A0A077ZG22_TRITR Loading...

Protein diaphanous 2

AlphaFold DB , UniProt , Accession A0A077ZG22, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,154 aa.

						>A0A077ZG22_TRITR|A0A077ZG22
MLFGKVSGSFRSHNKARQHRRMPSDLSQDNFNETEHSVDDMYQSTTSLPTLPSHFDIDSLDRVQVEAIFEDMLEDMNLTESKKEPLRQVSLEQKRVMISQKIRTDQTVRGGKVKCDDPADYIRILSSVENADKLLATLRSLRVALSNNPISWIKQFGRQGLNMLLGILSWTSQYSISFWKARYCPTVSRNNGQLVFQQSEHECVKCLRAFMNNNYGLGQILSHPDSCRTLVQSLSVDVQSTMIDVVKLLAAICVVPARNDGAQSGHEKVLEALSCPNESDGRKKLAPILAALAITDNPALQNACMQLVNAIVIISDDLDLRLHLSNDFMRAGLADLIEILEASESEDLKLQVKIFTEHRDADLEDLYQQHENLRVEMDTPRKCYDMLERSLSNTPTLLPFLSILQHLLLVRGDEQTKTAYFKLIEEMVSYTVLNRSCYDYGYQQNKRFSLNIEDVLEKVMEGNRYESLERPLSSDMRHKLELLITEKQELQAKLAQVLEKMVEYEAEANSLRKYIDSDGDNSLPPLTEPLSPGTVQFLSRSDSLKSKGKLDTQGVVPSAAPPPPPPPPPPPPSLPGSKSTGVPPPPPPPPGPGSMAPPPPPPMLANSTVRFPPIGGSTTSAPPSLPSFLKQKQPYKPETTLRKVNWRIIKPSELSEHAFWTRSEEDKLKSDDLFKILELQFSTANAVSGVSKANIRKVKTLQVLEHKAAQALDILQGSTKMSAIEWKKAILEIDESVLSESALQQLIINLPDGESVEKLKAFSDRLDSLADVEQFVLTLVSIRRLKPRLQCICFKLKFAEMVDDIKPSIVAVTAACEEVRTSKGFSIFLELLLLVGNYMNSSTKASLAYGYHFQILSKLTEIRSVDQSKTLMHVLIDVISNRCPKELRFTDDFIHVKAAADVSPDVLAANLKEMQLSIQLVENELKQFQLQCENDRFEKLMNNFLSEAREQHQLLAKMHEKMLDSYNCLMKYFAFDPKKYTIGLFFGDLSNFKAVYESVLKENEEIRMRHQRLLQAEAARRLAEQERQDRQKQKIKLLAMTHDSEEGVMDSLLEALSTGQAFPQRFKTPGVESHTRRKHARPRGSSSAFAASRERADAPSNVATPGTVKKVRRAAKQPKAASQEVARPNDSGKLSDGIAGATDLADLLRRLKEA
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	30.3	Very low	31.8	Very low	246 Å²	246	155.6 Å²	155.6	100%	1.212	83%	0.831	S	S	*	*				0	128.9	0	-64.1	174.4	-179.1	0	0	107.4
2	L	31.3	Very low	31.8	Very low	169 Å²	169	151.2 Å²	151.2	89%	0.885	82%	0.821	S	S	*	*			trans	-134.7	16.4	-169.4	-94.5	167	0	0	0	115.4	G4	L2-G4 PolarHBondContact O-N 2.96Å
3	F	34.5	Very low	31.6	Very low	211 Å²	211	152 Å²	152	93%	0.925	82%	0.815	S	S	*	*			trans	-95.8	58.5	176.6	-69	-69.9	0	0	0	112.6	K5	F3-K5 PolarHBondContact O-N 3.11Å
4	G	30.3	Very low	31.5	Very low	65 Å²	65	152.1 Å²	152.1	67%	0.67	82%	0.816	S	S	*	*			trans	-70.5	109.1	170.8	0	0	0	0	0	110.8	L2 V6	L2-G4 PolarHBondContact O-N 2.96Å; G4-V6 PolarHBondContact O-N 2.93Å
5	K	33.5	Very low	31.2	Very low	199 Å²	199	154.5 Å²	154.5	87%	0.865	82%	0.816	S	S	*	*			trans	-70.3	93	179.2	-71.8	-178.7	177.3	177.9	0	111.3	F3 S7	F3-K5 PolarHBondContact O-N 3.11Å; K5-S7 PolarHBondContact O-N 2.63Å
6	V	34.2	Very low	31.1	Very low	139 Å²	139	150.6 Å²	150.6	84%	0.842	81%	0.813	S	S	*	*			trans	-76.1	75.6	170.2	-172.9	0	0	0	0	109.7	G4 G8	G4-V6 PolarHBondContact O-N 2.93Å; V6-G8 PolarHBondContact O-N 3.15Å
7	S	30.7	Very low	31	Very low	115 Å²	115	156.1 Å²	156.1	80%	0.804	82%	0.819	S	S	*	*			trans	-78	53.4	171	61.6	0	0	0	0	111.3	K5 S9	K5-S7 PolarHBondContact O-N 2.63Å; S7-S9 PolarHBondContact O-N 3.15Å
8	G	32.7	Very low	30.8	Very low	50 Å²	50	157.4 Å²	157.4	52%	0.515	82%	0.82	S	S	.	*			trans	-74.2	104.7	178.1	0	0	0	0	0	110.8	V6 F10	V6-G8 PolarHBondContact O-N 3.15Å; G8-F10 PolarHBondContact O-N 2.98Å
9	S	30.6	Very low	30.7	Very low	104 Å²	104	158.9 Å²	158.9	73%	0.727	82%	0.822	S	S	*	*			trans	-68.4	94	-178.8	-171.7	0	0	0	0	111.4	S7 R11	S7-S9 PolarHBondContact O-N 3.15Å; S9-R11 PolarHBondContact O-N 3.34Å
10	F	30.6	Very low	30.5	Very low	209 Å²	209	163 Å²	163	92%	0.917	83%	0.826	S	S	*	*			trans	-69.3	74	168.3	-98.4	-92.5	0	0	0	110.5	G8 S12	G8-F10 PolarHBondContact O-N 2.98Å; F10-S12 VanDerWaalsContact C-N 3.31Å; F10-S12 PolarHBondContact O-N 3.43Å
11	R	31.4	Very low	30.3	Very low	205 Å²	205	166.5 Å²	166.5	77%	0.774	83%	0.83	S	S	*	*			trans	-66.6	92.1	167	-95.4	-174.2	166.7	-178.7	-3.1	109.2	S9 H13	S9-R11 PolarHBondContact O-N 3.34Å; R11-H13 PolarHBondContact O-N 2.7Å; R11-H13 PolarHBondContact O-ND1 2.88Å
12	S	31.2	Very low	30.2	Very low	102 Å²	102	162.8 Å²	162.8	71%	0.713	81%	0.811	S	S	*	*			trans	-46.1	108.1	167.8	-178.8	0	0	0	0	109.7	F10 N14	F10-S12 VanDerWaalsContact C-N 3.31Å; F10-S12 PolarHBondContact O-N 3.43Å; S12-N14 PolarHBondContact O-N 2.93Å
13	H	30	Very low	30	Very low	162 Å²	162	160.4 Å²	160.4	75%	0.75	81%	0.806	S	S	*	*			trans	-79.7	101.6	171.1	-85.8	60.9	0	0	0	107.5	R11 K15	R11-H13 PolarHBondContact O-N 2.7Å; R11-H13 PolarHBondContact O-ND1 2.88Å; H13-K15 PolarHBondContact O-N 3.07Å
14	N	29.1	Very low	29.6	Very low	153 Å²	153	156 Å²	156	82%	0.818	80%	0.801	S	S	*	*			trans	-62.7	73.2	167.6	-81.1	-24	0	0	0	110.4	S12 A16	S12-N14 PolarHBondContact O-N 2.93Å; N14-A16 PolarHBondContact O-N 2.99Å
15	K	28.1	Very low	29.5	Very low	189 Å²	189	160 Å²	160	82%	0.822	81%	0.807	S	S	*	*			trans	-67.4	102.7	165.4	-86.7	-170.9	172.7	-179.2	0	107.3	H13 R17	H13-K15 PolarHBondContact O-N 3.07Å; K15-R17 PolarHBondContact O-N 2.99Å
16	A	29.8	Very low	29.3	Very low	92 Å²	92	158.7 Å²	158.7	76%	0.76	81%	0.809	S	S	*	*			trans	-48.8	112.6	178.7	0	0	0	0	0	110.6	N14 Q18	N14-A16 PolarHBondContact O-N 2.99Å; A16-Q18 PolarHBondContact O-N 3.36Å; A16-Q18 VanDerWaalsContact O-N 3.08Å
17	R	29.2	Very low	29	Very low	244 Å²	244	156.1 Å²	156.1	92%	0.921	80%	0.797	S	S	*	*			trans	-65.8	110	167.3	-91.1	-174.5	166.7	-178.7	-3.4	107	K15	K15-R17 PolarHBondContact O-N 2.99Å
18	Q	27.1	Very low	28.8	Very low	180 Å²	180	159.9 Å²	159.9	84%	0.841	80%	0.802	S	S	*	*			trans	-54.7	138.8	-178.7	-67.5	169.9	-33.8	0	0	110.5	A16 R20	A16-Q18 PolarHBondContact O-N 3.36Å; A16-Q18 VanDerWaalsContact O-N 3.08Å; Q18-R20 PolarHBondContact O-N 3.36Å
19	H	28.5	Very low	28.7	Very low	185 Å²	185	163.2 Å²	163.2	86%	0.856	81%	0.808	S	S	*	*			trans	-63.2	91.5	175.4	-67.1	-94.1	0	0	0	110.7	R21	H19-R21 VanDerWaalsContact C-N 3.28Å; H19-R21 PolarHBondContact O-N 3.35Å
20	R	27.6	Very low	28.5	Very low	240 Å²	240	165.2 Å²	165.2	91%	0.906	81%	0.81	S	S	*	*			trans	-68.6	94.2	158.5	-89.8	-167.7	171.5	-170.7	-2.7	107.8	Q18 M22	Q18-R20 PolarHBondContact O-N 3.36Å; R20-M22 PolarHBondContact O-N 2.86Å
21	R	25.2	Very low	28.3	Very low	238 Å²	238	165.2 Å²	165.2	90%	0.898	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-54.5	118.8	165.2	-62.5	175	177.4	175.6	-3.6	108	H19	H19-R21 VanDerWaalsContact C-N 3.28Å; H19-R21 PolarHBondContact O-N 3.35Å
22	M	28.4	Very low	28.1	Very low	168 Å²	168	161.5 Å²	161.5	83%	0.828	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-97.6	155.5	152.9	-74.7	-58	-153.8	0	0	108.4	R20	R20-M22 PolarHBondContact O-N 2.86Å
23	P	27.9	Very low	27.8	Very low	119 Å²	119	165.8 Å²	165.8	77%	0.773	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-70.6	137.9	-161.6	-20.5	34.3	0	0	0	113.5	D25	P23-D25 VanDerWaalsContact C-N 3.35Å; P23-D25 PolarHBondContact O-N 3.3Å
24	S	26	Very low	27.7	Very low	117 Å²	117	163 Å²	163	82%	0.818	81%	0.809	S	S	*	*			trans	-90	69.7	169.2	56.4	0	0	0	0	110
25	D	28.7	Very low	27.6	Very low	150 Å²	150	164.7 Å²	164.7	80%	0.802	81%	0.812	S	S	*	*			trans	-149	83.5	172.9	-89.5	-48.1	0	0	0	110.2	P23	P23-D25 VanDerWaalsContact C-N 3.35Å; P23-D25 PolarHBondContact O-N 3.3Å
26	L	27.8	Very low	27.5	Very low	171 Å²	171	163.3 Å²	163.3	90%	0.895	81%	0.808	S	S	*	*			trans	-155.9	144.3	150.1	-110.5	168.4	0	0	0	108.2
27	S	28.8	Very low	27.3	Very low	86 Å²	86	162.4 Å²	162.4	60%	0.601	80%	0.796	S	S	*	*			trans	-73.5	161.1	-163.1	33.3	0	0	0	0	114.9	D29	S27-D29 PolarHBondContact O-N 2.93Å; S27-D29 PolarHBondContact OG-OD2 3.5Å
28	Q	27.1	Very low	27.3	Very low	194 Å²	194	156.4 Å²	156.4	91%	0.907	79%	0.786	S	S	*	*			trans	-71.6	72.8	164.6	-63.7	173.3	-96.5	0	0	110.5	N30	Q28-N30 PolarHBondContact O-N 2.91Å
29	D	28.9	Very low	27.4	Very low	120 Å²	120	152.8 Å²	152.8	64%	0.642	77%	0.773	S	S	*	*			trans	-78.3	118.7	163.6	-73.4	-66.3	0	0	0	108.7	S27 F31	S27-D29 PolarHBondContact O-N 2.93Å; S27-D29 PolarHBondContact OG-OD2 3.5Å; D29-F31 PolarHBondContact O-N 3.34Å
30	N	28	Very low	27.5	Very low	145 Å²	145	149 Å²	149	78%	0.775	76%	0.759	S	S	*	*			trans	-62.5	111	-179.6	-82.4	-26.5	0	0	0	109.7	Q28 N32	Q28-N30 PolarHBondContact O-N 2.91Å; N30-N32 PolarHBondContact O-N 3.06Å
31	F	25.3	Very low	27.5	Very low	210 Å²	210	145.2 Å²	145.2	92%	0.921	75%	0.753	S	S	*	*			trans	-66.4	82.3	151.9	-83.7	-94.1	0	0	0	108.1	D29 E33	D29-F31 PolarHBondContact O-N 3.34Å; F31-E33 PolarHBondContact O-N 2.92Å
32	N	27	Very low	27.8	Very low	126 Å²	126	143.4 Å²	143.4	67%	0.674	75%	0.748	S	S	*	*			trans	-56.4	133.5	156.2	-93.7	0.9	0	0	0	107.5	N30 T34	N30-N32 PolarHBondContact O-N 3.06Å; N32-T34 PolarHBondContact O-N 3.17Å
33	E	26.4	Very low	27.7	Very low	192 Å²	192	141.5 Å²	141.5	90%	0.897	74%	0.737	S	S	*	*			trans	-73.1	71.8	173	-65.1	171.7	129.3	0	0	109.3	F31 E35	F31-E33 PolarHBondContact O-N 2.92Å; E33-E35 VanDerWaalsContact C-N 3.32Å; E33-E35 PolarHBondContact O-N 3.31Å
34	T	26.1	Very low	27.7	Very low	103 Å²	103	140.9 Å²	140.9	63%	0.632	74%	0.736	S	S	*	*			trans	-68.6	98.6	158.7	42.7	0	0	0	0	107.4	N32 H36	N32-T34 PolarHBondContact O-N 3.17Å; T34-H36 VanDerWaalsContact C-N 3.27Å; T34-H36 PolarHBondContact O-N 3.27Å
35	E	26.9	Very low	27.8	Very low	189 Å²	189	140.2 Å²	140.2	88%	0.883	73%	0.727	S	S	*	*			trans	-54.9	90.9	167	-64.3	-179.2	124.6	0	0	109.2	E33 S37	E33-E35 VanDerWaalsContact C-N 3.32Å; E33-E35 PolarHBondContact O-N 3.31Å; E35-S37 PolarHBondContact O-N 2.83Å
36	H	26.1	Very low	27.8	Very low	161 Å²	161	138.9 Å²	138.9	75%	0.745	72%	0.724	S	S	*	*			trans	-69.5	89.6	167.3	-81.4	-68	0	0	0	108	T34 V38	T34-H36 VanDerWaalsContact C-N 3.27Å; T34-H36 PolarHBondContact O-N 3.27Å; H36-V38 PolarHBondContact O-N 2.8Å
37	S	26.7	Very low	27.8	Very low	72 Å²	72	135.1 Å²	135.1	50%	0.503	71%	0.712	S	S	.	*			trans	-55.1	138	167.8	-166.6	0	0	0	0	109.1	E35 D39	E35-S37 PolarHBondContact O-N 2.83Å; S37-D39 WeakPolarHBondContact CB-OD2 3.45Å; S37-D39 PolarHBondContact O-N 2.62Å; S37-D39 PolarHBondContact OG-OD2 3.23Å
38	V	29.3	Very low	27.9	Very low	118 Å²	118	136.8 Å²	136.8	72%	0.715	71%	0.714	S	S	*	*	G	3₁₀ helix	trans	-77.1	0.9	-175.2	-175.3	0	0	0	0	111.6	H36 D40	H36-V38 PolarHBondContact O-N 2.8Å; V38-D40 VanDerWaalsContact C-N 3.25Å; V38-D40 PolarHBondContact O-N 2.87Å
39	D	29.6	Very low	28.2	Very low	105 Å²	105	132.1 Å²	132.1	56%	0.561	70%	0.7	S	S	*	*	G	3₁₀ helix	trans	-55.2	-35.7	176.3	-65.2	-52.9	0	0	0	113.2	S37 M41 Y42 Q43	S37-D39 WeakPolarHBondContact CB-OD2 3.45Å; S37-D39 PolarHBondContact O-N 2.62Å; S37-D39 PolarHBondContact OG-OD2 3.23Å; D39-M41 VanDerWaalsContact C-N 3.29Å; D39-M41 PolarHBondContact O-N 2.94Å; D39-Y42 CarbonylContact O-C 3.55Å; D39-Y42 WeakPolarHBondContact O-CA 3.39Å; D39-Y42 PolarHBondContact O-N 3.08Å; D39-Q43 PolarHBondContact O-N 2.83Å; D39-Q43 VanDerWaalsContact O-N 3.08Å
40	D	29.4	Very low	28.5	Very low	105 Å²	105	132.2 Å²	132.2	56%	0.561	71%	0.705	S	S	*	*	G	3₁₀ helix	trans	-70.5	-18.6	-170.4	-75.6	-1.3	0	0	0	114.5	V38 Y42 Q43	V38-D40 VanDerWaalsContact C-N 3.25Å; V38-D40 PolarHBondContact O-N 2.87Å; D40-Y42 VanDerWaalsContact C-N 3.29Å; D40-Q43 PolarHBondContact O-N 3.01Å; D40-Q43 PolarHBondContact OD1-NE2 3.48Å
41	M	27.8	Very low	29.1	Very low	160 Å²	160	129 Å²	129	79%	0.788	69%	0.687	S	S	*	*	G	3₁₀ helix	trans	-78	-12.7	169.5	-77.5	-148.8	71.7	0	0	113.7	D39	D39-M41 VanDerWaalsContact C-N 3.29Å; D39-M41 PolarHBondContact O-N 2.94Å
42	Y	31.3	Very low	29.8	Very low	201 Å²	201	122 Å²	122	79%	0.788	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.1	-2.5	167.4	-71.8	-74	0	0	0	113.2	D39 D40 S44 T45	D39-Y42 CarbonylContact O-C 3.55Å; D39-Y42 WeakPolarHBondContact O-CA 3.39Å; D39-Y42 PolarHBondContact O-N 3.08Å; D40-Y42 VanDerWaalsContact C-N 3.29Å; Y42-S44 CarbonylContact O-C 3.59Å; Y42-S44 PolarHBondContact O-N 3.43Å; Y42-T45 PolarHBondContact O-N 3.32Å
43	Q	25.8	Very low	30.9	Very low	128 Å²	128	121.4 Å²	121.4	60%	0.598	67%	0.669	S	S	*	*			trans	-74.3	8.9	162.7	-66.2	-152.2	66.8	0	0	113.8	D39 D40 T45	D39-Q43 PolarHBondContact O-N 2.83Å; D39-Q43 VanDerWaalsContact O-N 3.08Å; D40-Q43 PolarHBondContact O-N 3.01Å; D40-Q43 PolarHBondContact OD1-NE2 3.48Å; Q43-T45 PolarHBondContact O-N 3.37Å; Q43-T45 PolarHBondContact O-OG1 3.48Å
44	S	28.4	Very low	31.9	Very low	106 Å²	106	120.5 Å²	120.5	74%	0.741	67%	0.665	S	S	*	*			trans	-69.1	52	139.8	-68.5	0	0	0	0	111.1	Y42 T46	Y42-S44 CarbonylContact O-C 3.59Å; Y42-S44 PolarHBondContact O-N 3.43Å; S44-T46 PolarHBondContact O-N 3.49Å
45	T	28.2	Very low	33.1	Very low	102 Å²	102	120.7 Å²	120.7	63%	0.626	66%	0.657	S	S	*	*			trans	-58.6	99.5	141.8	50.8	0	0	0	0	105.7	Y42 Q43 S47	Y42-T45 PolarHBondContact O-N 3.32Å; Q43-T45 PolarHBondContact O-N 3.37Å; Q43-T45 PolarHBondContact O-OG1 3.48Å; T45-S47 PolarHBondContact O-N 3.18Å
46	T	29.8	Very low	34.7	Very low	122 Å²	122	115.9 Å²	115.9	75%	0.748	64%	0.637	S	S	*	*			trans	-50.4	100	137.4	-58.9	0	0	0	0	104.4	S44 L48	S44-T46 PolarHBondContact O-N 3.49Å; T46-L48 PolarHBondContact O-N 3.42Å
47	S	27.2	Very low	36.6	Very low	92 Å²	92	109.2 Å²	109.2	64%	0.643	61%	0.607	S	S	*	*			trans	-64.9	92.6	169.5	55.2	0	0	0	0	104.8	T45 P49	T45-S47 PolarHBondContact O-N 3.18Å; S47-P49 WeakPolarHBondContact O-CD 3.49Å
48	L	29.9	Very low	38.8	Very low	121 Å²	121	110.3 Å²	110.3	63%	0.634	61%	0.607	S	S	*	*			trans	-41.4	117.7	158.4	-117	76.4	0	0	0	104.2	T46 T50	T46-L48 PolarHBondContact O-N 3.42Å; L48-T50 VanDerWaalsContact C-N 3.35Å; L48-T50 VanDerWaalsContact O-CA 3.29Å; L48-T50 WeakPolarHBondContact O-CA 3.28Å; L48-T50 PolarHBondContact O-N 2.91Å; L48-T50 PolarHBondContact O-OG1 2.88Å
49	P	33.1	Very low	41	Very low	96 Å²	96	108.5 Å²	108.5	62%	0.623	60%	0.599	S	S	*	*			trans	-58.4	106.1	-178.4	22.2	-31.6	0	0	0	105.8	S47 L51	S47-P49 WeakPolarHBondContact O-CD 3.49Å; P49-L51 WeakPolarHBondContact O-CA 3.07Å; P49-L51 PolarHBondContact O-N 2.92Å
50	T	37.1	Very low	43.3	Very low	123 Å²	123	104 Å²	104	76%	0.755	58%	0.575	S	S	*	*			trans	-69.4	78.4	-149.7	-50.8	0	0	0	0	111.3	L48 P52	L48-T50 VanDerWaalsContact C-N 3.35Å; L48-T50 VanDerWaalsContact O-CA 3.29Å; L48-T50 WeakPolarHBondContact O-CA 3.28Å; L48-T50 PolarHBondContact O-N 2.91Å; L48-T50 PolarHBondContact O-OG1 2.88Å; T50-P52 VanDerWaalsContact C-CD 3.47Å; T50-P52 VanDerWaalsContact C-N 3.28Å; T50-P52 WeakPolarHBondContact O-CA 3.32Å; T50-P52 VanDerWaalsContact O-CD 3.27Å; T50-P52 WeakPolarHBondContact O-CD 3.5Å
51	L	38.8	Very low	45.8	Very low	76 Å²	76	102.5 Å²	102.5	40%	0.398	57%	0.567	S	S	.	*			trans	-31.7	89.7	-140.2	-100.9	161.7	0	0	0	111.3	P49 S53 I68 I102	P49-L51 WeakPolarHBondContact O-CA 3.07Å; P49-L51 PolarHBondContact O-N 2.92Å; L51-S53 PolarHBondContact O-N 3.45Å; L51-S53 VanDerWaalsContact O-N 3.17Å; L51-I68 HydrophobicContact CD1-CG2 4.3Å; L51-I68 HydrophobicContact CD2-CD1 4.35Å; L51-I102 HydrophobicContact CD1-CD1 3.97Å; L51-I102 HydrophobicContact CD1-CG1 4.39Å
52	P	41.1	Very low	48.4	Very low	65 Å²	65	102.3 Å²	102.3	42%	0.422	56%	0.558	S	S	.	*			trans	-55	130.6	-165.5	-29.3	33.8	0	0	0	108.4	T50 H54 F55	T50-P52 VanDerWaalsContact C-CD 3.47Å; T50-P52 VanDerWaalsContact C-N 3.28Å; T50-P52 WeakPolarHBondContact O-CA 3.32Å; T50-P52 VanDerWaalsContact O-CD 3.27Å; T50-P52 WeakPolarHBondContact O-CD 3.5Å; P52-H54 PolarHBondContact O-N 3.37Å; P52-F55 HydrophobicContact CB-CD2 3.9Å; P52-F55 HydrophobicContact CB-CE2 4.37Å; P52-F55 HydrophobicContact CG-CD2 3.82Å; P52-F55 HydrophobicContact CG-CE2 3.94Å; P52-F55 PolarHBondContact O-N 3.11Å
53	S	49.7	Very low	51.1	Low	112 Å²	112	98 Å²	98	78%	0.783	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.6	13.1	-156.9	62.9	0	0	0	0	115.5	L51	L51-S53 PolarHBondContact O-N 3.45Å; L51-S53 VanDerWaalsContact O-N 3.17Å
54	H	48.3	Very low	53.9	Low	174 Å²	174	95.9 Å²	95.9	81%	0.806	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-145.5	22.3	176.7	-143.4	-60.7	0	0	0	112.9	P52 D56	P52-H54 PolarHBondContact O-N 3.37Å; H54-D56 PolarHBondContact O-N 3.07Å; H54-D56 VanDerWaalsContact O-N 3.1Å
55	F	50.3	Low	56.5	Low	107 Å²	107	90.9 Å²	90.9	47%	0.469	51%	0.507	S	S	.	.			trans	-61.6	113	159.1	-107.5	-83	0	0	0	107.7	P52 I57 L60	P52-F55 HydrophobicContact CB-CD2 3.9Å; P52-F55 HydrophobicContact CB-CE2 4.37Å; P52-F55 HydrophobicContact CG-CD2 3.82Å; P52-F55 HydrophobicContact CG-CE2 3.94Å; P52-F55 PolarHBondContact O-N 3.11Å; F55-I57 PolarHBondContact O-N 3.34Å; F55-I57 VanDerWaalsContact O-N 3.13Å; F55-L60 HydrophobicContact CD1-CD2 3.61Å; F55-L60 HydrophobicContact CD1-CG 4.47Å; F55-L60 HydrophobicContact CE1-CD2 3.9Å
56	D	61.8	Low	59.3	Low	87 Å²	87	88.7 Å²	88.7	47%	0.465	49%	0.49	S	S	.	.			trans	-68.3	107.3	172.3	-179.2	2	0	0	0	107.8	H54 D58 S59 L60	H54-D56 PolarHBondContact O-N 3.07Å; H54-D56 VanDerWaalsContact O-N 3.1Å; D56-D58 PolarHBondContact O-N 3.24Å; D56-D58 VanDerWaalsContact O-N 3.17Å; D56-D58 WeakPolarHBondContact OD1-CB 3.5Å; D56-D58 PolarHBondContact OD1-N 3.24Å; D56-D58 VanDerWaalsContact OD1-N 3.16Å; D56-S59 WeakPolarHBondContact O-CA 3.49Å; D56-S59 WeakPolarHBondContact O-CB 3.44Å; D56-S59 PolarHBondContact O-N 3Å; D56-S59 PolarHBondContact O-OG 3.35Å; D56-L60 PolarHBondContact O-N 2.87Å
57	I	65.9	Low	62	Low	22 Å²	22	85.3 Å²	85.3	11%	0.113	47%	0.474	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-21.7	-175.2	-66.4	164.4	0	0	0	110.8	F55 S59 L60 R95 I98 S99 I102	F55-I57 PolarHBondContact O-N 3.34Å; F55-I57 VanDerWaalsContact O-N 3.13Å; I57-S59 VanDerWaalsContact C-N 3.33Å; I57-L60 HydrophobicContact CB-CD1 4.46Å; I57-L60 HydrophobicContact CG1-CD1 4.42Å; I57-L60 HydrophobicContact CG2-CD1 4.4Å; I57-R95 HydrophobicContact CG2-CB 3.71Å; I57-R95 HydrophobicContact CG2-CG 3.72Å; I57-R95 WeakPolarHBondContact O-CD 3.38Å; I57-R95 PolarHBondContact O-NE 2.84Å; I57-I98 HydrophobicContact CD1-CG2 4.16Å; I57-S99 VanDerWaalsContact CD1-OG 3.32Å; I57-S99 WeakPolarHBondContact CD1-OG 3.45Å; I57-I102 HydrophobicContact CD1-CD1 3.94Å
58	D	71.7	Confident	64.7	Low	94 Å²	94	82.5 Å²	82.5	50%	0.503	45%	0.452	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-20.6	177.1	-55.2	-19.5	0	0	0	111.6	D56 R95	D56-D58 PolarHBondContact O-N 3.24Å; D56-D58 VanDerWaalsContact O-N 3.17Å; D56-D58 WeakPolarHBondContact OD1-CB 3.5Å; D56-D58 PolarHBondContact OD1-N 3.24Å; D56-D58 VanDerWaalsContact OD1-N 3.16Å; D58-R95 PolarHBondContact O-NH2 2.9Å
59	S	75.6	Confident	67.4	Low	80 Å²	80	76.8 Å²	76.8	56%	0.559	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.6	-18.8	173.2	80.6	0	0	0	0	114.3	D56 I57	D56-S59 WeakPolarHBondContact O-CA 3.49Å; D56-S59 WeakPolarHBondContact O-CB 3.44Å; D56-S59 PolarHBondContact O-N 3Å; D56-S59 PolarHBondContact O-OG 3.35Å; I57-S59 VanDerWaalsContact C-N 3.33Å
60	L	78.4	Confident	70	Confident	10 Å²	10	74.7 Å²	74.7	5%	0.052	40%	0.404	C	S	.	.	S	Bend	trans	-65.6	138.2	176.1	-64.8	174.5	0	0	0	110.5	F55 D56 I57 Q64 V65 I68 R95	F55-L60 HydrophobicContact CD1-CD2 3.61Å; F55-L60 HydrophobicContact CD1-CG 4.47Å; F55-L60 HydrophobicContact CE1-CD2 3.9Å; D56-L60 PolarHBondContact O-N 2.87Å; I57-L60 HydrophobicContact CB-CD1 4.46Å; I57-L60 HydrophobicContact CG1-CD1 4.42Å; I57-L60 HydrophobicContact CG2-CD1 4.4Å; L60-Q64 HydrophobicContact CB-CB 4.24Å; L60-Q64 HydrophobicContact CD2-CB 4.33Å; L60-V65 HydrophobicContact CB-CG2 3.64Å; L60-V65 HydrophobicContact CD1-CG2 4.35Å; L60-I68 HydrophobicContact CD1-CD1 3.87Å; L60-R95 PolarHBondContact O-NH2 2.91Å
61	D	81.8	Confident	72.1	Confident	75 Å²	75	72.9 Å²	72.9	40%	0.401	39%	0.389	S	S	.	.			trans	-70.4	168	174.5	80.1	43.1	0	0	0	112	V63 Q64 V65	D61-V63 VanDerWaalsContact C-N 3.3Å; D61-V63 PolarHBondContact O-N 3.01Å; D61-V63 WeakPolarHBondContact OD1-CA 3.13Å; D61-V63 WeakPolarHBondContact OD1-CB 3.49Å; D61-V63 PolarHBondContact OD1-N 2.65Å; D61-Q64 PolarHBondContact O-N 3.05Å; D61-Q64 PolarHBondContact OD1-N 2.95Å; D61-Q64 PolarHBondContact OD2-NE2 3.17Å; D61-V65 WeakPolarHBondContact O-CG2 3.22Å; D61-V65 PolarHBondContact O-N 3.4Å
62	R	83.2	Confident	74.2	Confident	156 Å²	156	70.3 Å²	70.3	59%	0.589	38%	0.376	S	S	*	.	H	α-helix	trans	-56.5	-41.5	-178.2	173.4	174.1	175.5	173.5	7	112.9	E66 L91	R62-E66 HydrophobicContact CG-CG 4.35Å; R62-E66 VanDerWaalsContact CG-OE2 3.28Å; R62-E66 WeakPolarHBondContact CG-OE2 3.41Å; R62-E66 IonicContact CZ-OE1 2.77Å; R62-E66 IonicContact CZ-OE2 2.84Å; R62-E66 IonicContact NE-OE1 3.51Å; R62-E66 PolarHBondContact NE-OE1 2.78Å; R62-E66 IonicContact NE-OE2 2.88Å; R62-E66 PolarHBondContact NE-OE2 2.96Å; R62-E66 IonicContact NH2-OE1 3.6Å; R62-E66 PolarHBondContact NH2-OE1 3.06Å; R62-E66 IonicContact NH2-OE2 3.86Å; R62-E66 WeakPolarHBondContact O-CB 3.35Å; R62-E66 VanDerWaalsContact O-CG 3.31Å; R62-E66 WeakPolarHBondContact O-CG 3.43Å; R62-E66 PolarHBondContact O-N 2.91Å; R62-L91 HydrophobicContact CB-CD2 3.96Å; R62-L91 HydrophobicContact CG-CD1 4.06Å; R62-L91 HydrophobicContact CG-CD2 4.09Å
63	V	86.2	Confident	76.2	Confident	109 Å²	109	67.4 Å²	67.4	66%	0.661	36%	0.356	S	S	*	.	H	α-helix	trans	-70.4	-39.7	-176.5	-174.7	0	0	0	0	110.1	D61 E66 A67	D61-V63 VanDerWaalsContact C-N 3.3Å; D61-V63 PolarHBondContact O-N 3.01Å; D61-V63 WeakPolarHBondContact OD1-CA 3.13Å; D61-V63 WeakPolarHBondContact OD1-CB 3.49Å; D61-V63 PolarHBondContact OD1-N 2.65Å; V63-E66 PolarHBondContact O-N 2.87Å; V63-A67 WeakPolarHBondContact O-CB 3.45Å; V63-A67 PolarHBondContact O-N 2.72Å
64	Q	84.6	Confident	77.6	Confident	85 Å²	85	66.6 Å²	66.6	40%	0.397	34%	0.34	S	S	.	.	H	α-helix	trans	-65.5	-43.8	176	-63.5	170.4	28.4	0	0	111.8	L60 D61 A67 I68	L60-Q64 HydrophobicContact CB-CB 4.24Å; L60-Q64 HydrophobicContact CD2-CB 4.33Å; D61-Q64 PolarHBondContact O-N 3.05Å; D61-Q64 PolarHBondContact OD1-N 2.95Å; D61-Q64 PolarHBondContact OD2-NE2 3.17Å; Q64-A67 PolarHBondContact O-N 3.1Å; Q64-I68 WeakPolarHBondContact O-CD1 3.4Å; Q64-I68 WeakPolarHBondContact O-CG1 3.47Å; Q64-I68 PolarHBondContact O-N 3.28Å
65	V	84.5	Confident	79.2	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-65.1	-42	174.4	174.4	0	0	0	0	111.3	L60 D61 F69 L91 K94 R95 I98	L60-V65 HydrophobicContact CB-CG2 3.64Å; L60-V65 HydrophobicContact CD1-CG2 4.35Å; D61-V65 WeakPolarHBondContact O-CG2 3.22Å; D61-V65 PolarHBondContact O-N 3.4Å; V65-F69 WeakPolarHBondContact O-CB 3.45Å; V65-F69 PolarHBondContact O-N 3.09Å; V65-L91 HydrophobicContact CB-CD1 3.9Å; V65-L91 HydrophobicContact CG1-CD1 3.59Å; V65-L91 HydrophobicContact CG1-CG 4.32Å; V65-K94 HydrophobicContact CG1-CB 4.18Å; V65-R95 HydrophobicContact CG1-CG 3.88Å; V65-R95 HydrophobicContact CG2-CG 4.05Å; V65-I98 HydrophobicContact CG1-CD1 4.04Å
66	E	87.3	Confident	80.6	Confident	57 Å²	57	58.1 Å²	58.1	27%	0.266	30%	0.304	S	S	.	.	H	α-helix	trans	-67.5	-36.4	178.4	-75.3	177.9	147.7	0	0	112.2	R62 V63 E70 L91 K94	R62-E66 HydrophobicContact CG-CG 4.35Å; R62-E66 VanDerWaalsContact CG-OE2 3.28Å; R62-E66 WeakPolarHBondContact CG-OE2 3.41Å; R62-E66 IonicContact CZ-OE1 2.77Å; R62-E66 IonicContact CZ-OE2 2.84Å; R62-E66 IonicContact NE-OE1 3.51Å; R62-E66 PolarHBondContact NE-OE1 2.78Å; R62-E66 IonicContact NE-OE2 2.88Å; R62-E66 PolarHBondContact NE-OE2 2.96Å; R62-E66 IonicContact NH2-OE1 3.6Å; R62-E66 PolarHBondContact NH2-OE1 3.06Å; R62-E66 IonicContact NH2-OE2 3.86Å; R62-E66 WeakPolarHBondContact O-CB 3.35Å; R62-E66 VanDerWaalsContact O-CG 3.31Å; R62-E66 WeakPolarHBondContact O-CG 3.43Å; R62-E66 PolarHBondContact O-N 2.91Å; V63-E66 PolarHBondContact O-N 2.87Å; E66-E70 PolarHBondContact O-N 2.96Å; E66-L91 HydrophobicContact CG-CD1 4.16Å; E66-K94 IonicContact OE1-NZ 3.19Å
67	A	85.9	Confident	81.4	Confident	51 Å²	51	55.7 Å²	55.7	42%	0.421	29%	0.291	S	S	.	.	H	α-helix	trans	-65.5	-51.2	173.7	0	0	0	0	0	112.7	V63 Q64 F69 E70 D71	V63-A67 WeakPolarHBondContact O-CB 3.45Å; V63-A67 PolarHBondContact O-N 2.72Å; Q64-A67 PolarHBondContact O-N 3.1Å; A67-F69 PolarHBondContact O-N 2.78Å; A67-E70 PolarHBondContact O-N 3.17Å; A67-D71 PolarHBondContact O-N 2.96Å
68	I	84	Confident	81.9	Confident	33 Å²	33	57.1 Å²	57.1	17%	0.169	30%	0.299	C	S	.	.	H	α-helix	trans	-64.4	-30	178.9	-64.3	161.8	0	0	0	111.3	L51 L60 Q64 M72 I98	L51-I68 HydrophobicContact CD1-CG2 4.3Å; L51-I68 HydrophobicContact CD2-CD1 4.35Å; L60-I68 HydrophobicContact CD1-CD1 3.87Å; Q64-I68 WeakPolarHBondContact O-CD1 3.4Å; Q64-I68 WeakPolarHBondContact O-CG1 3.47Å; Q64-I68 PolarHBondContact O-N 3.28Å; I68-M72 WeakPolarHBondContact O-CB 3.45Å; I68-M72 PolarHBondContact O-N 3.31Å; I68-M72 VanDerWaalsContact O-N 3.15Å; I68-I98 HydrophobicContact CB-CD1 4.21Å; I68-I98 HydrophobicContact CG2-CD1 3.99Å; I68-I98 HydrophobicContact CG2-CG1 4.19Å; I68-I98 HydrophobicContact CG2-CG2 3.82Å
69	F	86.8	Confident	81.9	Confident	1 Å²	1	54.2 Å²	54.2	0%	0.004	29%	0.285	C	S	.	.	H	α-helix	trans	-68.9	-37.1	172.9	-168.8	-101.7	0	0	0	112.2	V65 A67 M72 L73 L86 K94 M97 I98	V65-F69 WeakPolarHBondContact O-CB 3.45Å; V65-F69 PolarHBondContact O-N 3.09Å; A67-F69 PolarHBondContact O-N 2.78Å; F69-M72 HydrophobicContact CD2-CE 3.4Å; F69-M72 VanDerWaalsContact CD2-CE 3.4Å; F69-M72 HydrophobicContact CE2-CE 3.46Å; F69-M72 VanDerWaalsContact CE2-CE 3.46Å; F69-M72 HydrophobicContact CG-CE 4.24Å; F69-M72 HydrophobicContact CZ-CE 4.34Å; F69-M72 PolarHBondContact O-N 2.91Å; F69-L73 HydrophobicContact CD1-CD1 3.89Å; F69-L73 HydrophobicContact CD1-CG 4.21Å; F69-L73 HydrophobicContact CE1-CD1 3.6Å; F69-L73 HydrophobicContact CE1-CD2 4.45Å; F69-L73 HydrophobicContact CE1-CG 4.03Å; F69-L73 HydrophobicContact CZ-CD1 4.45Å; F69-L73 WeakPolarHBondContact O-CG 3.41Å; F69-L73 PolarHBondContact O-N 3.38Å; F69-L86 HydrophobicContact CE1-CB 4.42Å; F69-L86 VanDerWaalsContact CE1-O 3.25Å; F69-L86 WeakPolarHBondContact CE1-O 3.4Å; F69-L86 HydrophobicContact CZ-CB 4.23Å; F69-L86 WeakPolarHBondContact CZ-O 3.32Å; F69-K94 HydrophobicContact CB-CD 4.33Å; F69-K94 HydrophobicContact CD1-CD 3.75Å; F69-K94 HydrophobicContact CD1-CG 4.12Å; F69-K94 HydrophobicContact CD2-CB 3.56Å; F69-K94 HydrophobicContact CD2-CD 4.15Å; F69-K94 HydrophobicContact CD2-CG 3.73Å; F69-K94 HydrophobicContact CE1-CD 3.97Å; F69-K94 HydrophobicContact CE1-CG 4.03Å; F69-K94 HydrophobicContact CE2-CB 3.82Å; F69-K94 HydrophobicContact CE2-CD 4.38Å; F69-K94 HydrophobicContact CE2-CG 3.67Å; F69-K94 HydrophobicContact CG-CB 4.03Å; F69-K94 HydrophobicContact CG-CD 3.82Å; F69-K94 HydrophobicContact CG-CG 3.96Å; F69-K94 HydrophobicContact CZ-CB 4.47Å; F69-K94 HydrophobicContact CZ-CD 4.28Å; F69-K94 HydrophobicContact CZ-CG 3.81Å; F69-M97 HydrophobicContact CE2-CB 4.01Å; F69-M97 HydrophobicContact CE2-CE 3.82Å; F69-M97 HydrophobicContact CE2-CG 4.5Å; F69-M97 HydrophobicContact CE2-SD 3.73Å; F69-M97 HydrophobicContact CZ-CE 3.93Å; F69-M97 HydrophobicContact CZ-SD 3.98Å; F69-I98 HydrophobicContact CB-CD1 4.12Å; F69-I98 HydrophobicContact CD2-CD1 4.45Å; F69-I98 HydrophobicContact CD2-CG1 4.24Å
70	E	86.6	Confident	82	Confident	52 Å²	52	54.6 Å²	54.6	24%	0.243	28%	0.278	C	S	.	.	H	α-helix	trans	-70.8	-47.4	177.1	-160.3	61.5	-141.4	0	0	111.6	E66 A67 M72 L73 E74 R87	E66-E70 PolarHBondContact O-N 2.96Å; A67-E70 PolarHBondContact O-N 3.17Å; E70-M72 PolarHBondContact O-N 2.94Å; E70-M72 VanDerWaalsContact O-N 3.17Å; E70-L73 WeakPolarHBondContact O-CA 3.21Å; E70-L73 PolarHBondContact O-N 3.33Å; E70-E74 PolarHBondContact O-N 3.28Å; E70-R87 IonicContact OE1-CZ 3.95Å; E70-R87 IonicContact OE1-NH1 4Å; E70-R87 PolarHBondContact OE1-NH1 3.12Å; E70-R87 IonicContact OE1-NH2 2.76Å; E70-R87 PolarHBondContact OE1-NH2 3.18Å; E70-R87 IonicContact OE2-CZ 2.84Å; E70-R87 IonicContact OE2-NH1 2.63Å; E70-R87 PolarHBondContact OE2-NH1 3.13Å
71	D	82.3	Confident	81.9	Confident	85 Å²	85	58.8 Å²	58.8	46%	0.455	31%	0.307	S	S	.	.	H	α-helix	trans	-49.5	-43	171.2	-73.6	-0.6	0	0	0	111	A67 D75	A67-D71 PolarHBondContact O-N 2.96Å; D71-D75 WeakPolarHBondContact O-CB 3.46Å; D71-D75 PolarHBondContact O-N 3.29Å
72	M	83.2	Confident	81.7	Confident	22 Å²	22	60.3 Å²	60.3	11%	0.108	31%	0.311	C	S	.	.	H	α-helix	trans	-68.2	-37.4	176.6	177.9	-173.7	73.9	0	0	113	I68 F69 E70 M76 M97 I98 K101	I68-M72 WeakPolarHBondContact O-CB 3.45Å; I68-M72 PolarHBondContact O-N 3.31Å; I68-M72 VanDerWaalsContact O-N 3.15Å; F69-M72 HydrophobicContact CD2-CE 3.4Å; F69-M72 VanDerWaalsContact CD2-CE 3.4Å; F69-M72 HydrophobicContact CE2-CE 3.46Å; F69-M72 VanDerWaalsContact CE2-CE 3.46Å; F69-M72 HydrophobicContact CG-CE 4.24Å; F69-M72 HydrophobicContact CZ-CE 4.34Å; F69-M72 PolarHBondContact O-N 2.91Å; E70-M72 PolarHBondContact O-N 2.94Å; E70-M72 VanDerWaalsContact O-N 3.17Å; M72-M76 HydrophobicContact CG-CG 4.47Å; M72-M76 WeakPolarHBondContact O-CB 3.39Å; M72-M76 WeakPolarHBondContact O-CG 3.31Å; M72-M76 PolarHBondContact O-N 2.74Å; M72-M76 VanDerWaalsContact O-N 3.16Å; M72-M97 HydrophobicContact CE-CB 4.08Å; M72-M97 HydrophobicContact CE-CE 4.29Å; M72-I98 HydrophobicContact CE-CG1 4.45Å; M72-I98 HydrophobicContact SD-CG1 4.37Å; M72-K101 HydrophobicContact CG-CB 4.35Å; M72-K101 HydrophobicContact CG-CG 3.97Å; M72-K101 HydrophobicContact SD-CB 3.57Å; M72-K101 VanDerWaalsContact SD-CB 3.57Å; M72-K101 HydrophobicContact SD-CG 3.86Å
73	L	83	Confident	81.6	Confident	3 Å²	3	53.4 Å²	53.4	2%	0.016	29%	0.285	C	S	.	.	H	α-helix	trans	-71.2	-37.8	177.7	-75.7	-177.4	0	0	0	112.1	F69 E70 K83 L86 R87	F69-L73 HydrophobicContact CD1-CD1 3.89Å; F69-L73 HydrophobicContact CD1-CG 4.21Å; F69-L73 HydrophobicContact CE1-CD1 3.6Å; F69-L73 HydrophobicContact CE1-CD2 4.45Å; F69-L73 HydrophobicContact CE1-CG 4.03Å; F69-L73 HydrophobicContact CZ-CD1 4.45Å; F69-L73 WeakPolarHBondContact O-CG 3.41Å; F69-L73 PolarHBondContact O-N 3.38Å; E70-L73 WeakPolarHBondContact O-CA 3.21Å; E70-L73 PolarHBondContact O-N 3.33Å; L73-K83 HydrophobicContact CB-CD 4.08Å; L73-K83 HydrophobicContact CB-CG 4.41Å; L73-K83 HydrophobicContact CD1-CB 4.21Å; L73-K83 HydrophobicContact CD1-CD 4.5Å; L73-K83 HydrophobicContact CD1-CG 4.33Å; L73-K83 VanDerWaalsContact O-CE 3.24Å; L73-K83 WeakPolarHBondContact O-CE 3.32Å; L73-K83 PolarHBondContact O-NZ 3.29Å; L73-L86 HydrophobicContact CD1-CB 4.5Å; L73-L86 HydrophobicContact CD2-CB 4.19Å; L73-L86 HydrophobicContact CD2-CD1 3.73Å; L73-R87 HydrophobicContact CD1-CG 4.48Å
74	E	78.4	Confident	81.4	Confident	95 Å²	95	52.1 Å²	52.1	44%	0.444	27%	0.272	S	S	.	.	H	α-helix	trans	-61	-49.4	169.8	-67.3	-174.1	174.1	0	0	111.1	E70 M76 N77 I150	E70-E74 PolarHBondContact O-N 3.28Å; E74-M76 PolarHBondContact O-N 3.44Å; E74-M76 VanDerWaalsContact O-N 3.15Å; E74-N77 PolarHBondContact O-N 2.6Å; E74-I150 WeakPolarHBondContact O-CD1 3.45Å
75	D	82.7	Confident	81.4	Confident	29 Å²	29	51.5 Å²	51.5	16%	0.155	28%	0.275	C	S	.	.	H	α-helix	trans	-63.5	-23.7	-178.6	-160.2	39.7	0	0	0	113.4	D71 K101 P149 I150 S151	D71-D75 WeakPolarHBondContact O-CB 3.46Å; D71-D75 PolarHBondContact O-N 3.29Å; D75-K101 IonicContact OD2-NZ 2.8Å; D75-P149 HydrophobicContact CB-CB 4.4Å; D75-P149 CarbonylContact O-C 3.37Å; D75-P149 WeakPolarHBondContact O-CA 3.46Å; D75-P149 WeakPolarHBondContact O-CB 3.41Å; D75-P149 WeakPolarHBondContact OD2-CB 3.47Å; D75-I150 PolarHBondContact O-N 3.26Å; D75-S151 VanDerWaalsContact CG-OG 3.26Å; D75-S151 WeakPolarHBondContact OD1-CA 3.41Å; D75-S151 WeakPolarHBondContact OD1-CB 3.15Å; D75-S151 PolarHBondContact OD1-N 2.94Å; D75-S151 PolarHBondContact OD1-OG 3.05Å; D75-S151 VanDerWaalsContact OD1-OG 3.05Å; D75-S151 WeakPolarHBondContact OD2-CB 3.41Å; D75-S151 PolarHBondContact OD2-OG 3.38Å
76	M	79.6	Confident	81.4	Confident	74 Å²	74	53.7 Å²	53.7	37%	0.365	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-4.1	-176.5	-79	-66.8	-55.4	0	0	115.7	M72 E74 L78	M72-M76 HydrophobicContact CG-CG 4.47Å; M72-M76 WeakPolarHBondContact O-CB 3.39Å; M72-M76 WeakPolarHBondContact O-CG 3.31Å; M72-M76 PolarHBondContact O-N 2.74Å; M72-M76 VanDerWaalsContact O-N 3.16Å; E74-M76 PolarHBondContact O-N 3.44Å; E74-M76 VanDerWaalsContact O-N 3.15Å; M76-L78 HydrophobicContact CB-CD1 3.88Å; M76-L78 HydrophobicContact CB-CG 3.98Å; M76-L78 PolarHBondContact O-N 2.7Å
77	N	77.5	Confident	81.3	Confident	37 Å²	37	54.2 Å²	54.2	20%	0.198	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	58.9	42.7	176.2	-156.7	34.4	0	0	0	113.9	E74 I150 N212 E1046	E74-N77 PolarHBondContact O-N 2.6Å; N77-I150 HydrophobicContact CB-CD1 4.11Å; N77-I150 HydrophobicContact CB-CG1 3.86Å; N77-N212 PolarHBondContact ND2-O 3.08Å; N77-N212 PolarHBondContact OD1-O 3.32Å; N77-E1046 VanDerWaalsContact OD1-CA 3.27Å; N77-E1046 WeakPolarHBondContact OD1-CA 3.41Å
78	L	77.2	Confident	81.4	Confident	51 Å²	51	58.4 Å²	58.4	27%	0.267	30%	0.297	S	S	.	.			trans	-113.5	85.2	-170.2	-70.6	177.6	0	0	0	112.9	M76 E80 K82 K83 L86 E1046	M76-L78 HydrophobicContact CB-CD1 3.88Å; M76-L78 HydrophobicContact CB-CG 3.98Å; M76-L78 PolarHBondContact O-N 2.7Å; L78-E80 PolarHBondContact O-N 3.21Å; L78-K82 HydrophobicContact CD2-CD 4.44Å; L78-K83 WeakPolarHBondContact O-CE 3.35Å; L78-K83 VanDerWaalsContact O-CG 3.24Å; L78-K83 WeakPolarHBondContact O-CG 3.43Å; L78-L86 HydrophobicContact CD1-CD1 4.34Å; L78-E1046 VanDerWaalsContact N-CD 3.35Å; L78-E1046 PolarHBondContact N-OE1 2.86Å
79	T	71.9	Confident	81.6	Confident	34 Å²	34	58.4 Å²	58.4	21%	0.209	30%	0.298	C	S	.	.			trans	-18.9	125.2	175	57.3	0	0	0	0	115.8	S81 K82 E1046	T79-S81 VanDerWaalsContact C-N 3.27Å; T79-S81 PolarHBondContact O-N 3.01Å; T79-K82 WeakPolarHBondContact O-CB 3.45Å; T79-K82 PolarHBondContact O-N 2.89Å; T79-K82 WeakPolarHBondContact OG1-CD 3.43Å; T79-K82 VanDerWaalsContact OG1-CE 3.29Å; T79-K82 WeakPolarHBondContact OG1-CE 3.11Å; T79-K82 PolarHBondContact OG1-NZ 3.09Å; T79-E1046 WeakPolarHBondContact CA-OE2 3.25Å; T79-E1046 HydrophobicContact CG2-CB 4.37Å; T79-E1046 PolarHBondContact N-OE2 3.16Å; T79-E1046 VanDerWaalsContact N-OE2 3.15Å
80	E	77.3	Confident	81.7	Confident	88 Å²	88	61.2 Å²	61.2	41%	0.411	32%	0.318	S	S	.	.	H	α-helix	trans	-30.8	-46.1	-174.4	-172.3	53.4	-137.8	0	0	117.7	L78 K82 K83 E84 R87	L78-E80 PolarHBondContact O-N 3.21Å; E80-K82 PolarHBondContact O-N 3.19Å; E80-K83 WeakPolarHBondContact O-CA 3.35Å; E80-K83 WeakPolarHBondContact O-CB 3.33Å; E80-K83 PolarHBondContact O-N 2.99Å; E80-E84 PolarHBondContact O-N 3.46Å; E80-R87 IonicContact OE1-CZ 3.99Å; E80-R87 VanDerWaalsContact OE1-CZ 3.31Å; E80-R87 IonicContact OE1-NE 3.48Å; E80-R87 PolarHBondContact OE1-NE 3.22Å; E80-R87 IonicContact OE1-NH2 2.68Å; E80-R87 PolarHBondContact OE1-NH2 2.97Å; E80-R87 IonicContact OE2-CZ 2.69Å; E80-R87 IonicContact OE2-NH2 3.53Å; E80-R87 PolarHBondContact OE2-NH2 3.22Å
81	S	75	Confident	81.6	Confident	97 Å²	97	61.2 Å²	61.2	68%	0.678	32%	0.319	S	S	*	.	H	α-helix	trans	-59.1	-15.9	176.7	56.8	0	0	0	0	115.1	T79 P85	T79-S81 VanDerWaalsContact C-N 3.27Å; T79-S81 PolarHBondContact O-N 3.01Å; S81-P85 WeakPolarHBondContact O-CD 3.1Å
82	K	78.1	Confident	81.7	Confident	108 Å²	108	61.9 Å²	61.9	47%	0.47	32%	0.32	S	S	.	.	H	α-helix	trans	-97.5	-24.2	171.8	-57.4	174.7	-170.3	132.4	0	112.4	L78 T79 E80 P85 L86	L78-K82 HydrophobicContact CD2-CD 4.44Å; T79-K82 WeakPolarHBondContact O-CB 3.45Å; T79-K82 PolarHBondContact O-N 2.89Å; T79-K82 WeakPolarHBondContact OG1-CD 3.43Å; T79-K82 VanDerWaalsContact OG1-CE 3.29Å; T79-K82 WeakPolarHBondContact OG1-CE 3.11Å; T79-K82 PolarHBondContact OG1-NZ 3.09Å; E80-K82 PolarHBondContact O-N 3.19Å; K82-P85 WeakPolarHBondContact O-CG 3.43Å; K82-L86 WeakPolarHBondContact O-CD1 3.22Å; K82-L86 WeakPolarHBondContact O-CG 3.48Å
83	K	80.7	Confident	81.7	Confident	11 Å²	11	66.1 Å²	66.1	5%	0.048	34%	0.339	C	S	.	.	H	α-helix	trans	-70.8	-47.4	171.6	-63.1	-169.3	179.9	177.1	0	110.9	L73 L78 E80 L86 R87 E1046	L73-K83 HydrophobicContact CB-CD 4.08Å; L73-K83 HydrophobicContact CB-CG 4.41Å; L73-K83 HydrophobicContact CD1-CB 4.21Å; L73-K83 HydrophobicContact CD1-CD 4.5Å; L73-K83 HydrophobicContact CD1-CG 4.33Å; L73-K83 VanDerWaalsContact O-CE 3.24Å; L73-K83 WeakPolarHBondContact O-CE 3.32Å; L73-K83 PolarHBondContact O-NZ 3.29Å; L78-K83 WeakPolarHBondContact O-CE 3.35Å; L78-K83 VanDerWaalsContact O-CG 3.24Å; L78-K83 WeakPolarHBondContact O-CG 3.43Å; E80-K83 WeakPolarHBondContact O-CA 3.35Å; E80-K83 WeakPolarHBondContact O-CB 3.33Å; E80-K83 PolarHBondContact O-N 2.99Å; K83-L86 CarbonylContact O-C 3.5Å; K83-L86 VanDerWaalsContact O-CA 3.24Å; K83-L86 WeakPolarHBondContact O-CA 3.41Å; K83-L86 VanDerWaalsContact O-CB 3.29Å; K83-L86 WeakPolarHBondContact O-CB 3.49Å; K83-L86 PolarHBondContact O-N 3.39Å; K83-R87 WeakPolarHBondContact O-CG 2.9Å; K83-R87 PolarHBondContact O-N 3.07Å; K83-E1046 VanDerWaalsContact CE-CD 3.46Å; K83-E1046 WeakPolarHBondContact CE-OE1 3.39Å; K83-E1046 WeakPolarHBondContact CE-OE2 3.29Å; K83-E1046 VanDerWaalsContact NZ-CD 3.28Å; K83-E1046 IonicContact NZ-OE1 3.31Å; K83-E1046 PolarHBondContact NZ-OE1 3Å; K83-E1046 IonicContact NZ-OE2 2.9Å; K83-E1046 PolarHBondContact NZ-OE2 2.72Å
84	E	82.3	Confident	81.9	Confident	82 Å²	82	66.7 Å²	66.7	38%	0.383	34%	0.342	S	S	.	.	H	α-helix	trans	-47.4	-51.9	-176.3	-178	54.5	-153.3	0	0	114.5	E80 L86 R87 Q88	E80-E84 PolarHBondContact O-N 3.46Å; E84-L86 PolarHBondContact O-N 3.03Å; E84-R87 WeakPolarHBondContact O-CB 3.31Å; E84-R87 PolarHBondContact O-N 2.81Å; E84-R87 VanDerWaalsContact O-N 3.12Å; E84-R87 WeakPolarHBondContact OE2-CD 3.33Å; E84-R87 IonicContact OE2-NE 3.85Å; E84-Q88 WeakPolarHBondContact O-CG 3.5Å; E84-Q88 PolarHBondContact O-N 3.08Å; E84-Q88 PolarHBondContact OE1-NE2 3.3Å
85	P	84.6	Confident	82.2	Confident	72 Å²	72	64 Å²	64	47%	0.468	33%	0.328	S	S	.	.	H	α-helix	trans	-64.7	-24.9	175.3	26.2	-35.4	0	0	0	113.7	S81 K82 V89	S81-P85 WeakPolarHBondContact O-CD 3.1Å; K82-P85 WeakPolarHBondContact O-CG 3.43Å; P85-V89 WeakPolarHBondContact O-CG2 3.48Å
86	L	84.2	Confident	82.3	Confident	45 Å²	45	66.8 Å²	66.8	24%	0.236	35%	0.345	C	S	.	.	H	α-helix	trans	-80.2	-29.5	172.9	-58.6	176.3	0	0	0	112.4	F69 L73 L78 K82 K83 E84 Q88 V89 M97	F69-L86 HydrophobicContact CE1-CB 4.42Å; F69-L86 VanDerWaalsContact CE1-O 3.25Å; F69-L86 WeakPolarHBondContact CE1-O 3.4Å; F69-L86 HydrophobicContact CZ-CB 4.23Å; F69-L86 WeakPolarHBondContact CZ-O 3.32Å; L73-L86 HydrophobicContact CD1-CB 4.5Å; L73-L86 HydrophobicContact CD2-CB 4.19Å; L73-L86 HydrophobicContact CD2-CD1 3.73Å; L78-L86 HydrophobicContact CD1-CD1 4.34Å; K82-L86 WeakPolarHBondContact O-CD1 3.22Å; K82-L86 WeakPolarHBondContact O-CG 3.48Å; K83-L86 CarbonylContact O-C 3.5Å; K83-L86 VanDerWaalsContact O-CA 3.24Å; K83-L86 WeakPolarHBondContact O-CA 3.41Å; K83-L86 VanDerWaalsContact O-CB 3.29Å; K83-L86 WeakPolarHBondContact O-CB 3.49Å; K83-L86 PolarHBondContact O-N 3.39Å; E84-L86 PolarHBondContact O-N 3.03Å; L86-Q88 VanDerWaalsContact C-N 3.29Å; L86-Q88 PolarHBondContact O-N 3.09Å; L86-V89 HydrophobicContact CD2-CG2 4.49Å; L86-V89 VanDerWaalsContact O-CB 3.29Å; L86-V89 WeakPolarHBondContact O-CB 3.17Å; L86-V89 PolarHBondContact O-N 3.3Å; L86-M97 HydrophobicContact CD1-CE 4.46Å; L86-M97 HydrophobicContact CD2-CE 4.04Å
87	R	85.6	Confident	82.5	Confident	69 Å²	69	65.9 Å²	65.9	26%	0.26	34%	0.341	S	S	.	.	H	α-helix	trans	-63.7	-37.4	171.5	-62.7	176.5	-163.7	-69.8	0.7	111	E70 L73 E80 K83 E84 V89 K94	E70-R87 IonicContact OE1-CZ 3.95Å; E70-R87 IonicContact OE1-NH1 4Å; E70-R87 PolarHBondContact OE1-NH1 3.12Å; E70-R87 IonicContact OE1-NH2 2.76Å; E70-R87 PolarHBondContact OE1-NH2 3.18Å; E70-R87 IonicContact OE2-CZ 2.84Å; E70-R87 IonicContact OE2-NH1 2.63Å; E70-R87 PolarHBondContact OE2-NH1 3.13Å; L73-R87 HydrophobicContact CD1-CG 4.48Å; E80-R87 IonicContact OE1-CZ 3.99Å; E80-R87 VanDerWaalsContact OE1-CZ 3.31Å; E80-R87 IonicContact OE1-NE 3.48Å; E80-R87 PolarHBondContact OE1-NE 3.22Å; E80-R87 IonicContact OE1-NH2 2.68Å; E80-R87 PolarHBondContact OE1-NH2 2.97Å; E80-R87 IonicContact OE2-CZ 2.69Å; E80-R87 IonicContact OE2-NH2 3.53Å; E80-R87 PolarHBondContact OE2-NH2 3.22Å; K83-R87 WeakPolarHBondContact O-CG 2.9Å; K83-R87 PolarHBondContact O-N 3.07Å; E84-R87 WeakPolarHBondContact O-CB 3.31Å; E84-R87 PolarHBondContact O-N 2.81Å; E84-R87 VanDerWaalsContact O-N 3.12Å; E84-R87 WeakPolarHBondContact OE2-CD 3.33Å; E84-R87 IonicContact OE2-NE 3.85Å; R87-V89 VanDerWaalsContact C-N 3.29Å; R87-V89 PolarHBondContact O-N 3.19Å; R87-K94 WeakPolarHBondContact O-CE 3.5Å; R87-K94 PolarHBondContact O-NZ 2.83Å
88	Q	87.6	Confident	82.8	Confident	139 Å²	139	64.3 Å²	64.3	65%	0.65	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.5	-9.9	179.9	-65.1	177.5	16.7	0	0	114.4	E84 L86	E84-Q88 WeakPolarHBondContact O-CG 3.5Å; E84-Q88 PolarHBondContact O-N 3.08Å; E84-Q88 PolarHBondContact OE1-NE2 3.3Å; L86-Q88 VanDerWaalsContact C-N 3.29Å; L86-Q88 PolarHBondContact O-N 3.09Å
89	V	88.6	Confident	83	Confident	33 Å²	33	63.6 Å²	63.6	20%	0.2	33%	0.331	C	S	.	.	S	Bend	trans	-61.4	144.8	175.3	169.1	0	0	0	0	111	P85 L86 R87 Q93 K94 M97	P85-V89 WeakPolarHBondContact O-CG2 3.48Å; L86-V89 HydrophobicContact CD2-CG2 4.49Å; L86-V89 VanDerWaalsContact O-CB 3.29Å; L86-V89 WeakPolarHBondContact O-CB 3.17Å; L86-V89 PolarHBondContact O-N 3.3Å; R87-V89 VanDerWaalsContact C-N 3.29Å; R87-V89 PolarHBondContact O-N 3.19Å; V89-Q93 HydrophobicContact CG1-CB 3.19Å; V89-Q93 HydrophobicContact CG1-CG 4.23Å; V89-K94 HydrophobicContact CG1-CG 4.29Å; V89-K94 VanDerWaalsContact O-CE 3.28Å; V89-K94 WeakPolarHBondContact O-CE 3.47Å; V89-M97 HydrophobicContact CG1-SD 4.48Å
90	S	88.6	Confident	83.4	Confident	59 Å²	59	68 Å²	68	41%	0.413	35%	0.35	S	S	.	.			trans	-64.3	151.1	-178.9	70.3	0	0	0	0	112.4	E92 Q93 K94	S90-E92 PolarHBondContact O-N 2.97Å; S90-E92 VanDerWaalsContact O-N 3.13Å; S90-Q93 WeakPolarHBondContact O-CA 3.42Å; S90-Q93 WeakPolarHBondContact O-CB 3.27Å; S90-Q93 PolarHBondContact O-N 3.13Å; S90-Q93 VanDerWaalsContact OG-CD 3.32Å; S90-Q93 WeakPolarHBondContact OG-CG 3.33Å; S90-Q93 PolarHBondContact OG-OE1 2.99Å; S90-K94 PolarHBondContact O-N 3.14Å
91	L	84.5	Confident	83.4	Confident	52 Å²	52	65.3 Å²	65.3	27%	0.272	34%	0.337	S	S	.	.	H	α-helix	trans	-53.1	-39.2	-176.3	-170.4	66.8	0	0	0	112.9	R62 V65 E66 K94 R95	R62-L91 HydrophobicContact CB-CD2 3.96Å; R62-L91 HydrophobicContact CG-CD1 4.06Å; R62-L91 HydrophobicContact CG-CD2 4.09Å; V65-L91 HydrophobicContact CB-CD1 3.9Å; V65-L91 HydrophobicContact CG1-CD1 3.59Å; V65-L91 HydrophobicContact CG1-CG 4.32Å; E66-L91 HydrophobicContact CG-CD1 4.16Å; L91-K94 WeakPolarHBondContact O-CB 3.39Å; L91-K94 PolarHBondContact O-N 3.4Å; L91-R95 PolarHBondContact O-N 3.37Å
92	E	84.2	Confident	83.4	Confident	100 Å²	100	62.5 Å²	62.5	47%	0.467	31%	0.314	S	S	.	.	H	α-helix	trans	-68.9	-38.4	179.2	-162	68.2	176.5	0	0	112.3	S90 K94 R95 V96	S90-E92 PolarHBondContact O-N 2.97Å; S90-E92 VanDerWaalsContact O-N 3.13Å; E92-K94 VanDerWaalsContact C-N 3.32Å; E92-R95 WeakPolarHBondContact O-CB 3.32Å; E92-R95 PolarHBondContact O-N 3.38Å; E92-R95 IonicContact OE2-CZ 3.89Å; E92-R95 IonicContact OE2-NH1 2.7Å; E92-R95 PolarHBondContact OE2-NH1 2.95Å; E92-V96 WeakPolarHBondContact O-CG2 3.49Å; E92-V96 PolarHBondContact O-N 2.95Å
93	Q	84.9	Confident	83.1	Confident	111 Å²	111	65.3 Å²	65.3	52%	0.519	32%	0.321	S	S	.	.	H	α-helix	trans	-68	-32.8	172	-70.8	167.3	-56.4	0	0	111.6	V89 S90 V96 M97	V89-Q93 HydrophobicContact CG1-CB 3.19Å; V89-Q93 HydrophobicContact CG1-CG 4.23Å; S90-Q93 WeakPolarHBondContact O-CA 3.42Å; S90-Q93 WeakPolarHBondContact O-CB 3.27Å; S90-Q93 PolarHBondContact O-N 3.13Å; S90-Q93 VanDerWaalsContact OG-CD 3.32Å; S90-Q93 WeakPolarHBondContact OG-CG 3.33Å; S90-Q93 PolarHBondContact OG-OE1 2.99Å; Q93-V96 PolarHBondContact O-N 3.44Å; Q93-M97 WeakPolarHBondContact O-CG 3.35Å; Q93-M97 PolarHBondContact O-N 3.41Å
