3	64.3 Å²	64.3	2%	0.016	31%	0.31	C	S	.	.	H	α-helix	trans	-91.7	-39.7	173.6	-60	176.5	0	0	0	111.6	I915 L929 N930 R935 F987 V989 Y1122 F1126	I915-L932 HydrophobicContact CD1-CD1 3.44Å; I915-L932 VanDerWaalsContact CD1-CD1 3.44Å; L929-L932 HydrophobicContact CD2-CD1 4.38Å; L929-L932 WeakPolarHBondContact O-CA 3.31Å; L929-L932 WeakPolarHBondContact O-CB 3.14Å; L929-L932 PolarHBondContact O-N 3.06Å; N930-L932 PolarHBondContact O-N 3.11Å; L932-R935 PolarHBondContact O-N 2.91Å; L932-F987 HydrophobicContact CB-CE2 3.93Å; L932-F987 HydrophobicContact CB-CZ 4.22Å; L932-F987 HydrophobicContact CD1-CE2 4.39Å; L932-F987 HydrophobicContact CD1-CZ 4.2Å; L932-V989 HydrophobicContact CB-CG2 4.07Å; L932-Y1122 HydrophobicContact CD1-CD2 4.33Å; L932-Y1122 HydrophobicContact CD1-CE2 4.27Å; L932-Y1122 HydrophobicContact CD2-CD2 3.37Å; L932-Y1122 HydrophobicContact CD2-CE2 4.04Å; L932-Y1122 HydrophobicContact CD2-CG 4.11Å; L932-Y1122 HydrophobicContact CG-CD2 3.72Å; L932-Y1122 HydrophobicContact CG-CE2 3.84Å; L932-F1126 HydrophobicContact CD2-CE2 3.48Å; L932-F1126 VanDerWaalsContact CD2-CE2 3.48Å; L932-F1126 HydrophobicContact CD2-CZ 3.46Å; L932-F1126 VanDerWaalsContact CD2-CZ 3.46Å
933	L	71.3	Confident	58.3	Low	2 Å²	2	69.2 Å²	69.2	1%	0.01	34%	0.336	C	S	.	.	H	α-helix	trans	-73.4	-28.9	-179.5	-59.7	-179.6	0	0	0	112.9	L929 N930 R935 L936 L964 W965 F987	L929-L933 WeakPolarHBondContact O-CG 3.43Å; L929-L933 PolarHBondContact O-N 3.45Å; N930-L933 PolarHBondContact O-N 2.85Å; L933-R935 PolarHBondContact O-N 2.9Å; L933-L936 HydrophobicContact CB-CD1 4.41Å; L933-L936 HydrophobicContact CD2-CD1 3.89Å; L933-L936 WeakPolarHBondContact O-CB 3.24Å; L933-L936 PolarHBondContact O-N 3.46Å; L933-L936 VanDerWaalsContact O-N 3.11Å; L933-L964 HydrophobicContact CB-CB 4.2Å; L933-L964 HydrophobicContact CB-CD1 4.08Å; L933-L964 HydrophobicContact CD1-CB 4.17Å; L933-W965 HydrophobicContact CD1-CD2 4.13Å; L933-W965 HydrophobicContact CD1-CE3 4.45Å; L933-W965 HydrophobicContact CD1-CZ2 4.49Å; L933-F987 HydrophobicContact CD2-CD1 3.99Å; L933-F987 HydrophobicContact CD2-CD2 3.88Å; L933-F987 HydrophobicContact CD2-CE1 3.97Å; L933-F987 HydrophobicContact CD2-CE2 3.9Å; L933-F987 HydrophobicContact CD2-CG 3.94Å; L933-F987 HydrophobicContact CD2-CZ 3.95Å
934	T	54.3	Low	55.6	Low	84 Å²	84	78 Å²	78	52%	0.515	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-16.5	176.2	40.6	0	0	0	0	113.8	N930 P931 L964	N930-T934 WeakPolarHBondContact O-CB 3.28Å; N930-T934 WeakPolarHBondContact O-CG2 3.35Å; N930-T934 PolarHBondContact O-N 2.77Å; N930-T934 PolarHBondContact O-OG1 2.87Å; P931-T934 PolarHBondContact O-OG1 2.89Å; T934-L964 HydrophobicContact CG2-CD1 3.94Å
935	R	51	Low	52.9	Low	66 Å²	66	79.1 Å²	79.1	25%	0.249	39%	0.394	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.6	0.9	174.9	-65.1	-169.2	175.5	-164.9	0.1	114.2	L932 L933 R937 V989 S1119	L932-R935 PolarHBondContact O-N 2.91Å; L933-R935 PolarHBondContact O-N 2.9Å; R935-R937 PolarHBondContact O-N 3.25Å; R935-R937 VanDerWaalsContact O-N 3.13Å; R935-V989 HydrophobicContact CB-CG1 4.3Å; R935-S1119 PolarHBondContact NE-OG 3.07Å; R935-S1119 PolarHBondContact NH2-O 3.39Å; R935-S1119 VanDerWaalsContact NH2-O 3.09Å; R935-S1119 PolarHBondContact NH2-OG 3Å
936	L	41	Very low	50.1	Low	58 Å²	58	84.7 Å²	84.7	30%	0.304	43%	0.428	S	S	.	.			trans	-72.3	104.1	175.5	-78.5	164	0	0	0	111.4	L933 T938 C968 N988	L933-L936 HydrophobicContact CB-CD1 4.41Å; L933-L936 HydrophobicContact CD2-CD1 3.89Å; L933-L936 WeakPolarHBondContact O-CB 3.24Å; L933-L936 PolarHBondContact O-N 3.46Å; L933-L936 VanDerWaalsContact O-N 3.11Å; L936-T938 PolarHBondContact O-N 3.17Å; L936-C968 HydrophobicContact CD1-CB 3.91Å; L936-C968 WeakPolarHBondContact CD1-SG 3.33Å; L936-N988 WeakPolarHBondContact CD2-O 3.33Å
937	R	31.2	Very low	47.5	Very low	168 Å²	168	91.7 Å²	91.7	63%	0.634	46%	0.464	S	S	*	.			trans	-65.9	113.2	159	-75.9	-174.9	171.6	-158.8	-5.5	108.6	R935 T939	R935-R937 PolarHBondContact O-N 3.25Å; R935-R937 VanDerWaalsContact O-N 3.13Å; R937-T939 PolarHBondContact O-N 3.47Å
938	T	24.6	Very low	44.8	Very low	105 Å²	105	96.2 Å²	96.2	64%	0.644	49%	0.493	S	S	*	.			trans	-71.4	78	169.2	48.8	0	0	0	0	110.2	L936 L967	L936-T938 PolarHBondContact O-N 3.17Å; T938-L967 HydrophobicContact CG2-CB 4.25Å
939	T	23.9	Very low	42.1	Very low	103 Å²	103	103.2 Å²	103.2	63%	0.632	53%	0.53	S	S	*	.			trans	-120.9	88.2	171.3	49.2	0	0	0	0	109.2	R937	R937-T939 PolarHBondContact O-N 3.47Å
940	H	28.9	Very low	39.3	Very low	185 Å²	185	108 Å²	108	86%	0.856	56%	0.564	S	S	*	*			trans	-174.3	135.2	130.7	-111.1	-87.3	0	0	0	112.2
941	R	23.7	Very low	36.9	Very low	224 Å²	224	113 Å²	113	85%	0.845	60%	0.595	S	S	*	*			trans	-65.6	152.5	166.1	-64.7	167.2	163.8	172.7	-8.8	110.5
942	L	28.8	Very low	34.6	Very low	153 Å²	153	117.1 Å²	117.1	80%	0.801	62%	0.624	S	S	*	*				178.7	111.3	128.9	-96.3	153.9	0	0	0	113.3
943	D	24.2	Very low	32.2	Very low	137 Å²	137	123.2 Å²	123.2	73%	0.733	66%	0.656	S	S	*	*			trans	13	127.1	149.2	-46.5	-28.1	0	0	0	121.7
944	Q	27.7	Very low	30.1	Very low	201 Å²	201	130.3 Å²	130.3	94%	0.939	69%	0.689	S	S	*	*				-167.2	160.9	103.6	-103.6	175.7	16.9	0	0	113.5
945	S	24.7	Very low	28.9	Very low	97 Å²	97	129.7 Å²	129.7	68%	0.678	69%	0.688	S	S	*	*			trans	-115.2	173.2	-158.8	58.8	0	0	0	0	114.7
946	T	25.7	Very low	27.7	Very low	121 Å²	121	133.8 Å²	133.8	74%	0.742	71%	0.714	S	S	*	*			trans	61.7	105.4	156.8	55.9	0	0	0	0	119
947	L	26.9	Very low	27.1	Very low	169 Å²	169	132.6 Å²	132.6	89%	0.885	71%	0.712	S	S	*	*				-171.2	167.1	91.3	-105.3	162.9	0	0	0	111.7
948	V	27.2	Very low	26.7	Very low	116 Å²	116	129.9 Å²	129.9	70%	0.703	71%	0.71	S	S	*	*			trans	-121.8	150.6	-159.5	-161.6	0	0	0	0	109.4
949	D	29.5	Very low	26.8	Very low	147 Å²	147	127.7 Å²	127.7	79%	0.786	70%	0.699	S	S	*	*				172.6	120.9	122.7	-82.4	-16.8	0	0	0	114.4
950	S	27.8	Very low	26.9	Very low	101 Å²	101	127.8 Å²	127.8	71%	0.706	70%	0.7	S	S	*	*			trans	1.1	144	154.7	58.1	0	0	0	0	122
951	V	28.7	Very low	26.9	Very low	128 Å²	128	124.2 Å²	124.2	78%	0.776	69%	0.691	S	S	*	*				179.5	128.3	99.2	153.8	0	0	0	0	112.6
952	S	27.8	Very low	27.4	Very low	92 Å²	92	119.3 Å²	119.3	64%	0.643	69%	0.691	S	S	*	*			trans	30.5	128.3	156.2	71	0	0	0	0	125.8
953	D	27	Very low	27.9	Very low	130 Å²	130	113.1 Å²	113.1	70%	0.695	66%	0.66	S	S	*	*				96.2	126.3	124.6	-77.9	-35	0	0	0	125.4
954	Q	27.8	Very low	28.6	Very low	151 Å²	151	109 Å²	109	71%	0.706	64%	0.638	S	S	*	*			trans	62.4	144	156.5	-81.5	83.9	70.3	0	0	124.9
955	S	28	Very low	29	Very low	71 Å²	71	99.6 Å²	99.6	50%	0.497	59%	0.594	S	S	.	*			trans	70.2	125.9	176.8	68.7	0	0	0	0	116.9	S677	S677-S955 VanDerWaalsContact CB-C 3.44Å; S677-S955 PolarHBondContact N-O 2.96Å
956	I	27.6	Very low	29.6	Very low	152 Å²	152	97 Å²	97	78%	0.779	58%	0.576	S	S	*	*			cis	95.6	87.1	16.9	-46.6	-180	0	0	0	120.7	S677	S677-I956 VanDerWaalsContact CB-N 3.32Å; S677-I956 WeakPolarHBondContact CB-O 3.11Å; S677-I956 CarbonylContact O-C 3.57Å
957	A	26.8	Very low	30.1	Very low	33 Å²	33	96.4 Å²	96.4	27%	0.273	57%	0.568	S	S	.	*			trans	55.4	90.1	145.3	0	0	0	0	0	131	S677 F679	S677-A957 VanDerWaalsContact C-CA 3.45Å; S677-A957 CarbonylContact O-C 3.58Å; S677-A957 WeakPolarHBondContact O-CA 3.43Å; S677-A957 PolarHBondContact O-N 3.29Å; F679-A957 HydrophobicContact CD1-CB 4.47Å; F679-A957 WeakPolarHBondContact CD1-O 3.44Å; F679-A957 WeakPolarHBondContact CE1-O 3.38Å
958	D	24	Very low	30.7	Very low	112 Å²	112	90 Å²	90	60%	0.599	54%	0.536	S	S	*	.			trans	-140.6	22	160.8	-86.9	-62.7	0	0	0	122.7	S677 D678 F679	S677-D958 PolarHBondContact O-N 3.49Å; D678-D958 VanDerWaalsContact CA-N 3.26Å; D678-D958 VanDerWaalsContact OD1-CA 3.29Å; D678-D958 WeakPolarHBondContact OD1-CA 3.46Å; D678-D958 WeakPolarHBondContact OD1-CB 3.09Å; D678-D958 PolarHBondContact OD1-N 3.11Å; F679-D958 VanDerWaalsContact CD2-O 3.27Å; F679-D958 WeakPolarHBondContact CD2-O 3.31Å; F679-D958 HydrophobicContact CE2-CB 4.45Å; F679-D958 WeakPolarHBondContact CE2-O 3.3Å; F679-D958 VanDerWaalsContact CG-C 3.41Å; F679-D958 HydrophobicContact CZ-CB 4.27Å; F679-D958 WeakPolarHBondContact CZ-OD1 3.18Å
959	S	26.4	Very low	31.3	Very low	58 Å²	58	85.7 Å²	85.7	41%	0.406	51%	0.509	S	S	.	.			trans	-152.5	129.4	170.5	-166.6	0	0	0	0	120.4	D678 F679	D678-S959 PolarHBondContact OD1-N 3.09Å; F679-S959 VanDerWaalsContact CG-N 3.25Å
960	V	26.3	Very low	31.4	Very low	106 Å²	106	84.6 Å²	84.6	64%	0.642	50%	0.504	S	S	*	.			trans	-126.4	88.1	167.9	-175.5	0	0	0	0	112.7	F679	F679-V960 HydrophobicContact CB-CG2 3.64Å; F679-V960 VanDerWaalsContact O-CG2 3.26Å; F679-V960 WeakPolarHBondContact O-CG2 3.48Å
961	T	28.9	Very low	31.7	Very low	110 Å²	110	83.8 Å²	83.8	68%	0.675	51%	0.511	S	S	*	.			trans	-150.5	51.4	159.9	45.3	0	0	0	0	111.8	S963	T961-S963 PolarHBondContact O-N 2.88Å
962	S	32.7	Very low	31.9	Very low	121 Å²	121	81.9 Å²	81.9	85%	0.846	51%	0.509	S	S	*	.			trans	-76.5	93	179.3	51.3	0	0	0	0	112.4
963	S	40.2	Very low	31.9	Very low	22 Å²	22	81.3 Å²	81.3	15%	0.154	52%	0.517	C	S	.	.			trans	-60	149.1	-168.4	63.7	0	0	0	0	116.6	T961 W965 S966	T961-S963 PolarHBondContact O-N 2.88Å; S963-W965 PolarHBondContact O-N 3.02Å; S963-S966 VanDerWaalsContact O-CB 3.24Å; S963-S966 WeakPolarHBondContact O-CB 3.24Å; S963-S966 PolarHBondContact O-N 3.06Å; S963-S966 VanDerWaalsContact O-N 3.08Å
964	L	38.5	Very low	32	Very low	52 Å²	52	80.5 Å²	80.5	27%	0.272	52%	0.522	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.1	-31.5	176.6	-85.2	163.8	0	0	0	114.7	L933 T934 S966 L967 C968	L933-L964 HydrophobicContact CB-CB 4.2Å; L933-L964 HydrophobicContact CB-CD1 4.08Å; L933-L964 HydrophobicContact CD1-CB 4.17Å; T934-L964 HydrophobicContact CG2-CD1 3.94Å; L964-S966 PolarHBondContact O-N 3.16Å; L964-L967 PolarHBondContact O-N 3.3Å; L964-C968 PolarHBondContact O-SG 3.08Å
965	W	36.3	Very low	32	Very low	2 Å²	2	84.4 Å²	84.4	1%	0.008	53%	0.53	C	S	.	.	H	α-helix	trans	-41.6	-34.2	172.6	-69.2	110.6	0	0	0	114.3	I663 R666 D926 L929 L933 S963 L967 C968 L969 V985 F987 V1006	I663-W965 HydrophobicContact CG2-CH2 3.85Å; I663-W965 HydrophobicContact CG2-CZ2 4.29Å; I663-W965 HydrophobicContact CG2-CZ3 4.02Å; R666-W965 HydrophobicContact CB-CB 4.15Å; R666-W965 HydrophobicContact CB-CG 3.92Å; D926-W965 PolarHBondContact OD1-NE1 3.17Å; L929-W965 HydrophobicContact CB-CZ2 4.44Å; L929-W965 HydrophobicContact CD1-CH2 3.93Å; L929-W965 HydrophobicContact CD1-CZ2 3.52Å; L933-W965 HydrophobicContact CD1-CD2 4.13Å; L933-W965 HydrophobicContact CD1-CE3 4.45Å; L933-W965 HydrophobicContact CD1-CZ2 4.49Å; S963-W965 PolarHBondContact O-N 3.02Å; W965-L967 VanDerWaalsContact C-N 3.29Å; W965-L967 PolarHBondContact O-N 2.56Å; W965-C968 PolarHBondContact O-N 3.47Å; W965-L969 HydrophobicContact CE3-CD1 3.69Å; W965-L969 HydrophobicContact CE3-CG 4.48Å; W965-L969 HydrophobicContact CZ3-CD1 4.31Å; W965-V985 HydrophobicContact CZ3-CG1 4.09Å; W965-F987 HydrophobicContact CH2-CE1 4.26Å; W965-F987 HydrophobicContact CZ3-CD1 4.26Å; W965-F987 HydrophobicContact CZ3-CE1 4.42Å; W965-V1006 HydrophobicContact CH2-CG2 4.36Å
966	S	36.8	Very low	31.9	Very low	42 Å²	42	85.5 Å²	85.5	29%	0.294	54%	0.537	S	S	.	.	H	α-helix	trans	-46.6	-48.2	172.1	176.6	0	0	0	0	113.5	K670 S963 L964 N970	K670-S966 WeakPolarHBondContact CE-OG 3.37Å; K670-S966 PolarHBondContact NZ-O 3.42Å; K670-S966 PolarHBondContact NZ-OG 2.92Å; S963-S966 VanDerWaalsContact O-CB 3.24Å; S963-S966 WeakPolarHBondContact O-CB 3.24Å; S963-S966 PolarHBondContact O-N 3.06Å; S963-S966 VanDerWaalsContact O-N 3.08Å; L964-S966 PolarHBondContact O-N 3.16Å; S966-N970 PolarHBondContact O-OD1 3.07Å
967	L	37.4	Very low	31.7	Very low	110 Å²	110	85.1 Å²	85.1	58%	0.576	54%	0.537	S	S	*	.	H	α-helix	trans	-84.1	-26.1	-175.4	-69.5	164.7	0	0	0	112.4	T938 L964 W965 L969	T938-L967 HydrophobicContact CG2-CB 4.25Å; L964-L967 PolarHBondContact O-N 3.3Å; W965-L967 VanDerWaalsContact C-N 3.29Å; W965-L967 PolarHBondContact O-N 2.56Å; L967-L969 PolarHBondContact O-N 3.26Å
968	C	38.5	Very low	31.6	Very low	33 Å²	33	90 Å²	90	22%	0.223	56%	0.563	C	S	.	*	H	α-helix	trans	-77.5	-18.5	-168.5	-47.1	0	0	0	0	114.3	L936 L964 W965	L936-C968 HydrophobicContact CD1-CB 3.91Å; L936-C968 WeakPolarHBondContact CD1-SG 3.33Å; L964-C968 PolarHBondContact O-SG 3.08Å; W965-C968 PolarHBondContact O-N 3.47Å
969	L	39.7	Very low	31.7	Very low	27 Å²	27	90.7 Å²	90.7	14%	0.141	57%	0.571	C	S	.	*	S	Bend	trans	-128.1	0.7	-159	-63.7	171.7	0	0	0	115.7	M667 W965 L967 G971 A972 V985	M667-L969 HydrophobicContact CB-CD1 3.98Å; M667-L969 HydrophobicContact CE-CB 4.12Å; M667-L969 HydrophobicContact CE-CD1 3.47Å; M667-L969 VanDerWaalsContact CE-CD1 3.47Å; M667-L969 HydrophobicContact CE-CD2 3.65Å; M667-L969 HydrophobicContact CE-CG 3.92Å; M667-L969 HydrophobicContact CG-CD1 3.55Å; M667-L969 HydrophobicContact SD-CD1 4.27Å; W965-L969 HydrophobicContact CE3-CD1 3.69Å; W965-L969 HydrophobicContact CE3-CG 4.48Å; W965-L969 HydrophobicContact CZ3-CD1 4.31Å; L967-L969 PolarHBondContact O-N 3.26Å; L969-G971 PolarHBondContact O-N 3.08Å; L969-A972 PolarHBondContact O-N 2.82Å; L969-V985 HydrophobicContact CD1-CG1 4.34Å; L969-V985 HydrophobicContact CD2-CG1 3.91Å
970	N	33.1	Very low	31.7	Very low	124 Å²	124	92.2 Å²	92.2	66%	0.663	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.5	1.5	179.5	-85	9.5	0	0	0	114.5	K670 S966	K670-N970 PolarHBondContact NZ-ND2 3.09Å; K670-N970 PolarHBondContact NZ-OD1 2.9Å; S966-N970 PolarHBondContact O-OD1 3.07Å
971	G	33.9	Very low	32.5	Very low	84 Å²	84	95.3 Å²	95.3	87%	0.866	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98	-3.6	-179.5	0	0	0	0	0	116.8	L969	L969-G971 PolarHBondContact O-N 3.08Å
972	A	32.3	Very low	33.5	Very low	88 Å²	88	91.6 Å²	91.6	73%	0.727	57%	0.565	S	S	*	*	S	Bend	trans	-110.3	0.7	-172.5	0	0	0	0	0	115.2	L969 S974	L969-A972 PolarHBondContact O-N 2.82Å; A972-S974 PolarHBondContact O-N 3.5Å
973	G	27.8	Very low	35	Very low	80 Å²	80	91.1 Å²	91.1	83%	0.825	56%	0.557	S	S	*	*			trans	-96.5	47.5	-165.6	0	0	0	0	0	116.8
974	S	28.3	Very low	36.4	Very low	112 Å²	112	91 Å²	91	78%	0.783	56%	0.555	S	S	*	*			trans	-148.5	81.3	171.7	-161.5	0	0	0	0	114.8	A972	A972-S974 PolarHBondContact O-N 3.5Å
975	R	27.5	Very low	38.2	Very low	234 Å²	234	89.3 Å²	89.3	88%	0.883	55%	0.547	S	S	*	.			trans	178.6	104.8	147.5	-98	160.8	-173.5	-154	0.5	106.1
976	S	26.4	Very low	40.2	Very low	93 Å²	93	92.2 Å²	92.2	65%	0.65	57%	0.566	S	S	*	*				57.6	105.3	95.5	-169.8	0	0	0	0	112.4
977	N	24.2	Very low	42	Very low	144 Å²	144	90.6 Å²	90.6	77%	0.77	55%	0.553	S	S	*	*	S	Bend	trans	46.8	124.3	144.6	-58.1	-32.4	0	0	0	119.1
978	V	24.3	Very low	43.9	Very low	136 Å²	136	88.9 Å²	88.9	82%	0.824	55%	0.545	S	S	*	.			trans	73	68.9	170.3	-160.7	0	0	0	0	114.9
979	V	26.7	Very low	45.6	Very low	126 Å²	126	87.3 Å²	87.3	76%	0.764	53%	0.534	S	S	*	.			trans	-113.9	86.9	157.1	-173.6	0	0	0	0	109.9
980	S	26	Very low	47.1	Very low	90 Å²	90	89.3 Å²	89.3	63%	0.629	55%	0.545	S	S	*	.			trans	-74.1	144.6	157.2	57.1	0	0	0	0	109.4
981	K	42.1	Very low	48.9	Very low	172 Å²	172	83.4 Å²	83.4	75%	0.748	51%	0.513	S	S	*	.	S	Bend	trans	103.8	131.7	178.7	-58.8	157.2	-175.9	175.8	0	114.1	V983	K981-V983 PolarHBondContact O-N 3.18Å
982	S	50.8	Low	50.6	Low	32 Å²	32	84.8 Å²	84.8	22%	0.224	50%	0.496	C	S	.	.			trans	-69.2	113.9	174.3	52	0	0	0	0	110.7
983	V	64.4	Low	52.3	Low	111 Å²	111	80.7 Å²	80.7	67%	0.673	46%	0.461	S	S	*	.			trans	-111.2	132.6	171.6	-175.4	0	0	0	0	107.3	K981	K981-V983 PolarHBondContact O-N 3.18Å
984	P	69.4	Low	53.8	Low	18 Å²	18	80.6 Å²	80.6	12%	0.117	45%	0.446	C	S	.	.			trans	-65.1	158.1	175.5	30.2	-37.2	0	0	0	111.2	V1006 A1007 L1015	P984-V1006 WeakPolarHBondContact CA-O 3.25Å; P984-V1006 WeakPolarHBondContact CB-O 3.35Å; P984-A1007 HydrophobicContact CB-CB 4.15Å; P984-L1015 HydrophobicContact CG-CD1 3.96Å
985	V	76.4	Confident	55.4	Low	18 Å²	18	80.7 Å²	80.7	11%	0.109	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	117	178.9	177.2	0	0	0	0	109.1	I663 M667 W965 L969 V1006	I663-V985 HydrophobicContact CG2-CB 3.86Å; I663-V985 HydrophobicContact CG2-CG1 4.08Å; I663-V985 HydrophobicContact CG2-CG2 3.63Å; M667-V985 HydrophobicContact CE-CG1 3.82Å; M667-V985 HydrophobicContact CE-CG2 4.19Å; M667-V985 HydrophobicContact SD-CB 4.47Å; M667-V985 HydrophobicContact SD-CG1 4.09Å; M667-V985 HydrophobicContact SD-CG2 3.51Å; M667-V985 VanDerWaalsContact SD-CG2 3.51Å; W965-V985 HydrophobicContact CZ3-CG1 4.09Å; L969-V985 HydrophobicContact CD1-CG1 4.34Å; L969-V985 HydrophobicContact CD2-CG1 3.91Å; V985-V1006 PolarHBondContact N-O 3.3Å; V985-V1006 VanDerWaalsContact N-O 3.08Å; V985-V1006 PolarHBondContact O-N 3.42Å
986	T	78.2	Confident	57.1	Low	63 Å²	63	71 Å²	71	39%	0.387	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	131.8	-175.1	-51.8	0	0	0	0	111.4	S1003 C1004 S1005	T986-S1003 WeakPolarHBondContact CG2-OG 3.3Å; T986-C1004 CarbonylContact C-O 3.53Å; T986-C1004 VanDerWaalsContact CA-O 3.3Å; T986-C1004 WeakPolarHBondContact CA-O 3.39Å; T986-S1005 WeakPolarHBondContact CG2-OG 3.25Å; T986-S1005 PolarHBondContact OG1-OG 2.89Å
987	F	75.2	Confident	58.4	Low	8 Å²	8	71.5 Å²	71.5	4%	0.035	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	157.7	169.8	59.3	-100	0	0	0	110.5	I915 L929 L932 L933 W965 V989 S1003 C1004 V1006	I915-F987 HydrophobicContact CD1-CZ 4.37Å; L929-F987 HydrophobicContact CD2-CE1 4.39Å; L929-F987 HydrophobicContact CD2-CZ 4.17Å; L932-F987 HydrophobicContact CB-CE2 3.93Å; L932-F987 HydrophobicContact CB-CZ 4.22Å; L932-F987 HydrophobicContact CD1-CE2 4.39Å; L932-F987 HydrophobicContact CD1-CZ 4.2Å; L933-F987 HydrophobicContact CD2-CD1 3.99Å; L933-F987 HydrophobicContact CD2-CD2 3.88Å; L933-F987 HydrophobicContact CD2-CE1 3.97Å; L933-F987 HydrophobicContact CD2-CE2 3.9Å; L933-F987 HydrophobicContact CD2-CG 3.94Å; L933-F987 HydrophobicContact CD2-CZ 3.95Å; W965-F987 HydrophobicContact CH2-CE1 4.26Å; W965-F987 HydrophobicContact CZ3-CD1 4.26Å; W965-F987 HydrophobicContact CZ3-CE1 4.42Å; F987-V989 HydrophobicContact CD2-CG2 3.68Å; F987-V989 HydrophobicContact CE2-CG2 3.45Å; F987-V989 VanDerWaalsContact CE2-CG2 3.45Å; F987-S1003 CarbonylContact O-C 3.54Å; F987-C1004 HydrophobicContact CD2-CB 4.05Å; F987-C1004 HydrophobicContact CE1-CB 4.5Å; F987-C1004 HydrophobicContact CE2-CB 3.63Å; F987-C1004 HydrophobicContact CZ-CB 3.89Å; F987-C1004 PolarHBondContact N-O 3.41Å; F987-C1004 PolarHBondContact O-N 2.84Å; F987-V1006 HydrophobicContact CD1-CG2 4.24Å; F987-V1006 HydrophobicContact CE1-CG2 3.47Å; F987-V1006 VanDerWaalsContact CE1-CG2 3.47Å; F987-V1006 HydrophobicContact CZ-CG2 4.26Å
988	N	76.4	Confident	60	Low	74 Å²	74	69.2 Å²	69.2	40%	0.396	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	138.3	178.9	-62.1	-28.6	0	0	0	110.4	L936 I1002 S1003	L936-N988 WeakPolarHBondContact CD2-O 3.33Å; N988-I1002 CarbonylContact C-O 3.55Å; N988-I1002 WeakPolarHBondContact CA-O 3.36Å; N988-S1003 WeakPolarHBondContact OD1-CA 3.45Å; N988-S1003 WeakPolarHBondContact OD1-CB 3.49Å; N988-S1003 PolarHBondContact OD1-OG 3.37Å