94	K	86.8	Confident	82.5	Confident	15 Å²	15	68 Å²	68	7%	0.065	34%	0.338	C	S	.	.	H	α-helix	trans	-61.7	-44.5	170.7	-63.7	-173.5	177.6	177.3	0	111.3	V65 E66 F69 R87 V89 S90 L91 E92 V96 M97 I98	V65-K94 HydrophobicContact CG1-CB 4.18Å; E66-K94 IonicContact OE1-NZ 3.19Å; F69-K94 HydrophobicContact CB-CD 4.33Å; F69-K94 HydrophobicContact CD1-CD 3.75Å; F69-K94 HydrophobicContact CD1-CG 4.12Å; F69-K94 HydrophobicContact CD2-CB 3.56Å; F69-K94 HydrophobicContact CD2-CD 4.15Å; F69-K94 HydrophobicContact CD2-CG 3.73Å; F69-K94 HydrophobicContact CE1-CD 3.97Å; F69-K94 HydrophobicContact CE1-CG 4.03Å; F69-K94 HydrophobicContact CE2-CB 3.82Å; F69-K94 HydrophobicContact CE2-CD 4.38Å; F69-K94 HydrophobicContact CE2-CG 3.67Å; F69-K94 HydrophobicContact CG-CB 4.03Å; F69-K94 HydrophobicContact CG-CD 3.82Å; F69-K94 HydrophobicContact CG-CG 3.96Å; F69-K94 HydrophobicContact CZ-CB 4.47Å; F69-K94 HydrophobicContact CZ-CD 4.28Å; F69-K94 HydrophobicContact CZ-CG 3.81Å; R87-K94 WeakPolarHBondContact O-CE 3.5Å; R87-K94 PolarHBondContact O-NZ 2.83Å; V89-K94 HydrophobicContact CG1-CG 4.29Å; V89-K94 VanDerWaalsContact O-CE 3.28Å; V89-K94 WeakPolarHBondContact O-CE 3.47Å; S90-K94 PolarHBondContact O-N 3.14Å; L91-K94 WeakPolarHBondContact O-CB 3.39Å; L91-K94 PolarHBondContact O-N 3.4Å; E92-K94 VanDerWaalsContact C-N 3.32Å; K94-V96 PolarHBondContact O-N 3.44Å; K94-M97 PolarHBondContact O-N 3.28Å; K94-I98 WeakPolarHBondContact O-CG1 3.2Å; K94-I98 PolarHBondContact O-N 3.3Å
95	R	84.5	Confident	81.6	Confident	39 Å²	39	67.1 Å²	67.1	15%	0.147	34%	0.337	C	S	.	.	H	α-helix	trans	-57.6	-44.5	172.6	-69.2	-175.8	170.6	151.7	-13.2	112.7	I57 D58 L60 V65 L91 E92 I98 S99	I57-R95 HydrophobicContact CG2-CB 3.71Å; I57-R95 HydrophobicContact CG2-CG 3.72Å; I57-R95 WeakPolarHBondContact O-CD 3.38Å; I57-R95 PolarHBondContact O-NE 2.84Å; D58-R95 PolarHBondContact O-NH2 2.9Å; L60-R95 PolarHBondContact O-NH2 2.91Å; V65-R95 HydrophobicContact CG1-CG 3.88Å; V65-R95 HydrophobicContact CG2-CG 4.05Å; L91-R95 PolarHBondContact O-N 3.37Å; E92-R95 WeakPolarHBondContact O-CB 3.32Å; E92-R95 PolarHBondContact O-N 3.38Å; E92-R95 IonicContact OE2-CZ 3.89Å; E92-R95 IonicContact OE2-NH1 2.7Å; E92-R95 PolarHBondContact OE2-NH1 2.95Å; R95-I98 PolarHBondContact O-N 3.04Å; R95-S99 VanDerWaalsContact O-CB 3.3Å; R95-S99 WeakPolarHBondContact O-CB 3.36Å; R95-S99 PolarHBondContact O-N 3.26Å; R95-S99 PolarHBondContact O-OG 3.04Å
96	V	84.7	Confident	80.4	Confident	87 Å²	87	68.8 Å²	68.8	53%	0.527	34%	0.338	S	S	.	.	H	α-helix	trans	-62.5	-41.8	176	172	0	0	0	0	111.5	E92 Q93 K94 S99 Q100	E92-V96 WeakPolarHBondContact O-CG2 3.49Å; E92-V96 PolarHBondContact O-N 2.95Å; Q93-V96 PolarHBondContact O-N 3.44Å; K94-V96 PolarHBondContact O-N 3.44Å; V96-S99 WeakPolarHBondContact O-CB 3.39Å; V96-S99 PolarHBondContact O-N 3.39Å; V96-Q100 WeakPolarHBondContact O-CB 3.43Å; V96-Q100 PolarHBondContact O-N 3.04Å
97	M	83.7	Confident	78.9	Confident	54 Å²	54	70.9 Å²	70.9	27%	0.266	35%	0.353	S	S	.	.	H	α-helix	trans	-65	-45.7	176.5	-73.8	174.6	68.6	0	0	112.5	F69 M72 L86 V89 Q93 K94 S99 Q100 K101	F69-M97 HydrophobicContact CE2-CB 4.01Å; F69-M97 HydrophobicContact CE2-CE 3.82Å; F69-M97 HydrophobicContact CE2-CG 4.5Å; F69-M97 HydrophobicContact CE2-SD 3.73Å; F69-M97 HydrophobicContact CZ-CE 3.93Å; F69-M97 HydrophobicContact CZ-SD 3.98Å; M72-M97 HydrophobicContact CE-CB 4.08Å; M72-M97 HydrophobicContact CE-CE 4.29Å; L86-M97 HydrophobicContact CD1-CE 4.46Å; L86-M97 HydrophobicContact CD2-CE 4.04Å; V89-M97 HydrophobicContact CG1-SD 4.48Å; Q93-M97 WeakPolarHBondContact O-CG 3.35Å; Q93-M97 PolarHBondContact O-N 3.41Å; K94-M97 PolarHBondContact O-N 3.28Å; M97-S99 VanDerWaalsContact C-N 3.34Å; M97-S99 PolarHBondContact O-N 3.32Å; M97-Q100 PolarHBondContact O-N 2.86Å; M97-K101 PolarHBondContact O-N 2.95Å
98	I	83.9	Confident	77.1	Confident	5 Å²	5	71 Å²	71	3%	0.026	36%	0.361	C	S	.	.	H	α-helix	trans	-58.7	-47.2	173.9	-66.4	162.6	0	0	0	110.1	I57 V65 I68 F69 M72 K94 R95 Q100 K101 I102	I57-I98 HydrophobicContact CD1-CG2 4.16Å; V65-I98 HydrophobicContact CG1-CD1 4.04Å; I68-I98 HydrophobicContact CB-CD1 4.21Å; I68-I98 HydrophobicContact CG2-CD1 3.99Å; I68-I98 HydrophobicContact CG2-CG1 4.19Å; I68-I98 HydrophobicContact CG2-CG2 3.82Å; F69-I98 HydrophobicContact CB-CD1 4.12Å; F69-I98 HydrophobicContact CD2-CD1 4.45Å; F69-I98 HydrophobicContact CD2-CG1 4.24Å; M72-I98 HydrophobicContact CE-CG1 4.45Å; M72-I98 HydrophobicContact SD-CG1 4.37Å; K94-I98 WeakPolarHBondContact O-CG1 3.2Å; K94-I98 PolarHBondContact O-N 3.3Å; R95-I98 PolarHBondContact O-N 3.04Å; I98-Q100 VanDerWaalsContact C-N 3.28Å; I98-Q100 PolarHBondContact O-N 3.3Å; I98-K101 PolarHBondContact O-N 3.19Å; I98-I102 HydrophobicContact CG2-CD1 3.63Å; I98-I102 HydrophobicContact CG2-CG1 4.35Å; I98-I102 WeakPolarHBondContact O-CB 3.3Å; I98-I102 WeakPolarHBondContact O-CG1 3.4Å; I98-I102 PolarHBondContact O-N 3.03Å
99	S	81.7	Confident	75	Confident	35 Å²	35	74.8 Å²	74.8	25%	0.245	37%	0.37	C	S	.	.	H	α-helix	trans	-58.6	-39.1	176.4	-60.3	0	0	0	0	112.3	I57 R95 V96 M97 R103	I57-S99 VanDerWaalsContact CD1-OG 3.32Å; I57-S99 WeakPolarHBondContact CD1-OG 3.45Å; R95-S99 VanDerWaalsContact O-CB 3.3Å; R95-S99 WeakPolarHBondContact O-CB 3.36Å; R95-S99 PolarHBondContact O-N 3.26Å; R95-S99 PolarHBondContact O-OG 3.04Å; V96-S99 WeakPolarHBondContact O-CB 3.39Å; V96-S99 PolarHBondContact O-N 3.39Å; M97-S99 VanDerWaalsContact C-N 3.34Å; M97-S99 PolarHBondContact O-N 3.32Å; S99-R103 WeakPolarHBondContact O-CB 3.31Å; S99-R103 PolarHBondContact O-N 2.79Å
100	Q	80.6	Confident	72.7	Confident	127 Å²	127	76.2 Å²	76.2	59%	0.593	39%	0.391	S	S	*	.	H	α-helix	trans	-71.7	-39.4	177.2	-178.1	174.5	-16.6	0	0	112.1	V96 M97 I98 R103 T104	V96-Q100 WeakPolarHBondContact O-CB 3.43Å; V96-Q100 PolarHBondContact O-N 3.04Å; M97-Q100 PolarHBondContact O-N 2.86Å; I98-Q100 VanDerWaalsContact C-N 3.28Å; I98-Q100 PolarHBondContact O-N 3.3Å; Q100-R103 PolarHBondContact O-N 3.35Å; Q100-T104 WeakPolarHBondContact O-CB 3.46Å; Q100-T104 PolarHBondContact O-N 3.04Å; Q100-T104 PolarHBondContact O-OG1 3.37Å
101	K	77.5	Confident	70.1	Confident	31 Å²	31	75.9 Å²	75.9	14%	0.135	40%	0.397	C	S	.	.	H	α-helix	trans	-62.2	-53.4	173.8	169.4	59.3	170.1	146	0	110.9	M72 D75 M97 I98 R103 T104 D105	M72-K101 HydrophobicContact CG-CB 4.35Å; M72-K101 HydrophobicContact CG-CG 3.97Å; M72-K101 HydrophobicContact SD-CB 3.57Å; M72-K101 VanDerWaalsContact SD-CB 3.57Å; M72-K101 HydrophobicContact SD-CG 3.86Å; D75-K101 IonicContact OD2-NZ 2.8Å; M97-K101 PolarHBondContact O-N 2.95Å; I98-K101 PolarHBondContact O-N 3.19Å; K101-R103 VanDerWaalsContact C-N 3.3Å; K101-R103 PolarHBondContact O-N 3.06Å; K101-T104 WeakPolarHBondContact O-CA 3.35Å; K101-T104 WeakPolarHBondContact O-CB 3.47Å; K101-T104 PolarHBondContact O-N 3.01Å; K101-D105 WeakPolarHBondContact CD-OD2 3.32Å; K101-D105 WeakPolarHBondContact CE-OD2 3.1Å; K101-D105 IonicContact NZ-OD1 3.35Å; K101-D105 PolarHBondContact NZ-OD1 3.34Å; K101-D105 IonicContact NZ-OD2 3.06Å; K101-D105 PolarHBondContact NZ-OD2 2.9Å; K101-D105 PolarHBondContact O-N 3.48Å
102	I	74.9	Confident	67.9	Low	38 Å²	38	83.1 Å²	83.1	20%	0.195	43%	0.426	C	S	.	.	H	α-helix	trans	-56.6	-44.3	176.2	-66.8	167.7	0	0	0	110.7	L51 I57 I98 T104 D105 Q106	L51-I102 HydrophobicContact CD1-CD1 3.97Å; L51-I102 HydrophobicContact CD1-CG1 4.39Å; I57-I102 HydrophobicContact CD1-CD1 3.94Å; I98-I102 HydrophobicContact CG2-CD1 3.63Å; I98-I102 HydrophobicContact CG2-CG1 4.35Å; I98-I102 WeakPolarHBondContact O-CB 3.3Å; I98-I102 WeakPolarHBondContact O-CG1 3.4Å; I98-I102 PolarHBondContact O-N 3.03Å; I102-T104 VanDerWaalsContact C-N 3.32Å; I102-T104 PolarHBondContact O-N 3.07Å; I102-D105 PolarHBondContact O-N 3.28Å; I102-Q106 HydrophobicContact CG2-CG 4.35Å; I102-Q106 WeakPolarHBondContact O-CB 3.19Å; I102-Q106 VanDerWaalsContact O-CG 3.23Å; I102-Q106 WeakPolarHBondContact O-CG 3.29Å; I102-Q106 PolarHBondContact O-N 3.38Å
103	R	71.1	Confident	65.9	Low	167 Å²	167	85 Å²	85	63%	0.63	44%	0.444	S	S	*	.	H	α-helix	trans	-64.2	-35	175.7	-173.5	177.9	-61.5	168.8	4.4	112.6	S99 Q100 K101 T107	S99-R103 WeakPolarHBondContact O-CB 3.31Å; S99-R103 PolarHBondContact O-N 2.79Å; Q100-R103 PolarHBondContact O-N 3.35Å; K101-R103 VanDerWaalsContact C-N 3.3Å; K101-R103 PolarHBondContact O-N 3.06Å; R103-T107 HydrophobicContact CG-CG2 4.35Å; R103-T107 WeakPolarHBondContact O-CB 3.16Å; R103-T107 VanDerWaalsContact O-CG2 3.29Å; R103-T107 WeakPolarHBondContact O-CG2 3.4Å; R103-T107 PolarHBondContact O-N 2.98Å; R103-T107 PolarHBondContact O-OG1 2.84Å
104	T	68.9	Low	64.3	Low	67 Å²	67	87.4 Å²	87.4	41%	0.411	45%	0.453	S	S	.	.	H	α-helix	trans	-65.8	-51.2	174.5	-56.5	0	0	0	0	110.1	Q100 K101 I102 Q106 T107 V108	Q100-T104 WeakPolarHBondContact O-CB 3.46Å; Q100-T104 PolarHBondContact O-N 3.04Å; Q100-T104 PolarHBondContact O-OG1 3.37Å; K101-T104 WeakPolarHBondContact O-CA 3.35Å; K101-T104 WeakPolarHBondContact O-CB 3.47Å; K101-T104 PolarHBondContact O-N 3.01Å; I102-T104 VanDerWaalsContact C-N 3.32Å; I102-T104 PolarHBondContact O-N 3.07Å; T104-Q106 VanDerWaalsContact C-N 3.29Å; T104-Q106 PolarHBondContact O-N 3.33Å; T104-T107 WeakPolarHBondContact CA-OG1 3.38Å; T104-T107 PolarHBondContact O-N 2.86Å; T104-T107 PolarHBondContact O-OG1 3.25Å; T104-T107 VanDerWaalsContact O-OG1 3.11Å; T104-V108 WeakPolarHBondContact O-CB 3.44Å; T104-V108 VanDerWaalsContact O-CG2 3.28Å; T104-V108 WeakPolarHBondContact O-CG2 3.37Å; T104-V108 PolarHBondContact O-N 3.05Å
105	D	62.2	Low	62.7	Low	65 Å²	65	87.9 Å²	87.9	35%	0.348	46%	0.458	S	S	.	.	H	α-helix	trans	-63.5	-33.9	179.7	-61.3	-28.6	0	0	0	112.4	K101 I102 R109	K101-D105 WeakPolarHBondContact CD-OD2 3.32Å; K101-D105 WeakPolarHBondContact CE-OD2 3.1Å; K101-D105 IonicContact NZ-OD1 3.35Å; K101-D105 PolarHBondContact NZ-OD1 3.34Å; K101-D105 IonicContact NZ-OD2 3.06Å; K101-D105 PolarHBondContact NZ-OD2 2.9Å; K101-D105 PolarHBondContact O-N 3.48Å; I102-D105 PolarHBondContact O-N 3.28Å; D105-R109 WeakPolarHBondContact O-CG 3.38Å; D105-R109 PolarHBondContact O-N 3.4Å
106	Q	58.7	Low	61.8	Low	107 Å²	107	88.8 Å²	88.8	50%	0.5	47%	0.466	S	S	.	.	H	α-helix	trans	-71.8	-43	172.5	-73.6	175.6	2.5	0	0	113.1	I102 T104 R109 G110	I102-Q106 HydrophobicContact CG2-CG 4.35Å; I102-Q106 WeakPolarHBondContact O-CB 3.19Å; I102-Q106 VanDerWaalsContact O-CG 3.23Å; I102-Q106 WeakPolarHBondContact O-CG 3.29Å; I102-Q106 PolarHBondContact O-N 3.38Å; T104-Q106 VanDerWaalsContact C-N 3.29Å; T104-Q106 PolarHBondContact O-N 3.33Å; Q106-R109 PolarHBondContact O-N 2.7Å; Q106-G110 PolarHBondContact O-N 3.17Å
107	T	52.6	Low	61.5	Low	89 Å²	89	88.5 Å²	88.5	55%	0.546	46%	0.461	S	S	.	.	H	α-helix	trans	-70.9	-32.7	-179.9	47.2	0	0	0	0	112.4	R103 T104 R109 G110 G111	R103-T107 HydrophobicContact CG-CG2 4.35Å; R103-T107 WeakPolarHBondContact O-CB 3.16Å; R103-T107 VanDerWaalsContact O-CG2 3.29Å; R103-T107 WeakPolarHBondContact O-CG2 3.4Å; R103-T107 PolarHBondContact O-N 2.98Å; R103-T107 PolarHBondContact O-OG1 2.84Å; T104-T107 WeakPolarHBondContact CA-OG1 3.38Å; T104-T107 PolarHBondContact O-N 2.86Å; T104-T107 PolarHBondContact O-OG1 3.25Å; T104-T107 VanDerWaalsContact O-OG1 3.11Å; T107-R109 VanDerWaalsContact C-N 3.31Å; T107-R109 PolarHBondContact O-N 3.37Å; T107-G110 PolarHBondContact O-N 2.89Å; T107-G110 VanDerWaalsContact O-N 3.11Å; T107-G111 PolarHBondContact O-N 3.03Å; T107-G111 VanDerWaalsContact O-N 3.14Å
108	V	48.4	Very low	61.6	Low	71 Å²	71	86.1 Å²	86.1	43%	0.43	45%	0.45	S	S	.	.	H	α-helix	trans	-56.7	-44.2	169	167.6	0	0	0	0	110.8	T104 G110 G111 D116	T104-V108 WeakPolarHBondContact O-CB 3.44Å; T104-V108 VanDerWaalsContact O-CG2 3.28Å; T104-V108 WeakPolarHBondContact O-CG2 3.37Å; T104-V108 PolarHBondContact O-N 3.05Å; V108-G110 VanDerWaalsContact C-N 3.28Å; V108-G110 PolarHBondContact O-N 3.28Å; V108-G111 PolarHBondContact O-N 3.42Å; V108-D116 HydrophobicContact CG1-CB 4.02Å
109	R	44.1	Very low	61.7	Low	219 Å²	219	88.5 Å²	88.5	83%	0.826	47%	0.47	S	S	*	.	H	α-helix	trans	-67.8	-21.6	176	-69.4	179.9	-178.9	-154.8	-0.5	114.6	D105 Q106 T107	D105-R109 WeakPolarHBondContact O-CG 3.38Å; D105-R109 PolarHBondContact O-N 3.4Å; Q106-R109 PolarHBondContact O-N 2.7Å; T107-R109 VanDerWaalsContact C-N 3.31Å; T107-R109 PolarHBondContact O-N 3.37Å
110	G	39	Very low	61.9	Low	63 Å²	63	89 Å²	89	65%	0.649	47%	0.47	S	S	*	.	H	α-helix	trans	-92	-11.4	178.1	0	0	0	0	0	115	Q106 T107 V108 K112	Q106-G110 PolarHBondContact O-N 3.17Å; T107-G110 PolarHBondContact O-N 2.89Å; T107-G110 VanDerWaalsContact O-N 3.11Å; V108-G110 VanDerWaalsContact C-N 3.28Å; V108-G110 PolarHBondContact O-N 3.28Å; G110-K112 PolarHBondContact O-N 3.46Å
111	G	34.7	Very low	62.3	Low	52 Å²	52	83 Å²	83	54%	0.536	44%	0.442	S	S	.	.			trans	-76.1	106.7	-169.7	0	0	0	0	0	114.2	T107 V108 V113	T107-G111 PolarHBondContact O-N 3.03Å; T107-G111 VanDerWaalsContact O-N 3.14Å; V108-G111 PolarHBondContact O-N 3.42Å; G111-V113 PolarHBondContact O-N 2.87Å
112	K	37.6	Very low	62.8	Low	204 Å²	204	82.1 Å²	82.1	89%	0.887	44%	0.438	S	S	*	.	S	Bend	trans	-65.3	123.8	163.2	-71.1	-179.4	179.8	176.2	0	109.6	G110	G110-K112 PolarHBondContact O-N 3.46Å
113	V	42.2	Very low	63.4	Low	140 Å²	140	86.8 Å²	86.8	85%	0.848	45%	0.454	S	S	*	.	S	Bend	trans	75.6	76.4	176.8	-164.4	0	0	0	0	115.1	G111	G111-V113 PolarHBondContact O-N 2.87Å
114	K	51.3	Low	64.1	Low	160 Å²	160	81.4 Å²	81.4	70%	0.696	44%	0.437	S	S	*	.				-159.6	163	128.5	-99	147.8	-175.2	177.8	0	109.4	D116	K114-D116 WeakPolarHBondContact CB-OD2 3.42Å; K114-D116 PolarHBondContact O-N 2.81Å
115	C	54.1	Low	64.9	Low	26 Å²	26	78.5 Å²	78.5	18%	0.176	42%	0.419	C	S	.	.			trans	-85.6	85.7	169.9	-179.5	0	0	0	0	107	Y121 I124	C115-Y121 HydrophobicContact CB-CE1 4.47Å; C115-Y121 HydrophobicContact CB-CE2 4.43Å; C115-Y121 WeakPolarHBondContact O-CE2 3.42Å; C115-Y121 PolarHBondContact O-OH 3.48Å; C115-Y121 VanDerWaalsContact SG-CD2 3.59Å; C115-I124 HydrophobicContact CB-CD1 4.24Å
116	D	65.1	Low	65.8	Low	57 Å²	57	78.7 Å²	78.7	31%	0.305	43%	0.425	S	S	.	.			trans	-113	-11.6	-176.3	-65.6	-27.5	0	0	0	112.7	V108 K114 W152	V108-D116 HydrophobicContact CG1-CB 4.02Å; K114-D116 WeakPolarHBondContact CB-OD2 3.42Å; K114-D116 PolarHBondContact O-N 2.81Å; D116-W152 PolarHBondContact O-NE1 3.3Å
117	D	79.5	Confident	66.9	Low	81 Å²	81	77.2 Å²	77.2	43%	0.433	43%	0.427	S	S	.	.	S	Bend	trans	-84	134.7	172.3	-169.6	-57	0	0	0	111	A119 D120 Y121	D117-A119 VanDerWaalsContact C-N 3.27Å; D117-A119 PolarHBondContact O-N 2.62Å; D117-A119 WeakPolarHBondContact OD1-CA 3.3Å; D117-A119 VanDerWaalsContact OD1-CB 3.27Å; D117-A119 WeakPolarHBondContact OD1-CB 3.4Å; D117-A119 PolarHBondContact OD1-N 3Å; D117-D120 HydrophobicContact CB-CB 4.16Å; D117-D120 WeakPolarHBondContact O-CB 3.35Å; D117-D120 PolarHBondContact O-N 3.29Å; D117-D120 VanDerWaalsContact O-N 3.14Å; D117-Y121 WeakPolarHBondContact O-CD2 3.44Å; D117-Y121 PolarHBondContact O-N 3.32Å
118	P	84.9	Confident	68.1	Low	4 Å²	4	73.7 Å²	73.7	3%	0.026	41%	0.405	C	S	.	.	H	α-helix	trans	-54.6	-37.7	174.5	-24.6	33.2	0	0	0	114.5	D120 Y121 I122 W152 Q155 F156	P118-D120 VanDerWaalsContact C-N 3.35Å; P118-Y121 PolarHBondContact O-N 3.46Å; P118-I122 WeakPolarHBondContact O-CG1 3.25Å; P118-I122 PolarHBondContact O-N 2.59Å; P118-I122 VanDerWaalsContact O-N 3.17Å; P118-W152 HydrophobicContact CB-CZ2 4.33Å; P118-W152 HydrophobicContact CG-CD2 3.8Å; P118-W152 HydrophobicContact CG-CE3 4.43Å; P118-W152 HydrophobicContact CG-CG 3.99Å; P118-W152 HydrophobicContact CG-CZ2 4Å; P118-Q155 HydrophobicContact CB-CB 4.25Å; P118-Q155 HydrophobicContact CG-CB 3.77Å; P118-F156 HydrophobicContact CB-CB 3.98Å; P118-F156 HydrophobicContact CB-CD2 4.38Å
119	A	86	Confident	69.2	Low	55 Å²	55	78.1 Å²	78.1	46%	0.455	42%	0.421	S	S	.	.	H	α-helix	trans	-71.5	-29.8	179.4	0	0	0	0	0	112.1	D117 I122 R123	D117-A119 VanDerWaalsContact C-N 3.27Å; D117-A119 PolarHBondContact O-N 2.62Å; D117-A119 WeakPolarHBondContact OD1-CA 3.3Å; D117-A119 VanDerWaalsContact OD1-CB 3.27Å; D117-A119 WeakPolarHBondContact OD1-CB 3.4Å; D117-A119 PolarHBondContact OD1-N 3Å; A119-I122 PolarHBondContact O-N 3.32Å; A119-R123 VanDerWaalsContact O-CB 3.28Å; A119-R123 WeakPolarHBondContact O-CB 3.48Å; A119-R123 PolarHBondContact O-N 2.94Å
120	D	85.9	Confident	70.8	Confident	45 Å²	45	70.2 Å²	70.2	24%	0.241	40%	0.395	C	S	.	.	H	α-helix	trans	-63.8	-43	171	-81.9	-0.8	0	0	0	110.9	D117 P118 I122 R123 I124	D117-D120 HydrophobicContact CB-CB 4.16Å; D117-D120 WeakPolarHBondContact O-CB 3.35Å; D117-D120 PolarHBondContact O-N 3.29Å; D117-D120 VanDerWaalsContact O-N 3.14Å; P118-D120 VanDerWaalsContact C-N 3.35Å; D120-I122 PolarHBondContact O-N 2.8Å; D120-R123 PolarHBondContact O-N 3.01Å; D120-R123 IonicContact OD1-CZ 3.75Å; D120-R123 IonicContact OD1-NH1 2.82Å; D120-R123 PolarHBondContact OD1-NH1 3.35Å; D120-R123 IonicContact OD1-NH2 3.47Å; D120-R123 PolarHBondContact OD1-NH2 2.74Å; D120-R123 IonicContact OD2-NH2 3.49Å; D120-I124 WeakPolarHBondContact O-CB 3.34Å; D120-I124 VanDerWaalsContact O-CG1 3.26Å; D120-I124 WeakPolarHBondContact O-CG1 3.42Å; D120-I124 PolarHBondContact O-N 3.22Å
121	Y	90	Very high	72.6	Confident	3 Å²	3	67.2 Å²	67.2	1%	0.012	36%	0.364	C	S	.	.	H	α-helix	trans	-60.8	-45.4	174.9	-81.1	-75.7	0	0	0	112.3	C115 D117 P118 I124 L125 T137 S140 L141 A144 W152	C115-Y121 HydrophobicContact CB-CE1 4.47Å; C115-Y121 HydrophobicContact CB-CE2 4.43Å; C115-Y121 WeakPolarHBondContact O-CE2 3.42Å; C115-Y121 PolarHBondContact O-OH 3.48Å; C115-Y121 VanDerWaalsContact SG-CD2 3.59Å; D117-Y121 WeakPolarHBondContact O-CD2 3.44Å; D117-Y121 PolarHBondContact O-N 3.32Å; P118-Y121 PolarHBondContact O-N 3.46Å; Y121-I124 PolarHBondContact O-N 3.43Å; Y121-L125 VanDerWaalsContact O-CB 3.32Å; Y121-L125 WeakPolarHBondContact O-CB 3.47Å; Y121-L125 VanDerWaalsContact O-CG 3.31Å; Y121-L125 WeakPolarHBondContact O-CG 3.19Å; Y121-L125 PolarHBondContact O-N 3.07Å; Y121-T137 HydrophobicContact CD1-CG2 3.95Å; Y121-T137 HydrophobicContact CE1-CG2 4.32Å; Y121-S140 WeakPolarHBondContact OH-CB 3.46Å; Y121-S140 PolarHBondContact OH-O 3.31Å; Y121-S140 PolarHBondContact OH-OG 2.94Å; Y121-L141 HydrophobicContact CD1-CB 3.67Å; Y121-L141 HydrophobicContact CD1-CD1 3.93Å; Y121-L141 HydrophobicContact CD1-CD2 4.48Å; Y121-L141 HydrophobicContact CD1-CG 4.22Å; Y121-L141 HydrophobicContact CD2-CD1 4.19Å; Y121-L141 HydrophobicContact CE1-CB 3.64Å; Y121-L141 HydrophobicContact CE1-CD1 4.34Å; Y121-L141 HydrophobicContact CG-CB 4.46Å; Y121-L141 HydrophobicContact CG-CD1 3.85Å; Y121-A144 HydrophobicContact CE2-CB 4.05Å; Y121-W152 AromaticContact CD2-CH2 3.79Å; Y121-W152 HydrophobicContact CD2-CH2 3.79Å; Y121-W152 AromaticContact CD2-CZ2 3.65Å; Y121-W152 HydrophobicContact CD2-CZ2 3.65Å; Y121-W152 HydrophobicContact CE2-CH2 4.01Å; Y121-W152 AromaticContact CE2-CZ2 3.72Å; Y121-W152 HydrophobicContact CE2-CZ2 3.72Å
122	I	87.9	Confident	74.8	Confident	11 Å²	11	68.4 Å²	68.4	6%	0.056	36%	0.358	C	S	.	.	H	α-helix	trans	-63.8	-44.6	178.6	-65.3	166.5	0	0	0	110.6	P118 A119 D120 S126 F156 Q159 M163	P118-I122 WeakPolarHBondContact O-CG1 3.25Å; P118-I122 PolarHBondContact O-N 2.59Å; P118-I122 VanDerWaalsContact O-N 3.17Å; A119-I122 PolarHBondContact O-N 3.32Å; D120-I122 PolarHBondContact O-N 2.8Å; I122-S126 WeakPolarHBondContact O-CB 3.32Å; I122-S126 PolarHBondContact O-N 3.39Å; I122-S126 PolarHBondContact O-OG 3.47Å; I122-S126 VanDerWaalsContact O-OG 3.08Å; I122-F156 HydrophobicContact CD1-CD2 4.23Å; I122-F156 HydrophobicContact CG1-CD2 4.12Å; I122-F156 HydrophobicContact CG1-CE2 3.97Å; I122-Q159 HydrophobicContact CD1-CB 4.2Å; I122-Q159 HydrophobicContact CD1-CG 4.23Å; I122-Q159 HydrophobicContact CG2-CG 4.03Å; I122-M163 HydrophobicContact CG2-CE 4.48Å
123	R	86.4	Confident	77	Confident	136 Å²	136	65.3 Å²	65.3	51%	0.513	35%	0.345	S	S	.	.	H	α-helix	trans	-64	-41.8	177.7	-171.4	179.1	68	-107.1	-3.3	111.9	A119 D120 S126 S127	A119-R123 VanDerWaalsContact O-CB 3.28Å; A119-R123 WeakPolarHBondContact O-CB 3.48Å; A119-R123 PolarHBondContact O-N 2.94Å; D120-R123 PolarHBondContact O-N 3.01Å; D120-R123 IonicContact OD1-CZ 3.75Å; D120-R123 IonicContact OD1-NH1 2.82Å; D120-R123 PolarHBondContact OD1-NH1 3.35Å; D120-R123 IonicContact OD1-NH2 3.47Å; D120-R123 PolarHBondContact OD1-NH2 2.74Å; D120-R123 IonicContact OD2-NH2 3.49Å; R123-S126 PolarHBondContact O-OG 3.19Å; R123-S127 PolarHBondContact O-N 3.38Å; R123-S127 PolarHBondContact O-OG 2.92Å
124	I	85.9	Confident	79.1	Confident	54 Å²	54	58.7 Å²	58.7	28%	0.277	31%	0.305	S	S	.	.	H	α-helix	trans	-66.7	-55	176.1	-68.4	169.9	0	0	0	110	C115 D120 Y121 S126 S127 V128 T137	C115-I124 HydrophobicContact CB-CD1 4.24Å; D120-I124 WeakPolarHBondContact O-CB 3.34Å; D120-I124 VanDerWaalsContact O-CG1 3.26Å; D120-I124 WeakPolarHBondContact O-CG1 3.42Å; D120-I124 PolarHBondContact O-N 3.22Å; Y121-I124 PolarHBondContact O-N 3.43Å; I124-S126 VanDerWaalsContact C-N 3.27Å; I124-S126 PolarHBondContact O-N 2.8Å; I124-S127 CarbonylContact O-C 3.54Å; I124-S127 WeakPolarHBondContact O-CA 3.16Å; I124-S127 PolarHBondContact O-N 3.29Å; I124-S127 PolarHBondContact O-OG 2.85Å; I124-V128 HydrophobicContact CG2-CG2 3.86Å; I124-V128 WeakPolarHBondContact O-CG2 3.31Å; I124-V128 PolarHBondContact O-N 3.17Å; I124-T137 HydrophobicContact CB-CG2 4.5Å; I124-T137 HydrophobicContact CG2-CG2 3.87Å
125	L	85.8	Confident	80.8	Confident	6 Å²	6	51.4 Å²	51.4	3%	0.031	27%	0.273	C	S	.	.	H	α-helix	trans	-56.6	-37.6	-177.4	-74	179.6	0	0	0	113.3	Y121 S127 L134 T137 L138 L141 M163 I167	Y121-L125 VanDerWaalsContact O-CB 3.32Å; Y121-L125 WeakPolarHBondContact O-CB 3.47Å; Y121-L125 VanDerWaalsContact O-CG 3.31Å; Y121-L125 WeakPolarHBondContact O-CG 3.19Å; Y121-L125 PolarHBondContact O-N 3.07Å; L125-S127 PolarHBondContact O-N 2.72Å; L125-L134 HydrophobicContact CD2-CD1 3.63Å; L125-T137 HydrophobicContact CD2-CG2 3.64Å; L125-T137 HydrophobicContact CG-CG2 3.96Å; L125-L138 HydrophobicContact CD2-CD2 4.19Å; L125-L138 HydrophobicContact CD2-CG 4.39Å; L125-L141 HydrophobicContact CD1-CD2 3.65Å; L125-M163 HydrophobicContact CB-CG 3.64Å; L125-M163 HydrophobicContact CB-SD 4.19Å; L125-M163 HydrophobicContact CD1-CG 4.03Å; L125-I167 HydrophobicContact CB-CD1 4.27Å; L125-I167 HydrophobicContact CD1-CD1 4.14Å; L125-I167 HydrophobicContact CD2-CD1 3.97Å; L125-I167 HydrophobicContact CG-CD1 4.36Å
126	S	82.5	Confident	82.4	Confident	69 Å²	69	52.9 Å²	52.9	48%	0.483	29%	0.288	S	S	.	.	H	α-helix	trans	-67.6	-20.1	175.1	67	0	0	0	0	114.6	I122 R123 I124	I122-S126 WeakPolarHBondContact O-CB 3.32Å; I122-S126 PolarHBondContact O-N 3.39Å; I122-S126 PolarHBondContact O-OG 3.47Å; I122-S126 VanDerWaalsContact O-OG 3.08Å; R123-S126 PolarHBondContact O-OG 3.19Å; I124-S126 VanDerWaalsContact C-N 3.27Å; I124-S126 PolarHBondContact O-N 2.8Å
127	S	81.8	Confident	83.6	Confident	77 Å²	77	51.2 Å²	51.2	54%	0.538	28%	0.279	S	S	.	.	H	α-helix	trans	-118	8.9	-175	59.9	0	0	0	0	114.8	R123 I124 L125 E129	R123-S127 PolarHBondContact O-N 3.38Å; R123-S127 PolarHBondContact O-OG 2.92Å; I124-S127 CarbonylContact O-C 3.54Å; I124-S127 WeakPolarHBondContact O-CA 3.16Å; I124-S127 PolarHBondContact O-N 3.29Å; I124-S127 PolarHBondContact O-OG 2.85Å; L125-S127 PolarHBondContact O-N 2.72Å; S127-E129 PolarHBondContact O-N 3.03Å
128	V	77.4	Confident	84.2	Confident	14 Å²	14	47.4 Å²	47.4	9%	0.085	26%	0.259	C	S	.	.			trans	-73.4	120.5	177.2	-174.8	0	0	0	0	111.7	I124 N130 K133 L134 Y183	I124-V128 HydrophobicContact CG2-CG2 3.86Å; I124-V128 WeakPolarHBondContact O-CG2 3.31Å; I124-V128 PolarHBondContact O-N 3.17Å; V128-N130 WeakPolarHBondContact CG1-O 3.49Å; V128-K133 HydrophobicContact CG1-CB 4Å; V128-L134 HydrophobicContact CB-CB 4.49Å; V128-L134 HydrophobicContact CG1-CB 3.81Å; V128-L134 HydrophobicContact CG2-CD1 4.49Å; V128-Y183 WeakPolarHBondContact O-CD1 3.26Å; V128-Y183 WeakPolarHBondContact O-CE1 3.45Å
129	E	71.2	Confident	84.6	Confident	164 Å²	164	52.3 Å²	52.3	77%	0.766	28%	0.277	S	S	*	.			trans	-100.5	-1.2	173.8	-58.7	177.6	150.5	0	0	113.6	S127 Y183	S127-E129 PolarHBondContact O-N 3.03Å; E129-Y183 WeakPolarHBondContact O-CA 3.12Å
130	N	77.6	Confident	84.9	Confident	53 Å²	53	52.3 Å²	52.3	28%	0.283	27%	0.273	S	S	.	.			trans	-133.6	126.2	-170.9	172.4	-81.4	0	0	0	111.7	V128 D132 K133 L134 Y183	V128-N130 WeakPolarHBondContact CG1-O 3.49Å; N130-D132 PolarHBondContact O-N 3.02Å; N130-D132 PolarHBondContact OD1-N 3.07Å; N130-D132 VanDerWaalsContact OD1-N 3.1Å; N130-K133 HydrophobicContact CB-CB 4.27Å; N130-K133 HydrophobicContact CB-CD 4.19Å; N130-K133 HydrophobicContact CB-CG 4.19Å; N130-K133 WeakPolarHBondContact O-CB 3.23Å; N130-K133 PolarHBondContact O-N 3.46Å; N130-K133 PolarHBondContact OD1-N 2.86Å; N130-L134 PolarHBondContact O-N 2.6Å; N130-Y183 WeakPolarHBondContact CA-O 2.87Å
131	A	76.2	Confident	85.2	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-63.3	-36.9	-175.1	0	0	0	0	0	114.9	L134 L135 W179 Y183 C184 V195	A131-L134 WeakPolarHBondContact O-CB 3.18Å; A131-L134 PolarHBondContact O-N 3.1Å; A131-L135 WeakPolarHBondContact O-CB 3.39Å; A131-L135 PolarHBondContact O-N 2.82Å; A131-W179 HydrophobicContact CB-CH2 3.57Å; A131-W179 HydrophobicContact CB-CZ3 3.78Å; A131-Y183 PolarHBondContact N-O 2.83Å; A131-C184 WeakPolarHBondContact CB-SG 3.46Å; A131-V195 HydrophobicContact CB-CG1 3.66Å
132	D	82	Confident	85.3	Confident	78 Å²	78	54.1 Å²	54.1	42%	0.417	28%	0.277	S	S	.	.	H	α-helix	trans	-67.7	-38.2	177.6	-58.2	-73.1	0	0	0	111.2	N130 A136	N130-D132 PolarHBondContact O-N 3.02Å; N130-D132 PolarHBondContact OD1-N 3.07Å; N130-D132 VanDerWaalsContact OD1-N 3.1Å; D132-A136 WeakPolarHBondContact O-CB 3.28Å; D132-A136 PolarHBondContact O-N 3.14Å
133	K	84.1	Confident	85.4	Confident	139 Å²	139	56.6 Å²	56.6	60%	0.604	29%	0.293	S	S	*	.	H	α-helix	trans	-63.5	-43.8	169.9	-68.3	-174.6	-174.3	178.3	0	111.3	V128 N130 L135 A136 T137	V128-K133 HydrophobicContact CG1-CB 4Å; N130-K133 HydrophobicContact CB-CB 4.27Å; N130-K133 HydrophobicContact CB-CD 4.19Å; N130-K133 HydrophobicContact CB-CG 4.19Å; N130-K133 WeakPolarHBondContact O-CB 3.23Å; N130-K133 PolarHBondContact O-N 3.46Å; N130-K133 PolarHBondContact OD1-N 2.86Å; K133-L135 PolarHBondContact O-N 3.41Å; K133-A136 PolarHBondContact O-N 3.15Å; K133-T137 PolarHBondContact O-N 3.25Å; K133-T137 PolarHBondContact O-OG1 3.39Å; K133-T137 VanDerWaalsContact O-OG1 3.13Å
134	L	86.3	Confident	85.5	Confident	1 Å²	1	50.5 Å²	50.5	1%	0.005	27%	0.271	C	S	.	.	H	α-helix	trans	-59.1	-48.5	178.6	179.8	60.6	0	0	0	110.7	L125 V128 N130 A131 A136 T137 L138 I167 W179 Y183	L125-L134 HydrophobicContact CD2-CD1 3.63Å; V128-L134 HydrophobicContact CB-CB 4.49Å; V128-L134 HydrophobicContact CG1-CB 3.81Å; V128-L134 HydrophobicContact CG2-CD1 4.49Å; N130-L134 PolarHBondContact O-N 2.6Å; A131-L134 WeakPolarHBondContact O-CB 3.18Å; A131-L134 PolarHBondContact O-N 3.1Å; L134-A136 VanDerWaalsContact C-N 3.35Å; L134-A136 PolarHBondContact O-N 3.04Å; L134-T137 PolarHBondContact O-N 3.32Å; L134-L138 HydrophobicContact CD1-CD1 4.17Å; L134-L138 HydrophobicContact CD1-CG 4.3Å; L134-L138 HydrophobicContact CG-CD1 4.03Å; L134-L138 WeakPolarHBondContact O-CB 3.32Å; L134-L138 WeakPolarHBondContact O-CG 3.48Å; L134-L138 PolarHBondContact O-N 2.98Å; L134-I167 HydrophobicContact CD1-CD1 4.24Å; L134-W179 HydrophobicContact CD2-CZ2 3.89Å; L134-Y183 HydrophobicContact CD2-CD1 4.3Å; L134-Y183 HydrophobicContact CD2-CE1 4.22Å
135	L	86.9	Confident	85.7	Confident	7 Å²	7	48 Å²	48	4%	0.037	26%	0.258	C	S	.	.	H	α-helix	trans	-63.2	-38.3	177.5	-179.3	55.7	0	0	0	112.4	A131 K133 R139 V195 Q198 E202	A131-L135 WeakPolarHBondContact O-CB 3.39Å; A131-L135 PolarHBondContact O-N 2.82Å; K133-L135 PolarHBondContact O-N 3.41Å; L135-R139 HydrophobicContact CD1-CG 4.49Å; L135-R139 WeakPolarHBondContact O-CB 3.34Å; L135-R139 VanDerWaalsContact O-CG 3.25Å; L135-R139 WeakPolarHBondContact O-CG 3.19Å; L135-R139 PolarHBondContact O-N 2.92Å; L135-V195 HydrophobicContact CB-CG1 4.35Å; L135-V195 HydrophobicContact CD2-CG1 3.98Å; L135-Q198 HydrophobicContact CD1-CB 3.94Å; L135-Q198 HydrophobicContact CD2-CB 3.9Å; L135-E202 HydrophobicContact CD1-CB 4.3Å
136	A	88	Confident	85.8	Confident	57 Å²	57	50.9 Å²	50.9	47%	0.471	28%	0.279	S	S	.	.	H	α-helix	trans	-66.3	-44.1	174	0	0	0	0	0	112.2	D132 K133 L134 R139 S140	D132-A136 WeakPolarHBondContact O-CB 3.28Å; D132-A136 PolarHBondContact O-N 3.14Å; K133-A136 PolarHBondContact O-N 3.15Å; L134-A136 VanDerWaalsContact C-N 3.35Å; L134-A136 PolarHBondContact O-N 3.04Å; A136-R139 PolarHBondContact O-N 3.41Å; A136-S140 WeakPolarHBondContact O-CB 3.47Å; A136-S140 PolarHBondContact O-N 3.28Å
137	T	90	Very high	85.8	Confident	22 Å²	22	53.1 Å²	53.1	14%	0.135	29%	0.285	C	S	.	.	H	α-helix	trans	-64.4	-41.8	175.9	-60.9	0	0	0	0	111.6	Y121 I124 L125 K133 L134 S140 L141	Y121-T137 HydrophobicContact CD1-CG2 3.95Å; Y121-T137 HydrophobicContact CE1-CG2 4.32Å; I124-T137 HydrophobicContact CB-CG2 4.5Å; I124-T137 HydrophobicContact CG2-CG2 3.87Å; L125-T137 HydrophobicContact CD2-CG2 3.64Å; L125-T137 HydrophobicContact CG-CG2 3.96Å; K133-T137 PolarHBondContact O-N 3.25Å; K133-T137 PolarHBondContact O-OG1 3.39Å; K133-T137 VanDerWaalsContact O-OG1 3.13Å; L134-T137 PolarHBondContact O-N 3.32Å; T137-S140 PolarHBondContact O-N 2.97Å; T137-L141 VanDerWaalsContact O-CB 3.29Å; T137-L141 WeakPolarHBondContact O-CB 3.43Å; T137-L141 PolarHBondContact O-N 3.04Å
138	L	92	Very high	86	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-64.3	-42	175.6	-72.2	170.8	0	0	0	112	L125 L134 S140 L141 R142 L164 E202 C203 C206	L125-L138 HydrophobicContact CD2-CD2 4.19Å; L125-L138 HydrophobicContact CD2-CG 4.39Å; L134-L138 HydrophobicContact CD1-CD1 4.17Å; L134-L138 HydrophobicContact CD1-CG 4.3Å; L134-L138 HydrophobicContact CG-CD1 4.03Å; L134-L138 WeakPolarHBondContact O-CB 3.32Å; L134-L138 WeakPolarHBondContact O-CG 3.48Å; L134-L138 PolarHBondContact O-N 2.98Å; L138-S140 VanDerWaalsContact C-N 3.33Å; L138-S140 PolarHBondContact O-N 3.1Å; L138-L141 PolarHBondContact O-N 2.96Å; L138-R142 WeakPolarHBondContact O-CB 3.24Å; L138-R142 PolarHBondContact O-N 3.44Å; L138-L164 HydrophobicContact CD2-CD2 3.97Å; L138-E202 HydrophobicContact CB-CB 4.23Å; L138-E202 HydrophobicContact CB-CG 4.01Å; L138-C203 HydrophobicContact CD1-CB 4.42Å; L138-C206 PolarHBondContact O-SG 3.33Å
139	R	93.2	Very high	86.3	Confident	108 Å²	108	51.9 Å²	51.9	41%	0.408	27%	0.273	S	S	.	.	H	α-helix	trans	-59.6	-42.3	173.2	-77.7	169.7	175.8	158.8	5.3	112.3	L135 A136 V143 E202	L135-R139 HydrophobicContact CD1-CG 4.49Å; L135-R139 WeakPolarHBondContact O-CB 3.34Å; L135-R139 VanDerWaalsContact O-CG 3.25Å; L135-R139 WeakPolarHBondContact O-CG 3.19Å; L135-R139 PolarHBondContact O-N 2.92Å; A136-R139 PolarHBondContact O-N 3.41Å; R139-V143 WeakPolarHBondContact O-CG2 3.09Å; R139-V143 PolarHBondContact O-N 2.88Å; R139-E202 HydrophobicContact CG-CG 3.9Å; R139-E202 WeakPolarHBondContact CG-OE1 3.48Å
140	S	91.1	Very high	86.9	Confident	54 Å²	54	44 Å²	44	38%	0.378	24%	0.237	S	C	.	.	H	α-helix	trans	-65.9	-45.7	175.6	-163.1	0	0	0	0	111.5	Y121 A136 T137 L138 R142 V143 A144	Y121-S140 WeakPolarHBondContact OH-CB 3.46Å; Y121-S140 PolarHBondContact OH-O 3.31Å; Y121-S140 PolarHBondContact OH-OG 2.94Å; A136-S140 WeakPolarHBondContact O-CB 3.47Å; A136-S140 PolarHBondContact O-N 3.28Å; T137-S140 PolarHBondContact O-N 2.97Å; L138-S140 VanDerWaalsContact C-N 3.33Å; L138-S140 PolarHBondContact O-N 3.1Å; S140-R142 PolarHBondContact O-N 3.46Å; S140-V143 PolarHBondContact O-N 3.4Å; S140-V143 VanDerWaalsContact O-N 3.16Å; S140-A144 PolarHBondContact O-N 3.21Å
141	L	93.4	Very high	87.3	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-63.7	-39.4	178.7	178.3	56.4	0	0	0	112.5	Y121 L125 T137 L138 V143 A144 L145 W152 F156 L164	Y121-L141 HydrophobicContact CD1-CB 3.67Å; Y121-L141 HydrophobicContact CD1-CD1 3.93Å; Y121-L141 HydrophobicContact CD1-CD2 4.48Å; Y121-L141 HydrophobicContact CD1-CG 4.22Å; Y121-L141 HydrophobicContact CD2-CD1 4.19Å; Y121-L141 HydrophobicContact CE1-CB 3.64Å; Y121-L141 HydrophobicContact CE1-CD1 4.34Å; Y121-L141 HydrophobicContact CG-CB 4.46Å; Y121-L141 HydrophobicContact CG-CD1 3.85Å; L125-L141 HydrophobicContact CD1-CD2 3.65Å; T137-L141 VanDerWaalsContact O-CB 3.29Å; T137-L141 WeakPolarHBondContact O-CB 3.43Å; T137-L141 PolarHBondContact O-N 3.04Å; L138-L141 PolarHBondContact O-N 2.96Å; L141-V143 VanDerWaalsContact C-N 3.31Å; L141-V143 PolarHBondContact O-N 3.15Å; L141-A144 PolarHBondContact O-N 2.75Å; L141-L145 HydrophobicContact CD1-CD1 3.85Å; L141-L145 HydrophobicContact CD1-CG 3.88Å; L141-L145 HydrophobicContact CD2-CD1 4.48Å; L141-L145 HydrophobicContact CG-CD1 3.77Å; L141-L145 HydrophobicContact CG-CG 4.29Å; L141-L145 WeakPolarHBondContact O-CB 3.35Å; L141-L145 WeakPolarHBondContact O-CG 3.32Å; L141-L145 PolarHBondContact O-N 3.16Å; L141-W152 HydrophobicContact CD1-CH2 3.73Å; L141-W152 HydrophobicContact CD1-CZ3 4.2Å; L141-F156 HydrophobicContact CD1-CD2 4.35Å; L141-F156 HydrophobicContact CD1-CE2 3.85Å; L141-F156 HydrophobicContact CD1-CZ 4.1Å; L141-F156 HydrophobicContact CD2-CE2 4.07Å; L141-F156 HydrophobicContact CD2-CZ 3.83Å; L141-L164 HydrophobicContact CD2-CD2 3.94Å
142	R	92.6	Very high	87.9	Confident	86 Å²	86	44.1 Å²	44.1	33%	0.325	24%	0.238	S	C	.	.	H	α-helix	trans	-58.1	-45.7	172.9	-171.4	-157.8	69.4	-160.4	3.4	110.7	L138 S140 L145 S146 E202 K205	L138-R142 WeakPolarHBondContact O-CB 3.24Å; L138-R142 PolarHBondContact O-N 3.44Å; S140-R142 PolarHBondContact O-N 3.46Å; R142-L145 PolarHBondContact O-N 3.25Å; R142-S146 WeakPolarHBondContact O-CB 3.07Å; R142-S146 PolarHBondContact O-N 3.06Å; R142-S146 VanDerWaalsContact O-N 3.08Å; R142-S146 PolarHBondContact O-OG 3.38Å; R142-E202 WeakPolarHBondContact CD-OE1 3.28Å; R142-E202 IonicContact CZ-OE1 2.79Å; R142-E202 VanDerWaalsContact CZ-OE1 3.23Å; R142-E202 IonicContact NE-OE1 2.73Å; R142-E202 PolarHBondContact NE-OE1 2.97Å; R142-E202 IonicContact NH1-OE1 3.5Å; R142-E202 PolarHBondContact NH1-OE1 3.43Å; R142-E202 IonicContact NH1-OE2 3.4Å; R142-K205 HydrophobicContact CG-CB 3.97Å
143	V	88.9	Confident	88.2	Confident	64 Å²	64	40.5 Å²	40.5	39%	0.388	22%	0.219	S	C	.	.	H	α-helix	trans	-66.1	-40.4	178.5	173.6	0	0	0	0	111.4	R139 S140 L141 S146 N147	R139-V143 WeakPolarHBondContact O-CG2 3.09Å; R139-V143 PolarHBondContact O-N 2.88Å; S140-V143 PolarHBondContact O-N 3.4Å; S140-V143 VanDerWaalsContact O-N 3.16Å; L141-V143 VanDerWaalsContact C-N 3.31Å; L141-V143 PolarHBondContact O-N 3.15Å; V143-S146 PolarHBondContact O-N 2.87Å; V143-N147 WeakPolarHBondContact O-CB 3.43Å; V143-N147 PolarHBondContact O-N 3.42Å; V143-N147 PolarHBondContact O-ND2 2.89Å
144	A	88.3	Confident	88.4	Confident	7 Å²	7	38.1 Å²	38.1	6%	0.058	21%	0.208	C	C	.	.	H	α-helix	trans	-60.9	-53.3	173.4	0	0	0	0	0	111.6	Y121 S140 L141 S146 N147 N148 W152	Y121-A144 HydrophobicContact CE2-CB 4.05Å; S140-A144 PolarHBondContact O-N 3.21Å; L141-A144 PolarHBondContact O-N 2.75Å; A144-S146 PolarHBondContact O-N 3.03Å; A144-S146 VanDerWaalsContact O-N 3.13Å; A144-N147 PolarHBondContact O-N 3.48Å; A144-N148 WeakPolarHBondContact O-CB 3.41Å; A144-N148 PolarHBondContact O-N 3.48Å; A144-W152 HydrophobicContact CB-CH2 3.69Å; A144-W152 HydrophobicContact CB-CZ2 3.82Å; A144-W152 HydrophobicContact CB-CZ3 4.23Å
145	L	90.4	Very high	88.5	Confident	3 Å²	3	43.8 Å²	43.8	2%	0.016	24%	0.235	C	C	.	.	H	α-helix	trans	-60.3	-22.1	178.3	-74.8	166.7	0	0	0	114.4	L141 R142 W152 I153 F156 L164 C206 A209 F210	L141-L145 HydrophobicContact CD1-CD1 3.85Å; L141-L145 HydrophobicContact CD1-CG 3.88Å; L141-L145 HydrophobicContact CD2-CD1 4.48Å; L141-L145 HydrophobicContact CG-CD1 3.77Å; L141-L145 HydrophobicContact CG-CG 4.29Å; L141-L145 WeakPolarHBondContact O-CB 3.35Å; L141-L145 WeakPolarHBondContact O-CG 3.32Å; L141-L145 PolarHBondContact O-N 3.16Å; R142-L145 PolarHBondContact O-N 3.25Å; L145-W152 HydrophobicContact CD2-CE3 4.39Å; L145-W152 HydrophobicContact CD2-CZ3 3.78Å; L145-W152 HydrophobicContact CG-CZ3 4.05Å; L145-I153 HydrophobicContact CD2-CG1 4.37Å; L145-F156 HydrophobicContact CD2-CD1 4.08Å; L145-F156 HydrophobicContact CD2-CE1 4.4Å; L145-L164 HydrophobicContact CD1-CD1 4.37Å; L145-C206 HydrophobicContact CD1-CB 3.9Å; L145-A209 HydrophobicContact CB-CB 3.73Å; L145-F210 HydrophobicContact CD1-CB 4.36Å; L145-F210 HydrophobicContact CD2-CB 4.16Å; L145-F210 HydrophobicContact CD2-CD2 3.97Å
146	S	87	Confident	88.8	Confident	66 Å²	66	43.5 Å²	43.5	46%	0.462	23%	0.233	S	C	.	.	H	α-helix	trans	-91.3	-24.6	178.4	-63.7	0	0	0	0	114.4	R142 V143 A144 A209	R142-S146 WeakPolarHBondContact O-CB 3.07Å; R142-S146 PolarHBondContact O-N 3.06Å; R142-S146 VanDerWaalsContact O-N 3.08Å; R142-S146 PolarHBondContact O-OG 3.38Å; V143-S146 PolarHBondContact O-N 2.87Å; A144-S146 PolarHBondContact O-N 3.03Å; A144-S146 VanDerWaalsContact O-N 3.13Å; S146-A209 WeakPolarHBondContact OG-CB 3.21Å
147	N	84.4	Confident	88.9	Confident	115 Å²	115	41 Å²	41	62%	0.615	21%	0.213	S	C	*	.	H	α-helix	trans	-120.8	-17.4	-168.9	-63.6	-20.6	0	0	0	114	V143 A144	V143-N147 WeakPolarHBondContact O-CB 3.43Å; V143-N147 PolarHBondContact O-N 3.42Å; V143-N147 PolarHBondContact O-ND2 2.89Å; A144-N147 PolarHBondContact O-N 3.48Å
148	N	85.7	Confident	89	Confident	48 Å²	48	46 Å²	46	26%	0.257	23%	0.23	S	C	.	.	S	Bend	trans	-86.6	154	177.8	-67.1	-6.1	0	0	0	110.6	A144 W152	A144-N148 WeakPolarHBondContact O-CB 3.41Å; A144-N148 PolarHBondContact O-N 3.48Å; N148-W152 HydrophobicContact CB-CB 3.77Å; N148-W152 HydrophobicContact CB-CD2 3.85Å; N148-W152 HydrophobicContact CB-CE3 4.31Å; N148-W152 HydrophobicContact CB-CG 3.59Å; N148-W152 PolarHBondContact ND2-NE1 2.96Å; N148-W152 VanDerWaalsContact ND2-NE1 3.12Å
149	P	84.1	Confident	88.9	Confident	17 Å²	17	52.4 Å²	52.4	11%	0.11	26%	0.26	C	S	.	.			trans	-63.5	164.4	-176.7	24.9	-36.9	0	0	0	114.6	D75 S151 W152 I153	D75-P149 HydrophobicContact CB-CB 4.4Å; D75-P149 CarbonylContact O-C 3.37Å; D75-P149 WeakPolarHBondContact O-CA 3.46Å; D75-P149 WeakPolarHBondContact O-CB 3.41Å; D75-P149 WeakPolarHBondContact OD2-CB 3.47Å; P149-S151 WeakPolarHBondContact CG-OG 3.48Å; P149-S151 PolarHBondContact O-N 3.32Å; P149-W152 HydrophobicContact CG-CB 4.2Å; P149-W152 WeakPolarHBondContact O-CA 3.41Å; P149-W152 WeakPolarHBondContact O-CB 3.23Å; P149-W152 PolarHBondContact O-N 2.87Å; P149-I153 PolarHBondContact O-N 2.88Å
150	I	83.8	Confident	88.9	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-59	-32.2	177.5	-50.1	-176	0	0	0	110.8	E74 D75 N77 W152 I153 K154 N213 E1045	E74-I150 WeakPolarHBondContact O-CD1 3.45Å; D75-I150 PolarHBondContact O-N 3.26Å; N77-I150 HydrophobicContact CB-CD1 4.11Å; N77-I150 HydrophobicContact CB-CG1 3.86Å; I150-W152 VanDerWaalsContact C-N 3.3Å; I150-W152 PolarHBondContact O-N 2.87Å; I150-I153 CarbonylContact O-C 3.41Å; I150-I153 PolarHBondContact O-N 3.17Å; I150-I153 VanDerWaalsContact O-N 3.11Å; I150-K154 HydrophobicContact CG2-CD 3.95Å; I150-K154 HydrophobicContact CG2-CG 4.27Å; I150-K154 WeakPolarHBondContact O-CB 3.22Å; I150-K154 VanDerWaalsContact O-CG 3.27Å; I150-K154 WeakPolarHBondContact O-CG 3.33Å; I150-K154 PolarHBondContact O-N 2.99Å; I150-N213 HydrophobicContact CD1-CB 4.34Å; I150-N213 HydrophobicContact CG1-CB 4.43Å; I150-E1045 HydrophobicContact CD1-CB 4.06Å
151	S	84.7	Confident	89.1	Confident	36 Å²	36	44.7 Å²	44.7	25%	0.252	22%	0.223	S	C	.	.	H	α-helix	trans	-59	-36	172.1	57.8	0	0	0	0	113.3	D75 P149 Q155	D75-S151 VanDerWaalsContact CG-OG 3.26Å; D75-S151 WeakPolarHBondContact OD1-CA 3.41Å; D75-S151 WeakPolarHBondContact OD1-CB 3.15Å; D75-S151 PolarHBondContact OD1-N 2.94Å; D75-S151 PolarHBondContact OD1-OG 3.05Å; D75-S151 VanDerWaalsContact OD1-OG 3.05Å; D75-S151 WeakPolarHBondContact OD2-CB 3.41Å; D75-S151 PolarHBondContact OD2-OG 3.38Å; P149-S151 WeakPolarHBondContact CG-OG 3.48Å; P149-S151 PolarHBondContact O-N 3.32Å; S151-Q155 VanDerWaalsContact O-CG 3.28Å; S151-Q155 WeakPolarHBondContact O-CG 3.46Å; S151-Q155 PolarHBondContact O-N 2.8Å; S151-Q155 PolarHBondContact O-NE2 2.9Å
152	W	88.6	Confident	89	Confident	19 Å²	19	48.3 Å²	48.3	7%	0.072	24%	0.242	C	C	.	.	H	α-helix	trans	-68.3	-40.8	173.1	-166.9	99.6	0	0	0	111	D116 P118 Y121 L141 A144 L145 N148 P149 I150 Q155 F156	D116-W152 PolarHBondContact O-NE1 3.3Å; P118-W152 HydrophobicContact CB-CZ2 4.33Å; P118-W152 HydrophobicContact CG-CD2 3.8Å; P118-W152 HydrophobicContact CG-CE3 4.43Å; P118-W152 HydrophobicContact CG-CG 3.99Å; P118-W152 HydrophobicContact CG-CZ2 4Å; Y121-W152 AromaticContact CD2-CH2 3.79Å; Y121-W152 HydrophobicContact CD2-CH2 3.79Å; Y121-W152 AromaticContact CD2-CZ2 3.65Å; Y121-W152 HydrophobicContact CD2-CZ2 3.65Å; Y121-W152 HydrophobicContact CE2-CH2 4.01Å; Y121-W152 AromaticContact CE2-CZ2 3.72Å; Y121-W152 HydrophobicContact CE2-CZ2 3.72Å; L141-W152 HydrophobicContact CD1-CH2 3.73Å; L141-W152 HydrophobicContact CD1-CZ3 4.2Å; A144-W152 HydrophobicContact CB-CH2 3.69Å; A144-W152 HydrophobicContact CB-CZ2 3.82Å; A144-W152 HydrophobicContact CB-CZ3 4.23Å; L145-W152 HydrophobicContact CD2-CE3 4.39Å; L145-W152 HydrophobicContact CD2-CZ3 3.78Å; L145-W152 HydrophobicContact CG-CZ3 4.05Å; N148-W152 HydrophobicContact CB-CB 3.77Å; N148-W152 HydrophobicContact CB-CD2 3.85Å; N148-W152 HydrophobicContact CB-CE3 4.31Å; N148-W152 HydrophobicContact CB-CG 3.59Å; N148-W152 PolarHBondContact ND2-NE1 2.96Å; N148-W152 VanDerWaalsContact ND2-NE1 3.12Å; P149-W152 HydrophobicContact CG-CB 4.2Å; P149-W152 WeakPolarHBondContact O-CA 3.41Å; P149-W152 WeakPolarHBondContact O-CB 3.23Å; P149-W152 PolarHBondContact O-N 2.87Å; I150-W152 VanDerWaalsContact C-N 3.3Å; I150-W152 PolarHBondContact O-N 2.87Å; W152-Q155 PolarHBondContact O-N 2.7Å; W152-F156 HydrophobicContact CE3-CB 4.4Å; W152-F156 HydrophobicContact CH2-CD2 4.46Å; W152-F156 HydrophobicContact CZ3-CB 4.12Å; W152-F156 HydrophobicContact CZ3-CD2 4.45Å; W152-F156 HydrophobicContact CZ3-CG 4.33Å; W152-F156 PolarHBondContact O-N 2.87Å
153	I	89	Confident	88.9	Confident	1 Å²	1	46.4 Å²	46.4	1%	0.005	24%	0.237	C	C	.	.	H	α-helix	trans	-69.4	-37	177.1	-54.2	179.1	0	0	0	111	L145 P149 I150 Q155 F156 G157 F210 N213 Y215	L145-I153 HydrophobicContact CD2-CG1 4.37Å; P149-I153 PolarHBondContact O-N 2.88Å; I150-I153 CarbonylContact O-C 3.41Å; I150-I153 PolarHBondContact O-N 3.17Å; I150-I153 VanDerWaalsContact O-N 3.11Å; I153-Q155 VanDerWaalsContact C-N 3.34Å; I153-F156 PolarHBondContact O-N 2.77Å; I153-G157 PolarHBondContact O-N 2.83Å; I153-F210 HydrophobicContact CG2-CD2 3.65Å; I153-F210 HydrophobicContact CG2-CE2 3.77Å; I153-N213 WeakPolarHBondContact CD1-ND2 3.44Å; I153-Y215 HydrophobicContact CG2-CD1 4.33Å
154	K	88.6	Confident	89.2	Confident	89 Å²	89	43.3 Å²	43.3	39%	0.387	22%	0.218	S	C	.	.	H	α-helix	trans	-62.5	-37.9	171.9	-74.8	160.5	176.6	160.4	0	111.2	I150 Y215 E1045	I150-K154 HydrophobicContact CG2-CD 3.95Å; I150-K154 HydrophobicContact CG2-CG 4.27Å; I150-K154 WeakPolarHBondContact O-CB 3.22Å; I150-K154 VanDerWaalsContact O-CG 3.27Å; I150-K154 WeakPolarHBondContact O-CG 3.33Å; I150-K154 PolarHBondContact O-N 2.99Å; K154-Y215 HydrophobicContact CG-CD1 4.02Å; K154-Y215 HydrophobicContact CG-CD2 3.79Å; K154-Y215 HydrophobicContact CG-CE1 4.34Å; K154-Y215 HydrophobicContact CG-CE2 4.09Å; K154-Y215 HydrophobicContact CG-CG 3.75Å; K154-E1045 IonicContact NZ-OE2 2.96Å
155	Q	88.7	Confident	89.4	Confident	120 Å²	120	43.3 Å²	43.3	56%	0.561	22%	0.217	S	C	*	.	H	α-helix	trans	-73.4	-38.7	173.9	-73.8	166.1	38.1	0	0	113.7	P118 S151 W152 I153 G157	P118-Q155 HydrophobicContact CB-CB 4.25Å; P118-Q155 HydrophobicContact CG-CB 3.77Å; S151-Q155 VanDerWaalsContact O-CG 3.28Å; S151-Q155 WeakPolarHBondContact O-CG 3.46Å; S151-Q155 PolarHBondContact O-N 2.8Å; S151-Q155 PolarHBondContact O-NE2 2.9Å; W152-Q155 PolarHBondContact O-N 2.7Å; I153-Q155 VanDerWaalsContact C-N 3.34Å; Q155-G157 VanDerWaalsContact C-N 3.34Å
156	F	92.8	Very high	89.2	Confident	1 Å²	1	44.3 Å²	44.3	0%	0.004	23%	0.229	C	C	.	.	H	α-helix	trans	-62.5	-45	171.7	-175.6	-107.5	0	0	0	110.8	P118 I122 L141 L145 W152 I153 G160 L164 F210	P118-F156 HydrophobicContact CB-CB 3.98Å; P118-F156 HydrophobicContact CB-CD2 4.38Å; I122-F156 HydrophobicContact CD1-CD2 4.23Å; I122-F156 HydrophobicContact CG1-CD2 4.12Å; I122-F156 HydrophobicContact CG1-CE2 3.97Å; L141-F156 HydrophobicContact CD1-CD2 4.35Å; L141-F156 HydrophobicContact CD1-CE2 3.85Å; L141-F156 HydrophobicContact CD1-CZ 4.1Å; L141-F156 HydrophobicContact CD2-CE2 4.07Å; L141-F156 HydrophobicContact CD2-CZ 3.83Å; L145-F156 HydrophobicContact CD2-CD1 4.08Å; L145-F156 HydrophobicContact CD2-CE1 4.4Å; W152-F156 HydrophobicContact CE3-CB 4.4Å; W152-F156 HydrophobicContact CH2-CD2 4.46Å; W152-F156 HydrophobicContact CZ3-CB 4.12Å; W152-F156 HydrophobicContact CZ3-CD2 4.45Å; W152-F156 HydrophobicContact CZ3-CG 4.33Å; W152-F156 PolarHBondContact O-N 2.87Å; I153-F156 PolarHBondContact O-N 2.77Å; F156-G160 VanDerWaalsContact CE1-CA 3.43Å; F156-G160 VanDerWaalsContact CZ-C 3.45Å; F156-G160 WeakPolarHBondContact CZ-O 3.14Å; F156-G160 WeakPolarHBondContact O-CA 3.49Å; F156-G160 PolarHBondContact O-N 3.12Å; F156-L164 HydrophobicContact CE1-CD1 3.85Å; F156-L164 HydrophobicContact CE1-CG 4.39Å; F156-L164 HydrophobicContact CZ-CD1 4.07Å; F156-L164 HydrophobicContact CZ-CG 4.2Å; F156-F210 AromaticContact CD1-CD2 3.89Å; F156-F210 HydrophobicContact CD1-CD2 3.89Å; F156-F210 AromaticContact CD1-CE2 3.92Å; F156-F210 HydrophobicContact CD1-CE2 3.92Å; F156-F210 HydrophobicContact CE1-CD2 4.28Å
157	G	89.3	Confident	89.2	Confident	5 Å²	5	41.6 Å²	41.6	5%	0.052	21%	0.208	C	C	.	.	H	α-helix	trans	56.9	-155.9	159.3	0	0	0	0	0	115.9	I153 Q155 Q159 G160 L161 Y215	I153-G157 PolarHBondContact O-N 2.83Å; Q155-G157 VanDerWaalsContact C-N 3.34Å; G157-Q159 VanDerWaalsContact C-N 3.32Å; G157-Q159 PolarHBondContact O-N 2.86Å; G157-G160 PolarHBondContact O-N 2.87Å; G157-L161 PolarHBondContact O-N 3.44Å; G157-Y215 WeakPolarHBondContact CA-OH 3.02Å
158	R	91.5	Very high	89.4	Confident	126 Å²	126	36.1 Å²	36.1	48%	0.475	18%	0.179	S	C	.	.	H	α-helix	trans	-67.3	-30.4	-179.3	-165.1	171.6	178.9	177.3	1.4	112.8	L161 N162	R158-L161 PolarHBondContact O-N 3.43Å; R158-N162 WeakPolarHBondContact O-CB 3.41Å; R158-N162 PolarHBondContact O-N 3.35Å; R158-N162 PolarHBondContact O-OD1 2.95Å; R158-N162 VanDerWaalsContact O-OD1 3.04Å
159	Q	91.2	Very high	89.3	Confident	136 Å²	136	35.1 Å²	35.1	64%	0.636	18%	0.176	S	C	*	.	H	α-helix	trans	-67.9	-44.2	177.7	-170.8	-179.1	8.7	0	0	111.5	I122 G157 N162 M163	I122-Q159 HydrophobicContact CD1-CB 4.2Å; I122-Q159 HydrophobicContact CD1-CG 4.23Å; I122-Q159 HydrophobicContact CG2-CG 4.03Å; G157-Q159 VanDerWaalsContact C-N 3.32Å; G157-Q159 PolarHBondContact O-N 2.86Å; Q159-N162 PolarHBondContact O-N 2.94Å; Q159-M163 PolarHBondContact O-N 2.82Å; Q159-M163 VanDerWaalsContact O-N 3.09Å
160	G	92.8	Very high	88.9	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-66.2	-40.4	173.4	0	0	0	0	0	113	F156 G157 M163 L164	F156-G160 VanDerWaalsContact CE1-CA 3.43Å; F156-G160 VanDerWaalsContact CZ-C 3.45Å; F156-G160 WeakPolarHBondContact CZ-O 3.14Å; F156-G160 WeakPolarHBondContact O-CA 3.49Å; F156-G160 PolarHBondContact O-N 3.12Å; G157-G160 PolarHBondContact O-N 2.87Å; G160-M163 WeakPolarHBondContact O-CB 3.19Å; G160-M163 PolarHBondContact O-N 2.95Å; G160-L164 PolarHBondContact O-N 2.76Å
161	L	94.8	Very high	88.3	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-59	-47.9	172.2	174.7	60.5	0	0	0	111.9	G157 R158 M163 L164 L165 L207 F210 Q219 I220 H223	G157-L161 PolarHBondContact O-N 3.44Å; R158-L161 PolarHBondContact O-N 3.43Å; L161-M163 PolarHBondContact O-N 2.54Å; L161-L164 PolarHBondContact O-N 2.66Å; L161-L164 VanDerWaalsContact O-N 3.13Å; L161-L165 HydrophobicContact CD1-CD1 3.85Å; L161-L165 HydrophobicContact CD1-CD2 4.47Å; L161-L165 HydrophobicContact CD1-CG 3.82Å; L161-L165 HydrophobicContact CD2-CD1 4.41Å; L161-L165 HydrophobicContact CG-CD1 3.89Å; L161-L165 HydrophobicContact CG-CG 4.27Å; L161-L165 PolarHBondContact O-N 2.83Å; L161-L207 HydrophobicContact CD1-CD2 3.73Å; L161-F210 HydrophobicContact CB-CE1 4.09Å; L161-F210 HydrophobicContact CB-CZ 3.97Å; L161-F210 HydrophobicContact CD1-CD1 4.21Å; L161-F210 HydrophobicContact CD1-CE1 3.97Å; L161-F210 HydrophobicContact CD2-CE1 4Å; L161-F210 HydrophobicContact CD2-CZ 4.42Å; L161-F210 HydrophobicContact CG-CE1 4.23Å; L161-Q219 HydrophobicContact CD2-CB 3.73Å; L161-I220 HydrophobicContact CD1-CD1 3.57Å; L161-I220 HydrophobicContact CD1-CG1 4.09Å; L161-I220 HydrophobicContact CD2-CD1 4.31Å; L161-I220 HydrophobicContact CD2-CG1 4.3Å; L161-H223 HydrophobicContact CD2-CB 4.47Å
162	N	92.4	Very high	87.7	Confident	75 Å²	75	38.5 Å²	38.5	40%	0.401	19%	0.187	S	C	.	.	H	α-helix	trans	-60.3	-32.8	177.3	-70.2	6.6	0	0	0	111.6	R158 Q159 G166 H223	R158-N162 WeakPolarHBondContact O-CB 3.41Å; R158-N162 PolarHBondContact O-N 3.35Å; R158-N162 PolarHBondContact O-OD1 2.95Å; R158-N162 VanDerWaalsContact O-OD1 3.04Å; Q159-N162 PolarHBondContact O-N 2.94Å; N162-G166 WeakPolarHBondContact O-CA 3.47Å; N162-G166 PolarHBondContact O-N 3.27Å; N162-H223 PolarHBondContact OD1-CD2 3.05Å; N162-H223 VanDerWaalsContact OD1-CD2 3.29Å; N162-H223 PolarHBondContact OD1-NE2 3.12Å
163	M	91	Very high	86.5	Confident	46 Å²	46	42.6 Å²	42.6	23%	0.227	21%	0.207	C	C	.	.	H	α-helix	trans	-67.5	-44.1	174.3	-167.4	59.9	58	0	0	111.9	I122 L125 Q159 G160 L161 G166 I167	I122-M163 HydrophobicContact CG2-CE 4.48Å; L125-M163 HydrophobicContact CB-CG 3.64Å; L125-M163 HydrophobicContact CB-SD 4.19Å; L125-M163 HydrophobicContact CD1-CG 4.03Å; Q159-M163 PolarHBondContact O-N 2.82Å; Q159-M163 VanDerWaalsContact O-N 3.09Å; G160-M163 WeakPolarHBondContact O-CB 3.19Å; G160-M163 PolarHBondContact O-N 2.95Å; L161-M163 PolarHBondContact O-N 2.54Å; M163-G166 PolarHBondContact O-N 3.38Å; M163-I167 HydrophobicContact CG-CD1 4.2Å; M163-I167 WeakPolarHBondContact O-CD1 3.24Å; M163-I167 VanDerWaalsContact O-CG1 3.29Å; M163-I167 WeakPolarHBondContact O-CG1 3.48Å; M163-I167 PolarHBondContact O-N 3.33Å
164	L	93.9	Very high	85.2	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-65.7	-49.4	176.1	-69.5	175.4	0	0	0	112.1	L138 L141 L145 F156 G160 L161 G166 I167 L168 C203 C206 L207	L138-L164 HydrophobicContact CD2-CD2 3.97Å; L141-L164 HydrophobicContact CD2-CD2 3.94Å; L145-L164 HydrophobicContact CD1-CD1 4.37Å; F156-L164 HydrophobicContact CE1-CD1 3.85Å; F156-L164 HydrophobicContact CE1-CG 4.39Å; F156-L164 HydrophobicContact CZ-CD1 4.07Å; F156-L164 HydrophobicContact CZ-CG 4.2Å; G160-L164 PolarHBondContact O-N 2.76Å; L161-L164 PolarHBondContact O-N 2.66Å; L161-L164 VanDerWaalsContact O-N 3.13Å; L164-G166 VanDerWaalsContact C-N 3.25Å; L164-G166 PolarHBondContact O-N 3.2Å; L164-I167 PolarHBondContact O-N 2.95Å; L164-L168 WeakPolarHBondContact O-CB 3.4Å; L164-L168 PolarHBondContact O-N 2.93Å; L164-C203 PolarHBondContact O-SG 3.39Å; L164-C203 VanDerWaalsContact O-SG 3.34Å; L164-C206 HydrophobicContact CD1-CB 3.8Å; L164-C206 HydrophobicContact CD2-CB 3.75Å; L164-C206 HydrophobicContact CG-CB 4.46Å; L164-L207 HydrophobicContact CB-CD2 3.76Å; L164-L207 HydrophobicContact CB-CG 4.41Å; L164-L207 HydrophobicContact CD1-CD2 3.98Å
165	L	91.7	Very high	83.6	Confident	7 Å²	7	46 Å²	46	4%	0.037	23%	0.231	C	C	.	.	H	α-helix	trans	-61.9	-36	175.9	-67.9	177.3	0	0	0	111.5	L161 S169 L207 I220 H223 T229	L161-L165 HydrophobicContact CD1-CD1 3.85Å; L161-L165 HydrophobicContact CD1-CD2 4.47Å; L161-L165 HydrophobicContact CD1-CG 3.82Å; L161-L165 HydrophobicContact CD2-CD1 4.41Å; L161-L165 HydrophobicContact CG-CD1 3.89Å; L161-L165 HydrophobicContact CG-CG 4.27Å; L161-L165 PolarHBondContact O-N 2.83Å; L165-S169 VanDerWaalsContact O-CB 3.26Å; L165-S169 WeakPolarHBondContact O-CB 3.35Å; L165-S169 PolarHBondContact O-N 2.72Å; L165-L207 HydrophobicContact CD2-CD1 4.1Å; L165-L207 HydrophobicContact CD2-CD2 4.25Å; L165-I220 HydrophobicContact CD2-CD1 4.43Å; L165-H223 HydrophobicContact CD1-CB 4.44Å; L165-T229 HydrophobicContact CD2-CG2 4.41Å
166	G	87.2	Confident	82.2	Confident	24 Å²	24	43.4 Å²	43.4	25%	0.247	22%	0.22	C	C	.	.	H	α-helix	trans	-58.5	-57.9	170.8	0	0	0	0	0	111.4	N162 M163 L164 L168 S169 W170	N162-G166 WeakPolarHBondContact O-CA 3.47Å; N162-G166 PolarHBondContact O-N 3.27Å; M163-G166 PolarHBondContact O-N 3.38Å; L164-G166 VanDerWaalsContact C-N 3.25Å; L164-G166 PolarHBondContact O-N 3.2Å; G166-L168 VanDerWaalsContact C-N 3.28Å; G166-L168 PolarHBondContact O-N 3.45Å; G166-S169 WeakPolarHBondContact O-CB 3.41Å; G166-S169 PolarHBondContact O-N 2.74Å; G166-S169 VanDerWaalsContact O-N 3.11Å; G166-W170 PolarHBondContact O-N 3.45Å
167	I	87.4	Confident	80.7	Confident	8 Å²	8	47.2 Å²	47.2	4%	0.041	25%	0.247	C	C	.	.	H	α-helix	trans	-54.5	-44.9	179	-70.2	161.3	0	0	0	111.2	L125 L134 M163 L164 S169 W170 T171	L125-I167 HydrophobicContact CB-CD1 4.27Å; L125-I167 HydrophobicContact CD1-CD1 4.14Å; L125-I167 HydrophobicContact CD2-CD1 3.97Å; L125-I167 HydrophobicContact CG-CD1 4.36Å; L134-I167 HydrophobicContact CD1-CD1 4.24Å; M163-I167 HydrophobicContact CG-CD1 4.2Å; M163-I167 WeakPolarHBondContact O-CD1 3.24Å; M163-I167 VanDerWaalsContact O-CG1 3.29Å; M163-I167 WeakPolarHBondContact O-CG1 3.48Å; M163-I167 PolarHBondContact O-N 3.33Å; L164-I167 PolarHBondContact O-N 2.95Å; I167-S169 PolarHBondContact O-N 2.92Å; I167-W170 PolarHBondContact O-N 3.29Å; I167-T171 PolarHBondContact O-N 3.31Å; I167-T171 PolarHBondContact O-OG1 3.07Å
168	L	87.7	Confident	79.6	Confident	0 Å²	0	52 Å²	52	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-66.9	-34.8	179.7	-171.5	61.5	0	0	0	112.9	L164 G166 T171 S172 E200 V204 L207 T229 L230 S233	L164-L168 WeakPolarHBondContact O-CB 3.4Å; L164-L168 PolarHBondContact O-N 2.93Å; G166-L168 VanDerWaalsContact C-N 3.28Å; G166-L168 PolarHBondContact O-N 3.45Å; L168-T171 WeakPolarHBondContact CA-OG1 3.38Å; L168-T171 PolarHBondContact O-N 3.46Å; L168-T171 PolarHBondContact O-OG1 3.24Å; L168-S172 WeakPolarHBondContact O-CB 3.17Å; L168-S172 PolarHBondContact O-N 3.5Å; L168-S172 PolarHBondContact O-OG 3.16Å; L168-E200 HydrophobicContact CD1-CG 3.97Å; L168-V204 HydrophobicContact CD1-CG2 3.94Å; L168-V204 HydrophobicContact CD2-CG2 4.24Å; L168-L207 HydrophobicContact CD2-CD1 3.59Å; L168-T229 HydrophobicContact CB-CG2 3.91Å; L168-T229 HydrophobicContact CD2-CG2 3.99Å; L168-T229 HydrophobicContact CG-CG2 3.88Å; L168-L230 HydrophobicContact CD2-CD2 4.2Å; L168-S233 WeakPolarHBondContact CD1-OG 3.37Å; L168-S233 VanDerWaalsContact CG-OG 3.25Å; L168-S233 WeakPolarHBondContact CG-OG 3.34Å
169	S	83.5	Confident	78.1	Confident	28 Å²	28	46.2 Å²	46.2	20%	0.196	24%	0.244	C	C	.	.	H	α-helix	trans	-68.1	-42.8	171.1	-176.1	0	0	0	0	111.7	L165 G166 I167 T171 S172 Q173	L165-S169 VanDerWaalsContact O-CB 3.26Å; L165-S169 WeakPolarHBondContact O-CB 3.35Å; L165-S169 PolarHBondContact O-N 2.72Å; G166-S169 WeakPolarHBondContact O-CB 3.41Å; G166-S169 PolarHBondContact O-N 2.74Å; G166-S169 VanDerWaalsContact O-N 3.11Å; I167-S169 PolarHBondContact O-N 2.92Å; S169-T171 VanDerWaalsContact C-N 3.29Å; S169-T171 PolarHBondContact O-N 2.89Å; S169-S172 PolarHBondContact O-N 3.02Å; S169-S172 PolarHBondContact O-OG 2.99Å; S169-Q173 VanDerWaalsContact O-CB 3.26Å; S169-Q173 WeakPolarHBondContact O-CB 3.29Å; S169-Q173 PolarHBondContact O-N 2.97Å
170	W	75.6	Confident	76.6	Confident	83 Å²	83	41.6 Å²	41.6	31%	0.314	22%	0.222	S	C	.	.	H	α-helix	trans	-64.3	-28.9	174.5	-73.8	106.9	0	0	0	113.1	G166 I167 Y174 F178	G166-W170 PolarHBondContact O-N 3.45Å; I167-W170 PolarHBondContact O-N 3.29Å; W170-Y174 HydrophobicContact CD2-CD2 4.31Å; W170-Y174 HydrophobicContact CD2-CE2 4.04Å; W170-Y174 HydrophobicContact CE3-CD1 4.26Å; W170-Y174 AromaticContact CE3-CD2 3.51Å; W170-Y174 HydrophobicContact CE3-CD2 3.51Å; W170-Y174 HydrophobicContact CE3-CE1 4.08Å; W170-Y174 AromaticContact CE3-CE2 3.31Å; W170-Y174 HydrophobicContact CE3-CE2 3.31Å; W170-Y174 AromaticContact CE3-CG 4Å; W170-Y174 HydrophobicContact CE3-CG 4Å; W170-Y174 AromaticContact CE3-CZ 3.62Å; W170-Y174 HydrophobicContact CH2-CE1 4.48Å; W170-Y174 HydrophobicContact CH2-CE2 4.27Å; W170-Y174 AromaticContact CH2-CZ 3.9Å; W170-Y174 HydrophobicContact CZ3-CD1 4.12Å; W170-Y174 HydrophobicContact CZ3-CD2 4Å; W170-Y174 AromaticContact CZ3-CE1 3.57Å; W170-Y174 HydrophobicContact CZ3-CE1 3.57Å; W170-Y174 AromaticContact CZ3-CE2 3.45Å; W170-Y174 HydrophobicContact CZ3-CE2 3.45Å; W170-Y174 VanDerWaalsContact CZ3-CE2 3.45Å; W170-Y174 HydrophobicContact CZ3-CG 4.31Å; W170-Y174 AromaticContact CZ3-CZ 3.2Å; W170-Y174 WeakPolarHBondContact CZ3-OH 3.25Å; W170-F178 HydrophobicContact CE3-CE1 4.23Å; W170-F178 AromaticContact CZ3-CE1 3.69Å; W170-F178 HydrophobicContact CZ3-CE1 3.69Å; W170-F178 HydrophobicContact CZ3-CZ 4.36Å
171	T	72.6	Confident	75.3	Confident	6 Å²	6	45.2 Å²	45.2	4%	0.037	25%	0.252	C	S	.	.	H	α-helix	trans	-82.3	-33.1	173.4	51.3	0	0	0	0	113.5	I167 L168 S169 W179 F196	I167-T171 PolarHBondContact O-N 3.31Å; I167-T171 PolarHBondContact O-OG1 3.07Å; L168-T171 WeakPolarHBondContact CA-OG1 3.38Å; L168-T171 PolarHBondContact O-N 3.46Å; L168-T171 PolarHBondContact O-OG1 3.24Å; S169-T171 VanDerWaalsContact C-N 3.29Å; S169-T171 PolarHBondContact O-N 2.89Å; T171-W179 HydrophobicContact CG2-CZ2 4.5Å; T171-F196 HydrophobicContact CG2-CD2 4.1Å; T171-F196 HydrophobicContact CG2-CE2 3.8Å; T171-F196 HydrophobicContact CG2-CZ 4.5Å; T171-F196 WeakPolarHBondContact O-CZ 3.41Å
172	S	70.5	Confident	73.9	Confident	35 Å²	35	51.1 Å²	51.1	25%	0.245	28%	0.275	C	S	.	.	H	α-helix	trans	-85.3	-35.5	-178.7	51.4	0	0	0	0	114.1	L168 S169 Q232	L168-S172 WeakPolarHBondContact O-CB 3.17Å; L168-S172 PolarHBondContact O-N 3.5Å; L168-S172 PolarHBondContact O-OG 3.16Å; S169-S172 PolarHBondContact O-N 3.02Å; S169-S172 PolarHBondContact O-OG 2.99Å; S172-Q232 WeakPolarHBondContact CB-O 3.24Å
173	Q	64.7	Low	72.5	Confident	104 Å²	104	48.3 Å²	48.3	49%	0.486	26%	0.258	S	S	.	.	H	α-helix	trans	-89.1	-29.7	-172.1	-166.7	179.3	22.9	0	0	114.2	S169	S169-Q173 VanDerWaalsContact O-CB 3.26Å; S169-Q173 WeakPolarHBondContact O-CB 3.29Å; S169-Q173 PolarHBondContact O-N 2.97Å
174	Y	60.8	Low	71.1	Confident	81 Å²	81	46.5 Å²	46.5	32%	0.318	25%	0.25	S	S	.	.	S	Bend	trans	-97.2	136.5	-170.9	-72.5	-98.9	0	0	0	112.4	W170 I176 F178	W170-Y174 HydrophobicContact CD2-CD2 4.31Å; W170-Y174 HydrophobicContact CD2-CE2 4.04Å; W170-Y174 HydrophobicContact CE3-CD1 4.26Å; W170-Y174 AromaticContact CE3-CD2 3.51Å; W170-Y174 HydrophobicContact CE3-CD2 3.51Å; W170-Y174 HydrophobicContact CE3-CE1 4.08Å; W170-Y174 AromaticContact CE3-CE2 3.31Å; W170-Y174 HydrophobicContact CE3-CE2 3.31Å; W170-Y174 AromaticContact CE3-CG 4Å; W170-Y174 HydrophobicContact CE3-CG 4Å; W170-Y174 AromaticContact CE3-CZ 3.62Å; W170-Y174 HydrophobicContact CH2-CE1 4.48Å; W170-Y174 HydrophobicContact CH2-CE2 4.27Å; W170-Y174 AromaticContact CH2-CZ 3.9Å; W170-Y174 HydrophobicContact CZ3-CD1 4.12Å; W170-Y174 HydrophobicContact CZ3-CD2 4Å; W170-Y174 AromaticContact CZ3-CE1 3.57Å; W170-Y174 HydrophobicContact CZ3-CE1 3.57Å; W170-Y174 AromaticContact CZ3-CE2 3.45Å; W170-Y174 HydrophobicContact CZ3-CE2 3.45Å; W170-Y174 VanDerWaalsContact CZ3-CE2 3.45Å; W170-Y174 HydrophobicContact CZ3-CG 4.31Å; W170-Y174 AromaticContact CZ3-CZ 3.2Å; W170-Y174 WeakPolarHBondContact CZ3-OH 3.25Å; Y174-I176 PolarHBondContact O-N 3.43Å; Y174-F178 HydrophobicContact CD1-CB 4.29Å; Y174-F178 AromaticContact CD1-CD1 3.43Å; Y174-F178 HydrophobicContact CD1-CD1 3.43Å; Y174-F178 VanDerWaalsContact CD1-CD1 3.43Å; Y174-F178 HydrophobicContact CD1-CD2 4.49Å; Y174-F178 AromaticContact CD1-CE1 3.83Å; Y174-F178 HydrophobicContact CD1-CE1 3.83Å; Y174-F178 AromaticContact CD1-CG 3.82Å; Y174-F178 HydrophobicContact CD1-CG 3.82Å; Y174-F178 HydrophobicContact CD1-CZ 4.49Å; Y174-F178 HydrophobicContact CE1-CD1 4.09Å; Y174-F178 HydrophobicContact CE1-CE1 4Å; Y174-F178 HydrophobicContact CE1-CZ 4.38Å; Y174-F178 HydrophobicContact CG-CD1 4.06Å
175	S	55	Low	69.4	Low	82 Å²	82	51.4 Å²	51.4	57%	0.573	28%	0.282	S	S	*	.			trans	-54.5	140.8	171.2	-177.6	0	0	0	0	110.9	S177 F178 W179	S175-S177 PolarHBondContact O-N 3.39Å; S175-S177 PolarHBondContact OG-OG 3.12Å; S175-F178 PolarHBondContact O-N 3.41Å; S175-W179 PolarHBondContact O-N 3.34Å
176	I	60.7	Low	67.8	Low	64 Å²	64	57.4 Å²	57.4	33%	0.328	32%	0.319	S	S	.	.	H	α-helix	trans	-50.9	-26.2	-178.8	-65.2	169.8	0	0	0	112.1	Y174 K180 F196	Y174-I176 PolarHBondContact O-N 3.43Å; I176-K180 HydrophobicContact CG2-CD 3.82Å; I176-K180 HydrophobicContact CG2-CG 4.36Å; I176-K180 VanDerWaalsContact O-CB 3.25Å; I176-K180 WeakPolarHBondContact O-CB 3.47Å; I176-K180 WeakPolarHBondContact O-CD 3.22Å; I176-K180 WeakPolarHBondContact O-CG 3.3Å; I176-K180 PolarHBondContact O-N 3.46Å; I176-K180 VanDerWaalsContact O-N 3.07Å; I176-F196 HydrophobicContact CG1-CE1 4.18Å; I176-F196 HydrophobicContact CG1-CZ 4.41Å
177	S	61.2	Low	66.2	Low	81 Å²	81	58.3 Å²	58.3	57%	0.566	32%	0.32	S	S	*	.	H	α-helix	trans	-64.5	-44.4	173.2	53.3	0	0	0	0	113.8	S175 K180 A181	S175-S177 PolarHBondContact O-N 3.39Å; S175-S177 PolarHBondContact OG-OG 3.12Å; S177-K180 PolarHBondContact O-N 2.87Å; S177-A181 PolarHBondContact O-N 3Å
178	F	64.6	Low	64.8	Low	105 Å²	105	62.2 Å²	62.2	46%	0.461	35%	0.348	S	S	.	.	H	α-helix	trans	-70.8	-43.5	-178.4	-173.4	-86.2	0	0	0	111.3	W170 Y174 S175 K180 A181 R182	W170-F178 HydrophobicContact CE3-CE1 4.23Å; W170-F178 AromaticContact CZ3-CE1 3.69Å; W170-F178 HydrophobicContact CZ3-CE1 3.69Å; W170-F178 HydrophobicContact CZ3-CZ 4.36Å; Y174-F178 HydrophobicContact CD1-CB 4.29Å; Y174-F178 AromaticContact CD1-CD1 3.43Å; Y174-F178 HydrophobicContact CD1-CD1 3.43Å; Y174-F178 VanDerWaalsContact CD1-CD1 3.43Å; Y174-F178 HydrophobicContact CD1-CD2 4.49Å; Y174-F178 AromaticContact CD1-CE1 3.83Å; Y174-F178 HydrophobicContact CD1-CE1 3.83Å; Y174-F178 AromaticContact CD1-CG 3.82Å; Y174-F178 HydrophobicContact CD1-CG 3.82Å; Y174-F178 HydrophobicContact CD1-CZ 4.49Å; Y174-F178 HydrophobicContact CE1-CD1 4.09Å; Y174-F178 HydrophobicContact CE1-CE1 4Å; Y174-F178 HydrophobicContact CE1-CZ 4.38Å; Y174-F178 HydrophobicContact CG-CD1 4.06Å; S175-F178 PolarHBondContact O-N 3.41Å; F178-K180 VanDerWaalsContact C-N 3.33Å; F178-K180 PolarHBondContact O-N 2.67Å; F178-A181 WeakPolarHBondContact O-CB 3.29Å; F178-A181 PolarHBondContact O-N 3.3Å; F178-R182 PolarHBondContact O-N 3.15Å
179	W	60.4	Low	63.2	Low	5 Å²	5	71.5 Å²	71.5	2%	0.019	38%	0.383	C	S	.	.	H	α-helix	trans	-63.6	-39.6	175.7	-163.1	98.8	0	0	0	111.7	A131 L134 T171 S175 A181 R182 Y183 F196	A131-W179 HydrophobicContact CB-CH2 3.57Å; A131-W179 HydrophobicContact CB-CZ3 3.78Å; L134-W179 HydrophobicContact CD2-CZ2 3.89Å; T171-W179 HydrophobicContact CG2-CZ2 4.5Å; S175-W179 PolarHBondContact O-N 3.34Å; W179-A181 PolarHBondContact O-N 2.84Å; W179-R182 PolarHBondContact O-N 2.67Å; W179-Y183 AromaticContact CD1-CD2 3.82Å; W179-Y183 AromaticContact CD1-CE2 3.89Å; W179-Y183 AromaticContact CD2-CD2 3.66Å; W179-Y183 HydrophobicContact CD2-CD2 3.66Å; W179-Y183 HydrophobicContact CD2-CE2 4.45Å; W179-Y183 HydrophobicContact CD2-CG 4.3Å; W179-Y183 AromaticContact CE2-CD2 3.51Å; W179-Y183 HydrophobicContact CE3-CD2 4.31Å; W179-Y183 AromaticContact CG-CD2 3.89Å; W179-Y183 HydrophobicContact CG-CD2 3.89Å; W179-Y183 HydrophobicContact CG-CE2 4.39Å; W179-Y183 HydrophobicContact CZ2-CD2 4.1Å; W179-Y183 HydrophobicContact CZ2-CG 4.21Å; W179-Y183 AromaticContact NE1-CD2 3.55Å; W179-Y183 AromaticContact NE1-CE2 3.61Å; W179-Y183 PolarHBondContact O-N 2.87Å; W179-F196 HydrophobicContact CB-CD2 4.4Å; W179-F196 HydrophobicContact CB-CE2 3.98Å; W179-F196 AromaticContact CD1-CE2 3.8Å; W179-F196 AromaticContact CD2-CD2 3.41Å; W179-F196 HydrophobicContact CD2-CD2 3.41Å; W179-F196 VanDerWaalsContact CD2-CD2 3.41Å; W179-F196 AromaticContact CD2-CE2 3.77Å; W179-F196 HydrophobicContact CD2-CE2 3.77Å; W179-F196 AromaticContact CE2-CD2 3.61Å; W179-F196 HydrophobicContact CE3-CB 4.34Å; W179-F196 AromaticContact CE3-CD2 3.58Å; W179-F196 HydrophobicContact CE3-CD2 3.58Å; W179-F196 HydrophobicContact CE3-CE2 4.31Å; W179-F196 HydrophobicContact CE3-CG 4.41Å; W179-F196 AromaticContact CG-CD2 3.79Å; W179-F196 HydrophobicContact CG-CD2 3.79Å; W179-F196 AromaticContact CG-CE2 3.6Å; W179-F196 HydrophobicContact CG-CE2 3.6Å; W179-F196 HydrophobicContact CH2-CB 4.21Å; W179-F196 HydrophobicContact CH2-CD2 4.08Å; W179-F196 AromaticContact CZ2-CD2 3.94Å; W179-F196 HydrophobicContact CZ2-CD2 3.94Å; W179-F196 HydrophobicContact CZ3-CB 3.97Å; W179-F196 AromaticContact CZ3-CD2 3.92Å; W179-F196 HydrophobicContact CZ3-CD2 3.92Å; W179-F196 HydrophobicContact CZ3-CG 4.46Å
180	K	59.8	Low	62.1	Low	40 Å²	40	75.6 Å²	75.6	17%	0.174	40%	0.402	C	S	.	.	H	α-helix	trans	-62.2	-39.5	172.6	-79.6	173.8	176.5	169.1	0	112.8	I176 S177 F178 R182 C184 R189	I176-K180 HydrophobicContact CG2-CD 3.82Å; I176-K180 HydrophobicContact CG2-CG 4.36Å; I176-K180 VanDerWaalsContact O-CB 3.25Å; I176-K180 WeakPolarHBondContact O-CB 3.47Å; I176-K180 WeakPolarHBondContact O-CD 3.22Å; I176-K180 WeakPolarHBondContact O-CG 3.3Å; I176-K180 PolarHBondContact O-N 3.46Å; I176-K180 VanDerWaalsContact O-N 3.07Å; S177-K180 PolarHBondContact O-N 2.87Å; F178-K180 VanDerWaalsContact C-N 3.33Å; F178-K180 PolarHBondContact O-N 2.67Å; K180-R182 VanDerWaalsContact C-N 3.26Å; K180-R182 PolarHBondContact O-N 3.31Å; K180-C184 HydrophobicContact CB-CB 4.42Å; K180-C184 HydrophobicContact CG-CB 4.28Å; K180-C184 CarbonylContact O-C 3.43Å; K180-C184 VanDerWaalsContact O-CA 3.3Å; K180-C184 WeakPolarHBondContact O-CA 3.18Å; K180-C184 PolarHBondContact O-N 3.4Å; K180-R189 PolarHBondContact NZ-O 3.31Å
181	A	65.1	Low	61.6	Low	76 Å²	76	76.2 Å²	76.2	63%	0.628	41%	0.412	S	S	*	.	H	α-helix	trans	-62.1	-32.3	176	0	0	0	0	0	113	S177 F178 W179	S177-A181 PolarHBondContact O-N 3Å; F178-A181 WeakPolarHBondContact O-CB 3.29Å; F178-A181 PolarHBondContact O-N 3.3Å; W179-A181 PolarHBondContact O-N 2.84Å
182	R	66.1	Low	61.3	Low	124 Å²	124	76 Å²	76	47%	0.468	41%	0.411	S	S	.	.	H	α-helix	trans	-86	-41.7	179.4	-174.4	170.9	-178.7	163.3	2.6	114.6	F178 W179 K180	F178-R182 PolarHBondContact O-N 3.15Å; W179-R182 PolarHBondContact O-N 2.67Å; K180-R182 VanDerWaalsContact C-N 3.26Å; K180-R182 PolarHBondContact O-N 3.31Å
183	Y	62.5	Low	61.3	Low	15 Å²	15	78 Å²	78	6%	0.059	42%	0.416	C	S	.	.	H	α-helix	trans	-115.2	-9.4	-169.4	-62.8	-82.5	0	0	0	114.9	V128 E129 N130 A131 L134 W179	V128-Y183 WeakPolarHBondContact O-CD1 3.26Å; V128-Y183 WeakPolarHBondContact O-CE1 3.45Å; E129-Y183 WeakPolarHBondContact O-CA 3.12Å; N130-Y183 WeakPolarHBondContact CA-O 2.87Å; A131-Y183 PolarHBondContact N-O 2.83Å; L134-Y183 HydrophobicContact CD2-CD1 4.3Å; L134-Y183 HydrophobicContact CD2-CE1 4.22Å; W179-Y183 AromaticContact CD1-CD2 3.82Å; W179-Y183 AromaticContact CD1-CE2 3.89Å; W179-Y183 AromaticContact CD2-CD2 3.66Å; W179-Y183 HydrophobicContact CD2-CD2 3.66Å; W179-Y183 HydrophobicContact CD2-CE2 4.45Å; W179-Y183 HydrophobicContact CD2-CG 4.3Å; W179-Y183 AromaticContact CE2-CD2 3.51Å; W179-Y183 HydrophobicContact CE3-CD2 4.31Å; W179-Y183 AromaticContact CG-CD2 3.89Å; W179-Y183 HydrophobicContact CG-CD2 3.89Å; W179-Y183 HydrophobicContact CG-CE2 4.39Å; W179-Y183 HydrophobicContact CZ2-CD2 4.1Å; W179-Y183 HydrophobicContact CZ2-CG 4.21Å; W179-Y183 AromaticContact NE1-CD2 3.55Å; W179-Y183 AromaticContact NE1-CE2 3.61Å; W179-Y183 PolarHBondContact O-N 2.87Å
184	C	62.5	Low	61.8	Low	9 Å²	9	77.6 Å²	77.6	6%	0.061	42%	0.417	C	S	.	.			trans	-144.7	45.5	-173.2	-82.7	0	0	0	0	114.2	A131 K180 T186 V187	A131-C184 WeakPolarHBondContact CB-SG 3.46Å; K180-C184 HydrophobicContact CB-CB 4.42Å; K180-C184 HydrophobicContact CG-CB 4.28Å; K180-C184 CarbonylContact O-C 3.43Å; K180-C184 VanDerWaalsContact O-CA 3.3Å; K180-C184 WeakPolarHBondContact O-CA 3.18Å; K180-C184 PolarHBondContact O-N 3.4Å; C184-T186 PolarHBondContact O-N 3.49Å; C184-V187 HydrophobicContact CB-CB 3.93Å; C184-V187 HydrophobicContact CB-CG2 3.97Å; C184-V187 PolarHBondContact O-N 3.26Å
185	P	57.8	Low	62.6	Low	103 Å²	103	74.3 Å²	74.3	67%	0.669	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-18.9	-175.3	26	-35.9	0	0	0	114.6
186	T	57.9	Low	63.6	Low	133 Å²	133	71.1 Å²	71.1	82%	0.816	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119	3.7	-176.1	52.6	0	0	0	0	114.5	C184	C184-T186 PolarHBondContact O-N 3.49Å
187	V	54.2	Low	64.7	Low	43 Å²	43	70.2 Å²	70.2	26%	0.261	38%	0.375	S	S	.	.	S	Bend	trans	-94.7	138.2	-169.8	-176.7	0	0	0	0	112.2	C184 N191	C184-V187 HydrophobicContact CB-CB 3.93Å; C184-V187 HydrophobicContact CB-CG2 3.97Å; C184-V187 PolarHBondContact O-N 3.26Å; V187-N191 HydrophobicContact CG1-CB 4.15Å
188	S	57.2	Low	65.9	Low	90 Å²	90	70.2 Å²	70.2	63%	0.629	37%	0.367	S	S	*	.			trans	-56.5	142.8	177.4	-178.8	0	0	0	0	112.9	N190 N191 G192	S188-N190 PolarHBondContact O-N 3.11Å; S188-N191 PolarHBondContact O-N 2.86Å; S188-N191 VanDerWaalsContact O-N 3.12Å; S188-G192 PolarHBondContact O-N 3.02Å
189	R	55.6	Low	67	Low	195 Å²	195	65.2 Å²	65.2	74%	0.736	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.6	-37	-165.2	-160.6	176.7	83.7	168.2	6.4	114.1	K180	K180-R189 PolarHBondContact NZ-O 3.31Å
190	N	59.2	Low	68.2	Low	113 Å²	113	65.5 Å²	65.5	60%	0.604	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-45.4	-178.4	-63.6	11.9	0	0	0	111.8	S188 G192 Q193 L194	S188-N190 PolarHBondContact O-N 3.11Å; N190-G192 PolarHBondContact O-N 2.97Å; N190-Q193 WeakPolarHBondContact O-CB 3.3Å; N190-Q193 PolarHBondContact O-N 3.3Å; N190-Q193 VanDerWaalsContact O-N 3.07Å; N190-L194 PolarHBondContact O-N 3.45Å
191	N	65.2	Low	69.7	Low	96 Å²	96	65 Å²	65	51%	0.513	34%	0.344	S	S	.	.	H	α-helix	trans	-63.1	-43	-175.5	-133	54.6	0	0	0	111.3	V187 S188 Q193 L194 V195	V187-N191 HydrophobicContact CG1-CB 4.15Å; S188-N191 PolarHBondContact O-N 2.86Å; S188-N191 VanDerWaalsContact O-N 3.12Å; N191-Q193 PolarHBondContact O-N 3.15Å; N191-L194 PolarHBondContact O-N 3.2Å; N191-V195 WeakPolarHBondContact O-CG2 3.44Å; N191-V195 PolarHBondContact O-N 3.3Å
192	G	67	Low	71.1	Confident	1 Å²	1	61.6 Å²	61.6	1%	0.01	32%	0.316	C	S	.	.	H	α-helix	trans	-64.6	-19.2	176.6	0	0	0	0	0	114.5	S188 N190 F196	S188-G192 PolarHBondContact O-N 3.02Å; N190-G192 PolarHBondContact O-N 2.97Å; G192-F196 VanDerWaalsContact O-CB 3.25Å; G192-F196 WeakPolarHBondContact O-CB 3.22Å; G192-F196 PolarHBondContact O-N 2.99Å
193	Q	69.5	Low	72.4	Confident	78 Å²	78	55.7 Å²	55.7	36%	0.364	29%	0.293	S	S	.	.	H	α-helix	trans	-80.7	-39.3	173.8	-176.6	170.3	-12.9	0	0	111.8	N190 N191 F196 Q197	N190-Q193 WeakPolarHBondContact O-CB 3.3Å; N190-Q193 PolarHBondContact O-N 3.3Å; N190-Q193 VanDerWaalsContact O-N 3.07Å; N191-Q193 PolarHBondContact O-N 3.15Å; Q193-F196 WeakPolarHBondContact O-CB 3.22Å; Q193-F196 PolarHBondContact O-N 3.14Å; Q193-Q197 WeakPolarHBondContact O-CG 3.15Å; Q193-Q197 PolarHBondContact O-N 2.98Å
194	L	75	Confident	73.9	Confident	95 Å²	95	55 Å²	55	50%	0.497	29%	0.291	S	S	.	.	H	α-helix	trans	-66.1	-42.6	174.2	-70.5	171.3	0	0	0	111.8	N190 N191 F196 Q197 Q198	N190-L194 PolarHBondContact O-N 3.45Å; N191-L194 PolarHBondContact O-N 3.2Å; L194-F196 VanDerWaalsContact C-N 3.31Å; L194-F196 PolarHBondContact O-N 3.48Å; L194-Q197 PolarHBondContact O-N 3.03Å; L194-Q198 WeakPolarHBondContact O-CB 3.3Å; L194-Q198 VanDerWaalsContact O-CG 3.25Å; L194-Q198 WeakPolarHBondContact O-CG 3.28Å; L194-Q198 PolarHBondContact O-N 3.18Å
195	V	79	Confident	75.4	Confident	12 Å²	12	56.8 Å²	56.8	7%	0.073	30%	0.297	C	S	.	.	H	α-helix	trans	-64.4	-36.6	176.8	177.4	0	0	0	0	111.4	A131 L135 N191 S199	A131-V195 HydrophobicContact CB-CG1 3.66Å; L135-V195 HydrophobicContact CB-CG1 4.35Å; L135-V195 HydrophobicContact CD2-CG1 3.98Å; N191-V195 WeakPolarHBondContact O-CG2 3.44Å; N191-V195 PolarHBondContact O-N 3.3Å; V195-S199 WeakPolarHBondContact O-CB 3.43Å; V195-S199 PolarHBondContact O-N 2.9Å; V195-S199 PolarHBondContact O-OG 3.19Å
196	F	76.2	Confident	77.3	Confident	16 Å²	16	51.9 Å²	51.9	7%	0.07	27%	0.265	C	S	.	.	H	α-helix	trans	-61.4	-55.6	173.6	173.8	-102.4	0	0	0	112.2	T171 I176 W179 G192 Q193 L194 Q198 S199 E200	T171-F196 HydrophobicContact CG2-CD2 4.1Å; T171-F196 HydrophobicContact CG2-CE2 3.8Å; T171-F196 HydrophobicContact CG2-CZ 4.5Å; T171-F196 WeakPolarHBondContact O-CZ 3.41Å; I176-F196 HydrophobicContact CG1-CE1 4.18Å; I176-F196 HydrophobicContact CG1-CZ 4.41Å; W179-F196 HydrophobicContact CB-CD2 4.4Å; W179-F196 HydrophobicContact CB-CE2 3.98Å; W179-F196 AromaticContact CD1-CE2 3.8Å; W179-F196 AromaticContact CD2-CD2 3.41Å; W179-F196 HydrophobicContact CD2-CD2 3.41Å; W179-F196 VanDerWaalsContact CD2-CD2 3.41Å; W179-F196 AromaticContact CD2-CE2 3.77Å; W179-F196 HydrophobicContact CD2-CE2 3.77Å; W179-F196 AromaticContact CE2-CD2 3.61Å; W179-F196 HydrophobicContact CE3-CB 4.34Å; W179-F196 AromaticContact CE3-CD2 3.58Å; W179-F196 HydrophobicContact CE3-CD2 3.58Å; W179-F196 HydrophobicContact CE3-CE2 4.31Å; W179-F196 HydrophobicContact CE3-CG 4.41Å; W179-F196 AromaticContact CG-CD2 3.79Å; W179-F196 HydrophobicContact CG-CD2 3.79Å; W179-F196 AromaticContact CG-CE2 3.6Å; W179-F196 HydrophobicContact CG-CE2 3.6Å; W179-F196 HydrophobicContact CH2-CB 4.21Å; W179-F196 HydrophobicContact CH2-CD2 4.08Å; W179-F196 AromaticContact CZ2-CD2 3.94Å; W179-F196 HydrophobicContact CZ2-CD2 3.94Å; W179-F196 HydrophobicContact CZ3-CB 3.97Å; W179-F196 AromaticContact CZ3-CD2 3.92Å; W179-F196 HydrophobicContact CZ3-CD2 3.92Å; W179-F196 HydrophobicContact CZ3-CG 4.46Å; G192-F196 VanDerWaalsContact O-CB 3.25Å; G192-F196 WeakPolarHBondContact O-CB 3.22Å; G192-F196 PolarHBondContact O-N 2.99Å; Q193-F196 WeakPolarHBondContact O-CB 3.22Å; Q193-F196 PolarHBondContact O-N 3.14Å; L194-F196 VanDerWaalsContact C-N 3.31Å; L194-F196 PolarHBondContact O-N 3.48Å; F196-Q198 VanDerWaalsContact C-N 3.28Å; F196-Q198 PolarHBondContact O-N 3.42Å; F196-S199 WeakPolarHBondContact O-CB 3.45Å; F196-S199 PolarHBondContact O-N 3.38Å; F196-E200 PolarHBondContact O-N 3.38Å
197	Q	82.3	Confident	79.1	Confident	44 Å²	44	45.5 Å²	45.5	21%	0.206	23%	0.226	C	C	.	.	H	α-helix	trans	-61.5	-35.2	178.6	-67.2	172.4	-49.2	0	0	112.2	Q193 L194 H201 V238	Q193-Q197 WeakPolarHBondContact O-CG 3.15Å; Q193-Q197 PolarHBondContact O-N 2.98Å; L194-Q197 PolarHBondContact O-N 3.03Å; Q197-H201 PolarHBondContact O-N 2.91Å; Q197-V238 HydrophobicContact CB-CG2 4.22Å; Q197-V238 HydrophobicContact CG-CG2 3.83Å; Q197-V238 VanDerWaalsContact NE2-CG2 3.32Å
198	Q	87.3	Confident	81	Confident	82 Å²	82	47.3 Å²	47.3	38%	0.383	23%	0.229	S	C	.	.	H	α-helix	trans	-68.9	-35.5	172.8	-73.3	179.4	29.3	0	0	112.6	L135 L194 F196 E202	L135-Q198 HydrophobicContact CD1-CB 3.94Å; L135-Q198 HydrophobicContact CD2-CB 3.9Å; L194-Q198 WeakPolarHBondContact O-CB 3.3Å; L194-Q198 VanDerWaalsContact O-CG 3.25Å; L194-Q198 WeakPolarHBondContact O-CG 3.28Å; L194-Q198 PolarHBondContact O-N 3.18Å; F196-Q198 VanDerWaalsContact C-N 3.28Å; F196-Q198 PolarHBondContact O-N 3.42Å; Q198-E202 VanDerWaalsContact O-CB 3.24Å; Q198-E202 WeakPolarHBondContact O-CB 3.3Å; Q198-E202 PolarHBondContact O-N 3.31Å
199	S	86.4	Confident	82.6	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-69.7	-40.8	177.3	-58.4	0	0	0	0	111.5	V195 F196 E202 C203	V195-S199 WeakPolarHBondContact O-CB 3.43Å; V195-S199 PolarHBondContact O-N 2.9Å; V195-S199 PolarHBondContact O-OG 3.19Å; F196-S199 WeakPolarHBondContact O-CB 3.45Å; F196-S199 PolarHBondContact O-N 3.38Å; S199-E202 PolarHBondContact O-N 3.14Å; S199-C203 VanDerWaalsContact O-CB 3.3Å; S199-C203 WeakPolarHBondContact O-CB 3.45Å; S199-C203 PolarHBondContact O-N 3.45Å
200	E	87.1	Confident	84.5	Confident	11 Å²	11	34.2 Å²	34.2	5%	0.051	17%	0.168	C	C	.	.	H	α-helix	trans	-58.9	-53.1	171.9	-174.2	-172.7	-170.8	0	0	111.1	L168 F196 E202 C203 V204 T241	L168-E200 HydrophobicContact CD1-CG 3.97Å; F196-E200 PolarHBondContact O-N 3.38Å; E200-E202 VanDerWaalsContact C-N 3.3Å; E200-E202 PolarHBondContact O-N 3.29Å; E200-C203 WeakPolarHBondContact O-CB 3.17Å; E200-C203 PolarHBondContact O-N 3.08Å; E200-V204 WeakPolarHBondContact O-CG2 3.4Å; E200-V204 PolarHBondContact O-N 2.78Å; E200-T241 HydrophobicContact CG-CG2 4.2Å
201	H	91.6	Very high	86	Confident	29 Å²	29	28.9 Å²	28.9	13%	0.134	14%	0.139	C	C	.	.	H	α-helix	trans	-61.5	-38.3	179	-166.7	-156.3	0	0	0	112.6	Q197 V204 K205 S240 T241 D244	Q197-H201 PolarHBondContact O-N 2.91Å; H201-V204 PolarHBondContact O-N 3.18Å; H201-K205 VanDerWaalsContact CD2-CE 3.41Å; H201-K205 WeakPolarHBondContact CD2-CE 3.43Å; H201-K205 WeakPolarHBondContact CE1-CE 3.49Å; H201-K205 PolarHBondContact CE1-NZ 3.25Å; H201-K205 VanDerWaalsContact CG-CE 3.41Å; H201-K205 WeakPolarHBondContact ND1-CE 3.36Å; H201-K205 PolarHBondContact ND1-NZ 3.35Å; H201-K205 VanDerWaalsContact NE2-CE 3.26Å; H201-K205 WeakPolarHBondContact NE2-CE 2.85Å; H201-K205 WeakPolarHBondContact O-CE 3.41Å; H201-K205 WeakPolarHBondContact O-CG 3.5Å; H201-K205 PolarHBondContact O-N 2.86Å; H201-K205 VanDerWaalsContact O-N 3.11Å; H201-S240 PolarHBondContact NE2-O 3.22Å; H201-T241 VanDerWaalsContact CB-OG1 3.26Å; H201-T241 WeakPolarHBondContact CB-OG1 3.32Å; H201-D244 IonicContact CD2-OD2 2.64Å; H201-D244 IonicContact CE1-OD2 3.23Å; H201-D244 IonicContact NE2-OD2 2.69Å; H201-D244 PolarHBondContact NE2-OD2 3.31Å
202	E	92.9	Very high	87.2	Confident	5 Å²	5	25.7 Å²	25.7	2%	0.023	12%	0.122	C	C	.	.	H	α-helix	trans	-70.7	-35.4	178.1	-155.4	71.2	177.4	0	0	112.1	L135 L138 R139 R142 Q198 S199 E200 K205 C206	L135-E202 HydrophobicContact CD1-CB 4.3Å; L138-E202 HydrophobicContact CB-CB 4.23Å; L138-E202 HydrophobicContact CB-CG 4.01Å; R139-E202 HydrophobicContact CG-CG 3.9Å; R139-E202 WeakPolarHBondContact CG-OE1 3.48Å; R142-E202 WeakPolarHBondContact CD-OE1 3.28Å; R142-E202 IonicContact CZ-OE1 2.79Å; R142-E202 VanDerWaalsContact CZ-OE1 3.23Å; R142-E202 IonicContact NE-OE1 2.73Å; R142-E202 PolarHBondContact NE-OE1 2.97Å; R142-E202 IonicContact NH1-OE1 3.5Å; R142-E202 PolarHBondContact NH1-OE1 3.43Å; R142-E202 IonicContact NH1-OE2 3.4Å; Q198-E202 VanDerWaalsContact O-CB 3.24Å; Q198-E202 WeakPolarHBondContact O-CB 3.3Å; Q198-E202 PolarHBondContact O-N 3.31Å; S199-E202 PolarHBondContact O-N 3.14Å; E200-E202 VanDerWaalsContact C-N 3.3Å; E200-E202 PolarHBondContact O-N 3.29Å; E202-K205 WeakPolarHBondContact O-CB 3.35Å; E202-K205 PolarHBondContact O-N 3.45Å; E202-K205 WeakPolarHBondContact OE2-CD 3.16Å; E202-K205 IonicContact OE2-NZ 2.96Å; E202-K205 PolarHBondContact OE2-NZ 3.14Å; E202-C206 PolarHBondContact O-N 3.12Å; E202-C206 PolarHBondContact O-SG 3.36Å
203	C	93.1	Very high	88.2	Confident	0 Å²	0	25.6 Å²	25.6	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-63.1	-41.9	172.8	-167	0	0	0	0	111.6	L138 L164 S199 E200 K205 C206 L207	L138-C203 HydrophobicContact CD1-CB 4.42Å; L164-C203 PolarHBondContact O-SG 3.39Å; L164-C203 VanDerWaalsContact O-SG 3.34Å; S199-C203 VanDerWaalsContact O-CB 3.3Å; S199-C203 WeakPolarHBondContact O-CB 3.45Å; S199-C203 PolarHBondContact O-N 3.45Å; E200-C203 WeakPolarHBondContact O-CB 3.17Å; E200-C203 PolarHBondContact O-N 3.08Å; C203-K205 VanDerWaalsContact C-N 3.31Å; C203-K205 PolarHBondContact O-N 3.41Å; C203-C206 WeakPolarHBondContact O-CB 3.27Å; C203-C206 PolarHBondContact O-N 3.03Å; C203-C206 VanDerWaalsContact O-N 3.14Å; C203-L207 PolarHBondContact O-N 3.19Å
204	V	94.3	Very high	88.9	Confident	0 Å²	0	22.5 Å²	22.5	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-60.9	-38.2	172.8	173.8	0	0	0	0	111.6	L168 E200 H201 L207 R208 T241 D244 V245 L248	L168-V204 HydrophobicContact CD1-CG2 3.94Å; L168-V204 HydrophobicContact CD2-CG2 4.24Å; E200-V204 WeakPolarHBondContact O-CG2 3.4Å; E200-V204 PolarHBondContact O-N 2.78Å; H201-V204 PolarHBondContact O-N 3.18Å; V204-L207 PolarHBondContact O-N 3.16Å; V204-R208 PolarHBondContact O-N 3.08Å; V204-T241 HydrophobicContact CG2-CG2 3.99Å; V204-D244 HydrophobicContact CG1-CB 3.73Å; V204-V245 HydrophobicContact CB-CG2 4.47Å; V204-V245 HydrophobicContact CG1-CG2 3.85Å; V204-V245 HydrophobicContact CG2-CG2 3.74Å; V204-L248 HydrophobicContact CG1-CD1 3.86Å
205	K	95.3	Very high	89.6	Confident	46 Å²	46	20.8 Å²	20.8	20%	0.2	10%	0.095	C	C	.	.	H	α-helix	trans	-68.8	-35.2	173.1	-67	166.7	-140.8	153.2	0	113.1	R142 H201 E202 C203 L207 R208 A209	R142-K205 HydrophobicContact CG-CB 3.97Å; H201-K205 VanDerWaalsContact CD2-CE 3.41Å; H201-K205 WeakPolarHBondContact CD2-CE 3.43Å; H201-K205 WeakPolarHBondContact CE1-CE 3.49Å; H201-K205 PolarHBondContact CE1-NZ 3.25Å; H201-K205 VanDerWaalsContact CG-CE 3.41Å; H201-K205 WeakPolarHBondContact ND1-CE 3.36Å; H201-K205 PolarHBondContact ND1-NZ 3.35Å; H201-K205 VanDerWaalsContact NE2-CE 3.26Å; H201-K205 WeakPolarHBondContact NE2-CE 2.85Å; H201-K205 WeakPolarHBondContact O-CE 3.41Å; H201-K205 WeakPolarHBondContact O-CG 3.5Å; H201-K205 PolarHBondContact O-N 2.86Å; H201-K205 VanDerWaalsContact O-N 3.11Å; E202-K205 WeakPolarHBondContact O-CB 3.35Å; E202-K205 PolarHBondContact O-N 3.45Å; E202-K205 WeakPolarHBondContact OE2-CD 3.16Å; E202-K205 IonicContact OE2-NZ 2.96Å; E202-K205 PolarHBondContact OE2-NZ 3.14Å; C203-K205 VanDerWaalsContact C-N 3.31Å; C203-K205 PolarHBondContact O-N 3.41Å; K205-L207 VanDerWaalsContact C-N 3.32Å; K205-R208 PolarHBondContact O-N 2.86Å; K205-A209 WeakPolarHBondContact O-CB 3.21Å; K205-A209 PolarHBondContact O-N 3.13Å
206	C	96.1	Very high	90.1	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-60.3	-43.4	170.2	-64.6	0	0	0	0	110.6	L138 L145 L164 E202 C203 A209 F210	L138-C206 PolarHBondContact O-SG 3.33Å; L145-C206 HydrophobicContact CD1-CB 3.9Å; L164-C206 HydrophobicContact CD1-CB 3.8Å; L164-C206 HydrophobicContact CD2-CB 3.75Å; L164-C206 HydrophobicContact CG-CB 4.46Å; E202-C206 PolarHBondContact O-N 3.12Å; E202-C206 PolarHBondContact O-SG 3.36Å; C203-C206 WeakPolarHBondContact O-CB 3.27Å; C203-C206 PolarHBondContact O-N 3.03Å; C203-C206 VanDerWaalsContact O-N 3.14Å; C206-A209 PolarHBondContact O-N 3.42Å; C206-F210 VanDerWaalsContact O-CB 3.25Å; C206-F210 WeakPolarHBondContact O-CB 3.39Å; C206-F210 PolarHBondContact O-N 3.09Å
207	L	95.5	Very high	90.7	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-63.5	-41.3	175	-66.3	176.4	0	0	0	112.3	L161 L164 L165 L168 C203 V204 K205 F210 M211 I220 L230	L161-L207 HydrophobicContact CD1-CD2 3.73Å; L164-L207 HydrophobicContact CB-CD2 3.76Å; L164-L207 HydrophobicContact CB-CG 4.41Å; L164-L207 HydrophobicContact CD1-CD2 3.98Å; L165-L207 HydrophobicContact CD2-CD1 4.1Å; L165-L207 HydrophobicContact CD2-CD2 4.25Å; L168-L207 HydrophobicContact CD2-CD1 3.59Å; C203-L207 PolarHBondContact O-N 3.19Å; V204-L207 PolarHBondContact O-N 3.16Å; K205-L207 VanDerWaalsContact C-N 3.32Å; L207-F210 PolarHBondContact O-N 3.03Å; L207-M211 HydrophobicContact CB-CE 4.31Å; L207-M211 WeakPolarHBondContact O-CB 3.37Å; L207-M211 WeakPolarHBondContact O-CE 3.31Å; L207-M211 WeakPolarHBondContact O-CG 3.47Å; L207-M211 PolarHBondContact O-N 2.98Å; L207-I220 HydrophobicContact CD2-CD1 4.41Å; L207-L230 HydrophobicContact CD1-CD2 4.13Å
208	R	94.7	Very high	91	Very high	81 Å²	81	17.8 Å²	17.8	31%	0.306	8%	0.082	S	C	.	.	H	α-helix	trans	-59.9	-47.6	173.7	-177.1	174.3	168.9	-173.5	-6.6	112.1	V204 K205 M211 N212 D244 L248 M1049 D1050	V204-R208 PolarHBondContact O-N 3.08Å; K205-R208 PolarHBondContact O-N 2.86Å; R208-M211 PolarHBondContact O-N 3.33Å; R208-N212 PolarHBondContact O-N 2.81Å; R208-D244 IonicContact NH1-OD1 2.76Å; R208-D244 PolarHBondContact NH1-OD1 3.5Å; R208-L248 HydrophobicContact CB-CD1 4.42Å; R208-L248 HydrophobicContact CB-CD2 3.93Å; R208-L248 HydrophobicContact CG-CD2 4.02Å; R208-M1049 HydrophobicContact CG-CG 4.11Å; R208-D1050 IonicContact CZ-OD1 2.63Å; R208-D1050 IonicContact NE-OD1 3.82Å; R208-D1050 PolarHBondContact NE-OD1 3.47Å; R208-D1050 IonicContact NH2-OD1 3.83Å; R208-D1050 PolarHBondContact NH2-OD1 3Å
209	A	92.1	Very high	91.2	Very high	10 Å²	10	15.6 Å²	15.6	8%	0.083	7%	0.072	C	C	.	.	H	α-helix	trans	-63	-46.4	178	0	0	0	0	0	111.5	L145 S146 K205 C206 M211 N212	L145-A209 HydrophobicContact CB-CB 3.73Å; S146-A209 WeakPolarHBondContact OG-CB 3.21Å; K205-A209 WeakPolarHBondContact O-CB 3.21Å; K205-A209 PolarHBondContact O-N 3.13Å; C206-A209 PolarHBondContact O-N 3.42Å; A209-M211 VanDerWaalsContact C-N 3.28Å; A209-M211 PolarHBondContact O-N 2.73Å; A209-N212 WeakPolarHBondContact O-CB 3.49Å; A209-N212 PolarHBondContact O-N 3.42Å
210	F	93.8	Very high	91.4	Very high	0 Å²	0	15.6 Å²	15.6	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-58.3	-37.1	175.5	179.2	-96.6	0	0	0	112.6	L145 I153 F156 L161 C206 L207 N212 N213 Y215 G216 Q219 I220	L145-F210 HydrophobicContact CD1-CB 4.36Å; L145-F210 HydrophobicContact CD2-CB 4.16Å; L145-F210 HydrophobicContact CD2-CD2 3.97Å; I153-F210 HydrophobicContact CG2-CD2 3.65Å; I153-F210 HydrophobicContact CG2-CE2 3.77Å; F156-F210 AromaticContact CD1-CD2 3.89Å; F156-F210 HydrophobicContact CD1-CD2 3.89Å; F156-F210 AromaticContact CD1-CE2 3.92Å; F156-F210 HydrophobicContact CD1-CE2 3.92Å; F156-F210 HydrophobicContact CE1-CD2 4.28Å; L161-F210 HydrophobicContact CB-CE1 4.09Å; L161-F210 HydrophobicContact CB-CZ 3.97Å; L161-F210 HydrophobicContact CD1-CD1 4.21Å; L161-F210 HydrophobicContact CD1-CE1 3.97Å; L161-F210 HydrophobicContact CD2-CE1 4Å; L161-F210 HydrophobicContact CD2-CZ 4.42Å; L161-F210 HydrophobicContact CG-CE1 4.23Å; C206-F210 VanDerWaalsContact O-CB 3.25Å; C206-F210 WeakPolarHBondContact O-CB 3.39Å; C206-F210 PolarHBondContact O-N 3.09Å; L207-F210 PolarHBondContact O-N 3.03Å; F210-N212 VanDerWaalsContact C-N 3.35Å; F210-N213 PolarHBondContact O-ND2 3.14Å; F210-Y215 HydrophobicContact CZ-CE1 4.48Å; F210-G216 VanDerWaalsContact CE1-CA 3.41Å; F210-G216 WeakPolarHBondContact CE1-O 3.36Å; F210-G216 WeakPolarHBondContact O-CA 3.22Å; F210-Q219 HydrophobicContact CE1-CB 3.97Å; F210-Q219 HydrophobicContact CZ-CB 3.96Å; F210-Q219 HydrophobicContact CZ-CG 4.19Å; F210-I220 HydrophobicContact CD1-CG1 4.48Å; F210-I220 HydrophobicContact CE1-CG1 4.47Å