989	V	73.8	Confident	61.9	Low	0 Å²	0	69 Å²	69	0%	0	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	122.5	176.8	-170.2	0	0	0	0	108.6	L932 R935 F987 V991 I1002 C1004	L932-V989 HydrophobicContact CB-CG2 4.07Å; R935-V989 HydrophobicContact CB-CG1 4.3Å; F987-V989 HydrophobicContact CD2-CG2 3.68Å; F987-V989 HydrophobicContact CE2-CG2 3.45Å; F987-V989 VanDerWaalsContact CE2-CG2 3.45Å; V989-V991 HydrophobicContact CB-CG2 4.3Å; V989-V991 HydrophobicContact CG1-CG2 3.64Å; V989-I1002 PolarHBondContact N-O 2.85Å; V989-I1002 PolarHBondContact O-N 3Å; V989-C1004 HydrophobicContact CG2-CB 4.48Å
990	D	72.7	Confident	64.2	Low	68 Å²	68	63 Å²	63	36%	0.364	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	109	170.6	-74.9	-11.9	0	0	0	109.3	S1001	D990-S1001 WeakPolarHBondContact OD1-CB 3.44Å; D990-S1001 PolarHBondContact OD1-OG 3.05Å
991	V	70.9	Confident	66.6	Low	1 Å²	1	60.2 Å²	60.2	1%	0.006	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	119.7	-178	-171.6	0	0	0	0	108	V989 L993 R999 F1000 I1002 T1123 F1126	V989-V991 HydrophobicContact CB-CG2 4.3Å; V989-V991 HydrophobicContact CG1-CG2 3.64Å; V991-L993 HydrophobicContact CB-CD2 4.13Å; V991-L993 HydrophobicContact CG1-CD2 3.57Å; V991-L993 PolarHBondContact O-N 3.11Å; V991-R999 WeakPolarHBondContact O-CA 3.38Å; V991-F1000 PolarHBondContact N-O 2.82Å; V991-F1000 PolarHBondContact O-N 2.78Å; V991-I1002 HydrophobicContact CG2-CD1 3.89Å; V991-T1123 HydrophobicContact CG1-CG2 4.26Å; V991-F1126 HydrophobicContact CB-CD2 4.41Å; V991-F1126 HydrophobicContact CG1-CB 4.49Å; V991-F1126 HydrophobicContact CG1-CD2 4.08Å; V991-F1126 HydrophobicContact CG2-CD2 3.64Å; V991-F1126 HydrophobicContact CG2-CE2 3.93Å; V991-F1126 HydrophobicContact CG2-CG 4.34Å
992	F	69.1	Low	68.5	Low	113 Å²	113	52 Å²	52	50%	0.496	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	118.6	164	-175.8	-100	0	0	0	108.2	R999	F992-R999 HydrophobicContact CD2-CG 4.45Å
993	L	68.5	Low	70.2	Confident	1 Å²	1	51.2 Å²	51.2	1%	0.005	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	113.7	177.1	-56.5	-177.4	0	0	0	108.6	V991 V995 A996 C997 N998 F1000 T1123 F1126 E1127 W1130	V991-L993 HydrophobicContact CB-CD2 4.13Å; V991-L993 HydrophobicContact CG1-CD2 3.57Å; V991-L993 PolarHBondContact O-N 3.11Å; L993-V995 VanDerWaalsContact C-N 3.25Å; L993-V995 PolarHBondContact O-N 2.84Å; L993-A996 HydrophobicContact CB-CB 4Å; L993-A996 HydrophobicContact CD1-CB 4.41Å; L993-A996 PolarHBondContact O-N 2.84Å; L993-A996 VanDerWaalsContact O-N 3.08Å; L993-C997 PolarHBondContact O-N 3.33Å; L993-C997 VanDerWaalsContact O-N 3.12Å; L993-N998 PolarHBondContact N-O 2.8Å; L993-F1000 HydrophobicContact CD1-CB 3.54Å; L993-F1000 HydrophobicContact CD1-CD1 3.74Å; L993-F1000 HydrophobicContact CD1-CG 3.91Å; L993-F1000 HydrophobicContact CD2-CB 4.48Å; L993-F1000 HydrophobicContact CG-CB 3.79Å; L993-F1000 HydrophobicContact CG-CD1 4.45Å; L993-T1123 HydrophobicContact CD2-CG2 4.34Å; L993-F1126 HydrophobicContact CD2-CB 4.04Å; L993-E1127 HydrophobicContact CB-CG 4.21Å; L993-E1127 HydrophobicContact CD1-CG 4.46Å; L993-E1127 HydrophobicContact CD2-CG 3.84Å; L993-E1127 HydrophobicContact CG-CG 4.39Å; L993-W1130 HydrophobicContact CD1-CB 3.6Å; L993-W1130 HydrophobicContact CD1-CD2 4.33Å; L993-W1130 HydrophobicContact CD1-CG 3.76Å
994	P	59.7	Low	71.2	Confident	79 Å²	79	46 Å²	46	51%	0.513	26%	0.257	S	S	.	.	G	3₁₀ helix	trans	-51.2	-43.3	176.3	-29	35.1	0	0	0	113.2	A996 C997 E1127	P994-A996 VanDerWaalsContact C-N 3.29Å; P994-A996 PolarHBondContact O-N 2.84Å; P994-C997 PolarHBondContact O-N 2.9Å; P994-E1127 WeakPolarHBondContact CD-OE1 3.4Å
995	V	61.1	Low	71.9	Confident	113 Å²	113	45.6 Å²	45.6	69%	0.685	26%	0.255	S	S	*	.	G	3₁₀ helix	trans	-65.6	-28.4	-178.9	177.9	0	0	0	0	113.2	L993 E1127	L993-V995 VanDerWaalsContact C-N 3.25Å; L993-V995 PolarHBondContact O-N 2.84Å; V995-E1127 WeakPolarHBondContact CG2-OE1 3.22Å
996	A	62.2	Low	72.4	Confident	30 Å²	30	44.8 Å²	44.8	25%	0.248	25%	0.25	C	S	.	.	G	3₁₀ helix	trans	-95.1	-7.9	179.6	0	0	0	0	0	113.6	L993 P994 N998 W1130	L993-A996 HydrophobicContact CB-CB 4Å; L993-A996 HydrophobicContact CD1-CB 4.41Å; L993-A996 PolarHBondContact O-N 2.84Å; L993-A996 VanDerWaalsContact O-N 3.08Å; P994-A996 VanDerWaalsContact C-N 3.29Å; P994-A996 PolarHBondContact O-N 2.84Å; A996-N998 HydrophobicContact CB-CB 4.36Å; A996-N998 WeakPolarHBondContact O-CB 3.32Å; A996-N998 PolarHBondContact O-N 3.38Å; A996-W1130 HydrophobicContact CB-CZ2 4.43Å
997	C	53.5	Low	72.5	Confident	105 Å²	105	41.8 Å²	41.8	71%	0.709	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.2	24.8	-168.2	-66.1	0	0	0	0	114.2	L993 P994	L993-C997 PolarHBondContact O-N 3.33Å; L993-C997 VanDerWaalsContact O-N 3.12Å; P994-C997 PolarHBondContact O-N 2.9Å
998	N	59.4	Low	72.9	Confident	96 Å²	96	41.4 Å²	41.4	51%	0.513	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	163.8	-167	-161.1	0.1	0	0	0	111.1	L993 A996	L993-N998 PolarHBondContact N-O 2.8Å; A996-N998 HydrophobicContact CB-CB 4.36Å; A996-N998 WeakPolarHBondContact O-CB 3.32Å; A996-N998 PolarHBondContact O-N 3.38Å
999	R	64.2	Low	73.1	Confident	130 Å²	130	38.2 Å²	38.2	49%	0.491	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	125.1	172.4	-68.8	-174.3	-177.7	165	5.8	110.4	V991 F992	V991-R999 WeakPolarHBondContact O-CA 3.38Å; F992-R999 HydrophobicContact CD2-CG 4.45Å
1000	F	75.1	Confident	73.4	Confident	2 Å²	2	38.2 Å²	38.2	1%	0.009	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	126.2	170.7	-178.3	-144.4	0	0	0	109	S910 V991 L993 I1002 F1126 V1129 W1130	S910-F1000 WeakPolarHBondContact O-CE2 3.28Å; S910-F1000 VanDerWaalsContact OG-CD2 3.29Å; S910-F1000 WeakPolarHBondContact OG-CD2 3.42Å; V991-F1000 PolarHBondContact N-O 2.82Å; V991-F1000 PolarHBondContact O-N 2.78Å; L993-F1000 HydrophobicContact CD1-CB 3.54Å; L993-F1000 HydrophobicContact CD1-CD1 3.74Å; L993-F1000 HydrophobicContact CD1-CG 3.91Å; L993-F1000 HydrophobicContact CD2-CB 4.48Å; L993-F1000 HydrophobicContact CG-CB 3.79Å; L993-F1000 HydrophobicContact CG-CD1 4.45Å; F1000-I1002 HydrophobicContact CD1-CD1 3.34Å; F1000-I1002 HydrophobicContact CD1-CG1 3.43Å; F1000-I1002 VanDerWaalsContact CD1-CG1 3.43Å; F1000-I1002 HydrophobicContact CD2-CG1 4.39Å; F1000-I1002 HydrophobicContact CE1-CD1 3.49Å; F1000-I1002 VanDerWaalsContact CE1-CD1 3.49Å; F1000-I1002 HydrophobicContact CE1-CG1 3.54Å; F1000-I1002 HydrophobicContact CE2-CG1 4.46Å; F1000-I1002 HydrophobicContact CG-CD1 4.22Å; F1000-I1002 HydrophobicContact CG-CG1 3.89Å; F1000-I1002 HydrophobicContact CZ-CD1 4.46Å; F1000-I1002 HydrophobicContact CZ-CG1 4.08Å; F1000-F1126 WeakPolarHBondContact CE1-O 3.03Å; F1000-V1129 HydrophobicContact CE1-CB 4.36Å; F1000-V1129 HydrophobicContact CE1-CG1 4.18Å; F1000-V1129 HydrophobicContact CZ-CG1 4.12Å; F1000-W1130 HydrophobicContact CD1-CB 4.04Å; F1000-W1130 HydrophobicContact CD2-CD2 4.31Å; F1000-W1130 AromaticContact CD2-CE3 3.3Å; F1000-W1130 HydrophobicContact CD2-CE3 3.3Å; F1000-W1130 AromaticContact CD2-CZ3 3.71Å; F1000-W1130 HydrophobicContact CD2-CZ3 3.71Å; F1000-W1130 HydrophobicContact CE1-CB 3.88Å; F1000-W1130 HydrophobicContact CE2-CD2 4.5Å; F1000-W1130 AromaticContact CE2-CE3 3.43Å; F1000-W1130 HydrophobicContact CE2-CE3 3.43Å; F1000-W1130 VanDerWaalsContact CE2-CE3 3.43Å; F1000-W1130 HydrophobicContact CE2-CZ3 4.01Å; F1000-W1130 HydrophobicContact CG-CB 4.47Å; F1000-W1130 AromaticContact CG-CE3 3.91Å; F1000-W1130 HydrophobicContact CG-CE3 3.91Å; F1000-W1130 HydrophobicContact CZ-CB 4.17Å; F1000-W1130 HydrophobicContact CZ-CE3 4.13Å
1001	S	76.3	Confident	73.6	Confident	30 Å²	30	35 Å²	35	21%	0.21	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	113.9	-178.2	-161.3	0	0	0	0	110.3	S910 G911 D990	S910-S1001 PolarHBondContact N-O 3.23Å; S910-S1001 PolarHBondContact OG-N 3.13Å; S910-S1001 VanDerWaalsContact OG-N 3.16Å; S910-S1001 PolarHBondContact OG-O 3.2Å; S910-S1001 VanDerWaalsContact OG-O 3.04Å; G911-S1001 PolarHBondContact N-O 3.09Å; D990-S1001 WeakPolarHBondContact OD1-CB 3.44Å; D990-S1001 PolarHBondContact OD1-OG 3.05Å
1002	I	82.2	Confident	73.8	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	122.1	-165.5	-45.9	177.6	0	0	0	109.6	V913 N988 V989 V991 F1000 C1004 F1126	V913-I1002 HydrophobicContact CB-CG2 4.28Å; V913-I1002 HydrophobicContact CG2-CG2 3.71Å; N988-I1002 CarbonylContact C-O 3.55Å; N988-I1002 WeakPolarHBondContact CA-O 3.36Å; V989-I1002 PolarHBondContact N-O 2.85Å; V989-I1002 PolarHBondContact O-N 3Å; V991-I1002 HydrophobicContact CG2-CD1 3.89Å; F1000-I1002 HydrophobicContact CD1-CD1 3.34Å; F1000-I1002 HydrophobicContact CD1-CG1 3.43Å; F1000-I1002 VanDerWaalsContact CD1-CG1 3.43Å; F1000-I1002 HydrophobicContact CD2-CG1 4.39Å; F1000-I1002 HydrophobicContact CE1-CD1 3.49Å; F1000-I1002 VanDerWaalsContact CE1-CD1 3.49Å; F1000-I1002 HydrophobicContact CE1-CG1 3.54Å; F1000-I1002 HydrophobicContact CE2-CG1 4.46Å; F1000-I1002 HydrophobicContact CG-CD1 4.22Å; F1000-I1002 HydrophobicContact CG-CG1 3.89Å; F1000-I1002 HydrophobicContact CZ-CD1 4.46Å; F1000-I1002 HydrophobicContact CZ-CG1 4.08Å; I1002-C1004 PolarHBondContact O-N 3.29Å; I1002-F1126 HydrophobicContact CD1-CB 3.57Å; I1002-F1126 HydrophobicContact CD1-CD1 3.23Å; I1002-F1126 HydrophobicContact CD1-CD2 3.94Å; I1002-F1126 HydrophobicContact CD1-CE1 3.79Å; I1002-F1126 HydrophobicContact CD1-CE2 4.4Å; I1002-F1126 HydrophobicContact CD1-CG 3.31Å; I1002-F1126 HydrophobicContact CD1-CZ 4.32Å; I1002-F1126 HydrophobicContact CG2-CE1 4.4Å
1003	S	85.3	Confident	73.9	Confident	16 Å²	16	31.9 Å²	31.9	11%	0.112	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	105.7	174.4	-152.3	0	0	0	0	110	G911 T912 V913 T986 F987 N988	G911-S1003 PolarHBondContact O-N 3.08Å; T912-S1003 WeakPolarHBondContact CA-O 3.39Å; V913-S1003 PolarHBondContact N-O 2.89Å; T986-S1003 WeakPolarHBondContact CG2-OG 3.3Å; F987-S1003 CarbonylContact O-C 3.54Å; N988-S1003 WeakPolarHBondContact OD1-CA 3.45Å; N988-S1003 WeakPolarHBondContact OD1-CB 3.49Å; N988-S1003 PolarHBondContact OD1-OG 3.37Å
1004	C	86.1	Confident	73.9	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	117.5	-178.9	-63.3	0	0	0	0	109.5	V913 I915 T986 F987 V989 I1002	V913-C1004 CarbonylContact O-C 3.52Å; V913-C1004 WeakPolarHBondContact O-CA 3.45Å; I915-C1004 HydrophobicContact CD1-CB 4.1Å; T986-C1004 CarbonylContact C-O 3.53Å; T986-C1004 VanDerWaalsContact CA-O 3.3Å; T986-C1004 WeakPolarHBondContact CA-O 3.39Å; F987-C1004 HydrophobicContact CD2-CB 4.05Å; F987-C1004 HydrophobicContact CE1-CB 4.5Å; F987-C1004 HydrophobicContact CE2-CB 3.63Å; F987-C1004 HydrophobicContact CZ-CB 3.89Å; F987-C1004 PolarHBondContact N-O 3.41Å; F987-C1004 PolarHBondContact O-N 2.84Å; V989-C1004 HydrophobicContact CG2-CB 4.48Å; I1002-C1004 PolarHBondContact O-N 3.29Å
1005	S	83.9	Confident	74.4	Confident	10 Å²	10	29 Å²	29	7%	0.07	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	113.3	178.9	-62.9	0	0	0	0	110.5	V913 V914 I915 T986	V913-S1005 PolarHBondContact O-N 3.16Å; V914-S1005 CarbonylContact C-O 3.59Å; V914-S1005 WeakPolarHBondContact CA-O 3.32Å; V914-S1005 WeakPolarHBondContact CG2-O 3.32Å; I915-S1005 PolarHBondContact N-O 2.8Å; T986-S1005 WeakPolarHBondContact CG2-OG 3.25Å; T986-S1005 PolarHBondContact OG1-OG 2.89Å
1006	V	86.7	Confident	74.6	Confident	1 Å²	1	25 Å²	25	1%	0.006	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	126.9	-179.5	-164.9	0	0	0	0	110.5	I663 I915 L917 L929 W965 P984 V985 F987	I663-V1006 HydrophobicContact CD1-CB 3.89Å; I663-V1006 HydrophobicContact CD1-CG1 3.36Å; I915-V1006 HydrophobicContact CB-CG2 4.44Å; I915-V1006 HydrophobicContact CD1-CG2 4.49Å; I915-V1006 WeakPolarHBondContact O-CA 3.37Å; L917-V1006 HydrophobicContact CD1-CG1 3.29Å; L929-V1006 HydrophobicContact CD1-CG1 4.05Å; L929-V1006 HydrophobicContact CD1-CG2 4.24Å; L929-V1006 HydrophobicContact CD2-CG2 3.96Å; W965-V1006 HydrophobicContact CH2-CG2 4.36Å; P984-V1006 WeakPolarHBondContact CA-O 3.25Å; P984-V1006 WeakPolarHBondContact CB-O 3.35Å; V985-V1006 PolarHBondContact N-O 3.3Å; V985-V1006 VanDerWaalsContact N-O 3.08Å; V985-V1006 PolarHBondContact O-N 3.42Å; F987-V1006 HydrophobicContact CD1-CG2 4.24Å; F987-V1006 HydrophobicContact CE1-CG2 3.47Å; F987-V1006 VanDerWaalsContact CE1-CG2 3.47Å; F987-V1006 HydrophobicContact CZ-CG2 4.26Å
1007	A	80	Confident	74.6	Confident	0 Å²	0	24.4 Å²	24.4	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	141.5	-175.8	0	0	0	0	0	111.3	V914 I915 C916 L917 P984 C1011 A1012	V914-A1007 HydrophobicContact CG2-CB 4.11Å; I915-A1007 PolarHBondContact O-N 2.95Å; C916-A1007 WeakPolarHBondContact CA-O 3.21Å; L917-A1007 PolarHBondContact N-O 2.99Å; P984-A1007 HydrophobicContact CB-CB 4.15Å; A1007-C1011 HydrophobicContact CB-CB 4.12Å; A1007-A1012 HydrophobicContact CB-CB 4.32Å
1008	S	83.8	Confident	75.2	Confident	0 Å²	0	24.2 Å²	24.2	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	158.2	156.9	57.2	0	0	0	0	111.6	D660 L917 C919 H1010 C1011 A1012	D660-S1008 WeakPolarHBondContact OD1-CB 3.35Å; D660-S1008 PolarHBondContact OD1-N 2.85Å; D660-S1008 VanDerWaalsContact OD1-N 3.09Å; D660-S1008 PolarHBondContact OD1-OG 3.21Å; D660-S1008 PolarHBondContact OD2-OG 2.87Å; L917-S1008 CarbonylContact O-C 3.57Å; L917-S1008 WeakPolarHBondContact O-CA 3.41Å; C919-S1008 WeakPolarHBondContact SG-CB 3.46Å; S1008-H1010 PolarHBondContact O-N 3.43Å; S1008-H1010 VanDerWaalsContact O-N 3.08Å; S1008-H1010 PolarHBondContact OG-CE1 3.27Å; S1008-H1010 PolarHBondContact OG-ND1 3Å; S1008-H1010 VanDerWaalsContact OG-ND1 3.11Å; S1008-H1010 PolarHBondContact OG-NE2 2.94Å; S1008-C1011 PolarHBondContact O-N 3.15Å; S1008-C1011 WeakPolarHBondContact OG-CB 3.39Å; S1008-C1011 PolarHBondContact OG-N 3.24Å; S1008-A1012 WeakPolarHBondContact O-CB 3.37Å; S1008-A1012 PolarHBondContact O-N 2.81Å
1009	Y	81.5	Confident	75.4	Confident	7 Å²	7	20.4 Å²	20.4	3%	0.027	10%	0.103	C	C	.	.	H	α-helix	trans	-48.9	-36.3	170.9	85.5	-90.3	0	0	0	114.2	L573 F643 L917 M918 C919 L1013 H1039	L573-Y1009 HydrophobicContact CD2-CE1 4.36Å; L573-Y1009 HydrophobicContact CD2-CE2 3.99Å; L573-Y1009 WeakPolarHBondContact CD2-OH 3.22Å; F643-Y1009 VanDerWaalsContact CE1-OH 3.25Å; F643-Y1009 WeakPolarHBondContact CE1-OH 3.33Å; L917-Y1009 PolarHBondContact O-N 3.21Å; M918-Y1009 HydrophobicContact CE-CD1 4.34Å; M918-Y1009 HydrophobicContact CE-CG 4.1Å; M918-Y1009 WeakPolarHBondContact SD-CB 3.44Å; M918-Y1009 HydrophobicContact SD-CD1 4.44Å; M918-Y1009 HydrophobicContact SD-CG 4.02Å; C919-Y1009 HydrophobicContact CB-CD1 4.06Å; C919-Y1009 HydrophobicContact CB-CE1 3.86Å; Y1009-L1013 VanDerWaalsContact O-CB 3.27Å; Y1009-L1013 WeakPolarHBondContact O-CB 3.48Å; Y1009-L1013 PolarHBondContact O-N 2.89Å; Y1009-H1039 AromaticContact CD2-CE1 3.31Å; Y1009-H1039 WeakPolarHBondContact CD2-CE1 3.49Å; Y1009-H1039 AromaticContact CD2-ND1 3.64Å; Y1009-H1039 AromaticContact CE2-CE1 3.49Å; Y1009-H1039 VanDerWaalsContact CE2-CE1 3.49Å; Y1009-H1039 WeakPolarHBondContact CE2-CE1 3.35Å
1010	H	79.3	Confident	75.5	Confident	0 Å²	0	18.1 Å²	18.1	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-85.4	-26	-177.4	63.3	66.2	0	0	0	112.5	F643 P647 C652 C658 D660 S1008 A1014	F643-H1010 HydrophobicContact CE1-CB 4.33Å; F643-H1010 HydrophobicContact CE2-CB 4.3Å; F643-H1010 HydrophobicContact CZ-CB 3.57Å; F643-H1010 AromaticContact CZ-CD2 3.58Å; F643-H1010 AromaticContact CZ-CG 3.62Å; P647-H1010 HydrophobicContact CB-CB 4.15Å; C652-H1010 PolarHBondContact SG-NE2 2.84Å; C658-H1010 PolarHBondContact SG-NE2 3.35Å; D660-H1010 IonicContact OD2-CE1 3.81Å; D660-H1010 PolarHBondContact OD2-CE1 2.97Å; D660-H1010 VanDerWaalsContact OD2-CE1 3.24Å; D660-H1010 IonicContact OD2-ND1 3.63Å; S1008-H1010 PolarHBondContact O-N 3.43Å; S1008-H1010 VanDerWaalsContact O-N 3.08Å; S1008-H1010 PolarHBondContact OG-CE1 3.27Å; S1008-H1010 PolarHBondContact OG-ND1 3Å; S1008-H1010 VanDerWaalsContact OG-ND1 3.11Å; S1008-H1010 PolarHBondContact OG-NE2 2.94Å; H1010-A1014 WeakPolarHBondContact O-CB 3.34Å; H1010-A1014 PolarHBondContact O-N 2.76Å
1011	C	77.8	Confident	75.1	Confident	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-69.9	-47.1	166.1	-173	0	0	0	0	109.7	A1007 S1008 L1013 A1014 L1015	A1007-C1011 HydrophobicContact CB-CB 4.12Å; S1008-C1011 PolarHBondContact O-N 3.15Å; S1008-C1011 WeakPolarHBondContact OG-CB 3.39Å; S1008-C1011 PolarHBondContact OG-N 3.24Å; C1011-L1013 PolarHBondContact O-N 2.65Å; C1011-A1014 CarbonylContact O-C 3.5Å; C1011-A1014 WeakPolarHBondContact O-CA 3.28Å; C1011-A1014 PolarHBondContact O-N 3.4Å; C1011-A1014 VanDerWaalsContact O-N 3.08Å; C1011-L1015 VanDerWaalsContact O-CG 3.27Å; C1011-L1015 WeakPolarHBondContact O-CG 3.34Å; C1011-L1015 PolarHBondContact O-N 2.82Å
1012	A	73.5	Confident	75.2	Confident	16 Å²	16	21.9 Å²	21.9	13%	0.132	12%	0.115	C	C	.	.	H	α-helix	trans	-54.3	-53.8	173.1	0	0	0	0	0	111.2	C916 A1007 S1008 A1014 L1015 T1016	C916-A1012 HydrophobicContact CB-CB 4.46Å; A1007-A1012 HydrophobicContact CB-CB 4.32Å; S1008-A1012 WeakPolarHBondContact O-CB 3.37Å; S1008-A1012 PolarHBondContact O-N 2.81Å; A1012-A1014 VanDerWaalsContact C-N 3.29Å; A1012-A1014 PolarHBondContact O-N 3.14Å; A1012-L1015 WeakPolarHBondContact O-CA 3.26Å; A1012-L1015 WeakPolarHBondContact O-CB 3.1Å; A1012-L1015 PolarHBondContact O-N 2.96Å; A1012-T1016 PolarHBondContact O-N 2.91Å; A1012-T1016 PolarHBondContact O-OG1 3.11Å
1013	L	71.7	Confident	75.3	Confident	34 Å²	34	23.1 Å²	23.1	18%	0.178	12%	0.122	C	C	.	.	H	α-helix	trans	-56.4	-39.7	174.4	-179.3	64.1	0	0	0	112.5	V580 L644 Y1009 C1011 L1015 T1016 L1017	V580-L1013 HydrophobicContact CG2-CD2 4.24Å; L644-L1013 HydrophobicContact CD2-CD2 3.98Å; Y1009-L1013 VanDerWaalsContact O-CB 3.27Å; Y1009-L1013 WeakPolarHBondContact O-CB 3.48Å; Y1009-L1013 PolarHBondContact O-N 2.89Å; C1011-L1013 PolarHBondContact O-N 2.65Å; L1013-L1015 VanDerWaalsContact C-N 3.33Å; L1013-T1016 PolarHBondContact O-N 2.99Å; L1013-L1017 HydrophobicContact CD1-CD1 4.11Å; L1013-L1017 HydrophobicContact CD1-CG 4.17Å; L1013-L1017 HydrophobicContact CG-CD1 3.93Å; L1013-L1017 HydrophobicContact CG-CG 4.38Å; L1013-L1017 VanDerWaalsContact O-CB 3.24Å; L1013-L1017 WeakPolarHBondContact O-CB 3.43Å; L1013-L1017 WeakPolarHBondContact O-CG 3.41Å; L1013-L1017 PolarHBondContact O-N 2.74Å
1014	A	69.6	Low	75.2	Confident	8 Å²	8	22.3 Å²	22.3	7%	0.066	12%	0.117	C	C	.	.	H	α-helix	trans	-72.1	-23.4	176.3	0	0	0	0	0	113.9	P647 H1010 C1011 A1012 K1018	P647-A1014 HydrophobicContact CB-CB 4.31Å; P647-A1014 HydrophobicContact CG-CB 4.12Å; H1010-A1014 WeakPolarHBondContact O-CB 3.34Å; H1010-A1014 PolarHBondContact O-N 2.76Å; C1011-A1014 CarbonylContact O-C 3.5Å; C1011-A1014 WeakPolarHBondContact O-CA 3.28Å; C1011-A1014 PolarHBondContact O-N 3.4Å; C1011-A1014 VanDerWaalsContact O-N 3.08Å; A1012-A1014 VanDerWaalsContact C-N 3.29Å; A1012-A1014 PolarHBondContact O-N 3.14Å; A1014-K1018 VanDerWaalsContact O-CD 3.25Å; A1014-K1018 WeakPolarHBondContact O-CD 3.33Å; A1014-K1018 WeakPolarHBondContact O-CE 3.23Å; A1014-K1018 VanDerWaalsContact O-CG 3.24Å; A1014-K1018 WeakPolarHBondContact O-CG 3.11Å