211	M	91.6	Very high	91.5	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-78.1	-9.8	175.8	-74.9	-172.6	-76.4	0	0	114.9	L207 R208 A209 N213 L217 I220 L248 I252 M1049	L207-M211 HydrophobicContact CB-CE 4.31Å; L207-M211 WeakPolarHBondContact O-CB 3.37Å; L207-M211 WeakPolarHBondContact O-CE 3.31Å; L207-M211 WeakPolarHBondContact O-CG 3.47Å; L207-M211 PolarHBondContact O-N 2.98Å; R208-M211 PolarHBondContact O-N 3.33Å; A209-M211 VanDerWaalsContact C-N 3.28Å; A209-M211 PolarHBondContact O-N 2.73Å; M211-N213 PolarHBondContact O-N 3.44Å; M211-L217 HydrophobicContact SD-CD1 4.32Å; M211-I220 HydrophobicContact CG-CB 4.25Å; M211-I220 HydrophobicContact CG-CG1 3.7Å; M211-I220 HydrophobicContact SD-CB 4.01Å; M211-I220 HydrophobicContact SD-CD1 4.37Å; M211-I220 HydrophobicContact SD-CG1 3.75Å; M211-I220 HydrophobicContact SD-CG2 3.78Å; M211-L248 HydrophobicContact CE-CB 4.29Å; M211-L248 HydrophobicContact CE-CD1 3.73Å; M211-L248 HydrophobicContact CE-CD2 3.57Å; M211-L248 HydrophobicContact CE-CG 4.04Å; M211-I252 HydrophobicContact SD-CD1 4.04Å; M211-I252 HydrophobicContact SD-CG1 4.28Å; M211-M1049 HydrophobicContact CB-CB 4.36Å; M211-M1049 HydrophobicContact CB-CG 4.21Å; M211-M1049 HydrophobicContact CB-SD 4.06Å; M211-M1049 HydrophobicContact CE-SD 4.36Å; M211-M1049 HydrophobicContact SD-SD 4.42Å
212	N	90.8	Very high	91.3	Very high	29 Å²	29	18.5 Å²	18.5	16%	0.155	10%	0.095	C	C	.	.	S	Bend	trans	-79.7	33.8	-174.9	-149.1	17.6	0	0	0	114	N77 R208 A209 F210 G1047 M1049 D1050	N77-N212 PolarHBondContact ND2-O 3.08Å; N77-N212 PolarHBondContact OD1-O 3.32Å; R208-N212 PolarHBondContact O-N 2.81Å; A209-N212 WeakPolarHBondContact O-CB 3.49Å; A209-N212 PolarHBondContact O-N 3.42Å; F210-N212 VanDerWaalsContact C-N 3.35Å; N212-G1047 PolarHBondContact O-N 3.33Å; N212-G1047 WeakPolarHBondContact OD1-CA 3.49Å; N212-G1047 PolarHBondContact OD1-O 3.11Å; N212-M1049 HydrophobicContact CB-CB 4.05Å; N212-M1049 WeakPolarHBondContact OD1-CB 3.49Å; N212-M1049 PolarHBondContact OD1-N 3.37Å; N212-D1050 PolarHBondContact ND2-OD2 3.15Å; N212-D1050 PolarHBondContact OD1-N 2.82Å
213	N	87.6	Confident	91.2	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	10%	0.099	C	C	.	.	B	Isolated β-bridge	trans	-159.7	157.9	176.7	62	87.1	0	0	0	109.2	I150 I153 F210 M211 Y215 G216 L217 E1045	I150-N213 HydrophobicContact CD1-CB 4.34Å; I150-N213 HydrophobicContact CG1-CB 4.43Å; I153-N213 WeakPolarHBondContact CD1-ND2 3.44Å; F210-N213 PolarHBondContact O-ND2 3.14Å; M211-N213 PolarHBondContact O-N 3.44Å; N213-Y215 VanDerWaalsContact C-N 3.31Å; N213-Y215 PolarHBondContact O-N 3.33Å; N213-Y215 PolarHBondContact OD1-N 3.37Å; N213-G216 PolarHBondContact O-N 3.06Å; N213-G216 PolarHBondContact OD1-N 2.94Å; N213-L217 PolarHBondContact O-N 2.9Å; N213-E1045 CarbonylContact C-O 3.43Å; N213-E1045 WeakPolarHBondContact CA-O 3.4Å
214	N	85	Confident	90.9	Very high	13 Å²	13	23.4 Å²	23.4	7%	0.07	12%	0.124	C	C	.	.	H	α-helix	trans	-68.4	-25.2	-171.5	-111.9	-18.6	0	0	0	115.9	G218 R258 T1041 S1044 E1045	N214-G218 PolarHBondContact O-N 2.86Å; N214-R258 PolarHBondContact O-NH1 3.45Å; N214-R258 VanDerWaalsContact O-NH1 3.13Å; N214-R258 PolarHBondContact O-NH2 3.36Å; N214-R258 VanDerWaalsContact O-NH2 3.14Å; N214-R258 PolarHBondContact OD1-NH2 2.81Å; N214-T1041 VanDerWaalsContact CG-O 3.28Å; N214-T1041 PolarHBondContact ND2-O 2.9Å; N214-T1041 PolarHBondContact OD1-O 3.17Å; N214-S1044 PolarHBondContact ND2-O 2.78Å; N214-E1045 PolarHBondContact N-O 3.05Å
215	Y	87.9	Confident	90.5	Very high	59 Å²	59	26.6 Å²	26.6	23%	0.231	14%	0.141	C	C	.	.	H	α-helix	trans	-71.1	-53.7	176.3	171.7	-92.3	0	0	0	111.4	I153 K154 G157 F210 N213 G218 Q219	I153-Y215 HydrophobicContact CG2-CD1 4.33Å; K154-Y215 HydrophobicContact CG-CD1 4.02Å; K154-Y215 HydrophobicContact CG-CD2 3.79Å; K154-Y215 HydrophobicContact CG-CE1 4.34Å; K154-Y215 HydrophobicContact CG-CE2 4.09Å; K154-Y215 HydrophobicContact CG-CG 3.75Å; G157-Y215 WeakPolarHBondContact CA-OH 3.02Å; F210-Y215 HydrophobicContact CZ-CE1 4.48Å; N213-Y215 VanDerWaalsContact C-N 3.31Å; N213-Y215 PolarHBondContact O-N 3.33Å; N213-Y215 PolarHBondContact OD1-N 3.37Å; Y215-G218 CarbonylContact O-C 3.54Å; Y215-G218 WeakPolarHBondContact O-CA 3.28Å; Y215-G218 PolarHBondContact O-N 3.31Å; Y215-G218 VanDerWaalsContact O-N 3.08Å; Y215-Q219 HydrophobicContact CD1-CG 4.2Å; Y215-Q219 HydrophobicContact CE1-CG 3.67Å; Y215-Q219 HydrophobicContact CE2-CG 4.24Å; Y215-Q219 PolarHBondContact O-N 3.35Å
216	G	90.4	Very high	90.3	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-70.7	-34.6	-174.7	0	0	0	0	0	113.6	F210 N213 G218 Q219 I220	F210-G216 VanDerWaalsContact CE1-CA 3.41Å; F210-G216 WeakPolarHBondContact CE1-O 3.36Å; F210-G216 WeakPolarHBondContact O-CA 3.22Å; N213-G216 PolarHBondContact O-N 3.06Å; N213-G216 PolarHBondContact OD1-N 2.94Å; G216-G218 VanDerWaalsContact C-N 3.29Å; G216-G218 PolarHBondContact O-N 2.89Å; G216-Q219 PolarHBondContact O-N 3.15Å; G216-I220 PolarHBondContact O-N 3.43Å
217	L	89.8	Confident	90	Very high	1 Å²	1	24.5 Å²	24.5	1%	0.005	13%	0.132	C	C	.	.	H	α-helix	trans	-59.8	-42.2	167	-179.1	59.8	0	0	0	111.1	M211 N213 Q219 I220 L221 V255 V1048 L1052	M211-L217 HydrophobicContact SD-CD1 4.32Å; N213-L217 PolarHBondContact O-N 2.9Å; L217-Q219 PolarHBondContact O-N 2.75Å; L217-I220 PolarHBondContact O-N 3.22Å; L217-L221 HydrophobicContact CD1-CD1 4.33Å; L217-L221 HydrophobicContact CG-CD1 4.16Å; L217-L221 WeakPolarHBondContact O-CG 3.48Å; L217-L221 PolarHBondContact O-N 2.7Å; L217-V255 HydrophobicContact CD1-CG2 4.43Å; L217-V255 HydrophobicContact CD2-CG2 4.3Å; L217-V1048 HydrophobicContact CD2-CG1 3.75Å; L217-L1052 HydrophobicContact CD2-CD1 4.29Å
218	G	87.9	Confident	89.6	Confident	8 Å²	8	28 Å²	28	8%	0.082	15%	0.146	C	C	.	.	H	α-helix	trans	-60.5	-41.9	173.3	0	0	0	0	0	113.5	N214 Y215 G216 L221 S222	N214-G218 PolarHBondContact O-N 2.86Å; Y215-G218 CarbonylContact O-C 3.54Å; Y215-G218 WeakPolarHBondContact O-CA 3.28Å; Y215-G218 PolarHBondContact O-N 3.31Å; Y215-G218 VanDerWaalsContact O-N 3.08Å; G216-G218 VanDerWaalsContact C-N 3.29Å; G216-G218 PolarHBondContact O-N 2.89Å; G218-L221 PolarHBondContact O-N 2.84Å; G218-S222 VanDerWaalsContact O-CB 3.28Å; G218-S222 WeakPolarHBondContact O-CB 3.24Å; G218-S222 PolarHBondContact O-N 3.21Å; G218-S222 PolarHBondContact O-OG 2.92Å
219	Q	90.3	Very high	89.3	Confident	36 Å²	36	24.5 Å²	24.5	17%	0.168	13%	0.133	C	C	.	.	H	α-helix	trans	-65.3	-39.4	176.5	-66.8	-59.3	-42.7	0	0	112	L161 F210 Y215 G216 L217 S222 H223	L161-Q219 HydrophobicContact CD2-CB 3.73Å; F210-Q219 HydrophobicContact CE1-CB 3.97Å; F210-Q219 HydrophobicContact CZ-CB 3.96Å; F210-Q219 HydrophobicContact CZ-CG 4.19Å; Y215-Q219 HydrophobicContact CD1-CG 4.2Å; Y215-Q219 HydrophobicContact CE1-CG 3.67Å; Y215-Q219 HydrophobicContact CE2-CG 4.24Å; Y215-Q219 PolarHBondContact O-N 3.35Å; G216-Q219 PolarHBondContact O-N 3.15Å; L217-Q219 PolarHBondContact O-N 2.75Å; Q219-S222 PolarHBondContact O-N 2.89Å; Q219-H223 WeakPolarHBondContact O-CB 3.46Å; Q219-H223 PolarHBondContact O-N 2.87Å
220	I	91.4	Very high	89.2	Confident	0 Å²	0	24 Å²	24	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-62.8	-46.8	174.6	-79.7	-80	0	0	0	111.5	L161 L165 L207 F210 M211 G216 L217 S222 H223 S226 I252	L161-I220 HydrophobicContact CD1-CD1 3.57Å; L161-I220 HydrophobicContact CD1-CG1 4.09Å; L161-I220 HydrophobicContact CD2-CD1 4.31Å; L161-I220 HydrophobicContact CD2-CG1 4.3Å; L165-I220 HydrophobicContact CD2-CD1 4.43Å; L207-I220 HydrophobicContact CD2-CD1 4.41Å; F210-I220 HydrophobicContact CD1-CG1 4.48Å; F210-I220 HydrophobicContact CE1-CG1 4.47Å; M211-I220 HydrophobicContact CG-CB 4.25Å; M211-I220 HydrophobicContact CG-CG1 3.7Å; M211-I220 HydrophobicContact SD-CB 4.01Å; M211-I220 HydrophobicContact SD-CD1 4.37Å; M211-I220 HydrophobicContact SD-CG1 3.75Å; M211-I220 HydrophobicContact SD-CG2 3.78Å; G216-I220 PolarHBondContact O-N 3.43Å; L217-I220 PolarHBondContact O-N 3.22Å; I220-S222 VanDerWaalsContact C-N 3.3Å; I220-S222 PolarHBondContact O-N 3.24Å; I220-H223 PolarHBondContact O-N 2.95Å; I220-S226 WeakPolarHBondContact O-CB 3.2Å; I220-S226 PolarHBondContact O-OG 3.15Å; I220-I252 HydrophobicContact CG2-CD1 3.89Å; I220-I252 HydrophobicContact CG2-CG1 4.38Å
221	L	89.1	Confident	88.9	Confident	25 Å²	25	24.4 Å²	24.4	13%	0.131	13%	0.132	C	C	.	.	H	α-helix	trans	-66.3	-31.9	177.3	-69.1	166.6	0	0	0	112.2	L217 G218 I252 V255 K268	L217-L221 HydrophobicContact CD1-CD1 4.33Å; L217-L221 HydrophobicContact CG-CD1 4.16Å; L217-L221 WeakPolarHBondContact O-CG 3.48Å; L217-L221 PolarHBondContact O-N 2.7Å; G218-L221 PolarHBondContact O-N 2.84Å; L221-I252 HydrophobicContact CD2-CG2 3.99Å; L221-V255 HydrophobicContact CD1-CB 4.23Å; L221-V255 HydrophobicContact CD1-CG1 3.79Å; L221-K268 WeakPolarHBondContact O-CD 3.44Å; L221-K268 PolarHBondContact O-NZ 3.38Å
222	S	88.6	Confident	88.5	Confident	76 Å²	76	26.7 Å²	26.7	53%	0.531	14%	0.142	S	C	.	.	H	α-helix	trans	-76.5	-25.7	177	-57.5	0	0	0	0	113.7	G218 Q219 I220	G218-S222 VanDerWaalsContact O-CB 3.28Å; G218-S222 WeakPolarHBondContact O-CB 3.24Å; G218-S222 PolarHBondContact O-N 3.21Å; G218-S222 PolarHBondContact O-OG 2.92Å; Q219-S222 PolarHBondContact O-N 2.89Å; I220-S222 VanDerWaalsContact C-N 3.3Å; I220-S222 PolarHBondContact O-N 3.24Å
223	H	90.8	Very high	88.2	Confident	26 Å²	26	25.3 Å²	25.3	12%	0.12	14%	0.135	C	C	.	.	S	Bend	trans	-74	136.6	178.3	-168.9	-71.8	0	0	0	110.5	L161 N162 L165 Q219 I220 D225 S226 K268	L161-H223 HydrophobicContact CD2-CB 4.47Å; N162-H223 PolarHBondContact OD1-CD2 3.05Å; N162-H223 VanDerWaalsContact OD1-CD2 3.29Å; N162-H223 PolarHBondContact OD1-NE2 3.12Å; L165-H223 HydrophobicContact CD1-CB 4.44Å; Q219-H223 WeakPolarHBondContact O-CB 3.46Å; Q219-H223 PolarHBondContact O-N 2.87Å; I220-H223 PolarHBondContact O-N 2.95Å; H223-D225 PolarHBondContact ND1-N 2.93Å; H223-S226 PolarHBondContact ND1-N 3.03Å; H223-S226 PolarHBondContact O-OG 3.48Å; H223-K268 PolarHBondContact O-NZ 3.39Å
224	P	85.2	Confident	88.2	Confident	81 Å²	81	26.1 Å²	26.1	53%	0.526	14%	0.139	S	C	.	.	S	Bend	trans	-64.8	-65.1	179.2	23.5	-31.7	0	0	0	111.6	S226	P224-S226 VanDerWaalsContact C-N 3.27Å; P224-S226 PolarHBondContact O-N 3.44Å; P224-S226 VanDerWaalsContact O-N 3.15Å
225	D	86.1	Confident	88	Confident	67 Å²	67	27.2 Å²	27.2	36%	0.358	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.8	10.5	-171.7	-56.3	-90.3	0	0	0	115.5	H223 C227 R228 T229	H223-D225 PolarHBondContact ND1-N 2.93Å; D225-C227 PolarHBondContact O-N 3.34Å; D225-R228 HydrophobicContact CB-CB 4.28Å; D225-R228 WeakPolarHBondContact O-CB 3.35Å; D225-R228 PolarHBondContact O-N 3.25Å; D225-R228 VanDerWaalsContact O-N 3.15Å; D225-R228 IonicContact OD1-NH1 3.52Å; D225-T229 PolarHBondContact O-N 3.07Å; D225-T229 PolarHBondContact O-OG1 3.41Å; D225-T229 VanDerWaalsContact O-OG1 3.1Å
226	S	91.1	Very high	87.7	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-60.8	-50.4	-175.1	50.1	0	0	0	0	112.3	I220 H223 P224 R228 T229 L230	I220-S226 WeakPolarHBondContact O-CB 3.2Å; I220-S226 PolarHBondContact O-OG 3.15Å; H223-S226 PolarHBondContact ND1-N 3.03Å; H223-S226 PolarHBondContact O-OG 3.48Å; P224-S226 VanDerWaalsContact C-N 3.27Å; P224-S226 PolarHBondContact O-N 3.44Å; P224-S226 VanDerWaalsContact O-N 3.15Å; S226-R228 VanDerWaalsContact C-N 3.28Å; S226-R228 PolarHBondContact O-N 3.43Å; S226-T229 PolarHBondContact O-N 3.36Å; S226-L230 WeakPolarHBondContact O-CG 3.33Å; S226-L230 PolarHBondContact O-N 3.01Å; S226-L230 VanDerWaalsContact O-N 3.11Å
227	C	90.5	Very high	87.3	Confident	2 Å²	2	33.1 Å²	33.1	1%	0.014	19%	0.185	C	C	.	.	H	α-helix	trans	-66	-33.8	176.1	-61.6	0	0	0	0	111.2	D225 L230 V231 K268 A272	D225-C227 PolarHBondContact O-N 3.34Å; C227-L230 PolarHBondContact O-N 3.17Å; C227-V231 WeakPolarHBondContact O-CB 3.45Å; C227-V231 WeakPolarHBondContact O-CG2 3.5Å; C227-V231 PolarHBondContact O-N 3Å; C227-K268 HydrophobicContact CB-CB 4.4Å; C227-K268 WeakPolarHBondContact CB-O 3.49Å; C227-A272 HydrophobicContact CB-CB 3.72Å
228	R	86.8	Confident	87	Confident	74 Å²	74	33.9 Å²	33.9	28%	0.279	19%	0.189	S	C	.	.	H	α-helix	trans	-65	-46.5	177.1	-169.6	179.9	-172.2	173.4	4.6	111.8	D225 S226 V231 Q232 A272	D225-R228 HydrophobicContact CB-CB 4.28Å; D225-R228 WeakPolarHBondContact O-CB 3.35Å; D225-R228 PolarHBondContact O-N 3.25Å; D225-R228 VanDerWaalsContact O-N 3.15Å; D225-R228 IonicContact OD1-NH1 3.52Å; S226-R228 VanDerWaalsContact C-N 3.28Å; S226-R228 PolarHBondContact O-N 3.43Å; R228-V231 PolarHBondContact O-N 2.96Å; R228-Q232 WeakPolarHBondContact O-CB 3.32Å; R228-Q232 VanDerWaalsContact O-CG 3.29Å; R228-Q232 WeakPolarHBondContact O-CG 3.39Å; R228-Q232 PolarHBondContact O-N 3.48Å; R228-A272 HydrophobicContact CB-CB 4.49Å
229	T	88.7	Confident	87.1	Confident	8 Å²	8	36.3 Å²	36.3	5%	0.049	20%	0.199	C	C	.	.	H	α-helix	trans	-64	-40.9	176.2	-57.3	0	0	0	0	111.7	L165 L168 D225 S226 Q232 S233	L165-T229 HydrophobicContact CD2-CG2 4.41Å; L168-T229 HydrophobicContact CB-CG2 3.91Å; L168-T229 HydrophobicContact CD2-CG2 3.99Å; L168-T229 HydrophobicContact CG-CG2 3.88Å; D225-T229 PolarHBondContact O-N 3.07Å; D225-T229 PolarHBondContact O-OG1 3.41Å; D225-T229 VanDerWaalsContact O-OG1 3.1Å; S226-T229 PolarHBondContact O-N 3.36Å; T229-Q232 PolarHBondContact O-N 2.94Å; T229-S233 PolarHBondContact O-N 3.24Å; T229-S233 VanDerWaalsContact O-N 3.13Å; T229-S233 PolarHBondContact O-OG 2.93Å
230	L	90.5	Very high	87.1	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-61.8	-47.3	173.4	-73.3	172.3	0	0	0	111.5	L168 L207 S226 C227 Q232 S233 V245 L248 L249 I252	L168-L230 HydrophobicContact CD2-CD2 4.2Å; L207-L230 HydrophobicContact CD1-CD2 4.13Å; S226-L230 WeakPolarHBondContact O-CG 3.33Å; S226-L230 PolarHBondContact O-N 3.01Å; S226-L230 VanDerWaalsContact O-N 3.11Å; C227-L230 PolarHBondContact O-N 3.17Å; L230-Q232 VanDerWaalsContact C-N 3.3Å; L230-Q232 PolarHBondContact O-N 2.71Å; L230-S233 WeakPolarHBondContact O-CA 3.31Å; L230-S233 WeakPolarHBondContact O-CB 3.44Å; L230-S233 PolarHBondContact O-N 3.06Å; L230-V245 HydrophobicContact CB-CG1 4.45Å; L230-V245 WeakPolarHBondContact O-CG1 3.24Å; L230-L248 HydrophobicContact CD2-CD1 4.31Å; L230-L249 HydrophobicContact CB-CD2 3.78Å; L230-L249 HydrophobicContact CB-CG 4.15Å; L230-L249 HydrophobicContact CD1-CD2 4.25Å; L230-I252 HydrophobicContact CD1-CD1 3.63Å
231	V	87.4	Confident	87	Confident	7 Å²	7	37.5 Å²	37.5	4%	0.042	21%	0.211	C	C	.	.	H	α-helix	trans	-62.9	-33.8	175.8	167.6	0	0	0	0	112.5	C227 R228 S233 L234 L249 A272 L273 K284	C227-V231 WeakPolarHBondContact O-CB 3.45Å; C227-V231 WeakPolarHBondContact O-CG2 3.5Å; C227-V231 PolarHBondContact O-N 3Å; R228-V231 PolarHBondContact O-N 2.96Å; V231-S233 PolarHBondContact O-N 3.44Å; V231-L234 HydrophobicContact CB-CD1 4.47Å; V231-L234 HydrophobicContact CG1-CD1 4.29Å; V231-L234 WeakPolarHBondContact O-CB 3.48Å; V231-L234 WeakPolarHBondContact O-CG 3.3Å; V231-L234 PolarHBondContact O-N 3.28Å; V231-L249 HydrophobicContact CG2-CD1 3.84Å; V231-L249 HydrophobicContact CG2-CD2 3.98Å; V231-A272 HydrophobicContact CB-CB 4.41Å; V231-A272 HydrophobicContact CG2-CB 3.91Å; V231-L273 HydrophobicContact CG1-CD2 3.96Å; V231-L273 HydrophobicContact CG2-CD2 3.91Å; V231-L273 HydrophobicContact CG2-CG 4.1Å; V231-K284 HydrophobicContact CG1-CD 3.9Å; V231-K284 HydrophobicContact CG1-CG 4.45Å
232	Q	83.1	Confident	87.1	Confident	48 Å²	48	36.3 Å²	36.3	22%	0.224	21%	0.205	C	C	.	.	H	α-helix	trans	-68.1	-21.1	173.1	-75.5	170.2	-26.4	0	0	113.1	S172 R228 T229 L230 L234	S172-Q232 WeakPolarHBondContact CB-O 3.24Å; R228-Q232 WeakPolarHBondContact O-CB 3.32Å; R228-Q232 VanDerWaalsContact O-CG 3.29Å; R228-Q232 WeakPolarHBondContact O-CG 3.39Å; R228-Q232 PolarHBondContact O-N 3.48Å; T229-Q232 PolarHBondContact O-N 2.94Å; L230-Q232 VanDerWaalsContact C-N 3.3Å; L230-Q232 PolarHBondContact O-N 2.71Å; Q232-L234 VanDerWaalsContact C-N 3.32Å
233	S	84.8	Confident	87.4	Confident	1 Å²	1	34.2 Å²	34.2	1%	0.007	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.1	10.4	178.1	-48.4	0	0	0	0	113.7	L168 T229 L230 V231 S235	L168-S233 WeakPolarHBondContact CD1-OG 3.37Å; L168-S233 VanDerWaalsContact CG-OG 3.25Å; L168-S233 WeakPolarHBondContact CG-OG 3.34Å; T229-S233 PolarHBondContact O-N 3.24Å; T229-S233 VanDerWaalsContact O-N 3.13Å; T229-S233 PolarHBondContact O-OG 2.93Å; L230-S233 WeakPolarHBondContact O-CA 3.31Å; L230-S233 WeakPolarHBondContact O-CB 3.44Å; L230-S233 PolarHBondContact O-N 3.06Å; V231-S233 PolarHBondContact O-N 3.44Å; S233-S235 VanDerWaalsContact C-N 3.31Å; S233-S235 PolarHBondContact O-N 2.74Å
234	L	85.9	Confident	87.6	Confident	16 Å²	16	34.1 Å²	34.1	8%	0.084	19%	0.188	C	C	.	.			trans	-78	75	177.3	-70.1	173.7	0	0	0	111.7	V231 Q232 M242 V245 V246 L249 P287 I288	V231-L234 HydrophobicContact CB-CD1 4.47Å; V231-L234 HydrophobicContact CG1-CD1 4.29Å; V231-L234 WeakPolarHBondContact O-CB 3.48Å; V231-L234 WeakPolarHBondContact O-CG 3.3Å; V231-L234 PolarHBondContact O-N 3.28Å; Q232-L234 VanDerWaalsContact C-N 3.32Å; L234-M242 HydrophobicContact CD2-CE 4.27Å; L234-M242 HydrophobicContact CD2-CG 4.35Å; L234-V245 HydrophobicContact CD2-CB 4.26Å; L234-V245 HydrophobicContact CD2-CG1 3.57Å; L234-V245 HydrophobicContact CG-CG1 4.12Å; L234-V246 HydrophobicContact CD2-CG1 3.47Å; L234-V246 VanDerWaalsContact CD2-CG1 3.47Å; L234-L249 HydrophobicContact CD1-CD1 4.15Å; L234-L249 HydrophobicContact CD2-CD1 4.21Å; L234-L249 HydrophobicContact CG-CD1 4.38Å; L234-P287 HydrophobicContact CB-CB 4.2Å; L234-I288 HydrophobicContact CD1-CG1 4.44Å
235	S	81.2	Confident	88	Confident	36 Å²	36	30.2 Å²	30.2	25%	0.252	16%	0.163	S	C	.	.			trans	-100.6	118.8	175.8	-173.5	0	0	0	0	113	S233 D237 V238	S233-S235 VanDerWaalsContact C-N 3.31Å; S233-S235 PolarHBondContact O-N 2.74Å; S235-D237 PolarHBondContact O-N 3.34Å; S235-D237 PolarHBondContact OG-N 2.89Å; S235-V238 PolarHBondContact O-N 3.22Å
236	V	82.9	Confident	88.4	Confident	40 Å²	40	27 Å²	27	24%	0.242	15%	0.146	C	C	.	.	G	3₁₀ helix	trans	-67.1	-25.3	176.8	-173.9	0	0	0	0	111.9	V238 M242 P287 A290 I294	V236-V238 PolarHBondContact O-N 2.85Å; V236-M242 HydrophobicContact CB-SD 4.46Å; V236-M242 HydrophobicContact CG2-CE 4.45Å; V236-M242 HydrophobicContact CG2-SD 4Å; V236-P287 HydrophobicContact CG2-CB 4.24Å; V236-A290 HydrophobicContact CG2-CB 4.22Å; V236-I294 HydrophobicContact CG1-CD1 3.52Å
237	D	80.3	Confident	88.6	Confident	143 Å²	143	29.5 Å²	29.5	77%	0.765	16%	0.156	S	C	*	.	G	3₁₀ helix	trans	-64.3	-22.2	178.5	-60.9	-44.4	0	0	0	113	S235	S235-D237 PolarHBondContact O-N 3.34Å; S235-D237 PolarHBondContact OG-N 2.89Å
238	V	84.8	Confident	88.8	Confident	17 Å²	17	29.4 Å²	29.4	10%	0.103	16%	0.156	C	C	.	.	G	3₁₀ helix	trans	-125.3	68.3	-178.3	-163	0	0	0	0	109.6	Q197 S235 V236 S240 T241 M242	Q197-V238 HydrophobicContact CB-CG2 4.22Å; Q197-V238 HydrophobicContact CG-CG2 3.83Å; Q197-V238 VanDerWaalsContact NE2-CG2 3.32Å; S235-V238 PolarHBondContact O-N 3.22Å; V236-V238 PolarHBondContact O-N 2.85Å; V238-S240 PolarHBondContact O-N 3.1Å; V238-T241 WeakPolarHBondContact CG1-OG1 3.39Å; V238-T241 WeakPolarHBondContact O-CA 3.47Å; V238-T241 WeakPolarHBondContact O-CB 3.47Å; V238-T241 PolarHBondContact O-N 3.14Å; V238-M242 PolarHBondContact O-N 3.5Å
239	Q	89.6	Confident	89.2	Confident	59 Å²	59	25.9 Å²	25.9	28%	0.276	14%	0.142	S	C	.	.	H	α-helix	trans	-47.4	-35.3	-175.9	-58.8	-177.9	7	0	0	114.1	M242 I243 N297 L300	Q239-M242 PolarHBondContact O-N 3.36Å; Q239-I243 VanDerWaalsContact O-CG1 3.28Å; Q239-I243 WeakPolarHBondContact O-CG1 3.42Å; Q239-I243 PolarHBondContact O-N 3.46Å; Q239-N297 PolarHBondContact OE1-ND2 2.93Å; Q239-L300 HydrophobicContact CB-CD2 4.13Å; Q239-L300 HydrophobicContact CG-CD2 3.88Å
240	S	89.8	Confident	89.5	Confident	60 Å²	60	25.5 Å²	25.5	42%	0.42	14%	0.14	S	C	.	.	H	α-helix	trans	-67.9	-40.5	177.1	59.5	0	0	0	0	113.4	H201 V238 D244	H201-S240 PolarHBondContact NE2-O 3.22Å; V238-S240 PolarHBondContact O-N 3.1Å; S240-D244 PolarHBondContact O-N 3.37Å
241	T	90.2	Very high	89.7	Confident	2 Å²	2	25.6 Å²	25.6	1%	0.012	14%	0.14	C	C	.	.	H	α-helix	trans	-65.6	-44.5	171.3	-55.3	0	0	0	0	109.6	E200 H201 V204 V238 I243 D244 V245	E200-T241 HydrophobicContact CG-CG2 4.2Å; H201-T241 VanDerWaalsContact CB-OG1 3.26Å; H201-T241 WeakPolarHBondContact CB-OG1 3.32Å; V204-T241 HydrophobicContact CG2-CG2 3.99Å; V238-T241 WeakPolarHBondContact CG1-OG1 3.39Å; V238-T241 WeakPolarHBondContact O-CA 3.47Å; V238-T241 WeakPolarHBondContact O-CB 3.47Å; V238-T241 PolarHBondContact O-N 3.14Å; T241-I243 PolarHBondContact O-N 2.78Å; T241-D244 PolarHBondContact O-N 3.31Å; T241-V245 HydrophobicContact CG2-CG2 4.1Å; T241-V245 WeakPolarHBondContact O-CG2 3.31Å; T241-V245 PolarHBondContact O-N 3.38Å
242	M	91.8	Very high	90	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-61.6	-41.8	-178.7	-166.6	172.7	179.6	0	0	112.6	L234 V236 V238 Q239 D244 V245 V246 P287 A291 L300	L234-M242 HydrophobicContact CD2-CE 4.27Å; L234-M242 HydrophobicContact CD2-CG 4.35Å; V236-M242 HydrophobicContact CB-SD 4.46Å; V236-M242 HydrophobicContact CG2-CE 4.45Å; V236-M242 HydrophobicContact CG2-SD 4Å; V238-M242 PolarHBondContact O-N 3.5Å; Q239-M242 PolarHBondContact O-N 3.36Å; M242-D244 PolarHBondContact O-N 3.27Å; M242-V245 PolarHBondContact O-N 3Å; M242-V246 HydrophobicContact CE-CG1 4.22Å; M242-V246 HydrophobicContact CG-CG1 4.22Å; M242-V246 WeakPolarHBondContact O-CG2 3.48Å; M242-V246 PolarHBondContact O-N 3.43Å; M242-P287 HydrophobicContact CE-CB 4.24Å; M242-P287 WeakPolarHBondContact CE-O 3.41Å; M242-A291 HydrophobicContact CE-CB 3.53Å; M242-A291 HydrophobicContact SD-CB 3.69Å; M242-L300 HydrophobicContact CB-CD1 4.12Å; M242-L300 HydrophobicContact CG-CD1 4.07Å; M242-L300 HydrophobicContact SD-CD1 4.16Å
243	I	93.9	Very high	90.4	Very high	31 Å²	31	23 Å²	23	16%	0.159	13%	0.128	C	C	.	.	H	α-helix	trans	-55.1	-49.5	174.2	-76.2	161.8	0	0	0	111.2	Q239 T241 K247 A299 L300 A303	Q239-I243 VanDerWaalsContact O-CG1 3.28Å; Q239-I243 WeakPolarHBondContact O-CG1 3.42Å; Q239-I243 PolarHBondContact O-N 3.46Å; T241-I243 PolarHBondContact O-N 2.78Å; I243-K247 HydrophobicContact CG2-CD 4.25Å; I243-K247 VanDerWaalsContact O-CB 3.27Å; I243-K247 WeakPolarHBondContact O-CB 3.27Å; I243-K247 VanDerWaalsContact O-CG 3.31Å; I243-K247 WeakPolarHBondContact O-CG 3.1Å; I243-K247 PolarHBondContact O-N 3.36Å; I243-A299 HydrophobicContact CD1-CB 4.37Å; I243-L300 HydrophobicContact CD1-CB 4.14Å; I243-L300 HydrophobicContact CG1-CB 4.01Å; I243-L300 HydrophobicContact CG1-CD1 3.85Å; I243-A303 HydrophobicContact CG1-CB 4.4Å; I243-A303 HydrophobicContact CG2-CB 4.27Å
244	D	94.5	Very high	90.7	Very high	24 Å²	24	23 Å²	23	13%	0.128	13%	0.128	C	C	.	.	H	α-helix	trans	-66.1	-44.8	178	-77.5	-53	0	0	0	110.6	H201 V204 R208 S240 T241 M242 K247 L248	H201-D244 IonicContact CD2-OD2 2.64Å; H201-D244 IonicContact CE1-OD2 3.23Å; H201-D244 IonicContact NE2-OD2 2.69Å; H201-D244 PolarHBondContact NE2-OD2 3.31Å; V204-D244 HydrophobicContact CG1-CB 3.73Å; R208-D244 IonicContact NH1-OD1 2.76Å; R208-D244 PolarHBondContact NH1-OD1 3.5Å; S240-D244 PolarHBondContact O-N 3.37Å; T241-D244 PolarHBondContact O-N 3.31Å; M242-D244 PolarHBondContact O-N 3.27Å; D244-K247 PolarHBondContact O-N 3.35Å; D244-L248 VanDerWaalsContact O-CG 3.29Å; D244-L248 WeakPolarHBondContact O-CG 3.43Å; D244-L248 PolarHBondContact O-N 2.96Å
245	V	94.2	Very high	90.8	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-62	-46.7	-179.5	174.7	0	0	0	0	112.7	V204 L230 L234 T241 M242 K247 L248 L249	V204-V245 HydrophobicContact CB-CG2 4.47Å; V204-V245 HydrophobicContact CG1-CG2 3.85Å; V204-V245 HydrophobicContact CG2-CG2 3.74Å; L230-V245 HydrophobicContact CB-CG1 4.45Å; L230-V245 WeakPolarHBondContact O-CG1 3.24Å; L234-V245 HydrophobicContact CD2-CB 4.26Å; L234-V245 HydrophobicContact CD2-CG1 3.57Å; L234-V245 HydrophobicContact CG-CG1 4.12Å; T241-V245 HydrophobicContact CG2-CG2 4.1Å; T241-V245 WeakPolarHBondContact O-CG2 3.31Å; T241-V245 PolarHBondContact O-N 3.38Å; M242-V245 PolarHBondContact O-N 3Å; V245-K247 VanDerWaalsContact C-N 3.3Å; V245-K247 PolarHBondContact O-N 3.45Å; V245-L248 PolarHBondContact O-N 2.97Å; V245-L249 HydrophobicContact CG1-CD1 4.01Å; V245-L249 HydrophobicContact CG1-CG 4.5Å; V245-L249 WeakPolarHBondContact O-CB 3.18Å; V245-L249 WeakPolarHBondContact O-CG 3.46Å; V245-L249 PolarHBondContact O-N 3.25Å
246	V	94.7	Very high	90.9	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-68.4	-31.5	178.4	-59.8	0	0	0	0	111.9	L234 M242 A250 A303 L307	L234-V246 HydrophobicContact CD2-CG1 3.47Å; L234-V246 VanDerWaalsContact CD2-CG1 3.47Å; M242-V246 HydrophobicContact CE-CG1 4.22Å; M242-V246 HydrophobicContact CG-CG1 4.22Å; M242-V246 WeakPolarHBondContact O-CG2 3.48Å; M242-V246 PolarHBondContact O-N 3.43Å; V246-A250 VanDerWaalsContact O-CB 3.27Å; V246-A250 WeakPolarHBondContact O-CB 2.94Å; V246-A250 PolarHBondContact O-N 3.25Å; V246-A303 VanDerWaalsContact CG2-C 3.42Å; V246-A303 HydrophobicContact CG2-CB 3.53Å; V246-A303 WeakPolarHBondContact CG2-O 3.49Å; V246-L307 HydrophobicContact CB-CB 4.33Å; V246-L307 HydrophobicContact CB-CD2 3.87Å; V246-L307 HydrophobicContact CG1-CD2 3.93Å
247	K	95.3	Very high	90.8	Very high	51 Å²	51	22 Å²	22	22%	0.222	13%	0.126	C	C	.	.	H	α-helix	trans	-67.3	-43.3	172.5	-83.6	-176.3	176.3	-169.8	0	112.5	I243 D244 V245 A250 A251 A303 L1053	I243-K247 HydrophobicContact CG2-CD 4.25Å; I243-K247 VanDerWaalsContact O-CB 3.27Å; I243-K247 WeakPolarHBondContact O-CB 3.27Å; I243-K247 VanDerWaalsContact O-CG 3.31Å; I243-K247 WeakPolarHBondContact O-CG 3.1Å; I243-K247 PolarHBondContact O-N 3.36Å; D244-K247 PolarHBondContact O-N 3.35Å; V245-K247 VanDerWaalsContact C-N 3.3Å; V245-K247 PolarHBondContact O-N 3.45Å; K247-A250 PolarHBondContact O-N 3.47Å; K247-A251 WeakPolarHBondContact O-CB 3.15Å; K247-A251 PolarHBondContact O-N 3.02Å; K247-A303 HydrophobicContact CD-CB 4.43Å; K247-A303 HydrophobicContact CG-CB 4.07Å; K247-L1053 HydrophobicContact CB-CD2 3.65Å; K247-L1053 HydrophobicContact CD-CD2 4.39Å; K247-L1053 HydrophobicContact CG-CD2 4.1Å; K247-L1053 WeakPolarHBondContact O-CD2 3.31Å
248	L	95.5	Very high	90.5	Very high	1 Å²	1	20.3 Å²	20.3	1%	0.005	11%	0.109	C	C	.	.	H	α-helix	trans	-61.1	-47.2	173.1	-69	-175.6	0	0	0	110.9	V204 R208 M211 L230 D244 V245 A250 A251 I252 M1049	V204-L248 HydrophobicContact CG1-CD1 3.86Å; R208-L248 HydrophobicContact CB-CD1 4.42Å; R208-L248 HydrophobicContact CB-CD2 3.93Å; R208-L248 HydrophobicContact CG-CD2 4.02Å; M211-L248 HydrophobicContact CE-CB 4.29Å; M211-L248 HydrophobicContact CE-CD1 3.73Å; M211-L248 HydrophobicContact CE-CD2 3.57Å; M211-L248 HydrophobicContact CE-CG 4.04Å; L230-L248 HydrophobicContact CD2-CD1 4.31Å; D244-L248 VanDerWaalsContact O-CG 3.29Å; D244-L248 WeakPolarHBondContact O-CG 3.43Å; D244-L248 PolarHBondContact O-N 2.96Å; V245-L248 PolarHBondContact O-N 2.97Å; L248-A250 PolarHBondContact O-N 2.87Å; L248-A251 PolarHBondContact O-N 2.85Å; L248-I252 WeakPolarHBondContact O-CB 3.47Å; L248-I252 WeakPolarHBondContact O-CD1 3.42Å; L248-I252 WeakPolarHBondContact O-CG1 3.32Å; L248-I252 PolarHBondContact O-N 3.17Å; L248-M1049 HydrophobicContact CD2-CE 3.52Å; L248-M1049 HydrophobicContact CD2-CG 4.29Å; L248-M1049 HydrophobicContact CD2-SD 3.55Å; L248-M1049 VanDerWaalsContact CD2-SD 3.55Å
249	L	95.3	Very high	89.8	Confident	0 Å²	0	25.2 Å²	25.2	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-61.4	-41.6	176	-73	170.3	0	0	0	112.1	L230 V231 L234 V245 I252 C253 V269 L307	L230-L249 HydrophobicContact CB-CD2 3.78Å; L230-L249 HydrophobicContact CB-CG 4.15Å; L230-L249 HydrophobicContact CD1-CD2 4.25Å; V231-L249 HydrophobicContact CG2-CD1 3.84Å; V231-L249 HydrophobicContact CG2-CD2 3.98Å; L234-L249 HydrophobicContact CD1-CD1 4.15Å; L234-L249 HydrophobicContact CD2-CD1 4.21Å; L234-L249 HydrophobicContact CG-CD1 4.38Å; V245-L249 HydrophobicContact CG1-CD1 4.01Å; V245-L249 HydrophobicContact CG1-CG 4.5Å; V245-L249 WeakPolarHBondContact O-CB 3.18Å; V245-L249 WeakPolarHBondContact O-CG 3.46Å; V245-L249 PolarHBondContact O-N 3.25Å; L249-I252 PolarHBondContact O-N 2.95Å; L249-C253 WeakPolarHBondContact O-CB 3.21Å; L249-C253 PolarHBondContact O-N 3.12Å; L249-V269 HydrophobicContact CD2-CG2 4.17Å; L249-L307 HydrophobicContact CB-CD1 3.83Å; L249-L307 HydrophobicContact CB-CD2 4.21Å; L249-L307 HydrophobicContact CD1-CD2 4.37Å
250	A	94.5	Very high	88.6	Confident	0 Å²	0	31 Å²	31	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-64.7	-43.2	178.7	0	0	0	0	0	111.8	V246 K247 L248 C253 V254 L307 A310 L1056	V246-A250 VanDerWaalsContact O-CB 3.27Å; V246-A250 WeakPolarHBondContact O-CB 2.94Å; V246-A250 PolarHBondContact O-N 3.25Å; K247-A250 PolarHBondContact O-N 3.47Å; L248-A250 PolarHBondContact O-N 2.87Å; A250-C253 WeakPolarHBondContact O-CB 3.37Å; A250-C253 PolarHBondContact O-N 3.48Å; A250-V254 PolarHBondContact O-N 3.44Å; A250-L307 HydrophobicContact CB-CB 4.13Å; A250-L307 HydrophobicContact CB-CD1 4.21Å; A250-A310 HydrophobicContact CB-CB 4.17Å; A250-L1056 HydrophobicContact CB-CD1 3.75Å
251	A	93.7	Very high	87.5	Confident	1 Å²	1	32.3 Å²	32.3	1%	0.008	19%	0.19	C	C	.	.	H	α-helix	trans	-66.2	-44	177.1	0	0	0	0	0	112	K247 L248 C253 V254 V255 M1049 L1052 L1053 L1056	K247-A251 WeakPolarHBondContact O-CB 3.15Å; K247-A251 PolarHBondContact O-N 3.02Å; L248-A251 PolarHBondContact O-N 2.85Å; A251-C253 VanDerWaalsContact C-N 3.32Å; A251-C253 PolarHBondContact O-N 3.3Å; A251-V254 VanDerWaalsContact O-CG2 3.24Å; A251-V254 WeakPolarHBondContact O-CG2 3.26Å; A251-V254 PolarHBondContact O-N 3.08Å; A251-V255 VanDerWaalsContact O-CG2 3.32Å; A251-V255 WeakPolarHBondContact O-CG2 3.42Å; A251-M1049 HydrophobicContact CB-CE 3.22Å; A251-M1049 HydrophobicContact CB-SD 4.23Å; A251-L1052 HydrophobicContact CB-CB 4.01Å; A251-L1052 HydrophobicContact CB-CD1 4.48Å; A251-L1053 HydrophobicContact CB-CD2 4.21Å; A251-L1056 HydrophobicContact CB-CD1 4.15Å
252	I	93.6	Very high	86.7	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-58.9	-45.9	173.1	-68.8	164.1	0	0	0	110	M211 I220 L221 L230 L248 L249 V254 V255 G265 V269	M211-I252 HydrophobicContact SD-CD1 4.04Å; M211-I252 HydrophobicContact SD-CG1 4.28Å; I220-I252 HydrophobicContact CG2-CD1 3.89Å; I220-I252 HydrophobicContact CG2-CG1 4.38Å; L221-I252 HydrophobicContact CD2-CG2 3.99Å; L230-I252 HydrophobicContact CD1-CD1 3.63Å; L248-I252 WeakPolarHBondContact O-CB 3.47Å; L248-I252 WeakPolarHBondContact O-CD1 3.42Å; L248-I252 WeakPolarHBondContact O-CG1 3.32Å; L248-I252 PolarHBondContact O-N 3.17Å; L249-I252 PolarHBondContact O-N 2.95Å; I252-V254 PolarHBondContact O-N 3.49Å; I252-V255 PolarHBondContact O-N 3.43Å; I252-G265 VanDerWaalsContact O-CA 3.27Å; I252-G265 WeakPolarHBondContact O-CA 3.41Å; I252-V269 HydrophobicContact CB-CG2 4.37Å; I252-V269 HydrophobicContact CG2-CG2 3.89Å
253	C	92.5	Very high	86	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-58.2	-30.7	-177.4	-170	0	0	0	0	113.3	L249 A250 A251 H266 V269 A310	L249-C253 WeakPolarHBondContact O-CB 3.21Å; L249-C253 PolarHBondContact O-N 3.12Å; A250-C253 WeakPolarHBondContact O-CB 3.37Å; A250-C253 PolarHBondContact O-N 3.48Å; A251-C253 VanDerWaalsContact C-N 3.32Å; A251-C253 PolarHBondContact O-N 3.3Å; C253-H266 WeakPolarHBondContact O-CA 3.47Å; C253-H266 WeakPolarHBondContact O-CB 3.41Å; C253-H266 PolarHBondContact O-N 2.78Å; C253-H266 VanDerWaalsContact O-N 3.14Å; C253-V269 HydrophobicContact CB-CB 4.19Å; C253-V269 HydrophobicContact CB-CG1 4.2Å; C253-V269 HydrophobicContact CB-CG2 4.05Å; C253-A310 HydrophobicContact CB-CB 3.93Å
254	V	89.9	Confident	85.6	Confident	3 Å²	3	38.5 Å²	38.5	2%	0.018	23%	0.23	C	C	.	.	H	α-helix	trans	-85.7	-11.9	176.5	-57.3	0	0	0	0	114.5	A250 A251 I252 P256 A310 I314 L1037 L1052 L1056	A250-V254 PolarHBondContact O-N 3.44Å; A251-V254 VanDerWaalsContact O-CG2 3.24Å; A251-V254 WeakPolarHBondContact O-CG2 3.26Å; A251-V254 PolarHBondContact O-N 3.08Å; I252-V254 PolarHBondContact O-N 3.49Å; V254-P256 WeakPolarHBondContact O-CD 3.47Å; V254-A310 HydrophobicContact CG1-CB 3.94Å; V254-I314 HydrophobicContact CB-CD1 4.11Å; V254-I314 HydrophobicContact CG1-CD1 4.13Å; V254-L1037 HydrophobicContact CB-CD2 3.95Å; V254-L1037 HydrophobicContact CG2-CD2 4.22Å; V254-L1037 WeakPolarHBondContact O-CD2 3.36Å; V254-L1052 HydrophobicContact CG2-CD2 4.11Å; V254-L1056 HydrophobicContact CG1-CD2 3.95Å
255	V	88.4	Confident	85.2	Confident	3 Å²	3	37.4 Å²	37.4	2%	0.018	22%	0.224	C	C	.	.	P	Polyproline II helix	trans	-70.3	122.8	-178.2	-169.2	0	0	0	0	110.9	L217 L221 A251 I252 G265 L1052	L217-V255 HydrophobicContact CD1-CG2 4.43Å; L217-V255 HydrophobicContact CD2-CG2 4.3Å; L221-V255 HydrophobicContact CD1-CB 4.23Å; L221-V255 HydrophobicContact CD1-CG1 3.79Å; A251-V255 VanDerWaalsContact O-CG2 3.32Å; A251-V255 WeakPolarHBondContact O-CG2 3.42Å; I252-V255 PolarHBondContact O-N 3.43Å; V255-G265 PolarHBondContact O-N 3.41Å; V255-L1052 HydrophobicContact CG2-CD1 3.89Å
256	P	83.1	Confident	85	Confident	25 Å²	25	38.1 Å²	38.1	16%	0.162	23%	0.228	C	C	.	.	P	Polyproline II helix	trans	-67.1	158.8	176	28.9	-35.4	0	0	0	112	V254 R258 L1038	V254-P256 WeakPolarHBondContact O-CD 3.47Å; P256-R258 PolarHBondContact O-N 3.01Å; P256-L1038 HydrophobicContact CG-CB 4.3Å; P256-L1038 HydrophobicContact CG-CD1 3.87Å
257	A	80.8	Confident	84.6	Confident	43 Å²	43	42.2 Å²	42.2	36%	0.355	25%	0.246	S	C	.	.	P	Polyproline II helix	trans	-60.5	132.7	170	0	0	0	0	0	110.3	A262	A257-A262 WeakPolarHBondContact CB-O 3.45Å
258	R	74.3	Confident	84.2	Confident	106 Å²	106	40.6 Å²	40.6	40%	0.4	24%	0.24	S	C	.	.	S	Bend	trans	-77.5	-33	-179.2	-71.5	-175.7	171.8	-178.5	-3.4	113.2	N214 P256	N214-R258 PolarHBondContact O-NH1 3.45Å; N214-R258 VanDerWaalsContact O-NH1 3.13Å; N214-R258 PolarHBondContact O-NH2 3.36Å; N214-R258 VanDerWaalsContact O-NH2 3.14Å; N214-R258 PolarHBondContact OD1-NH2 2.81Å; P256-R258 PolarHBondContact O-N 3.01Å
259	N	70.7	Confident	84	Confident	121 Å²	121	40.6 Å²	40.6	65%	0.647	24%	0.239	S	C	*	.	S	Bend	trans	-132.4	151.3	-177.1	-62.2	-3.7	0	0	0	110.2	G261 A262	N259-G261 PolarHBondContact O-N 3.41Å; N259-A262 WeakPolarHBondContact O-CB 3.48Å; N259-A262 PolarHBondContact O-N 3.21Å; N259-A262 VanDerWaalsContact O-N 3.12Å
260	D	65	Low	83.5	Confident	179 Å²	179	41.4 Å²	41.4	96%	0.957	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.4	127.1	170.4	-72.7	-49	0	0	0	111.2
261	G	66.7	Low	83	Confident	88 Å²	88	45.3 Å²	45.3	91%	0.907	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.7	-5.6	-177.8	0	0	0	0	0	115.7	N259	N259-G261 PolarHBondContact O-N 3.41Å
262	A	72.2	Confident	82.5	Confident	50 Å²	50	45.5 Å²	45.5	41%	0.413	26%	0.264	S	S	.	.	S	Bend	trans	-81.1	140.2	167.1	0	0	0	0	0	110.8	A257 N259 S264	A257-A262 WeakPolarHBondContact CB-O 3.45Å; N259-A262 WeakPolarHBondContact O-CB 3.48Å; N259-A262 PolarHBondContact O-N 3.21Å; N259-A262 VanDerWaalsContact O-N 3.12Å; A262-S264 PolarHBondContact O-N 2.87Å
263	Q	77.2	Confident	81.9	Confident	91 Å²	91	46.1 Å²	46.1	43%	0.425	27%	0.267	S	S	.	.	P	Polyproline II helix	trans	-61.2	134.2	170.7	-69.5	177.1	-57.2	0	0	110.3	E267 K268 E271	Q263-E267 HydrophobicContact CB-CB 4.43Å; Q263-K268 HydrophobicContact CB-CD 4.18Å; Q263-K268 HydrophobicContact CB-CG 3.69Å; Q263-K268 VanDerWaalsContact OE1-CE 3.25Å; Q263-E271 PolarHBondContact NE2-OE2 3.11Å
264	S	84.9	Confident	80.9	Confident	22 Å²	22	47.8 Å²	47.8	15%	0.154	28%	0.278	C	S	.	.	P	Polyproline II helix	trans	-67.9	157.7	167.8	64.5	0	0	0	0	111.3	A262 H266 E267 K268	A262-S264 PolarHBondContact O-N 2.87Å; S264-H266 PolarHBondContact O-N 2.92Å; S264-E267 WeakPolarHBondContact CB-OE2 3.45Å; S264-E267 PolarHBondContact N-OE2 2.98Å; S264-E267 PolarHBondContact O-N 2.94Å; S264-E267 VanDerWaalsContact O-N 3.13Å; S264-E267 WeakPolarHBondContact OG-CG 3.29Å; S264-E267 PolarHBondContact OG-N 3.04Å; S264-E267 PolarHBondContact OG-OE2 3.41Å; S264-K268 WeakPolarHBondContact O-CG 3.35Å; S264-K268 PolarHBondContact O-N 3.13Å; S264-K268 VanDerWaalsContact O-N 3.12Å
265	G	87.1	Confident	79.6	Confident	1 Å²	1	49 Å²	49	1%	0.01	29%	0.287	C	S	.	.	H	α-helix	trans	-59.9	-32.4	177	0	0	0	0	0	113.2	I252 V255 K268 V269	I252-G265 VanDerWaalsContact O-CA 3.27Å; I252-G265 WeakPolarHBondContact O-CA 3.41Å; V255-G265 PolarHBondContact O-N 3.41Å; G265-K268 PolarHBondContact O-N 2.9Å; G265-V269 WeakPolarHBondContact O-CB 3.29Å; G265-V269 WeakPolarHBondContact O-CG2 3.31Å; G265-V269 PolarHBondContact O-N 2.65Å
266	H	89.6	Confident	77.8	Confident	16 Å²	16	50.7 Å²	50.7	7%	0.074	30%	0.298	C	S	.	.	H	α-helix	trans	-57.8	-51.4	171.4	-179.4	-118.2	0	0	0	112.1	C253 S264 K268 V269 L270 I311 I314	C253-H266 WeakPolarHBondContact O-CA 3.47Å; C253-H266 WeakPolarHBondContact O-CB 3.41Å; C253-H266 PolarHBondContact O-N 2.78Å; C253-H266 VanDerWaalsContact O-N 3.14Å; S264-H266 PolarHBondContact O-N 2.92Å; H266-K268 PolarHBondContact O-N 3.29Å; H266-V269 PolarHBondContact O-N 2.89Å; H266-L270 WeakPolarHBondContact CE1-CD1 3.21Å; H266-L270 WeakPolarHBondContact O-CB 3.37Å; H266-L270 PolarHBondContact O-N 2.89Å; H266-I311 PolarHBondContact NE2-O 3.01Å; H266-I314 HydrophobicContact CB-CG2 3.81Å; H266-I314 WeakPolarHBondContact CD2-CG2 3.37Å; H266-I314 VanDerWaalsContact CG-CG2 3.47Å
267	E	87.1	Confident	76.1	Confident	85 Å²	85	51.9 Å²	51.9	40%	0.397	30%	0.303	S	S	.	.	H	α-helix	trans	-63.3	-40.9	-179.9	-71.5	162.1	123	0	0	111.9	Q263 S264 V269 L270 E271	Q263-E267 HydrophobicContact CB-CB 4.43Å; S264-E267 WeakPolarHBondContact CB-OE2 3.45Å; S264-E267 PolarHBondContact N-OE2 2.98Å; S264-E267 PolarHBondContact O-N 2.94Å; S264-E267 VanDerWaalsContact O-N 3.13Å; S264-E267 WeakPolarHBondContact OG-CG 3.29Å; S264-E267 PolarHBondContact OG-N 3.04Å; S264-E267 PolarHBondContact OG-OE2 3.41Å; E267-V269 VanDerWaalsContact C-N 3.34Å; E267-V269 PolarHBondContact O-N 3.38Å; E267-L270 PolarHBondContact O-N 3.03Å; E267-E271 WeakPolarHBondContact O-CB 3.28Å; E267-E271 PolarHBondContact O-N 3.09Å
268	K	87.4	Confident	74.4	Confident	18 Å²	18	58 Å²	58	8%	0.078	32%	0.324	C	S	.	.	H	α-helix	trans	-67.5	-34.2	177.8	-53.1	-157.1	86.3	177	0	112.6	L221 H223 C227 Q263 S264 G265 H266 A272	L221-K268 WeakPolarHBondContact O-CD 3.44Å; L221-K268 PolarHBondContact O-NZ 3.38Å; H223-K268 PolarHBondContact O-NZ 3.39Å; C227-K268 HydrophobicContact CB-CB 4.4Å; C227-K268 WeakPolarHBondContact CB-O 3.49Å; Q263-K268 HydrophobicContact CB-CD 4.18Å; Q263-K268 HydrophobicContact CB-CG 3.69Å; Q263-K268 VanDerWaalsContact OE1-CE 3.25Å; S264-K268 WeakPolarHBondContact O-CG 3.35Å; S264-K268 PolarHBondContact O-N 3.13Å; S264-K268 VanDerWaalsContact O-N 3.12Å; G265-K268 PolarHBondContact O-N 2.9Å; H266-K268 PolarHBondContact O-N 3.29Å; K268-A272 WeakPolarHBondContact O-CB 3.37Å; K268-A272 PolarHBondContact O-N 3.25Å
269	V	90.2	Very high	73	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-73.2	-41.5	175.3	170.3	0	0	0	0	111	L249 I252 C253 G265 H266 E267 A272 L273 L307 I311	L249-V269 HydrophobicContact CD2-CG2 4.17Å; I252-V269 HydrophobicContact CB-CG2 4.37Å; I252-V269 HydrophobicContact CG2-CG2 3.89Å; C253-V269 HydrophobicContact CB-CB 4.19Å; C253-V269 HydrophobicContact CB-CG1 4.2Å; C253-V269 HydrophobicContact CB-CG2 4.05Å; G265-V269 WeakPolarHBondContact O-CB 3.29Å; G265-V269 WeakPolarHBondContact O-CG2 3.31Å; G265-V269 PolarHBondContact O-N 2.65Å; H266-V269 PolarHBondContact O-N 2.89Å; E267-V269 VanDerWaalsContact C-N 3.34Å; E267-V269 PolarHBondContact O-N 3.38Å; V269-A272 PolarHBondContact O-N 3.11Å; V269-L273 HydrophobicContact CG1-CD1 3.86Å; V269-L273 WeakPolarHBondContact O-CB 3.38Å; V269-L273 VanDerWaalsContact O-CG 3.24Å; V269-L273 WeakPolarHBondContact O-CG 3.48Å; V269-L273 PolarHBondContact O-N 3.28Å; V269-L307 HydrophobicContact CG1-CD1 4.47Å; V269-I311 HydrophobicContact CG1-CG1 4.35Å
270	L	85.3	Confident	71.7	Confident	18 Å²	18	56 Å²	56	9%	0.094	33%	0.329	C	S	.	.	H	α-helix	trans	-61.9	-48.8	172.7	-82.2	-179.8	0	0	0	112.1	H266 E267 A272 L273 S274 I311 L324	H266-L270 WeakPolarHBondContact CE1-CD1 3.21Å; H266-L270 WeakPolarHBondContact O-CB 3.37Å; H266-L270 PolarHBondContact O-N 2.89Å; E267-L270 PolarHBondContact O-N 3.03Å; L270-A272 VanDerWaalsContact C-N 3.33Å; L270-A272 PolarHBondContact O-N 2.63Å; L270-L273 CarbonylContact O-C 3.13Å; L270-L273 PolarHBondContact O-N 3.15Å; L270-L273 VanDerWaalsContact O-N 3.08Å; L270-S274 PolarHBondContact O-N 3.37Å; L270-S274 PolarHBondContact O-OG 2.9Å; L270-I311 HydrophobicContact CD2-CG2 3.73Å; L270-L324 HydrophobicContact CD1-CD1 4.41Å; L270-L324 HydrophobicContact CD2-CD1 4.47Å; L270-L324 HydrophobicContact CD2-CD2 4.02Å
271	E	82.8	Confident	70.5	Confident	82 Å²	82	51.5 Å²	51.5	38%	0.383	33%	0.325	S	S	.	.	H	α-helix	trans	-59.4	-44.1	177.3	-177.3	172.3	-157.6	0	0	111.2	Q263 E267 L273 S274 C275	Q263-E271 PolarHBondContact NE2-OE2 3.11Å; E267-E271 WeakPolarHBondContact O-CB 3.28Å; E267-E271 PolarHBondContact O-N 3.09Å; E271-L273 VanDerWaalsContact C-N 3.29Å; E271-L273 PolarHBondContact O-N 3.44Å; E271-S274 PolarHBondContact O-N 3.37Å; E271-C275 WeakPolarHBondContact O-CB 3.48Å; E271-C275 PolarHBondContact O-N 3.38Å; E271-C275 PolarHBondContact O-SG 2.91Å
272	A	83.6	Confident	69.4	Low	5 Å²	5	55.5 Å²	55.5	4%	0.041	31%	0.312	C	S	.	.	H	α-helix	trans	-62.5	-33	175.1	0	0	0	0	0	113.5	C227 R228 V231 K268 V269 L270 K284	C227-A272 HydrophobicContact CB-CB 3.72Å; R228-A272 HydrophobicContact CB-CB 4.49Å; V231-A272 HydrophobicContact CB-CB 4.41Å; V231-A272 HydrophobicContact CG2-CB 3.91Å; K268-A272 WeakPolarHBondContact O-CB 3.37Å; K268-A272 PolarHBondContact O-N 3.25Å; V269-A272 PolarHBondContact O-N 3.11Å; L270-A272 VanDerWaalsContact C-N 3.33Å; L270-A272 PolarHBondContact O-N 2.63Å; A272-K284 PolarHBondContact O-NZ 2.73Å
273	L	81	Confident	68.6	Low	13 Å²	13	58.3 Å²	58.3	7%	0.068	32%	0.315	C	S	.	.	H	α-helix	trans	-79.4	-29.8	175.9	-73.9	169.3	0	0	0	113.3	V231 V269 L270 E271 K284 I288 I311	V231-L273 HydrophobicContact CG1-CD2 3.96Å; V231-L273 HydrophobicContact CG2-CD2 3.91Å; V231-L273 HydrophobicContact CG2-CG 4.1Å; V269-L273 HydrophobicContact CG1-CD1 3.86Å; V269-L273 WeakPolarHBondContact O-CB 3.38Å; V269-L273 VanDerWaalsContact O-CG 3.24Å; V269-L273 WeakPolarHBondContact O-CG 3.48Å; V269-L273 PolarHBondContact O-N 3.28Å; L270-L273 CarbonylContact O-C 3.13Å; L270-L273 PolarHBondContact O-N 3.15Å; L270-L273 VanDerWaalsContact O-N 3.08Å; E271-L273 VanDerWaalsContact C-N 3.29Å; E271-L273 PolarHBondContact O-N 3.44Å; L273-K284 HydrophobicContact CD2-CB 4.24Å; L273-K284 WeakPolarHBondContact O-CB 3.45Å; L273-K284 WeakPolarHBondContact O-CD 3.49Å; L273-I288 HydrophobicContact CD2-CD1 4.38Å; L273-I311 HydrophobicContact CD1-CD1 3.46Å; L273-I311 VanDerWaalsContact CD1-CD1 3.46Å; L273-I311 HydrophobicContact CD1-CG1 4.27Å