1015	L	69.1	Low	75.2	Confident	12 Å²	12	22.9 Å²	22.9	6%	0.063	12%	0.119	C	C	.	.	H	α-helix	trans	-77.2	-44	172.1	-69.6	169.1	0	0	0	110	P984 C1011 A1012 L1013 K1018 D1019 I1020 F1022	P984-L1015 HydrophobicContact CG-CD1 3.96Å; C1011-L1015 VanDerWaalsContact O-CG 3.27Å; C1011-L1015 WeakPolarHBondContact O-CG 3.34Å; C1011-L1015 PolarHBondContact O-N 2.82Å; A1012-L1015 WeakPolarHBondContact O-CA 3.26Å; A1012-L1015 WeakPolarHBondContact O-CB 3.1Å; A1012-L1015 PolarHBondContact O-N 2.96Å; L1013-L1015 VanDerWaalsContact C-N 3.33Å; L1015-K1018 CarbonylContact O-C 3.55Å; L1015-K1018 VanDerWaalsContact O-C 3.22Å; L1015-K1018 WeakPolarHBondContact O-CA 3.49Å; L1015-K1018 PolarHBondContact O-N 3.01Å; L1015-K1018 VanDerWaalsContact O-N 3.09Å; L1015-D1019 PolarHBondContact O-N 3.4Å; L1015-I1020 HydrophobicContact CB-CB 4.26Å; L1015-I1020 HydrophobicContact CD2-CB 4.21Å; L1015-I1020 HydrophobicContact CD2-CD1 3.59Å; L1015-I1020 HydrophobicContact CD2-CG1 4.48Å; L1015-I1020 HydrophobicContact CD2-CG2 4.35Å; L1015-I1020 PolarHBondContact O-N 3.26Å; L1015-F1022 HydrophobicContact CD1-CE2 4.33Å; L1015-F1022 HydrophobicContact CD1-CZ 4.26Å
1016	T	65	Low	75.4	Confident	27 Å²	27	22.5 Å²	22.5	17%	0.166	12%	0.116	C	C	.	.	H	α-helix	trans	-73.7	-29.5	176.7	0.6	0	0	0	0	113.3	A1012 L1013 K1018 D1019 L1066	A1012-T1016 PolarHBondContact O-N 2.91Å; A1012-T1016 PolarHBondContact O-OG1 3.11Å; L1013-T1016 PolarHBondContact O-N 2.99Å; T1016-K1018 PolarHBondContact O-N 2.76Å; T1016-D1019 WeakPolarHBondContact O-CA 3.34Å; T1016-D1019 PolarHBondContact O-N 3.1Å; T1016-L1066 VanDerWaalsContact CB-CD2 3.48Å; T1016-L1066 HydrophobicContact CG2-CD2 3.47Å; T1016-L1066 VanDerWaalsContact CG2-CD2 3.47Å
1017	L	63.2	Low	75.4	Confident	19 Å²	19	23.7 Å²	23.7	10%	0.099	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	0.9	167.1	-71.3	173.9	0	0	0	113.9	M583 L1013	M583-L1017 HydrophobicContact SD-CD1 4.35Å; L1013-L1017 HydrophobicContact CD1-CD1 4.11Å; L1013-L1017 HydrophobicContact CD1-CG 4.17Å; L1013-L1017 HydrophobicContact CG-CD1 3.93Å; L1013-L1017 HydrophobicContact CG-CG 4.38Å; L1013-L1017 VanDerWaalsContact O-CB 3.24Å; L1013-L1017 WeakPolarHBondContact O-CB 3.43Å; L1013-L1017 WeakPolarHBondContact O-CG 3.41Å; L1013-L1017 PolarHBondContact O-N 2.74Å
1018	K	65.1	Low	75.9	Confident	100 Å²	100	23.8 Å²	23.8	44%	0.435	12%	0.122	S	C	.	.	T	Hydrogen-bonded Turn	trans	-123.8	8.3	166.4	-61.2	168.4	-169.1	159.6	0	111.3	A1014 L1015 T1016 I1020	A1014-K1018 VanDerWaalsContact O-CD 3.25Å; A1014-K1018 WeakPolarHBondContact O-CD 3.33Å; A1014-K1018 WeakPolarHBondContact O-CE 3.23Å; A1014-K1018 VanDerWaalsContact O-CG 3.24Å; A1014-K1018 WeakPolarHBondContact O-CG 3.11Å; L1015-K1018 CarbonylContact O-C 3.55Å; L1015-K1018 VanDerWaalsContact O-C 3.22Å; L1015-K1018 WeakPolarHBondContact O-CA 3.49Å; L1015-K1018 PolarHBondContact O-N 3.01Å; L1015-K1018 VanDerWaalsContact O-N 3.09Å; T1016-K1018 PolarHBondContact O-N 2.76Å; K1018-I1020 VanDerWaalsContact C-N 3.34Å; K1018-I1020 PolarHBondContact O-N 3.19Å
1019	D	63.7	Low	76.1	Confident	17 Å²	17	23.8 Å²	23.8	9%	0.091	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.2	41	-179.8	-36.8	-100.4	0	0	0	116.4	L1015 T1016 L1021 L1180 W1184	L1015-D1019 PolarHBondContact O-N 3.4Å; T1016-D1019 WeakPolarHBondContact O-CA 3.34Å; T1016-D1019 PolarHBondContact O-N 3.1Å; D1019-L1021 PolarHBondContact O-N 2.95Å; D1019-L1180 HydrophobicContact CB-CB 4.05Å; D1019-L1180 HydrophobicContact CB-CD1 3.61Å; D1019-L1180 HydrophobicContact CB-CD2 3.26Å; D1019-L1180 HydrophobicContact CB-CG 3.72Å; D1019-W1184 PolarHBondContact OD1-NE1 3.25Å; D1019-W1184 VanDerWaalsContact OD2-CD1 3.26Å; D1019-W1184 PolarHBondContact OD2-NE1 3.14Å
1020	I	66	Low	76.5	Confident	81 Å²	81	23.5 Å²	23.5	42%	0.415	12%	0.12	S	C	.	.			trans	-78.6	108	168.4	-65.2	165.9	0	0	0	108.1	L1015 K1018 F1022	L1015-I1020 HydrophobicContact CB-CB 4.26Å; L1015-I1020 HydrophobicContact CD2-CB 4.21Å; L1015-I1020 HydrophobicContact CD2-CD1 3.59Å; L1015-I1020 HydrophobicContact CD2-CG1 4.48Å; L1015-I1020 HydrophobicContact CD2-CG2 4.35Å; L1015-I1020 PolarHBondContact O-N 3.26Å; K1018-I1020 VanDerWaalsContact C-N 3.34Å; K1018-I1020 PolarHBondContact O-N 3.19Å; I1020-F1022 HydrophobicContact CG2-CE2 4.06Å; I1020-F1022 HydrophobicContact CG2-CZ 4.09Å
1021	L	67.9	Low	76.8	Confident	91 Å²	91	23.5 Å²	23.5	48%	0.476	12%	0.12	S	C	.	.			trans	-99.3	150.8	-177.1	-59.8	177.3	0	0	0	112.4	D1019	D1019-L1021 PolarHBondContact O-N 2.95Å
1022	F	77.4	Confident	77.1	Confident	20 Å²	20	26.4 Å²	26.4	9%	0.088	13%	0.133	C	C	.	.			trans	-119.8	163.9	179.8	-61.9	-95.4	0	0	0	111.8	V914 L1015 I1020 Y1025 K1071	V914-F1022 HydrophobicContact CB-CB 4.36Å; V914-F1022 HydrophobicContact CB-CD1 3.9Å; V914-F1022 HydrophobicContact CB-CD2 3.62Å; V914-F1022 HydrophobicContact CB-CE1 4.07Å; V914-F1022 HydrophobicContact CB-CE2 3.81Å; V914-F1022 HydrophobicContact CB-CG 3.68Å; V914-F1022 HydrophobicContact CB-CZ 4.03Å; V914-F1022 HydrophobicContact CG1-CB 4.13Å; V914-F1022 HydrophobicContact CG1-CD2 3.61Å; V914-F1022 HydrophobicContact CG1-CE2 4.16Å; V914-F1022 HydrophobicContact CG1-CG 3.84Å; V914-F1022 HydrophobicContact CG2-CD2 4.41Å; V914-F1022 HydrophobicContact CG2-CE2 4.14Å; V914-F1022 HydrophobicContact CG2-CZ 4.27Å; L1015-F1022 HydrophobicContact CD1-CE2 4.33Å; L1015-F1022 HydrophobicContact CD1-CZ 4.26Å; I1020-F1022 HydrophobicContact CG2-CE2 4.06Å; I1020-F1022 HydrophobicContact CG2-CZ 4.09Å; F1022-Y1025 HydrophobicContact CB-CE1 4.31Å; F1022-Y1025 HydrophobicContact CB-CE2 4.47Å; F1022-Y1025 HydrophobicContact CD2-CE1 4.16Å; F1022-Y1025 PolarHBondContact N-OH 2.92Å; F1022-K1071 WeakPolarHBondContact O-CE 3.42Å
1023	D	84.4	Confident	77.7	Confident	26 Å²	26	26.4 Å²	26.4	14%	0.139	13%	0.13	C	C	.	.	S	Bend	trans	-76.9	-20.9	175.6	-62	-55	0	0	0	114.4	T912 K1071 P1072 V1129 K1133	T912-D1023 PolarHBondContact N-OD2 2.91Å; T912-D1023 CarbonylContact O-C 3.6Å; T912-D1023 VanDerWaalsContact O-CA 3.25Å; T912-D1023 WeakPolarHBondContact O-CA 3.49Å; T912-D1023 WeakPolarHBondContact O-CB 3.46Å; T912-D1023 PolarHBondContact O-N 3.49Å; T912-D1023 PolarHBondContact OG1-N 3.33Å; T912-D1023 VanDerWaalsContact OG1-N 3.09Å; T912-D1023 PolarHBondContact OG1-OD2 3.37Å; D1023-K1071 IonicContact OD1-NZ 3.54Å; D1023-K1071 PolarHBondContact OD1-NZ 3.43Å; D1023-P1072 VanDerWaalsContact O-CD 3.28Å; D1023-P1072 WeakPolarHBondContact O-CD 3.39Å; D1023-V1129 HydrophobicContact CB-CG1 4.07Å; D1023-K1133 HydrophobicContact CB-CD 4.38Å; D1023-K1133 WeakPolarHBondContact OD2-CE 3.38Å; D1023-K1133 IonicContact OD2-NZ 3.73Å; D1023-K1133 PolarHBondContact OD2-NZ 2.9Å
1024	G	83.9	Confident	78.5	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	157.1	171.2	0	0	0	0	0	112	T912 V913 V914 P1072	T912-G1024 PolarHBondContact O-N 3.04Å; T912-G1024 VanDerWaalsContact O-N 3.08Å; V913-G1024 VanDerWaalsContact CA-O 3.32Å; V913-G1024 WeakPolarHBondContact CA-O 3.48Å; V914-G1024 PolarHBondContact N-O 3.08Å; G1024-P1072 WeakPolarHBondContact CA-O 3.41Å
1025	Y	84.8	Confident	79.2	Confident	12 Å²	12	28.1 Å²	28.1	5%	0.047	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	124.1	-176.6	-59.7	-100.9	0	0	0	110.5	V914 F1022 F1027 L1067 K1071 P1072 M1073 M1074	V914-Y1025 HydrophobicContact CG1-CD1 3.2Å; V914-Y1025 HydrophobicContact CG1-CE1 3.64Å; V914-Y1025 HydrophobicContact CG1-CG 3.97Å; F1022-Y1025 HydrophobicContact CB-CE1 4.31Å; F1022-Y1025 HydrophobicContact CB-CE2 4.47Å; F1022-Y1025 HydrophobicContact CD2-CE1 4.16Å; F1022-Y1025 PolarHBondContact N-OH 2.92Å; Y1025-F1027 HydrophobicContact CD1-CZ 4.31Å; Y1025-F1027 HydrophobicContact CG-CZ 4.39Å; Y1025-L1067 HydrophobicContact CD1-CD2 3.79Å; Y1025-L1067 HydrophobicContact CD2-CD2 3.89Å; Y1025-L1067 HydrophobicContact CE1-CD2 3.79Å; Y1025-L1067 HydrophobicContact CE2-CD2 3.89Å; Y1025-L1067 HydrophobicContact CG-CD2 3.87Å; Y1025-K1071 HydrophobicContact CD2-CB 4.28Å; Y1025-K1071 HydrophobicContact CE2-CB 4.04Å; Y1025-K1071 HydrophobicContact CE2-CG 4.27Å; Y1025-P1072 PolarHBondContact N-O 3.42Å; Y1025-P1072 VanDerWaalsContact N-O 3.08Å; Y1025-M1073 CarbonylContact O-C 3.57Å; Y1025-M1073 WeakPolarHBondContact O-CA 3.43Å; Y1025-M1074 PolarHBondContact O-N 3.44Å
1026	M	88.2	Confident	79.9	Confident	1 Å²	1	27.5 Å²	27.5	1%	0.005	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	117.2	172.4	-64.4	174.5	66.2	0	0	108.7	V913 V914 I915 C916 M1074 Y1122 F1125	V913-M1026 HydrophobicContact CG1-CG 3.97Å; V913-M1026 HydrophobicContact CG1-SD 3.9Å; V914-M1026 PolarHBondContact O-N 3.18Å; I915-M1026 HydrophobicContact CD1-SD 4.25Å; I915-M1026 HydrophobicContact CG1-CB 4.29Å; I915-M1026 HydrophobicContact CG1-SD 4.02Å; I915-M1026 HydrophobicContact CG2-CB 4.36Å; C916-M1026 PolarHBondContact N-O 2.83Å; M1026-M1074 CarbonylContact C-O 3.55Å; M1026-M1074 WeakPolarHBondContact CA-O 3.44Å; M1026-M1074 HydrophobicContact CE-SD 4.24Å; M1026-M1074 HydrophobicContact CG-CB 4.34Å; M1026-Y1122 HydrophobicContact CE-CD1 3.35Å; M1026-Y1122 HydrophobicContact CE-CD2 4.47Å; M1026-Y1122 HydrophobicContact CE-CE1 3.33Å; M1026-Y1122 HydrophobicContact CE-CE2 4.42Å; M1026-Y1122 HydrophobicContact CE-CG 3.94Å; M1026-F1125 HydrophobicContact CG-CD1 4.17Å; M1026-F1125 HydrophobicContact CG-CE1 3.53Å; M1026-F1125 HydrophobicContact CG-CE2 4.47Å; M1026-F1125 HydrophobicContact CG-CZ 3.7Å; M1026-F1125 HydrophobicContact SD-CD1 4.11Å; M1026-F1125 HydrophobicContact SD-CE1 3.73Å; M1026-F1125 HydrophobicContact SD-CZ 4.49Å
1027	F	87.6	Confident	80.7	Confident	27 Å²	27	26.3 Å²	26.3	12%	0.118	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	114.2	177.6	-61.8	-71.2	0	0	0	109.2	C916 Y1025 L1040 L1067 M1073 M1074 F1075 V1076	C916-F1027 HydrophobicContact CB-CD1 3.87Å; C916-F1027 HydrophobicContact CB-CE1 4.25Å; Y1025-F1027 HydrophobicContact CD1-CZ 4.31Å; Y1025-F1027 HydrophobicContact CG-CZ 4.39Å; F1027-L1040 HydrophobicContact CB-CD1 3.81Å; F1027-L1040 HydrophobicContact CB-CD2 3.78Å; F1027-L1040 HydrophobicContact CB-CG 4.48Å; F1027-L1040 HydrophobicContact CD1-CD2 3.46Å; F1027-L1040 VanDerWaalsContact CD1-CD2 3.46Å; F1027-L1040 HydrophobicContact CD2-CD2 4.44Å; F1027-L1040 HydrophobicContact CE1-CD2 4.14Å; F1027-L1040 HydrophobicContact CG-CD1 4.49Å; F1027-L1040 HydrophobicContact CG-CD2 3.64Å; F1027-L1067 HydrophobicContact CE2-CD1 4.31Å; F1027-L1067 HydrophobicContact CZ-CD1 4.08Å; F1027-L1067 HydrophobicContact CZ-CD2 4.44Å; F1027-M1073 HydrophobicContact CE2-CG 4.44Å; F1027-M1073 HydrophobicContact CE2-SD 4.47Å; F1027-M1074 PolarHBondContact N-O 2.65Å; F1027-F1075 HydrophobicContact CD2-CD2 4.5Å; F1027-F1075 HydrophobicContact CD2-CE2 4.1Å; F1027-F1075 HydrophobicContact CD2-CZ 4.24Å; F1027-F1075 WeakPolarHBondContact O-CA 3.37Å; F1027-V1076 PolarHBondContact O-N 3.08Å
1028	I	89.7	Confident	81.3	Confident	2 Å²	2	26 Å²	26	1%	0.01	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	124.7	-176.7	-46.1	-169.4	0	0	0	108.7	I915 C916 L917 F923 V928 V1076 V1078	I915-I1028 HydrophobicContact CG2-CD1 3.48Å; I915-I1028 VanDerWaalsContact CG2-CD1 3.48Å; I915-I1028 HydrophobicContact CG2-CG1 4.06Å; C916-I1028 PolarHBondContact O-N 3.05Å; L917-I1028 HydrophobicContact CD2-CB 4.41Å; L917-I1028 HydrophobicContact CD2-CD1 4.36Å; L917-I1028 HydrophobicContact CG-CB 4.27Å; L917-I1028 HydrophobicContact CG-CD1 4.37Å; F923-I1028 HydrophobicContact CE2-CG2 3.86Å; F923-I1028 HydrophobicContact CZ-CG2 3.58Å; V928-I1028 HydrophobicContact CB-CD1 3.81Å; V928-I1028 HydrophobicContact CB-CG2 4.49Å; V928-I1028 HydrophobicContact CG1-CD1 4.34Å; V928-I1028 HydrophobicContact CG1-CG2 4.03Å; V928-I1028 HydrophobicContact CG2-CD1 3.62Å; V928-I1028 HydrophobicContact CG2-CG2 4.2Å; I1028-V1076 WeakPolarHBondContact CA-O 3.48Å; I1028-V1076 HydrophobicContact CB-CB 4.44Å; I1028-V1076 HydrophobicContact CG1-CB 4.15Å; I1028-V1076 HydrophobicContact CG1-CG2 4.39Å; I1028-V1076 HydrophobicContact CG2-CB 4.17Å; I1028-V1076 HydrophobicContact CG2-CG1 4.35Å; I1028-V1078 HydrophobicContact CG2-CG2 3.51Å
1029	Y	88.8	Confident	81.3	Confident	0 Å²	0	23.1 Å²	23.1	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	145.7	-174	80.5	-82.2	0	0	0	111.9	P1031 S1036 L1037 L1040 V1076 A1077 V1078 L1093 F1108	Y1029-P1031 HydrophobicContact CE2-CB 4.31Å; Y1029-S1036 VanDerWaalsContact CA-OG 3.29Å; Y1029-S1036 WeakPolarHBondContact CA-OG 3.44Å; Y1029-S1036 VanDerWaalsContact CB-OG 3.25Å; Y1029-S1036 WeakPolarHBondContact CB-OG 3.24Å; Y1029-L1037 HydrophobicContact CD2-CB 4.08Å; Y1029-L1037 HydrophobicContact CD2-CD1 4.35Å; Y1029-L1037 HydrophobicContact CE2-CB 4.31Å; Y1029-L1037 HydrophobicContact CE2-CD1 4.19Å; Y1029-L1040 HydrophobicContact CD1-CD1 4.42Å; Y1029-V1076 WeakPolarHBondContact CD1-O 3.38Å; Y1029-V1076 PolarHBondContact N-O 2.92Å; Y1029-A1077 HydrophobicContact CD1-CB 4.48Å; Y1029-A1077 HydrophobicContact CE1-CB 3.65Å; Y1029-A1077 HydrophobicContact CE2-CB 4.32Å; Y1029-A1077 WeakPolarHBondContact OH-CB 3.39Å; Y1029-V1078 PolarHBondContact O-N 3.49Å; Y1029-L1093 PolarHBondContact OH-O 3.33Å; Y1029-F1108 HydrophobicContact CE1-CE2 4.08Å; Y1029-F1108 VanDerWaalsContact OH-CE2 3.31Å; Y1029-F1108 WeakPolarHBondContact OH-CE2 3.44Å; Y1029-F1108 WeakPolarHBondContact OH-CZ 3.5Å
1030	S	89	Confident	81.5	Confident	0 Å²	0	23 Å²	23	0%	0	11%	0.11	C	C	.	.			trans	-82.3	124.6	168.4	-179.7	0	0	0	0	110.6	D921 D922 K1032 R1033 S1036	D921-S1030 WeakPolarHBondContact OD2-CB 3.44Å; D921-S1030 PolarHBondContact OD2-N 2.87Å; D922-S1030 WeakPolarHBondContact OD1-CB 3.39Å; D922-S1030 PolarHBondContact OD1-OG 3.05Å; S1030-K1032 PolarHBondContact O-N 3.42Å; S1030-K1032 PolarHBondContact OG-N 3.12Å; S1030-R1033 PolarHBondContact O-N 3.1Å; S1030-S1036 PolarHBondContact N-OG 2.71Å
1031	P	86.8	Confident	81.1	Confident	0 Å²	0	23.1 Å²	23.1	0%	0	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-12.4	173.9	31.1	-33.6	0	0	0	112.5	Y1029 R1033 V1078 A1090 L1093 I1094	Y1029-P1031 HydrophobicContact CE2-CB 4.31Å; P1031-R1033 PolarHBondContact O-N 3.09Å; P1031-V1078 VanDerWaalsContact CD-O 3.26Å; P1031-V1078 WeakPolarHBondContact CD-O 3.44Å; P1031-A1090 WeakPolarHBondContact O-CA 3.46Å; P1031-L1093 WeakPolarHBondContact O-CD1 3.16Å; P1031-I1094 HydrophobicContact CB-CD1 3.9Å; P1031-I1094 HydrophobicContact CB-CG1 3.49Å; P1031-I1094 VanDerWaalsContact CB-CG1 3.49Å; P1031-I1094 HydrophobicContact CG-CD1 4.05Å; P1031-I1094 HydrophobicContact CG-CG1 4.09Å
1032	K	84.7	Confident	80.3	Confident	62 Å²	62	20.9 Å²	20.9	27%	0.27	9%	0.094	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.6	1.3	172.6	-81.6	174.5	157.7	152.2	0	114.3	E542 D922 S1030 D1083	E542-K1032 IonicContact OE1-NZ 3.68Å; D922-K1032 WeakPolarHBondContact OD2-CD 3.23Å; S1030-K1032 PolarHBondContact O-N 3.42Å; S1030-K1032 PolarHBondContact OG-N 3.12Å; K1032-D1083 WeakPolarHBondContact CE-OD1 3.41Å; K1032-D1083 WeakPolarHBondContact CE-OD2 3.42Å; K1032-D1083 IonicContact NZ-OD1 2.84Å; K1032-D1083 PolarHBondContact NZ-OD1 3.24Å; K1032-D1083 IonicContact NZ-OD2 2.76Å; K1032-D1083 PolarHBondContact NZ-OD2 3.4Å
1033	R	86.3	Confident	78.9	Confident	16 Å²	16	21.7 Å²	21.7	6%	0.06	10%	0.104	C	C	.	.			trans	-143.5	97	-167.6	-172	171.3	174.8	-122.1	-3.5	112	E570 C919 D921 S1030 P1031 S1035 S1036	E570-R1033 IonicContact OE1-CZ 3.81Å; E570-R1033 IonicContact OE1-NE 3.35Å; E570-R1033 PolarHBondContact OE1-NE 3.23Å; E570-R1033 IonicContact OE1-NH2 2.74Å; E570-R1033 IonicContact OE2-CZ 3.29Å; E570-R1033 IonicContact OE2-NE 3.93Å; E570-R1033 PolarHBondContact OE2-NE 3.26Å; E570-R1033 VanDerWaalsContact OE2-NE 3.14Å; E570-R1033 IonicContact OE2-NH2 2.7Å; E570-R1033 PolarHBondContact OE2-NH2 3.33Å; C919-R1033 PolarHBondContact O-NH1 2.87Å; C919-R1033 PolarHBondContact O-NH2 2.89Å; D921-R1033 IonicContact OD1-CZ 2.97Å; D921-R1033 IonicContact OD1-NH1 2.64Å; D921-R1033 PolarHBondContact OD1-NH1 2.96Å; S1030-R1033 PolarHBondContact O-N 3.1Å; P1031-R1033 PolarHBondContact O-N 3.09Å; R1033-S1035 WeakPolarHBondContact CG-OG 3.48Å; R1033-S1035 VanDerWaalsContact CZ-OG 3.31Å; R1033-S1035 PolarHBondContact NE-OG 2.8Å; R1033-S1035 VanDerWaalsContact NE-OG 3.16Å; R1033-S1035 PolarHBondContact NH2-OG 2.9Å; R1033-S1035 PolarHBondContact O-N 2.85Å; R1033-S1035 VanDerWaalsContact O-N 3.11Å; R1033-S1036 WeakPolarHBondContact O-CA 3.44Å; R1033-S1036 WeakPolarHBondContact O-CB 3.24Å; R1033-S1036 PolarHBondContact O-N 2.97Å
1034	R	86.5	Confident	76.7	Confident	77 Å²	77	24.3 Å²	24.3	29%	0.291	12%	0.115	S	C	.	.	H	α-helix	trans	-49.8	-39.7	-179	-171.4	159.2	-158.2	117.3	18.1	114.3	E574 S1036 L1037 A1038 L1093 E1096	E574-R1034 HydrophobicContact CG-CG 4.39Å; R1034-S1036 PolarHBondContact O-N 2.92Å; R1034-L1037 PolarHBondContact O-N 2.92Å; R1034-A1038 WeakPolarHBondContact O-CB 3.45Å; R1034-A1038 PolarHBondContact O-N 2.89Å; R1034-L1093 HydrophobicContact CB-CD1 4.04Å; R1034-L1093 HydrophobicContact CB-CD2 4.17Å; R1034-L1093 HydrophobicContact CG-CD2 3.99Å; R1034-E1096 IonicContact CZ-OE1 2.68Å; R1034-E1096 IonicContact CZ-OE2 2.63Å; R1034-E1096 IonicContact NH1-OE1 3.03Å; R1034-E1096 VanDerWaalsContact NH2-CD 3.26Å; R1034-E1096 IonicContact NH2-OE1 2.66Å; R1034-E1096 PolarHBondContact NH2-OE1 3.41Å; R1034-E1096 IonicContact NH2-OE2 3.25Å; R1034-E1096 PolarHBondContact NH2-OE2 2.88Å
1035	S	84.2	Confident	74.5	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-60.8	-24.5	175.8	69.6	0	0	0	0	114.5	E570 R1033 H1039	E570-S1035 PolarHBondContact OE2-OG 2.83Å; R1033-S1035 WeakPolarHBondContact CG-OG 3.48Å; R1033-S1035 VanDerWaalsContact CZ-OG 3.31Å; R1033-S1035 PolarHBondContact NE-OG 2.8Å; R1033-S1035 VanDerWaalsContact NE-OG 3.16Å; R1033-S1035 PolarHBondContact NH2-OG 2.9Å; R1033-S1035 PolarHBondContact O-N 2.85Å; R1033-S1035 VanDerWaalsContact O-N 3.11Å; S1035-H1039 PolarHBondContact O-CD2 3.02Å
1036	S	85.2	Confident	72	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-72.2	-36.2	178.3	-164.7	0	0	0	0	111.8	M918 D921 Y1029 S1030 R1033 R1034	M918-S1036 WeakPolarHBondContact CB-OG 3.11Å; M918-S1036 VanDerWaalsContact CG-OG 3.22Å; M918-S1036 WeakPolarHBondContact CG-OG 3.28Å; D921-S1036 PolarHBondContact OD1-OG 2.8Å; D921-S1036 PolarHBondContact OD2-OG 3.1Å; Y1029-S1036 VanDerWaalsContact CA-OG 3.29Å; Y1029-S1036 WeakPolarHBondContact CA-OG 3.44Å; Y1029-S1036 VanDerWaalsContact CB-OG 3.25Å; Y1029-S1036 WeakPolarHBondContact CB-OG 3.24Å; S1030-S1036 PolarHBondContact N-OG 2.71Å; R1033-S1036 WeakPolarHBondContact O-CA 3.44Å; R1033-S1036 WeakPolarHBondContact O-CB 3.24Å; R1033-S1036 PolarHBondContact O-N 2.97Å; R1034-S1036 PolarHBondContact O-N 2.92Å
1037	L	82.4	Confident	69.2	Low	1 Å²	1	36.6 Å²	36.6	1%	0.005	19%	0.193	C	C	.	.	H	α-helix	trans	-86.5	-36	175.7	-177.7	62.9	0	0	0	112.8	Y1029 R1034 H1039 L1040 E1041 L1093 E1096 L1100	Y1029-L1037 HydrophobicContact CD2-CB 4.08Å; Y1029-L1037 HydrophobicContact CD2-CD1 4.35Å; Y1029-L1037 HydrophobicContact CE2-CB 4.31Å; Y1029-L1037 HydrophobicContact CE2-CD1 4.19Å; R1034-L1037 PolarHBondContact O-N 2.92Å; L1037-H1039 PolarHBondContact O-N 3.25Å; L1037-H1039 VanDerWaalsContact O-N 3.12Å; L1037-L1040 HydrophobicContact CD1-CB 4.43Å; L1037-L1040 HydrophobicContact CD1-CD1 4.21Å; L1037-L1040 WeakPolarHBondContact O-CA 3.21Å; L1037-L1040 VanDerWaalsContact O-CB 3.31Å; L1037-L1040 WeakPolarHBondContact O-CB 3.43Å; L1037-L1040 PolarHBondContact O-N 3.12Å; L1037-E1041 PolarHBondContact O-N 2.94Å; L1037-E1041 VanDerWaalsContact O-N 3.14Å; L1037-L1093 HydrophobicContact CB-CD2 4.26Å; L1037-L1093 HydrophobicContact CD2-CB 4.42Å; L1037-L1093 HydrophobicContact CD2-CD2 3.78Å; L1037-L1093 WeakPolarHBondContact CD2-O 3.43Å; L1037-E1096 HydrophobicContact CD2-CB 3.58Å; L1037-L1100 HydrophobicContact CD1-CD2 4.09Å