274	S	72.2	Confident	67.8	Low	34 Å²	34	54.9 Å²	54.9	24%	0.238	30%	0.299	C	S	.	.	H	α-helix	trans	-88	-31.5	178	-69.1	0	0	0	0	113.8	L270 E271 P276 Y438 D439	L270-S274 PolarHBondContact O-N 3.37Å; L270-S274 PolarHBondContact O-OG 2.9Å; E271-S274 PolarHBondContact O-N 3.37Å; S274-P276 WeakPolarHBondContact O-CD 3.2Å; S274-P276 VanDerWaalsContact O-N 3.15Å; S274-Y438 WeakPolarHBondContact CB-O 3.4Å; S274-Y438 WeakPolarHBondContact OG-CB 3.49Å; S274-Y438 PolarHBondContact OG-O 3.06Å; S274-D439 VanDerWaalsContact O-O 3.09Å
275	C	63	Low	67.2	Low	29 Å²	29	54.5 Å²	54.5	20%	0.196	30%	0.295	C	S	.	.	S	Bend	trans	-53	123.6	177.2	-79.1	0	0	0	0	111	E271 N277 K284	E271-C275 WeakPolarHBondContact O-CB 3.48Å; E271-C275 PolarHBondContact O-N 3.38Å; E271-C275 PolarHBondContact O-SG 2.91Å; C275-N277 PolarHBondContact O-N 2.98Å; C275-K284 WeakPolarHBondContact O-CD 3.45Å; C275-K284 VanDerWaalsContact O-CE 3.23Å; C275-K284 WeakPolarHBondContact O-CE 3.47Å; C275-K284 PolarHBondContact O-NZ 2.78Å
276	P	49.8	Very low	66.8	Low	38 Å²	38	56.5 Å²	56.5	25%	0.247	31%	0.311	C	S	.	.	P	Polyproline II helix	trans	-60.8	139.4	175.2	23.4	-32.2	0	0	0	110.6	S274 Q443	S274-P276 WeakPolarHBondContact O-CD 3.2Å; S274-P276 VanDerWaalsContact O-N 3.15Å; P276-Q443 HydrophobicContact CG-CG 3.84Å
277	N	47.7	Very low	66.4	Low	50 Å²	50	56.9 Å²	56.9	27%	0.267	32%	0.315	S	S	.	.	P	Polyproline II helix	trans	-83	122.1	161.3	-76	-11.2	0	0	0	106.7	C275 S279 K284	C275-N277 PolarHBondContact O-N 2.98Å; N277-S279 PolarHBondContact O-N 2.71Å; N277-K284 WeakPolarHBondContact ND2-CE 3.42Å; N277-K284 WeakPolarHBondContact OD1-CE 3.34Å; N277-K284 PolarHBondContact OD1-NZ 3.43Å
278	E	45.2	Very low	66.5	Low	173 Å²	173	52.8 Å²	52.8	81%	0.808	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-20.7	-174.7	-60.3	172.1	131.5	0	0	113.7
279	S	44.2	Very low	66.4	Low	103 Å²	103	52.7 Å²	52.7	72%	0.72	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.1	-9.2	-166.1	44.1	0	0	0	0	116.2	N277	N277-S279 PolarHBondContact O-N 2.71Å
280	D	43.4	Very low	66.3	Low	82 Å²	82	55 Å²	55	44%	0.439	32%	0.316	S	S	.	.			trans	-158.2	135.3	173.4	-153.3	-24.4	0	0	0	112.6	R282	D280-R282 HydrophobicContact CB-CG 4.26Å; D280-R282 PolarHBondContact O-N 2.93Å; D280-R282 IonicContact OD1-NE 3.45Å; D280-R282 IonicContact OD2-CZ 2.77Å; D280-R282 IonicContact OD2-NE 3.55Å; D280-R282 PolarHBondContact OD2-NE 2.88Å; D280-R282 IonicContact OD2-NH2 2.62Å; D280-R282 PolarHBondContact OD2-NH2 3.49Å
281	G	39.4	Very low	66.5	Low	83 Å²	83	54.1 Å²	54.1	86%	0.856	31%	0.311	S	S	*	.			trans	-74.2	22.2	-173.9	0	0	0	0	0	115.2	K283	G281-K283 PolarHBondContact O-N 3.27Å
282	R	43.3	Very low	66.9	Low	173 Å²	173	50.3 Å²	50.3	65%	0.653	29%	0.293	S	S	*	.			trans	-73.9	120.6	-179.4	-55.2	-177.3	-161.2	-175.2	9.3	109.3	D280 K284	D280-R282 HydrophobicContact CB-CG 4.26Å; D280-R282 PolarHBondContact O-N 2.93Å; D280-R282 IonicContact OD1-NE 3.45Å; D280-R282 IonicContact OD2-CZ 2.77Å; D280-R282 IonicContact OD2-NE 3.55Å; D280-R282 PolarHBondContact OD2-NE 2.88Å; D280-R282 IonicContact OD2-NH2 2.62Å; D280-R282 PolarHBondContact OD2-NH2 3.49Å; R282-K284 PolarHBondContact O-N 2.88Å
283	K	55.6	Low	67.1	Low	108 Å²	108	52.5 Å²	52.5	47%	0.47	31%	0.312	S	S	.	.			trans	-49.7	127.4	160.8	-64	-174	179.1	-170.4	0	107.6	G281 L285 A286 Y440	G281-K283 PolarHBondContact O-N 3.27Å; K283-L285 PolarHBondContact O-N 3.46Å; K283-L285 VanDerWaalsContact O-N 3.12Å; K283-A286 HydrophobicContact CB-CB 4.48Å; K283-A286 WeakPolarHBondContact O-CB 3.28Å; K283-A286 PolarHBondContact O-N 2.89Å; K283-Y440 HydrophobicContact CB-CE1 4.01Å; K283-Y440 HydrophobicContact CD-CE1 4.22Å; K283-Y440 HydrophobicContact CG-CD1 4.21Å; K283-Y440 HydrophobicContact CG-CE1 4.01Å
284	K	60.2	Low	67.5	Low	19 Å²	19	53.3 Å²	53.3	8%	0.083	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-11.3	-174.5	-80.8	177.1	156.8	-179.1	0	115	V231 A272 L273 C275 N277 R282 A286 P287	V231-K284 HydrophobicContact CG1-CD 3.9Å; V231-K284 HydrophobicContact CG1-CG 4.45Å; A272-K284 PolarHBondContact O-NZ 2.73Å; L273-K284 HydrophobicContact CD2-CB 4.24Å; L273-K284 WeakPolarHBondContact O-CB 3.45Å; L273-K284 WeakPolarHBondContact O-CD 3.49Å; C275-K284 WeakPolarHBondContact O-CD 3.45Å; C275-K284 VanDerWaalsContact O-CE 3.23Å; C275-K284 WeakPolarHBondContact O-CE 3.47Å; C275-K284 PolarHBondContact O-NZ 2.78Å; N277-K284 WeakPolarHBondContact ND2-CE 3.42Å; N277-K284 WeakPolarHBondContact OD1-CE 3.34Å; N277-K284 PolarHBondContact OD1-NZ 3.43Å; R282-K284 PolarHBondContact O-N 2.88Å; K284-A286 VanDerWaalsContact C-N 3.33Å; K284-P287 WeakPolarHBondContact O-CD 3.48Å
285	L	73.5	Confident	68.1	Low	14 Å²	14	56 Å²	56	7%	0.073	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-19.6	166.3	-51.5	-171.8	0	0	0	112.9	K283 I288 L289 F328 A331 Y440	K283-L285 PolarHBondContact O-N 3.46Å; K283-L285 VanDerWaalsContact O-N 3.12Å; L285-I288 WeakPolarHBondContact O-CB 3.37Å; L285-I288 PolarHBondContact O-N 3.1Å; L285-I288 VanDerWaalsContact O-N 3.13Å; L285-L289 HydrophobicContact CB-CD1 4.25Å; L285-L289 WeakPolarHBondContact O-CG 3.48Å; L285-L289 PolarHBondContact O-N 3.17Å; L285-F328 HydrophobicContact CB-CE1 4.4Å; L285-F328 HydrophobicContact CD1-CD1 3.99Å; L285-F328 HydrophobicContact CD1-CE1 3.89Å; L285-F328 HydrophobicContact CD1-CG 4.38Å; L285-F328 HydrophobicContact CD1-CZ 4.21Å; L285-F328 HydrophobicContact CD2-CE1 3.79Å; L285-F328 HydrophobicContact CD2-CZ 3.75Å; L285-F328 HydrophobicContact CG-CE1 4.24Å; L285-A331 HydrophobicContact CD1-CB 4.39Å; L285-Y440 VanDerWaalsContact CD1-OH 3.28Å; L285-Y440 WeakPolarHBondContact CD1-OH 3.42Å
286	A	77.4	Confident	69.3	Low	43 Å²	43	60.8 Å²	60.8	36%	0.355	35%	0.354	S	S	.	.	H	α-helix	trans	-64.1	-38.7	-174.2	0	0	0	0	0	114.4	K283 K284 I288 L289 A290	K283-A286 HydrophobicContact CB-CB 4.48Å; K283-A286 WeakPolarHBondContact O-CB 3.28Å; K283-A286 PolarHBondContact O-N 2.89Å; K284-A286 VanDerWaalsContact C-N 3.33Å; A286-I288 VanDerWaalsContact C-N 3.35Å; A286-L289 PolarHBondContact O-N 3.2Å; A286-A290 WeakPolarHBondContact O-CB 3.47Å; A286-A290 PolarHBondContact O-N 3.22Å
287	P	82.1	Confident	71.3	Confident	24 Å²	24	60.4 Å²	60.4	16%	0.156	35%	0.35	C	S	.	.	H	α-helix	trans	-58.6	-45.2	169.4	-24.8	35.1	0	0	0	112.2	L234 V236 M242 K284 L289 A290 A291	L234-P287 HydrophobicContact CB-CB 4.2Å; V236-P287 HydrophobicContact CG2-CB 4.24Å; M242-P287 HydrophobicContact CE-CB 4.24Å; M242-P287 WeakPolarHBondContact CE-O 3.41Å; K284-P287 WeakPolarHBondContact O-CD 3.48Å; P287-L289 PolarHBondContact O-N 2.99Å; P287-A290 PolarHBondContact O-N 3.42Å; P287-A291 WeakPolarHBondContact O-CB 3.46Å; P287-A291 PolarHBondContact O-N 3.03Å
288	I	88.3	Confident	73.4	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-62.4	-44.3	-179.1	-53.6	172.6	0	0	0	110.4	L234 L273 L285 A286 A291 L292 C304 L307 V308	L234-I288 HydrophobicContact CD1-CG1 4.44Å; L273-I288 HydrophobicContact CD2-CD1 4.38Å; L285-I288 WeakPolarHBondContact O-CB 3.37Å; L285-I288 PolarHBondContact O-N 3.1Å; L285-I288 VanDerWaalsContact O-N 3.13Å; A286-I288 VanDerWaalsContact C-N 3.35Å; I288-A291 PolarHBondContact O-N 3.47Å; I288-L292 HydrophobicContact CG2-CD1 4.24Å; I288-L292 WeakPolarHBondContact O-CG 3.18Å; I288-L292 PolarHBondContact O-N 3.16Å; I288-C304 HydrophobicContact CG2-CB 3.92Å; I288-L307 HydrophobicContact CD1-CD2 3.79Å; I288-L307 HydrophobicContact CG1-CD2 4.45Å; I288-V308 HydrophobicContact CG2-CG2 4.35Å
289	L	87	Confident	75.6	Confident	15 Å²	15	54.5 Å²	54.5	8%	0.079	33%	0.334	C	S	.	.	H	α-helix	trans	-71.4	-37.7	178.3	-67.3	168.2	0	0	0	112.7	L285 A286 P287 A291 L292 A293 A331 L333	L285-L289 HydrophobicContact CB-CD1 4.25Å; L285-L289 WeakPolarHBondContact O-CG 3.48Å; L285-L289 PolarHBondContact O-N 3.17Å; A286-L289 PolarHBondContact O-N 3.2Å; P287-L289 PolarHBondContact O-N 2.99Å; L289-A291 VanDerWaalsContact C-N 3.29Å; L289-A291 PolarHBondContact O-N 3.18Å; L289-L292 HydrophobicContact CD2-CD1 4.23Å; L289-L292 PolarHBondContact O-N 2.89Å; L289-A293 PolarHBondContact O-N 3.43Å; L289-A331 HydrophobicContact CD1-CB 3.54Å; L289-A331 WeakPolarHBondContact CD1-O 3.41Å; L289-L333 HydrophobicContact CD2-CB 3.97Å
290	A	87.2	Confident	78	Confident	49 Å²	49	49.6 Å²	49.6	41%	0.405	30%	0.3	S	S	.	.	H	α-helix	trans	-63.8	-36.1	172.8	0	0	0	0	0	111.8	V236 A286 P287 A293	V236-A290 HydrophobicContact CG2-CB 4.22Å; A286-A290 WeakPolarHBondContact O-CB 3.47Å; A286-A290 PolarHBondContact O-N 3.22Å; P287-A290 PolarHBondContact O-N 3.42Å; A290-A293 PolarHBondContact O-N 2.89Å
291	A	89.1	Confident	80.4	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-71.6	-36.2	173.5	0	0	0	0	0	113.2	M242 P287 I288 L289 A293 I294 L300	M242-A291 HydrophobicContact CE-CB 3.53Å; M242-A291 HydrophobicContact SD-CB 3.69Å; P287-A291 WeakPolarHBondContact O-CB 3.46Å; P287-A291 PolarHBondContact O-N 3.03Å; I288-A291 PolarHBondContact O-N 3.47Å; L289-A291 VanDerWaalsContact C-N 3.29Å; L289-A291 PolarHBondContact O-N 3.18Å; A291-A293 PolarHBondContact O-N 3.25Å; A291-I294 WeakPolarHBondContact O-CB 3.19Å; A291-I294 PolarHBondContact O-N 3.06Å; A291-L300 HydrophobicContact CB-CD1 4.06Å; A291-L300 HydrophobicContact CB-CD2 3.87Å; A291-L300 HydrophobicContact CB-CG 3.93Å
292	L	91.5	Very high	83.1	Confident	1 Å²	1	42.5 Å²	42.5	1%	0.005	24%	0.242	C	C	.	.	H	α-helix	trans	-64.4	-27.2	171.5	-76.4	161.2	0	0	0	112.6	I288 L289 I294 Q301 C304 M305 V308 L333 L336 L340	I288-L292 HydrophobicContact CG2-CD1 4.24Å; I288-L292 WeakPolarHBondContact O-CG 3.18Å; I288-L292 PolarHBondContact O-N 3.16Å; L289-L292 HydrophobicContact CD2-CD1 4.23Å; L289-L292 PolarHBondContact O-N 2.89Å; L292-I294 VanDerWaalsContact C-N 3.28Å; L292-I294 PolarHBondContact O-N 3.25Å; L292-Q301 HydrophobicContact CD2-CB 4.4Å; L292-Q301 VanDerWaalsContact CD2-O 3.29Å; L292-Q301 WeakPolarHBondContact CD2-O 3.39Å; L292-Q301 PolarHBondContact O-NE2 3.23Å; L292-C304 HydrophobicContact CD1-CB 4.22Å; L292-C304 HydrophobicContact CD2-CB 3.81Å; L292-C304 HydrophobicContact CG-CB 3.67Å; L292-M305 HydrophobicContact CD2-CB 4.31Å; L292-M305 HydrophobicContact CD2-SD 4.42Å; L292-V308 HydrophobicContact CD1-CG2 4.3Å; L292-L333 HydrophobicContact CD1-CD1 4.16Å; L292-L336 HydrophobicContact CB-CD1 3.72Å; L292-L340 HydrophobicContact CD2-CD1 4.07Å; L292-L340 HydrophobicContact CD2-CD2 4.17Å
293	A	89.1	Confident	85.5	Confident	52 Å²	52	34.2 Å²	34.2	43%	0.43	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-7.2	175	0	0	0	0	0	114.5	L289 A290 A291 T295 L336	L289-A293 PolarHBondContact O-N 3.43Å; A290-A293 PolarHBondContact O-N 2.89Å; A291-A293 PolarHBondContact O-N 3.25Å; A293-T295 PolarHBondContact O-N 3.46Å; A293-L336 HydrophobicContact CB-CD1 4.49Å; A293-L336 HydrophobicContact CB-CD2 4.01Å
294	I	88.9	Confident	87.4	Confident	30 Å²	30	29.1 Å²	29.1	15%	0.154	19%	0.189	C	C	.	.			trans	-84.4	93.2	178.4	-65.1	177.6	0	0	0	109.3	V236 A291 L292 D296 N297 L300 Q301	V236-I294 HydrophobicContact CG1-CD1 3.52Å; A291-I294 WeakPolarHBondContact O-CB 3.19Å; A291-I294 PolarHBondContact O-N 3.06Å; L292-I294 VanDerWaalsContact C-N 3.28Å; L292-I294 PolarHBondContact O-N 3.25Å; I294-D296 VanDerWaalsContact C-N 3.33Å; I294-D296 WeakPolarHBondContact CG2-OD1 3.47Å; I294-D296 PolarHBondContact O-N 3.03Å; I294-N297 HydrophobicContact CG2-CB 4.12Å; I294-N297 PolarHBondContact O-N 3.47Å; I294-L300 HydrophobicContact CB-CD2 4.3Å; I294-L300 HydrophobicContact CD1-CD2 4.01Å; I294-L300 HydrophobicContact CG2-CD2 4.41Å; I294-Q301 WeakPolarHBondContact O-CG 3.43Å; I294-Q301 PolarHBondContact O-NE2 2.91Å
295	T	84.8	Confident	89	Confident	91 Å²	91	28.2 Å²	28.2	56%	0.558	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.2	-18.3	-173.6	53.5	0	0	0	0	114.8	A293 N297 I339	A293-T295 PolarHBondContact O-N 3.46Å; T295-N297 VanDerWaalsContact C-N 3.31Å; T295-I339 HydrophobicContact CG2-CG2 3.68Å
296	D	87.9	Confident	90.1	Very high	128 Å²	128	27.5 Å²	27.5	68%	0.684	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-9	178	56.9	-59.8	0	0	0	113.6	I294	I294-D296 VanDerWaalsContact C-N 3.33Å; I294-D296 WeakPolarHBondContact CG2-OD1 3.47Å; I294-D296 PolarHBondContact O-N 3.03Å
297	N	91.8	Very high	90.9	Very high	30 Å²	30	25.5 Å²	25.5	16%	0.16	16%	0.164	C	C	.	.			trans	-126.6	81.5	177.6	-169	-16.3	0	0	0	112.5	Q239 I294 T295 A299 L300 Q301	Q239-N297 PolarHBondContact OE1-ND2 2.93Å; I294-N297 HydrophobicContact CG2-CB 4.12Å; I294-N297 PolarHBondContact O-N 3.47Å; T295-N297 VanDerWaalsContact C-N 3.31Å; N297-A299 PolarHBondContact O-N 2.82Å; N297-A299 VanDerWaalsContact O-N 3.17Å; N297-A299 WeakPolarHBondContact OD1-CB 3.21Å; N297-A299 PolarHBondContact OD1-N 2.98Å; N297-L300 HydrophobicContact CB-CB 4Å; N297-L300 WeakPolarHBondContact O-CB 3.44Å; N297-L300 PolarHBondContact O-N 2.62Å; N297-L300 VanDerWaalsContact O-N 3.1Å; N297-L300 PolarHBondContact OD1-N 2.72Å; N297-Q301 PolarHBondContact O-N 2.93Å; N297-Q301 VanDerWaalsContact O-N 3.11Å
298	P	90.8	Very high	91.5	Very high	49 Å²	49	24.3 Å²	24.3	32%	0.318	16%	0.157	S	C	.	.	H	α-helix	trans	-63.6	-21.2	178.2	25.5	-34.6	0	0	0	113.5	N302	P298-N302 WeakPolarHBondContact O-CB 3.42Å; P298-N302 PolarHBondContact O-N 2.98Å
299	A	92	Very high	91.8	Very high	51 Å²	51	24.3 Å²	24.3	42%	0.421	16%	0.157	S	C	.	.	H	α-helix	trans	-72.2	-35.7	175	0	0	0	0	0	112.1	I243 N297 A303	I243-A299 HydrophobicContact CD1-CB 4.37Å; N297-A299 PolarHBondContact O-N 2.82Å; N297-A299 VanDerWaalsContact O-N 3.17Å; N297-A299 WeakPolarHBondContact OD1-CB 3.21Å; N297-A299 PolarHBondContact OD1-N 2.98Å; A299-A303 VanDerWaalsContact O-CB 3.22Å; A299-A303 WeakPolarHBondContact O-CB 3.45Å; A299-A303 PolarHBondContact O-N 3.49Å
300	L	94.3	Very high	92.1	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-67	-47.3	169.9	178.7	65.5	0	0	0	111	Q239 M242 I243 A291 I294 N297 N302 A303 C304	Q239-L300 HydrophobicContact CB-CD2 4.13Å; Q239-L300 HydrophobicContact CG-CD2 3.88Å; M242-L300 HydrophobicContact CB-CD1 4.12Å; M242-L300 HydrophobicContact CG-CD1 4.07Å; M242-L300 HydrophobicContact SD-CD1 4.16Å; I243-L300 HydrophobicContact CD1-CB 4.14Å; I243-L300 HydrophobicContact CG1-CB 4.01Å; I243-L300 HydrophobicContact CG1-CD1 3.85Å; A291-L300 HydrophobicContact CB-CD1 4.06Å; A291-L300 HydrophobicContact CB-CD2 3.87Å; A291-L300 HydrophobicContact CB-CG 3.93Å; I294-L300 HydrophobicContact CB-CD2 4.3Å; I294-L300 HydrophobicContact CD1-CD2 4.01Å; I294-L300 HydrophobicContact CG2-CD2 4.41Å; N297-L300 HydrophobicContact CB-CB 4Å; N297-L300 WeakPolarHBondContact O-CB 3.44Å; N297-L300 PolarHBondContact O-N 2.62Å; N297-L300 VanDerWaalsContact O-N 3.1Å; N297-L300 PolarHBondContact OD1-N 2.72Å; L300-N302 PolarHBondContact O-N 3.31Å; L300-A303 PolarHBondContact O-N 3.47Å; L300-C304 WeakPolarHBondContact O-CB 3.35Å; L300-C304 PolarHBondContact O-N 3.31Å; L300-C304 PolarHBondContact O-SG 3.49Å; L300-C304 VanDerWaalsContact O-SG 3.35Å
301	Q	94.7	Very high	92.3	Very high	4 Å²	4	21.4 Å²	21.4	2%	0.019	13%	0.134	C	C	.	.	H	α-helix	trans	-57.7	-48.1	176.9	-64.7	-177.8	-50.5	0	0	111.7	L292 I294 N297 C304 M305 L340 L348	L292-Q301 HydrophobicContact CD2-CB 4.4Å; L292-Q301 VanDerWaalsContact CD2-O 3.29Å; L292-Q301 WeakPolarHBondContact CD2-O 3.39Å; L292-Q301 PolarHBondContact O-NE2 3.23Å; I294-Q301 WeakPolarHBondContact O-CG 3.43Å; I294-Q301 PolarHBondContact O-NE2 2.91Å; N297-Q301 PolarHBondContact O-N 2.93Å; N297-Q301 VanDerWaalsContact O-N 3.11Å; Q301-C304 PolarHBondContact O-N 3.35Å; Q301-M305 WeakPolarHBondContact O-CB 3.34Å; Q301-M305 PolarHBondContact O-N 2.84Å; Q301-L340 HydrophobicContact CB-CD2 3.99Å; Q301-L340 HydrophobicContact CG-CD2 4.09Å; Q301-L348 HydrophobicContact CB-CD1 4.13Å; Q301-L348 HydrophobicContact CB-CD2 3.76Å
302	N	94.9	Very high	92.4	Very high	11 Å²	11	21.7 Å²	21.7	6%	0.059	14%	0.136	C	C	.	.	H	α-helix	trans	-59.6	-48.7	176.5	-179.9	16.1	0	0	0	111.5	P298 L300 C304 M305 Q306 D347 L348 Q351	P298-N302 WeakPolarHBondContact O-CB 3.42Å; P298-N302 PolarHBondContact O-N 2.98Å; L300-N302 PolarHBondContact O-N 3.31Å; N302-C304 VanDerWaalsContact C-N 3.33Å; N302-C304 PolarHBondContact O-N 2.76Å; N302-M305 PolarHBondContact O-N 2.78Å; N302-M305 VanDerWaalsContact O-N 3.11Å; N302-Q306 WeakPolarHBondContact O-CG 3.33Å; N302-Q306 PolarHBondContact O-N 3.35Å; N302-Q306 PolarHBondContact OD1-NE2 2.93Å; N302-D347 WeakPolarHBondContact ND2-CB 3.24Å; N302-L348 HydrophobicContact CB-CB 4.33Å; N302-Q351 VanDerWaalsContact OD1-CG 3.29Å; N302-Q351 WeakPolarHBondContact OD1-CG 3.44Å
303	A	94.6	Very high	92.3	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-60.3	-39.6	178.5	0	0	0	0	0	112.7	I243 V246 K247 A299 L300 L307	I243-A303 HydrophobicContact CG1-CB 4.4Å; I243-A303 HydrophobicContact CG2-CB 4.27Å; V246-A303 VanDerWaalsContact CG2-C 3.42Å; V246-A303 HydrophobicContact CG2-CB 3.53Å; V246-A303 WeakPolarHBondContact CG2-O 3.49Å; K247-A303 HydrophobicContact CD-CB 4.43Å; K247-A303 HydrophobicContact CG-CB 4.07Å; A299-A303 VanDerWaalsContact O-CB 3.22Å; A299-A303 WeakPolarHBondContact O-CB 3.45Å; A299-A303 PolarHBondContact O-N 3.49Å; L300-A303 PolarHBondContact O-N 3.47Å; A303-L307 PolarHBondContact O-N 2.99Å
304	C	95.1	Very high	92.2	Very high	0 Å²	0	21 Å²	21	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-68.4	-39	173.7	-69	0	0	0	0	112.1	I288 L292 L300 Q301 N302 L307 V308	I288-C304 HydrophobicContact CG2-CB 3.92Å; L292-C304 HydrophobicContact CD1-CB 4.22Å; L292-C304 HydrophobicContact CD2-CB 3.81Å; L292-C304 HydrophobicContact CG-CB 3.67Å; L300-C304 WeakPolarHBondContact O-CB 3.35Å; L300-C304 PolarHBondContact O-N 3.31Å; L300-C304 PolarHBondContact O-SG 3.49Å; L300-C304 VanDerWaalsContact O-SG 3.35Å; Q301-C304 PolarHBondContact O-N 3.35Å; N302-C304 VanDerWaalsContact C-N 3.33Å; N302-C304 PolarHBondContact O-N 2.76Å; C304-L307 WeakPolarHBondContact O-CB 3.33Å; C304-L307 PolarHBondContact O-N 2.83Å; C304-V308 WeakPolarHBondContact O-CG2 3.45Å; C304-V308 PolarHBondContact O-N 3.28Å
305	M	94.6	Very high	92	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-68.9	-33.8	178.3	-158.2	66.9	-154.8	0	0	112.5	L292 Q301 N302 L307 V308 N309 L333 L348 Q351 V352 F355	L292-M305 HydrophobicContact CD2-CB 4.31Å; L292-M305 HydrophobicContact CD2-SD 4.42Å; Q301-M305 WeakPolarHBondContact O-CB 3.34Å; Q301-M305 PolarHBondContact O-N 2.84Å; N302-M305 PolarHBondContact O-N 2.78Å; N302-M305 VanDerWaalsContact O-N 3.11Å; M305-L307 VanDerWaalsContact C-N 3.29Å; M305-L307 PolarHBondContact O-N 3.33Å; M305-V308 HydrophobicContact CE-CB 4.3Å; M305-V308 HydrophobicContact CE-CG1 3.99Å; M305-V308 PolarHBondContact O-N 3.48Å; M305-V308 HydrophobicContact SD-CB 4.33Å; M305-N309 WeakPolarHBondContact O-CB 3.47Å; M305-N309 PolarHBondContact O-N 3.31Å; M305-L333 HydrophobicContact CE-CD2 4.35Å; M305-L333 HydrophobicContact SD-CD1 4.29Å; M305-L348 HydrophobicContact CB-CD1 4.2Å; M305-Q351 HydrophobicContact CB-CB 3.91Å; M305-Q351 HydrophobicContact CG-CB 3.68Å; M305-V352 HydrophobicContact CG-CG2 4.34Å; M305-F355 HydrophobicContact CE-CB 3.37Å; M305-F355 HydrophobicContact CE-CD1 4.02Å; M305-F355 HydrophobicContact CE-CD2 3.73Å; M305-F355 HydrophobicContact CE-CG 3.43Å; M305-F355 VanDerWaalsContact CE-CG 3.43Å
306	Q	95.4	Very high	91.6	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-57.7	-40.8	169.5	-72.4	174	-5.2	0	0	111.7	N302 A310 Q351 S1057	N302-Q306 WeakPolarHBondContact O-CG 3.33Å; N302-Q306 PolarHBondContact O-N 3.35Å; N302-Q306 PolarHBondContact OD1-NE2 2.93Å; Q306-A310 WeakPolarHBondContact O-CB 3.48Å; Q306-A310 PolarHBondContact O-N 2.98Å; Q306-Q351 HydrophobicContact CG-CG 3.96Å; Q306-S1057 PolarHBondContact NE2-OG 3.45Å
307	L	95.5	Very high	91.3	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-70	-41.2	175.8	179	58.8	0	0	0	112.4	V246 L249 A250 V269 I288 A303 C304 M305 N309 A310 I311	V246-L307 HydrophobicContact CB-CB 4.33Å; V246-L307 HydrophobicContact CB-CD2 3.87Å; V246-L307 HydrophobicContact CG1-CD2 3.93Å; L249-L307 HydrophobicContact CB-CD1 3.83Å; L249-L307 HydrophobicContact CB-CD2 4.21Å; L249-L307 HydrophobicContact CD1-CD2 4.37Å; A250-L307 HydrophobicContact CB-CB 4.13Å; A250-L307 HydrophobicContact CB-CD1 4.21Å; V269-L307 HydrophobicContact CG1-CD1 4.47Å; I288-L307 HydrophobicContact CD1-CD2 3.79Å; I288-L307 HydrophobicContact CG1-CD2 4.45Å; A303-L307 PolarHBondContact O-N 2.99Å; C304-L307 WeakPolarHBondContact O-CB 3.33Å; C304-L307 PolarHBondContact O-N 2.83Å; M305-L307 VanDerWaalsContact C-N 3.29Å; M305-L307 PolarHBondContact O-N 3.33Å; L307-N309 VanDerWaalsContact C-N 3.34Å; L307-N309 PolarHBondContact O-N 3.13Å; L307-A310 PolarHBondContact O-N 3.2Å; L307-I311 HydrophobicContact CD1-CD1 3.76Å; L307-I311 HydrophobicContact CD1-CG1 4.05Å; L307-I311 HydrophobicContact CG-CD1 3.79Å; L307-I311 WeakPolarHBondContact O-CD1 3.48Å; L307-I311 VanDerWaalsContact O-CG1 3.27Å; L307-I311 WeakPolarHBondContact O-CG1 3.42Å; L307-I311 PolarHBondContact O-N 2.98Å
308	V	93.5	Very high	90.8	Very high	0 Å²	0	14.5 Å²	14.5	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-57.7	-48.3	173	174.9	0	0	0	0	110.4	I288 L292 C304 M305 I311 V312 F328 L333 F355	I288-V308 HydrophobicContact CG2-CG2 4.35Å; L292-V308 HydrophobicContact CD1-CG2 4.3Å; C304-V308 WeakPolarHBondContact O-CG2 3.45Å; C304-V308 PolarHBondContact O-N 3.28Å; M305-V308 HydrophobicContact CE-CB 4.3Å; M305-V308 HydrophobicContact CE-CG1 3.99Å; M305-V308 PolarHBondContact O-N 3.48Å; M305-V308 HydrophobicContact SD-CB 4.33Å; V308-I311 PolarHBondContact O-N 3.11Å; V308-V312 HydrophobicContact CG1-CG2 4.35Å; V308-V312 WeakPolarHBondContact O-CB 3.28Å; V308-V312 WeakPolarHBondContact O-CG2 3.33Å; V308-V312 PolarHBondContact O-N 2.9Å; V308-F328 HydrophobicContact CG1-CD1 4.31Å; V308-F328 HydrophobicContact CG1-CD2 4.19Å; V308-F328 HydrophobicContact CG1-CE1 4.48Å; V308-F328 HydrophobicContact CG1-CE2 4.35Å; V308-F328 HydrophobicContact CG1-CG 4.17Å; V308-F328 HydrophobicContact CG1-CZ 4.49Å; V308-F328 HydrophobicContact CG2-CD1 4.06Å; V308-F328 HydrophobicContact CG2-CE1 3.75Å; V308-F328 HydrophobicContact CG2-CZ 4.14Å; V308-L333 HydrophobicContact CG1-CD2 4.07Å; V308-F355 HydrophobicContact CG1-CD2 3.99Å; V308-F355 HydrophobicContact CG1-CE2 3.88Å
309	N	94.8	Very high	90.4	Very high	0 Å²	0	15.6 Å²	15.6	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-62.7	-42.8	177.6	-75.7	-17.8	0	0	0	112.1	M305 L307 I311 V312 I313 Q351 F355 F1062	M305-N309 WeakPolarHBondContact O-CB 3.47Å; M305-N309 PolarHBondContact O-N 3.31Å; L307-N309 VanDerWaalsContact C-N 3.34Å; L307-N309 PolarHBondContact O-N 3.13Å; N309-I311 PolarHBondContact O-N 3.49Å; N309-V312 PolarHBondContact O-N 3.09Å; N309-I313 HydrophobicContact CB-CD1 3.92Å; N309-I313 VanDerWaalsContact O-CB 3.24Å; N309-I313 WeakPolarHBondContact O-CB 3.24Å; N309-I313 WeakPolarHBondContact O-CG1 3.34Å; N309-I313 PolarHBondContact O-N 3.47Å; N309-Q351 PolarHBondContact ND2-O 3.35Å; N309-Q351 PolarHBondContact ND2-OE1 3.46Å; N309-F355 VanDerWaalsContact OD1-CB 3.3Å; N309-F355 WeakPolarHBondContact OD1-CB 3.33Å; N309-F1062 HydrophobicContact CB-CE1 3.8Å; N309-F1062 HydrophobicContact CB-CE2 3.95Å; N309-F1062 HydrophobicContact CB-CZ 3.42Å; N309-F1062 VanDerWaalsContact CB-CZ 3.42Å
310	A	94.1	Very high	89.9	Confident	0 Å²	0	14.7 Å²	14.7	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-59.4	-45.4	175.2	0	0	0	0	0	112.2	A250 C253 V254 Q306 L307 I314 L1056	A250-A310 HydrophobicContact CB-CB 4.17Å; C253-A310 HydrophobicContact CB-CB 3.93Å; V254-A310 HydrophobicContact CG1-CB 3.94Å; Q306-A310 WeakPolarHBondContact O-CB 3.48Å; Q306-A310 PolarHBondContact O-N 2.98Å; L307-A310 PolarHBondContact O-N 3.2Å; A310-I314 WeakPolarHBondContact O-CB 3.45Å; A310-I314 WeakPolarHBondContact O-CG2 3.48Å; A310-L1056 HydrophobicContact CB-CD2 4.36Å
311	I	91.4	Very high	89.6	Confident	2 Å²	2	14.8 Å²	14.8	1%	0.01	8%	0.079	C	C	.	.	H	α-helix	trans	-67.7	-43.9	179.8	-66.3	160.8	0	0	0	111.9	H266 V269 L270 L273 L307 V308 N309 L324 F328	H266-I311 PolarHBondContact NE2-O 3.01Å; V269-I311 HydrophobicContact CG1-CG1 4.35Å; L270-I311 HydrophobicContact CD2-CG2 3.73Å; L273-I311 HydrophobicContact CD1-CD1 3.46Å; L273-I311 VanDerWaalsContact CD1-CD1 3.46Å; L273-I311 HydrophobicContact CD1-CG1 4.27Å; L307-I311 HydrophobicContact CD1-CD1 3.76Å; L307-I311 HydrophobicContact CD1-CG1 4.05Å; L307-I311 HydrophobicContact CG-CD1 3.79Å; L307-I311 WeakPolarHBondContact O-CD1 3.48Å; L307-I311 VanDerWaalsContact O-CG1 3.27Å; L307-I311 WeakPolarHBondContact O-CG1 3.42Å; L307-I311 PolarHBondContact O-N 2.98Å; V308-I311 PolarHBondContact O-N 3.11Å; N309-I311 PolarHBondContact O-N 3.49Å; I311-L324 HydrophobicContact CG2-CD1 4.37Å; I311-F328 HydrophobicContact CB-CE2 4.29Å; I311-F328 HydrophobicContact CD1-CE2 4.48Å; I311-F328 HydrophobicContact CD1-CZ 3.98Å; I311-F328 HydrophobicContact CG2-CE2 3.95Å; I311-F328 HydrophobicContact CG2-CZ 4.48Å
312	V	90.3	Very high	89.1	Confident	7 Å²	7	15.4 Å²	15.4	4%	0.042	8%	0.082	C	C	.	.	H	α-helix	trans	-82.2	-40.7	-172.4	175.5	0	0	0	0	112.3	V308 N309 R321 L324 F328 F355	V308-V312 HydrophobicContact CG1-CG2 4.35Å; V308-V312 WeakPolarHBondContact O-CB 3.28Å; V308-V312 WeakPolarHBondContact O-CG2 3.33Å; V308-V312 PolarHBondContact O-N 2.9Å; N309-V312 PolarHBondContact O-N 3.09Å; V312-R321 VanDerWaalsContact O-CD 3.31Å; V312-R321 WeakPolarHBondContact O-CD 3.46Å; V312-R321 WeakPolarHBondContact O-CG 3.23Å; V312-L324 HydrophobicContact CG2-CB 4.14Å; V312-F328 HydrophobicContact CG2-CD2 3.61Å; V312-F328 HydrophobicContact CG2-CE2 3.84Å; V312-F355 HydrophobicContact CG1-CE2 4.42Å; V312-F355 HydrophobicContact CG2-CE2 4.37Å
313	I	90.4	Very high	88.5	Confident	3 Å²	3	16.7 Å²	16.7	2%	0.015	9%	0.088	C	C	.	.	H	α-helix	trans	-91.9	-30.6	-164.7	-59.7	171.6	0	0	0	113.1	N309 S315 I354 H358 F1062	N309-I313 HydrophobicContact CB-CD1 3.92Å; N309-I313 VanDerWaalsContact O-CB 3.24Å; N309-I313 WeakPolarHBondContact O-CB 3.24Å; N309-I313 WeakPolarHBondContact O-CG1 3.34Å; N309-I313 PolarHBondContact O-N 3.47Å; I313-S315 PolarHBondContact O-N 3.33Å; I313-I354 HydrophobicContact CD1-CG2 3.54Å; I313-H358 HydrophobicContact CD1-CB 4Å; I313-H358 HydrophobicContact CG1-CB 4.07Å; I313-H358 VanDerWaalsContact CG2-CE1 3.44Å; I313-H358 WeakPolarHBondContact CG2-CE1 3.37Å; I313-H358 WeakPolarHBondContact CG2-ND1 3.39Å; I313-F1062 HydrophobicContact CB-CD1 3.97Å; I313-F1062 HydrophobicContact CD1-CD1 4.2Å; I313-F1062 HydrophobicContact CD1-CG 4.4Å; I313-F1062 HydrophobicContact CG2-CB 4.18Å; I313-F1062 HydrophobicContact CG2-CD1 3.94Å; I313-F1062 HydrophobicContact CG2-CG 4.42Å
314	I	86.9	Confident	88	Confident	34 Å²	34	17.4 Å²	17.4	17%	0.174	9%	0.092	C	C	.	.	S	Bend	trans	-68.8	-19.8	-174.1	-156.7	71.9	0	0	0	113.3	V254 H266 A310 L1037	V254-I314 HydrophobicContact CB-CD1 4.11Å; V254-I314 HydrophobicContact CG1-CD1 4.13Å; H266-I314 HydrophobicContact CB-CG2 3.81Å; H266-I314 WeakPolarHBondContact CD2-CG2 3.37Å; H266-I314 VanDerWaalsContact CG-CG2 3.47Å; A310-I314 WeakPolarHBondContact O-CB 3.45Å; A310-I314 WeakPolarHBondContact O-CG2 3.48Å; I314-L1037 HydrophobicContact CD1-CD2 4.48Å
315	S	84.1	Confident	87.6	Confident	12 Å²	12	17.6 Å²	17.6	8%	0.084	9%	0.093	C	C	.	.			trans	-68.9	131.7	-177.3	-165.1	0	0	0	0	112	I313 D317 R321 R1030	I313-S315 PolarHBondContact O-N 3.33Å; S315-D317 VanDerWaalsContact C-N 3.31Å; S315-R321 VanDerWaalsContact O-CD 3.29Å; S315-R321 WeakPolarHBondContact O-CD 3.45Å; S315-R321 WeakPolarHBondContact O-CG 3.25Å; S315-R321 PolarHBondContact O-NH1 3.09Å; S315-R1030 PolarHBondContact O-NH1 3.46Å; S315-R1030 VanDerWaalsContact O-NH1 3.14Å
316	D	77.1	Confident	87.1	Confident	74 Å²	74	20.6 Å²	20.6	40%	0.396	11%	0.109	S	C	.	.	S	Bend	trans	-66.4	-35.9	176.5	-56.7	-61.3	0	0	0	112.2	L318 R321 R1030 K1034	D316-L318 PolarHBondContact O-N 3.11Å; D316-R321 PolarHBondContact O-NH1 3.49Å; D316-R1030 WeakPolarHBondContact OD1-CD 3.28Å; D316-K1034 VanDerWaalsContact CG-NZ 3.26Å; D316-K1034 VanDerWaalsContact OD1-CE 3.28Å; D316-K1034 WeakPolarHBondContact OD1-CE 3.35Å; D316-K1034 IonicContact OD1-NZ 2.69Å; D316-K1034 PolarHBondContact OD1-NZ 2.8Å; D316-K1034 VanDerWaalsContact OD1-NZ 3.12Å; D316-K1034 IonicContact OD2-NZ 3.71Å; D316-K1034 PolarHBondContact OD2-NZ 3.04Å
317	D	80.9	Confident	86.4	Confident	36 Å²	36	21.2 Å²	21.2	19%	0.193	11%	0.112	C	C	.	.			trans	-75.5	113.5	-171.8	-173.9	-46.2	0	0	0	110.9	S315 D319 L320 R321 R435	S315-D317 VanDerWaalsContact C-N 3.31Å; D317-D319 PolarHBondContact O-N 3.18Å; D317-D319 PolarHBondContact OD1-N 3.03Å; D317-L320 HydrophobicContact CB-CB 3.85Å; D317-L320 PolarHBondContact O-N 2.68Å; D317-L320 PolarHBondContact OD1-N 2.92Å; D317-R321 WeakPolarHBondContact O-CG 3.16Å; D317-R321 PolarHBondContact O-N 3.4Å; D317-R321 PolarHBondContact O-NH1 3.5Å; D317-R435 IonicContact OD2-CZ 3.67Å; D317-R435 VanDerWaalsContact OD2-CZ 3.25Å; D317-R435 IonicContact OD2-NE 2.81Å; D317-R435 PolarHBondContact OD2-NE 2.8Å; D317-R435 IonicContact OD2-NH2 3.12Å; D317-R435 PolarHBondContact OD2-NH2 3.38Å
318	L	81.6	Confident	85.9	Confident	22 Å²	22	21.3 Å²	21.3	12%	0.115	11%	0.113	C	C	.	.	H	α-helix	trans	-60.8	-43.7	-176.2	172.9	64.1	0	0	0	111.9	D316 L320 R321 L322 D362 D365	D316-L318 PolarHBondContact O-N 3.11Å; L318-L320 VanDerWaalsContact C-N 3.34Å; L318-R321 VanDerWaalsContact CD1-NH2 3.32Å; L318-R321 PolarHBondContact O-N 3.46Å; L318-L322 HydrophobicContact CD1-CD1 4Å; L318-L322 HydrophobicContact CD1-CG 4.25Å; L318-L322 HydrophobicContact CG-CD1 4.01Å; L318-L322 WeakPolarHBondContact O-CG 3.38Å; L318-L322 PolarHBondContact O-N 2.77Å; L318-D362 HydrophobicContact CD1-CB 3.72Å; L318-D365 HydrophobicContact CD1-CB 4.4Å; L318-D365 HydrophobicContact CD2-CB 4.11Å
319	D	81.5	Confident	85.5	Confident	72 Å²	72	23.4 Å²	23.4	39%	0.385	12%	0.123	S	C	.	.	H	α-helix	trans	-69.8	-36.1	-177	-57.4	-54.2	0	0	0	110.7	D317 H323 L433	D317-D319 PolarHBondContact O-N 3.18Å; D317-D319 PolarHBondContact OD1-N 3.03Å; D319-H323 VanDerWaalsContact O-CB 3.25Å; D319-H323 WeakPolarHBondContact O-CB 3.49Å; D319-H323 PolarHBondContact O-N 3.48Å; D319-L433 HydrophobicContact CB-CD2 3.52Å
320	L	83.1	Confident	84.8	Confident	31 Å²	31	30.2 Å²	30.2	16%	0.162	15%	0.149	C	C	.	.	H	α-helix	trans	-66.2	-38.6	171	-175.1	55.4	0	0	0	112.6	D317 L318 H323 L324	D317-L320 HydrophobicContact CB-CB 3.85Å; D317-L320 PolarHBondContact O-N 2.68Å; D317-L320 PolarHBondContact OD1-N 2.92Å; L318-L320 VanDerWaalsContact C-N 3.34Å; L320-H323 PolarHBondContact O-N 3.11Å; L320-L324 HydrophobicContact CD1-CD1 4.07Å; L320-L324 HydrophobicContact CD1-CG 4.06Å; L320-L324 HydrophobicContact CG-CD1 4Å; L320-L324 HydrophobicContact CG-CG 4.43Å; L320-L324 WeakPolarHBondContact O-CB 2.98Å; L320-L324 VanDerWaalsContact O-CG 3.27Å; L320-L324 WeakPolarHBondContact O-CG 3.47Å; L320-L324 PolarHBondContact O-N 3.04Å
321	R	87.8	Confident	84	Confident	3 Å²	3	31.6 Å²	31.6	1%	0.011	16%	0.16	C	C	.	.	H	α-helix	trans	-63.7	-47.1	173.7	-69.1	-157.9	-58.3	-66.8	-5.5	112.1	V312 S315 D316 D317 L318 H323 L324 S325 D362 R1030	V312-R321 VanDerWaalsContact O-CD 3.31Å; V312-R321 WeakPolarHBondContact O-CD 3.46Å; V312-R321 WeakPolarHBondContact O-CG 3.23Å; S315-R321 VanDerWaalsContact O-CD 3.29Å; S315-R321 WeakPolarHBondContact O-CD 3.45Å; S315-R321 WeakPolarHBondContact O-CG 3.25Å; S315-R321 PolarHBondContact O-NH1 3.09Å; D316-R321 PolarHBondContact O-NH1 3.49Å; D317-R321 WeakPolarHBondContact O-CG 3.16Å; D317-R321 PolarHBondContact O-N 3.4Å; D317-R321 PolarHBondContact O-NH1 3.5Å; L318-R321 VanDerWaalsContact CD1-NH2 3.32Å; L318-R321 PolarHBondContact O-N 3.46Å; R321-H323 VanDerWaalsContact C-N 3.32Å; R321-H323 PolarHBondContact O-N 2.98Å; R321-L324 PolarHBondContact O-N 2.84Å; R321-S325 VanDerWaalsContact O-CB 3.31Å; R321-S325 WeakPolarHBondContact O-CB 3.11Å; R321-S325 PolarHBondContact O-N 3.37Å; R321-D362 IonicContact CZ-OD1 2.66Å; R321-D362 IonicContact CZ-OD2 2.74Å; R321-D362 IonicContact NE-OD1 2.79Å; R321-D362 PolarHBondContact NE-OD1 2.99Å; R321-D362 IonicContact NE-OD2 3.86Å; R321-D362 PolarHBondContact NE-OD2 3.42Å; R321-D362 IonicContact NH2-OD1 2.65Å; R321-D362 PolarHBondContact NH2-OD1 3.49Å; R321-D362 IonicContact NH2-OD2 2.67Å; R321-R1030 VanDerWaalsContact NH2-NH2 3.19Å
322	L	82.8	Confident	83.5	Confident	16 Å²	16	32.5 Å²	32.5	8%	0.084	17%	0.17	C	C	.	.	H	α-helix	trans	-61.2	-41.6	176	-74.3	168.6	0	0	0	111.1	L318 N326 D362 L363 L366	L318-L322 HydrophobicContact CD1-CD1 4Å; L318-L322 HydrophobicContact CD1-CG 4.25Å; L318-L322 HydrophobicContact CG-CD1 4.01Å; L318-L322 WeakPolarHBondContact O-CG 3.38Å; L318-L322 PolarHBondContact O-N 2.77Å; L322-N326 VanDerWaalsContact O-CB 3.28Å; L322-N326 WeakPolarHBondContact O-CB 3.18Å; L322-N326 VanDerWaalsContact O-CG 3.26Å; L322-N326 PolarHBondContact O-N 2.87Å; L322-N326 PolarHBondContact O-ND2 2.8Å; L322-D362 HydrophobicContact CD2-CB 3.89Å; L322-D362 HydrophobicContact CG-CB 4.23Å; L322-L363 HydrophobicContact CD2-CD2 4.01Å; L322-L363 HydrophobicContact CD2-CG 4.21Å; L322-L366 HydrophobicContact CD1-CB 4.14Å; L322-L366 HydrophobicContact CD1-CD1 4.27Å; L322-L366 HydrophobicContact CD1-CD2 4.19Å; L322-L366 HydrophobicContact CD1-CG 4.43Å
323	H	82.2	Confident	83.4	Confident	38 Å²	38	32.2 Å²	32.2	18%	0.176	17%	0.168	C	C	.	.	H	α-helix	trans	-60.4	-54.1	174.1	-178.9	90.8	0	0	0	111.7	D319 L320 R321 S325 N326 D327 L433 C437	D319-H323 VanDerWaalsContact O-CB 3.25Å; D319-H323 WeakPolarHBondContact O-CB 3.49Å; D319-H323 PolarHBondContact O-N 3.48Å; L320-H323 PolarHBondContact O-N 3.11Å; R321-H323 VanDerWaalsContact C-N 3.32Å; R321-H323 PolarHBondContact O-N 2.98Å; H323-S325 PolarHBondContact O-N 3.43Å; H323-N326 PolarHBondContact O-N 3.09Å; H323-D327 WeakPolarHBondContact O-CB 3.47Å; H323-D327 PolarHBondContact O-N 2.69Å; H323-L433 HydrophobicContact CB-CD1 4.39Å; H323-C437 PolarHBondContact NE2-SG 2.63Å
324	L	85.2	Confident	83.2	Confident	16 Å²	16	34.3 Å²	34.3	8%	0.084	19%	0.186	C	C	.	.	H	α-helix	trans	-62.5	-41.3	-178.6	-70.5	169.4	0	0	0	112.2	L270 I311 V312 L320 R321 D327 F328	L270-L324 HydrophobicContact CD1-CD1 4.41Å; L270-L324 HydrophobicContact CD2-CD1 4.47Å; L270-L324 HydrophobicContact CD2-CD2 4.02Å; I311-L324 HydrophobicContact CG2-CD1 4.37Å; V312-L324 HydrophobicContact CG2-CB 4.14Å; L320-L324 HydrophobicContact CD1-CD1 4.07Å; L320-L324 HydrophobicContact CD1-CG 4.06Å; L320-L324 HydrophobicContact CG-CD1 4Å; L320-L324 HydrophobicContact CG-CG 4.43Å; L320-L324 WeakPolarHBondContact O-CB 2.98Å; L320-L324 VanDerWaalsContact O-CG 3.27Å; L320-L324 WeakPolarHBondContact O-CG 3.47Å; L320-L324 PolarHBondContact O-N 3.04Å; R321-L324 PolarHBondContact O-N 2.84Å; L324-D327 PolarHBondContact O-N 3.03Å; L324-F328 WeakPolarHBondContact O-CD2 3.49Å; L324-F328 PolarHBondContact O-N 2.79Å
325	S	87.3	Confident	83.2	Confident	4 Å²	4	39.1 Å²	39.1	3%	0.028	21%	0.212	C	C	.	.	H	α-helix	trans	-62.2	-47.4	175.7	-168.8	0	0	0	0	111.3	R321 H323 D327 F328 M329 F355	R321-S325 VanDerWaalsContact O-CB 3.31Å; R321-S325 WeakPolarHBondContact O-CB 3.11Å; R321-S325 PolarHBondContact O-N 3.37Å; H323-S325 PolarHBondContact O-N 3.43Å; S325-D327 VanDerWaalsContact C-N 3.3Å; S325-D327 PolarHBondContact O-N 2.82Å; S325-F328 PolarHBondContact O-N 3.04Å; S325-M329 VanDerWaalsContact O-CG 3.23Å; S325-M329 WeakPolarHBondContact O-CG 3.33Å; S325-M329 PolarHBondContact O-N 3.16Å; S325-F355 WeakPolarHBondContact OG-CZ 3.29Å
326	N	82.9	Confident	83.5	Confident	62 Å²	62	39.6 Å²	39.6	33%	0.332	21%	0.214	S	C	.	.	H	α-helix	trans	-63.7	-34.3	175.2	-74.7	-44.9	0	0	0	112.1	L322 H323 M329 R330	L322-N326 VanDerWaalsContact O-CB 3.28Å; L322-N326 WeakPolarHBondContact O-CB 3.18Å; L322-N326 VanDerWaalsContact O-CG 3.26Å; L322-N326 PolarHBondContact O-N 2.87Å; L322-N326 PolarHBondContact O-ND2 2.8Å; H323-N326 PolarHBondContact O-N 3.09Å; N326-M329 PolarHBondContact O-N 2.89Å; N326-R330 WeakPolarHBondContact O-CB 3.31Å; N326-R330 WeakPolarHBondContact O-CG 3.43Å; N326-R330 PolarHBondContact O-N 3.01Å
327	D	80.4	Confident	84.1	Confident	13 Å²	13	37.1 Å²	37.1	7%	0.07	20%	0.2	C	C	.	.	H	α-helix	trans	-67.9	-45.4	177.3	-163.8	52.8	0	0	0	112.5	H323 L324 S325 M329 R330 A331 Y440	H323-D327 WeakPolarHBondContact O-CB 3.47Å; H323-D327 PolarHBondContact O-N 2.69Å; L324-D327 PolarHBondContact O-N 3.03Å; S325-D327 VanDerWaalsContact C-N 3.3Å; S325-D327 PolarHBondContact O-N 2.82Å; D327-M329 VanDerWaalsContact C-N 3.32Å; D327-M329 PolarHBondContact O-N 2.97Å; D327-R330 PolarHBondContact O-N 3.3Å; D327-R330 IonicContact OD1-CZ 2.63Å; D327-R330 IonicContact OD1-NE 2.91Å; D327-R330 IonicContact OD1-NH2 3.99Å; D327-R330 PolarHBondContact OD1-NH2 2.92Å; D327-A331 WeakPolarHBondContact O-CB 3.43Å; D327-A331 PolarHBondContact O-N 2.94Å; D327-Y440 WeakPolarHBondContact OD2-CE2 3.45Å; D327-Y440 PolarHBondContact OD2-OH 2.95Å
328	F	86	Confident	84.4	Confident	3 Å²	3	43 Å²	43	1%	0.013	23%	0.227	C	C	.	.	H	α-helix	trans	-57.9	-43.4	171	-86.6	-72.9	0	0	0	112.2	L285 V308 I311 V312 L324 S325 A331 G332 L333	L285-F328 HydrophobicContact CB-CE1 4.4Å; L285-F328 HydrophobicContact CD1-CD1 3.99Å; L285-F328 HydrophobicContact CD1-CE1 3.89Å; L285-F328 HydrophobicContact CD1-CG 4.38Å; L285-F328 HydrophobicContact CD1-CZ 4.21Å; L285-F328 HydrophobicContact CD2-CE1 3.79Å; L285-F328 HydrophobicContact CD2-CZ 3.75Å; L285-F328 HydrophobicContact CG-CE1 4.24Å; V308-F328 HydrophobicContact CG1-CD1 4.31Å; V308-F328 HydrophobicContact CG1-CD2 4.19Å; V308-F328 HydrophobicContact CG1-CE1 4.48Å; V308-F328 HydrophobicContact CG1-CE2 4.35Å; V308-F328 HydrophobicContact CG1-CG 4.17Å; V308-F328 HydrophobicContact CG1-CZ 4.49Å; V308-F328 HydrophobicContact CG2-CD1 4.06Å; V308-F328 HydrophobicContact CG2-CE1 3.75Å; V308-F328 HydrophobicContact CG2-CZ 4.14Å; I311-F328 HydrophobicContact CB-CE2 4.29Å; I311-F328 HydrophobicContact CD1-CE2 4.48Å; I311-F328 HydrophobicContact CD1-CZ 3.98Å; I311-F328 HydrophobicContact CG2-CE2 3.95Å; I311-F328 HydrophobicContact CG2-CZ 4.48Å; V312-F328 HydrophobicContact CG2-CD2 3.61Å; V312-F328 HydrophobicContact CG2-CE2 3.84Å; L324-F328 WeakPolarHBondContact O-CD2 3.49Å; L324-F328 PolarHBondContact O-N 2.79Å; S325-F328 PolarHBondContact O-N 3.04Å; F328-A331 PolarHBondContact O-N 2.93Å; F328-G332 PolarHBondContact O-N 3.18Å; F328-L333 HydrophobicContact CB-CB 4.35Å; F328-L333 HydrophobicContact CB-CD2 3.97Å; F328-L333 WeakPolarHBondContact O-CB 3.4Å; F328-L333 PolarHBondContact O-N 3.24Å
329	M	85.1	Confident	84.8	Confident	44 Å²	44	45.8 Å²	45.8	22%	0.217	24%	0.241	C	C	.	.	I	π-helix	trans	-60.4	-49.2	176.9	-70	-67.8	-77.7	0	0	111.7	S325 N326 D327 A331 G332 L333 A334 I337 F355	S325-M329 VanDerWaalsContact O-CG 3.23Å; S325-M329 WeakPolarHBondContact O-CG 3.33Å; S325-M329 PolarHBondContact O-N 3.16Å; N326-M329 PolarHBondContact O-N 2.89Å; D327-M329 VanDerWaalsContact C-N 3.32Å; D327-M329 PolarHBondContact O-N 2.97Å; M329-A331 VanDerWaalsContact C-N 3.31Å; M329-A331 PolarHBondContact O-N 3.32Å; M329-G332 PolarHBondContact O-N 3.23Å; M329-L333 HydrophobicContact SD-CB 4.41Å; M329-L333 HydrophobicContact SD-CG 4.4Å; M329-A334 HydrophobicContact CB-CB 4.46Å; M329-A334 HydrophobicContact CE-CB 3.64Å; M329-A334 HydrophobicContact SD-CB 4.08Å; M329-I337 HydrophobicContact CE-CD1 4Å; M329-I337 HydrophobicContact SD-CD1 3.54Å; M329-I337 VanDerWaalsContact SD-CD1 3.54Å; M329-F355 HydrophobicContact SD-CE1 4.16Å; M329-F355 HydrophobicContact SD-CZ 4.48Å
330	R	78.9	Confident	85.3	Confident	143 Å²	143	42.4 Å²	42.4	54%	0.54	22%	0.223	S	C	.	.	I	π-helix	trans	-65.4	-29.8	176.3	-69.4	-178.9	-45	157.8	7.3	113.6	N326 D327 G332 E425	N326-R330 WeakPolarHBondContact O-CB 3.31Å; N326-R330 WeakPolarHBondContact O-CG 3.43Å; N326-R330 PolarHBondContact O-N 3.01Å; D327-R330 PolarHBondContact O-N 3.3Å; D327-R330 IonicContact OD1-CZ 2.63Å; D327-R330 IonicContact OD1-NE 2.91Å; D327-R330 IonicContact OD1-NH2 3.99Å; D327-R330 PolarHBondContact OD1-NH2 2.92Å; R330-G332 VanDerWaalsContact C-N 3.31Å; R330-E425 IonicContact CZ-OE1 3.72Å; R330-E425 IonicContact NH1-OE1 2.75Å; R330-E425 PolarHBondContact NH1-OE1 3.41Å; R330-E425 IonicContact NH2-OE1 3.96Å; R330-E425 PolarHBondContact NH2-OE1 3.46Å
331	A	78.2	Confident	85.6	Confident	29 Å²	29	44.2 Å²	44.2	24%	0.24	23%	0.23	C	C	.	.	I	π-helix	trans	-75.5	-20.6	-179.7	0	0	0	0	0	113	L285 L289 D327 F328 M329	L285-A331 HydrophobicContact CD1-CB 4.39Å; L289-A331 HydrophobicContact CD1-CB 3.54Å; L289-A331 WeakPolarHBondContact CD1-O 3.41Å; D327-A331 WeakPolarHBondContact O-CB 3.43Å; D327-A331 PolarHBondContact O-N 2.94Å; F328-A331 PolarHBondContact O-N 2.93Å; M329-A331 VanDerWaalsContact C-N 3.31Å; M329-A331 PolarHBondContact O-N 3.32Å
332	G	80.8	Confident	85.7	Confident	21 Å²	21	48 Å²	48	22%	0.216	26%	0.262	C	S	.	.	I	π-helix	trans	143.9	-4.5	173.2	0	0	0	0	0	115.5	F328 M329 R330 A334 D335	F328-G332 PolarHBondContact O-N 3.18Å; M329-G332 PolarHBondContact O-N 3.23Å; R330-G332 VanDerWaalsContact C-N 3.31Å; G332-A334 PolarHBondContact O-N 2.77Å; G332-D335 PolarHBondContact O-N 3.45Å
333	L	88.7	Confident	86	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	27%	0.265	C	S	.	.	I	π-helix	trans	-63.4	-30.1	-178.7	-176.2	61.3	0	0	0	112.4	L289 L292 M305 V308 F328 M329 D335 L336 I337 L340 F355	L289-L333 HydrophobicContact CD2-CB 3.97Å; L292-L333 HydrophobicContact CD1-CD1 4.16Å; M305-L333 HydrophobicContact CE-CD2 4.35Å; M305-L333 HydrophobicContact SD-CD1 4.29Å; V308-L333 HydrophobicContact CG1-CD2 4.07Å; F328-L333 HydrophobicContact CB-CB 4.35Å; F328-L333 HydrophobicContact CB-CD2 3.97Å; F328-L333 WeakPolarHBondContact O-CB 3.4Å; F328-L333 PolarHBondContact O-N 3.24Å; M329-L333 HydrophobicContact SD-CB 4.41Å; M329-L333 HydrophobicContact SD-CG 4.4Å; L333-D335 VanDerWaalsContact C-N 3.34Å; L333-D335 PolarHBondContact O-N 3.08Å; L333-L336 PolarHBondContact O-N 3.02Å; L333-I337 HydrophobicContact CG-CD1 4.35Å; L333-I337 HydrophobicContact CG-CG1 4.24Å; L333-I337 PolarHBondContact O-N 3.11Å; L333-I337 VanDerWaalsContact O-N 3.14Å; L333-L340 HydrophobicContact CD1-CD1 4.25Å; L333-F355 HydrophobicContact CD2-CD1 4.5Å; L333-F355 HydrophobicContact CD2-CE1 3.86Å; L333-F355 HydrophobicContact CD2-CE2 4.04Å; L333-F355 HydrophobicContact CD2-CZ 3.6Å
334	A	86	Confident	86.3	Confident	47 Å²	47	55.2 Å²	55.2	39%	0.388	30%	0.298	S	S	.	.	H	α-helix	trans	-57.2	-43.2	-178.2	0	0	0	0	0	113.1	M329 G332 L336	M329-A334 HydrophobicContact CB-CB 4.46Å; M329-A334 HydrophobicContact CE-CB 3.64Å; M329-A334 HydrophobicContact SD-CB 4.08Å; G332-A334 PolarHBondContact O-N 2.77Å; A334-L336 PolarHBondContact O-N 3.49Å
335	D	85.8	Confident	86.6	Confident	135 Å²	135	55.7 Å²	55.7	72%	0.722	30%	0.303	S	S	*	.	H	α-helix	trans	-72.8	-16.4	178.8	-63.6	-51.5	0	0	0	112.8	G332 L333	G332-D335 PolarHBondContact O-N 3.45Å; L333-D335 VanDerWaalsContact C-N 3.34Å; L333-D335 PolarHBondContact O-N 3.08Å
336	L	90.4	Very high	86.8	Confident	22 Å²	22	61.6 Å²	61.6	12%	0.115	33%	0.33	C	S	.	.	H	α-helix	trans	-94.6	-24.7	-177.9	-60.4	178.3	0	0	0	113.1	L292 A293 L333 A334 E338 I339 L340	L292-L336 HydrophobicContact CB-CD1 3.72Å; A293-L336 HydrophobicContact CB-CD1 4.49Å; A293-L336 HydrophobicContact CB-CD2 4.01Å; L333-L336 PolarHBondContact O-N 3.02Å; A334-L336 PolarHBondContact O-N 3.49Å; L336-E338 PolarHBondContact O-N 3.21Å; L336-I339 HydrophobicContact CD2-CD1 4.4Å; L336-I339 WeakPolarHBondContact O-CA 3.14Å; L336-I339 WeakPolarHBondContact O-CB 3.35Å; L336-I339 PolarHBondContact O-N 3.02Å; L336-L340 HydrophobicContact CB-CD1 4Å; L336-L340 HydrophobicContact CB-CG 4.4Å; L336-L340 VanDerWaalsContact O-CG 3.27Å; L336-L340 WeakPolarHBondContact O-CG 3.39Å; L336-L340 PolarHBondContact O-N 2.93Å
337	I	89.8	Confident	87.2	Confident	23 Å²	23	63 Å²	63	12%	0.118	34%	0.338	C	S	.	.	H	α-helix	trans	-56.8	-45.3	-174.5	-75.5	171.5	0	0	0	112.7	M329 L333 I339 L340 E341 V352 F355	M329-I337 HydrophobicContact CE-CD1 4Å; M329-I337 HydrophobicContact SD-CD1 3.54Å; M329-I337 VanDerWaalsContact SD-CD1 3.54Å; L333-I337 HydrophobicContact CG-CD1 4.35Å; L333-I337 HydrophobicContact CG-CG1 4.24Å; L333-I337 PolarHBondContact O-N 3.11Å; L333-I337 VanDerWaalsContact O-N 3.14Å; I337-I339 PolarHBondContact O-N 2.87Å; I337-L340 PolarHBondContact O-N 3.09Å; I337-E341 HydrophobicContact CG2-CG 4.36Å; I337-E341 PolarHBondContact O-N 2.92Å; I337-V352 HydrophobicContact CG2-CG1 4.33Å; I337-F355 HydrophobicContact CD1-CD1 4.24Å; I337-F355 HydrophobicContact CD1-CE1 3.96Å
338	E	88.1	Confident	87.8	Confident	159 Å²	159	62.4 Å²	62.4	74%	0.743	33%	0.334	S	S	*	.	H	α-helix	trans	-62.9	-31.5	177.8	-66.8	-168.1	169.2	0	0	112.3	L336 A342	L336-E338 PolarHBondContact O-N 3.21Å; E338-A342 VanDerWaalsContact O-CB 3.24Å; E338-A342 WeakPolarHBondContact O-CB 3.46Å; E338-A342 PolarHBondContact O-N 3.28Å
339	I	90	Very high	88.1	Confident	80 Å²	80	65.3 Å²	65.3	41%	0.41	35%	0.347	S	S	.	.	H	α-helix	trans	-75.4	-39.6	178.2	-55.9	175.3	0	0	0	110.5	T295 L336 I337 A342 S343	T295-I339 HydrophobicContact CG2-CG2 3.68Å; L336-I339 HydrophobicContact CD2-CD1 4.4Å; L336-I339 WeakPolarHBondContact O-CA 3.14Å; L336-I339 WeakPolarHBondContact O-CB 3.35Å; L336-I339 PolarHBondContact O-N 3.02Å; I337-I339 PolarHBondContact O-N 2.87Å; I339-A342 PolarHBondContact O-N 3.1Å; I339-S343 PolarHBondContact O-N 3.01Å
340	L	91.8	Very high	88.4	Confident	1 Å²	1	66.3 Å²	66.3	1%	0.005	35%	0.353	C	S	.	.	H	α-helix	trans	-73.9	-37.9	179.5	-59.8	165.9	0	0	0	111.8	L292 Q301 L333 L336 I337 A342 S343 L348 V352	L292-L340 HydrophobicContact CD2-CD1 4.07Å; L292-L340 HydrophobicContact CD2-CD2 4.17Å; Q301-L340 HydrophobicContact CB-CD2 3.99Å; Q301-L340 HydrophobicContact CG-CD2 4.09Å; L333-L340 HydrophobicContact CD1-CD1 4.25Å; L336-L340 HydrophobicContact CB-CD1 4Å; L336-L340 HydrophobicContact CB-CG 4.4Å; L336-L340 VanDerWaalsContact O-CG 3.27Å; L336-L340 WeakPolarHBondContact O-CG 3.39Å; L336-L340 PolarHBondContact O-N 2.93Å; I337-L340 PolarHBondContact O-N 3.09Å; L340-A342 VanDerWaalsContact C-N 3.26Å; L340-A342 PolarHBondContact O-N 3.34Å; L340-S343 WeakPolarHBondContact O-CB 3.43Å; L340-S343 PolarHBondContact O-N 2.88Å; L340-L348 HydrophobicContact CB-CD2 4.48Å; L340-L348 HydrophobicContact CD2-CD1 4.2Å; L340-L348 HydrophobicContact CD2-CD2 3.94Å; L340-V352 HydrophobicContact CB-CG2 3.65Å; L340-V352 HydrophobicContact CD1-CG2 4.49Å
341	E	89.5	Confident	89.2	Confident	69 Å²	69	59.5 Å²	59.5	32%	0.322	33%	0.327	S	S	.	.	H	α-helix	trans	-61.6	-33.6	169.8	-77.6	-161.6	134.5	0	0	112	I337 S343 V352 R1076	I337-E341 HydrophobicContact CG2-CG 4.36Å; I337-E341 PolarHBondContact O-N 2.92Å; E341-S343 VanDerWaalsContact C-N 3.34Å; E341-V352 HydrophobicContact CG-CG1 3.68Å; E341-R1076 IonicContact OE1-CZ 2.62Å; E341-R1076 IonicContact OE1-NH1 3.73Å; E341-R1076 IonicContact OE1-NH2 2.81Å; E341-R1076 PolarHBondContact OE1-NH2 3.47Å; E341-R1076 IonicContact OE2-NH2 3.12Å; E341-R1076 PolarHBondContact OE2-NH2 3.12Å
342	A	89.4	Confident	89.9	Confident	82 Å²	82	58.1 Å²	58.1	68%	0.678	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-0.5	-178.3	0	0	0	0	0	115	E338 I339 L340	E338-A342 VanDerWaalsContact O-CB 3.24Å; E338-A342 WeakPolarHBondContact O-CB 3.46Å; E338-A342 PolarHBondContact O-N 3.28Å; I339-A342 PolarHBondContact O-N 3.1Å; L340-A342 VanDerWaalsContact C-N 3.26Å; L340-A342 PolarHBondContact O-N 3.34Å
343	S	89.6	Confident	90.5	Very high	22 Å²	22	62.2 Å²	62.2	15%	0.154	33%	0.328	C	S	.	.	S	Bend	trans	-64.1	160.7	176.9	-171	0	0	0	0	112.4	I339 L340 E341 S345 K349	I339-S343 PolarHBondContact O-N 3.01Å; L340-S343 WeakPolarHBondContact O-CB 3.43Å; L340-S343 PolarHBondContact O-N 2.88Å; E341-S343 VanDerWaalsContact C-N 3.34Å; S343-S345 PolarHBondContact OG-N 2.62Å; S343-K349 WeakPolarHBondContact O-CE 3.33Å; S343-K349 PolarHBondContact O-NZ 2.86Å
344	E	89	Confident	90.6	Very high	184 Å²	184	63.1 Å²	63.1	86%	0.86	33%	0.332	S	S	*	.	S	Bend	trans	-81.8	-15.2	171.9	-64.7	-171.6	164.2	0	0	112.7	E346	E344-E346 PolarHBondContact O-N 3.27Å
345	S	91.1	Very high	91	Very high	27 Å²	27	61 Å²	61	19%	0.189	31%	0.314	C	S	.	.			trans	-77.8	115	-177.7	176.3	0	0	0	0	112.8	S343 D347 L348 K349	S343-S345 PolarHBondContact OG-N 2.62Å; S345-D347 VanDerWaalsContact C-N 3.32Å; S345-D347 PolarHBondContact O-N 3.14Å; S345-L348 PolarHBondContact O-N 2.9Å; S345-L348 PolarHBondContact OG-N 3.4Å; S345-K349 WeakPolarHBondContact O-CG 3.48Å; S345-K349 PolarHBondContact O-N 3.48Å
346	E	90.9	Very high	91.2	Very high	128 Å²	128	55.6 Å²	55.6	60%	0.598	29%	0.286	S	S	*	.	H	α-helix	trans	-63.1	-35	173.8	-63.2	-56	123.8	0	0	112.8	E344 L348 K349 L350	E344-E346 PolarHBondContact O-N 3.27Å; E346-L348 PolarHBondContact O-N 3.24Å; E346-K349 PolarHBondContact O-N 3.03Å; E346-K349 IonicContact OE1-NZ 2.67Å; E346-K349 PolarHBondContact OE1-NZ 3.45Å; E346-L350 WeakPolarHBondContact O-CB 3.35Å; E346-L350 PolarHBondContact O-N 2.82Å
347	D	90.6	Very high	91.2	Very high	92 Å²	92	57.3 Å²	57.3	49%	0.492	29%	0.294	S	S	.	.	H	α-helix	trans	-62.3	-43.2	175.8	-55.3	-42	0	0	0	111.4	N302 S345 L350 Q351	N302-D347 WeakPolarHBondContact ND2-CB 3.24Å; S345-D347 VanDerWaalsContact C-N 3.32Å; S345-D347 PolarHBondContact O-N 3.14Å; D347-L350 WeakPolarHBondContact O-CB 3.49Å; D347-L350 PolarHBondContact O-N 2.97Å; D347-Q351 WeakPolarHBondContact O-CG 3.5Å; D347-Q351 PolarHBondContact O-N 2.8Å; D347-Q351 VanDerWaalsContact O-N 3.08Å
348	L	93.1	Very high	91.2	Very high	0 Å²	0	57 Å²	57	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-66.1	-44.1	176.8	177.6	57.3	0	0	0	111.1	Q301 N302 M305 L340 S345 E346 L350 Q351 V352	Q301-L348 HydrophobicContact CB-CD1 4.13Å; Q301-L348 HydrophobicContact CB-CD2 3.76Å; N302-L348 HydrophobicContact CB-CB 4.33Å; M305-L348 HydrophobicContact CB-CD1 4.2Å; L340-L348 HydrophobicContact CB-CD2 4.48Å; L340-L348 HydrophobicContact CD2-CD1 4.2Å; L340-L348 HydrophobicContact CD2-CD2 3.94Å; S345-L348 PolarHBondContact O-N 2.9Å; S345-L348 PolarHBondContact OG-N 3.4Å; E346-L348 PolarHBondContact O-N 3.24Å; L348-L350 VanDerWaalsContact C-N 3.26Å; L348-L350 PolarHBondContact O-N 3.48Å; L348-Q351 PolarHBondContact O-N 3.26Å; L348-Q351 VanDerWaalsContact O-N 3.15Å; L348-V352 HydrophobicContact CD1-CG2 4.13Å; L348-V352 HydrophobicContact CG-CG2 4.47Å; L348-V352 WeakPolarHBondContact O-CG2 3.36Å; L348-V352 PolarHBondContact O-N 3.44Å
349	K	93.1	Very high	91.2	Very high	64 Å²	64	52.5 Å²	52.5	28%	0.278	27%	0.268	S	S	.	.	H	α-helix	trans	-57.1	-40.4	173.4	-69.2	171.6	-163.8	166.4	0	111.7	S343 S345 E346 V352 K353	S343-K349 WeakPolarHBondContact O-CE 3.33Å; S343-K349 PolarHBondContact O-NZ 2.86Å; S345-K349 WeakPolarHBondContact O-CG 3.48Å; S345-K349 PolarHBondContact O-N 3.48Å; E346-K349 PolarHBondContact O-N 3.03Å; E346-K349 IonicContact OE1-NZ 2.67Å; E346-K349 PolarHBondContact OE1-NZ 3.45Å; K349-V352 PolarHBondContact O-N 3.08Å; K349-K353 WeakPolarHBondContact O-CB 3.17Å; K349-K353 PolarHBondContact O-N 2.92Å
350	L	92.6	Very high	91	Very high	64 Å²	64	52 Å²	52	34%	0.335	27%	0.266	S	S	.	.	H	α-helix	trans	-61.6	-45.8	176.1	178.9	60.1	0	0	0	111.1	E346 D347 L348 K353 I354	E346-L350 WeakPolarHBondContact O-CB 3.35Å; E346-L350 PolarHBondContact O-N 2.82Å; D347-L350 WeakPolarHBondContact O-CB 3.49Å; D347-L350 PolarHBondContact O-N 2.97Å; L348-L350 VanDerWaalsContact C-N 3.26Å; L348-L350 PolarHBondContact O-N 3.48Å; L350-K353 PolarHBondContact O-N 3.43Å; L350-I354 HydrophobicContact CD1-CD1 4.02Å; L350-I354 HydrophobicContact CD1-CG1 4.34Å; L350-I354 HydrophobicContact CG-CD1 3.89Å; L350-I354 WeakPolarHBondContact O-CB 3.48Å; L350-I354 WeakPolarHBondContact O-CD1 3.33Å; L350-I354 WeakPolarHBondContact O-CG1 3.32Å; L350-I354 PolarHBondContact O-N 3.25Å
351	Q	93.8	Very high	90.6	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-66	-39.5	177.2	-62.9	-59.6	-38.5	0	0	113.1	N302 M305 Q306 N309 D347 L348 I354 F355 L1056 S1057	N302-Q351 VanDerWaalsContact OD1-CG 3.29Å; N302-Q351 WeakPolarHBondContact OD1-CG 3.44Å; M305-Q351 HydrophobicContact CB-CB 3.91Å; M305-Q351 HydrophobicContact CG-CB 3.68Å; Q306-Q351 HydrophobicContact CG-CG 3.96Å; N309-Q351 PolarHBondContact ND2-O 3.35Å; N309-Q351 PolarHBondContact ND2-OE1 3.46Å; D347-Q351 WeakPolarHBondContact O-CG 3.5Å; D347-Q351 PolarHBondContact O-N 2.8Å; D347-Q351 VanDerWaalsContact O-N 3.08Å; L348-Q351 PolarHBondContact O-N 3.26Å; L348-Q351 VanDerWaalsContact O-N 3.15Å; Q351-I354 PolarHBondContact O-N 2.96Å; Q351-F355 PolarHBondContact O-N 2.97Å; Q351-L1056 PolarHBondContact NE2-O 2.96Å; Q351-S1057 PolarHBondContact NE2-O 2.91Å
352	V	93.6	Very high	90.5	Very high	1 Å²	1	50 Å²	50	1%	0.006	26%	0.261	C	S	.	.	H	α-helix	trans	-68	-37.5	175.4	178.1	0	0	0	0	111.3	M305 I337 L340 E341 L348 K349 F355 T356	M305-V352 HydrophobicContact CG-CG2 4.34Å; I337-V352 HydrophobicContact CG2-CG1 4.33Å; L340-V352 HydrophobicContact CB-CG2 3.65Å; L340-V352 HydrophobicContact CD1-CG2 4.49Å; E341-V352 HydrophobicContact CG-CG1 3.68Å; L348-V352 HydrophobicContact CD1-CG2 4.13Å; L348-V352 HydrophobicContact CG-CG2 4.47Å; L348-V352 WeakPolarHBondContact O-CG2 3.36Å; L348-V352 PolarHBondContact O-N 3.44Å; K349-V352 PolarHBondContact O-N 3.08Å; V352-F355 PolarHBondContact O-N 2.92Å; V352-T356 HydrophobicContact CG1-CG2 4.5Å; V352-T356 WeakPolarHBondContact O-CB 3.35Å; V352-T356 WeakPolarHBondContact O-CG2 3.37Å; V352-T356 PolarHBondContact O-N 2.94Å; V352-T356 PolarHBondContact O-OG1 2.95Å
353	K	92.6	Very high	90	Very high	107 Å²	107	46.9 Å²	46.9	47%	0.465	23%	0.233	S	C	.	.	H	α-helix	trans	-62.8	-45.3	172.3	-179.3	-176	167.2	-172.1	0	111.3	K349 L350 F355 T356 E357	K349-K353 WeakPolarHBondContact O-CB 3.17Å; K349-K353 PolarHBondContact O-N 2.92Å; L350-K353 PolarHBondContact O-N 3.43Å; K353-F355 PolarHBondContact O-N 3.12Å; K353-T356 WeakPolarHBondContact CA-OG1 3.07Å; K353-T356 PolarHBondContact O-N 2.84Å; K353-T356 PolarHBondContact O-OG1 2.93Å; K353-E357 VanDerWaalsContact CE-OE1 3.26Å; K353-E357 WeakPolarHBondContact CE-OE1 3.36Å; K353-E357 WeakPolarHBondContact CE-OE2 3.1Å; K353-E357 HydrophobicContact CG-CG 4.12Å; K353-E357 IonicContact NZ-OE2 3.87Å; K353-E357 WeakPolarHBondContact O-CB 3.46Å; K353-E357 WeakPolarHBondContact O-CG 3.37Å; K353-E357 PolarHBondContact O-N 3.38Å
354	I	92.3	Very high	89.5	Confident	19 Å²	19	48.8 Å²	48.8	10%	0.097	24%	0.239	C	C	.	.	H	α-helix	trans	-58.3	-48.8	176	-73.3	161.3	0	0	0	110.2	I313 L350 Q351 T356 H358 F1062	I313-I354 HydrophobicContact CD1-CG2 3.54Å; L350-I354 HydrophobicContact CD1-CD1 4.02Å; L350-I354 HydrophobicContact CD1-CG1 4.34Å; L350-I354 HydrophobicContact CG-CD1 3.89Å; L350-I354 WeakPolarHBondContact O-CB 3.48Å; L350-I354 WeakPolarHBondContact O-CD1 3.33Å; L350-I354 WeakPolarHBondContact O-CG1 3.32Å; L350-I354 PolarHBondContact O-N 3.25Å; Q351-I354 PolarHBondContact O-N 2.96Å; I354-T356 PolarHBondContact O-N 2.69Å; I354-H358 WeakPolarHBondContact O-CB 3.48Å; I354-H358 PolarHBondContact O-CD2 2.81Å; I354-H358 VanDerWaalsContact O-CD2 3.29Å; I354-H358 PolarHBondContact O-N 2.94Å; I354-F1062 HydrophobicContact CD1-CD2 4.17Å; I354-F1062 HydrophobicContact CG2-CB 4.32Å; I354-F1062 HydrophobicContact CG2-CD2 3.73Å; I354-F1062 HydrophobicContact CG2-CE2 4.3Å; I354-F1062 HydrophobicContact CG2-CG 4.05Å
355	F	93.6	Very high	89	Confident	2 Å²	2	42.1 Å²	42.1	1%	0.009	21%	0.21	C	C	.	.	H	α-helix	trans	-56.9	-51	176.5	-177.2	-102.2	0	0	0	112.4	M305 V308 N309 V312 S325 M329 L333 I337 Q351 V352 K353 R359	M305-F355 HydrophobicContact CE-CB 3.37Å; M305-F355 HydrophobicContact CE-CD1 4.02Å; M305-F355 HydrophobicContact CE-CD2 3.73Å; M305-F355 HydrophobicContact CE-CG 3.43Å; M305-F355 VanDerWaalsContact CE-CG 3.43Å; V308-F355 HydrophobicContact CG1-CD2 3.99Å; V308-F355 HydrophobicContact CG1-CE2 3.88Å; N309-F355 VanDerWaalsContact OD1-CB 3.3Å; N309-F355 WeakPolarHBondContact OD1-CB 3.33Å; V312-F355 HydrophobicContact CG1-CE2 4.42Å; V312-F355 HydrophobicContact CG2-CE2 4.37Å; S325-F355 WeakPolarHBondContact OG-CZ 3.29Å; M329-F355 HydrophobicContact SD-CE1 4.16Å; M329-F355 HydrophobicContact SD-CZ 4.48Å; L333-F355 HydrophobicContact CD2-CD1 4.5Å; L333-F355 HydrophobicContact CD2-CE1 3.86Å; L333-F355 HydrophobicContact CD2-CE2 4.04Å; L333-F355 HydrophobicContact CD2-CZ 3.6Å; I337-F355 HydrophobicContact CD1-CD1 4.24Å; I337-F355 HydrophobicContact CD1-CE1 3.96Å; Q351-F355 PolarHBondContact O-N 2.97Å; V352-F355 PolarHBondContact O-N 2.92Å; K353-F355 PolarHBondContact O-N 3.12Å; F355-R359 VanDerWaalsContact O-CB 3.23Å; F355-R359 WeakPolarHBondContact O-CB 3.32Å; F355-R359 PolarHBondContact O-N 3.44Å
356	T	91	Very high	88.2	Confident	22 Å²	22	42 Å²	42	14%	0.135	21%	0.207	C	C	.	.	H	α-helix	trans	-69.3	-41.7	-175.6	48.5	0	0	0	0	112.3	V352 K353 I354 R359 D360	V352-T356 HydrophobicContact CG1-CG2 4.5Å; V352-T356 WeakPolarHBondContact O-CB 3.35Å; V352-T356 WeakPolarHBondContact O-CG2 3.37Å; V352-T356 PolarHBondContact O-N 2.94Å; V352-T356 PolarHBondContact O-OG1 2.95Å; K353-T356 WeakPolarHBondContact CA-OG1 3.07Å; K353-T356 PolarHBondContact O-N 2.84Å; K353-T356 PolarHBondContact O-OG1 2.93Å; I354-T356 PolarHBondContact O-N 2.69Å; T356-R359 PolarHBondContact O-N 2.75Å; T356-D360 VanDerWaalsContact O-CB 3.23Å; T356-D360 WeakPolarHBondContact O-CB 3.46Å; T356-D360 PolarHBondContact O-N 3.01Å
357	E	90.4	Very high	87.2	Confident	58 Å²	58	37.2 Å²	37.2	27%	0.271	18%	0.184	S	C	.	.	H	α-helix	trans	-69	-35.3	177.6	-67.6	-170.5	149	0	0	112.7	K353 A361 K1067	K353-E357 VanDerWaalsContact CE-OE1 3.26Å; K353-E357 WeakPolarHBondContact CE-OE1 3.36Å; K353-E357 WeakPolarHBondContact CE-OE2 3.1Å; K353-E357 HydrophobicContact CG-CG 4.12Å; K353-E357 IonicContact NZ-OE2 3.87Å; K353-E357 WeakPolarHBondContact O-CB 3.46Å; K353-E357 WeakPolarHBondContact O-CG 3.37Å; K353-E357 PolarHBondContact O-N 3.38Å; E357-A361 VanDerWaalsContact O-CB 3.29Å; E357-A361 WeakPolarHBondContact O-CB 3.37Å; E357-A361 PolarHBondContact O-N 2.89Å; E357-A361 VanDerWaalsContact O-N 3.09Å; E357-K1067 WeakPolarHBondContact OE1-CE 3.4Å; E357-K1067 IonicContact OE1-NZ 2.57Å; E357-K1067 PolarHBondContact OE1-NZ 2.98Å
358	H	89.8	Confident	86.2	Confident	16 Å²	16	39.1 Å²	39.1	7%	0.074	19%	0.19	C	C	.	.	H	α-helix	trans	-67.9	-46.1	171.7	-88.3	-88.3	0	0	0	112.5	I313 I354 A361 D362 P1063	I313-H358 HydrophobicContact CD1-CB 4Å; I313-H358 HydrophobicContact CG1-CB 4.07Å; I313-H358 VanDerWaalsContact CG2-CE1 3.44Å; I313-H358 WeakPolarHBondContact CG2-CE1 3.37Å; I313-H358 WeakPolarHBondContact CG2-ND1 3.39Å; I354-H358 WeakPolarHBondContact O-CB 3.48Å; I354-H358 PolarHBondContact O-CD2 2.81Å; I354-H358 VanDerWaalsContact O-CD2 3.29Å; I354-H358 PolarHBondContact O-N 2.94Å; H358-A361 PolarHBondContact O-N 2.81Å; H358-D362 WeakPolarHBondContact O-CB 3.37Å; H358-D362 PolarHBondContact O-N 2.81Å; H358-P1063 PolarHBondContact CE1-O 3.23Å; H358-P1063 PolarHBondContact NE2-O 3.44Å; H358-P1063 VanDerWaalsContact NE2-O 3.16Å
359	R	87.3	Confident	85	Confident	64 Å²	64	44.7 Å²	44.7	24%	0.242	22%	0.216	C	C	.	.	H	α-helix	trans	-61.6	-43.8	177.3	-174.8	-154	76.7	114.6	4.3	111.8	F355 T356 A361 D362 L363	F355-R359 VanDerWaalsContact O-CB 3.23Å; F355-R359 WeakPolarHBondContact O-CB 3.32Å; F355-R359 PolarHBondContact O-N 3.44Å; T356-R359 PolarHBondContact O-N 2.75Å; R359-A361 VanDerWaalsContact C-N 3.31Å; R359-A361 PolarHBondContact O-N 3.31Å; R359-D362 PolarHBondContact O-N 3.17Å; R359-L363 HydrophobicContact CG-CD1 4.29Å; R359-L363 WeakPolarHBondContact O-CB 3.45Å; R359-L363 VanDerWaalsContact O-CG 3.26Å; R359-L363 WeakPolarHBondContact O-CG 3.5Å; R359-L363 PolarHBondContact O-N 3.42Å
360	D	85.5	Confident	83.5	Confident	69 Å²	69	46.2 Å²	46.2	37%	0.369	22%	0.224	S	C	.	.	H	α-helix	trans	-64.5	-36.7	177.8	-73.3	4.8	0	0	0	111.4	T356 E364	T356-D360 VanDerWaalsContact O-CB 3.23Å; T356-D360 WeakPolarHBondContact O-CB 3.46Å; T356-D360 PolarHBondContact O-N 3.01Å; D360-E364 PolarHBondContact O-N 3.17Å
361	A	84.4	Confident	81.9	Confident	26 Å²	26	51.1 Å²	51.1	22%	0.215	24%	0.244	C	C	.	.	H	α-helix	trans	-74	-41.1	176.6	0	0	0	0	0	113	E357 H358 R359 L363 E364 D365 R1065	E357-A361 VanDerWaalsContact O-CB 3.29Å; E357-A361 WeakPolarHBondContact O-CB 3.37Å; E357-A361 PolarHBondContact O-N 2.89Å; E357-A361 VanDerWaalsContact O-N 3.09Å; H358-A361 PolarHBondContact O-N 2.81Å; R359-A361 VanDerWaalsContact C-N 3.31Å; R359-A361 PolarHBondContact O-N 3.31Å; A361-L363 PolarHBondContact O-N 2.79Å; A361-E364 PolarHBondContact O-N 3.41Å; A361-D365 VanDerWaalsContact O-CG 3.3Å; A361-D365 PolarHBondContact O-N 2.57Å; A361-R1065 HydrophobicContact CB-CB 4.42Å
362	D	85.9	Confident	80.2	Confident	4 Å²	4	56.9 Å²	56.9	2%	0.021	28%	0.275	C	S	.	.	H	α-helix	trans	-64.3	-30.4	173.5	-73.2	-17.2	0	0	0	111.4	L318 R321 L322 H358 R359 L366 R1065	L318-D362 HydrophobicContact CD1-CB 3.72Å; R321-D362 IonicContact CZ-OD1 2.66Å; R321-D362 IonicContact CZ-OD2 2.74Å; R321-D362 IonicContact NE-OD1 2.79Å; R321-D362 PolarHBondContact NE-OD1 2.99Å; R321-D362 IonicContact NE-OD2 3.86Å; R321-D362 PolarHBondContact NE-OD2 3.42Å; R321-D362 IonicContact NH2-OD1 2.65Å; R321-D362 PolarHBondContact NH2-OD1 3.49Å; R321-D362 IonicContact NH2-OD2 2.67Å; L322-D362 HydrophobicContact CD2-CB 3.89Å; L322-D362 HydrophobicContact CG-CB 4.23Å; H358-D362 WeakPolarHBondContact O-CB 3.37Å; H358-D362 PolarHBondContact O-N 2.81Å; R359-D362 PolarHBondContact O-N 3.17Å; D362-L366 PolarHBondContact O-N 3.48Å; D362-R1065 IonicContact OD1-CZ 3.67Å; D362-R1065 VanDerWaalsContact OD1-CZ 3.28Å; D362-R1065 IonicContact OD1-NH1 3.46Å; D362-R1065 PolarHBondContact OD1-NH1 3.24Å; D362-R1065 IonicContact OD1-NH2 3.79Å
363	L	80.9	Confident	78.4	Confident	16 Å²	16	58.4 Å²	58.4	8%	0.084	28%	0.283	C	S	.	.	H	α-helix	trans	-71	-41.9	170.3	-75	169.9	0	0	0	112.7	L322 R359 A361 D365 L366 Y367	L322-L363 HydrophobicContact CD2-CD2 4.01Å; L322-L363 HydrophobicContact CD2-CG 4.21Å; R359-L363 HydrophobicContact CG-CD1 4.29Å; R359-L363 WeakPolarHBondContact O-CB 3.45Å; R359-L363 VanDerWaalsContact O-CG 3.26Å; R359-L363 WeakPolarHBondContact O-CG 3.5Å; R359-L363 PolarHBondContact O-N 3.42Å; A361-L363 PolarHBondContact O-N 2.79Å; L363-D365 VanDerWaalsContact C-N 3.35Å; L363-L366 WeakPolarHBondContact O-CB 3.41Å; L363-L366 PolarHBondContact O-N 2.96Å; L363-Y367 HydrophobicContact CB-CE1 4.49Å; L363-Y367 HydrophobicContact CB-CE2 4.2Å; L363-Y367 HydrophobicContact CD2-CE1 4.43Å; L363-Y367 WeakPolarHBondContact O-CD1 3.45Å; L363-Y367 WeakPolarHBondContact O-CD2 3.13Å; L363-Y367 PolarHBondContact O-N 2.94Å
364	E	78.2	Confident	76.8	Confident	61 Å²	61	60.5 Å²	60.5	29%	0.285	29%	0.288	S	S	.	.	H	α-helix	trans	-68.7	-32.7	175.5	-172.1	66	-155.4	0	0	112	D360 A361 Y367 Q368 R374	D360-E364 PolarHBondContact O-N 3.17Å; A361-E364 PolarHBondContact O-N 3.41Å; E364-Y367 CarbonylContact O-C 3.03Å; E364-Y367 PolarHBondContact O-N 3.43Å; E364-Q368 WeakPolarHBondContact O-CG 3.37Å; E364-Q368 PolarHBondContact O-N 3.23Å; E364-R374 IonicContact OE1-CZ 2.71Å; E364-R374 IonicContact OE1-NH2 3.15Å; E364-R374 PolarHBondContact OE1-NH2 3.41Å
365	D	78.4	Confident	75.3	Confident	45 Å²	45	62.6 Å²	62.6	24%	0.241	30%	0.302	C	S	.	.	H	α-helix	trans	-59.1	-47.2	170.1	-70.1	-19.1	0	0	0	110.8	L318 A361 L363 Y367 Q368 Q369 R1065	L318-D365 HydrophobicContact CD1-CB 4.4Å; L318-D365 HydrophobicContact CD2-CB 4.11Å; A361-D365 VanDerWaalsContact O-CG 3.3Å; A361-D365 PolarHBondContact O-N 2.57Å; L363-D365 VanDerWaalsContact C-N 3.35Å; D365-Y367 VanDerWaalsContact C-N 3.32Å; D365-Y367 PolarHBondContact O-N 2.77Å; D365-Q368 PolarHBondContact O-N 2.59Å; D365-Q369 WeakPolarHBondContact O-CG 3.35Å; D365-Q369 PolarHBondContact O-N 3.08Å; D365-R1065 IonicContact OD2-CZ 2.73Å; D365-R1065 IonicContact OD2-NH1 2.78Å; D365-R1065 PolarHBondContact OD2-NH1 3.18Å; D365-R1065 IonicContact OD2-NH2 3.34Å; D365-R1065 PolarHBondContact OD2-NH2 2.8Å
366	L	74.2	Confident	73.9	Confident	25 Å²	25	65.5 Å²	65.5	13%	0.131	32%	0.315	C	S	.	.	H	α-helix	trans	-60.5	-39.8	173.7	-176.3	73.4	0	0	0	111.7	L322 D362 L363 Q368 Q369 H370 L373	L322-L366 HydrophobicContact CD1-CB 4.14Å; L322-L366 HydrophobicContact CD1-CD1 4.27Å; L322-L366 HydrophobicContact CD1-CD2 4.19Å; L322-L366 HydrophobicContact CD1-CG 4.43Å; D362-L366 PolarHBondContact O-N 3.48Å; L363-L366 WeakPolarHBondContact O-CB 3.41Å; L363-L366 PolarHBondContact O-N 2.96Å; L366-Q368 VanDerWaalsContact C-N 3.33Å; L366-Q368 PolarHBondContact O-N 3.06Å; L366-Q369 PolarHBondContact O-N 3.26Å; L366-H370 PolarHBondContact O-N 2.97Å; L366-L373 HydrophobicContact CD1-CD1 4.5Å; L366-L373 HydrophobicContact CD2-CD1 4.31Å; L366-L373 HydrophobicContact CG-CD1 4.21Å
367	Y	70.7	Confident	72.8	Confident	27 Å²	27	67.4 Å²	67.4	11%	0.106	32%	0.323	C	S	.	.	H	α-helix	trans	-71.1	-24.9	177.8	-58.1	-18.5	0	0	0	113.4	L363 E364 D365 H370 E371 L373 R374	L363-Y367 HydrophobicContact CB-CE1 4.49Å; L363-Y367 HydrophobicContact CB-CE2 4.2Å; L363-Y367 HydrophobicContact CD2-CE1 4.43Å; L363-Y367 WeakPolarHBondContact O-CD1 3.45Å; L363-Y367 WeakPolarHBondContact O-CD2 3.13Å; L363-Y367 PolarHBondContact O-N 2.94Å; E364-Y367 CarbonylContact O-C 3.03Å; E364-Y367 PolarHBondContact O-N 3.43Å; D365-Y367 VanDerWaalsContact C-N 3.32Å; D365-Y367 PolarHBondContact O-N 2.77Å; Y367-H370 CarbonylContact O-C 3.36Å; Y367-E371 WeakPolarHBondContact O-CA 3.49Å; Y367-E371 PolarHBondContact O-N 3.09Å; Y367-L373 HydrophobicContact CD1-CB 4.04Å; Y367-L373 WeakPolarHBondContact CD1-O 3.21Å; Y367-L373 HydrophobicContact CE1-CB 4.46Å; Y367-L373 WeakPolarHBondContact CE1-O 3.41Å; Y367-R374 HydrophobicContact CD2-CG 4.08Å; Y367-R374 HydrophobicContact CG-CG 3.94Å
368	Q	69	Low	71.8	Confident	132 Å²	132	69.4 Å²	69.4	62%	0.617	34%	0.336	S	S	*	.	H	α-helix	trans	-78.5	-35.5	171.8	-74.1	179.2	38.4	0	0	111.9	E364 D365 L366 H370	E364-Q368 WeakPolarHBondContact O-CG 3.37Å; E364-Q368 PolarHBondContact O-N 3.23Å; D365-Q368 PolarHBondContact O-N 2.59Å; L366-Q368 VanDerWaalsContact C-N 3.33Å; L366-Q368 PolarHBondContact O-N 3.06Å; Q368-H370 VanDerWaalsContact C-N 3.28Å
369	Q	67.2	Low	71.2	Confident	117 Å²	117	71.4 Å²	71.4	55%	0.547	35%	0.35	S	S	.	.	H	α-helix	trans	-69.2	-29.6	170.9	-65.9	178.9	28.5	0	0	112	D365 L366	D365-Q369 WeakPolarHBondContact O-CG 3.35Å; D365-Q369 PolarHBondContact O-N 3.08Å; L366-Q369 PolarHBondContact O-N 3.26Å
370	H	62.8	Low	71	Confident	96 Å²	96	74 Å²	74	44%	0.444	37%	0.374	S	S	.	.			trans	-138.3	86.5	-177.8	-56.4	-40.1	0	0	0	111.7	L366 Y367 Q368 N372 L373	L366-H370 PolarHBondContact O-N 2.97Å; Y367-H370 CarbonylContact O-C 3.36Å; Q368-H370 VanDerWaalsContact C-N 3.28Å; H370-N372 PolarHBondContact O-N 3.27Å; H370-L373 HydrophobicContact CB-CB 4.17Å; H370-L373 HydrophobicContact CB-CD1 3.61Å; H370-L373 HydrophobicContact CB-CG 3.64Å; H370-L373 WeakPolarHBondContact O-CB 3.4Å; H370-L373 PolarHBondContact O-N 3.3Å
371	E	58.3	Low	71	Confident	166 Å²	166	79.7 Å²	79.7	78%	0.776	39%	0.391	S	S	*	.	G	3₁₀ helix	trans	-50.5	-31.8	-177.4	-60.7	-173	146.8	0	0	114.1	Y367 L373	Y367-E371 WeakPolarHBondContact O-CA 3.49Å; Y367-E371 PolarHBondContact O-N 3.09Å; E371-L373 VanDerWaalsContact C-N 3.26Å; E371-L373 PolarHBondContact O-N 2.8Å
372	N	57.7	Low	70.9	Confident	121 Å²	121	81 Å²	81	65%	0.647	39%	0.392	S	S	*	.	G	3₁₀ helix	trans	-69.6	-14	178.7	-69.5	-34.5	0	0	0	114.5	H370	H370-N372 PolarHBondContact O-N 3.27Å
373	L	56.1	Low	70.8	Confident	33 Å²	33	82.4 Å²	82.4	17%	0.173	40%	0.402	C	S	.	.	G	3₁₀ helix	trans	-93.5	10.4	-171.2	-65.1	-171.4	0	0	0	115.4	L366 Y367 H370 E371 V375 M377 M386	L366-L373 HydrophobicContact CD1-CD1 4.5Å; L366-L373 HydrophobicContact CD2-CD1 4.31Å; L366-L373 HydrophobicContact CG-CD1 4.21Å; Y367-L373 HydrophobicContact CD1-CB 4.04Å; Y367-L373 WeakPolarHBondContact CD1-O 3.21Å; Y367-L373 HydrophobicContact CE1-CB 4.46Å; Y367-L373 WeakPolarHBondContact CE1-O 3.41Å; H370-L373 HydrophobicContact CB-CB 4.17Å; H370-L373 HydrophobicContact CB-CD1 3.61Å; H370-L373 HydrophobicContact CB-CG 3.64Å; H370-L373 WeakPolarHBondContact O-CB 3.4Å; H370-L373 PolarHBondContact O-N 3.3Å; E371-L373 VanDerWaalsContact C-N 3.26Å; E371-L373 PolarHBondContact O-N 2.8Å; L373-V375 PolarHBondContact O-N 3.09Å; L373-M377 HydrophobicContact CB-CE 4.38Å; L373-M377 HydrophobicContact CD2-CE 3.97Å; L373-M386 VanDerWaalsContact C-CE 3.44Å; L373-M386 HydrophobicContact CB-CE 4.22Å; L373-M386 HydrophobicContact CD2-CE 4.08Å; L373-M386 WeakPolarHBondContact O-CE 3.5Å
374	R	58.5	Low	71.1	Confident	151 Å²	151	85.8 Å²	85.8	57%	0.57	41%	0.414	S	S	*	.			trans	-64.3	32.1	-174.7	-77	-175.5	149.3	-156.9	-10.6	117.7	E364 Y367	E364-R374 IonicContact OE1-CZ 2.71Å; E364-R374 IonicContact OE1-NH2 3.15Å; E364-R374 PolarHBondContact OE1-NH2 3.41Å; Y367-R374 HydrophobicContact CD2-CG 4.08Å; Y367-R374 HydrophobicContact CG-CG 3.94Å
375	V	62.2	Low	71.4	Confident	63 Å²	63	84.9 Å²	84.9	38%	0.382	41%	0.411	S	S	.	.	S	Bend	trans	-137.4	146.5	177.4	169.9	0	0	0	0	109.6	L373 K382 M386	L373-V375 PolarHBondContact O-N 3.09Å; V375-K382 HydrophobicContact CG1-CB 4.3Å; V375-K382 HydrophobicContact CG1-CD 3.92Å; V375-K382 HydrophobicContact CG1-CG 4.21Å; V375-M386 HydrophobicContact CB-CE 3.78Å; V375-M386 HydrophobicContact CB-CG 4.33Å; V375-M386 HydrophobicContact CB-SD 3.57Å; V375-M386 VanDerWaalsContact CB-SD 3.57Å; V375-M386 HydrophobicContact CG1-SD 3.78Å; V375-M386 VanDerWaalsContact O-CE 3.31Å; V375-M386 WeakPolarHBondContact O-CE 3.4Å
376	E	63	Low	71.4	Confident	63 Å²	63	83.2 Å²	83.2	29%	0.294	40%	0.402	S	S	.	.			trans	-64.7	138.3	-171.5	-59.1	150.8	154.7	0	0	113.4	D378 K382	E376-D378 PolarHBondContact O-N 2.89Å; E376-K382 HydrophobicContact CB-CD 4.3Å; E376-K382 WeakPolarHBondContact O-CB 3.16Å; E376-K382 WeakPolarHBondContact O-CD 3.36Å; E376-K382 IonicContact OE2-NZ 3.62Å; E376-K382 PolarHBondContact OE2-NZ 2.72Å
377	M	68.6	Low	71.9	Confident	62 Å²	62	85.6 Å²	85.6	31%	0.305	41%	0.414	S	S	.	.			trans	-86.1	25.7	178.1	-61.1	-64.2	168.4	0	0	113.9	L373 T379 C383 M386	L373-M377 HydrophobicContact CB-CE 4.38Å; L373-M377 HydrophobicContact CD2-CE 3.97Å; M377-T379 VanDerWaalsContact C-N 3.34Å; M377-T379 PolarHBondContact O-N 3.48Å; M377-C383 HydrophobicContact SD-CB 4.37Å; M377-C383 VanDerWaalsContact SD-SG 3.69Å; M377-M386 HydrophobicContact CE-CE 3.35Å; M377-M386 HydrophobicContact CE-SD 3.9Å; M377-M386 HydrophobicContact SD-CE 4.45Å; M377-M386 HydrophobicContact SD-SD 4.26Å
378	D	70.1	Confident	72.6	Confident	100 Å²	100	88.3 Å²	88.3	54%	0.535	43%	0.428	S	S	.	.	S	Bend	trans	-75.5	-18.4	-171.1	71.4	-11.7	0	0	0	114.6	E376 K382	E376-D378 PolarHBondContact O-N 2.89Å; D378-K382 WeakPolarHBondContact OD1-CD 3.48Å; D378-K382 WeakPolarHBondContact OD1-CE 3.31Å; D378-K382 IonicContact OD1-NZ 3.8Å; D378-K382 PolarHBondContact OD1-NZ 3.04Å; D378-K382 IonicContact OD2-NZ 3.67Å; D378-K382 PolarHBondContact OD2-NZ 2.97Å
379	T	76.9	Confident	73.3	Confident	59 Å²	59	89.2 Å²	89.2	36%	0.362	43%	0.426	S	S	.	.	S	Bend	trans	-143.1	135.9	-168.6	45.8	0	0	0	0	110.8	M377 R381 K382 C383	M377-T379 VanDerWaalsContact C-N 3.34Å; M377-T379 PolarHBondContact O-N 3.48Å; T379-R381 PolarHBondContact O-N 3.22Å; T379-K382 PolarHBondContact O-N 3.03Å; T379-K382 WeakPolarHBondContact OG1-CG 3.34Å; T379-C383 PolarHBondContact O-N 2.92Å; T379-C383 PolarHBondContact O-SG 2.91Å; T379-C383 VanDerWaalsContact O-SG 3.33Å
380	P	81.9	Confident	73.9	Confident	117 Å²	117	85.4 Å²	85.4	76%	0.76	41%	0.412	S	S	*	.	H	α-helix	trans	-54.2	-26.6	-178	-28.8	35.1	0	0	0	114.4	Y384	P380-Y384 WeakPolarHBondContact O-CB 3.29Å; P380-Y384 PolarHBondContact O-N 2.83Å
381	R	86	Confident	74.9	Confident	190 Å²	190	82.4 Å²	82.4	72%	0.717	40%	0.399	S	S	*	.	H	α-helix	trans	-77.5	-38	177.6	-168.4	164.3	-170.8	147.2	7.2	113.9	T379 C383 Y384 D385	T379-R381 PolarHBondContact O-N 3.22Å; R381-C383 VanDerWaalsContact C-N 3.31Å; R381-Y384 PolarHBondContact O-N 2.9Å; R381-D385 IonicContact NE-OD1 2.71Å; R381-D385 VanDerWaalsContact O-CB 3.3Å; R381-D385 WeakPolarHBondContact O-CB 3.39Å; R381-D385 PolarHBondContact O-N 3.21Å
382	K	82.7	Confident	76	Confident	54 Å²	54	77 Å²	77	24%	0.235	38%	0.379	C	S	.	.	H	α-helix	trans	-60.7	-46.7	170.7	-73.8	-177.9	-161.1	162.9	0	109.4	V375 E376 D378 T379 Y384 D385 M386	V375-K382 HydrophobicContact CG1-CB 4.3Å; V375-K382 HydrophobicContact CG1-CD 3.92Å; V375-K382 HydrophobicContact CG1-CG 4.21Å; E376-K382 HydrophobicContact CB-CD 4.3Å; E376-K382 WeakPolarHBondContact O-CB 3.16Å; E376-K382 WeakPolarHBondContact O-CD 3.36Å; E376-K382 IonicContact OE2-NZ 3.62Å; E376-K382 PolarHBondContact OE2-NZ 2.72Å; D378-K382 WeakPolarHBondContact OD1-CD 3.48Å; D378-K382 WeakPolarHBondContact OD1-CE 3.31Å; D378-K382 IonicContact OD1-NZ 3.8Å; D378-K382 PolarHBondContact OD1-NZ 3.04Å; D378-K382 IonicContact OD2-NZ 3.67Å; D378-K382 PolarHBondContact OD2-NZ 2.97Å; T379-K382 PolarHBondContact O-N 3.03Å; T379-K382 WeakPolarHBondContact OG1-CG 3.34Å; K382-Y384 PolarHBondContact O-N 3.48Å; K382-D385 PolarHBondContact O-N 2.73Å; K382-M386 WeakPolarHBondContact O-CB 3.44Å; K382-M386 WeakPolarHBondContact O-CG 3.41Å; K382-M386 PolarHBondContact O-N 2.95Å
383	C	82.9	Confident	77	Confident	33 Å²	33	79 Å²	79	22%	0.223	39%	0.39	C	S	.	.	H	α-helix	trans	-58.7	-45.1	177.1	-50	0	0	0	0	112.4	M377 T379 R381 M386 L387	M377-C383 HydrophobicContact SD-CB 4.37Å; M377-C383 VanDerWaalsContact SD-SG 3.69Å; T379-C383 PolarHBondContact O-N 2.92Å; T379-C383 PolarHBondContact O-SG 2.91Å; T379-C383 VanDerWaalsContact O-SG 3.33Å; R381-C383 VanDerWaalsContact C-N 3.31Å; C383-M386 PolarHBondContact O-N 3.09Å; C383-L387 WeakPolarHBondContact O-CG 3.33Å; C383-L387 PolarHBondContact O-N 3.29Å
384	Y	87.7	Confident	78	Confident	87 Å²	87	79.8 Å²	79.8	34%	0.341	40%	0.396	S	S	.	.	H	α-helix	trans	-59.7	-54.4	174	175.4	-86.1	0	0	0	112	P380 R381 K382 M386 L387 E388 F400 L404	P380-Y384 WeakPolarHBondContact O-CB 3.29Å; P380-Y384 PolarHBondContact O-N 2.83Å; R381-Y384 PolarHBondContact O-N 2.9Å; K382-Y384 PolarHBondContact O-N 3.48Å; Y384-M386 PolarHBondContact O-N 3.38Å; Y384-M386 VanDerWaalsContact O-N 3.12Å; Y384-L387 PolarHBondContact O-N 3.41Å; Y384-L387 VanDerWaalsContact O-N 3.13Å; Y384-E388 HydrophobicContact CD1-CB 4.48Å; Y384-E388 HydrophobicContact CE1-CB 3.97Å; Y384-E388 VanDerWaalsContact CE1-CD 3.47Å; Y384-E388 HydrophobicContact CE1-CG 4.28Å; Y384-E388 WeakPolarHBondContact CE1-OE1 3.4Å; Y384-E388 VanDerWaalsContact CZ-OE1 3.3Å; Y384-E388 WeakPolarHBondContact O-CB 3.46Å; Y384-E388 PolarHBondContact O-N 2.67Å; Y384-E388 PolarHBondContact OH-OE1 2.63Å; Y384-F400 HydrophobicContact CD2-CZ 4.25Å; Y384-F400 HydrophobicContact CE2-CE1 4.26Å; Y384-F400 HydrophobicContact CE2-CZ 4.39Å; Y384-L404 HydrophobicContact CD2-CD1 4.2Å; Y384-L404 HydrophobicContact CE2-CD1 3.66Å
385	D	84.2	Confident	78.9	Confident	42 Å²	42	77.5 Å²	77.5	23%	0.225	40%	0.401	C	S	.	.	H	α-helix	trans	-57	-30.3	-177.8	-82.9	31.7	0	0	0	111.7	R381 K382 R389	R381-D385 IonicContact NE-OD1 2.71Å; R381-D385 VanDerWaalsContact O-CB 3.3Å; R381-D385 WeakPolarHBondContact O-CB 3.39Å; R381-D385 PolarHBondContact O-N 3.21Å; K382-D385 PolarHBondContact O-N 2.73Å; D385-R389 WeakPolarHBondContact O-CB 3.45Å; D385-R389 VanDerWaalsContact O-CD 3.23Å; D385-R389 WeakPolarHBondContact O-CD 3.38Å; D385-R389 WeakPolarHBondContact O-CG 3.5Å; D385-R389 PolarHBondContact O-N 3.36Å; D385-R389 PolarHBondContact O-NE 3.47Å; D385-R389 IonicContact OD2-NH2 2.62Å; D385-R389 PolarHBondContact OD2-NH2 3.31Å; D385-R389 VanDerWaalsContact OD2-NH2 3.15Å
386	M	78.8	Confident	79.9	Confident	9 Å²	9	77.9 Å²	77.9	4%	0.044	40%	0.404	C	S	.	.	H	α-helix	trans	-81.6	-41	177.7	-66.7	166.7	74.9	0	0	112.9	L373 V375 M377 K382 C383 Y384 R389 S390	L373-M386 VanDerWaalsContact C-CE 3.44Å; L373-M386 HydrophobicContact CB-CE 4.22Å; L373-M386 HydrophobicContact CD2-CE 4.08Å; L373-M386 WeakPolarHBondContact O-CE 3.5Å; V375-M386 HydrophobicContact CB-CE 3.78Å; V375-M386 HydrophobicContact CB-CG 4.33Å; V375-M386 HydrophobicContact CB-SD 3.57Å; V375-M386 VanDerWaalsContact CB-SD 3.57Å; V375-M386 HydrophobicContact CG1-SD 3.78Å; V375-M386 VanDerWaalsContact O-CE 3.31Å; V375-M386 WeakPolarHBondContact O-CE 3.4Å; M377-M386 HydrophobicContact CE-CE 3.35Å; M377-M386 HydrophobicContact CE-SD 3.9Å; M377-M386 HydrophobicContact SD-CE 4.45Å; M377-M386 HydrophobicContact SD-SD 4.26Å; K382-M386 WeakPolarHBondContact O-CB 3.44Å; K382-M386 WeakPolarHBondContact O-CG 3.41Å; K382-M386 PolarHBondContact O-N 2.95Å; C383-M386 PolarHBondContact O-N 3.09Å; Y384-M386 PolarHBondContact O-N 3.38Å; Y384-M386 VanDerWaalsContact O-N 3.12Å; M386-R389 PolarHBondContact O-N 3.34Å; M386-S390 WeakPolarHBondContact O-CB 3.36Å; M386-S390 PolarHBondContact O-N 2.86Å; M386-S390 PolarHBondContact O-OG 3.02Å
387	L	84.7	Confident	81	Confident	75 Å²	75	78 Å²	78	39%	0.393	41%	0.406	S	S	.	.	H	α-helix	trans	-64.8	-44.1	173.4	-71.8	168.2	0	0	0	110.5	C383 Y384 R389 S390 L391 F400	C383-L387 WeakPolarHBondContact O-CG 3.33Å; C383-L387 PolarHBondContact O-N 3.29Å; Y384-L387 PolarHBondContact O-N 3.41Å; Y384-L387 VanDerWaalsContact O-N 3.13Å; L387-R389 PolarHBondContact O-N 3.33Å; L387-S390 PolarHBondContact O-N 2.94Å; L387-S390 PolarHBondContact O-OG 2.95Å; L387-L391 VanDerWaalsContact O-CB 3.22Å; L387-L391 WeakPolarHBondContact O-CB 3.24Å; L387-L391 WeakPolarHBondContact O-CG 3.44Å; L387-L391 PolarHBondContact O-N 3.08Å; L387-F400 HydrophobicContact CB-CE1 4.05Å; L387-F400 HydrophobicContact CB-CE2 3.96Å; L387-F400 HydrophobicContact CB-CZ 3.55Å; L387-F400 HydrophobicContact CD1-CE2 3.82Å; L387-F400 HydrophobicContact CD1-CZ 4.05Å; L387-F400 HydrophobicContact CG-CE2 4.45Å; L387-F400 HydrophobicContact CG-CZ 4.44Å
388	E	85.9	Confident	81.9	Confident	84 Å²	84	81.1 Å²	81.1	39%	0.393	42%	0.423	S	S	.	.	H	α-helix	trans	-59.2	-44.2	175.1	-175	179.9	-112.3	0	0	111.9	Y384 S392	Y384-E388 HydrophobicContact CD1-CB 4.48Å; Y384-E388 HydrophobicContact CE1-CB 3.97Å; Y384-E388 VanDerWaalsContact CE1-CD 3.47Å; Y384-E388 HydrophobicContact CE1-CG 4.28Å; Y384-E388 WeakPolarHBondContact CE1-OE1 3.4Å; Y384-E388 VanDerWaalsContact CZ-OE1 3.3Å; Y384-E388 WeakPolarHBondContact O-CB 3.46Å; Y384-E388 PolarHBondContact O-N 2.67Å; Y384-E388 PolarHBondContact OH-OE1 2.63Å; E388-S392 VanDerWaalsContact O-CB 3.31Å; E388-S392 WeakPolarHBondContact O-CB 3.28Å; E388-S392 PolarHBondContact O-N 2.96Å
389	R	82.9	Confident	82.7	Confident	152 Å²	152	79.8 Å²	79.8	57%	0.574	42%	0.42	S	S	*	.	H	α-helix	trans	-66.7	-50	176.6	-73.3	167.8	-154.9	164.6	12.1	112.9	D385 M386 L387 L391 S392	D385-R389 WeakPolarHBondContact O-CB 3.45Å; D385-R389 VanDerWaalsContact O-CD 3.23Å; D385-R389 WeakPolarHBondContact O-CD 3.38Å; D385-R389 WeakPolarHBondContact O-CG 3.5Å; D385-R389 PolarHBondContact O-N 3.36Å; D385-R389 PolarHBondContact O-NE 3.47Å; D385-R389 IonicContact OD2-NH2 2.62Å; D385-R389 PolarHBondContact OD2-NH2 3.31Å; D385-R389 VanDerWaalsContact OD2-NH2 3.15Å; M386-R389 PolarHBondContact O-N 3.34Å; L387-R389 PolarHBondContact O-N 3.33Å; R389-L391 VanDerWaalsContact C-N 3.3Å; R389-L391 PolarHBondContact O-N 2.91Å; R389-S392 WeakPolarHBondContact O-CB 3.02Å; R389-S392 PolarHBondContact O-N 3.5Å; R389-S392 PolarHBondContact O-OG 2.88Å
390	S	80	Confident	83.4	Confident	36 Å²	36	78.3 Å²	78.3	25%	0.252	41%	0.409	S	S	.	.	H	α-helix	trans	-70	-25.6	-176.4	55.8	0	0	0	0	113.5	M386 L387	M386-S390 WeakPolarHBondContact O-CB 3.36Å; M386-S390 PolarHBondContact O-N 2.86Å; M386-S390 PolarHBondContact O-OG 3.02Å; L387-S390 PolarHBondContact O-N 2.94Å; L387-S390 PolarHBondContact O-OG 2.95Å
391	L	84.5	Confident	83.8	Confident	33 Å²	33	76.6 Å²	76.6	17%	0.173	39%	0.393	C	S	.	.	H	α-helix	trans	-95	-6.1	173.6	-54.8	177.8	0	0	0	113.1	L387 R389 N393 T394 T396 L397 F400	L387-L391 VanDerWaalsContact O-CB 3.22Å; L387-L391 WeakPolarHBondContact O-CB 3.24Å; L387-L391 WeakPolarHBondContact O-CG 3.44Å; L387-L391 PolarHBondContact O-N 3.08Å; R389-L391 VanDerWaalsContact C-N 3.3Å; R389-L391 PolarHBondContact O-N 2.91Å; L391-N393 PolarHBondContact O-N 3.29Å; L391-T394 WeakPolarHBondContact O-CB 3.4Å; L391-T394 PolarHBondContact O-N 3.35Å; L391-T394 PolarHBondContact O-OG1 3.44Å; L391-T396 HydrophobicContact CD2-CG2 3.86Å; L391-L397 HydrophobicContact CB-CD1 4.46Å; L391-F400 HydrophobicContact CD1-CB 3.64Å; L391-F400 HydrophobicContact CD1-CD1 3.95Å; L391-F400 HydrophobicContact CD1-CD2 4.14Å; L391-F400 HydrophobicContact CD1-CG 3.65Å
392	S	81.8	Confident	84	Confident	53 Å²	53	69.9 Å²	69.9	37%	0.371	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	138.3	177.9	71.1	0	0	0	0	111.6	E388 R389 T394	E388-S392 VanDerWaalsContact O-CB 3.31Å; E388-S392 WeakPolarHBondContact O-CB 3.28Å; E388-S392 PolarHBondContact O-N 2.96Å; R389-S392 WeakPolarHBondContact O-CB 3.02Å; R389-S392 PolarHBondContact O-N 3.5Å; R389-S392 PolarHBondContact O-OG 2.88Å; S392-T394 PolarHBondContact O-N 2.99Å; S392-T394 VanDerWaalsContact O-N 3.09Å
393	N	77	Confident	84.5	Confident	164 Å²	164	72 Å²	72	88%	0.877	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.5	8.8	-174.5	-46.4	-72.3	0	0	0	115.5	L391	L391-N393 PolarHBondContact O-N 3.29Å
394	T	78	Confident	85	Confident	48 Å²	48	72.8 Å²	72.8	29%	0.294	39%	0.389	S	S	.	.	S	Bend	trans	-98.1	152.3	172.6	78.1	0	0	0	0	111.2	L391 S392 T396 L397	L391-T394 WeakPolarHBondContact O-CB 3.4Å; L391-T394 PolarHBondContact O-N 3.35Å; L391-T394 PolarHBondContact O-OG1 3.44Å; S392-T394 PolarHBondContact O-N 2.99Å; S392-T394 VanDerWaalsContact O-N 3.09Å; T394-T396 PolarHBondContact O-N 3.44Å; T394-T396 WeakPolarHBondContact OG1-CB 3.35Å; T394-T396 PolarHBondContact OG1-N 3.47Å; T394-L397 WeakPolarHBondContact O-CB 3.32Å; T394-L397 PolarHBondContact O-N 3.06Å
395	P	76.8	Confident	85.2	Confident	104 Å²	104	73.4 Å²	73.4	68%	0.675	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-23.3	171.9	26.1	-34.8	0	0	0	112.8	L397 L398 P399	P395-L397 PolarHBondContact O-N 2.9Å; P395-L398 PolarHBondContact O-N 3.48Å; P395-P399 VanDerWaalsContact O-CD 3.31Å; P395-P399 WeakPolarHBondContact O-CD 3.48Å
396	T	82.7	Confident	85.6	Confident	71 Å²	71	76.9 Å²	76.9	44%	0.436	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-18.1	178.9	-41.6	0	0	0	0	113.5	L391 T394 L398 P399 F400	L391-T396 HydrophobicContact CD2-CG2 3.86Å; T394-T396 PolarHBondContact O-N 3.44Å; T394-T396 WeakPolarHBondContact OG1-CB 3.35Å; T394-T396 PolarHBondContact OG1-N 3.47Å; T396-L398 PolarHBondContact O-N 2.93Å; T396-P399 WeakPolarHBondContact O-CD 3.41Å; T396-F400 PolarHBondContact O-N 2.95Å; T396-F400 VanDerWaalsContact O-N 3.07Å
397	L	87	Confident	86.2	Confident	65 Å²	65	79 Å²	79	34%	0.34	42%	0.421	S	S	.	.	H	α-helix	trans	-59.4	-33.1	176.1	-173.6	60.9	0	0	0	112.9	L391 T394 P395 F400 L401	L391-L397 HydrophobicContact CB-CD1 4.46Å; T394-L397 WeakPolarHBondContact O-CB 3.32Å; T394-L397 PolarHBondContact O-N 3.06Å; P395-L397 PolarHBondContact O-N 2.9Å; L397-F400 HydrophobicContact CD1-CD1 4.38Å; L397-F400 PolarHBondContact O-N 3.36Å; L397-L401 WeakPolarHBondContact O-CB 3.39Å; L397-L401 PolarHBondContact O-N 2.94Å
398	L	87.2	Confident	86.4	Confident	127 Å²	127	82.4 Å²	82.4	67%	0.665	44%	0.439	S	S	*	.	H	α-helix	trans	-72.3	-47.9	179.2	-70	173.7	0	0	0	112.6	P395 T396 F400 L401 S402	P395-L398 PolarHBondContact O-N 3.48Å; T396-L398 PolarHBondContact O-N 2.93Å; L398-F400 VanDerWaalsContact C-N 3.31Å; L398-F400 PolarHBondContact O-N 3.14Å; L398-L401 PolarHBondContact O-N 2.92Å; L398-S402 WeakPolarHBondContact O-CB 3.41Å; L398-S402 PolarHBondContact O-N 3.42Å
399	P	86.3	Confident	86.6	Confident	73 Å²	73	83.4 Å²	83.4	47%	0.474	45%	0.447	S	S	.	.	H	α-helix	trans	-51.8	-43.8	165.2	-30.8	35	0	0	0	114	P395 T396 S402 I403	P395-P399 VanDerWaalsContact O-CD 3.31Å; P395-P399 WeakPolarHBondContact O-CD 3.48Å; T396-P399 WeakPolarHBondContact O-CD 3.41Å; P399-S402 WeakPolarHBondContact O-CB 3.39Å; P399-S402 PolarHBondContact O-N 2.97Å; P399-I403 WeakPolarHBondContact O-CG1 3.47Å; P399-I403 PolarHBondContact O-N 3.03Å
400	F	92.7	Very high	86.8	Confident	27 Å²	27	77.4 Å²	77.4	12%	0.118	43%	0.427	C	S	.	.	H	α-helix	trans	-64.2	-46.8	178.9	178	-120.9	0	0	0	112.6	Y384 L387 L391 T396 L397 L398 S402 I403 L404	Y384-F400 HydrophobicContact CD2-CZ 4.25Å; Y384-F400 HydrophobicContact CE2-CE1 4.26Å; Y384-F400 HydrophobicContact CE2-CZ 4.39Å; L387-F400 HydrophobicContact CB-CE1 4.05Å; L387-F400 HydrophobicContact CB-CE2 3.96Å; L387-F400 HydrophobicContact CB-CZ 3.55Å; L387-F400 HydrophobicContact CD1-CE2 3.82Å; L387-F400 HydrophobicContact CD1-CZ 4.05Å; L387-F400 HydrophobicContact CG-CE2 4.45Å; L387-F400 HydrophobicContact CG-CZ 4.44Å; L391-F400 HydrophobicContact CD1-CB 3.64Å; L391-F400 HydrophobicContact CD1-CD1 3.95Å; L391-F400 HydrophobicContact CD1-CD2 4.14Å; L391-F400 HydrophobicContact CD1-CG 3.65Å; T396-F400 PolarHBondContact O-N 2.95Å; T396-F400 VanDerWaalsContact O-N 3.07Å; L397-F400 HydrophobicContact CD1-CD1 4.38Å; L397-F400 PolarHBondContact O-N 3.36Å; L398-F400 VanDerWaalsContact C-N 3.31Å; L398-F400 PolarHBondContact O-N 3.14Å; F400-S402 VanDerWaalsContact C-N 3.28Å; F400-S402 PolarHBondContact O-N 3.34Å; F400-I403 PolarHBondContact O-N 3.41Å; F400-L404 HydrophobicContact CD1-CD1 4.16Å; F400-L404 HydrophobicContact CE1-CD1 3.74Å; F400-L404 HydrophobicContact CE2-CD1 4.17Å; F400-L404 HydrophobicContact CE2-CD2 4.24Å; F400-L404 HydrophobicContact CE2-CG 4.17Å; F400-L404 HydrophobicContact CZ-CD1 3.74Å; F400-L404 HydrophobicContact CZ-CD2 4.31Å; F400-L404 HydrophobicContact CZ-CG 4.22Å; F400-L404 WeakPolarHBondContact O-CG 3.21Å; F400-L404 PolarHBondContact O-N 2.82Å