1038	A	74.7	Confident	66.5	Low	14 Å²	14	44.9 Å²	44.9	12%	0.116	23%	0.23	C	C	.	.	H	α-helix	trans	-59.3	-27.6	-176.9	0	0	0	0	0	113.8	E574 R1034 L1040	E574-A1038 HydrophobicContact CB-CB 4.29Å; E574-A1038 HydrophobicContact CG-CB 4.15Å; R1034-A1038 WeakPolarHBondContact O-CB 3.45Å; R1034-A1038 PolarHBondContact O-N 2.89Å; A1038-L1040 PolarHBondContact O-N 2.82Å
1039	H	66.3	Low	63.5	Low	38 Å²	38	48.9 Å²	48.9	18%	0.176	26%	0.263	C	S	.	.	H	α-helix	trans	-65.9	-23.9	171.3	-91.1	-112.6	0	0	0	113.6	L573 M918 Y1009 S1035 L1037	L573-H1039 VanDerWaalsContact CD2-NE2 3.31Å; L573-H1039 WeakPolarHBondContact CD2-NE2 3.18Å; L573-H1039 PolarHBondContact O-CD2 2.85Å; L573-H1039 PolarHBondContact O-NE2 3Å; M918-H1039 HydrophobicContact CE-CB 3.76Å; M918-H1039 VanDerWaalsContact CE-CG 3.44Å; M918-H1039 HydrophobicContact SD-CB 4.08Å; Y1009-H1039 AromaticContact CD2-CE1 3.31Å; Y1009-H1039 WeakPolarHBondContact CD2-CE1 3.49Å; Y1009-H1039 AromaticContact CD2-ND1 3.64Å; Y1009-H1039 AromaticContact CE2-CE1 3.49Å; Y1009-H1039 VanDerWaalsContact CE2-CE1 3.49Å; Y1009-H1039 WeakPolarHBondContact CE2-CE1 3.35Å; S1035-H1039 PolarHBondContact O-CD2 3.02Å; L1037-H1039 PolarHBondContact O-N 3.25Å; L1037-H1039 VanDerWaalsContact O-N 3.12Å
1040	L	66	Low	60.5	Low	16 Å²	16	57.7 Å²	57.7	8%	0.084	31%	0.307	C	S	.	.	H	α-helix	trans	-91.3	-36.7	178.5	-51.9	178.5	0	0	0	111.6	F1027 Y1029 L1037 A1038 Y1042 A1043 F1075 L1100	F1027-L1040 HydrophobicContact CB-CD1 3.81Å; F1027-L1040 HydrophobicContact CB-CD2 3.78Å; F1027-L1040 HydrophobicContact CB-CG 4.48Å; F1027-L1040 HydrophobicContact CD1-CD2 3.46Å; F1027-L1040 VanDerWaalsContact CD1-CD2 3.46Å; F1027-L1040 HydrophobicContact CD2-CD2 4.44Å; F1027-L1040 HydrophobicContact CE1-CD2 4.14Å; F1027-L1040 HydrophobicContact CG-CD1 4.49Å; F1027-L1040 HydrophobicContact CG-CD2 3.64Å; Y1029-L1040 HydrophobicContact CD1-CD1 4.42Å; L1037-L1040 HydrophobicContact CD1-CB 4.43Å; L1037-L1040 HydrophobicContact CD1-CD1 4.21Å; L1037-L1040 WeakPolarHBondContact O-CA 3.21Å; L1037-L1040 VanDerWaalsContact O-CB 3.31Å; L1037-L1040 WeakPolarHBondContact O-CB 3.43Å; L1037-L1040 PolarHBondContact O-N 3.12Å; A1038-L1040 PolarHBondContact O-N 2.82Å; L1040-Y1042 PolarHBondContact O-N 2.63Å; L1040-Y1042 VanDerWaalsContact O-N 3.11Å; L1040-A1043 VanDerWaalsContact O-CB 3.27Å; L1040-A1043 WeakPolarHBondContact O-CB 3.48Å; L1040-A1043 PolarHBondContact O-N 3.16Å; L1040-F1075 HydrophobicContact CB-CE1 3.92Å; L1040-F1075 HydrophobicContact CD1-CD1 3.8Å; L1040-F1075 HydrophobicContact CD1-CE1 3.69Å; L1040-F1075 HydrophobicContact CG-CE1 4.33Å; L1040-L1100 HydrophobicContact CB-CD2 3.75Å
1041	E	58.4	Low	57.8	Low	83 Å²	83	64.2 Å²	64.2	39%	0.388	35%	0.346	S	S	.	.	H	α-helix	trans	-52.5	-35.3	177.2	-80.2	-160.3	110.6	0	0	112.4	L1037 A1043 H1044 L1100	L1037-E1041 PolarHBondContact O-N 2.94Å; L1037-E1041 VanDerWaalsContact O-N 3.14Å; E1041-A1043 PolarHBondContact O-N 3.2Å; E1041-A1043 VanDerWaalsContact O-N 3.12Å; E1041-H1044 PolarHBondContact O-N 2.91Å; E1041-L1100 HydrophobicContact CG-CD2 4.24Å
1042	Y	52.1	Low	54.9	Low	44 Å²	44	70.8 Å²	70.8	17%	0.173	38%	0.381	C	S	.	.	G	3₁₀ helix	trans	-64.7	-17.3	-179.1	-143	-114.1	0	0	0	113.8	Y577 L1040 H1044 V1045 L1059 L1063	Y577-Y1042 VanDerWaalsContact CB-CE2 3.41Å; Y577-Y1042 VanDerWaalsContact CB-CZ 3.42Å; Y577-Y1042 HydrophobicContact CD1-CD2 4.35Å; Y577-Y1042 HydrophobicContact CD1-CE2 4.25Å; Y577-Y1042 AromaticContact CD2-CE2 3.73Å; Y577-Y1042 HydrophobicContact CD2-CE2 3.73Å; Y577-Y1042 AromaticContact CD2-CZ 3.88Å; Y577-Y1042 AromaticContact CG-CD2 3.96Å; Y577-Y1042 HydrophobicContact CG-CD2 3.96Å; Y577-Y1042 AromaticContact CG-CE2 3.54Å; Y577-Y1042 HydrophobicContact CG-CE2 3.54Å; Y577-Y1042 AromaticContact CG-CZ 3.89Å; L1040-Y1042 PolarHBondContact O-N 2.63Å; L1040-Y1042 VanDerWaalsContact O-N 3.11Å; Y1042-H1044 PolarHBondContact O-N 3.04Å; Y1042-V1045 HydrophobicContact CD2-CB 4.27Å; Y1042-V1045 HydrophobicContact CD2-CG2 3.73Å; Y1042-V1045 HydrophobicContact CE2-CB 4.23Å; Y1042-V1045 HydrophobicContact CE2-CG2 4.06Å; Y1042-L1059 HydrophobicContact CE1-CD2 3.54Å; Y1042-L1059 VanDerWaalsContact OH-CD1 3.26Å; Y1042-L1059 WeakPolarHBondContact OH-CD1 3.26Å; Y1042-L1059 WeakPolarHBondContact OH-CD2 3.46Å; Y1042-L1063 HydrophobicContact CD1-CD1 4.02Å; Y1042-L1063 HydrophobicContact CD1-CD2 3.83Å; Y1042-L1063 HydrophobicContact CD1-CG 4.41Å; Y1042-L1063 HydrophobicContact CE1-CD1 3.88Å; Y1042-L1063 HydrophobicContact CE1-CD2 4.3Å; Y1042-L1063 HydrophobicContact CE1-CG 4.44Å; Y1042-L1063 WeakPolarHBondContact O-CD1 3.39Å; Y1042-L1063 WeakPolarHBondContact O-CD2 3.47Å
1043	A	46.1	Very low	52.2	Low	37 Å²	37	76.5 Å²	76.5	31%	0.306	41%	0.406	S	S	.	.	G	3₁₀ helix	trans	-65.1	-18.6	169.9	0	0	0	0	0	113.3	L1040 E1041 L1067 M1104	L1040-A1043 VanDerWaalsContact O-CB 3.27Å; L1040-A1043 WeakPolarHBondContact O-CB 3.48Å; L1040-A1043 PolarHBondContact O-N 3.16Å; E1041-A1043 PolarHBondContact O-N 3.2Å; E1041-A1043 VanDerWaalsContact O-N 3.12Å; A1043-L1067 HydrophobicContact CB-CD1 4.41Å; A1043-M1104 HydrophobicContact CB-CE 3.64Å; A1043-M1104 HydrophobicContact CB-SD 4.02Å
1044	H	39.6	Very low	49.4	Very low	80 Å²	80	82.4 Å²	82.4	37%	0.37	44%	0.438	S	S	.	.	G	3₁₀ helix	trans	-127.6	23.2	-176.1	-142.2	-48.6	0	0	0	115	E1041 Y1042 G1046 L1100 K1103 M1104	E1041-H1044 PolarHBondContact O-N 2.91Å; Y1042-H1044 PolarHBondContact O-N 3.04Å; H1044-G1046 PolarHBondContact O-N 2.63Å; H1044-L1100 HydrophobicContact CB-CD1 3.71Å; H1044-K1103 VanDerWaalsContact CD2-C 3.48Å; H1044-K1103 PolarHBondContact CD2-O 2.92Å; H1044-K1103 VanDerWaalsContact NE2-C 3.3Å; H1044-K1103 PolarHBondContact NE2-O 3.24Å; H1044-M1104 HydrophobicContact CB-SD 4Å; H1044-M1104 PolarHBondContact CD2-SD 3.03Å
1045	V	38	Very low	46.7	Very low	82 Å²	82	83.1 Å²	83.1	50%	0.497	45%	0.447	S	S	.	.			trans	-78	64.4	171.6	-174.2	0	0	0	0	110.2	Y1042	Y1042-V1045 HydrophobicContact CD2-CB 4.27Å; Y1042-V1045 HydrophobicContact CD2-CG2 3.73Å; Y1042-V1045 HydrophobicContact CE2-CB 4.23Å; Y1042-V1045 HydrophobicContact CE2-CG2 4.06Å
1046	G	31.3	Very low	44	Very low	38 Å²	38	91.6 Å²	91.6	39%	0.392	48%	0.484	S	S	.	.			trans	-105.3	-7.6	-179	0	0	0	0	0	114.8	H1044	H1044-G1046 PolarHBondContact O-N 2.63Å
1047	N	28.8	Very low	41.4	Very low	151 Å²	151	102.6 Å²	102.6	81%	0.807	53%	0.526	S	S	*	.	S	Bend	trans	-173.1	107.7	168.8	-95.1	-38.5	0	0	0	111.4
1048	F	31.2	Very low	38.9	Very low	201 Å²	201	105.1 Å²	105.1	88%	0.882	54%	0.537	S	S	*	.				-176	161.9	119.1	-116.4	-99.3	0	0	0	111.5
1049	A	27.3	Very low	36.8	Very low	86 Å²	86	107 Å²	107	71%	0.711	54%	0.544	S	S	*	.			trans	-49.6	158.1	-164.4	0	0	0	0	0	119.5
1050	M	26.8	Very low	35	Very low	186 Å²	186	110.1 Å²	110.1	92%	0.916	56%	0.562	S	S	*	*			trans	71	109.5	-173.2	-52.8	-161.5	-172.9	0	0	113.4
1051	V	30.6	Very low	33.3	Very low	136 Å²	136	110.9 Å²	110.9	82%	0.824	57%	0.569	S	S	*	*			cis	-123.6	137.8	28.3	172.8	0	0	0	0	112.5	F1053	V1051-F1053 PolarHBondContact O-N 3.28Å
1052	N	26.7	Very low	32.1	Very low	138 Å²	138	107.2 Å²	107.2	74%	0.738	55%	0.552	S	S	*	*			trans	-80.8	102.4	163.7	-75.7	-39.1	0	0	0	109.4
1053	F	28.1	Very low	31.3	Very low	182 Å²	182	106.4 Å²	106.4	80%	0.798	55%	0.551	S	S	*	*	S	Bend		178.2	125.6	129.1	-115.4	-117.1	0	0	0	110.2	V1051	V1051-F1053 PolarHBondContact O-N 3.28Å
1054	I	28	Very low	30.9	Very low	140 Å²	140	108.9 Å²	108.9	72%	0.718	57%	0.566	S	S	*	*	S	Bend	trans	70	135.6	163.1	-53.6	170.1	0	0	0	116.2
1055	N	28.1	Very low	31.1	Very low	92 Å²	92	107.9 Å²	107.9	49%	0.492	56%	0.559	S	S	.	*			trans	72.2	25.3	173.3	-67.6	-20.6	0	0	0	120.6	R1057 F1058	N1055-R1057 PolarHBondContact O-N 2.99Å; N1055-F1058 HydrophobicContact CB-CB 4.22Å; N1055-F1058 PolarHBondContact O-N 3.4Å; N1055-F1058 VanDerWaalsContact O-N 3.08Å
1056	K	29.3	Very low	31.5	Very low	179 Å²	179	105.8 Å²	105.8	78%	0.778	55%	0.545	S	S	*	.	H	α-helix	trans	-49	-22.6	165.2	-111	-174.9	179.4	-178.2	0	115.7
1057	R	30	Very low	32.4	Very low	230 Å²	230	105.6 Å²	105.6	87%	0.868	53%	0.534	S	S	*	.	H	α-helix	trans	-93.4	-21.2	-177.8	-153.6	170.1	-175.4	152.2	-0.2	113.8	N1055	N1055-R1057 PolarHBondContact O-N 2.99Å
1058	F	30.1	Very low	33.3	Very low	54 Å²	54	100.4 Å²	100.4	24%	0.237	51%	0.509	C	S	.	.	H	α-helix	trans	-77.5	-51.9	-179	-173.4	-109.4	0	0	0	110.8	Q584 L588 N1055 L1060 S1061 C1062	Q584-F1058 HydrophobicContact CB-CE1 3.85Å; Q584-F1058 HydrophobicContact CB-CZ 4.01Å; L588-F1058 HydrophobicContact CD1-CD2 4.48Å; L588-F1058 HydrophobicContact CD1-CE1 4.49Å; L588-F1058 HydrophobicContact CD1-CE2 3.51Å; L588-F1058 HydrophobicContact CD1-CZ 3.51Å; N1055-F1058 HydrophobicContact CB-CB 4.22Å; N1055-F1058 PolarHBondContact O-N 3.4Å; N1055-F1058 VanDerWaalsContact O-N 3.08Å; F1058-L1060 PolarHBondContact O-N 3.25Å; F1058-S1061 PolarHBondContact O-N 2.91Å; F1058-S1061 PolarHBondContact O-OG 2.84Å; F1058-C1062 PolarHBondContact O-N 2.81Å
1059	L	29.4	Very low	34.4	Very low	53 Å²	53	96.3 Å²	96.3	28%	0.277	51%	0.505	S	S	.	.	H	α-helix	trans	-61.3	-43.8	-179.1	-95.3	168	0	0	0	113.7	Y1042 S1061 C1062 L1063	Y1042-L1059 HydrophobicContact CE1-CD2 3.54Å; Y1042-L1059 VanDerWaalsContact OH-CD1 3.26Å; Y1042-L1059 WeakPolarHBondContact OH-CD1 3.26Å; Y1042-L1059 WeakPolarHBondContact OH-CD2 3.46Å; L1059-S1061 PolarHBondContact O-N 3.33Å; L1059-C1062 PolarHBondContact O-N 2.77Å; L1059-L1063 HydrophobicContact CD2-CD1 4.32Å; L1059-L1063 WeakPolarHBondContact O-CB 3.12Å; L1059-L1063 WeakPolarHBondContact O-CG 3.19Å; L1059-L1063 PolarHBondContact O-N 2.96Å
1060	L	28.8	Very low	36	Very low	104 Å²	104	95.9 Å²	95.9	55%	0.545	50%	0.497	S	S	.	.	H	α-helix	trans	-58	-40	174.1	-123.9	76.4	0	0	0	111.4	F1058 S1064	F1058-L1060 PolarHBondContact O-N 3.25Å; L1060-S1064 VanDerWaalsContact O-CB 3.26Å; L1060-S1064 WeakPolarHBondContact O-CB 3.44Å; L1060-S1064 PolarHBondContact O-N 2.84Å; L1060-S1064 PolarHBondContact O-OG 2.88Å
1061	S	29.9	Very low	38.3	Very low	32 Å²	32	89.7 Å²	89.7	22%	0.224	47%	0.465	C	S	.	.	H	α-helix	trans	-73.3	-39.6	-179.1	81	0	0	0	0	112.7	F1058 L1059 S1064 R1065	F1058-S1061 PolarHBondContact O-N 2.91Å; F1058-S1061 PolarHBondContact O-OG 2.84Å; L1059-S1061 PolarHBondContact O-N 3.33Å; S1061-S1064 PolarHBondContact O-OG 3.28Å; S1061-R1065 WeakPolarHBondContact O-CB 3.39Å; S1061-R1065 WeakPolarHBondContact O-CD 3.26Å; S1061-R1065 WeakPolarHBondContact O-CG 3.19Å; S1061-R1065 PolarHBondContact O-N 3.04Å
1062	C	33.1	Very low	40.9	Very low	6 Å²	6	83.3 Å²	83.3	4%	0.041	43%	0.426	C	S	.	.	H	α-helix	trans	-66.5	-41.1	176.9	-67.7	0	0	0	0	110.9	F1058 L1059 R1065 L1066	F1058-C1062 PolarHBondContact O-N 2.81Å; L1059-C1062 PolarHBondContact O-N 2.77Å; C1062-R1065 PolarHBondContact O-N 3.5Å; C1062-L1066 WeakPolarHBondContact O-CD1 3.11Å; C1062-L1066 WeakPolarHBondContact O-CG 3.33Å; C1062-L1066 PolarHBondContact O-N 3.09Å
1063	L	36.7	Very low	43.7	Very low	28 Å²	28	77 Å²	77	15%	0.147	39%	0.392	C	S	.	.	H	α-helix	trans	-73.4	-42	-178.8	-70.5	169.9	0	0	0	113.3	Y1042 L1059 R1065 L1066	Y1042-L1063 HydrophobicContact CD1-CD1 4.02Å; Y1042-L1063 HydrophobicContact CD1-CD2 3.83Å; Y1042-L1063 HydrophobicContact CD1-CG 4.41Å; Y1042-L1063 HydrophobicContact CE1-CD1 3.88Å; Y1042-L1063 HydrophobicContact CE1-CD2 4.3Å; Y1042-L1063 HydrophobicContact CE1-CG 4.44Å; Y1042-L1063 WeakPolarHBondContact O-CD1 3.39Å; Y1042-L1063 WeakPolarHBondContact O-CD2 3.47Å; L1059-L1063 HydrophobicContact CD2-CD1 4.32Å; L1059-L1063 WeakPolarHBondContact O-CB 3.12Å; L1059-L1063 WeakPolarHBondContact O-CG 3.19Å; L1059-L1063 PolarHBondContact O-N 2.96Å; L1063-R1065 PolarHBondContact O-N 3.37Å; L1063-R1065 VanDerWaalsContact O-N 3.12Å; L1063-L1066 HydrophobicContact CD2-CD1 4.02Å; L1063-L1066 PolarHBondContact O-N 3.31Å; L1063-L1066 VanDerWaalsContact O-N 3.14Å
1064	S	38.2	Very low	46.6	Very low	88 Å²	88	68.3 Å²	68.3	62%	0.615	35%	0.354	S	S	*	.	H	α-helix	trans	-65.9	-15.1	176.7	76.8	0	0	0	0	113.8	L1060 S1061	L1060-S1064 VanDerWaalsContact O-CB 3.26Å; L1060-S1064 WeakPolarHBondContact O-CB 3.44Å; L1060-S1064 PolarHBondContact O-N 2.84Å; L1060-S1064 PolarHBondContact O-OG 2.88Å; S1061-S1064 PolarHBondContact O-OG 3.28Å
1065	R	42.4	Very low	49.5	Very low	59 Å²	59	61.7 Å²	61.7	22%	0.223	32%	0.32	C	S	.	.	H	α-helix	trans	-94.2	-22.9	176.7	-68.8	171	-177.2	-148.2	14	113.2	S1061 C1062 L1063 F1183	S1061-R1065 WeakPolarHBondContact O-CB 3.39Å; S1061-R1065 WeakPolarHBondContact O-CD 3.26Å; S1061-R1065 WeakPolarHBondContact O-CG 3.19Å; S1061-R1065 PolarHBondContact O-N 3.04Å; C1062-R1065 PolarHBondContact O-N 3.5Å; L1063-R1065 PolarHBondContact O-N 3.37Å; L1063-R1065 VanDerWaalsContact O-N 3.12Å; R1065-F1183 HydrophobicContact CB-CE1 3.76Å; R1065-F1183 HydrophobicContact CB-CZ 3.55Å; R1065-F1183 HydrophobicContact CG-CE1 3.88Å; R1065-F1183 HydrophobicContact CG-CE2 3.9Å; R1065-F1183 HydrophobicContact CG-CZ 3.28Å; R1065-F1183 VanDerWaalsContact NH1-CG 3.32Å; R1065-F1183 PolarHBondContact NH1-O 3.25Å
1066	L	46.3	Very low	52.5	Low	39 Å²	39	57.3 Å²	57.3	20%	0.204	30%	0.297	C	S	.	.	H	α-helix	trans	-73.5	-28.3	-174.3	-83.6	162.5	0	0	0	112.9	T1016 C1062 L1063	T1016-L1066 VanDerWaalsContact CB-CD2 3.48Å; T1016-L1066 HydrophobicContact CG2-CD2 3.47Å; T1016-L1066 VanDerWaalsContact CG2-CD2 3.47Å; C1062-L1066 WeakPolarHBondContact O-CD1 3.11Å; C1062-L1066 WeakPolarHBondContact O-CG 3.33Å; C1062-L1066 PolarHBondContact O-N 3.09Å; L1063-L1066 HydrophobicContact CD2-CD1 4.02Å; L1063-L1066 PolarHBondContact O-N 3.31Å; L1063-L1066 VanDerWaalsContact O-N 3.14Å
1067	L	50.8	Low	55.4	Low	33 Å²	33	49 Å²	49	17%	0.173	26%	0.261	C	S	.	.	S	Bend	trans	-142.9	115.7	173.3	-70.2	168.7	0	0	0	109.7	Y1025 F1027 A1043 S1069 M1073 M1104	Y1025-L1067 HydrophobicContact CD1-CD2 3.79Å; Y1025-L1067 HydrophobicContact CD2-CD2 3.89Å; Y1025-L1067 HydrophobicContact CE1-CD2 3.79Å; Y1025-L1067 HydrophobicContact CE2-CD2 3.89Å; Y1025-L1067 HydrophobicContact CG-CD2 3.87Å; F1027-L1067 HydrophobicContact CE2-CD1 4.31Å; F1027-L1067 HydrophobicContact CZ-CD1 4.08Å; F1027-L1067 HydrophobicContact CZ-CD2 4.44Å; A1043-L1067 HydrophobicContact CB-CD1 4.41Å; L1067-S1069 PolarHBondContact O-N 3.15Å; L1067-M1073 HydrophobicContact CD1-SD 3.88Å; L1067-M1104 HydrophobicContact CD1-CE 3.91Å
1068	P	48.1	Very low	58.3	Low	42 Å²	42	38 Å²	38	27%	0.273	22%	0.22	S	C	.	.			trans	-64	131.2	169.4	-17.5	30.6	0	0	0	109.7	S1070 K1071	P1068-S1070 PolarHBondContact O-N 3.09Å; P1068-K1071 HydrophobicContact CB-CG 4.45Å; P1068-K1071 HydrophobicContact CG-CG 4.39Å; P1068-K1071 PolarHBondContact O-N 3.13Å
1069	S	52.8	Low	60.7	Low	116 Å²	116	35.9 Å²	35.9	81%	0.811	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-9.6	175.6	55	0	0	0	0	114.2	L1067	L1067-S1069 PolarHBondContact O-N 3.15Å
1070	S	61.5	Low	62.9	Low	76 Å²	76	35.3 Å²	35.3	53%	0.531	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88	-11.4	177.2	60.7	0	0	0	0	115.3	P1068 R1132	P1068-S1070 PolarHBondContact O-N 3.09Å; S1070-R1132 WeakPolarHBondContact O-CD 3.42Å; S1070-R1132 PolarHBondContact O-NH1 2.83Å
1071	K	74.7	Confident	64.9	Low	57 Å²	57	34.9 Å²	34.9	25%	0.248	21%	0.21	C	C	.	.	S	Bend	trans	-89.6	137.6	179.3	-68.3	-68.2	-170.2	-179.8	0	111.8	F1022 D1023 Y1025 P1068	F1022-K1071 WeakPolarHBondContact O-CE 3.42Å; D1023-K1071 IonicContact OD1-NZ 3.54Å; D1023-K1071 PolarHBondContact OD1-NZ 3.43Å; Y1025-K1071 HydrophobicContact CD2-CB 4.28Å; Y1025-K1071 HydrophobicContact CE2-CB 4.04Å; Y1025-K1071 HydrophobicContact CE2-CG 4.27Å; P1068-K1071 HydrophobicContact CB-CG 4.45Å; P1068-K1071 HydrophobicContact CG-CG 4.39Å; P1068-K1071 PolarHBondContact O-N 3.13Å
1072	P	85.4	Confident	66.6	Low	1 Å²	1	37.8 Å²	37.8	1%	0.006	23%	0.227	C	C	.	.			trans	-61.9	138.5	173.6	-21	34.4	0	0	0	111.6	D1023 G1024 Y1025 F1125 E1128 V1129 R1132	D1023-P1072 VanDerWaalsContact O-CD 3.28Å; D1023-P1072 WeakPolarHBondContact O-CD 3.39Å; G1024-P1072 WeakPolarHBondContact CA-O 3.41Å; Y1025-P1072 PolarHBondContact N-O 3.42Å; Y1025-P1072 VanDerWaalsContact N-O 3.08Å; P1072-F1125 HydrophobicContact CB-CD2 4.27Å; P1072-F1125 HydrophobicContact CB-CE2 3.92Å; P1072-E1128 HydrophobicContact CB-CB 4.35Å; P1072-E1128 HydrophobicContact CB-CG 4.14Å; P1072-E1128 HydrophobicContact CG-CB 4.39Å; P1072-E1128 HydrophobicContact CG-CG 4.03Å; P1072-V1129 HydrophobicContact CB-CG2 4Å; P1072-V1129 HydrophobicContact CG-CG2 3.97Å; P1072-R1132 HydrophobicContact CG-CB 4.24Å; P1072-R1132 HydrophobicContact CG-CG 4.02Å
1073	M	86.1	Confident	68.2	Low	5 Å²	5	38.2 Å²	38.2	3%	0.025	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	145.1	178.1	-71.3	177.1	-78.1	0	0	109.7	Y1025 F1027 L1067 M1104 A1106 R1107	Y1025-M1073 CarbonylContact O-C 3.57Å; Y1025-M1073 WeakPolarHBondContact O-CA 3.43Å; F1027-M1073 HydrophobicContact CE2-CG 4.44Å; F1027-M1073 HydrophobicContact CE2-SD 4.47Å; L1067-M1073 HydrophobicContact CD1-SD 3.88Å; M1073-M1104 HydrophobicContact CE-CB 4.31Å; M1073-M1104 HydrophobicContact CE-CE 3.99Å; M1073-M1104 VanDerWaalsContact CE-O 3.24Å; M1073-M1104 WeakPolarHBondContact CE-O 3.44Å; M1073-M1104 HydrophobicContact SD-CE 3.72Å; M1073-A1106 HydrophobicContact CB-CB 3.48Å; M1073-A1106 VanDerWaalsContact CB-CB 3.48Å; M1073-A1106 CarbonylContact O-C 3.59Å; M1073-A1106 WeakPolarHBondContact O-CA 3.22Å; M1073-R1107 PolarHBondContact O-N 3.38Å
1074	M	88.8	Confident	69.6	Low	0 Å²	0	40.4 Å²	40.4	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	131.4	174.2	174.1	174.8	-96	0	0	110.1	Y1025 M1026 F1027 V1076 R1107 V1109 Y1122 F1125	Y1025-M1074 PolarHBondContact O-N 3.44Å; M1026-M1074 CarbonylContact C-O 3.55Å; M1026-M1074 WeakPolarHBondContact CA-O 3.44Å; M1026-M1074 HydrophobicContact CE-SD 4.24Å; M1026-M1074 HydrophobicContact CG-CB 4.34Å; F1027-M1074 PolarHBondContact N-O 2.65Å; M1074-V1076 HydrophobicContact CG-CG2 3.91Å; M1074-V1076 HydrophobicContact SD-CG2 4.19Å; M1074-R1107 CarbonylContact C-O 3.59Å; M1074-R1107 WeakPolarHBondContact CA-O 3.49Å; M1074-R1107 HydrophobicContact CB-CB 4.41Å; M1074-R1107 HydrophobicContact CE-CB 4.09Å; M1074-R1107 HydrophobicContact CG-CB 4.43Å; M1074-V1109 HydrophobicContact CE-CG2 3.76Å; M1074-Y1122 HydrophobicContact SD-CD1 3.79Å; M1074-Y1122 HydrophobicContact SD-CE1 4.31Å; M1074-F1125 HydrophobicContact CB-CD2 3.68Å; M1074-F1125 HydrophobicContact CB-CE2 3.95Å; M1074-F1125 HydrophobicContact CB-CG 4.14Å; M1074-F1125 HydrophobicContact CE-CB 3.55Å; M1074-F1125 HydrophobicContact CE-CG 4.34Å; M1074-F1125 HydrophobicContact SD-CB 3.96Å; M1074-F1125 HydrophobicContact SD-CG 4.19Å
1075	F	89.4	Confident	71	Confident	2 Å²	2	44 Å²	44	1%	0.009	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	124.2	176	-73.8	-117.3	0	0	0	107.8	F1027 L1040 L1100 A1101 M1104 A1106 R1107 F1108 V1109	F1027-F1075 HydrophobicContact CD2-CD2 4.5Å; F1027-F1075 HydrophobicContact CD2-CE2 4.1Å; F1027-F1075 HydrophobicContact CD2-CZ 4.24Å; F1027-F1075 WeakPolarHBondContact O-CA 3.37Å; L1040-F1075 HydrophobicContact CB-CE1 3.92Å; L1040-F1075 HydrophobicContact CD1-CD1 3.8Å; L1040-F1075 HydrophobicContact CD1-CE1 3.69Å; L1040-F1075 HydrophobicContact CG-CE1 4.33Å; F1075-L1100 HydrophobicContact CE1-CD2 3.76Å; F1075-L1100 HydrophobicContact CE1-CG 4.01Å; F1075-L1100 HydrophobicContact CZ-CD2 4.38Å; F1075-L1100 HydrophobicContact CZ-CG 4.3Å; F1075-A1101 HydrophobicContact CB-CB 4.24Å; F1075-A1101 HydrophobicContact CD2-CB 3.96Å; F1075-A1101 HydrophobicContact CE2-CB 4.5Å; F1075-A1101 HydrophobicContact CG-CB 4.03Å; F1075-M1104 HydrophobicContact CZ-CG 4.34Å; F1075-A1106 HydrophobicContact CD2-CB 3.52Å; F1075-A1106 HydrophobicContact CE2-CB 3.47Å; F1075-A1106 VanDerWaalsContact CE2-CB 3.47Å; F1075-R1107 PolarHBondContact N-O 3.17Å; F1075-F1108 HydrophobicContact CB-CD2 3.92Å; F1075-F1108 HydrophobicContact CB-CE2 4.48Å; F1075-V1109 PolarHBondContact O-N 3.28Å