401	L	89.7	Confident	86.9	Confident	82 Å²	82	85.2 Å²	85.2	43%	0.429	45%	0.451	S	S	.	.	H	α-helix	trans	-58.1	-40.8	173.2	177.1	60.4	0	0	0	111.8	L397 L398 L404 Q405	L397-L401 WeakPolarHBondContact O-CB 3.39Å; L397-L401 PolarHBondContact O-N 2.94Å; L398-L401 PolarHBondContact O-N 2.92Å; L401-L404 PolarHBondContact O-N 3.43Å; L401-Q405 HydrophobicContact CD1-CG 4.39Å; L401-Q405 VanDerWaalsContact O-CG 3.28Å; L401-Q405 WeakPolarHBondContact O-CG 3.32Å; L401-Q405 PolarHBondContact O-N 3.02Å
402	S	90.6	Very high	86.8	Confident	49 Å²	49	85.6 Å²	85.6	34%	0.343	46%	0.462	S	S	.	.	H	α-helix	trans	-61.5	-45.4	175.2	-175.9	0	0	0	0	111.9	L398 P399 F400 L404 Q405 H406	L398-S402 WeakPolarHBondContact O-CB 3.41Å; L398-S402 PolarHBondContact O-N 3.42Å; P399-S402 WeakPolarHBondContact O-CB 3.39Å; P399-S402 PolarHBondContact O-N 2.97Å; F400-S402 VanDerWaalsContact C-N 3.28Å; F400-S402 PolarHBondContact O-N 3.34Å; S402-L404 PolarHBondContact O-N 3.34Å; S402-Q405 PolarHBondContact O-N 2.96Å; S402-H406 PolarHBondContact O-N 3.47Å; S402-H406 PolarHBondContact O-ND1 3.24Å; S402-H406 PolarHBondContact OG-CE1 3.17Å
403	I	93.7	Very high	86.9	Confident	99 Å²	99	86.9 Å²	86.9	51%	0.508	47%	0.465	S	S	.	.	H	α-helix	trans	-56.8	-50.9	175.9	-70	160.2	0	0	0	110.2	P399 F400 Q405 H406 L407	P399-I403 WeakPolarHBondContact O-CG1 3.47Å; P399-I403 PolarHBondContact O-N 3.03Å; F400-I403 PolarHBondContact O-N 3.41Å; I403-Q405 VanDerWaalsContact C-N 3.32Å; I403-Q405 PolarHBondContact O-N 3.07Å; I403-H406 PolarHBondContact O-N 2.9Å; I403-H406 VanDerWaalsContact O-N 3.07Å; I403-L407 HydrophobicContact CG2-CD1 4.46Å; I403-L407 WeakPolarHBondContact O-CG 3.44Å; I403-L407 PolarHBondContact O-N 3.25Å
404	L	93.3	Very high	87.2	Confident	48 Å²	48	86.8 Å²	86.8	25%	0.251	46%	0.46	S	S	.	.	H	α-helix	trans	-59.7	-40.4	179.2	-64.8	173.7	0	0	0	112.7	Y384 F400 L401 S402 H406 L407 L408	Y384-L404 HydrophobicContact CD2-CD1 4.2Å; Y384-L404 HydrophobicContact CE2-CD1 3.66Å; F400-L404 HydrophobicContact CD1-CD1 4.16Å; F400-L404 HydrophobicContact CE1-CD1 3.74Å; F400-L404 HydrophobicContact CE2-CD1 4.17Å; F400-L404 HydrophobicContact CE2-CD2 4.24Å; F400-L404 HydrophobicContact CE2-CG 4.17Å; F400-L404 HydrophobicContact CZ-CD1 3.74Å; F400-L404 HydrophobicContact CZ-CD2 4.31Å; F400-L404 HydrophobicContact CZ-CG 4.22Å; F400-L404 WeakPolarHBondContact O-CG 3.21Å; F400-L404 PolarHBondContact O-N 2.82Å; L401-L404 PolarHBondContact O-N 3.43Å; S402-L404 PolarHBondContact O-N 3.34Å; L404-H406 VanDerWaalsContact C-N 3.34Å; L404-H406 PolarHBondContact O-N 3.37Å; L404-L407 HydrophobicContact CD2-CD1 4.49Å; L404-L407 PolarHBondContact O-N 3.19Å; L404-L408 WeakPolarHBondContact O-CG 3.43Å; L404-L408 PolarHBondContact O-N 2.96Å; L404-L408 VanDerWaalsContact O-N 3.14Å
405	Q	92.1	Very high	87.4	Confident	101 Å²	101	92.1 Å²	92.1	47%	0.472	48%	0.481	S	S	.	.	H	α-helix	trans	-60.8	-41.8	174.3	-73.9	172.1	2.8	0	0	111.7	L401 S402 I403 L408 L409	L401-Q405 HydrophobicContact CD1-CG 4.39Å; L401-Q405 VanDerWaalsContact O-CG 3.28Å; L401-Q405 WeakPolarHBondContact O-CG 3.32Å; L401-Q405 PolarHBondContact O-N 3.02Å; S402-Q405 PolarHBondContact O-N 2.96Å; I403-Q405 VanDerWaalsContact C-N 3.32Å; I403-Q405 PolarHBondContact O-N 3.07Å; Q405-L408 PolarHBondContact O-N 3.49Å; Q405-L409 WeakPolarHBondContact O-CG 3.49Å; Q405-L409 PolarHBondContact O-N 3.29Å
406	H	91.7	Very high	87.6	Confident	115 Å²	115	89.9 Å²	89.9	53%	0.532	47%	0.466	S	S	.	.	H	α-helix	trans	-68.4	-35.3	176.8	-71.1	87.2	0	0	0	112.8	S402 I403 L404 L408 L409	S402-H406 PolarHBondContact O-N 3.47Å; S402-H406 PolarHBondContact O-ND1 3.24Å; S402-H406 PolarHBondContact OG-CE1 3.17Å; I403-H406 PolarHBondContact O-N 2.9Å; I403-H406 VanDerWaalsContact O-N 3.07Å; L404-H406 VanDerWaalsContact C-N 3.34Å; L404-H406 PolarHBondContact O-N 3.37Å; H406-L408 VanDerWaalsContact C-N 3.27Å; H406-L408 PolarHBondContact O-N 3.08Å; H406-L409 WeakPolarHBondContact O-CB 3.3Å; H406-L409 PolarHBondContact O-N 3.42Å
407	L	92.2	Very high	87.5	Confident	52 Å²	52	91 Å²	91	27%	0.272	47%	0.465	S	S	.	.	H	α-helix	trans	-61.8	-35.2	172.2	-61.8	-178	0	0	0	112.1	I403 L404 L409 V410 F421 I424	I403-L407 HydrophobicContact CG2-CD1 4.46Å; I403-L407 WeakPolarHBondContact O-CG 3.44Å; I403-L407 PolarHBondContact O-N 3.25Å; L404-L407 HydrophobicContact CD2-CD1 4.49Å; L404-L407 PolarHBondContact O-N 3.19Å; L407-L409 VanDerWaalsContact C-N 3.27Å; L407-L409 PolarHBondContact O-N 3.09Å; L407-V410 WeakPolarHBondContact O-CG2 3.45Å; L407-V410 PolarHBondContact O-N 3.39Å; L407-F421 HydrophobicContact CB-CE1 4.32Å; L407-F421 HydrophobicContact CB-CZ 4.38Å; L407-F421 HydrophobicContact CD2-CE1 4.05Å; L407-I424 HydrophobicContact CD2-CD1 3.92Å; L407-I424 HydrophobicContact CD2-CG2 4.01Å
408	L	88.7	Confident	87.2	Confident	148 Å²	148	91.5 Å²	91.5	78%	0.775	47%	0.47	S	S	*	.	H	α-helix	trans	-73.3	-14.4	174.4	-66.6	171.3	0	0	0	113.8	L404 Q405 H406 V410	L404-L408 WeakPolarHBondContact O-CG 3.43Å; L404-L408 PolarHBondContact O-N 2.96Å; L404-L408 VanDerWaalsContact O-N 3.14Å; Q405-L408 PolarHBondContact O-N 3.49Å; H406-L408 VanDerWaalsContact C-N 3.27Å; H406-L408 PolarHBondContact O-N 3.08Å; L408-V410 VanDerWaalsContact C-N 3.35Å
409	L	88.7	Confident	86.8	Confident	105 Å²	105	88.2 Å²	88.2	55%	0.55	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-4.9	175.1	-67.4	176.4	0	0	0	113.6	Q405 H406 L407 R411	Q405-L409 WeakPolarHBondContact O-CG 3.49Å; Q405-L409 PolarHBondContact O-N 3.29Å; H406-L409 WeakPolarHBondContact O-CB 3.3Å; H406-L409 PolarHBondContact O-N 3.42Å; L407-L409 VanDerWaalsContact C-N 3.27Å; L407-L409 PolarHBondContact O-N 3.09Å; L409-R411 PolarHBondContact O-N 2.95Å; L409-R411 VanDerWaalsContact O-N 3.09Å
410	V	87.4	Confident	86.7	Confident	25 Å²	25	90.4 Å²	90.4	15%	0.152	46%	0.461	C	S	.	.			trans	-66.2	107.3	176.6	-179.7	0	0	0	0	110.4	L407 L408 K417 Y420 F421 I424	L407-V410 WeakPolarHBondContact O-CG2 3.45Å; L407-V410 PolarHBondContact O-N 3.39Å; L408-V410 VanDerWaalsContact C-N 3.35Å; V410-K417 HydrophobicContact CG1-CG 4.22Å; V410-Y420 HydrophobicContact CG1-CD2 3.79Å; V410-Y420 HydrophobicContact CG1-CG 3.82Å; V410-F421 HydrophobicContact CB-CE2 4.12Å; V410-F421 HydrophobicContact CG1-CD2 4.41Å; V410-F421 HydrophobicContact CG1-CE2 4.09Å; V410-F421 HydrophobicContact CG2-CE2 4.3Å; V410-F421 HydrophobicContact CG2-CZ 4.4Å; V410-I424 HydrophobicContact CG2-CD1 4.31Å
411	R	83.5	Confident	86.4	Confident	200 Å²	200	93.5 Å²	93.5	76%	0.755	48%	0.475	S	S	*	.			trans	-112.5	153.1	-179.7	-66.8	-177.9	-171.8	-161.7	2.3	111.5	L409	L409-R411 PolarHBondContact O-N 2.95Å; L409-R411 VanDerWaalsContact O-N 3.09Å
412	G	82.7	Confident	85.8	Confident	41 Å²	41	95 Å²	95	42%	0.423	48%	0.477	S	S	.	.	S	Bend	trans	145.7	-179.7	-175.2	0	0	0	0	0	110.7	K417	G412-K417 VanDerWaalsContact O-CE 3.3Å; G412-K417 WeakPolarHBondContact O-CE 3.24Å
413	D	82.9	Confident	85.2	Confident	81 Å²	81	96.3 Å²	96.3	43%	0.433	48%	0.48	S	S	.	.	S	Bend	trans	-70.2	-177.1	163	74.8	-65.4	0	0	0	110.9	Q415 T416 K417	D413-Q415 PolarHBondContact O-N 3.03Å; D413-Q415 WeakPolarHBondContact OD2-CA 3.31Å; D413-Q415 WeakPolarHBondContact OD2-CB 3.24Å; D413-Q415 WeakPolarHBondContact OD2-CG 3.35Å; D413-Q415 PolarHBondContact OD2-N 2.78Å; D413-T416 WeakPolarHBondContact OD1-CB 3.46Å; D413-T416 PolarHBondContact OD1-N 3.08Å; D413-T416 PolarHBondContact OD1-OG1 3.27Å; D413-K417 WeakPolarHBondContact O-CB 3.49Å; D413-K417 VanDerWaalsContact O-CG 3.29Å; D413-K417 WeakPolarHBondContact O-CG 3.19Å; D413-K417 PolarHBondContact O-N 2.77Å
414	E	84.1	Confident	84.9	Confident	162 Å²	162	94.1 Å²	94.1	76%	0.757	47%	0.469	S	S	*	.	H	α-helix	trans	-65.2	-35.8	-178.8	-168.8	170.1	-175.2	0	0	113.2	T418	E414-T418 WeakPolarHBondContact O-CB 3.48Å; E414-T418 PolarHBondContact O-N 3.19Å; E414-T418 PolarHBondContact O-OG1 3.16Å
415	Q	81.2	Confident	84.2	Confident	160 Å²	160	95.2 Å²	95.2	75%	0.748	47%	0.473	S	S	*	.	H	α-helix	trans	-70.8	-47.2	177.6	-53.8	-174.7	-4	0	0	110.8	D413 K417 T418 A419	D413-Q415 PolarHBondContact O-N 3.03Å; D413-Q415 WeakPolarHBondContact OD2-CA 3.31Å; D413-Q415 WeakPolarHBondContact OD2-CB 3.24Å; D413-Q415 WeakPolarHBondContact OD2-CG 3.35Å; D413-Q415 PolarHBondContact OD2-N 2.78Å; Q415-K417 VanDerWaalsContact C-N 3.35Å; Q415-K417 PolarHBondContact O-N 3.1Å; Q415-T418 PolarHBondContact O-N 3.44Å; Q415-A419 PolarHBondContact O-N 3.03Å
416	T	80.7	Confident	83.2	Confident	57 Å²	57	94.5 Å²	94.5	35%	0.35	47%	0.47	S	S	.	.	H	α-helix	trans	-59.7	-43.6	175.6	-62.1	0	0	0	0	111.7	D413 A419 Y420	D413-T416 WeakPolarHBondContact OD1-CB 3.46Å; D413-T416 PolarHBondContact OD1-N 3.08Å; D413-T416 PolarHBondContact OD1-OG1 3.27Å; T416-A419 PolarHBondContact O-N 3.36Å; T416-Y420 HydrophobicContact CG2-CD2 3.82Å; T416-Y420 HydrophobicContact CG2-CE2 3.69Å; T416-Y420 WeakPolarHBondContact O-CD2 3.39Å; T416-Y420 PolarHBondContact O-N 3.32Å
417	K	80.3	Confident	82.5	Confident	95 Å²	95	92.6 Å²	92.6	41%	0.413	46%	0.462	S	S	.	.	H	α-helix	trans	-60.6	-46	174.8	-76.5	171.7	176.7	173.8	0	111.9	V410 G412 D413 Q415 A419 Y420 F421	V410-K417 HydrophobicContact CG1-CG 4.22Å; G412-K417 VanDerWaalsContact O-CE 3.3Å; G412-K417 WeakPolarHBondContact O-CE 3.24Å; D413-K417 WeakPolarHBondContact O-CB 3.49Å; D413-K417 VanDerWaalsContact O-CG 3.29Å; D413-K417 WeakPolarHBondContact O-CG 3.19Å; D413-K417 PolarHBondContact O-N 2.77Å; Q415-K417 VanDerWaalsContact C-N 3.35Å; Q415-K417 PolarHBondContact O-N 3.1Å; K417-A419 VanDerWaalsContact C-N 3.3Å; K417-A419 PolarHBondContact O-N 2.79Å; K417-Y420 PolarHBondContact O-N 3.09Å; K417-F421 WeakPolarHBondContact O-CD2 3.45Å; K417-F421 PolarHBondContact O-N 3.49Å
418	T	81.7	Confident	82	Confident	74 Å²	74	93.8 Å²	93.8	45%	0.454	47%	0.471	S	S	.	.	H	α-helix	trans	-60.1	-40.6	177.7	-58.9	0	0	0	0	111.5	E414 Q415 F421 K422	E414-T418 WeakPolarHBondContact O-CB 3.48Å; E414-T418 PolarHBondContact O-N 3.19Å; E414-T418 PolarHBondContact O-OG1 3.16Å; Q415-T418 PolarHBondContact O-N 3.44Å; T418-F421 PolarHBondContact O-N 3.48Å; T418-K422 WeakPolarHBondContact O-CB 3.5Å; T418-K422 WeakPolarHBondContact O-CG 3.36Å; T418-K422 PolarHBondContact O-N 2.85Å
419	A	78.2	Confident	81.1	Confident	58 Å²	58	87.7 Å²	87.7	48%	0.479	44%	0.441	S	S	.	.	H	α-helix	trans	-63.7	-44.2	175.3	0	0	0	0	0	112.6	Q415 T416 K417 K422 L423	Q415-A419 PolarHBondContact O-N 3.03Å; T416-A419 PolarHBondContact O-N 3.36Å; K417-A419 VanDerWaalsContact C-N 3.3Å; K417-A419 PolarHBondContact O-N 2.79Å; A419-K422 PolarHBondContact O-N 3.25Å; A419-L423 PolarHBondContact O-N 3.09Å; A419-L423 VanDerWaalsContact O-N 3.08Å
420	Y	84	Confident	80	Confident	119 Å²	119	85 Å²	85	47%	0.467	42%	0.424	S	S	.	.	H	α-helix	trans	-61.3	-46.8	174.8	-87.3	-66.4	0	0	0	112.7	V410 T416 K417 K422 L423 I424	V410-Y420 HydrophobicContact CG1-CD2 3.79Å; V410-Y420 HydrophobicContact CG1-CG 3.82Å; T416-Y420 HydrophobicContact CG2-CD2 3.82Å; T416-Y420 HydrophobicContact CG2-CE2 3.69Å; T416-Y420 WeakPolarHBondContact O-CD2 3.39Å; T416-Y420 PolarHBondContact O-N 3.32Å; K417-Y420 PolarHBondContact O-N 3.09Å; Y420-K422 PolarHBondContact O-N 3.43Å; Y420-L423 PolarHBondContact O-N 3.05Å; Y420-I424 WeakPolarHBondContact O-CD1 3.37Å; Y420-I424 VanDerWaalsContact O-CG1 3.27Å; Y420-I424 WeakPolarHBondContact O-CG1 3.4Å; Y420-I424 PolarHBondContact O-N 3.27Å
421	F	86.7	Confident	79.3	Confident	93 Å²	93	87.1 Å²	87.1	41%	0.408	44%	0.437	S	S	.	.	H	α-helix	trans	-67.6	-33.5	-179.4	-83.9	-77.2	0	0	0	112.8	L407 V410 K417 T418 I424 E425	L407-F421 HydrophobicContact CB-CE1 4.32Å; L407-F421 HydrophobicContact CB-CZ 4.38Å; L407-F421 HydrophobicContact CD2-CE1 4.05Å; V410-F421 HydrophobicContact CB-CE2 4.12Å; V410-F421 HydrophobicContact CG1-CD2 4.41Å; V410-F421 HydrophobicContact CG1-CE2 4.09Å; V410-F421 HydrophobicContact CG2-CE2 4.3Å; V410-F421 HydrophobicContact CG2-CZ 4.4Å; K417-F421 WeakPolarHBondContact O-CD2 3.45Å; K417-F421 PolarHBondContact O-N 3.49Å; T418-F421 PolarHBondContact O-N 3.48Å; F421-I424 PolarHBondContact O-N 3.07Å; F421-E425 WeakPolarHBondContact O-CB 3.47Å; F421-E425 PolarHBondContact O-N 3.02Å
422	K	78.3	Confident	78.9	Confident	112 Å²	112	82.3 Å²	82.3	49%	0.487	43%	0.43	S	S	.	.	H	α-helix	trans	-61.3	-46.9	169.4	-80.2	-177	167.7	-160.9	0	112.8	T418 A419 Y420 I424 E425 E426	T418-K422 WeakPolarHBondContact O-CB 3.5Å; T418-K422 WeakPolarHBondContact O-CG 3.36Å; T418-K422 PolarHBondContact O-N 2.85Å; A419-K422 PolarHBondContact O-N 3.25Å; Y420-K422 PolarHBondContact O-N 3.43Å; K422-I424 VanDerWaalsContact C-N 3.29Å; K422-I424 PolarHBondContact O-N 2.95Å; K422-E425 WeakPolarHBondContact O-CB 3.42Å; K422-E425 PolarHBondContact O-N 2.96Å; K422-E426 PolarHBondContact O-N 3.36Å
423	L	78.1	Confident	78.1	Confident	77 Å²	77	81.9 Å²	81.9	40%	0.403	42%	0.417	S	S	.	.	H	α-helix	trans	-63.4	-37.6	178.1	179.8	63	0	0	0	111.5	A419 Y420 E426 M427 F448	A419-L423 PolarHBondContact O-N 3.09Å; A419-L423 VanDerWaalsContact O-N 3.08Å; Y420-L423 PolarHBondContact O-N 3.05Å; L423-E426 PolarHBondContact O-N 3.26Å; L423-M427 WeakPolarHBondContact O-CG 3.28Å; L423-M427 PolarHBondContact O-N 3.4Å; L423-F448 HydrophobicContact CD1-CE2 4.42Å
424	I	85.7	Confident	77	Confident	53 Å²	53	82.5 Å²	82.5	27%	0.272	42%	0.421	S	S	.	.	H	α-helix	trans	-68.4	-39.2	175.4	-66.9	163.3	0	0	0	111	L407 V410 Y420 F421 K422 M427 V428	L407-I424 HydrophobicContact CD2-CD1 3.92Å; L407-I424 HydrophobicContact CD2-CG2 4.01Å; V410-I424 HydrophobicContact CG2-CD1 4.31Å; Y420-I424 WeakPolarHBondContact O-CD1 3.37Å; Y420-I424 VanDerWaalsContact O-CG1 3.27Å; Y420-I424 WeakPolarHBondContact O-CG1 3.4Å; Y420-I424 PolarHBondContact O-N 3.27Å; F421-I424 PolarHBondContact O-N 3.07Å; K422-I424 VanDerWaalsContact C-N 3.29Å; K422-I424 PolarHBondContact O-N 2.95Å; I424-M427 PolarHBondContact O-N 3.36Å; I424-V428 HydrophobicContact CG2-CG2 4.27Å; I424-V428 WeakPolarHBondContact O-CB 3.38Å; I424-V428 VanDerWaalsContact O-CG2 3.27Å; I424-V428 WeakPolarHBondContact O-CG2 3.46Å; I424-V428 PolarHBondContact O-N 3.26Å
425	E	79.8	Confident	75.6	Confident	72 Å²	72	81.6 Å²	81.6	34%	0.336	41%	0.411	S	S	.	.	H	α-helix	trans	-59.8	-44.7	172.6	173.9	178.7	-164.7	0	0	112	R330 F421 K422 S429	R330-E425 IonicContact CZ-OE1 3.72Å; R330-E425 IonicContact NH1-OE1 2.75Å; R330-E425 PolarHBondContact NH1-OE1 3.41Å; R330-E425 IonicContact NH2-OE1 3.96Å; R330-E425 PolarHBondContact NH2-OE1 3.46Å; F421-E425 WeakPolarHBondContact O-CB 3.47Å; F421-E425 PolarHBondContact O-N 3.02Å; K422-E425 WeakPolarHBondContact O-CB 3.42Å; K422-E425 PolarHBondContact O-N 2.96Å; E425-S429 VanDerWaalsContact O-CB 3.25Å; E425-S429 WeakPolarHBondContact O-CB 3.39Å; E425-S429 PolarHBondContact O-N 3.4Å; E425-S429 PolarHBondContact O-OG 2.92Å
426	E	70.1	Confident	73.9	Confident	85 Å²	85	76.4 Å²	76.4	40%	0.397	39%	0.392	S	S	.	.	H	α-helix	trans	-61	-49.7	175.2	-170.1	-161.9	165.5	0	0	111.1	K422 L423 V428 S429 Y430	K422-E426 PolarHBondContact O-N 3.36Å; L423-E426 PolarHBondContact O-N 3.26Å; E426-V428 PolarHBondContact O-N 3.23Å; E426-S429 PolarHBondContact O-N 2.83Å; E426-Y430 WeakPolarHBondContact O-CB 3.38Å; E426-Y430 PolarHBondContact O-N 3.3Å
427	M	77.7	Confident	72.3	Confident	75 Å²	75	75.4 Å²	75.4	37%	0.369	39%	0.387	S	S	.	.	H	α-helix	trans	-63.2	-43.4	179.8	-71.8	-165.9	78.9	0	0	112.4	L423 I424 Y430 T431 F448	L423-M427 WeakPolarHBondContact O-CG 3.28Å; L423-M427 PolarHBondContact O-N 3.4Å; I424-M427 PolarHBondContact O-N 3.36Å; M427-Y430 PolarHBondContact O-N 3.35Å; M427-T431 WeakPolarHBondContact O-CG2 3.43Å; M427-T431 PolarHBondContact O-N 3.29Å; M427-T431 PolarHBondContact O-OG1 2.97Å; M427-T431 VanDerWaalsContact O-OG1 3.11Å; M427-F448 HydrophobicContact CE-CD1 3.9Å; M427-F448 HydrophobicContact CE-CD2 4.43Å; M427-F448 HydrophobicContact CE-CE1 3.6Å; M427-F448 HydrophobicContact CE-CE2 4.16Å; M427-F448 HydrophobicContact CE-CG 4.31Å; M427-F448 HydrophobicContact CE-CZ 3.73Å; M427-F448 HydrophobicContact CG-CD2 4.28Å; M427-F448 HydrophobicContact CG-CE2 3.88Å; M427-F448 HydrophobicContact CG-CZ 4.23Å; M427-F448 HydrophobicContact SD-CE1 4.19Å; M427-F448 HydrophobicContact SD-CE2 3.99Å; M427-F448 HydrophobicContact SD-CZ 3.69Å
428	V	81.6	Confident	70.9	Confident	78 Å²	78	77.5 Å²	77.5	47%	0.473	39%	0.393	S	S	.	.	H	α-helix	trans	-62.4	-48.7	176.1	169.1	0	0	0	0	110.2	I424 E426 Y430 T431 V432	I424-V428 HydrophobicContact CG2-CG2 4.27Å; I424-V428 WeakPolarHBondContact O-CB 3.38Å; I424-V428 VanDerWaalsContact O-CG2 3.27Å; I424-V428 WeakPolarHBondContact O-CG2 3.46Å; I424-V428 PolarHBondContact O-N 3.26Å; E426-V428 PolarHBondContact O-N 3.23Å; V428-Y430 VanDerWaalsContact C-N 3.31Å; V428-Y430 PolarHBondContact O-N 3.5Å; V428-T431 WeakPolarHBondContact CA-OG1 3.5Å; V428-T431 PolarHBondContact O-N 2.76Å; V428-T431 VanDerWaalsContact O-N 3.13Å; V428-T431 PolarHBondContact O-OG1 3.22Å; V428-V432 HydrophobicContact CG1-CG2 4.31Å; V428-V432 WeakPolarHBondContact O-CG2 3.31Å; V428-V432 PolarHBondContact O-N 2.93Å
429	S	68.7	Low	69	Low	20 Å²	20	77 Å²	77	14%	0.14	39%	0.387	C	S	.	.	H	α-helix	trans	-58.9	-42.2	177.9	-58.4	0	0	0	0	111.5	E425 E426 V432 L433	E425-S429 VanDerWaalsContact O-CB 3.25Å; E425-S429 WeakPolarHBondContact O-CB 3.39Å; E425-S429 PolarHBondContact O-N 3.4Å; E425-S429 PolarHBondContact O-OG 2.92Å; E426-S429 PolarHBondContact O-N 2.83Å; S429-V432 PolarHBondContact O-N 3.19Å; S429-L433 WeakPolarHBondContact O-CB 3.33Å; S429-L433 VanDerWaalsContact O-CG 3.27Å; S429-L433 WeakPolarHBondContact O-CG 3.32Å; S429-L433 PolarHBondContact O-N 3.46Å
430	Y	67.2	Low	67.4	Low	48 Å²	48	78.4 Å²	78.4	19%	0.188	38%	0.381	C	S	.	.	H	α-helix	trans	-62.4	-44.5	174.6	-176.2	-104.7	0	0	0	112.5	E426 M427 V428 V432 N434 F448 I452	E426-Y430 WeakPolarHBondContact O-CB 3.38Å; E426-Y430 PolarHBondContact O-N 3.3Å; M427-Y430 PolarHBondContact O-N 3.35Å; V428-Y430 VanDerWaalsContact C-N 3.31Å; V428-Y430 PolarHBondContact O-N 3.5Å; Y430-V432 VanDerWaalsContact C-N 3.32Å; Y430-V432 PolarHBondContact O-N 3.46Å; Y430-N434 WeakPolarHBondContact O-CA 3.36Å; Y430-N434 PolarHBondContact O-N 2.84Å; Y430-N434 VanDerWaalsContact O-N 3.11Å; Y430-F448 HydrophobicContact CD1-CB 4.41Å; Y430-F448 HydrophobicContact CE1-CB 4.38Å; Y430-F448 WeakPolarHBondContact CE1-O 3.48Å; Y430-F448 PolarHBondContact OH-O 3.01Å; Y430-I452 HydrophobicContact CD1-CD1 4.19Å; Y430-I452 HydrophobicContact CE1-CD1 3.92Å
431	T	73.1	Confident	65.3	Low	69 Å²	69	74.3 Å²	74.3	42%	0.423	38%	0.375	S	S	.	.	H	α-helix	trans	-71.1	-21.6	-179.9	54.3	0	0	0	0	115	M427 V428	M427-T431 WeakPolarHBondContact O-CG2 3.43Å; M427-T431 PolarHBondContact O-N 3.29Å; M427-T431 PolarHBondContact O-OG1 2.97Å; M427-T431 VanDerWaalsContact O-OG1 3.11Å; V428-T431 WeakPolarHBondContact CA-OG1 3.5Å; V428-T431 PolarHBondContact O-N 2.76Å; V428-T431 VanDerWaalsContact O-N 3.13Å; V428-T431 PolarHBondContact O-OG1 3.22Å
432	V	74.4	Confident	63	Low	100 Å²	100	79.5 Å²	79.5	61%	0.606	39%	0.393	S	S	*	.	H	α-helix	trans	-98.2	-42.5	-179.1	174.9	0	0	0	0	111.5	V428 S429 Y430	V428-V432 HydrophobicContact CG1-CG2 4.31Å; V428-V432 WeakPolarHBondContact O-CG2 3.31Å; V428-V432 PolarHBondContact O-N 2.93Å; S429-V432 PolarHBondContact O-N 3.19Å; Y430-V432 VanDerWaalsContact C-N 3.32Å; Y430-V432 PolarHBondContact O-N 3.46Å
433	L	65.2	Low	61.1	Low	31 Å²	31	80 Å²	80	16%	0.162	40%	0.397	C	S	.	.	H	α-helix	trans	-89.6	-8.6	-176	-53.4	176.1	0	0	0	113.5	D319 H323 S429 R435	D319-L433 HydrophobicContact CB-CD2 3.52Å; H323-L433 HydrophobicContact CB-CD1 4.39Å; S429-L433 WeakPolarHBondContact O-CB 3.33Å; S429-L433 VanDerWaalsContact O-CG 3.27Å; S429-L433 WeakPolarHBondContact O-CG 3.32Å; S429-L433 PolarHBondContact O-N 3.46Å; L433-R435 PolarHBondContact O-N 3.32Å
434	N	60.7	Low	59.2	Low	94 Å²	94	84.8 Å²	84.8	50%	0.503	42%	0.417	S	S	.	.	S	Bend	trans	53.9	9.7	-171.3	-68.8	-44.7	0	0	0	115.5	Y430 I452	Y430-N434 WeakPolarHBondContact O-CA 3.36Å; Y430-N434 PolarHBondContact O-N 2.84Å; Y430-N434 VanDerWaalsContact O-N 3.11Å; N434-I452 WeakPolarHBondContact OD1-CD1 3.31Å
435	R	53.5	Low	57.1	Low	144 Å²	144	88.4 Å²	88.4	54%	0.543	44%	0.437	S	S	.	.	S	Bend	trans	-125.3	144.1	178.3	-58.4	-179.3	-162.5	-112.7	8.4	108.9	D317 L433 C437	D317-R435 IonicContact OD2-CZ 3.67Å; D317-R435 VanDerWaalsContact OD2-CZ 3.25Å; D317-R435 IonicContact OD2-NE 2.81Å; D317-R435 PolarHBondContact OD2-NE 2.8Å; D317-R435 IonicContact OD2-NH2 3.12Å; D317-R435 PolarHBondContact OD2-NH2 3.38Å; L433-R435 PolarHBondContact O-N 3.32Å; R435-C437 PolarHBondContact O-N 3.23Å; R435-C437 VanDerWaalsContact O-N 3.13Å
436	S	46.3	Very low	55.4	Low	51 Å²	51	93.5 Å²	93.5	36%	0.357	46%	0.458	S	S	.	.			trans	-68.5	108	161.7	-61.9	0	0	0	0	107.6
437	C	48.1	Very low	54.3	Low	35 Å²	35	99.8 Å²	99.8	24%	0.236	48%	0.478	C	S	.	.	P	Polyproline II helix	trans	-64.4	139.5	166.5	-165	0	0	0	0	108.6	H323 R435 D439	H323-C437 PolarHBondContact NE2-SG 2.63Å; R435-C437 PolarHBondContact O-N 3.23Å; R435-C437 VanDerWaalsContact O-N 3.13Å; C437-D439 PolarHBondContact O-N 3.45Å
438	Y	49.2	Very low	53.1	Low	139 Å²	139	101 Å²	101	55%	0.545	48%	0.482	S	S	.	.	P	Polyproline II helix	trans	-73.7	120.4	-166	-63.9	-89.5	0	0	0	111.2	S274	S274-Y438 WeakPolarHBondContact CB-O 3.4Å; S274-Y438 WeakPolarHBondContact OG-CB 3.49Å; S274-Y438 PolarHBondContact OG-O 3.06Å
439	D	43.2	Very low	51.8	Low	63 Å²	63	102.7 Å²	102.7	34%	0.337	50%	0.497	S	S	.	.	P	Polyproline II helix	trans	-63.9	153.7	-156.3	152.1	63.7	0	0	0	117	S274 C437 G441 Y442	S274-D439 VanDerWaalsContact O-O 3.09Å; C437-D439 PolarHBondContact O-N 3.45Å; D439-G441 VanDerWaalsContact C-N 3.34Å; D439-G441 PolarHBondContact O-N 3.37Å; D439-G441 PolarHBondContact OD1-N 3.18Å; D439-G441 WeakPolarHBondContact OD2-CA 3.45Å; D439-G441 PolarHBondContact OD2-N 3.27Å; D439-Y442 PolarHBondContact OD1-N 3.25Å; D439-Y442 PolarHBondContact OD2-N 3.34Å
440	Y	44.1	Very low	51.5	Low	89 Å²	89	106.1 Å²	106.1	35%	0.349	51%	0.513	S	S	.	.	S	Bend	trans	-92.7	44.2	172	-88.4	-66.9	0	0	0	113.4	K283 L285 D327	K283-Y440 HydrophobicContact CB-CE1 4.01Å; K283-Y440 HydrophobicContact CD-CE1 4.22Å; K283-Y440 HydrophobicContact CG-CD1 4.21Å; K283-Y440 HydrophobicContact CG-CE1 4.01Å; L285-Y440 VanDerWaalsContact CD1-OH 3.28Å; L285-Y440 WeakPolarHBondContact CD1-OH 3.42Å; D327-Y440 WeakPolarHBondContact OD2-CE2 3.45Å; D327-Y440 PolarHBondContact OD2-OH 2.95Å
441	G	39	Very low	51.5	Low	32 Å²	32	107.5 Å²	107.5	33%	0.33	52%	0.524	S	S	.	.	S	Bend	trans	90.5	64.3	162.7	0	0	0	0	0	116.8	D439	D439-G441 VanDerWaalsContact C-N 3.34Å; D439-G441 PolarHBondContact O-N 3.37Å; D439-G441 PolarHBondContact OD1-N 3.18Å; D439-G441 WeakPolarHBondContact OD2-CA 3.45Å; D439-G441 PolarHBondContact OD2-N 3.27Å
442	Y	39.1	Very low	51.3	Low	202 Å²	202	105.2 Å²	105.2	79%	0.792	51%	0.509	S	S	*	.			trans	-138.3	73.5	153	-116.2	-81.1	0	0	0	112.1	D439 Q444	D439-Y442 PolarHBondContact OD1-N 3.25Å; D439-Y442 PolarHBondContact OD2-N 3.34Å; Y442-Q444 PolarHBondContact O-N 3.27Å
443	Q	37.5	Very low	51.1	Low	123 Å²	123	107.3 Å²	107.3	58%	0.575	51%	0.512	S	S	*	.			trans	-55.9	135.2	166.9	-79.1	-175.6	-9.8	0	0	110.4	P276	P276-Q443 HydrophobicContact CG-CG 3.84Å
444	Q	38.4	Very low	51.4	Low	177 Å²	177	109.6 Å²	109.6	83%	0.827	53%	0.525	S	S	*	.			trans	69.2	83.5	-167.8	-50.4	-169.5	57	0	0	115.2	Y442	Y442-Q444 PolarHBondContact O-N 3.27Å
445	N	42.2	Very low	52.1	Low	130 Å²	130	108.1 Å²	108.1	70%	0.695	52%	0.519	S	S	*	.				-157.4	152.8	109	-108.3	-76.5	0	0	0	113.4	R447	N445-R447 PolarHBondContact O-N 3.48Å
446	K	45	Very low	53	Low	178 Å²	178	106.2 Å²	106.2	77%	0.774	52%	0.519	S	S	*	.			trans	-0.2	106.4	159.7	-58.7	158.7	-168.1	169	0	116.1	F448	K446-F448 PolarHBondContact O-N 3.41Å
447	R	46.9	Very low	54.3	Low	217 Å²	217	109.7 Å²	109.7	82%	0.819	53%	0.53	S	S	*	.			trans	-45.6	130.5	159.8	-76	177.7	170.5	146.4	-2.9	109.6	N445 S449	N445-R447 PolarHBondContact O-N 3.48Å; R447-S449 PolarHBondContact O-N 3Å
448	F	52.5	Low	55.5	Low	100 Å²	100	113.9 Å²	113.9	44%	0.439	54%	0.544	S	S	.	.			trans	-69.8	79	169.5	-79.1	-80.7	0	0	0	110	L423 M427 Y430 K446 L450	L423-F448 HydrophobicContact CD1-CE2 4.42Å; M427-F448 HydrophobicContact CE-CD1 3.9Å; M427-F448 HydrophobicContact CE-CD2 4.43Å; M427-F448 HydrophobicContact CE-CE1 3.6Å; M427-F448 HydrophobicContact CE-CE2 4.16Å; M427-F448 HydrophobicContact CE-CG 4.31Å; M427-F448 HydrophobicContact CE-CZ 3.73Å; M427-F448 HydrophobicContact CG-CD2 4.28Å; M427-F448 HydrophobicContact CG-CE2 3.88Å; M427-F448 HydrophobicContact CG-CZ 4.23Å; M427-F448 HydrophobicContact SD-CE1 4.19Å; M427-F448 HydrophobicContact SD-CE2 3.99Å; M427-F448 HydrophobicContact SD-CZ 3.69Å; Y430-F448 HydrophobicContact CD1-CB 4.41Å; Y430-F448 HydrophobicContact CE1-CB 4.38Å; Y430-F448 WeakPolarHBondContact CE1-O 3.48Å; Y430-F448 PolarHBondContact OH-O 3.01Å; K446-F448 PolarHBondContact O-N 3.41Å; F448-L450 PolarHBondContact O-N 3.08Å
449	S	54	Low	56.7	Low	115 Å²	115	111 Å²	111	80%	0.804	54%	0.541	S	S	*	.			trans	-74.4	71.4	180	63.5	0	0	0	0	111.5	R447	R447-S449 PolarHBondContact O-N 3Å
450	L	61.2	Low	58.2	Low	91 Å²	91	113.1 Å²	113.1	48%	0.476	55%	0.55	S	S	.	.			trans	-102	126	171.9	-169.3	76	0	0	0	108.2	F448 I452 V455	F448-L450 PolarHBondContact O-N 3.08Å; L450-I452 HydrophobicContact CD2-CG1 4.4Å; L450-I452 PolarHBondContact O-N 2.97Å; L450-I452 VanDerWaalsContact O-N 3.16Å; L450-V455 HydrophobicContact CD1-CG2 4.02Å; L450-V455 HydrophobicContact CD2-CG2 4.29Å; L450-V455 HydrophobicContact CG-CG2 4.12Å
451	N	68.7	Low	59.1	Low	78 Å²	78	115.1 Å²	115.1	42%	0.417	56%	0.562	S	S	.	*			trans	-75.3	104.3	165	-173.8	3.4	0	0	0	108.2	E453 D454 V455	N451-E453 VanDerWaalsContact C-N 3.33Å; N451-E453 PolarHBondContact OD1-N 3.37Å; N451-D454 HydrophobicContact CB-CB 3.97Å; N451-D454 WeakPolarHBondContact CB-OD2 3.34Å; N451-D454 PolarHBondContact ND2-OD2 3.15Å; N451-V455 WeakPolarHBondContact O-CG2 3.14Å; N451-V455 PolarHBondContact O-N 3.39Å
452	I	67.8	Low	60.2	Low	21 Å²	21	115.4 Å²	115.4	11%	0.108	57%	0.565	C	S	.	*	H	α-helix	trans	-67.7	-36.3	-174.9	-68.3	158.2	0	0	0	110.5	Y430 N434 L450 V455 L456	Y430-I452 HydrophobicContact CD1-CD1 4.19Å; Y430-I452 HydrophobicContact CE1-CD1 3.92Å; N434-I452 WeakPolarHBondContact OD1-CD1 3.31Å; L450-I452 HydrophobicContact CD2-CG1 4.4Å; L450-I452 PolarHBondContact O-N 2.97Å; L450-I452 VanDerWaalsContact O-N 3.16Å; I452-V455 PolarHBondContact O-N 2.84Å; I452-L456 HydrophobicContact CG2-CD1 3.88Å; I452-L456 HydrophobicContact CG2-CG 4.31Å; I452-L456 WeakPolarHBondContact O-CG 3.38Å; I452-L456 PolarHBondContact O-N 2.9Å
453	E	71.5	Confident	61.4	Low	144 Å²	144	110.1 Å²	110.1	67%	0.673	55%	0.551	S	S	*	*	H	α-helix	trans	-61.8	-49.8	178.3	-57.5	-178.3	160.3	0	0	111.4	N451 V455 L456 E457	N451-E453 VanDerWaalsContact C-N 3.33Å; N451-E453 PolarHBondContact OD1-N 3.37Å; E453-V455 PolarHBondContact O-N 3.4Å; E453-V455 VanDerWaalsContact O-N 3.15Å; E453-L456 PolarHBondContact O-N 3.37Å; E453-E457 PolarHBondContact O-N 3.08Å
454	D	71.1	Confident	62.4	Low	78 Å²	78	110.7 Å²	110.7	42%	0.417	55%	0.548	S	S	.	.	H	α-helix	trans	-55.9	-31	175.5	-87.4	-28.6	0	0	0	113.1	N451 K458	N451-D454 HydrophobicContact CB-CB 3.97Å; N451-D454 WeakPolarHBondContact CB-OD2 3.34Å; N451-D454 PolarHBondContact ND2-OD2 3.15Å; D454-K458 WeakPolarHBondContact O-CD 3.09Å; D454-K458 WeakPolarHBondContact O-CG 3.49Å; D454-K458 PolarHBondContact O-NZ 3.43Å
455	V	74.6	Confident	63	Low	64 Å²	64	109.1 Å²	109.1	39%	0.388	54%	0.535	S	S	.	.	H	α-helix	trans	-84.3	-40.9	-177.1	172.2	0	0	0	0	110.9	L450 N451 I452 E453 K458 V459	L450-V455 HydrophobicContact CD1-CG2 4.02Å; L450-V455 HydrophobicContact CD2-CG2 4.29Å; L450-V455 HydrophobicContact CG-CG2 4.12Å; N451-V455 WeakPolarHBondContact O-CG2 3.14Å; N451-V455 PolarHBondContact O-N 3.39Å; I452-V455 PolarHBondContact O-N 2.84Å; E453-V455 PolarHBondContact O-N 3.4Å; E453-V455 VanDerWaalsContact O-N 3.15Å; V455-K458 PolarHBondContact O-N 3.14Å; V455-V459 WeakPolarHBondContact O-CG2 2.95Å; V455-V459 PolarHBondContact O-N 3.44Å
456	L	73.6	Confident	63.6	Low	104 Å²	104	109.5 Å²	109.5	55%	0.545	53%	0.533	S	S	.	.	H	α-helix	trans	-61.8	-44.8	178.1	-72.7	170.3	0	0	0	112	I452 E453 K458 V459 M460	I452-L456 HydrophobicContact CG2-CD1 3.88Å; I452-L456 HydrophobicContact CG2-CG 4.31Å; I452-L456 WeakPolarHBondContact O-CG 3.38Å; I452-L456 PolarHBondContact O-N 2.9Å; E453-L456 PolarHBondContact O-N 3.37Å; L456-K458 PolarHBondContact O-N 3.36Å; L456-V459 PolarHBondContact O-N 3.02Å; L456-M460 WeakPolarHBondContact O-CG 3.48Å; L456-M460 PolarHBondContact O-N 2.94Å
457	E	72.5	Confident	64	Low	123 Å²	123	105 Å²	105	58%	0.575	52%	0.524	S	S	*	.	H	α-helix	trans	-58.2	-47.2	180	-173.4	168.3	-127.6	0	0	111.9	E453 V459 M460 E461	E453-E457 PolarHBondContact O-N 3.08Å; E457-V459 VanDerWaalsContact C-N 3.32Å; E457-V459 PolarHBondContact O-N 3.44Å; E457-M460 WeakPolarHBondContact O-CB 3.42Å; E457-M460 PolarHBondContact O-N 2.63Å; E457-M460 VanDerWaalsContact O-N 3.08Å; E457-E461 PolarHBondContact O-N 3.05Å
458	K	73.5	Confident	64.2	Low	123 Å²	123	101.1 Å²	101.1	54%	0.535	52%	0.519	S	S	.	.	H	α-helix	trans	-63.4	-34.3	-179.8	-65.2	176	-174.2	73.5	0	113	D454 V455 L456 G462	D454-K458 WeakPolarHBondContact O-CD 3.09Å; D454-K458 WeakPolarHBondContact O-CG 3.49Å; D454-K458 PolarHBondContact O-NZ 3.43Å; V455-K458 PolarHBondContact O-N 3.14Å; L456-K458 PolarHBondContact O-N 3.36Å; K458-G462 PolarHBondContact O-N 3.3Å
459	V	75.5	Confident	64	Low	80 Å²	80	101.4 Å²	101.4	49%	0.485	52%	0.521	S	S	.	.	H	α-helix	trans	-71.6	-37.2	174.6	173.8	0	0	0	0	111	V455 L456 E457 G462 N463	V455-V459 WeakPolarHBondContact O-CG2 2.95Å; V455-V459 PolarHBondContact O-N 3.44Å; L456-V459 PolarHBondContact O-N 3.02Å; E457-V459 VanDerWaalsContact C-N 3.32Å; E457-V459 PolarHBondContact O-N 3.44Å; V459-G462 PolarHBondContact O-N 3.48Å; V459-N463 PolarHBondContact O-N 3.2Å
460	M	73.1	Confident	64	Low	107 Å²	107	103 Å²	103	53%	0.527	51%	0.51	S	S	.	.	H	α-helix	trans	-67.1	-35.4	176.7	-70.5	177.8	66.3	0	0	113	L456 E457 R464	L456-M460 WeakPolarHBondContact O-CG 3.48Å; L456-M460 PolarHBondContact O-N 2.94Å; E457-M460 WeakPolarHBondContact O-CB 3.42Å; E457-M460 PolarHBondContact O-N 2.63Å; E457-M460 VanDerWaalsContact O-N 3.08Å; M460-R464 WeakPolarHBondContact O-CG 3.37Å
461	E	63.6	Low	63.5	Low	130 Å²	130	103.3 Å²	103.3	61%	0.607	52%	0.517	S	S	*	.	H	α-helix	trans	-62.6	-49	173.9	-70	-174.6	137.2	0	0	111.8	E457 N463 R464	E457-E461 PolarHBondContact O-N 3.05Å; E461-N463 PolarHBondContact O-N 2.97Å; E461-R464 PolarHBondContact O-N 3.35Å
462	G	62.6	Low	62.7	Low	38 Å²	38	106.8 Å²	106.8	39%	0.392	54%	0.535	S	S	.	.	H	α-helix	trans	-59.8	-48.7	-178.5	0	0	0	0	0	113.5	K458 V459 R464 Y465	K458-G462 PolarHBondContact O-N 3.3Å; V459-G462 PolarHBondContact O-N 3.48Å; G462-R464 VanDerWaalsContact C-N 3.26Å; G462-R464 PolarHBondContact O-N 3.17Å; G462-Y465 PolarHBondContact O-N 2.88Å; G462-Y465 VanDerWaalsContact O-N 3.08Å
463	N	64.1	Low	62.5	Low	92 Å²	92	107.8 Å²	107.8	49%	0.492	54%	0.544	S	S	.	.	H	α-helix	trans	-61.4	-30.1	-175.3	-73.3	-11.6	0	0	0	113.7	V459 E461 Y465 S467	V459-N463 PolarHBondContact O-N 3.2Å; E461-N463 PolarHBondContact O-N 2.97Å; N463-Y465 VanDerWaalsContact C-N 3.33Å; N463-S467 WeakPolarHBondContact O-CB 3.24Å; N463-S467 PolarHBondContact O-N 2.84Å; N463-S467 PolarHBondContact O-OG 3.03Å
464	R	58.6	Low	62.2	Low	135 Å²	135	104.8 Å²	104.8	51%	0.509	54%	0.539	S	S	.	.	H	α-helix	trans	-67.3	-34.5	177.7	-68	176.2	77.2	84.9	0.5	112.1	M460 E461 G462	M460-R464 WeakPolarHBondContact O-CG 3.37Å; E461-R464 PolarHBondContact O-N 3.35Å; G462-R464 VanDerWaalsContact C-N 3.26Å; G462-R464 PolarHBondContact O-N 3.17Å
465	Y	50.5	Low	62.3	Low	143 Å²	143	106.8 Å²	106.8	56%	0.561	55%	0.549	S	S	*	.	H	α-helix	trans	-76.5	-34.6	-175.2	-174.3	-109.3	0	0	0	113.2	G462 N463 R470	G462-Y465 PolarHBondContact O-N 2.88Å; G462-Y465 VanDerWaalsContact O-N 3.08Å; N463-Y465 VanDerWaalsContact C-N 3.33Å; Y465-R470 VanDerWaalsContact CE1-NH2 3.33Å; Y465-R470 PolarHBondContact OH-NH2 2.84Å
466	E	54.3	Low	62.1	Low	138 Å²	138	110 Å²	110	65%	0.645	56%	0.562	S	S	*	*	H	α-helix	trans	-78.6	-38.2	178.2	-61.2	-164.4	143.2	0	0	112.8
467	S	53.6	Low	62	Low	84 Å²	84	109.5 Å²	109.5	59%	0.587	55%	0.553	S	S	*	*	H	α-helix	trans	-75.8	-32.4	-164.3	-57.4	0	0	0	0	115.6	N463	N463-S467 WeakPolarHBondContact O-CB 3.24Å; N463-S467 PolarHBondContact O-N 2.84Å; N463-S467 PolarHBondContact O-OG 3.03Å
468	L	51.1	Low	62.3	Low	136 Å²	136	108.5 Å²	108.5	71%	0.712	55%	0.548	S	S	*	.	S	Bend	trans	-106.7	-35.3	-162.1	-73.3	171.2	0	0	0	116.1
469	E	49.6	Very low	62.7	Low	106 Å²	106	109.1 Å²	109.1	50%	0.495	55%	0.551	S	S	.	*	S	Bend	trans	-113.4	-23.9	-166.1	-60.2	-159.6	137.4	0	0	115.8	K1001	E469-K1001 WeakPolarHBondContact OE1-CE 3.33Å; E469-K1001 IonicContact OE1-NZ 3.15Å; E469-K1001 PolarHBondContact OE1-NZ 3.43Å; E469-K1001 IonicContact OE2-NZ 3.64Å; E469-K1001 PolarHBondContact OE2-NZ 2.77Å
470	R	52.1	Low	62.9	Low	148 Å²	148	109 Å²	109	56%	0.558	55%	0.547	S	S	*	.	S	Bend	trans	-81.7	-69.4	-164.4	-79.8	179.7	166.4	-143.9	-4.7	116.1	Y465	Y465-R470 VanDerWaalsContact CE1-NH2 3.33Å; Y465-R470 PolarHBondContact OH-NH2 2.84Å
471	P	50.7	Low	63.3	Low	98 Å²	98	107.3 Å²	107.3	64%	0.636	54%	0.537	S	S	*	.	H	α-helix	trans	-75.9	-57.8	-161.5	26.7	-33.7	0	0	0	113.9	S473 S474	P471-S473 PolarHBondContact O-N 2.89Å; P471-S474 PolarHBondContact O-N 2.67Å
472	L	52.5	Low	64.4	Low	150 Å²	150	105.8 Å²	105.8	79%	0.785	53%	0.533	S	S	*	.	H	α-helix	trans	-64.8	-27.7	-168.6	-159.5	75.4	0	0	0	113
473	S	63	Low	65.6	Low	42 Å²	42	108.4 Å²	108.4	29%	0.294	54%	0.538	S	S	.	.	H	α-helix	trans	-88.9	-18.9	-174.4	-162.9	0	0	0	0	113.9	P471 R477	P471-S473 PolarHBondContact O-N 2.89Å; S473-R477 VanDerWaalsContact O-CG 3.28Å; S473-R477 WeakPolarHBondContact O-CG 3.31Å; S473-R477 PolarHBondContact O-N 2.79Å; S473-R477 PolarHBondContact O-NE 3.14Å; S473-R477 VanDerWaalsContact OG-CZ 3.29Å; S473-R477 PolarHBondContact OG-NE 3.42Å; S473-R477 PolarHBondContact OG-NH2 3.25Å
474	S	66.4	Low	66.8	Low	82 Å²	82	105.4 Å²	105.4	57%	0.573	52%	0.521	S	S	*	.	H	α-helix	trans	-80.3	-45.7	-179.2	-164.4	0	0	0	0	112.3	P471 R477 H478	P471-S474 PolarHBondContact O-N 2.67Å; S474-R477 PolarHBondContact O-N 3.39Å; S474-H478 PolarHBondContact O-N 3.18Å; S474-H478 VanDerWaalsContact O-N 3.13Å
475	D	72	Confident	68.2	Low	119 Å²	119	100.9 Å²	100.9	64%	0.636	51%	0.509	S	S	*	.	H	α-helix	trans	-64	-44	179.8	-179.8	71.7	0	0	0	111.5	R477 H478 K479	D475-R477 PolarHBondContact O-N 2.73Å; D475-H478 PolarHBondContact O-N 2.86Å; D475-K479 WeakPolarHBondContact O-CB 3.38Å; D475-K479 PolarHBondContact O-N 2.75Å
476	M	71.1	Confident	70.1	Confident	131 Å²	131	98.8 Å²	98.8	65%	0.645	50%	0.504	S	S	*	.	H	α-helix	trans	-66.7	-35.7	-179.5	-166.1	171.5	-66.7	0	0	112.9	L480	M476-L480 WeakPolarHBondContact O-CB 3.39Å; M476-L480 PolarHBondContact O-N 2.82Å
477	R	72.3	Confident	71.8	Confident	95 Å²	95	96.7 Å²	96.7	36%	0.358	49%	0.493	S	S	.	.	H	α-helix	trans	-65.9	-49.5	173	-77.9	-176.8	-125.3	-126.3	10.7	111.5	S473 S474 D475 K479 L480 E481	S473-R477 VanDerWaalsContact O-CG 3.28Å; S473-R477 WeakPolarHBondContact O-CG 3.31Å; S473-R477 PolarHBondContact O-N 2.79Å; S473-R477 PolarHBondContact O-NE 3.14Å; S473-R477 VanDerWaalsContact OG-CZ 3.29Å; S473-R477 PolarHBondContact OG-NE 3.42Å; S473-R477 PolarHBondContact OG-NH2 3.25Å; S474-R477 PolarHBondContact O-N 3.39Å; D475-R477 PolarHBondContact O-N 2.73Å; R477-K479 VanDerWaalsContact C-N 3.29Å; R477-K479 PolarHBondContact O-N 2.92Å; R477-L480 WeakPolarHBondContact O-CA 3.49Å; R477-L480 WeakPolarHBondContact O-CB 3.33Å; R477-L480 PolarHBondContact O-N 2.83Å; R477-E481 WeakPolarHBondContact O-CG 3.29Å; R477-E481 PolarHBondContact O-N 2.97Å
478	H	78.2	Confident	73.5	Confident	101 Å²	101	93.3 Å²	93.3	47%	0.468	47%	0.468	S	S	.	.	H	α-helix	trans	-58.3	-41.6	179	-177.4	49.8	0	0	0	112.5	S474 D475 L480 E481 L482	S474-H478 PolarHBondContact O-N 3.18Å; S474-H478 VanDerWaalsContact O-N 3.13Å; D475-H478 PolarHBondContact O-N 2.86Å; H478-L480 VanDerWaalsContact C-N 3.28Å; H478-L480 PolarHBondContact O-N 3.41Å; H478-E481 IonicContact ND1-OE2 3.55Å; H478-E481 PolarHBondContact O-N 3.03Å; H478-L482 WeakPolarHBondContact O-CG 3.41Å; H478-L482 PolarHBondContact O-N 3.07Å; H478-L482 VanDerWaalsContact O-N 3.15Å
479	K	82.1	Confident	75.3	Confident	137 Å²	137	88.2 Å²	88.2	60%	0.596	44%	0.44	S	S	*	.	H	α-helix	trans	-63	-32.9	174.9	-171.1	173	-177.4	175.9	0	113.2	D475 R477 L483	D475-K479 WeakPolarHBondContact O-CB 3.38Å; D475-K479 PolarHBondContact O-N 2.75Å; R477-K479 VanDerWaalsContact C-N 3.29Å; R477-K479 PolarHBondContact O-N 2.92Å; K479-L483 WeakPolarHBondContact O-CG 3.19Å; K479-L483 PolarHBondContact O-N 3.21Å
480	L	78.9	Confident	77.2	Confident	77 Å²	77	87.1 Å²	87.1	40%	0.403	44%	0.437	S	S	.	.	H	α-helix	trans	-75	-39.8	177.7	-178.4	51	0	0	0	111.9	M476 R477 H478 L482 L483 I484 I894	M476-L480 WeakPolarHBondContact O-CB 3.39Å; M476-L480 PolarHBondContact O-N 2.82Å; R477-L480 WeakPolarHBondContact O-CA 3.49Å; R477-L480 WeakPolarHBondContact O-CB 3.33Å; R477-L480 PolarHBondContact O-N 2.83Å; H478-L480 VanDerWaalsContact C-N 3.28Å; H478-L480 PolarHBondContact O-N 3.41Å; L480-L482 VanDerWaalsContact C-N 3.34Å; L480-L482 PolarHBondContact O-N 3.36Å; L480-L483 PolarHBondContact O-N 2.7Å; L480-I484 HydrophobicContact CD1-CD1 3.87Å; L480-I484 HydrophobicContact CD1-CG1 4.17Å; L480-I484 HydrophobicContact CG-CD1 3.88Å; L480-I484 WeakPolarHBondContact O-CB 3.5Å; L480-I484 VanDerWaalsContact O-CG1 3.28Å; L480-I484 WeakPolarHBondContact O-CG1 3.17Å; L480-I484 PolarHBondContact O-N 2.79Å; L480-I894 HydrophobicContact CD2-CD1 3.47Å; L480-I894 VanDerWaalsContact CD2-CD1 3.47Å; L480-I894 HydrophobicContact CG-CD1 4.01Å
481	E	82.7	Confident	78.9	Confident	71 Å²	71	84.3 Å²	84.3	33%	0.332	43%	0.431	S	S	.	.	H	α-helix	trans	-57.3	-43.9	172.2	-66.9	162	179.7	0	0	111.9	R477 H478 I484 T485 I894	R477-E481 WeakPolarHBondContact O-CG 3.29Å; R477-E481 PolarHBondContact O-N 2.97Å; H478-E481 IonicContact ND1-OE2 3.55Å; H478-E481 PolarHBondContact O-N 3.03Å; E481-I484 PolarHBondContact O-N 3.35Å; E481-T485 PolarHBondContact O-N 3.42Å; E481-T485 PolarHBondContact O-OG1 3.31Å; E481-I894 HydrophobicContact CG-CG2 4.06Å
482	L	86.1	Confident	80.7	Confident	98 Å²	98	79.7 Å²	79.7	51%	0.513	40%	0.401	S	S	.	.	H	α-helix	trans	-62.2	-46.3	175.8	-69.8	172.1	0	0	0	112.3	H478 L480 I484 T485 E486	H478-L482 WeakPolarHBondContact O-CG 3.41Å; H478-L482 PolarHBondContact O-N 3.07Å; H478-L482 VanDerWaalsContact O-N 3.15Å; L480-L482 VanDerWaalsContact C-N 3.34Å; L480-L482 PolarHBondContact O-N 3.36Å; L482-I484 VanDerWaalsContact C-N 3.33Å; L482-I484 PolarHBondContact O-N 2.94Å; L482-T485 WeakPolarHBondContact O-CB 3.23Å; L482-T485 PolarHBondContact O-N 3.39Å; L482-E486 PolarHBondContact O-N 2.94Å
483	L	87.2	Confident	82.4	Confident	93 Å²	93	73.2 Å²	73.2	49%	0.487	37%	0.366	S	S	.	.	H	α-helix	trans	-66.5	-33.8	178	-71.7	169	0	0	0	112.6	K479 L480 K487	K479-L483 WeakPolarHBondContact O-CG 3.19Å; K479-L483 PolarHBondContact O-N 3.21Å; L480-L483 PolarHBondContact O-N 2.7Å; L483-K487 VanDerWaalsContact O-CB 3.29Å; L483-K487 WeakPolarHBondContact O-CB 3.44Å; L483-K487 PolarHBondContact O-N 3.37Å
484	I	89	Confident	83.5	Confident	29 Å²	29	75.8 Å²	75.8	15%	0.149	38%	0.376	C	S	.	.	H	α-helix	trans	-68.2	-39.3	174.2	-74.2	166.5	0	0	0	110.7	L480 E481 L482 Q488 V810 A814	L480-I484 HydrophobicContact CD1-CD1 3.87Å; L480-I484 HydrophobicContact CD1-CG1 4.17Å; L480-I484 HydrophobicContact CG-CD1 3.88Å; L480-I484 WeakPolarHBondContact O-CB 3.5Å; L480-I484 VanDerWaalsContact O-CG1 3.28Å; L480-I484 WeakPolarHBondContact O-CG1 3.17Å; L480-I484 PolarHBondContact O-N 2.79Å; E481-I484 PolarHBondContact O-N 3.35Å; L482-I484 VanDerWaalsContact C-N 3.33Å; L482-I484 PolarHBondContact O-N 2.94Å; I484-Q488 WeakPolarHBondContact O-CG 2.94Å; I484-Q488 PolarHBondContact O-N 2.92Å; I484-Q488 VanDerWaalsContact O-N 3.12Å; I484-V810 HydrophobicContact CG2-CG1 4.31Å; I484-A814 HydrophobicContact CG2-CB 3.67Å
485	T	88.8	Confident	84.5	Confident	40 Å²	40	72.4 Å²	72.4	25%	0.245	35%	0.353	C	S	.	.	H	α-helix	trans	-61.8	-50.1	173.6	-57.3	0	0	0	0	111.2	E481 L482 K487 Q488 E489 K806 V810	E481-T485 PolarHBondContact O-N 3.42Å; E481-T485 PolarHBondContact O-OG1 3.31Å; L482-T485 WeakPolarHBondContact O-CB 3.23Å; L482-T485 PolarHBondContact O-N 3.39Å; T485-K487 PolarHBondContact O-N 3.08Å; T485-Q488 PolarHBondContact O-N 2.92Å; T485-Q488 VanDerWaalsContact O-N 3.17Å; T485-E489 PolarHBondContact O-N 2.72Å; T485-K806 HydrophobicContact CG2-CD 4.3Å; T485-V810 HydrophobicContact CG2-CG2 4.21Å
486	E	90.2	Very high	85.2	Confident	99 Å²	99	67.5 Å²	67.5	46%	0.463	33%	0.326	S	S	.	.	H	α-helix	trans	-60.5	-44.2	178.4	-173.7	177.3	-159.2	0	0	111.9	L482 Q488 E489 L490	L482-E486 PolarHBondContact O-N 2.94Å; E486-Q488 VanDerWaalsContact C-N 3.31Å; E486-Q488 PolarHBondContact O-N 3.43Å; E486-E489 PolarHBondContact O-N 2.89Å; E486-L490 HydrophobicContact CG-CD1 4.02Å; E486-L490 WeakPolarHBondContact O-CB 3.45Å; E486-L490 WeakPolarHBondContact O-CG 3.42Å; E486-L490 PolarHBondContact O-N 3.43Å
487	K	90.5	Very high	85.9	Confident	95 Å²	95	62.7 Å²	62.7	41%	0.413	30%	0.304	S	S	.	.	H	α-helix	trans	-54.4	-44.6	173.7	174.4	-169.8	170.8	-170.3	0	111.9	L483 T485 Q491	L483-K487 VanDerWaalsContact O-CB 3.29Å; L483-K487 WeakPolarHBondContact O-CB 3.44Å; L483-K487 PolarHBondContact O-N 3.37Å; T485-K487 PolarHBondContact O-N 3.08Å; K487-Q491 WeakPolarHBondContact O-CB 3.39Å; K487-Q491 VanDerWaalsContact O-CG 3.29Å; K487-Q491 WeakPolarHBondContact O-CG 3.38Å; K487-Q491 PolarHBondContact O-N 3.5Å
488	Q	89.6	Confident	86.7	Confident	13 Å²	13	62.8 Å²	62.8	6%	0.061	31%	0.311	C	S	.	.	H	α-helix	trans	-71.7	-40.2	-177.7	-71.5	-174	42.9	0	0	112.4	I484 T485 E486 Q491 A492 V810 T813 M958	I484-Q488 WeakPolarHBondContact O-CG 2.94Å; I484-Q488 PolarHBondContact O-N 2.92Å; I484-Q488 VanDerWaalsContact O-N 3.12Å; T485-Q488 PolarHBondContact O-N 2.92Å; T485-Q488 VanDerWaalsContact O-N 3.17Å; E486-Q488 VanDerWaalsContact C-N 3.31Å; E486-Q488 PolarHBondContact O-N 3.43Å; Q488-Q491 PolarHBondContact O-N 2.92Å; Q488-A492 PolarHBondContact O-N 2.93Å; Q488-V810 PolarHBondContact NE2-O 2.93Å; Q488-T813 HydrophobicContact CG-CG2 4.36Å; Q488-M958 HydrophobicContact CB-CE 4.15Å
489	E	89.4	Confident	87.1	Confident	29 Å²	29	61.9 Å²	61.9	14%	0.136	31%	0.307	C	S	.	.	H	α-helix	trans	-61.1	-44.8	172.2	-75.2	-161.2	-167.1	0	0	111.9	T485 E486 Q491 A492 K493 K806 L954 M958	T485-E489 PolarHBondContact O-N 2.72Å; E486-E489 PolarHBondContact O-N 2.89Å; E489-Q491 VanDerWaalsContact C-N 3.33Å; E489-Q491 PolarHBondContact O-N 2.79Å; E489-A492 PolarHBondContact O-N 3.12Å; E489-K493 WeakPolarHBondContact O-CB 3.48Å; E489-K493 VanDerWaalsContact O-CG 3.31Å; E489-K493 WeakPolarHBondContact O-CG 3.34Å; E489-K493 PolarHBondContact O-N 2.97Å; E489-K493 IonicContact OE2-NZ 2.74Å; E489-K493 PolarHBondContact OE2-NZ 3.5Å; E489-K806 WeakPolarHBondContact OE1-CE 3.26Å; E489-K806 IonicContact OE1-NZ 2.81Å; E489-K806 PolarHBondContact OE1-NZ 2.55Å; E489-L954 HydrophobicContact CG-CD2 4.24Å; E489-M958 HydrophobicContact CG-CE 4.32Å; E489-M958 HydrophobicContact CG-SD 4.09Å