1076	V	90.6	Very high	72.3	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	108.8	-178.3	-173	0	0	0	0	109	V928 F1027 I1028 Y1029 M1074 V1078 V1109 V1111 Y1122	V928-V1076 HydrophobicContact CG1-CG1 4.39Å; F1027-V1076 PolarHBondContact O-N 3.08Å; I1028-V1076 WeakPolarHBondContact CA-O 3.48Å; I1028-V1076 HydrophobicContact CB-CB 4.44Å; I1028-V1076 HydrophobicContact CG1-CB 4.15Å; I1028-V1076 HydrophobicContact CG1-CG2 4.39Å; I1028-V1076 HydrophobicContact CG2-CB 4.17Å; I1028-V1076 HydrophobicContact CG2-CG1 4.35Å; Y1029-V1076 WeakPolarHBondContact CD1-O 3.38Å; Y1029-V1076 PolarHBondContact N-O 2.92Å; M1074-V1076 HydrophobicContact CG-CG2 3.91Å; M1074-V1076 HydrophobicContact SD-CG2 4.19Å; V1076-V1078 HydrophobicContact CG1-CG2 4.16Å; V1076-V1109 CarbonylContact C-O 3.59Å; V1076-V1109 WeakPolarHBondContact CA-O 3.48Å; V1076-V1111 HydrophobicContact CG1-CB 4.34Å; V1076-V1111 HydrophobicContact CG1-CG2 3.69Å; V1076-Y1122 HydrophobicContact CG2-CE1 4.22Å
1077	A	90.8	Very high	73.7	Confident	3 Å²	3	46.1 Å²	46.1	3%	0.025	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	119.1	177	0	0	0	0	0	109.9	Y1029 I1094 F1108 V1109 S1110 V1111	Y1029-A1077 HydrophobicContact CD1-CB 4.48Å; Y1029-A1077 HydrophobicContact CE1-CB 3.65Å; Y1029-A1077 HydrophobicContact CE2-CB 4.32Å; Y1029-A1077 WeakPolarHBondContact OH-CB 3.39Å; A1077-I1094 HydrophobicContact CB-CG1 4.5Å; A1077-F1108 HydrophobicContact CB-CE1 4.48Å; A1077-F1108 HydrophobicContact CB-CE2 4.3Å; A1077-F1108 HydrophobicContact CB-CZ 3.75Å; A1077-V1109 PolarHBondContact N-O 3.06Å; A1077-S1110 CarbonylContact O-C 3.52Å; A1077-S1110 WeakPolarHBondContact O-CA 3.48Å; A1077-V1111 PolarHBondContact O-N 3.32Å
1078	V	90	Very high	75.1	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	90.3	-173.4	-171.9	0	0	0	0	111.8	F923 L927 V928 I1028 Y1029 P1031 V1076 V1111	F923-V1078 HydrophobicContact CB-CG1 3.79Å; F923-V1078 HydrophobicContact CD1-CB 3.74Å; F923-V1078 HydrophobicContact CD1-CG1 3.82Å; F923-V1078 HydrophobicContact CD1-CG2 4.4Å; F923-V1078 HydrophobicContact CD2-CB 4.32Å; F923-V1078 HydrophobicContact CD2-CG1 3.92Å; F923-V1078 HydrophobicContact CD2-CG2 4.37Å; F923-V1078 HydrophobicContact CE1-CB 3.88Å; F923-V1078 HydrophobicContact CE1-CG1 4.39Å; F923-V1078 HydrophobicContact CE1-CG2 4.15Å; F923-V1078 HydrophobicContact CE2-CB 4.43Å; F923-V1078 HydrophobicContact CE2-CG1 4.47Å; F923-V1078 HydrophobicContact CE2-CG2 4.11Å; F923-V1078 HydrophobicContact CG-CB 3.99Å; F923-V1078 HydrophobicContact CG-CG1 3.57Å; F923-V1078 HydrophobicContact CZ-CB 4.24Å; F923-V1078 HydrophobicContact CZ-CG2 4.02Å; L927-V1078 HydrophobicContact CD2-CG1 3.49Å; L927-V1078 VanDerWaalsContact CD2-CG1 3.49Å; V928-V1078 HydrophobicContact CG1-CG2 3.62Å; I1028-V1078 HydrophobicContact CG2-CG2 3.51Å; Y1029-V1078 PolarHBondContact O-N 3.49Å; P1031-V1078 VanDerWaalsContact CD-O 3.26Å; P1031-V1078 WeakPolarHBondContact CD-O 3.44Å; V1076-V1078 HydrophobicContact CG1-CG2 4.16Å; V1078-V1111 WeakPolarHBondContact CA-O 3.42Å
1079	G	80.9	Confident	76.8	Confident	9 Å²	9	54 Å²	54	9%	0.093	30%	0.297	C	S	.	.			trans	-154	162.1	-176.5	0	0	0	0	0	112.1	V1111 S1112	G1079-V1111 PolarHBondContact N-O 3.43Å; G1079-V1111 VanDerWaalsContact N-O 3.1Å; G1079-V1111 VanDerWaalsContact O-O 3.13Å; G1079-S1112 WeakPolarHBondContact O-CA 3.44Å
1080	E	76.4	Confident	78.2	Confident	42 Å²	42	48.5 Å²	48.5	20%	0.196	26%	0.258	C	S	.	.			trans	-69.9	151.2	178.8	-71.5	-58.9	126	0	0	111.8	V1082 D1083 F1084 S1112 R1113 S1114	E1080-V1082 HydrophobicContact CB-CB 4.26Å; E1080-V1082 PolarHBondContact O-N 2.95Å; E1080-D1083 HydrophobicContact CB-CB 4.3Å; E1080-D1083 PolarHBondContact N-OD2 2.95Å; E1080-D1083 WeakPolarHBondContact O-CB 3.43Å; E1080-D1083 PolarHBondContact O-N 2.91Å; E1080-F1084 PolarHBondContact O-N 2.87Å; E1080-S1112 PolarHBondContact OE2-OG 3.45Å; E1080-R1113 HydrophobicContact CG-CG 4.11Å; E1080-R1113 VanDerWaalsContact OE1-CA 3.22Å; E1080-R1113 WeakPolarHBondContact OE1-CA 3.27Å; E1080-R1113 WeakPolarHBondContact OE1-CB 3.4Å; E1080-R1113 VanDerWaalsContact OE1-CG 3.25Å; E1080-R1113 WeakPolarHBondContact OE1-CG 3.44Å; E1080-R1113 PolarHBondContact OE1-N 3.1Å; E1080-S1114 VanDerWaalsContact CD-OG 3.25Å; E1080-S1114 WeakPolarHBondContact OE1-CB 3.5Å; E1080-S1114 PolarHBondContact OE1-N 2.92Å; E1080-S1114 PolarHBondContact OE1-OG 3.39Å; E1080-S1114 VanDerWaalsContact OE1-OG 3.1Å; E1080-S1114 WeakPolarHBondContact OE2-CB 3.42Å; E1080-S1114 PolarHBondContact OE2-OG 3.4Å
1081	V	69.2	Low	79.3	Confident	94 Å²	94	46.7 Å²	46.7	57%	0.57	24%	0.243	S	C	*	.	H	α-helix	trans	-56.4	-32.8	165.4	-177.8	0	0	0	0	110.5	F1084 F1085	V1081-F1084 PolarHBondContact O-N 3.41Å; V1081-F1085 HydrophobicContact CG1-CD2 4.34Å; V1081-F1085 HydrophobicContact CG1-CE2 3.94Å; V1081-F1085 WeakPolarHBondContact O-CD2 3.3Å
1082	V	66.5	Low	79.9	Confident	94 Å²	94	47.3 Å²	47.3	57%	0.57	25%	0.247	S	C	*	.	H	α-helix	trans	-67.8	-35.1	175.7	-163.9	0	0	0	0	112.1	E1080 F1084 F1085 S1086	E1080-V1082 HydrophobicContact CB-CB 4.26Å; E1080-V1082 PolarHBondContact O-N 2.95Å; V1082-F1084 VanDerWaalsContact C-N 3.29Å; V1082-F1084 PolarHBondContact O-N 2.94Å; V1082-F1085 PolarHBondContact O-N 2.91Å; V1082-F1085 VanDerWaalsContact O-N 3.17Å; V1082-S1086 WeakPolarHBondContact O-CB 3.35Å; V1082-S1086 PolarHBondContact O-N 3.43Å; V1082-S1086 PolarHBondContact O-OG 3.45Å
1083	D	66.5	Low	80	Confident	15 Å²	15	47.3 Å²	47.3	8%	0.08	25%	0.246	C	C	.	.	H	α-helix	trans	-62.8	-39.6	178.4	-62.9	-30.6	0	0	0	110.1	K1032 E1080 F1085 S1086 D1087 A1090	K1032-D1083 WeakPolarHBondContact CE-OD1 3.41Å; K1032-D1083 WeakPolarHBondContact CE-OD2 3.42Å; K1032-D1083 IonicContact NZ-OD1 2.84Å; K1032-D1083 PolarHBondContact NZ-OD1 3.24Å; K1032-D1083 IonicContact NZ-OD2 2.76Å; K1032-D1083 PolarHBondContact NZ-OD2 3.4Å; E1080-D1083 HydrophobicContact CB-CB 4.3Å; E1080-D1083 PolarHBondContact N-OD2 2.95Å; E1080-D1083 WeakPolarHBondContact O-CB 3.43Å; E1080-D1083 PolarHBondContact O-N 2.91Å; D1083-F1085 VanDerWaalsContact C-N 3.25Å; D1083-F1085 PolarHBondContact O-N 3.03Å; D1083-S1086 PolarHBondContact O-N 3.27Å; D1083-D1087 PolarHBondContact O-N 2.83Å; D1083-A1090 HydrophobicContact CB-CB 4.29Å
1084	F	65.7	Low	80.1	Confident	73 Å²	73	48.2 Å²	48.2	32%	0.32	25%	0.251	S	S	.	.	H	α-helix	trans	-60.2	-28.6	176.1	-174.9	-100.5	0	0	0	114.1	E1080 V1081 V1082 N1091 I1094	E1080-F1084 PolarHBondContact O-N 2.87Å; V1081-F1084 PolarHBondContact O-N 3.41Å; V1082-F1084 VanDerWaalsContact C-N 3.29Å; V1082-F1084 PolarHBondContact O-N 2.94Å; F1084-N1091 PolarHBondContact O-ND2 3.45Å; F1084-I1094 HydrophobicContact CB-CD1 4.35Å; F1084-I1094 HydrophobicContact CD2-CB 4.29Å; F1084-I1094 HydrophobicContact CD2-CD1 3.8Å; F1084-I1094 HydrophobicContact CD2-CG2 4.05Å; F1084-I1094 HydrophobicContact CE2-CB 4.45Å; F1084-I1094 HydrophobicContact CE2-CG2 3.95Å
1085	F	68.6	Low	80.1	Confident	163 Å²	163	52.4 Å²	52.4	72%	0.715	27%	0.272	S	S	*	.	H	α-helix	trans	-101.9	-18	179.9	-65.5	-69.4	0	0	0	114.5	V1081 V1082 D1083	V1081-F1085 HydrophobicContact CG1-CD2 4.34Å; V1081-F1085 HydrophobicContact CG1-CE2 3.94Å; V1081-F1085 WeakPolarHBondContact O-CD2 3.3Å; V1082-F1085 PolarHBondContact O-N 2.91Å; V1082-F1085 VanDerWaalsContact O-N 3.17Å; D1083-F1085 VanDerWaalsContact C-N 3.25Å; D1083-F1085 PolarHBondContact O-N 3.03Å
1086	S	69.8	Low	80	Confident	87 Å²	87	54.5 Å²	54.5	61%	0.608	28%	0.282	S	S	*	.	H	α-helix	trans	-114.4	-20.1	-172.4	65.2	0	0	0	0	114.9	V1082 D1083	V1082-S1086 WeakPolarHBondContact O-CB 3.35Å; V1082-S1086 PolarHBondContact O-N 3.43Å; V1082-S1086 PolarHBondContact O-OG 3.45Å; D1083-S1086 PolarHBondContact O-N 3.27Å
1087	D	74.5	Confident	79.7	Confident	56 Å²	56	54.5 Å²	54.5	30%	0.299	28%	0.282	S	S	.	.			trans	-116.8	109.9	177.6	-173.8	-14.1	0	0	0	109.7	D1083 E1089 A1090 N1091	D1083-D1087 PolarHBondContact O-N 2.83Å; D1087-E1089 VanDerWaalsContact C-N 3.3Å; D1087-E1089 PolarHBondContact O-N 3.07Å; D1087-E1089 PolarHBondContact OD1-N 2.9Å; D1087-A1090 HydrophobicContact CB-CB 3.79Å; D1087-A1090 PolarHBondContact O-N 3.32Å; D1087-A1090 PolarHBondContact OD1-N 2.94Å; D1087-N1091 PolarHBondContact O-N 2.9Å
1088	Q	81.4	Confident	79.6	Confident	143 Å²	143	56.2 Å²	56.2	67%	0.668	29%	0.293	S	S	*	.	H	α-helix	trans	-62.8	-36.6	179.5	-175.8	-178.8	-22.7	0	0	111.6	N1091 E1092	Q1088-N1091 PolarHBondContact O-N 3.09Å; Q1088-E1092 HydrophobicContact CG-CG 4.48Å; Q1088-E1092 WeakPolarHBondContact CG-OE1 3.32Å; Q1088-E1092 PolarHBondContact NE2-OE1 2.98Å; Q1088-E1092 WeakPolarHBondContact O-CB 3.49Å; Q1088-E1092 VanDerWaalsContact O-CG 3.31Å; Q1088-E1092 WeakPolarHBondContact O-CG 3.3Å; Q1088-E1092 PolarHBondContact O-N 2.87Å
1089	E	82.2	Confident	79.5	Confident	98 Å²	98	61 Å²	61	46%	0.458	32%	0.316	S	S	.	.	H	α-helix	trans	-69.7	-37.2	179	-171.1	170.7	-171.8	0	0	110.3	D1087 E1092 L1093	D1087-E1089 VanDerWaalsContact C-N 3.3Å; D1087-E1089 PolarHBondContact O-N 3.07Å; D1087-E1089 PolarHBondContact OD1-N 2.9Å; E1089-E1092 PolarHBondContact O-N 3.1Å; E1089-L1093 HydrophobicContact CG-CD1 4.02Å; E1089-L1093 WeakPolarHBondContact O-CB 3.32Å; E1089-L1093 VanDerWaalsContact O-CG 3.22Å; E1089-L1093 WeakPolarHBondContact O-CG 3.43Å; E1089-L1093 PolarHBondContact O-N 3.21Å
1090	A	83.2	Confident	79.5	Confident	0 Å²	0	61 Å²	61	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-68	-38.7	174.6	0	0	0	0	0	113.1	P1031 D1083 D1087 L1093 I1094	P1031-A1090 WeakPolarHBondContact O-CA 3.46Å; D1083-A1090 HydrophobicContact CB-CB 4.29Å; D1087-A1090 HydrophobicContact CB-CB 3.79Å; D1087-A1090 PolarHBondContact O-N 3.32Å; D1087-A1090 PolarHBondContact OD1-N 2.94Å; A1090-L1093 PolarHBondContact O-N 3.01Å; A1090-I1094 VanDerWaalsContact O-CG1 3.3Å; A1090-I1094 WeakPolarHBondContact O-CG1 3.5Å; A1090-I1094 PolarHBondContact O-N 3.02Å
1091	N	85.3	Confident	79.8	Confident	39 Å²	39	59 Å²	59	21%	0.209	30%	0.304	C	S	.	.	H	α-helix	trans	-64.2	-48.1	173.5	-168.8	-48.2	0	0	0	111	F1084 D1087 Q1088 L1093 I1094 M1095	F1084-N1091 PolarHBondContact O-ND2 3.45Å; D1087-N1091 PolarHBondContact O-N 2.9Å; Q1088-N1091 PolarHBondContact O-N 3.09Å; N1091-L1093 VanDerWaalsContact C-N 3.3Å; N1091-L1093 PolarHBondContact O-N 3.07Å; N1091-I1094 PolarHBondContact O-N 3.26Å; N1091-M1095 WeakPolarHBondContact O-CG 3.43Å; N1091-M1095 PolarHBondContact O-N 3.23Å; N1091-M1095 WeakPolarHBondContact OD1-CE 3.13Å
1092	E	86.8	Confident	80.5	Confident	70 Å²	70	59.6 Å²	59.6	33%	0.327	30%	0.304	S	S	.	.	H	α-helix	trans	-55.5	-43.8	174.8	-76.5	174.5	-164.5	0	0	111.6	Q1088 E1089 M1095 E1096	Q1088-E1092 HydrophobicContact CG-CG 4.48Å; Q1088-E1092 WeakPolarHBondContact CG-OE1 3.32Å; Q1088-E1092 PolarHBondContact NE2-OE1 2.98Å; Q1088-E1092 WeakPolarHBondContact O-CB 3.49Å; Q1088-E1092 VanDerWaalsContact O-CG 3.31Å; Q1088-E1092 WeakPolarHBondContact O-CG 3.3Å; Q1088-E1092 PolarHBondContact O-N 2.87Å; E1089-E1092 PolarHBondContact O-N 3.1Å; E1092-M1095 HydrophobicContact CG-CE 4.33Å; E1092-M1095 PolarHBondContact O-N 2.96Å; E1092-E1096 WeakPolarHBondContact O-CB 3.5Å; E1092-E1096 WeakPolarHBondContact O-CG 3.49Å; E1092-E1096 PolarHBondContact O-N 3.17Å
1093	L	87.9	Confident	80.9	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-71.4	-32.4	178.5	-70	168.9	0	0	0	113.7	Y1029 P1031 R1034 L1037 E1089 A1090 N1091 G1097	Y1029-L1093 PolarHBondContact OH-O 3.33Å; P1031-L1093 WeakPolarHBondContact O-CD1 3.16Å; R1034-L1093 HydrophobicContact CB-CD1 4.04Å; R1034-L1093 HydrophobicContact CB-CD2 4.17Å; R1034-L1093 HydrophobicContact CG-CD2 3.99Å; L1037-L1093 HydrophobicContact CB-CD2 4.26Å; L1037-L1093 HydrophobicContact CD2-CB 4.42Å; L1037-L1093 HydrophobicContact CD2-CD2 3.78Å; L1037-L1093 WeakPolarHBondContact CD2-O 3.43Å; E1089-L1093 HydrophobicContact CG-CD1 4.02Å; E1089-L1093 WeakPolarHBondContact O-CB 3.32Å; E1089-L1093 VanDerWaalsContact O-CG 3.22Å; E1089-L1093 WeakPolarHBondContact O-CG 3.43Å; E1089-L1093 PolarHBondContact O-N 3.21Å; A1090-L1093 PolarHBondContact O-N 3.01Å; N1091-L1093 VanDerWaalsContact C-N 3.3Å; N1091-L1093 PolarHBondContact O-N 3.07Å; L1093-G1097 PolarHBondContact O-N 2.79Å
1094	I	87.7	Confident	81.1	Confident	24 Å²	24	61.7 Å²	61.7	12%	0.123	31%	0.306	C	S	.	.	H	α-helix	trans	-66	-42.2	170.9	-72.3	166.6	0	0	0	110.4	P1031 A1077 F1084 A1090 N1091 G1097 S1098 F1108	P1031-I1094 HydrophobicContact CB-CD1 3.9Å; P1031-I1094 HydrophobicContact CB-CG1 3.49Å; P1031-I1094 VanDerWaalsContact CB-CG1 3.49Å; P1031-I1094 HydrophobicContact CG-CD1 4.05Å; P1031-I1094 HydrophobicContact CG-CG1 4.09Å; A1077-I1094 HydrophobicContact CB-CG1 4.5Å; F1084-I1094 HydrophobicContact CB-CD1 4.35Å; F1084-I1094 HydrophobicContact CD2-CB 4.29Å; F1084-I1094 HydrophobicContact CD2-CD1 3.8Å; F1084-I1094 HydrophobicContact CD2-CG2 4.05Å; F1084-I1094 HydrophobicContact CE2-CB 4.45Å; F1084-I1094 HydrophobicContact CE2-CG2 3.95Å; A1090-I1094 VanDerWaalsContact O-CG1 3.3Å; A1090-I1094 WeakPolarHBondContact O-CG1 3.5Å; A1090-I1094 PolarHBondContact O-N 3.02Å; N1091-I1094 PolarHBondContact O-N 3.26Å; I1094-G1097 PolarHBondContact O-N 3.25Å; I1094-S1098 WeakPolarHBondContact O-CB 3.2Å; I1094-S1098 PolarHBondContact O-N 2.83Å; I1094-F1108 HydrophobicContact CG2-CE1 4.26Å; I1094-F1108 HydrophobicContact CG2-CZ 4.12Å
1095	M	88.5	Confident	81.7	Confident	88 Å²	88	64.5 Å²	64.5	43%	0.433	32%	0.324	S	S	.	.	H	α-helix	trans	-66.6	-46.8	175.7	-70.3	-168.7	-65.3	0	0	112.3	N1091 E1092 G1097 S1098 Q1099	N1091-M1095 WeakPolarHBondContact O-CG 3.43Å; N1091-M1095 PolarHBondContact O-N 3.23Å; N1091-M1095 WeakPolarHBondContact OD1-CE 3.13Å; E1092-M1095 HydrophobicContact CG-CE 4.33Å; E1092-M1095 PolarHBondContact O-N 2.96Å; M1095-G1097 VanDerWaalsContact C-N 3.29Å; M1095-G1097 PolarHBondContact O-N 3.33Å; M1095-S1098 PolarHBondContact O-N 3.07Å; M1095-Q1099 WeakPolarHBondContact O-CB 3.5Å; M1095-Q1099 VanDerWaalsContact O-CG 3.26Å; M1095-Q1099 WeakPolarHBondContact O-CG 3.3Å; M1095-Q1099 PolarHBondContact O-N 2.89Å
1096	E	86.7	Confident	82.4	Confident	47 Å²	47	57.4 Å²	57.4	22%	0.22	30%	0.295	C	S	.	.	H	α-helix	trans	-57.8	-43.2	174.6	-76.6	179.3	-171.8	0	0	110.4	R1034 L1037 E1092 Q1099 L1100	R1034-E1096 IonicContact CZ-OE1 2.68Å; R1034-E1096 IonicContact CZ-OE2 2.63Å; R1034-E1096 IonicContact NH1-OE1 3.03Å; R1034-E1096 VanDerWaalsContact NH2-CD 3.26Å; R1034-E1096 IonicContact NH2-OE1 2.66Å; R1034-E1096 PolarHBondContact NH2-OE1 3.41Å; R1034-E1096 IonicContact NH2-OE2 3.25Å; R1034-E1096 PolarHBondContact NH2-OE2 2.88Å; L1037-E1096 HydrophobicContact CD2-CB 3.58Å; E1092-E1096 WeakPolarHBondContact O-CB 3.5Å; E1092-E1096 WeakPolarHBondContact O-CG 3.49Å; E1092-E1096 PolarHBondContact O-N 3.17Å; E1096-Q1099 PolarHBondContact O-N 2.89Å; E1096-L1100 VanDerWaalsContact O-CB 3.23Å; E1096-L1100 WeakPolarHBondContact O-CB 3.26Å; E1096-L1100 PolarHBondContact O-N 3.45Å
1097	G	85	Confident	83.3	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-66.6	-39.7	177.9	0	0	0	0	0	114.1	L1093 I1094 M1095 L1100 A1101 F1108	L1093-G1097 PolarHBondContact O-N 2.79Å; I1094-G1097 PolarHBondContact O-N 3.25Å; M1095-G1097 VanDerWaalsContact C-N 3.29Å; M1095-G1097 PolarHBondContact O-N 3.33Å; G1097-L1100 PolarHBondContact O-N 2.92Å; G1097-A1101 WeakPolarHBondContact O-CB 3.29Å; G1097-A1101 PolarHBondContact O-N 2.98Å; G1097-F1108 VanDerWaalsContact C-CE2 3.45Å
1098	S	89.4	Confident	84.1	Confident	38 Å²	38	57.3 Å²	57.3	27%	0.266	28%	0.279	S	S	.	.	H	α-helix	trans	-66.7	-47.5	173.8	-169.9	0	0	0	0	111	I1094 M1095 L1100 A1101 D1102	I1094-S1098 WeakPolarHBondContact O-CB 3.2Å; I1094-S1098 PolarHBondContact O-N 2.83Å; M1095-S1098 PolarHBondContact O-N 3.07Å; S1098-L1100 VanDerWaalsContact C-N 3.26Å; S1098-L1100 PolarHBondContact O-N 3.38Å; S1098-A1101 WeakPolarHBondContact O-CB 3.45Å; S1098-A1101 PolarHBondContact O-N 3.38Å; S1098-A1101 VanDerWaalsContact O-N 3.12Å; S1098-D1102 PolarHBondContact O-N 3.14Å
1099	Q	88.1	Confident	84.5	Confident	101 Å²	101	52 Å²	52	47%	0.472	26%	0.256	S	S	.	.	H	α-helix	trans	-60.8	-36.1	176.5	-71.7	176.6	32	0	0	112.1	M1095 E1096 K1103	M1095-Q1099 WeakPolarHBondContact O-CB 3.5Å; M1095-Q1099 VanDerWaalsContact O-CG 3.26Å; M1095-Q1099 WeakPolarHBondContact O-CG 3.3Å; M1095-Q1099 PolarHBondContact O-N 2.89Å; E1096-Q1099 PolarHBondContact O-N 2.89Å; Q1099-K1103 VanDerWaalsContact O-CB 3.31Å; Q1099-K1103 WeakPolarHBondContact O-CB 3.23Å; Q1099-K1103 VanDerWaalsContact O-CD 3.3Å; Q1099-K1103 WeakPolarHBondContact O-CD 3.36Å; Q1099-K1103 WeakPolarHBondContact O-CG 3.45Å; Q1099-K1103 PolarHBondContact O-N 3.46Å
1100	L	80.7	Confident	84.7	Confident	9 Å²	9	51.4 Å²	51.4	5%	0.047	26%	0.263	C	S	.	.	H	α-helix	trans	-68.5	-41.8	174.9	-179.5	62.9	0	0	0	111.3	L1037 L1040 E1041 H1044 F1075 E1096 G1097 S1098 K1103 M1104	L1037-L1100 HydrophobicContact CD1-CD2 4.09Å; L1040-L1100 HydrophobicContact CB-CD2 3.75Å; E1041-L1100 HydrophobicContact CG-CD2 4.24Å; H1044-L1100 HydrophobicContact CB-CD1 3.71Å; F1075-L1100 HydrophobicContact CE1-CD2 3.76Å; F1075-L1100 HydrophobicContact CE1-CG 4.01Å; F1075-L1100 HydrophobicContact CZ-CD2 4.38Å; F1075-L1100 HydrophobicContact CZ-CG 4.3Å; E1096-L1100 VanDerWaalsContact O-CB 3.23Å; E1096-L1100 WeakPolarHBondContact O-CB 3.26Å; E1096-L1100 PolarHBondContact O-N 3.45Å; G1097-L1100 PolarHBondContact O-N 2.92Å; S1098-L1100 VanDerWaalsContact C-N 3.26Å; S1098-L1100 PolarHBondContact O-N 3.38Å; L1100-K1103 PolarHBondContact O-N 2.88Å; L1100-M1104 HydrophobicContact CD1-CG 4.16Å; L1100-M1104 HydrophobicContact CG-CG 4.42Å; L1100-M1104 VanDerWaalsContact O-CB 3.3Å; L1100-M1104 WeakPolarHBondContact O-CB 3.31Å; L1100-M1104 WeakPolarHBondContact O-CG 3.5Å; L1100-M1104 PolarHBondContact O-N 3.46Å
1101	A	82.8	Confident	84.9	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-61.4	-46.4	175	0	0	0	0	0	111.6	F1075 G1097 S1098 K1103 M1104 N1105 A1106 F1108	F1075-A1101 HydrophobicContact CB-CB 4.24Å; F1075-A1101 HydrophobicContact CD2-CB 3.96Å; F1075-A1101 HydrophobicContact CE2-CB 4.5Å; F1075-A1101 HydrophobicContact CG-CB 4.03Å; G1097-A1101 WeakPolarHBondContact O-CB 3.29Å; G1097-A1101 PolarHBondContact O-N 2.98Å; S1098-A1101 WeakPolarHBondContact O-CB 3.45Å; S1098-A1101 PolarHBondContact O-N 3.38Å; S1098-A1101 VanDerWaalsContact O-N 3.12Å; A1101-K1103 PolarHBondContact O-N 3.26Å; A1101-M1104 CarbonylContact O-C 3.56Å; A1101-M1104 PolarHBondContact O-N 3.36Å; A1101-M1104 VanDerWaalsContact O-N 3.11Å; A1101-N1105 PolarHBondContact O-N 3.5Å; A1101-A1106 HydrophobicContact CB-CB 4.19Å; A1101-A1106 PolarHBondContact O-N 3.06Å; A1101-F1108 HydrophobicContact CB-CB 3.99Å; A1101-F1108 HydrophobicContact CB-CD2 4.11Å
1102	D	83.3	Confident	84.7	Confident	106 Å²	106	50.9 Å²	50.9	57%	0.567	26%	0.262	S	S	*	.	H	α-helix	trans	-58.2	-48.8	174.8	-66.8	-33.8	0	0	0	111.3	S1098 M1104 N1105	S1098-D1102 PolarHBondContact O-N 3.14Å; D1102-M1104 PolarHBondContact O-N 3.15Å; D1102-N1105 PolarHBondContact O-N 2.69Å; D1102-N1105 VanDerWaalsContact O-N 3.17Å
1103	K	75.4	Confident	84.3	Confident	127 Å²	127	50 Å²	50	55%	0.552	26%	0.256	S	S	*	.	H	α-helix	trans	-59.4	-34.6	175.7	-73.3	165.8	-170.1	165.1	0	112.2	H1044 Q1099 L1100 A1101	H1044-K1103 VanDerWaalsContact CD2-C 3.48Å; H1044-K1103 PolarHBondContact CD2-O 2.92Å; H1044-K1103 VanDerWaalsContact NE2-C 3.3Å; H1044-K1103 PolarHBondContact NE2-O 3.24Å; Q1099-K1103 VanDerWaalsContact O-CB 3.31Å; Q1099-K1103 WeakPolarHBondContact O-CB 3.23Å; Q1099-K1103 VanDerWaalsContact O-CD 3.3Å; Q1099-K1103 WeakPolarHBondContact O-CD 3.36Å; Q1099-K1103 WeakPolarHBondContact O-CG 3.45Å; Q1099-K1103 PolarHBondContact O-N 3.46Å; L1100-K1103 PolarHBondContact O-N 2.88Å; A1101-K1103 PolarHBondContact O-N 3.26Å
1104	M	69.5	Low	83.4	Confident	27 Å²	27	54.2 Å²	54.2	13%	0.133	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-3.1	179.7	-70.8	-67.4	-73.3	0	0	114.2	A1043 H1044 L1067 M1073 F1075 L1100 A1101 D1102 A1106	A1043-M1104 HydrophobicContact CB-CE 3.64Å; A1043-M1104 HydrophobicContact CB-SD 4.02Å; H1044-M1104 HydrophobicContact CB-SD 4Å; H1044-M1104 PolarHBondContact CD2-SD 3.03Å; L1067-M1104 HydrophobicContact CD1-CE 3.91Å; M1073-M1104 HydrophobicContact CE-CB 4.31Å; M1073-M1104 HydrophobicContact CE-CE 3.99Å; M1073-M1104 VanDerWaalsContact CE-O 3.24Å; M1073-M1104 WeakPolarHBondContact CE-O 3.44Å; M1073-M1104 HydrophobicContact SD-CE 3.72Å; F1075-M1104 HydrophobicContact CZ-CG 4.34Å; L1100-M1104 HydrophobicContact CD1-CG 4.16Å; L1100-M1104 HydrophobicContact CG-CG 4.42Å; L1100-M1104 VanDerWaalsContact O-CB 3.3Å; L1100-M1104 WeakPolarHBondContact O-CB 3.31Å; L1100-M1104 WeakPolarHBondContact O-CG 3.5Å; L1100-M1104 PolarHBondContact O-N 3.46Å; A1101-M1104 CarbonylContact O-C 3.56Å; A1101-M1104 PolarHBondContact O-N 3.36Å; A1101-M1104 VanDerWaalsContact O-N 3.11Å; D1102-M1104 PolarHBondContact O-N 3.15Å; M1104-A1106 VanDerWaalsContact C-N 3.27Å; M1104-A1106 HydrophobicContact CB-CB 4.15Å; M1104-A1106 PolarHBondContact O-N 3.12Å
1105	N	79.1	Confident	82.3	Confident	132 Å²	132	55.7 Å²	55.7	71%	0.706	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.3	44.5	-166	-85.1	-18.2	0	0	0	112.6	A1101 D1102	A1101-N1105 PolarHBondContact O-N 3.5Å; D1102-N1105 PolarHBondContact O-N 2.69Å; D1102-N1105 VanDerWaalsContact O-N 3.17Å
1106	A	82.9	Confident	81.3	Confident	13 Å²	13	57.4 Å²	57.4	11%	0.107	31%	0.308	C	S	.	.			trans	-111.2	153.6	178.7	0	0	0	0	0	111.3	M1073 F1075 A1101 M1104	M1073-A1106 HydrophobicContact CB-CB 3.48Å; M1073-A1106 VanDerWaalsContact CB-CB 3.48Å; M1073-A1106 CarbonylContact O-C 3.59Å; M1073-A1106 WeakPolarHBondContact O-CA 3.22Å; F1075-A1106 HydrophobicContact CD2-CB 3.52Å; F1075-A1106 HydrophobicContact CE2-CB 3.47Å; F1075-A1106 VanDerWaalsContact CE2-CB 3.47Å; A1101-A1106 HydrophobicContact CB-CB 4.19Å; A1101-A1106 PolarHBondContact O-N 3.06Å; M1104-A1106 VanDerWaalsContact C-N 3.27Å; M1104-A1106 HydrophobicContact CB-CB 4.15Å; M1104-A1106 PolarHBondContact O-N 3.12Å
1107	R	88.8	Confident	80.4	Confident	86 Å²	86	56.1 Å²	56.1	33%	0.325	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	141.5	172.3	-61.7	-173.4	-173.5	-129.6	-8.2	110.3	M1073 M1074 F1075 S1124 E1128	M1073-R1107 PolarHBondContact O-N 3.38Å; M1074-R1107 CarbonylContact C-O 3.59Å; M1074-R1107 WeakPolarHBondContact CA-O 3.49Å; M1074-R1107 HydrophobicContact CB-CB 4.41Å; M1074-R1107 HydrophobicContact CE-CB 4.09Å; M1074-R1107 HydrophobicContact CG-CB 4.43Å; F1075-R1107 PolarHBondContact N-O 3.17Å; R1107-S1124 VanDerWaalsContact NH1-C 3.32Å; R1107-S1124 PolarHBondContact NH1-O 3.33Å; R1107-S1124 VanDerWaalsContact NH1-O 3.08Å; R1107-S1124 PolarHBondContact NH1-OG 3.27Å; R1107-S1124 PolarHBondContact NH2-O 3.08Å; R1107-E1128 IonicContact CZ-OE2 3.3Å; R1107-E1128 IonicContact NE-OE2 2.67Å; R1107-E1128 PolarHBondContact NE-OE2 2.86Å; R1107-E1128 IonicContact NH2-OE2 3.11Å; R1107-E1128 PolarHBondContact NH2-OE2 3.33Å
1108	F	90.7	Very high	79.7	Confident	55 Å²	55	59.5 Å²	59.5	24%	0.241	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	136.5	171.5	-170.1	-95.4	0	0	0	110.8	Y1029 F1075 A1077 I1094 G1097 A1101	Y1029-F1108 HydrophobicContact CE1-CE2 4.08Å; Y1029-F1108 VanDerWaalsContact OH-CE2 3.31Å; Y1029-F1108 WeakPolarHBondContact OH-CE2 3.44Å; Y1029-F1108 WeakPolarHBondContact OH-CZ 3.5Å; F1075-F1108 HydrophobicContact CB-CD2 3.92Å; F1075-F1108 HydrophobicContact CB-CE2 4.48Å; A1077-F1108 HydrophobicContact CB-CE1 4.48Å; A1077-F1108 HydrophobicContact CB-CE2 4.3Å; A1077-F1108 HydrophobicContact CB-CZ 3.75Å; I1094-F1108 HydrophobicContact CG2-CE1 4.26Å; I1094-F1108 HydrophobicContact CG2-CZ 4.12Å; G1097-F1108 VanDerWaalsContact C-CE2 3.45Å; A1101-F1108 HydrophobicContact CB-CB 3.99Å; A1101-F1108 HydrophobicContact CB-CD2 4.11Å
1109	V	89.8	Confident	78.6	Confident	31 Å²	31	59.7 Å²	59.7	19%	0.188	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	136.6	176.7	177.6	0	0	0	0	110	M1074 F1075 V1076 A1077 V1111 I1121	M1074-V1109 HydrophobicContact CE-CG2 3.76Å; F1075-V1109 PolarHBondContact O-N 3.28Å; V1076-V1109 CarbonylContact C-O 3.59Å; V1076-V1109 WeakPolarHBondContact CA-O 3.48Å; A1077-V1109 PolarHBondContact N-O 3.06Å; V1109-V1111 HydrophobicContact CG1-CG2 4.4Å; V1109-I1121 HydrophobicContact CG1-CD1 3.61Å; V1109-I1121 HydrophobicContact CG1-CG1 3.83Å
1110	S	87.7	Confident	78	Confident	86 Å²	86	58.9 Å²	58.9	60%	0.601	33%	0.331	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.7	135.8	168.5	56.4	0	0	0	0	111.3	A1077	A1077-S1110 CarbonylContact O-C 3.52Å; A1077-S1110 WeakPolarHBondContact O-CA 3.48Å
1111	V	86.9	Confident	78.1	Confident	4 Å²	4	60.3 Å²	60.3	2%	0.024	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	126.5	176.5	169.9	0	0	0	0	108.9	L927 V928 V1076 A1077 V1078 G1079 V1109 P1117 I1121	L927-V1111 HydrophobicContact CD2-CG1 4.4Å; L927-V1111 HydrophobicContact CG-CG1 4.32Å; V928-V1111 HydrophobicContact CG1-CG1 4.46Å; V1076-V1111 HydrophobicContact CG1-CB 4.34Å; V1076-V1111 HydrophobicContact CG1-CG2 3.69Å; A1077-V1111 PolarHBondContact O-N 3.32Å; V1078-V1111 WeakPolarHBondContact CA-O 3.42Å; G1079-V1111 PolarHBondContact N-O 3.43Å; G1079-V1111 VanDerWaalsContact N-O 3.1Å; G1079-V1111 VanDerWaalsContact O-O 3.13Å; V1109-V1111 HydrophobicContact CG1-CG2 4.4Å; V1111-P1117 HydrophobicContact CG1-CB 4.21Å; V1111-P1117 HydrophobicContact CG1-CG 3.67Å; V1111-P1117 HydrophobicContact CG2-CB 4.22Å; V1111-P1117 HydrophobicContact CG2-CG 4.1Å; V1111-I1121 HydrophobicContact CG2-CD1 3.73Å
1112	S	82.3	Confident	78.4	Confident	25 Å²	25	60.3 Å²	60.3	18%	0.175	34%	0.338	C	S	.	.			trans	-69.6	149.2	173.6	-152.1	0	0	0	0	110.7	G1079 E1080 S1114	G1079-S1112 WeakPolarHBondContact O-CA 3.44Å; E1080-S1112 PolarHBondContact OE2-OG 3.45Å; S1112-S1114 PolarHBondContact OG-OG 3.48Å
1113	R	76.8	Confident	78.4	Confident	50 Å²	50	56.1 Å²	56.1	19%	0.189	32%	0.316	C	S	.	.	S	Bend	trans	-80.1	-30.7	175.6	-23.9	-178.8	84	153.2	38.8	111.6	E542 D922 L927 E1080	E542-R1113 IonicContact OE1-NH1 3.19Å; D922-R1113 VanDerWaalsContact CG-NH1 3.31Å; D922-R1113 IonicContact OD1-CZ 3.17Å; D922-R1113 IonicContact OD1-NH1 2.99Å; D922-R1113 IonicContact OD1-NH2 2.65Å; D922-R1113 PolarHBondContact OD1-NH2 3.01Å; D922-R1113 IonicContact OD2-CZ 3.58Å; D922-R1113 VanDerWaalsContact OD2-CZ 3.29Å; D922-R1113 IonicContact OD2-NH1 2.7Å; D922-R1113 PolarHBondContact OD2-NH1 3.32Å; D922-R1113 IonicContact OD2-NH2 3.78Å; D922-R1113 PolarHBondContact OD2-NH2 3.32Å; L927-R1113 HydrophobicContact CD2-CB 4.33Å; E1080-R1113 HydrophobicContact CG-CG 4.11Å; E1080-R1113 VanDerWaalsContact OE1-CA 3.22Å; E1080-R1113 WeakPolarHBondContact OE1-CA 3.27Å; E1080-R1113 WeakPolarHBondContact OE1-CB 3.4Å; E1080-R1113 VanDerWaalsContact OE1-CG 3.25Å; E1080-R1113 WeakPolarHBondContact OE1-CG 3.44Å; E1080-R1113 PolarHBondContact OE1-N 3.1Å
1114	S	69.7	Low	78.9	Confident	89 Å²	89	52.2 Å²	52.2	62%	0.622	31%	0.305	S	S	*	.	S	Bend	trans	-75.5	-15.9	179.7	48.2	0	0	0	0	115.2	E1080 S1112	E1080-S1114 VanDerWaalsContact CD-OG 3.25Å; E1080-S1114 WeakPolarHBondContact OE1-CB 3.5Å; E1080-S1114 PolarHBondContact OE1-N 2.92Å; E1080-S1114 PolarHBondContact OE1-OG 3.39Å; E1080-S1114 VanDerWaalsContact OE1-OG 3.1Å; E1080-S1114 WeakPolarHBondContact OE2-CB 3.42Å; E1080-S1114 PolarHBondContact OE2-OG 3.4Å; S1112-S1114 PolarHBondContact OG-OG 3.48Å
1115	A	65.2	Low	79.8	Confident	55 Å²	55	51 Å²	51	46%	0.455	30%	0.299	S	S	.	.	S	Bend	trans	-134.2	122.6	-177.4	0	0	0	0	0	110.9	P1117	A1115-P1117 WeakPolarHBondContact O-CD 3.37Å
1116	E	66.2	Low	80.3	Confident	124 Å²	124	44.8 Å²	44.8	58%	0.579	27%	0.266	S	S	*	.	P	Polyproline II helix	trans	-60.3	123.2	170.5	-71.8	-160.2	139.1	0	0	109.5	N930	N930-E1116 PolarHBondContact ND2-OE1 2.89Å
1117	P	69	Low	80.4	Confident	20 Å²	20	46.1 Å²	46.1	13%	0.13	27%	0.27	C	S	.	.	P	Polyproline II helix	trans	-70.3	142.2	-178.6	27.1	-32	0	0	0	110.6	L927 P931 V1111 A1115 S1119 I1121	L927-P1117 WeakPolarHBondContact O-CD 3.02Å; P931-P1117 HydrophobicContact CG-CG 3.67Å; P931-P1117 WeakPolarHBondContact CG-O 2.95Å; V1111-P1117 HydrophobicContact CG1-CB 4.21Å; V1111-P1117 HydrophobicContact CG1-CG 3.67Å; V1111-P1117 HydrophobicContact CG2-CB 4.22Å; V1111-P1117 HydrophobicContact CG2-CG 4.1Å; A1115-P1117 WeakPolarHBondContact O-CD 3.37Å; P1117-S1119 PolarHBondContact O-N 3.33Å; P1117-I1121 HydrophobicContact CB-CB 4.48Å; P1117-I1121 HydrophobicContact CB-CD1 3.51Å; P1117-I1121 HydrophobicContact CB-CG2 4.22Å; P1117-I1121 HydrophobicContact CG-CD1 4.4Å
1118	S	68.8	Low	80.3	Confident	71 Å²	71	43.5 Å²	43.5	50%	0.497	26%	0.261	S	S	.	.	P	Polyproline II helix	trans	-49.2	141	177.1	171.5	0	0	0	0	112.1	T1120 I1121	S1118-T1120 PolarHBondContact O-N 3.25Å; S1118-T1120 PolarHBondContact OG-N 2.68Å; S1118-T1120 PolarHBondContact OG-OG1 2.86Å; S1118-I1121 VanDerWaalsContact O-CB 3.32Å; S1118-I1121 WeakPolarHBondContact O-CB 3.44Å; S1118-I1121 WeakPolarHBondContact O-CG2 3.48Å; S1118-I1121 PolarHBondContact O-N 3.18Å
1119	S	66.6	Low	80.1	Confident	42 Å²	42	41 Å²	41	29%	0.294	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-15.2	173.7	77.7	0	0	0	0	114.1	R935 P1117	R935-S1119 PolarHBondContact NE-OG 3.07Å; R935-S1119 PolarHBondContact NH2-O 3.39Å; R935-S1119 VanDerWaalsContact NH2-O 3.09Å; R935-S1119 PolarHBondContact NH2-OG 3Å; P1117-S1119 PolarHBondContact O-N 3.33Å
1120	T	75.8	Confident	79.9	Confident	85 Å²	85	43 Å²	43	52%	0.521	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-18.8	174.5	56	0	0	0	0	114.1	S1118 Y1122 T1123	S1118-T1120 PolarHBondContact O-N 3.25Å; S1118-T1120 PolarHBondContact OG-N 2.68Å; S1118-T1120 PolarHBondContact OG-OG1 2.86Å; T1120-Y1122 VanDerWaalsContact C-N 3.27Å; T1120-Y1122 PolarHBondContact O-N 3.16Å; T1120-Y1122 VanDerWaalsContact O-N 3.11Å; T1120-T1123 WeakPolarHBondContact CA-OG1 3.36Å; T1120-T1123 VanDerWaalsContact O-CB 3.23Å; T1120-T1123 WeakPolarHBondContact O-CB 3.45Å; T1120-T1123 PolarHBondContact O-N 2.91Å; T1120-T1123 PolarHBondContact O-OG1 3.46Å
1121	I	83.6	Confident	79.6	Confident	38 Å²	38	41.6 Å²	41.6	20%	0.195	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-36	-169.2	-163.7	166.1	0	0	0	114.3	V1109 V1111 P1117 S1118	V1109-I1121 HydrophobicContact CG1-CD1 3.61Å; V1109-I1121 HydrophobicContact CG1-CG1 3.83Å; V1111-I1121 HydrophobicContact CG2-CD1 3.73Å; P1117-I1121 HydrophobicContact CB-CB 4.48Å; P1117-I1121 HydrophobicContact CB-CD1 3.51Å; P1117-I1121 HydrophobicContact CB-CG2 4.22Å; P1117-I1121 HydrophobicContact CG-CD1 4.4Å; S1118-I1121 VanDerWaalsContact O-CB 3.32Å; S1118-I1121 WeakPolarHBondContact O-CB 3.44Å; S1118-I1121 WeakPolarHBondContact O-CG2 3.48Å; S1118-I1121 PolarHBondContact O-N 3.18Å
1122	Y	88	Confident	79.2	Confident	1 Å²	1	45.3 Å²	45.3	0%	0.004	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-6.9	180	-53.9	-54.7	0	0	0	114	V928 P931 L932 M1026 M1074 V1076 T1120 S1124 F1125 F1126	V928-Y1122 WeakPolarHBondContact O-CE2 3.5Å; V928-Y1122 PolarHBondContact O-OH 2.89Å; P931-Y1122 HydrophobicContact CB-CD2 4.34Å; P931-Y1122 HydrophobicContact CB-CE2 3.97Å; P931-Y1122 HydrophobicContact CG-CE2 4.16Å; L932-Y1122 HydrophobicContact CD1-CD2 4.33Å; L932-Y1122 HydrophobicContact CD1-CE2 4.27Å; L932-Y1122 HydrophobicContact CD2-CD2 3.37Å; L932-Y1122 HydrophobicContact CD2-CE2 4.04Å; L932-Y1122 HydrophobicContact CD2-CG 4.11Å; L932-Y1122 HydrophobicContact CG-CD2 3.72Å; L932-Y1122 HydrophobicContact CG-CE2 3.84Å; M1026-Y1122 HydrophobicContact CE-CD1 3.35Å; M1026-Y1122 HydrophobicContact CE-CD2 4.47Å; M1026-Y1122 HydrophobicContact CE-CE1 3.33Å; M1026-Y1122 HydrophobicContact CE-CE2 4.42Å; M1026-Y1122 HydrophobicContact CE-CG 3.94Å; M1074-Y1122 HydrophobicContact SD-CD1 3.79Å; M1074-Y1122 HydrophobicContact SD-CE1 4.31Å; V1076-Y1122 HydrophobicContact CG2-CE1 4.22Å; T1120-Y1122 VanDerWaalsContact C-N 3.27Å; T1120-Y1122 PolarHBondContact O-N 3.16Å; T1120-Y1122 VanDerWaalsContact O-N 3.11Å; Y1122-S1124 VanDerWaalsContact C-N 3.29Å; Y1122-S1124 PolarHBondContact O-N 2.96Å; Y1122-F1125 PolarHBondContact O-N 3.12Å; Y1122-F1125 VanDerWaalsContact O-N 3.14Å; Y1122-F1126 VanDerWaalsContact O-CD2 3.24Å; Y1122-F1126 WeakPolarHBondContact O-CD2 3.46Å; Y1122-F1126 WeakPolarHBondContact O-CG 3.45Å; Y1122-F1126 PolarHBondContact O-N 3.23Å
1123	T	83.4	Confident	79	Confident	17 Å²	17	46.4 Å²	46.4	10%	0.104	26%	0.258	C	S	.	.	H	α-helix	trans	-58.5	-42.3	-172.3	-57.2	0	0	0	0	111.2	V991 L993 T1120 F1125 F1126 E1127	V991-T1123 HydrophobicContact CG1-CG2 4.26Å; L993-T1123 HydrophobicContact CD2-CG2 4.34Å; T1120-T1123 WeakPolarHBondContact CA-OG1 3.36Å; T1120-T1123 VanDerWaalsContact O-CB 3.23Å; T1120-T1123 WeakPolarHBondContact O-CB 3.45Å; T1120-T1123 PolarHBondContact O-N 2.91Å; T1120-T1123 PolarHBondContact O-OG1 3.46Å; T1123-F1125 VanDerWaalsContact C-N 3.34Å; T1123-F1125 PolarHBondContact O-N 2.95Å; T1123-F1126 CarbonylContact O-C 3.6Å; T1123-F1126 WeakPolarHBondContact O-CB 3.46Å; T1123-F1126 PolarHBondContact O-N 3.34Å; T1123-F1126 VanDerWaalsContact O-N 3.12Å; T1123-E1127 WeakPolarHBondContact O-CG 3.4Å; T1123-E1127 PolarHBondContact O-N 3.4Å
1124	S	85.7	Confident	78.8	Confident	46 Å²	46	45.7 Å²	45.7	32%	0.322	26%	0.259	S	S	.	.	H	α-helix	trans	-69.2	-28.6	-177.9	76.5	0	0	0	0	113.6	R1107 Y1122 E1128	R1107-S1124 VanDerWaalsContact NH1-C 3.32Å; R1107-S1124 PolarHBondContact NH1-O 3.33Å; R1107-S1124 VanDerWaalsContact NH1-O 3.08Å; R1107-S1124 PolarHBondContact NH1-OG 3.27Å; R1107-S1124 PolarHBondContact NH2-O 3.08Å; Y1122-S1124 VanDerWaalsContact C-N 3.29Å; Y1122-S1124 PolarHBondContact O-N 2.96Å; S1124-E1128 PolarHBondContact O-N 3.26Å
1125	F	89.8	Confident	78.8	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-73	-38.9	170.1	165.1	-100.5	0	0	0	111.3	V913 M1026 P1072 M1074 Y1122 T1123 E1127 E1128 V1129	V913-F1125 HydrophobicContact CG1-CE1 3.9Å; V913-F1125 HydrophobicContact CG1-CZ 4.18Å; V913-F1125 HydrophobicContact CG2-CE1 4.02Å; V913-F1125 HydrophobicContact CG2-CZ 4.4Å; M1026-F1125 HydrophobicContact CG-CD1 4.17Å; M1026-F1125 HydrophobicContact CG-CE1 3.53Å; M1026-F1125 HydrophobicContact CG-CE2 4.47Å; M1026-F1125 HydrophobicContact CG-CZ 3.7Å; M1026-F1125 HydrophobicContact SD-CD1 4.11Å; M1026-F1125 HydrophobicContact SD-CE1 3.73Å; M1026-F1125 HydrophobicContact SD-CZ 4.49Å; P1072-F1125 HydrophobicContact CB-CD2 4.27Å; P1072-F1125 HydrophobicContact CB-CE2 3.92Å; M1074-F1125 HydrophobicContact CB-CD2 3.68Å; M1074-F1125 HydrophobicContact CB-CE2 3.95Å; M1074-F1125 HydrophobicContact CB-CG 4.14Å; M1074-F1125 HydrophobicContact CE-CB 3.55Å; M1074-F1125 HydrophobicContact CE-CG 4.34Å; M1074-F1125 HydrophobicContact SD-CB 3.96Å; M1074-F1125 HydrophobicContact SD-CG 4.19Å; Y1122-F1125 PolarHBondContact O-N 3.12Å; Y1122-F1125 VanDerWaalsContact O-N 3.14Å; T1123-F1125 VanDerWaalsContact C-N 3.34Å; T1123-F1125 PolarHBondContact O-N 2.95Å; F1125-E1127 VanDerWaalsContact C-N 3.35Å; F1125-E1128 WeakPolarHBondContact O-CB 3.42Å; F1125-E1128 PolarHBondContact O-N 2.95Å; F1125-E1128 VanDerWaalsContact O-N 3.1Å; F1125-V1129 HydrophobicContact CD1-CG2 4.39Å; F1125-V1129 HydrophobicContact CD2-CG2 4.48Å; F1125-V1129 HydrophobicContact CE1-CG2 3.97Å; F1125-V1129 HydrophobicContact CE2-CG2 4.09Å; F1125-V1129 HydrophobicContact CZ-CG2 3.82Å; F1125-V1129 WeakPolarHBondContact O-CG2 3.34Å; F1125-V1129 PolarHBondContact O-N 2.83Å
1126	F	88.6	Confident	78.7	Confident	3 Å²	3	45.3 Å²	45.3	1%	0.013	25%	0.25	C	S	.	.	H	α-helix	trans	-67.4	-33.3	175.3	-63.6	-39.2	0	0	0	113.3	V913 L932 V991 L993 F1000 I1002 Y1122 T1123 E1128 V1129 W1130	V913-F1126 HydrophobicContact CG2-CE1 4.35Å; L932-F1126 HydrophobicContact CD2-CE2 3.48Å; L932-F1126 VanDerWaalsContact CD2-CE2 3.48Å; L932-F1126 HydrophobicContact CD2-CZ 3.46Å; L932-F1126 VanDerWaalsContact CD2-CZ 3.46Å; V991-F1126 HydrophobicContact CB-CD2 4.41Å; V991-F1126 HydrophobicContact CG1-CB 4.49Å; V991-F1126 HydrophobicContact CG1-CD2 4.08Å; V991-F1126 HydrophobicContact CG2-CD2 3.64Å; V991-F1126 HydrophobicContact CG2-CE2 3.93Å; V991-F1126 HydrophobicContact CG2-CG 4.34Å; L993-F1126 HydrophobicContact CD2-CB 4.04Å; F1000-F1126 WeakPolarHBondContact CE1-O 3.03Å; I1002-F1126 HydrophobicContact CD1-CB 3.57Å; I1002-F1126 HydrophobicContact CD1-CD1 3.23Å; I1002-F1126 HydrophobicContact CD1-CD2 3.94Å; I1002-F1126 HydrophobicContact CD1-CE1 3.79Å; I1002-F1126 HydrophobicContact CD1-CE2 4.4Å; I1002-F1126 HydrophobicContact CD1-CG 3.31Å; I1002-F1126 HydrophobicContact CD1-CZ 4.32Å; I1002-F1126 HydrophobicContact CG2-CE1 4.4Å; Y1122-F1126 VanDerWaalsContact O-CD2 3.24Å; Y1122-F1126 WeakPolarHBondContact O-CD2 3.46Å; Y1122-F1126 WeakPolarHBondContact O-CG 3.45Å; Y1122-F1126 PolarHBondContact O-N 3.23Å; T1123-F1126 CarbonylContact O-C 3.6Å; T1123-F1126 WeakPolarHBondContact O-CB 3.46Å; T1123-F1126 PolarHBondContact O-N 3.34Å; T1123-F1126 VanDerWaalsContact O-N 3.12Å; F1126-E1128 VanDerWaalsContact C-N 3.31Å; F1126-V1129 PolarHBondContact O-N 3Å; F1126-W1130 WeakPolarHBondContact O-CB 3.23Å; F1126-W1130 PolarHBondContact O-N 2.92Å
1127	E	85.4	Confident	78.2	Confident	40 Å²	40	45.5 Å²	45.5	19%	0.187	25%	0.249	C	C	.	.	H	α-helix	trans	-59.6	-41.6	167.1	-70.6	176.6	149.3	0	0	111.2	L993 P994 V995 T1123 F1125 W1130 T1131	L993-E1127 HydrophobicContact CB-CG 4.21Å; L993-E1127 HydrophobicContact CD1-CG 4.46Å; L993-E1127 HydrophobicContact CD2-CG 3.84Å; L993-E1127 HydrophobicContact CG-CG 4.39Å; P994-E1127 WeakPolarHBondContact CD-OE1 3.4Å; V995-E1127 WeakPolarHBondContact CG2-OE1 3.22Å; T1123-E1127 WeakPolarHBondContact O-CG 3.4Å; T1123-E1127 PolarHBondContact O-N 3.4Å; F1125-E1127 VanDerWaalsContact C-N 3.35Å; E1127-W1130 WeakPolarHBondContact O-CB 3.29Å; E1127-W1130 PolarHBondContact O-N 3.08Å; E1127-T1131 WeakPolarHBondContact O-CB 3.46Å; E1127-T1131 PolarHBondContact O-N 3.22Å; E1127-T1131 PolarHBondContact O-OG1 3.47Å; E1127-T1131 VanDerWaalsContact O-OG1 3.09Å
1128	E	86.5	Confident	77.3	Confident	32 Å²	32	50.3 Å²	50.3	15%	0.15	27%	0.27	C	S	.	.	H	α-helix	trans	-69.2	-39.2	177.5	-159.2	-177.5	143	0	0	113.3	P1072 R1107 S1124 F1125 F1126 W1130 T1131 R1132	P1072-E1128 HydrophobicContact CB-CB 4.35Å; P1072-E1128 HydrophobicContact CB-CG 4.14Å; P1072-E1128 HydrophobicContact CG-CB 4.39Å; P1072-E1128 HydrophobicContact CG-CG 4.03Å; R1107-E1128 IonicContact CZ-OE2 3.3Å; R1107-E1128 IonicContact NE-OE2 2.67Å; R1107-E1128 PolarHBondContact NE-OE2 2.86Å; R1107-E1128 IonicContact NH2-OE2 3.11Å; R1107-E1128 PolarHBondContact NH2-OE2 3.33Å; S1124-E1128 PolarHBondContact O-N 3.26Å; F1125-E1128 WeakPolarHBondContact O-CB 3.42Å; F1125-E1128 PolarHBondContact O-N 2.95Å; F1125-E1128 VanDerWaalsContact O-N 3.1Å; F1126-E1128 VanDerWaalsContact C-N 3.31Å; E1128-W1130 VanDerWaalsContact C-N 3.31Å; E1128-T1131 PolarHBondContact O-N 2.9Å; E1128-R1132 HydrophobicContact CG-CG 4.32Å; E1128-R1132 WeakPolarHBondContact O-CB 3.27Å; E1128-R1132 WeakPolarHBondContact O-CG 3.48Å; E1128-R1132 PolarHBondContact O-N 3.11Å; E1128-R1132 IonicContact OE1-CZ 3.61Å; E1128-R1132 IonicContact OE1-NE 3.83Å; E1128-R1132 PolarHBondContact OE1-NE 3.08Å; E1128-R1132 IonicContact OE1-NH2 2.77Å; E1128-R1132 PolarHBondContact OE1-NH2 3.34Å
1129	V	86.8	Confident	76.5	Confident	1 Å²	1	50.9 Å²	50.9	1%	0.006	27%	0.27	C	S	.	.	H	α-helix	trans	-63.4	-38.4	172.6	175.4	0	0	0	0	110.8	V913 F1000 D1023 P1072 F1125 F1126 K1133	V913-V1129 HydrophobicContact CG2-CG1 4.38Å; V913-V1129 HydrophobicContact CG2-CG2 4.33Å; F1000-V1129 HydrophobicContact CE1-CB 4.36Å; F1000-V1129 HydrophobicContact CE1-CG1 4.18Å; F1000-V1129 HydrophobicContact CZ-CG1 4.12Å; D1023-V1129 HydrophobicContact CB-CG1 4.07Å; P1072-V1129 HydrophobicContact CB-CG2 4Å; P1072-V1129 HydrophobicContact CG-CG2 3.97Å; F1125-V1129 HydrophobicContact CD1-CG2 4.39Å; F1125-V1129 HydrophobicContact CD2-CG2 4.48Å; F1125-V1129 HydrophobicContact CE1-CG2 3.97Å; F1125-V1129 HydrophobicContact CE2-CG2 4.09Å; F1125-V1129 HydrophobicContact CZ-CG2 3.82Å; F1125-V1129 WeakPolarHBondContact O-CG2 3.34Å; F1125-V1129 PolarHBondContact O-N 2.83Å; F1126-V1129 PolarHBondContact O-N 3Å; V1129-K1133 WeakPolarHBondContact O-CB 3.39Å; V1129-K1133 PolarHBondContact O-N 3.38Å
1130	W	84.5	Confident	75.6	Confident	75 Å²	75	51.3 Å²	51.3	28%	0.284	28%	0.277	S	S	.	.	H	α-helix	trans	-62	-59.6	171	174.3	-104.6	0	0	0	110.9	L993 A996 F1000 F1126 E1127 E1128 R1132 K1133 T1134	L993-W1130 HydrophobicContact CD1-CB 3.6Å; L993-W1130 HydrophobicContact CD1-CD2 4.33Å; L993-W1130 HydrophobicContact CD1-CG 3.76Å; A996-W1130 HydrophobicContact CB-CZ2 4.43Å; F1000-W1130 HydrophobicContact CD1-CB 4.04Å; F1000-W1130 HydrophobicContact CD2-CD2 4.31Å; F1000-W1130 AromaticContact CD2-CE3 3.3Å; F1000-W1130 HydrophobicContact CD2-CE3 3.3Å; F1000-W1130 AromaticContact CD2-CZ3 3.71Å; F1000-W1130 HydrophobicContact CD2-CZ3 3.71Å; F1000-W1130 HydrophobicContact CE1-CB 3.88Å; F1000-W1130 HydrophobicContact CE2-CD2 4.5Å; F1000-W1130 AromaticContact CE2-CE3 3.43Å; F1000-W1130 HydrophobicContact CE2-CE3 3.43Å; F1000-W1130 VanDerWaalsContact CE2-CE3 3.43Å; F1000-W1130 HydrophobicContact CE2-CZ3 4.01Å; F1000-W1130 HydrophobicContact CG-CB 4.47Å; F1000-W1130 AromaticContact CG-CE3 3.91Å; F1000-W1130 HydrophobicContact CG-CE3 3.91Å; F1000-W1130 HydrophobicContact CZ-CB 4.17Å; F1000-W1130 HydrophobicContact CZ-CE3 4.13Å; F1126-W1130 WeakPolarHBondContact O-CB 3.23Å; F1126-W1130 PolarHBondContact O-N 2.92Å; E1127-W1130 WeakPolarHBondContact O-CB 3.29Å; E1127-W1130 PolarHBondContact O-N 3.08Å; E1128-W1130 VanDerWaalsContact C-N 3.31Å; W1130-R1132 PolarHBondContact O-N 3.32Å; W1130-K1133 CarbonylContact O-C 3.53Å; W1130-K1133 WeakPolarHBondContact O-CA 3.37Å; W1130-K1133 PolarHBondContact O-N 2.78Å; W1130-T1134 HydrophobicContact CD2-CG2 3.84Å; W1130-T1134 HydrophobicContact CE3-CG2 4.22Å; W1130-T1134 HydrophobicContact CG-CG2 4.35Å; W1130-T1134 HydrophobicContact CH2-CG2 4.29Å; W1130-T1134 HydrophobicContact CZ2-CG2 3.85Å; W1130-T1134 HydrophobicContact CZ3-CG2 4.45Å; W1130-T1134 PolarHBondContact O-N 3.03Å; W1130-T1134 PolarHBondContact O-OG1 3.1Å
1131	T	82.3	Confident	74.1	Confident	56 Å²	56	53.4 Å²	53.4	34%	0.344	28%	0.282	S	S	.	.	H	α-helix	trans	-59.1	-46.6	-176	-59.5	0	0	0	0	112.7	E1127 E1128 K1133 T1134 N1135	E1127-T1131 WeakPolarHBondContact O-CB 3.46Å; E1127-T1131 PolarHBondContact O-N 3.22Å; E1127-T1131 PolarHBondContact O-OG1 3.47Å; E1127-T1131 VanDerWaalsContact O-OG1 3.09Å; E1128-T1131 PolarHBondContact O-N 2.9Å; T1131-K1133 PolarHBondContact O-N 3.08Å; T1131-T1134 WeakPolarHBondContact CA-OG1 3.49Å; T1131-T1134 PolarHBondContact O-N 2.84Å; T1131-T1134 PolarHBondContact O-OG1 2.72Å; T1131-N1135 VanDerWaalsContact O-CB 3.27Å; T1131-N1135 WeakPolarHBondContact O-CB 3.49Å; T1131-N1135 PolarHBondContact O-N 3.06Å; T1131-N1135 PolarHBondContact O-OD1 2.93Å
1132	R	79.2	Confident	72.3	Confident	82 Å²	82	58 Å²	58	31%	0.309	30%	0.302	S	S	.	.	H	α-helix	trans	-65.2	-28.2	177.9	-63.9	-156.2	-157.1	-168.2	2.1	111.9	S1070 P1072 E1128 W1130 A1136	S1070-R1132 WeakPolarHBondContact O-CD 3.42Å; S1070-R1132 PolarHBondContact O-NH1 2.83Å; P1072-R1132 HydrophobicContact CG-CB 4.24Å; P1072-R1132 HydrophobicContact CG-CG 4.02Å; E1128-R1132 HydrophobicContact CG-CG 4.32Å; E1128-R1132 WeakPolarHBondContact O-CB 3.27Å; E1128-R1132 WeakPolarHBondContact O-CG 3.48Å; E1128-R1132 PolarHBondContact O-N 3.11Å; E1128-R1132 IonicContact OE1-CZ 3.61Å; E1128-R1132 IonicContact OE1-NE 3.83Å; E1128-R1132 PolarHBondContact OE1-NE 3.08Å; E1128-R1132 IonicContact OE1-NH2 2.77Å; E1128-R1132 PolarHBondContact OE1-NH2 3.34Å; W1130-R1132 PolarHBondContact O-N 3.32Å; R1132-A1136 WeakPolarHBondContact O-CB 3.41Å; R1132-A1136 PolarHBondContact O-N 3.12Å; R1132-A1136 VanDerWaalsContact O-N 3.07Å
1133	K	76.6	Confident	70.3	Confident	47 Å²	47	63.2 Å²	63.2	20%	0.204	33%	0.33	C	S	.	.	H	α-helix	trans	-85	-32.1	178.3	-170.2	165.4	179.7	179.2	0	113.8	S910 D1023 V1129 W1130 T1131 K1137	S910-K1133 WeakPolarHBondContact O-CD 3.4Å; S910-K1133 WeakPolarHBondContact O-CE 3.45Å; S910-K1133 PolarHBondContact O-NZ 3.26Å; D1023-K1133 HydrophobicContact CB-CD 4.38Å; D1023-K1133 WeakPolarHBondContact OD2-CE 3.38Å; D1023-K1133 IonicContact OD2-NZ 3.73Å; D1023-K1133 PolarHBondContact OD2-NZ 2.9Å; V1129-K1133 WeakPolarHBondContact O-CB 3.39Å; V1129-K1133 PolarHBondContact O-N 3.38Å; W1130-K1133 CarbonylContact O-C 3.53Å; W1130-K1133 WeakPolarHBondContact O-CA 3.37Å; W1130-K1133 PolarHBondContact O-N 2.78Å; T1131-K1133 PolarHBondContact O-N 3.08Å; K1133-K1137 WeakPolarHBondContact O-CG 3.03Å; K1133-K1137 PolarHBondContact O-N 2.9Å; K1133-K1137 VanDerWaalsContact O-N 3.17Å
1134	T	73	Confident	68.5	Low	35 Å²	35	64.5 Å²	64.5	22%	0.215	34%	0.339	C	S	.	.	H	α-helix	trans	-67.9	-48	169.1	52	0	0	0	0	110	W1130 T1131 A1136 K1137 E1138	W1130-T1134 HydrophobicContact CD2-CG2 3.84Å; W1130-T1134 HydrophobicContact CE3-CG2 4.22Å; W1130-T1134 HydrophobicContact CG-CG2 4.35Å; W1130-T1134 HydrophobicContact CH2-CG2 4.29Å; W1130-T1134 HydrophobicContact CZ2-CG2 3.85Å; W1130-T1134 HydrophobicContact CZ3-CG2 4.45Å; W1130-T1134 PolarHBondContact O-N 3.03Å; W1130-T1134 PolarHBondContact O-OG1 3.1Å; T1131-T1134 WeakPolarHBondContact CA-OG1 3.49Å; T1131-T1134 PolarHBondContact O-N 2.84Å; T1131-T1134 PolarHBondContact O-OG1 2.72Å; T1134-A1136 VanDerWaalsContact C-N 3.3Å; T1134-A1136 PolarHBondContact O-N 3.05Å; T1134-K1137 CarbonylContact O-C 3.58Å; T1134-K1137 WeakPolarHBondContact O-CA 3.46Å; T1134-K1137 WeakPolarHBondContact O-CB 3.48Å; T1134-K1137 PolarHBondContact O-N 3.49Å; T1134-E1138 PolarHBondContact O-N 2.64Å
1135	N	69.7	Low	66.3	Low	77 Å²	77	68.8 Å²	68.8	41%	0.412	35%	0.352	S	S	.	.	H	α-helix	trans	-63.5	-37.1	179.2	-62.7	18.4	0	0	0	111.2	T1131 K1137 E1138 V1139	T1131-N1135 VanDerWaalsContact O-CB 3.27Å; T1131-N1135 WeakPolarHBondContact O-CB 3.49Å; T1131-N1135 PolarHBondContact O-N 3.06Å; T1131-N1135 PolarHBondContact O-OD1 2.93Å; N1135-K1137 VanDerWaalsContact C-N 3.31Å; N1135-K1137 PolarHBondContact O-N 3.25Å; N1135-E1138 PolarHBondContact O-N 3.23Å; N1135-V1139 WeakPolarHBondContact O-CB 3.39Å; N1135-V1139 VanDerWaalsContact O-CG2 3.29Å; N1135-V1139 WeakPolarHBondContact O-CG2 3.3Å; N1135-V1139 PolarHBondContact O-N 3.48Å
1136	A	62.4	Low	64	Low	59 Å²	59	72.3 Å²	72.3	49%	0.488	38%	0.377	S	S	.	.	H	α-helix	trans	-64.7	-33	172.5	0	0	0	0	0	113	R1132 T1134 A1140	R1132-A1136 WeakPolarHBondContact O-CB 3.41Å; R1132-A1136 PolarHBondContact O-N 3.12Å; R1132-A1136 VanDerWaalsContact O-N 3.07Å; T1134-A1136 VanDerWaalsContact C-N 3.3Å; T1134-A1136 PolarHBondContact O-N 3.05Å; A1136-A1140 WeakPolarHBondContact O-CB 3.47Å; A1136-A1140 PolarHBondContact O-N 3.32Å
1137	K	57.3	Low	61.8	Low	129 Å²	129	75.7 Å²	75.7	56%	0.561	40%	0.398	S	S	*	.	H	α-helix	trans	-74.4	-35.7	172.9	-78.1	-178.2	173.8	-171.9	0	112.8	K1133 T1134 N1135 M1141	K1133-K1137 WeakPolarHBondContact O-CG 3.03Å; K1133-K1137 PolarHBondContact O-N 2.9Å; K1133-K1137 VanDerWaalsContact O-N 3.17Å; T1134-K1137 CarbonylContact O-C 3.58Å; T1134-K1137 WeakPolarHBondContact O-CA 3.46Å; T1134-K1137 WeakPolarHBondContact O-CB 3.48Å; T1134-K1137 PolarHBondContact O-N 3.49Å; N1135-K1137 VanDerWaalsContact C-N 3.31Å; N1135-K1137 PolarHBondContact O-N 3.25Å; K1137-M1141 WeakPolarHBondContact O-CB 3.34Å; K1137-M1141 WeakPolarHBondContact O-CG 3.4Å; K1137-M1141 PolarHBondContact O-N 3.44Å
1138	E	49.6	Very low	59.5	Low	120 Å²	120	76.1 Å²	76.1	56%	0.561	41%	0.408	S	S	*	.	H	α-helix	trans	-68.4	-48.4	175.6	-73	174.8	161.7	0	0	110.6	T1134 N1135 A1140 M1141 E1142	T1134-E1138 PolarHBondContact O-N 2.64Å; N1135-E1138 PolarHBondContact O-N 3.23Å; E1138-A1140 VanDerWaalsContact C-N 3.31Å; E1138-A1140 PolarHBondContact O-N 3.11Å; E1138-M1141 CarbonylContact O-C 3.53Å; E1138-M1141 PolarHBondContact O-N 3.11Å; E1138-M1141 VanDerWaalsContact O-N 3.08Å; E1138-E1142 PolarHBondContact O-N 3.16Å
1139	V	52.7	Low	57.4	Low	83 Å²	83	83 Å²	83	50%	0.503	44%	0.44	S	S	.	.	H	α-helix	trans	-61.5	-37.9	173.7	173.4	0	0	0	0	111.5	N1135 E1142 L1143	N1135-V1139 WeakPolarHBondContact O-CB 3.39Å; N1135-V1139 VanDerWaalsContact O-CG2 3.29Å; N1135-V1139 WeakPolarHBondContact O-CG2 3.3Å; N1135-V1139 PolarHBondContact O-N 3.48Å; V1139-E1142 PolarHBondContact O-N 3.33Å; V1139-L1143 HydrophobicContact CG1-CD1 4.35Å; V1139-L1143 WeakPolarHBondContact O-CB 3.47Å; V1139-L1143 PolarHBondContact O-N 2.67Å
1140	A	47.5	Very low	55.4	Low	52 Å²	52	86.7 Å²	86.7	43%	0.43	47%	0.466	S	S	.	.	H	α-helix	trans	-67.2	-38.6	172.6	0	0	0	0	0	112.5	A1136 E1138 C1144	A1136-A1140 WeakPolarHBondContact O-CB 3.47Å; A1136-A1140 PolarHBondContact O-N 3.32Å; E1138-A1140 VanDerWaalsContact C-N 3.31Å; E1138-A1140 PolarHBondContact O-N 3.11Å; A1140-C1144 VanDerWaalsContact O-CB 3.27Å; A1140-C1144 WeakPolarHBondContact O-CB 3.18Å; A1140-C1144 PolarHBondContact O-N 3.46Å; A1140-C1144 PolarHBondContact O-SG 2.89Å; A1140-C1144 VanDerWaalsContact O-SG 3.34Å
1141	M	43.4	Very low	53.1	Low	128 Å²	128	89.4 Å²	89.4	63%	0.631	49%	0.486	S	S	*	.	H	α-helix	trans	-69.2	-33.8	173.9	-85.7	-166.8	173.9	0	0	113	K1137 E1138 K1145	K1137-M1141 WeakPolarHBondContact O-CB 3.34Å; K1137-M1141 WeakPolarHBondContact O-CG 3.4Å; K1137-M1141 PolarHBondContact O-N 3.44Å; E1138-M1141 CarbonylContact O-C 3.53Å; E1138-M1141 PolarHBondContact O-N 3.11Å; E1138-M1141 VanDerWaalsContact O-N 3.08Å; M1141-K1145 VanDerWaalsContact O-CB 3.3Å; M1141-K1145 WeakPolarHBondContact O-CB 3.34Å; M1141-K1145 WeakPolarHBondContact O-CG 3.04Å; M1141-K1145 PolarHBondContact O-N 3.47Å
1142	E	46.2	Very low	51.1	Low	134 Å²	134	93.5 Å²	93.5	63%	0.626	51%	0.505	S	S	*	.	H	α-helix	trans	-72	-42.3	174.5	-73.3	-171.6	146	0	0	111.3	E1138 V1139 K1145 S1146	E1138-E1142 PolarHBondContact O-N 3.16Å; V1139-E1142 PolarHBondContact O-N 3.33Å; E1142-K1145 PolarHBondContact O-N 3.43Å; E1142-S1146 WeakPolarHBondContact O-CB 3.29Å; E1142-S1146 PolarHBondContact O-N 3.4Å; E1142-S1146 PolarHBondContact O-OG 2.94Å
1143	L	46.9	Very low	49.3	Very low	111 Å²	111	98.5 Å²	98.5	58%	0.581	53%	0.532	S	S	*	.	H	α-helix	trans	-60	-51.4	170.4	-106.9	73.2	0	0	0	111.1	V1139 K1145 S1146 T1147	V1139-L1143 HydrophobicContact CG1-CD1 4.35Å; V1139-L1143 WeakPolarHBondContact O-CB 3.47Å; V1139-L1143 PolarHBondContact O-N 2.67Å; L1143-K1145 VanDerWaalsContact C-N 3.28Å; L1143-K1145 PolarHBondContact O-N 2.85Å; L1143-S1146 WeakPolarHBondContact CA-OG 3.37Å; L1143-S1146 CarbonylContact O-C 3.5Å; L1143-S1146 PolarHBondContact O-N 3.04Å; L1143-S1146 PolarHBondContact O-OG 3.1Å; L1143-T1147 PolarHBondContact O-N 2.83Å; L1143-T1147 PolarHBondContact O-OG1 2.92Å; L1143-T1147 VanDerWaalsContact O-OG1 3.11Å
1144	C	45.3	Very low	47.5	Very low	44 Å²	44	105.9 Å²	105.9	30%	0.297	56%	0.563	S	S	.	*	H	α-helix	trans	-65.3	-27.5	179.9	-71	0	0	0	0	113.2	A1140 T1147 A1148 E1174	A1140-C1144 VanDerWaalsContact O-CB 3.27Å; A1140-C1144 WeakPolarHBondContact O-CB 3.18Å; A1140-C1144 PolarHBondContact O-N 3.46Å; A1140-C1144 PolarHBondContact O-SG 2.89Å; A1140-C1144 VanDerWaalsContact O-SG 3.34Å; C1144-T1147 WeakPolarHBondContact CA-OG1 3.28Å; C1144-T1147 PolarHBondContact O-OG1 2.89Å; C1144-A1148 WeakPolarHBondContact O-CB 3.43Å; C1144-A1148 PolarHBondContact O-N 3.23Å; C1144-E1174 PolarHBondContact SG-OE1 3.35Å
1145	K	38.8	Very low	45.6	Very low	136 Å²	136	108.8 Å²	108.8	59%	0.591	59%	0.591	S	S	*	*	H	α-helix	trans	-69.3	-44.7	168.3	-78.6	169.6	-177.5	176.4	0	111.4	M1141 E1142 L1143 T1147 A1148 E1149	M1141-K1145 VanDerWaalsContact O-CB 3.3Å; M1141-K1145 WeakPolarHBondContact O-CB 3.34Å; M1141-K1145 WeakPolarHBondContact O-CG 3.04Å; M1141-K1145 PolarHBondContact O-N 3.47Å; E1142-K1145 PolarHBondContact O-N 3.43Å; L1143-K1145 VanDerWaalsContact C-N 3.28Å; L1143-K1145 PolarHBondContact O-N 2.85Å; K1145-T1147 VanDerWaalsContact C-N 3.28Å; K1145-T1147 PolarHBondContact O-N 3.37Å; K1145-A1148 PolarHBondContact O-N 2.93Å; K1145-E1149 PolarHBondContact O-N 3.37Å; K1145-E1149 VanDerWaalsContact O-N 3.14Å
1146	S	42.5	Very low	43.9	Very low	74 Å²	74	109.4 Å²	109.4	52%	0.517	61%	0.607	S	S	.	*	H	α-helix	trans	-65.7	-26.7	178.8	73.3	0	0	0	0	113.9	E1142 L1143	E1142-S1146 WeakPolarHBondContact O-CB 3.29Å; E1142-S1146 PolarHBondContact O-N 3.4Å; E1142-S1146 PolarHBondContact O-OG 2.94Å; L1143-S1146 WeakPolarHBondContact CA-OG 3.37Å; L1143-S1146 CarbonylContact O-C 3.5Å; L1143-S1146 PolarHBondContact O-N 3.04Å; L1143-S1146 PolarHBondContact O-OG 3.1Å
1147	T	40.9	Very low	42.6	Very low	75 Å²	75	114 Å²	114	46%	0.46	62%	0.623	S	S	.	*	H	α-helix	trans	-92.6	-25.5	173.1	52	0	0	0	0	113.7	L1143 C1144 K1145 E1149 S1150	L1143-T1147 PolarHBondContact O-N 2.83Å; L1143-T1147 PolarHBondContact O-OG1 2.92Å; L1143-T1147 VanDerWaalsContact O-OG1 3.11Å; C1144-T1147 WeakPolarHBondContact CA-OG1 3.28Å; C1144-T1147 PolarHBondContact O-OG1 2.89Å; K1145-T1147 VanDerWaalsContact C-N 3.28Å; K1145-T1147 PolarHBondContact O-N 3.37Å; T1147-E1149 VanDerWaalsContact C-N 3.35Å; T1147-S1150 PolarHBondContact O-N 3.47Å; T1147-S1150 PolarHBondContact O-OG 3.31Å
1148	A	38.5	Very low	41.5	Very low	48 Å²	48	114 Å²	114	40%	0.397	63%	0.634	S	S	.	*	H	α-helix	trans	-69.6	-30.9	173	0	0	0	0	0	112.7	C1144 K1145 S1150 I1152	C1144-A1148 WeakPolarHBondContact O-CB 3.43Å; C1144-A1148 PolarHBondContact O-N 3.23Å; K1145-A1148 PolarHBondContact O-N 2.93Å; A1148-S1150 VanDerWaalsContact C-N 3.29Å; A1148-S1150 PolarHBondContact O-N 3.14Å; A1148-I1152 WeakPolarHBondContact O-CD1 3.18Å; A1148-I1152 WeakPolarHBondContact O-CG1 3.44Å
1149	E	40.9	Very low	40.7	Very low	176 Å²	176	113.7 Å²	113.7	82%	0.822	64%	0.641	S	S	*	*	H	α-helix	trans	-74.9	-14.9	175.9	-71	-176.6	166.7	0	0	113.4	K1145 T1147	K1145-E1149 PolarHBondContact O-N 3.37Å; K1145-E1149 VanDerWaalsContact O-N 3.14Å; T1147-E1149 VanDerWaalsContact C-N 3.35Å
1150	S	44.3	Very low	39.8	Very low	80 Å²	80	116.4 Å²	116.4	56%	0.559	66%	0.658	S	S	*	*	H	α-helix	trans	-94.3	-20.5	177	55.8	0	0	0	0	115.6	T1147 A1148	T1147-S1150 PolarHBondContact O-N 3.47Å; T1147-S1150 PolarHBondContact O-OG 3.31Å; A1148-S1150 VanDerWaalsContact C-N 3.29Å; A1148-S1150 PolarHBondContact O-N 3.14Å
1151	D	38	Very low	39.1	Very low	132 Å²	132	118 Å²	118	71%	0.706	68%	0.679	S	S	*	*	H	α-helix	trans	-102.4	-4.1	-173	-84.9	-11.8	0	0	0	114.9	E1153	D1151-E1153 VanDerWaalsContact C-N 3.31Å; D1151-E1153 PolarHBondContact O-N 2.9Å
1152	I	40.5	Very low	38.5	Very low	142 Å²	142	122.6 Å²	122.6	73%	0.728	69%	0.689	S	S	*	*	G	3₁₀ helix	trans	-78.3	-12.1	-179.7	-72.7	172.4	0	0	0	113	A1148 K1154	A1148-I1152 WeakPolarHBondContact O-CD1 3.18Å; A1148-I1152 WeakPolarHBondContact O-CG1 3.44Å; I1152-K1154 PolarHBondContact O-N 3.35Å
1153	E	40.8	Very low	37.8	Very low	187 Å²	187	123.5 Å²	123.5	87%	0.874	69%	0.694	S	S	*	*	G	3₁₀ helix	trans	-85	7.3	-176	-138.9	178.7	-159.2	0	0	115.3	D1151	D1151-E1153 VanDerWaalsContact C-N 3.31Å; D1151-E1153 PolarHBondContact O-N 2.9Å
1154	K	38	Very low	36.9	Very low	201 Å²	201	123.2 Å²	123.2	87%	0.874	70%	0.701	S	S	*	*	G	3₁₀ helix	trans	-132.4	5.8	-171	-82	-176.8	179.9	167.6	0	119	I1152	I1152-K1154 PolarHBondContact O-N 3.35Å
1155	A	33.4	Very low	36.1	Very low	97 Å²	97	129.3 Å²	129.3	80%	0.802	73%	0.729	S	S	*	*			trans	-144.2	53.7	-177.3	0	0	0	0	0	115.8
1156	A	33.6	Very low	35.6	Very low	90 Å²	90	129.7 Å²	129.7	74%	0.744	74%	0.743	S	S	*	*			trans	-88	117.4	166.2	0	0	0	0	0	111.4
1157	N	35.1	Very low	34.8	Very low	155 Å²	155	135.5 Å²	135.5	83%	0.829	76%	0.762	S	S	*	*			trans	153.7	136.8	135.3	-77.2	-29.1	0	0	0	114.6
1158	T	34.8	Very low	34	Very low	129 Å²	129	140.5 Å²	140.5	79%	0.791	78%	0.78	S	S	*	*			trans	95.6	76.8	152.5	-10	0	0	0	0	122.4
1159	T	32.1	Very low	33.4	Very low	114 Å²	114	143.4 Å²	143.4	70%	0.699	80%	0.798	S	S	*	*				48.1	115.9	117	-17.9	0	0	0	0	124
1160	T	34.2	Very low	32.6	Very low	140 Å²	140	139.9 Å²	139.9	86%	0.859	79%	0.792	S	S	*	*			trans	63.4	131.2	139.6	54.1	0	0	0	0	124.5
1161	G	33.2	Very low	31.7	Very low	84 Å²	84	143.9 Å²	143.9	87%	0.866	81%	0.807	S	S	*	*			trans	176.4	136.6	158.1	0	0	0	0	0	113.7
1162	R	29.7	Very low	31.2	Very low	225 Å²	225	142.3 Å²	142.3	85%	0.849	81%	0.813	S	S	*	*			trans	-106.9	156.2	-166.2	-134.4	-175.7	179.3	167.6	-2.7	113.7
1163	Q	31.9	Very low	30.5	Very low	154 Å²	154	145.3 Å²	145.3	72%	0.72	82%	0.82	S	S	*	*			trans	86.3	107.8	146.4	-83.1	164.5	-22.1	0	0	123.3
1164	S	28.7	Very low	29.8	Very low	105 Å²	105	143.9 Å²	143.9	73%	0.734	81%	0.814	S	S	*	*			trans	50.7	105.4	133.5	65.1	0	0	0	0	122.4
1165	L	27.5	Very low	29.3	Very low	171 Å²	171	138.9 Å²	138.9	90%	0.895	80%	0.804	S	S	*	*				-151.8	172.4	128.3	-141.9	72.8	0	0	0	110.5
1166	V	28.2	Very low	28.9	Very low	145 Å²	145	143.4 Å²	143.4	88%	0.879	81%	0.809	S	S	*	*			trans	-61.1	142.6	-167	-179.8	0	0	0	0	113	E1168	V1166-E1168 PolarHBondContact O-N 3.45Å
1167	Q	26.3	Very low	28.6	Very low	196 Å²	196	149 Å²	149	92%	0.916	81%	0.812	S	S	*	*			trans	-93.1	88.7	-149.9	-158.9	168.2	-4.2	0	0	114.1
1168	E	25.2	Very low	28.2	Very low	179 Å²	179	146.7 Å²	146.7	84%	0.836	80%	0.797	S	S	*	*			trans	-91.8	129.3	166.4	-76.8	-172.1	139.2	0	0	112.6	V1166	V1166-E1168 PolarHBondContact O-N 3.45Å
1169	S	24.5	Very low	27.9	Very low	110 Å²	110	144.8 Å²	144.8	77%	0.769	79%	0.786	S	S	*	*			trans	63.2	144.8	144.4	77.2	0	0	0	0	122.8
1170	S	25.4	Very low	27.7	Very low	101 Å²	101	142.9 Å²	142.9	71%	0.706	77%	0.771	S	S	*	*			trans	98.4	115.2	146.8	79.9	0	0	0	0	120.7
1171	N	24.9	Very low	27.5	Very low	164 Å²	164	140.2 Å²	140.2	88%	0.877	76%	0.758	S	S	*	*			trans	58.4	95.1	133.8	-61.2	-9.6	0	0	0	120.7
1172	A	26.3	Very low	27.3	Very low	99 Å²	99	138.6 Å²	138.6	82%	0.818	73%	0.733	S	S	*	*			trans	-135.3	99.6	142.5	0	0	0	0	0	110.4
1173	K	25.8	Very low	27.3	Very low	205 Å²	205	129.9 Å²	129.9	89%	0.891	70%	0.702	S	S	*	*			trans	20.5	110.2	138.9	-61.5	178.5	175.5	-173.5	0	118.2
1174	E	26.3	Very low	27.1	Very low	157 Å²	157	125.9 Å²	125.9	73%	0.734	68%	0.68	S	S	*	*			trans	-159.7	129.9	132.2	-119	173.2	174.1	0	0	111.5	C1144	C1144-E1174 PolarHBondContact SG-OE1 3.35Å
1175	S	27.8	Very low	27.2	Very low	96 Å²	96	125.1 Å²	125.1	67%	0.671	68%	0.675	S	S	*	*			trans	37	120.1	169.4	-64.5	0	0	0	0	121.6	Y1177	S1175-Y1177 PolarHBondContact O-N 3.45Å; S1175-Y1177 VanDerWaalsContact O-N 3.1Å
1176	E	24.7	Very low	27.1	Very low	193 Å²	193	119.6 Å²	119.6	90%	0.902	66%	0.659	S	S	*	*			trans	-54	104.3	169.8	-58.7	172.1	126.7	0	0	113.1
1177	Y	27.2	Very low	27	Very low	208 Å²	208	116.6 Å²	116.6	82%	0.816	65%	0.649	S	S	*	*			trans	-127.1	133	162.3	-79.8	-85.3	0	0	0	109.8	S1175 T1179	S1175-Y1177 PolarHBondContact O-N 3.45Å; S1175-Y1177 VanDerWaalsContact O-N 3.1Å; Y1177-T1179 PolarHBondContact O-N 3.29Å
1178	M	26.8	Very low	27.1	Very low	105 Å²	105	113.6 Å²	113.6	52%	0.517	63%	0.634	S	S	.	*			trans	-53.3	130.4	-162.7	-64.5	-159.5	-157.9	0	0	112.6	L1180 F1183 F1188	M1178-L1180 PolarHBondContact O-N 2.95Å; M1178-F1183 HydrophobicContact CB-CB 4.48Å; M1178-F1183 HydrophobicContact SD-CB 4.49Å; M1178-F1183 HydrophobicContact SD-CD2 3.75Å; M1178-F1188 HydrophobicContact CE-CE1 4.09Å
1179	T	30.1	Very low	27.3	Very low	90 Å²	90	110.5 Å²	110.5	55%	0.552	63%	0.629	S	S	*	*			trans	-59.6	137.1	160.7	49.9	0	0	0	0	109	Y1177 S1181 S1182 F1183	Y1177-T1179 PolarHBondContact O-N 3.29Å; T1179-S1181 PolarHBondContact O-N 3.22Å; T1179-S1181 VanDerWaalsContact O-N 3.16Å; T1179-S1182 PolarHBondContact O-N 3.34Å; T1179-S1182 PolarHBondContact O-OG 3.48Å; T1179-S1182 PolarHBondContact OG1-OG 3.15Å; T1179-F1183 PolarHBondContact O-N 3.44Å; T1179-F1183 VanDerWaalsContact O-N 3.08Å
1180	L	27.2	Very low	27.4	Very low	73 Å²	73	110.4 Å²	110.4	38%	0.382	63%	0.629	S	S	.	*	H	α-helix	trans	-63.1	-28.9	-174.2	-57.5	167	0	0	0	110.4	D1019 M1178 F1183 W1184	D1019-L1180 HydrophobicContact CB-CB 4.05Å; D1019-L1180 HydrophobicContact CB-CD1 3.61Å; D1019-L1180 HydrophobicContact CB-CD2 3.26Å; D1019-L1180 HydrophobicContact CB-CG 3.72Å; M1178-L1180 PolarHBondContact O-N 2.95Å; L1180-F1183 WeakPolarHBondContact O-CB 3.33Å; L1180-F1183 PolarHBondContact O-N 2.85Å; L1180-W1184 PolarHBondContact O-N 3.26Å
1181	S	29	Very low	27.6	Very low	84 Å²	84	112.3 Å²	112.3	59%	0.587	64%	0.636	S	S	*	*	H	α-helix	trans	-62.6	-39.1	168.1	51.2	0	0	0	0	114.7	T1179 S1185	T1179-S1181 PolarHBondContact O-N 3.22Å; T1179-S1181 VanDerWaalsContact O-N 3.16Å; S1181-S1185 VanDerWaalsContact O-CB 3.28Å; S1181-S1185 WeakPolarHBondContact O-CB 3.29Å; S1181-S1185 PolarHBondContact O-N 3.3Å; S1181-S1185 PolarHBondContact O-OG 3.4Å
1182	S	29.8	Very low	27.7	Very low	50 Å²	50	111.9 Å²	111.9	35%	0.35	63%	0.634	S	S	.	*	H	α-helix	trans	-74.3	-34	175.7	69.8	0	0	0	0	111.7	T1179 S1185	T1179-S1182 PolarHBondContact O-N 3.34Å; T1179-S1182 PolarHBondContact O-OG 3.48Å; T1179-S1182 PolarHBondContact OG1-OG 3.15Å; S1182-S1185 PolarHBondContact O-N 3.2Å
1183	F	30.1	Very low	27.7	Very low	43 Å²	43	111.5 Å²	111.5	19%	0.189	63%	0.63	C	S	.	*	H	α-helix	trans	-61.8	-42.9	178.6	-166.6	-124.6	0	0	0	113.3	R1065 M1178 T1179 L1180	R1065-F1183 HydrophobicContact CB-CE1 3.76Å; R1065-F1183 HydrophobicContact CB-CZ 3.55Å; R1065-F1183 HydrophobicContact CG-CE1 3.88Å; R1065-F1183 HydrophobicContact CG-CE2 3.9Å; R1065-F1183 HydrophobicContact CG-CZ 3.28Å; R1065-F1183 VanDerWaalsContact NH1-CG 3.32Å; R1065-F1183 PolarHBondContact NH1-O 3.25Å; M1178-F1183 HydrophobicContact CB-CB 4.48Å; M1178-F1183 HydrophobicContact SD-CB 4.49Å; M1178-F1183 HydrophobicContact SD-CD2 3.75Å; T1179-F1183 PolarHBondContact O-N 3.44Å; T1179-F1183 VanDerWaalsContact O-N 3.08Å; L1180-F1183 WeakPolarHBondContact O-CB 3.33Å; L1180-F1183 PolarHBondContact O-N 2.85Å
1184	W	27.6	Very low	27.9	Very low	70 Å²	70	106.8 Å²	106.8	27%	0.265	62%	0.623	S	S	.	*	H	α-helix	trans	-85.4	-15.9	176.8	-69.6	101.2	0	0	0	114.9	D1019 L1180 G1186	D1019-W1184 PolarHBondContact OD1-NE1 3.25Å; D1019-W1184 VanDerWaalsContact OD2-CD1 3.26Å; D1019-W1184 PolarHBondContact OD2-NE1 3.14Å; L1180-W1184 PolarHBondContact O-N 3.26Å; W1184-G1186 VanDerWaalsContact C-N 3.32Å; W1184-G1186 PolarHBondContact O-N 3.19Å
1185	S	30.2	Very low	28	Very low	88 Å²	88	106.2 Å²	106.2	62%	0.615	62%	0.624	S	S	*	*	S	Bend	trans	-83.1	-1.7	-175.4	-63	0	0	0	0	114.8	S1181 S1182 A1187	S1181-S1185 VanDerWaalsContact O-CB 3.28Å; S1181-S1185 WeakPolarHBondContact O-CB 3.29Å; S1181-S1185 PolarHBondContact O-N 3.3Å; S1181-S1185 PolarHBondContact O-OG 3.4Å; S1182-S1185 PolarHBondContact O-N 3.2Å; S1185-A1187 PolarHBondContact O-N 2.87Å
1186	G	26.3	Very low	28.2	Very low	55 Å²	55	107 Å²	107	57%	0.567	62%	0.624	S	S	*	*			trans	67.8	1.7	174.1	0	0	0	0	0	116.1	W1184 F1188	W1184-G1186 VanDerWaalsContact C-N 3.32Å; W1184-G1186 PolarHBondContact O-N 3.19Å; G1186-F1188 VanDerWaalsContact C-N 3.32Å; G1186-F1188 PolarHBondContact O-N 3.37Å
1187	A	26.5	Very low	28.6	Very low	82 Å²	82	105.5 Å²	105.5	68%	0.678	62%	0.623	S	S	*	*			trans	-78.7	76	178.1	0	0	0	0	0	111.1	S1185 P1189	S1185-A1187 PolarHBondContact O-N 2.87Å; A1187-P1189 WeakPolarHBondContact O-CD 3.41Å
1188	F	28.1	Very low	28.8	Very low	134 Å²	134	98.9 Å²	98.9	59%	0.588	62%	0.618	S	S	*	*	P	Polyproline II helix	trans	-79.8	124.9	164.5	-78.1	-80.9	0	0	0	110	M1178 G1186	M1178-F1188 HydrophobicContact CE-CE1 4.09Å; G1186-F1188 VanDerWaalsContact C-N 3.32Å; G1186-F1188 PolarHBondContact O-N 3.37Å
1189	P	29.3	Very low	29	Very low	114 Å²	114	102.6 Å²	102.6	74%	0.74	63%	0.634	S	S	*	*	P	Polyproline II helix	trans	-60	143.8	160.6	-18.3	32.1	0	0	0	109.7	A1187 T1191	A1187-P1189 WeakPolarHBondContact O-CD 3.41Å; P1189-T1191 PolarHBondContact O-N 3.19Å
1190	S	26.5	Very low	28.9	Very low	108 Å²	108	106.4 Å²	106.4	76%	0.755	65%	0.645	S	S	*	*	P	Polyproline II helix	trans	-56.6	121.1	175.3	45.8	0	0	0	0	111.5
1191	T	28.7	Very low	29.2	Very low	141 Å²	141	110.4 Å²	110.4	87%	0.865	67%	0.665	S	S	*	*	P	Polyproline II helix	trans	-81	123.6	158.7	-26.2	0	0	0	0	107.5	P1189	P1189-T1191 PolarHBondContact O-N 3.19Å
1192	D	28	Very low	29.1	Very low	155 Å²	155	112.1 Å²	112.1	83%	0.829	67%	0.668	S	S	*	*	P	Polyproline II helix	trans	-60.5	137.9	-174	-83.4	-51.5	0	0	0	113
1193	A	25	Very low	29.2	Very low	90 Å²	90	117.7 Å²	117.7	74%	0.744	69%	0.688	S	S	*	*	P	Polyproline II helix	trans	-86.3	131.4	171.5	0	0	0	0	0	110.5
1194	S	29.9	Very low	29.3	Very low	106 Å²	106	118.9 Å²	118.9	74%	0.741	71%	0.712	S	S	*	*			trans	-115.2	105.2	147.1	44.6	0	0	0	0	107.3
1195	I	29.5	Very low	29.3	Very low	146 Å²	146	121.1 Å²	121.1	75%	0.749	74%	0.739	S	S	*	*				66.8	111.6	91.4	-62.2	156	0	0	0	108.5
1196	V	31.8	Very low	29.2	Very low	111 Å²	111	123 Å²	123	67%	0.673	75%	0.747	S	S	*	*				-161.6	139.6	60.1	177.5	0	0	0	0	111.5
1197	N	32.4	Very low	29.4	Very low	163 Å²	163	126.1 Å²	126.1	87%	0.872	76%	0.756	S	S	*	*			trans	44.8	147.3	156.9	-53.4	-14.6	0	0	0	120.7
1198	G	31.5	Very low	29.5	Very low	69 Å²	69	127.2 Å²	127.2	71%	0.711	76%	0.755	S	S	*	*			cis	162.4	147.9	5.2	0	0	0	0	0	105.4
1199	Q	32.2	Very low	29.5	Very low	183 Å²	183	126 Å²	126	86%	0.855	76%	0.763	S	S	*	*			cis	-152.4	176.6	38.9	-68.6	172.5	-91.4	0	0	112.2
1200	Q	28.1	Very low	29.5	Very low	170 Å²	170	129.2 Å²	129.2	79%	0.794	77%	0.768	S	S	*	*			trans	-30.7	154.5	169.3	-65.2	145.8	-49.2	0	0	116.5
1201	I	32	Very low	29.5	Very low	157 Å²	157	131.2 Å²	131.2	81%	0.805	77%	0.769	S	S	*	*				-153.3	122.3	59.7	-68.3	158.5	0	0	0	107
1202	D	28.6	Very low	29.5	Very low	120 Å²	120	134.7 Å²	134.7	64%	0.642	77%	0.773	S	S	*	*				83	141	70.5	-151.5	0.8	0	0	0	115.3
1203	H	32	Very low	29.5	Very low	166 Å²	166	131.9 Å²	131.9	77%	0.769	77%	0.771	S	S	*	*			trans	68.7	136.8	178.8	-46.1	-26.6	0	0	0	116.9
1204	G	30.4	Very low	29.5	Very low	68 Å²	68	137.4 Å²	137.4	70%	0.701	78%	0.778	S	S	*	*			cis	137.9	97.3	1.9	0	0	0	0	0	111.6
1205	S	27.8	Very low	29.4	Very low	118 Å²	118	143.7 Å²	143.7	83%	0.825	79%	0.786	S	S	*	*			trans	16.7	127.4	160.4	59.3	0	0	0	0	120.7
1206	V	27.8	Very low	29.3	Very low	128 Å²	128	147.1 Å²	147.1	78%	0.776	80%	0.795	S	S	*	*				-170.7	144.7	129.2	135.7	0	0	0	0	110
1207	P	30.5	Very low	29.1	Very low	119 Å²	119	146.5 Å²	146.5	77%	0.773	80%	0.796	S	S	*	*			trans	-89.7	141.3	-179.2	34.8	-34	0	0	0	112.7
1208	T	29.2	Very low	28.9	Very low	106 Å²	106	147 Å²	147	65%	0.65	79%	0.793	S	S	*	*			trans	-144.8	110.6	168.3	48.2	0	0	0	0	112.2
1209	S	27.7	Very low	28.8	Very low	107 Å²	107	149.3 Å²	149.3	75%	0.748	80%	0.798	S	S	*	*	S	Bend	trans	-60.3	153.2	145.9	46.3	0	0	0	0	109.9
1210	H	29.4	Very low	28.6	Very low	183 Å²	183	147.1 Å²	147.1	85%	0.847	80%	0.797	S	S	*	*			trans	57.3	93.3	-177.8	-66.7	-88.4	0	0	0	116.6
1211	L	27.9	Very low	28.6	Very low	150 Å²	150	146.6 Å²	146.6	79%	0.785	80%	0.795	S	S	*	*			trans	-175.8	76.1	150.6	-105.8	161.1	0	0	0	112.1
1212	F	27.5	Very low	28.5	Very low	214 Å²	214	147.6 Å²	147.6	94%	0.939	80%	0.796	S	S	*	*			trans	-150	7.2	163.4	-119.4	-78.9	0	0	0	116.8
1213	A	28.2	Very low	28.6	Very low	96 Å²	96	145.5 Å²	145.5	79%	0.793	80%	0.803	S	S	*	*	S	Bend	trans	-85	138.6	165.6	0	0	0	0	0	110.5
1214	K	26.3	Very low	28.5	Very low	205 Å²	205	147.2 Å²	147.2	89%	0.891	81%	0.808	S	S	*	*	S	Bend	trans	70.3	90.1	-173	-65	-177.4	171.2	-179.6	0	116.6
1215	R	26.7	Very low	28.8	Very low	238 Å²	238	149.8 Å²	149.8	90%	0.898	81%	0.813	S	S	*	*				176.9	94	123.9	-99.8	172.7	177.9	174.5	0.1	110.1
1216	F	27.4	Very low	29	Very low	218 Å²	218	148.6 Å²	148.6	96%	0.956	81%	0.81	S	S	*	*			trans	-170.7	88.8	142.2	-114.3	-75	0	0	0	108.6
1217	S	27.5	Very low	29	Very low	99 Å²	99	146.9 Å²	146.9	69%	0.692	80%	0.803	S	S	*	*			trans	-131.4	150	167.8	54.2	0	0	0	0	107.1
1218	E	27.7	Very low	29	Very low	173 Å²	173	150.1 Å²	150.1	81%	0.808	81%	0.806	S	S	*	*			trans	88.4	144.4	173.7	-53.5	171.6	-179.2	0	0	117.1
1219	S	29.6	Very low	28.9	Very low	117 Å²	117	149 Å²	149	82%	0.818	81%	0.807	S	S	*	*			trans	65.5	129.8	-166.8	78.7	0	0	0	0	114.2
1220	V	29.4	Very low	29	Very low	137 Å²	137	151.9 Å²	151.9	83%	0.83	81%	0.813	S	S	*	*			cis	-135.9	125.4	16.2	169.9	0	0	0	0	111.1
1221	Q	28.1	Very low	29.3	Very low	159 Å²	159	148.4 Å²	148.4	74%	0.743	81%	0.807	S	S	*	*			trans	-80.4	164.6	157.9	-62.4	179.5	-11.8	0	0	108.3
1222	Q	29.5	Very low	29.3	Very low	179 Å²	179	151.7 Å²	151.7	84%	0.836	82%	0.815	S	S	*	*			cis	-176.3	159.2	35	-145.9	170.6	71.1	0	0	108.1
1223	G	29.8	Very low	29.5	Very low	76 Å²	76	148.5 Å²	148.5	78%	0.784	81%	0.808	S	S	*	*			trans	170.1	94.1	171.5	0	0	0	0	0	115.6
1224	K	31	Very low	29.6	Very low	201 Å²	201	149.2 Å²	149.2	87%	0.874	81%	0.808	S	S	*	*			trans	-146	151.1	174.1	-92.4	-171.4	174.2	-176.4	0	110.2
1225	P	35.3	Very low	29.7	Very low	123 Å²	123	147.1 Å²	147.1	80%	0.799	80%	0.803	S	S	*	*				-130.7	144.2	119.5	5.9	16.8	0	0	0	111.6
1226	A	31.8	Very low	29.8	Very low	93 Å²	93	145.7 Å²	145.7	77%	0.769	80%	0.803	S	S	*	*				76.3	141.5	66.4	0	0	0	0	0	112.7
1227	S	29.6	Very low	29.7	Very low	91 Å²	91	141.3 Å²	141.3	64%	0.636	79%	0.794	S	S	*	*			cis	-176	147.7	5.4	35.4	0	0	0	0	108.6
1228	F	29.7	Very low	29.8	Very low	187 Å²	187	140.8 Å²	140.8	82%	0.82	80%	0.796	S	S	*	*				172.5	133.2	86.5	-95	-90.7	0	0	0	107
1229	A	28.1	Very low	29.9	Very low	82 Å²	82	139 Å²	139	68%	0.678	80%	0.797	S	S	*	*				62.3	135.8	83.4	0	0	0	0	0	115
1230	L	28.9	Very low	29.9	Very low	169 Å²	169	139.1 Å²	139.1	89%	0.885	80%	0.795	S	S	*	*			cis	-154.1	174.8	31.6	-79.7	170.3	0	0	0	113.7
1231	P	35	Very low	29.9	Very low	110 Å²	110	140.8 Å²	140.8	71%	0.714	80%	0.797	S	S	*	*			trans	-113.4	171.8	-174.4	41.8	-33.2	0	0	0	116.7
1232	F	28.8	Very low	29.9	Very low	218 Å²	218	140.3 Å²	140.3	96%	0.956	80%	0.8	S	S	*	*			trans	-144.1	168.9	164.3	-112.9	-87.8	0	0	0	113.2
1233	N	31	Very low	29.8	Very low	147 Å²	147	139.7 Å²	139.7	79%	0.786	80%	0.799	S	S	*	*			trans	-139.5	164.2	-154.8	-143.7	-3.3	0	0	0	113.3
1234	S	31.2	Very low	29.7	Very low	112 Å²	112	143.5 Å²	143.5	78%	0.783	80%	0.8	S	S	*	*			trans	75.5	161.2	165	81.4	0	0	0	0	119.9
1235	M	27	Very low	29.5	Very low	160 Å²	160	143.9 Å²	143.9	79%	0.788	80%	0.802	S	S	*	*			cis	174.1	106.2	-31.6	177.1	-178.9	-174.9	0	0	110.7
1236	F	29.2	Very low	29.2	Very low	208 Å²	208	143.7 Å²	143.7	91%	0.912	80%	0.798	S	S	*	*			trans	-169.4	115.8	162.1	-87.7	-72.7	0	0	0	107.5
1237	V	26.3	Very low	28.9	Very low	126 Å²	126	149.1 Å²	149.1	76%	0.764	81%	0.805	S	S	*	*				67.4	101.1	65	-175.8	0	0	0	0	115.2
1238	A	29.3	Very low	28.9	Very low	89 Å²	89	150.8 Å²	150.8	74%	0.736	81%	0.81	S	S	*	*				176.5	118.7	125.3	0	0	0	0	0	115.9
1239	V	28.6	Very low	28.9	Very low	135 Å²	135	150.9 Å²	150.9	82%	0.818	81%	0.811	S	S	*	*			trans	48.1	128.5	137.4	-168.3	0	0	0	0	122.2
1240	P	30.8	Very low	28.8	Very low	120 Å²	120	152 Å²	152	78%	0.779	81%	0.813	S	S	*	*			trans	-89.2	163.4	170.9	37.8	-35.7	0	0	0	114.1
1241	I	29.6	Very low	28.7	Very low	171 Å²	171	148.6 Å²	148.6	88%	0.877	80%	0.803	S	S	*	*			trans	-114.3	127.8	170.6	-65.7	177.6	0	0	0	110.4
1242	D	27.5	Very low	28.4	Very low	149 Å²	149	148.2 Å²	148.2	80%	0.797	80%	0.803	S	S	*	*			trans	-111.6	163	176.2	-141.3	-26.1	0	0	0	109.8
1243	M	26.8	Very low	28.5	Very low	166 Å²	166	146.3 Å²	146.3	82%	0.818	80%	0.796	S	S	*	*			trans	59.1	126.9	171.3	-66.5	-163.5	163.6	0	0	120.4
1244	L	28.4	Very low	28.3	Very low	156 Å²	156	147.5 Å²	147.5	82%	0.817	80%	0.797	S	S	*	*				-170.8	122.6	106.7	-102.1	155.1	0	0	0	113.2	V1246	L1244-V1246 HydrophobicContact CD2-CG2 3.86Å
1245	K	26.2	Very low	28.3	Very low	210 Å²	210	149.8 Å²	149.8	91%	0.913	80%	0.799	S	S	*	*			trans	-87.5	125.8	156.7	-73.5	175.6	176.9	172.4	0	108.1
1246	V	30.2	Very low	28.6	Very low	118 Å²	118	147.1 Å²	147.1	72%	0.715	80%	0.802	S	S	*	*			trans	-135.7	136.1	161.7	-176.3	0	0	0	0	109.8	L1244 V1248	L1244-V1246 HydrophobicContact CD2-CG2 3.86Å; V1246-V1248 HydrophobicContact CG1-CG2 4.05Å
1247	K	24.4	Very low	28.6	Very low	208 Å²	208	146.8 Å²	146.8	90%	0.904	80%	0.8	S	S	*	*			trans	-139.1	88.2	-178.8	-171.9	-167.3	-168.2	-174.3	0	108.1
1248	V	30.8	Very low	28.8	Very low	125 Å²	125	146.7 Å²	146.7	76%	0.758	80%	0.8	S	S	*	*			trans	-139.1	133.9	-178.7	-176.1	0	0	0	0	112.9	V1246	V1246-V1248 HydrophobicContact CG1-CG2 4.05Å
1249	F	27.8	Very low	29	Very low	190 Å²	190	149.2 Å²	149.2	83%	0.833	81%	0.806	S	S	*	*			trans	-16.5	133.8	165.3	-83.3	-112.1	0	0	0	121.6
1250	C	26.5	Very low	29.2	Very low	106 Å²	106	146.1 Å²	146.1	72%	0.716	80%	0.802	S	S	*	*				58.1	129.9	110.9	-134.1	0	0	0	0	123
1251	S	27.6	Very low	29.2	Very low	97 Å²	97	148.5 Å²	148.5	68%	0.678	81%	0.808	S	S	*	*			trans	78	120.1	138.6	54.3	0	0	0	0	123
1252	S	28.1	Very low	29.4	Very low	102 Å²	102	144 Å²	144	71%	0.713	80%	0.796	S	S	*	*			trans	61.4	116.5	141	55.7	0	0	0	0	121.4
1253	H	31.6	Very low	29.6	Very low	177 Å²	177	146.8 Å²	146.8	82%	0.819	80%	0.802	S	S	*	*				-168.8	156.3	99	-119.3	-90.5	0	0	0	114.2
1254	Q	26.2	Very low	30.1	Very low	172 Å²	172	142.5 Å²	142.5	80%	0.804	79%	0.793	S	S	*	*			trans	-82.1	162.7	168.8	-64.5	170.1	-42	0	0	112
1255	I	31.2	Very low	30.4	Very low	161 Å²	161	142.5 Å²	142.5	83%	0.826	79%	0.794	S	S	*	*			trans	142.8	115.2	134.6	-72.7	154.5	0	0	0	111.7
1256	A	32.9	Very low	30.9	Very low	103 Å²	103	138.6 Å²	138.6	85%	0.851	79%	0.793	S	S	*	*			trans	177.8	150.9	136.2	0	0	0	0	0	110.2
1257	K	30	Very low	31	Very low	201 Å²	201	136.4 Å²	136.4	87%	0.874	79%	0.794	S	S	*	*			trans	-152.3	148.2	-173.1	-151	-176.7	-170.3	-177.4	0	110.8
1258	T	31.3	Very low	31.5	Very low	124 Å²	124	132.8 Å²	132.8	76%	0.761	79%	0.794	S	S	*	*			trans	91.3	151.6	155.8	-37.1	0	0	0	0	118.9
1259	V	32.3	Very low	31.6	Very low	142 Å²	142	132 Å²	132	86%	0.861	80%	0.8	S	S	*	*			trans	84.3	126	174.7	-165.4	0	0	0	0	114.8
1260	G	33.4	Very low	31.9	Very low	70 Å²	70	126.3 Å²	126.3	72%	0.722	80%	0.795	S	S	*	*			cis	-174	164.5	-3.5	0	0	0	0	0	112.5
1261	N	30.3	Very low	32.4	Very low	170 Å²	170	129.6 Å²	129.6	91%	0.909	80%	0.804	S	S	*	*			trans	-76.9	154.3	-175.5	-67.8	-23.8	0	0	0	114.4
1262	A	34	Very low	32.4	Very low	77 Å²	77	130.4 Å²	130.4	64%	0.636	81%	0.808	S	S	*	*				157.8	156.8	111.1	0	0	0	0	0	115.6
1263	F	32.3	Very low	32.8	Very low	207 Å²	207	130.6 Å²	130.6	91%	0.908	81%	0.807	S	S	*	*			trans	73.3	150	170	-60.6	-84	0	0	0	119.1
1264	A	36.4	Very low	32.9	Very low	77 Å²	77	130.2 Å²	130.2	64%	0.636	81%	0.809	S	S	*	*				165.9	131.2	-54.6	0	0	0	0	0	110.9
1265	N	34.9	Very low	33.1	Very low	155 Å²	155	130.1 Å²	130.1	83%	0.829	81%	0.809	S	S	*	*			trans	76	138.1	151.8	-64.7	-11.2	0	0	0	124.2
1266	S	36.8	Very low	33.1	Very low	129 Å²	129	128.7 Å²	128.7	90%	0.902	81%	0.808	S	S	*	*			trans	70.4	139.7	155.4	67.2	0	0	0	0	119
1267	G	33.4	Very low	33.1	Very low	71 Å²	71	129.9 Å²	129.9	73%	0.732	80%	0.804	S	S	*	*			cis	155.3	136.4	4	0	0	0	0	0	112.3
1268	C	34	Very low	33.1	Very low	133 Å²	133	129.9 Å²	129.9	90%	0.899	81%	0.807	S	S	*	*			trans	63	107.6	158.8	-65.4	0	0	0	0	122.9
1269	A	34	Very low	33.4	Very low	107 Å²	107	128.6 Å²	128.6	88%	0.884	81%	0.809	S	S	*	*				47.8	132.3	119.5	0	0	0	0	0	123.1
1270	G	33.8	Very low	33.4	Very low	72 Å²	72	125.3 Å²	125.3	74%	0.742	80%	0.804	S	S	*	*			trans	165.2	78.8	158.3	0	0	0	0	0	120.3
1271	I	35.9	Very low	33.5	Very low	175 Å²	175	130 Å²	130	90%	0.897	81%	0.812	S	S	*	*			trans	55.6	124	136.5	-57.5	167.8	0	0	0	121.7
1272	C	27.4	Very low	33.7	Very low	113 Å²	113	133.4 Å²	133.4	76%	0.764	82%	0.822	S	S	*	*			trans	-44.5	-177.1	160.9	-85.1	0	0	0	0	118.4
1273	P	38	Very low	33.7	Very low	107 Å²	107	136.3 Å²	136.3	70%	0.695	83%	0.831	S	S	*	*			cis	-133.8	-178.7	-39.4	37.5	-21.3	0	0	0	111.9
1274	I	33.1	Very low	33.8	Very low	168 Å²	168	132.5 Å²	132.5	86%	0.862	83%	0.827	S	S	*	*			trans	-175.1	156	138.8	-99.9	156.4	0	0	0	111.2
1275	Q	31	Very low	33.6	Very low	171 Å²	171	135.6 Å²	135.6	80%	0.799	84%	0.837	S	S	*	*			trans	-74.3	171.8	-172.6	-61	162.8	-62.9	0	0	115
1276	T	29.3	Very low	33.5	Very low	130 Å²	130	134.5 Å²	134.5	80%	0.798	84%	0.838	S	S	*	*			trans	95.5	110.2	153.4	-27	0	0	0	0	116.5
1277	V	33.9	Very low	33.3	Very low	129 Å²	129	134.8 Å²	134.8	78%	0.782	83%	0.834	S	S	*	*				173.2	124.3	110.1	157.5	0	0	0	0	108.1
1278	Q	30.8	Very low	33.3	Very low	201 Å²	201	139.1 Å²	139.1	94%	0.939	84%	0.841	S	S	*	*			trans	-82.7	124	167.9	-72.4	174.5	-76.2	0	0	110.5
1279	A	36.5	Very low	33.3	Very low	97 Å²	97	139.5 Å²	139.5	80%	0.802	84%	0.837	S	S	*	*			trans	-164.1	121.6	144.8	0	0	0	0	0	105
1280	G	31.7	Very low	33.2	Very low	72 Å²	72	142 Å²	142	74%	0.742	83%	0.833	S	S	*	*			cis	109.9	83.3	32.1	0	0	0	0	0	107.8
1281	L	35.1	Very low	33.2	Very low	170 Å²	170	147.8 Å²	147.8	89%	0.89	84%	0.84	S	S	*	*			trans	-164.9	72.5	151.6	-104.9	162.9	0	0	0	107.9
1282	H	35.5	Very low	32.9	Very low	241 Å²	241	145.4 Å²	145.4	100%	1.116	84%	0.835	S	S	*	*			trans	39.7	0	174.8	-73.7	-75.6	0	0	0	116.8

Retrieved 1,282 of 1,282 residues in 1655.2 ms (Link to these results)

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