490	L	87.8	Confident	87.2	Confident	82 Å²	82	56.8 Å²	56.8	43%	0.429	29%	0.285	S	S	.	.	H	α-helix	trans	-56.3	-46.3	173.8	-83.7	159.5	0	0	0	111.5	E486 A492 L494 F537	E486-L490 HydrophobicContact CG-CD1 4.02Å; E486-L490 WeakPolarHBondContact O-CB 3.45Å; E486-L490 WeakPolarHBondContact O-CG 3.42Å; E486-L490 PolarHBondContact O-N 3.43Å; L490-A492 PolarHBondContact O-N 2.98Å; L490-L494 VanDerWaalsContact O-CB 3.32Å; L490-L494 WeakPolarHBondContact O-CB 3.4Å; L490-L494 PolarHBondContact O-N 2.71Å; L490-F537 HydrophobicContact CD2-CE1 3.56Å; L490-F537 HydrophobicContact CD2-CZ 4.01Å; L490-F537 HydrophobicContact CG-CE1 4.01Å; L490-F537 HydrophobicContact CG-CZ 4.09Å
491	Q	88.7	Confident	87.4	Confident	90 Å²	90	58 Å²	58	42%	0.421	29%	0.29	S	S	.	.	H	α-helix	trans	-66.2	-33.7	178.4	-76.3	-179.9	-31.2	0	0	113	K487 Q488 E489 A495 K961	K487-Q491 WeakPolarHBondContact O-CB 3.39Å; K487-Q491 VanDerWaalsContact O-CG 3.29Å; K487-Q491 WeakPolarHBondContact O-CG 3.38Å; K487-Q491 PolarHBondContact O-N 3.5Å; Q488-Q491 PolarHBondContact O-N 2.92Å; E489-Q491 VanDerWaalsContact C-N 3.33Å; E489-Q491 PolarHBondContact O-N 2.79Å; Q491-A495 PolarHBondContact O-N 3.42Å; Q491-K961 PolarHBondContact O-NZ 3.29Å
492	A	88.6	Confident	87.7	Confident	1 Å²	1	59 Å²	59	1%	0.008	30%	0.301	C	S	.	.	H	α-helix	trans	-74	-45.6	176.2	0	0	0	0	0	112	Q488 E489 L490 L494 A495 Q496 L954 K957 M958	Q488-A492 PolarHBondContact O-N 2.93Å; E489-A492 PolarHBondContact O-N 3.12Å; L490-A492 PolarHBondContact O-N 2.98Å; A492-L494 VanDerWaalsContact C-N 3.29Å; A492-L494 PolarHBondContact O-N 3.09Å; A492-A495 PolarHBondContact O-N 3.14Å; A492-Q496 PolarHBondContact O-N 3.31Å; A492-Q496 VanDerWaalsContact O-N 3.11Å; A492-L954 HydrophobicContact CB-CD1 3.72Å; A492-K957 HydrophobicContact CB-CB 4.46Å; A492-M958 HydrophobicContact CB-CB 4.48Å; A492-M958 HydrophobicContact CB-CG 3.41Å; A492-M958 VanDerWaalsContact CB-CG 3.41Å
493	K	87.8	Confident	87.8	Confident	14 Å²	14	58.7 Å²	58.7	6%	0.061	30%	0.297	C	S	.	.	H	α-helix	trans	-59.2	-39.3	174.4	-69.1	166.6	-176.7	160.8	0	111.5	E489 A495 Q496 V497 F537 L954	E489-K493 WeakPolarHBondContact O-CB 3.48Å; E489-K493 VanDerWaalsContact O-CG 3.31Å; E489-K493 WeakPolarHBondContact O-CG 3.34Å; E489-K493 PolarHBondContact O-N 2.97Å; E489-K493 IonicContact OE2-NZ 2.74Å; E489-K493 PolarHBondContact OE2-NZ 3.5Å; K493-A495 PolarHBondContact O-N 3.39Å; K493-Q496 PolarHBondContact O-N 2.99Å; K493-V497 WeakPolarHBondContact O-CG2 3.43Å; K493-V497 PolarHBondContact O-N 3.18Å; K493-V497 VanDerWaalsContact O-N 3.08Å; K493-F537 HydrophobicContact CD-CD1 3.48Å; K493-F537 VanDerWaalsContact CD-CD1 3.48Å; K493-F537 HydrophobicContact CD-CE1 3.47Å; K493-F537 VanDerWaalsContact CD-CE1 3.47Å; K493-F537 HydrophobicContact CD-CG 4.13Å; K493-F537 HydrophobicContact CD-CZ 4.15Å; K493-L954 HydrophobicContact CD-CD1 4.42Å; K493-L954 HydrophobicContact CG-CD1 3.78Å
494	L	86.9	Confident	87.7	Confident	96 Å²	96	58.8 Å²	58.8	50%	0.503	29%	0.291	S	S	.	.	H	α-helix	trans	-62.9	-36.1	173.8	-179.3	60.7	0	0	0	113.2	L490 A492 V497 L498	L490-L494 VanDerWaalsContact O-CB 3.32Å; L490-L494 WeakPolarHBondContact O-CB 3.4Å; L490-L494 PolarHBondContact O-N 2.71Å; A492-L494 VanDerWaalsContact C-N 3.29Å; A492-L494 PolarHBondContact O-N 3.09Å; L494-V497 PolarHBondContact O-N 3.2Å; L494-L498 HydrophobicContact CD1-CD1 4.48Å; L494-L498 HydrophobicContact CD1-CG 4.46Å; L494-L498 HydrophobicContact CG-CD1 4.23Å; L494-L498 WeakPolarHBondContact O-CG 3.23Å; L494-L498 PolarHBondContact O-N 3.21Å
495	A	87.2	Confident	87.6	Confident	10 Å²	10	62.8 Å²	62.8	8%	0.083	31%	0.309	C	S	.	.	H	α-helix	trans	-68.9	-41.8	175.1	0	0	0	0	0	112.2	Q491 A492 K493 V497 L498 E499	Q491-A495 PolarHBondContact O-N 3.42Å; A492-A495 PolarHBondContact O-N 3.14Å; K493-A495 PolarHBondContact O-N 3.39Å; A495-V497 VanDerWaalsContact C-N 3.25Å; A495-V497 PolarHBondContact O-N 2.67Å; A495-L498 PolarHBondContact O-N 3.37Å; A495-L498 VanDerWaalsContact O-N 3.15Å; A495-E499 WeakPolarHBondContact O-CB 3.36Å; A495-E499 WeakPolarHBondContact O-CG 3.37Å; A495-E499 PolarHBondContact O-N 3.07Å
496	Q	86.7	Confident	87.4	Confident	17 Å²	17	63.3 Å²	63.3	8%	0.079	32%	0.318	C	S	.	.	H	α-helix	trans	-56	-41.6	173	-67.1	174	-13	0	0	111.6	A492 K493 K500 Q953 K957	A492-Q496 PolarHBondContact O-N 3.31Å; A492-Q496 VanDerWaalsContact O-N 3.11Å; K493-Q496 PolarHBondContact O-N 2.99Å; Q496-K500 VanDerWaalsContact O-CB 3.31Å; Q496-K500 WeakPolarHBondContact O-CB 3.35Å; Q496-K500 PolarHBondContact O-N 3.45Å; Q496-Q953 PolarHBondContact NE2-O 3.05Å; Q496-Q953 VanDerWaalsContact NE2-O 3.08Å; Q496-K957 HydrophobicContact CG-CG 3.99Å
497	V	86	Confident	87.1	Confident	30 Å²	30	59.8 Å²	59.8	18%	0.182	30%	0.301	C	S	.	.	H	α-helix	trans	-63.8	-46.3	175.3	174.6	0	0	0	0	111.9	K493 L494 A495 K500 M501 L530 L538	K493-V497 WeakPolarHBondContact O-CG2 3.43Å; K493-V497 PolarHBondContact O-N 3.18Å; K493-V497 VanDerWaalsContact O-N 3.08Å; L494-V497 PolarHBondContact O-N 3.2Å; A495-V497 VanDerWaalsContact C-N 3.25Å; A495-V497 PolarHBondContact O-N 2.67Å; V497-K500 WeakPolarHBondContact O-CB 3.41Å; V497-K500 PolarHBondContact O-N 2.94Å; V497-M501 HydrophobicContact CG1-CG 4.5Å; V497-M501 HydrophobicContact CG1-SD 4.3Å; V497-M501 WeakPolarHBondContact O-CG 3.22Å; V497-M501 PolarHBondContact O-N 3.48Å; V497-L530 HydrophobicContact CG2-CD1 4.01Å; V497-L538 HydrophobicContact CG2-CD1 3.39Å; V497-L538 HydrophobicContact CG2-CD2 4.45Å
498	L	87.9	Confident	86.9	Confident	97 Å²	97	57.4 Å²	57.4	51%	0.508	30%	0.299	S	S	.	.	H	α-helix	trans	-65.2	-41.8	-179	-71	169.3	0	0	0	112.1	L494 A495 K500 M501 V502	L494-L498 HydrophobicContact CD1-CD1 4.48Å; L494-L498 HydrophobicContact CD1-CG 4.46Å; L494-L498 HydrophobicContact CG-CD1 4.23Å; L494-L498 WeakPolarHBondContact O-CG 3.23Å; L494-L498 PolarHBondContact O-N 3.21Å; A495-L498 PolarHBondContact O-N 3.37Å; A495-L498 VanDerWaalsContact O-N 3.15Å; L498-K500 VanDerWaalsContact C-N 3.31Å; L498-K500 PolarHBondContact O-N 3.39Å; L498-M501 PolarHBondContact O-N 2.88Å; L498-V502 PolarHBondContact O-N 3.44Å
499	E	87.1	Confident	86.6	Confident	82 Å²	82	61 Å²	61	38%	0.383	32%	0.319	S	S	.	.	H	α-helix	trans	-60.6	-42.4	172.2	-70.6	166.5	-149.2	0	0	110.8	A495 M501 V502 E503 K957	A495-E499 WeakPolarHBondContact O-CB 3.36Å; A495-E499 WeakPolarHBondContact O-CG 3.37Å; A495-E499 PolarHBondContact O-N 3.07Å; E499-M501 PolarHBondContact O-N 3.19Å; E499-V502 WeakPolarHBondContact O-CB 3.31Å; E499-V502 PolarHBondContact O-N 3.07Å; E499-E503 PolarHBondContact O-N 2.95Å; E499-K957 WeakPolarHBondContact OE1-CE 3.38Å; E499-K957 IonicContact OE1-NZ 2.71Å; E499-K957 PolarHBondContact OE1-NZ 3.48Å; E499-K957 WeakPolarHBondContact OE2-CE 3.3Å; E499-K957 IonicContact OE2-NZ 2.74Å; E499-K957 PolarHBondContact OE2-NZ 3.4Å
500	K	84.6	Confident	86.3	Confident	30 Å²	30	62 Å²	62	13%	0.13	33%	0.329	C	S	.	.	H	α-helix	trans	-65.9	-34.6	176.6	-152.1	78.4	-167.6	167.3	0	113.8	Q496 V497 L498 V502 E503 Y504 E528 L530	Q496-K500 VanDerWaalsContact O-CB 3.31Å; Q496-K500 WeakPolarHBondContact O-CB 3.35Å; Q496-K500 PolarHBondContact O-N 3.45Å; V497-K500 WeakPolarHBondContact O-CB 3.41Å; V497-K500 PolarHBondContact O-N 2.94Å; L498-K500 VanDerWaalsContact C-N 3.31Å; L498-K500 PolarHBondContact O-N 3.39Å; K500-V502 VanDerWaalsContact C-N 3.32Å; K500-E503 WeakPolarHBondContact CD-OE2 3.45Å; K500-E503 VanDerWaalsContact CE-OE2 3.26Å; K500-E503 WeakPolarHBondContact CE-OE2 3.43Å; K500-E503 IonicContact NZ-OE2 3.55Å; K500-E503 PolarHBondContact NZ-OE2 3.12Å; K500-E503 PolarHBondContact O-N 3.26Å; K500-Y504 HydrophobicContact CG-CD2 4Å; K500-Y504 HydrophobicContact CG-CE2 3.61Å; K500-Y504 WeakPolarHBondContact O-CD2 3.38Å; K500-Y504 PolarHBondContact O-N 3.27Å; K500-E528 WeakPolarHBondContact CE-O 3.24Å; K500-E528 PolarHBondContact NZ-O 3.12Å; K500-L530 HydrophobicContact CB-CD1 4.4Å; K500-L530 HydrophobicContact CB-CD2 4.16Å; K500-L530 HydrophobicContact CB-CG 4.27Å; K500-L530 HydrophobicContact CD-CD2 4.22Å; K500-L530 HydrophobicContact CD-CG 4.38Å; K500-L530 HydrophobicContact CG-CD1 4.46Å; K500-L530 HydrophobicContact CG-CD2 4.16Å; K500-L530 HydrophobicContact CG-CG 3.97Å
501	M	83.4	Confident	86.1	Confident	102 Å²	102	60.9 Å²	60.9	50%	0.502	32%	0.323	S	S	.	.	H	α-helix	trans	-63.2	-40	173.1	-72.4	179.4	68.2	0	0	111.1	V497 L498 E499 Y504 E505	V497-M501 HydrophobicContact CG1-CG 4.5Å; V497-M501 HydrophobicContact CG1-SD 4.3Å; V497-M501 WeakPolarHBondContact O-CG 3.22Å; V497-M501 PolarHBondContact O-N 3.48Å; L498-M501 PolarHBondContact O-N 2.88Å; E499-M501 PolarHBondContact O-N 3.19Å; M501-Y504 PolarHBondContact O-N 3.47Å; M501-E505 WeakPolarHBondContact O-CB 3.32Å; M501-E505 WeakPolarHBondContact O-CG 3.43Å; M501-E505 PolarHBondContact O-N 3.27Å
502	V	88.4	Confident	85.8	Confident	93 Å²	93	64.5 Å²	64.5	56%	0.564	33%	0.333	S	S	*	.	H	α-helix	trans	-65.2	-37.9	174.3	175.8	0	0	0	0	111.8	L498 E499 K500 E505 A506	L498-V502 PolarHBondContact O-N 3.44Å; E499-V502 WeakPolarHBondContact O-CB 3.31Å; E499-V502 PolarHBondContact O-N 3.07Å; K500-V502 VanDerWaalsContact C-N 3.32Å; V502-E505 PolarHBondContact O-N 3Å; V502-A506 WeakPolarHBondContact O-CB 3.35Å; V502-A506 PolarHBondContact O-N 3.19Å
503	E	87.1	Confident	85.5	Confident	91 Å²	91	71.2 Å²	71.2	43%	0.425	36%	0.362	S	S	.	.	H	α-helix	trans	-62.5	-47.6	172.4	-70.9	179.3	-168.3	0	0	112.2	E499 K500 E505 A506 E507 T527	E499-E503 PolarHBondContact O-N 2.95Å; K500-E503 WeakPolarHBondContact CD-OE2 3.45Å; K500-E503 VanDerWaalsContact CE-OE2 3.26Å; K500-E503 WeakPolarHBondContact CE-OE2 3.43Å; K500-E503 IonicContact NZ-OE2 3.55Å; K500-E503 PolarHBondContact NZ-OE2 3.12Å; K500-E503 PolarHBondContact O-N 3.26Å; E503-E505 VanDerWaalsContact C-N 3.33Å; E503-E505 PolarHBondContact O-N 3.15Å; E503-A506 WeakPolarHBondContact O-CB 3.41Å; E503-A506 PolarHBondContact O-N 3.41Å; E503-A506 VanDerWaalsContact O-N 3.12Å; E503-E507 PolarHBondContact O-N 3.19Å; E503-T527 HydrophobicContact CB-CG2 4.08Å
504	Y	86.4	Confident	85.2	Confident	95 Å²	95	73.6 Å²	73.6	37%	0.373	37%	0.371	S	S	.	.	H	α-helix	trans	-65.8	-32.8	176.6	-74.9	-57.4	0	0	0	113	K500 M501 E507 A508 T527	K500-Y504 HydrophobicContact CG-CD2 4Å; K500-Y504 HydrophobicContact CG-CE2 3.61Å; K500-Y504 WeakPolarHBondContact O-CD2 3.38Å; K500-Y504 PolarHBondContact O-N 3.27Å; M501-Y504 PolarHBondContact O-N 3.47Å; Y504-E507 WeakPolarHBondContact CD1-OE2 3.43Å; Y504-A508 VanDerWaalsContact O-CB 3.22Å; Y504-A508 WeakPolarHBondContact O-CB 3.41Å; Y504-A508 PolarHBondContact O-N 3.41Å; Y504-T527 HydrophobicContact CD1-CG2 4.01Å; Y504-T527 HydrophobicContact CE1-CG2 3.66Å; Y504-T527 HydrophobicContact CE2-CG2 4.48Å
505	E	85.8	Confident	84.9	Confident	112 Å²	112	74.6 Å²	74.6	52%	0.523	38%	0.376	S	S	.	.	H	α-helix	trans	-65.6	-39.7	170.3	-76.6	177.2	-165.2	0	0	111.4	M501 V502 E503 N509	M501-E505 WeakPolarHBondContact O-CB 3.32Å; M501-E505 WeakPolarHBondContact O-CG 3.43Å; M501-E505 PolarHBondContact O-N 3.27Å; V502-E505 PolarHBondContact O-N 3Å; E503-E505 VanDerWaalsContact C-N 3.33Å; E503-E505 PolarHBondContact O-N 3.15Å; E505-N509 VanDerWaalsContact O-CB 3.29Å; E505-N509 WeakPolarHBondContact O-CB 3.27Å; E505-N509 VanDerWaalsContact O-CG 3.26Å; E505-N509 PolarHBondContact O-N 3.05Å; E505-N509 PolarHBondContact O-ND2 3.3Å
506	A	85.2	Confident	84.6	Confident	52 Å²	52	80.6 Å²	80.6	43%	0.43	41%	0.406	S	S	.	.	H	α-helix	trans	-67.5	-40.2	175.4	0	0	0	0	0	112.5	V502 E503 S510	V502-A506 WeakPolarHBondContact O-CB 3.35Å; V502-A506 PolarHBondContact O-N 3.19Å; E503-A506 WeakPolarHBondContact O-CB 3.41Å; E503-A506 PolarHBondContact O-N 3.41Å; E503-A506 VanDerWaalsContact O-N 3.12Å; A506-S510 WeakPolarHBondContact O-CB 3.35Å; A506-S510 PolarHBondContact O-N 3.26Å; A506-S510 PolarHBondContact O-OG 2.67Å
507	E	84.9	Confident	84.2	Confident	25 Å²	25	81.3 Å²	81.3	12%	0.117	41%	0.414	C	S	.	.	H	α-helix	trans	-63.2	-50.2	172.5	-176.9	-179	-167.1	0	0	110.9	E503 Y504 N509 S510 L511 T527	E503-E507 PolarHBondContact O-N 3.19Å; Y504-E507 WeakPolarHBondContact CD1-OE2 3.43Å; E507-N509 VanDerWaalsContact C-N 3.3Å; E507-N509 PolarHBondContact O-N 3.47Å; E507-S510 CarbonylContact O-C 3.33Å; E507-S510 WeakPolarHBondContact O-CA 3.45Å; E507-S510 WeakPolarHBondContact O-CB 3.38Å; E507-S510 PolarHBondContact O-N 2.85Å; E507-L511 HydrophobicContact CG-CD1 3.96Å; E507-L511 HydrophobicContact CG-CG 4.34Å; E507-L511 WeakPolarHBondContact O-CG 3.18Å; E507-L511 PolarHBondContact O-N 3.04Å; E507-T527 VanDerWaalsContact CD-OG1 3.3Å; E507-T527 PolarHBondContact OE1-N 2.69Å; E507-T527 WeakPolarHBondContact OE2-CB 3.21Å; E507-T527 PolarHBondContact OE2-N 2.83Å; E507-T527 PolarHBondContact OE2-OG1 2.62Å
508	A	84.5	Confident	83.7	Confident	45 Å²	45	88 Å²	88	37%	0.372	45%	0.448	S	S	.	.	H	α-helix	trans	-60.5	-37.5	178.7	0	0	0	0	0	112.6	Y504 S510 R512	Y504-A508 VanDerWaalsContact O-CB 3.22Å; Y504-A508 WeakPolarHBondContact O-CB 3.41Å; Y504-A508 PolarHBondContact O-N 3.41Å; A508-S510 VanDerWaalsContact C-N 3.32Å; A508-R512 WeakPolarHBondContact O-CB 3.4Å; A508-R512 VanDerWaalsContact O-CG 3.24Å; A508-R512 WeakPolarHBondContact O-CG 3.48Å; A508-R512 PolarHBondContact O-N 2.59Å
509	N	84.1	Confident	82.7	Confident	89 Å²	89	84.6 Å²	84.6	48%	0.476	44%	0.437	S	S	.	.	H	α-helix	trans	-69.3	-27.9	172.8	-77.3	-48.7	0	0	0	113.1	E505 E507 K513	E505-N509 VanDerWaalsContact O-CB 3.29Å; E505-N509 WeakPolarHBondContact O-CB 3.27Å; E505-N509 VanDerWaalsContact O-CG 3.26Å; E505-N509 PolarHBondContact O-N 3.05Å; E505-N509 PolarHBondContact O-ND2 3.3Å; E507-N509 VanDerWaalsContact C-N 3.3Å; E507-N509 PolarHBondContact O-N 3.47Å; N509-K513 WeakPolarHBondContact O-CG 3.49Å; N509-K513 PolarHBondContact O-N 3.07Å
510	S	83.7	Confident	82	Confident	49 Å²	49	88.3 Å²	88.3	34%	0.343	46%	0.459	S	S	.	.	H	α-helix	trans	-79.6	-39.7	175.9	-57	0	0	0	0	111.8	A506 E507 A508 K513 Y514	A506-S510 WeakPolarHBondContact O-CB 3.35Å; A506-S510 PolarHBondContact O-N 3.26Å; A506-S510 PolarHBondContact O-OG 2.67Å; E507-S510 CarbonylContact O-C 3.33Å; E507-S510 WeakPolarHBondContact O-CA 3.45Å; E507-S510 WeakPolarHBondContact O-CB 3.38Å; E507-S510 PolarHBondContact O-N 2.85Å; A508-S510 VanDerWaalsContact C-N 3.32Å; S510-K513 PolarHBondContact O-N 3.39Å; S510-Y514 PolarHBondContact O-N 3.49Å
511	L	82.5	Confident	81.3	Confident	59 Å²	59	91.6 Å²	91.6	31%	0.309	48%	0.478	S	S	.	.	H	α-helix	trans	-63.6	-39.8	172.5	-71.3	170.5	0	0	0	111.8	E507 Y514 I515 P524	E507-L511 HydrophobicContact CG-CD1 3.96Å; E507-L511 HydrophobicContact CG-CG 4.34Å; E507-L511 WeakPolarHBondContact O-CG 3.18Å; E507-L511 PolarHBondContact O-N 3.04Å; L511-Y514 PolarHBondContact O-N 3.15Å; L511-I515 VanDerWaalsContact O-CG1 3.31Å; L511-I515 WeakPolarHBondContact O-CG1 3.34Å; L511-I515 PolarHBondContact O-N 2.77Å; L511-P524 HydrophobicContact CD2-CG 3.61Å; L511-P524 HydrophobicContact CG-CG 3.81Å
512	R	82.4	Confident	80.7	Confident	165 Å²	165	91.9 Å²	91.9	62%	0.623	49%	0.49	S	S	*	.	H	α-helix	trans	-56.2	-51.4	170.7	-76.9	167.3	-176.4	-100.3	3.7	111.4	A508 Y514 I515 D516	A508-R512 WeakPolarHBondContact O-CB 3.4Å; A508-R512 VanDerWaalsContact O-CG 3.24Å; A508-R512 WeakPolarHBondContact O-CG 3.48Å; A508-R512 PolarHBondContact O-N 2.59Å; R512-Y514 VanDerWaalsContact C-N 3.3Å; R512-Y514 PolarHBondContact O-N 3.14Å; R512-I515 PolarHBondContact O-N 3.41Å; R512-I515 VanDerWaalsContact O-N 3.13Å; R512-D516 WeakPolarHBondContact O-CB 3.23Å; R512-D516 PolarHBondContact O-N 3.04Å
513	K	82.8	Confident	79.8	Confident	142 Å²	142	92.7 Å²	92.7	62%	0.617	49%	0.491	S	S	*	.	H	α-helix	trans	-60.2	-35.8	177.5	-70.9	170.3	-176.1	176.3	0	113.8	N509 S510 S517	N509-K513 WeakPolarHBondContact O-CG 3.49Å; N509-K513 PolarHBondContact O-N 3.07Å; S510-K513 PolarHBondContact O-N 3.39Å; K513-S517 WeakPolarHBondContact O-CB 3.45Å; K513-S517 PolarHBondContact O-N 3.06Å; K513-S517 PolarHBondContact O-OG 3.36Å; K513-S517 VanDerWaalsContact O-OG 3.13Å
514	Y	80.8	Confident	79	Confident	65 Å²	65	89.8 Å²	89.8	26%	0.255	48%	0.48	S	S	.	.	H	α-helix	trans	-64.2	-44.5	174.7	170.4	-96.1	0	0	0	111.6	S510 L511 R512 S517 G519 N521 L523	S510-Y514 PolarHBondContact O-N 3.49Å; L511-Y514 PolarHBondContact O-N 3.15Å; R512-Y514 VanDerWaalsContact C-N 3.3Å; R512-Y514 PolarHBondContact O-N 3.14Å; Y514-S517 PolarHBondContact O-N 3.02Å; Y514-S517 PolarHBondContact O-OG 3Å; Y514-G519 VanDerWaalsContact CE2-CA 3.44Å; Y514-G519 WeakPolarHBondContact CE2-O 3.49Å; Y514-G519 PolarHBondContact O-N 3.28Å; Y514-G519 VanDerWaalsContact O-N 3.1Å; Y514-N521 HydrophobicContact CD2-CB 4.38Å; Y514-N521 VanDerWaalsContact CD2-O 3.22Å; Y514-N521 WeakPolarHBondContact CD2-O 3.21Å; Y514-N521 WeakPolarHBondContact CE2-O 3.19Å; Y514-L523 HydrophobicContact CD1-CG 4.49Å; Y514-L523 HydrophobicContact CD2-CD1 4.49Å; Y514-L523 HydrophobicContact CD2-CG 4.45Å; Y514-L523 HydrophobicContact CE1-CD1 3.96Å; Y514-L523 HydrophobicContact CE1-CG 4.23Å; Y514-L523 HydrophobicContact CE2-CD1 3.76Å; Y514-L523 HydrophobicContact CE2-CG 4.19Å; Y514-L523 VanDerWaalsContact CZ-CD1 3.47Å
515	I	80.7	Confident	78.4	Confident	116 Å²	116	90.9 Å²	90.9	60%	0.595	50%	0.499	S	S	*	.	H	α-helix	trans	-65.7	-46	176	-65.8	162.9	0	0	0	110.9	L511 R512 S517 D518	L511-I515 VanDerWaalsContact O-CG1 3.31Å; L511-I515 WeakPolarHBondContact O-CG1 3.34Å; L511-I515 PolarHBondContact O-N 2.77Å; R512-I515 PolarHBondContact O-N 3.41Å; R512-I515 VanDerWaalsContact O-N 3.13Å; I515-S517 PolarHBondContact O-N 2.7Å; I515-S517 VanDerWaalsContact O-N 3.09Å; I515-D518 PolarHBondContact O-N 3.08Å; I515-D518 VanDerWaalsContact O-N 3.17Å
516	D	82	Confident	77.8	Confident	136 Å²	136	92.9 Å²	92.9	73%	0.727	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-10.9	177.5	-63.9	-29.2	0	0	0	113	R512	R512-D516 WeakPolarHBondContact O-CB 3.23Å; R512-D516 PolarHBondContact O-N 3.04Å
517	S	78.3	Confident	77.5	Confident	33 Å²	33	91.4 Å²	91.4	23%	0.231	50%	0.498	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.9	20.7	176.6	70.9	0	0	0	0	114.3	K513 Y514 I515 G519 D520 N521	K513-S517 WeakPolarHBondContact O-CB 3.45Å; K513-S517 PolarHBondContact O-N 3.06Å; K513-S517 PolarHBondContact O-OG 3.36Å; K513-S517 VanDerWaalsContact O-OG 3.13Å; Y514-S517 PolarHBondContact O-N 3.02Å; Y514-S517 PolarHBondContact O-OG 3Å; I515-S517 PolarHBondContact O-N 2.7Å; I515-S517 VanDerWaalsContact O-N 3.09Å; S517-G519 PolarHBondContact O-N 3.13Å; S517-D520 WeakPolarHBondContact O-CB 3.42Å; S517-D520 PolarHBondContact O-N 3.25Å; S517-N521 WeakPolarHBondContact CB-ND2 3.45Å; S517-N521 PolarHBondContact OG-ND2 2.54Å
518	D	74.1	Confident	77.1	Confident	170 Å²	170	97.9 Å²	97.9	91%	0.909	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.6	26.9	-176.7	-81.2	-40.1	0	0	0	114.3	I515	I515-D518 PolarHBondContact O-N 3.08Å; I515-D518 VanDerWaalsContact O-N 3.17Å
519	G	67.5	Low	76.5	Confident	26 Å²	26	100.7 Å²	100.7	27%	0.268	54%	0.542	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.9	10.3	179.4	0	0	0	0	0	117.1	Y514 S517 N521	Y514-G519 VanDerWaalsContact CE2-CA 3.44Å; Y514-G519 WeakPolarHBondContact CE2-O 3.49Å; Y514-G519 PolarHBondContact O-N 3.28Å; Y514-G519 VanDerWaalsContact O-N 3.1Å; S517-G519 PolarHBondContact O-N 3.13Å; G519-N521 VanDerWaalsContact C-N 3.29Å; G519-N521 PolarHBondContact O-N 3.44Å
520	D	72.6	Confident	75.9	Confident	160 Å²	160	98.6 Å²	98.6	86%	0.856	53%	0.531	S	S	*	.			trans	-73.1	-17.3	-177.9	-154.1	39.4	0	0	0	113.6	S517	S517-D520 WeakPolarHBondContact O-CB 3.42Å; S517-D520 PolarHBondContact O-N 3.25Å
521	N	69.4	Low	75.3	Confident	99 Å²	99	97.2 Å²	97.2	53%	0.529	52%	0.522	S	S	.	.	S	Bend	trans	-83.2	160.2	170	-77.1	-77.1	0	0	0	112	Y514 S517 G519	Y514-N521 HydrophobicContact CD2-CB 4.38Å; Y514-N521 VanDerWaalsContact CD2-O 3.22Å; Y514-N521 WeakPolarHBondContact CD2-O 3.21Å; Y514-N521 WeakPolarHBondContact CE2-O 3.19Å; S517-N521 WeakPolarHBondContact CB-ND2 3.45Å; S517-N521 PolarHBondContact OG-ND2 2.54Å; G519-N521 VanDerWaalsContact C-N 3.29Å; G519-N521 PolarHBondContact O-N 3.44Å
522	S	71.8	Confident	74.7	Confident	108 Å²	108	98.4 Å²	98.4	76%	0.755	53%	0.533	S	S	*	.	P	Polyproline II helix	trans	-68.1	139.3	167.6	56.7	0	0	0	0	111.6
523	L	69.5	Low	74.1	Confident	110 Å²	110	91.7 Å²	91.7	58%	0.576	52%	0.515	S	S	*	.	P	Polyproline II helix	trans	-55.4	140.4	168.6	-96.6	101.6	0	0	0	110.8	Y514	Y514-L523 HydrophobicContact CD1-CG 4.49Å; Y514-L523 HydrophobicContact CD2-CD1 4.49Å; Y514-L523 HydrophobicContact CD2-CG 4.45Å; Y514-L523 HydrophobicContact CE1-CD1 3.96Å; Y514-L523 HydrophobicContact CE1-CG 4.23Å; Y514-L523 HydrophobicContact CE2-CD1 3.76Å; Y514-L523 HydrophobicContact CE2-CG 4.19Å; Y514-L523 VanDerWaalsContact CZ-CD1 3.47Å
524	P	69.2	Low	73.5	Confident	30 Å²	30	85 Å²	85	20%	0.195	49%	0.486	C	S	.	.	P	Polyproline II helix	trans	-64.7	149.4	170.1	28.8	-33.8	0	0	0	110.6	L511	L511-P524 HydrophobicContact CD2-CG 3.61Å; L511-P524 HydrophobicContact CG-CG 3.81Å
525	P	73.5	Confident	73	Confident	118 Å²	118	85.1 Å²	85.1	77%	0.766	49%	0.493	S	S	*	.	P	Polyproline II helix	trans	-64.9	138.6	171.8	29.1	-34.5	0	0	0	110.1	T527	P525-T527 PolarHBondContact O-N 3.24Å
526	L	74.9	Confident	72.6	Confident	153 Å²	153	85.4 Å²	85.4	80%	0.801	49%	0.492	S	S	*	.	P	Polyproline II helix	trans	-64.9	131.5	-177.6	-154.9	86.8	0	0	0	111	E528	L526-E528 PolarHBondContact O-N 3.28Å
527	T	78.3	Confident	71.9	Confident	22 Å²	22	81.3 Å²	81.3	14%	0.135	47%	0.468	C	S	.	.			trans	-68.6	115.2	178.7	-56.3	0	0	0	0	111.1	E503 Y504 E507 P525	E503-T527 HydrophobicContact CB-CG2 4.08Å; Y504-T527 HydrophobicContact CD1-CG2 4.01Å; Y504-T527 HydrophobicContact CE1-CG2 3.66Å; Y504-T527 HydrophobicContact CE2-CG2 4.48Å; E507-T527 VanDerWaalsContact CD-OG1 3.3Å; E507-T527 PolarHBondContact OE1-N 2.69Å; E507-T527 WeakPolarHBondContact OE2-CB 3.21Å; E507-T527 PolarHBondContact OE2-N 2.83Å; E507-T527 PolarHBondContact OE2-OG1 2.62Å; P525-T527 PolarHBondContact O-N 3.24Å
528	E	75.8	Confident	71.4	Confident	160 Å²	160	82.7 Å²	82.7	75%	0.748	47%	0.473	S	S	*	.	P	Polyproline II helix	trans	-53.1	133.6	176.4	-67.1	-169.3	159.3	0	0	111.2	K500 L526	K500-E528 WeakPolarHBondContact CE-O 3.24Å; K500-E528 PolarHBondContact NZ-O 3.12Å; L526-E528 PolarHBondContact O-N 3.28Å
529	P	73.5	Confident	71	Confident	104 Å²	104	78.9 Å²	78.9	68%	0.675	46%	0.459	S	S	*	.	P	Polyproline II helix	trans	-68.3	157.7	-177.5	28.2	-35.2	0	0	0	113.3
530	L	70.9	Confident	70.8	Confident	45 Å²	45	85.5 Å²	85.5	24%	0.236	48%	0.476	C	S	.	.	P	Polyproline II helix	trans	-57.5	145.5	168	-75.8	168.3	0	0	0	110.9	V497 K500 V535	V497-L530 HydrophobicContact CG2-CD1 4.01Å; K500-L530 HydrophobicContact CB-CD1 4.4Å; K500-L530 HydrophobicContact CB-CD2 4.16Å; K500-L530 HydrophobicContact CB-CG 4.27Å; K500-L530 HydrophobicContact CD-CD2 4.22Å; K500-L530 HydrophobicContact CD-CG 4.38Å; K500-L530 HydrophobicContact CG-CD1 4.46Å; K500-L530 HydrophobicContact CG-CD2 4.16Å; K500-L530 HydrophobicContact CG-CG 3.97Å; L530-V535 HydrophobicContact CB-CG2 3.83Å
531	S	71	Confident	69.8	Low	21 Å²	21	82.1 Å²	82.1	15%	0.147	47%	0.465	C	S	.	.	P	Polyproline II helix	trans	-57.8	140.7	179.2	-170.4	0	0	0	0	111.8	G533 T534 V535 E950	S531-G533 PolarHBondContact O-N 3.43Å; S531-G533 VanDerWaalsContact O-N 3.14Å; S531-T534 PolarHBondContact O-N 3Å; S531-T534 VanDerWaalsContact O-N 3.15Å; S531-V535 PolarHBondContact O-N 2.7Å; S531-V535 VanDerWaalsContact O-N 3.11Å; S531-E950 WeakPolarHBondContact CB-OE2 3.34Å; S531-E950 PolarHBondContact OG-OE2 2.82Å
532	P	69.4	Low	68.8	Low	83 Å²	83	83.7 Å²	83.7	54%	0.539	47%	0.473	S	S	.	.	H	α-helix	trans	-55.7	-30.9	-177	-29.2	36.3	0	0	0	115.1	V535 Q536	P532-V535 PolarHBondContact O-N 3.13Å; P532-Q536 WeakPolarHBondContact O-CB 3.4Å; P532-Q536 VanDerWaalsContact O-CG 3.27Å; P532-Q536 WeakPolarHBondContact O-CG 3.34Å; P532-Q536 PolarHBondContact O-N 3.42Å
533	G	69.5	Low	67.6	Low	25 Å²	25	82.5 Å²	82.5	26%	0.258	47%	0.465	S	S	.	.	H	α-helix	trans	-67.7	-47.3	176.9	0	0	0	0	0	112	S531 V535 Q536 F537 E950	S531-G533 PolarHBondContact O-N 3.43Å; S531-G533 VanDerWaalsContact O-N 3.14Å; G533-V535 VanDerWaalsContact C-N 3.33Å; G533-V535 PolarHBondContact O-N 3.24Å; G533-Q536 PolarHBondContact O-N 2.8Å; G533-F537 WeakPolarHBondContact O-CB 3.18Å; G533-F537 PolarHBondContact O-N 3.42Å; G533-E950 VanDerWaalsContact CA-OE1 3.22Å; G533-E950 WeakPolarHBondContact CA-OE1 3.44Å; G533-E950 WeakPolarHBondContact CA-OE2 3.4Å; G533-E950 PolarHBondContact N-OE2 3.32Å
534	T	70.3	Confident	66.3	Low	2 Å²	2	84.4 Å²	84.4	1%	0.012	48%	0.475	C	S	.	.	H	α-helix	trans	-56.5	-45.2	172.2	-64.5	0	0	0	0	111.4	S531 F537 L538 E950	S531-T534 PolarHBondContact O-N 3Å; S531-T534 VanDerWaalsContact O-N 3.15Å; T534-F537 PolarHBondContact O-N 3.48Å; T534-L538 HydrophobicContact CG2-CD1 3.94Å; T534-L538 WeakPolarHBondContact O-CD1 3.11Å; T534-L538 VanDerWaalsContact O-CG 3.24Å; T534-L538 WeakPolarHBondContact O-CG 3.23Å; T534-L538 PolarHBondContact O-N 2.98Å; T534-L538 VanDerWaalsContact O-N 3.14Å; T534-E950 PolarHBondContact N-OE1 3.12Å
535	V	72.1	Confident	65	Low	66 Å²	66	91.6 Å²	91.6	40%	0.4	50%	0.503	S	S	.	.	H	α-helix	trans	-62.8	-51.6	177.1	179	0	0	0	0	111.1	L530 S531 P532 G533 F537 L538 S539	L530-V535 HydrophobicContact CB-CG2 3.83Å; S531-V535 PolarHBondContact O-N 2.7Å; S531-V535 VanDerWaalsContact O-N 3.11Å; P532-V535 PolarHBondContact O-N 3.13Å; G533-V535 VanDerWaalsContact C-N 3.33Å; G533-V535 PolarHBondContact O-N 3.24Å; V535-F537 VanDerWaalsContact C-N 3.28Å; V535-F537 PolarHBondContact O-N 2.89Å; V535-L538 PolarHBondContact O-N 3.45Å; V535-S539 PolarHBondContact O-N 2.92Å; V535-S539 PolarHBondContact O-OG 3.2Å
536	Q	70.5	Confident	63.5	Low	122 Å²	122	90.3 Å²	90.3	57%	0.57	50%	0.497	S	S	*	.	H	α-helix	trans	-58.6	-38.5	177.8	-77.1	-177.9	24	0	0	112.7	P532 G533 S539 R540	P532-Q536 WeakPolarHBondContact O-CB 3.4Å; P532-Q536 VanDerWaalsContact O-CG 3.27Å; P532-Q536 WeakPolarHBondContact O-CG 3.34Å; P532-Q536 PolarHBondContact O-N 3.42Å; G533-Q536 PolarHBondContact O-N 2.8Å; Q536-S539 PolarHBondContact O-N 3.31Å; Q536-R540 WeakPolarHBondContact O-CG 3.4Å; Q536-R540 PolarHBondContact O-N 3.23Å
537	F	68.7	Low	61.7	Low	51 Å²	51	92.1 Å²	92.1	22%	0.224	50%	0.498	C	S	.	.	H	α-helix	trans	-63.9	-44.8	179.7	-176.1	-97.2	0	0	0	111.2	L490 K493 G533 T534 V535 R540	L490-F537 HydrophobicContact CD2-CE1 3.56Å; L490-F537 HydrophobicContact CD2-CZ 4.01Å; L490-F537 HydrophobicContact CG-CE1 4.01Å; L490-F537 HydrophobicContact CG-CZ 4.09Å; K493-F537 HydrophobicContact CD-CD1 3.48Å; K493-F537 VanDerWaalsContact CD-CD1 3.48Å; K493-F537 HydrophobicContact CD-CE1 3.47Å; K493-F537 VanDerWaalsContact CD-CE1 3.47Å; K493-F537 HydrophobicContact CD-CG 4.13Å; K493-F537 HydrophobicContact CD-CZ 4.15Å; G533-F537 WeakPolarHBondContact O-CB 3.18Å; G533-F537 PolarHBondContact O-N 3.42Å; T534-F537 PolarHBondContact O-N 3.48Å; V535-F537 VanDerWaalsContact C-N 3.28Å; V535-F537 PolarHBondContact O-N 2.89Å; F537-R540 PolarHBondContact O-N 3.01Å
538	L	66.8	Low	59.6	Low	62 Å²	62	94.5 Å²	94.5	33%	0.325	53%	0.528	S	S	.	.	H	α-helix	trans	-66.4	-36.9	175.1	-63.3	160.5	0	0	0	111.8	V497 T534 V535 R540 S541	V497-L538 HydrophobicContact CG2-CD1 3.39Å; V497-L538 HydrophobicContact CG2-CD2 4.45Å; T534-L538 HydrophobicContact CG2-CD1 3.94Å; T534-L538 WeakPolarHBondContact O-CD1 3.11Å; T534-L538 VanDerWaalsContact O-CG 3.24Å; T534-L538 WeakPolarHBondContact O-CG 3.23Å; T534-L538 PolarHBondContact O-N 2.98Å; T534-L538 VanDerWaalsContact O-N 3.14Å; V535-L538 PolarHBondContact O-N 3.45Å; L538-R540 PolarHBondContact O-N 3.2Å; L538-S541 PolarHBondContact O-N 2.74Å; L538-S541 PolarHBondContact O-OG 2.97Å
539	S	66.4	Low	57.6	Low	89 Å²	89	95.9 Å²	95.9	62%	0.622	53%	0.531	S	S	*	.	H	α-helix	trans	-65.5	-13.2	176.5	-57.8	0	0	0	0	114.8	V535 Q536 S541	V535-S539 PolarHBondContact O-N 2.92Å; V535-S539 PolarHBondContact O-OG 3.2Å; Q536-S539 PolarHBondContact O-N 3.31Å; S539-S541 PolarHBondContact O-N 2.59Å; S539-S541 VanDerWaalsContact O-N 3.16Å
540	R	62.4	Low	55.6	Low	166 Å²	166	98.6 Å²	98.6	63%	0.626	54%	0.539	S	S	*	.	G	3₁₀ helix	trans	-73.3	2.2	177.6	-72.3	175.5	-177.8	-173.9	1.8	114.9	Q536 F537 L538 D542 S543	Q536-R540 WeakPolarHBondContact O-CG 3.4Å; Q536-R540 PolarHBondContact O-N 3.23Å; F537-R540 PolarHBondContact O-N 3.01Å; L538-R540 PolarHBondContact O-N 3.2Å; R540-D542 PolarHBondContact O-N 3.4Å; R540-S543 PolarHBondContact O-N 3.31Å
541	S	52.5	Low	53.8	Low	88 Å²	88	101.9 Å²	101.9	62%	0.615	56%	0.557	S	S	*	*	G	3₁₀ helix	trans	-48.9	-31.2	-170.3	-70.8	0	0	0	0	116.3	L538 S539	L538-S541 PolarHBondContact O-N 2.74Å; L538-S541 PolarHBondContact O-OG 2.97Å; S539-S541 PolarHBondContact O-N 2.59Å; S539-S541 VanDerWaalsContact O-N 3.16Å
542	D	47.9	Very low	51.9	Low	132 Å²	132	107.4 Å²	107.4	71%	0.706	59%	0.59	S	S	*	*	G	3₁₀ helix	trans	-78.9	-20.6	-179.9	-74	-49.9	0	0	0	114.9	R540 L544 K545	R540-D542 PolarHBondContact O-N 3.4Å; D542-L544 VanDerWaalsContact C-N 3.27Å; D542-L544 PolarHBondContact O-N 2.96Å; D542-K545 PolarHBondContact O-N 3.43Å
543	S	46.8	Very low	50.1	Low	84 Å²	84	111 Å²	111	59%	0.587	60%	0.6	S	S	*	*	H	α-helix	trans	-72.4	-15.8	-172.9	-68.9	0	0	0	0	114.6	R540 S546	R540-S543 PolarHBondContact O-N 3.31Å; S543-S546 PolarHBondContact O-OG 2.91Å
544	L	42.8	Very low	48.2	Very low	149 Å²	149	112.8 Å²	112.8	78%	0.78	62%	0.617	S	S	*	*	H	α-helix	trans	-80	-19.4	-179.9	-76.6	165.9	0	0	0	113.6	D542	D542-L544 VanDerWaalsContact C-N 3.27Å; D542-L544 PolarHBondContact O-N 2.96Å
545	K	41.9	Very low	46.4	Very low	181 Å²	181	119.7 Å²	119.7	79%	0.787	66%	0.659	S	S	*	*	H	α-helix	trans	-82.5	-23.7	-179.6	-75	177.6	179.2	168.2	0	114.2	D542	D542-K545 PolarHBondContact O-N 3.43Å
546	S	41.7	Very low	44.5	Very low	92 Å²	92	122.5 Å²	122.5	64%	0.643	68%	0.676	S	S	*	*	H	α-helix	trans	-79.9	-28.1	-177.7	60.6	0	0	0	0	113.6	S543 G548	S543-S546 PolarHBondContact O-OG 2.91Å; S546-G548 PolarHBondContact O-N 3.49Å; S546-G548 VanDerWaalsContact O-N 3.11Å
547	K	36.1	Very low	42.8	Very low	190 Å²	190	122.4 Å²	122.4	83%	0.826	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.3	1.7	-175.2	-131.5	171.8	-174.4	176.9	0	114.8	K549	K547-K549 VanDerWaalsContact C-N 3.31Å; K547-K549 PolarHBondContact O-N 3.47Å
548	G	34.6	Very low	41.2	Very low	73 Å²	73	125.6 Å²	125.6	75%	0.753	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.4	-10.5	175.8	0	0	0	0	0	115.2	S546	S546-G548 PolarHBondContact O-N 3.49Å; S546-G548 VanDerWaalsContact O-N 3.11Å
549	K	33	Very low	39.8	Very low	189 Å²	189	126.8 Å²	126.8	82%	0.822	73%	0.734	S	S	*	*			trans	-95.7	87.7	167.9	-74.9	-169.2	175.4	-173.8	0	110.3	K547 D551	K547-K549 VanDerWaalsContact C-N 3.31Å; K547-K549 PolarHBondContact O-N 3.47Å; K549-D551 VanDerWaalsContact C-N 3.32Å; K549-D551 PolarHBondContact O-N 3.28Å; K549-D551 VanDerWaalsContact O-N 3.09Å
550	L	31.5	Very low	38.4	Very low	161 Å²	161	126.9 Å²	126.9	84%	0.843	74%	0.74	S	S	*	*			trans	-73.7	92.3	161.3	-170.7	74.3	0	0	0	107.7	T552	L550-T552 PolarHBondContact O-N 2.97Å
551	D	34.1	Very low	37.4	Very low	113 Å²	113	124.4 Å²	124.4	60%	0.604	75%	0.745	S	S	*	*			trans	-64.6	120.3	-178.4	-156.2	40.6	0	0	0	109.5	K549 Q553	K549-D551 VanDerWaalsContact C-N 3.32Å; K549-D551 PolarHBondContact O-N 3.28Å; K549-D551 VanDerWaalsContact O-N 3.09Å; D551-Q553 HydrophobicContact CB-CG 4.42Å; D551-Q553 PolarHBondContact O-N 3.08Å; D551-Q553 WeakPolarHBondContact OD2-CG 3.4Å; D551-Q553 PolarHBondContact OD2-NE2 3.4Å
552	T	30.4	Very low	37.1	Very low	137 Å²	137	125.8 Å²	125.8	84%	0.84	75%	0.752	S	S	*	*			trans	-78.6	51.9	-174.6	37.4	0	0	0	0	112.3	L550	L550-T552 PolarHBondContact O-N 2.97Å
553	Q	32.4	Very low	37.1	Very low	160 Å²	160	125 Å²	125	75%	0.748	75%	0.754	S	S	*	*			trans	-68.1	133.9	170.3	-58.4	-162.7	13.6	0	0	109.4	D551	D551-Q553 HydrophobicContact CB-CG 4.42Å; D551-Q553 PolarHBondContact O-N 3.08Å; D551-Q553 WeakPolarHBondContact OD2-CG 3.4Å; D551-Q553 PolarHBondContact OD2-NE2 3.4Å
554	G	29.1	Very low	37.2	Very low	61 Å²	61	126.4 Å²	126.4	63%	0.629	76%	0.762	S	S	*	*			trans	-63	156.3	-162.1	0	0	0	0	0	114.5	V556	G554-V556 WeakPolarHBondContact O-CG2 3.43Å; G554-V556 PolarHBondContact O-N 2.86Å
555	V	31.9	Very low	37.7	Very low	147 Å²	147	124.8 Å²	124.8	89%	0.891	76%	0.76	S	S	*	*			trans	-66.9	82.6	174.3	-175.8	0	0	0	0	109.9
556	V	34.1	Very low	38.2	Very low	126 Å²	126	121.6 Å²	121.6	76%	0.764	76%	0.758	S	S	*	*			trans	-70.5	128.6	159.9	-147.3	0	0	0	0	106.4	G554 S558	G554-V556 WeakPolarHBondContact O-CG2 3.43Å; G554-V556 PolarHBondContact O-N 2.86Å; V556-S558 PolarHBondContact O-N 3.42Å
557	P	34.3	Very low	38.5	Very low	120 Å²	120	122.7 Å²	122.7	78%	0.779	76%	0.763	S	S	*	*			trans	-65.5	98.4	-176.5	-22.9	34.4	0	0	0	111.3	A559	P557-A559 PolarHBondContact O-N 3.45Å
558	S	33.6	Very low	39.3	Very low	117 Å²	117	119.2 Å²	119.2	82%	0.818	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-58.6	130.4	170.5	-168.9	0	0	0	0	108.4	V556 A560	V556-S558 PolarHBondContact O-N 3.42Å; S558-A560 PolarHBondContact O-N 2.99Å
559	A	38.6	Very low	39.8	Very low	88 Å²	88	121.2 Å²	121.2	73%	0.727	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-56.2	141.1	-177.7	0	0	0	0	0	110.3	P557	P557-A559 PolarHBondContact O-N 3.45Å
560	A	36.8	Very low	40.1	Very low	91 Å²	91	117.8 Å²	117.8	75%	0.752	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-52.2	136.3	178.1	0	0	0	0	0	109.9	S558	S558-A560 PolarHBondContact O-N 2.99Å
561	P	40.9	Very low	40.8	Very low	114 Å²	114	115.6 Å²	115.6	74%	0.74	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-57	142.8	-176.3	23.7	-33.9	0	0	0	110.1
562	P	46.8	Very low	41	Very low	117 Å²	117	116.3 Å²	116.3	76%	0.76	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-56.8	140.8	-179.3	24.4	-33.8	0	0	0	109.9
563	P	47.5	Very low	41	Very low	114 Å²	114	115.4 Å²	115.4	74%	0.74	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-58.8	143.2	-177.9	25.2	-34.3	0	0	0	110.2
564	P	49.1	Very low	41.2	Very low	115 Å²	115	115.7 Å²	115.7	75%	0.747	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-58.4	144.4	-179.2	24.9	-34.3	0	0	0	110.5
565	P	53	Low	41.5	Very low	115 Å²	115	118.5 Å²	118.5	75%	0.747	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-58.4	141.8	179.6	24.9	-33.9	0	0	0	110.3
566	P	52.4	Low	41.4	Very low	114 Å²	114	115.3 Å²	115.3	74%	0.74	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-61.1	141.9	-179.9	26.1	-34.1	0	0	0	110.3
567	P	49.2	Very low	41.2	Very low	115 Å²	115	115.1 Å²	115.1	75%	0.747	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-60.7	144.7	179.8	25.9	-34.4	0	0	0	110.7
568	P	51.6	Low	41.2	Very low	117 Å²	117	117.9 Å²	117.9	76%	0.76	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-60.3	144.6	-179.2	25.3	-34.2	0	0	0	111
569	P	45.9	Very low	41	Very low	114 Å²	114	118 Å²	118	74%	0.74	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-62.9	142	-178.6	26.3	-34.3	0	0	0	110.9
570	P	39.5	Very low	40.7	Very low	117 Å²	117	120 Å²	120	76%	0.76	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-62.5	144.8	179.8	26.2	-34.4	0	0	0	111.2
571	P	44.9	Very low	40.3	Very low	116 Å²	116	119.4 Å²	119.4	75%	0.753	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-65.6	155.8	-174.2	26.1	-34.7	0	0	0	112.7	S573	P571-S573 PolarHBondContact O-N 3.11Å
572	P	39.1	Very low	39.8	Very low	127 Å²	127	120.6 Å²	120.6	83%	0.825	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-60.2	137	-173.4	-24.2	34.6	0	0	0	113.6	L574	P572-L574 PolarHBondContact O-N 2.86Å; P572-L574 VanDerWaalsContact O-N 3.17Å
573	S	30.7	Very low	39.1	Very low	118 Å²	118	120 Å²	120	83%	0.825	78%	0.783	S	S	*	*			trans	-66.5	110.7	175.2	53.8	0	0	0	0	111.3	P571	P571-S573 PolarHBondContact O-N 3.11Å
574	L	35.7	Very low	38.6	Very low	167 Å²	167	120 Å²	120	87%	0.874	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-58.8	134.4	175.2	-82.1	159.1	0	0	0	111.2	P572	P572-L574 PolarHBondContact O-N 2.86Å; P572-L574 VanDerWaalsContact O-N 3.17Å
575	P	36.2	Very low	37.9	Very low	120 Å²	120	120 Å²	120	78%	0.779	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-70.2	147.2	-175.3	28.5	-34.7	0	0	0	112.2	S577	P575-S577 PolarHBondContact O-N 3.5Å
576	G	30.3	Very low	37.2	Very low	79 Å²	79	120.1 Å²	120.1	81%	0.814	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-65.2	116.9	-167.8	0	0	0	0	0	114.8
577	S	30.2	Very low	36.4	Very low	122 Å²	122	120.1 Å²	120.1	85%	0.853	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-71.3	138.8	163.9	-171.8	0	0	0	0	110.7	P575 S579	P575-S577 PolarHBondContact O-N 3.5Å; S577-S579 PolarHBondContact O-N 2.95Å
578	K	33.1	Very low	35.8	Very low	179 Å²	179	120.2 Å²	120.2	78%	0.778	78%	0.784	S	S	*	*			trans	-82.5	113.6	-173.4	-68.7	178	179.9	175.2	0	111.9	T580	K578-T580 PolarHBondContact O-N 3.39Å; K578-T580 VanDerWaalsContact O-N 3.07Å
579	S	30.8	Very low	35.3	Very low	119 Å²	119	120.2 Å²	120.2	83%	0.832	78%	0.784	S	S	*	*			trans	34.6	64.1	138.7	65	0	0	0	0	117.7	S577	S577-S579 PolarHBondContact O-N 2.95Å
580	T	31.4	Very low	34.9	Very low	130 Å²	130	120.8 Å²	120.8	80%	0.798	79%	0.788	S	S	*	*			trans	-93.7	112.9	158	52.7	0	0	0	0	108.4	K578 V582	K578-T580 PolarHBondContact O-N 3.39Å; K578-T580 VanDerWaalsContact O-N 3.07Å; T580-V582 PolarHBondContact O-N 3.07Å
581	G	27.6	Very low	34.6	Very low	79 Å²	79	118.6 Å²	118.6	81%	0.814	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-63.4	125.3	-170.5	0	0	0	0	0	113.5
582	V	31	Very low	34.6	Very low	138 Å²	138	119.4 Å²	119.4	84%	0.836	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-75.6	126.8	166.1	-179.5	0	0	0	0	107.8	T580	T580-V582 PolarHBondContact O-N 3.07Å
583	P	32.5	Very low	34.3	Very low	104 Å²	104	116 Å²	116	68%	0.675	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-65.7	150.8	177.7	27.6	-34.4	0	0	0	111.2
584	P	36.6	Very low	34.4	Very low	115 Å²	115	116 Å²	116	75%	0.747	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-64.2	151	-176.6	27.3	-35.3	0	0	0	112.1
585	P	35.1	Very low	34.1	Very low	116 Å²	116	116.4 Å²	116.4	75%	0.753	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-63.6	145	177.1	27.9	-35	0	0	0	111
586	P	37.4	Very low	34.1	Very low	117 Å²	117	114.7 Å²	114.7	76%	0.76	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-62.5	144.4	173.9	27.4	-34.2	0	0	0	110.5
587	P	36.7	Very low	34.6	Very low	113 Å²	113	116.5 Å²	116.5	73%	0.734	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-64.7	150.6	-179	27.4	-34.9	0	0	0	111.6
588	P	35.9	Very low	34.9	Very low	117 Å²	117	116.3 Å²	116.3	76%	0.76	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-62.4	143.6	177.6	27.1	-34.7	0	0	0	111
589	P	41.5	Very low	35.3	Very low	117 Å²	117	113.2 Å²	113.2	76%	0.76	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-62.8	148	176.8	27	-34.4	0	0	0	110.8	G591	P589-G591 PolarHBondContact O-N 3.46Å
590	P	36.4	Very low	35.9	Very low	127 Å²	127	113.1 Å²	113.1	83%	0.825	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-56.9	131.5	179.4	-24.8	34.4	0	0	0	111.8
591	G	32.9	Very low	36.5	Very low	70 Å²	70	112.4 Å²	112.4	72%	0.722	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-61	129	177	0	0	0	0	0	110.8	P589 G593	P589-G591 PolarHBondContact O-N 3.46Å; G591-G593 PolarHBondContact O-N 2.98Å
592	P	44.6	Very low	37	Very low	134 Å²	134	113.9 Å²	113.9	87%	0.87	76%	0.756	S	S	*	*			trans	-67.1	106.8	-179.9	26.5	-33.3	0	0	0	109.9	S594	P592-S594 PolarHBondContact O-N 3.28Å
593	G	34.5	Very low	37.1	Very low	54 Å²	54	116.2 Å²	116.2	56%	0.557	76%	0.76	S	S	*	*			trans	-66.8	119.6	-177.8	0	0	0	0	0	112.3	G591 M595	G591-G593 PolarHBondContact O-N 2.98Å; G593-M595 PolarHBondContact O-N 3.47Å
594	S	31.7	Very low	37.3	Very low	118 Å²	118	119.1 Å²	119.1	83%	0.825	77%	0.769	S	S	*	*			trans	32.4	56.7	148.9	63.1	0	0	0	0	117.4	P592	P592-S594 PolarHBondContact O-N 3.28Å
595	M	30.8	Very low	37.1	Very low	176 Å²	176	117.2 Å²	117.2	87%	0.867	76%	0.763	S	S	*	*			trans	-85.2	107.6	159.3	-72.7	-76.5	89.6	0	0	108	G593	G593-M595 PolarHBondContact O-N 3.47Å
596	A	35	Very low	37.1	Very low	85 Å²	85	119 Å²	119	70%	0.702	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-60.1	150.8	171.7	0	0	0	0	0	110.3
597	P	40.3	Very low	36.8	Very low	117 Å²	117	118.7 Å²	118.7	76%	0.76	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-58.6	141.1	178.7	25	-34.4	0	0	0	110.8
598	P	37.6	Very low	36.7	Very low	117 Å²	117	119.9 Å²	119.9	76%	0.76	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-62.2	147.5	-179.9	26.8	-34.7	0	0	0	110.9
599	P	41.8	Very low	36.8	Very low	115 Å²	115	119 Å²	119	75%	0.747	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-63.1	150.5	-179.2	27.1	-34.9	0	0	0	111.5
600	P	43	Very low	36.2	Very low	116 Å²	116	125 Å²	125	75%	0.753	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-61.5	148.4	177.5	26.8	-34.7	0	0	0	111.2
601	P	43.9	Very low	36.2	Very low	116 Å²	116	127.5 Å²	127.5	75%	0.753	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-60.5	148.2	179.5	25.9	-34.5	0	0	0	111.4	M603	P601-M603 PolarHBondContact O-N 3.43Å
602	P	37.7	Very low	36.5	Very low	110 Å²	110	128.6 Å²	128.6	71%	0.714	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-63.9	134.5	-170.8	25.9	-34.9	0	0	0	111.7	L604	P602-L604 PolarHBondContact O-N 3.31Å
603	M	33	Very low	36.3	Very low	187 Å²	187	128.6 Å²	128.6	92%	0.921	77%	0.765	S	S	*	*			trans	-69.9	95.9	171.1	-64.9	-156.8	77.7	0	0	109.7	P601 A605	P601-M603 PolarHBondContact O-N 3.43Å; M603-A605 PolarHBondContact O-N 2.81Å
604	L	36.4	Very low	36.6	Very low	164 Å²	164	133.5 Å²	133.5	86%	0.859	78%	0.777	S	S	*	*			trans	-70.7	77.7	167.7	-70.5	177	0	0	0	110	P602	P602-L604 PolarHBondContact O-N 3.31Å
605	A	33.2	Very low	36.7	Very low	76 Å²	76	131.6 Å²	131.6	63%	0.628	78%	0.776	S	S	*	*			trans	-59.1	161.7	155.4	0	0	0	0	0	110	M603	M603-A605 PolarHBondContact O-N 2.81Å
606	N	33.9	Very low	37.1	Very low	152 Å²	152	126.1 Å²	126.1	81%	0.813	76%	0.764	S	S	*	*			trans	67.5	73.9	175.1	-55.7	-13	0	0	0	116
607	S	33	Very low	37.3	Very low	111 Å²	111	127.6 Å²	127.6	78%	0.776	77%	0.77	S	S	*	*			trans	-143.6	104.4	134.6	-84	0	0	0	0	110.4	V609	S607-V609 PolarHBondContact O-N 3.27Å
608	T	34.4	Very low	37.3	Very low	139 Å²	139	128.1 Å²	128.1	85%	0.853	77%	0.771	S	S	*	*			trans	-78	59.7	-178.4	43.5	0	0	0	0	111.7	R610	T608-R610 PolarHBondContact O-N 3.16Å
609	V	36.6	Very low	37.4	Very low	99 Å²	99	128.9 Å²	128.9	60%	0.6	77%	0.774	S	S	*	*			trans	-70.9	96.3	175.7	-174.2	0	0	0	0	109.3	S607 F611	S607-V609 PolarHBondContact O-N 3.27Å; V609-F611 HydrophobicContact CB-CE2 4.25Å; V609-F611 HydrophobicContact CG1-CD2 3.93Å; V609-F611 HydrophobicContact CG1-CE2 3.51Å; V609-F611 HydrophobicContact CG1-CZ 3.95Å; V609-F611 PolarHBondContact O-N 3.33Å
610	R	30.4	Very low	37.5	Very low	241 Å²	241	128.7 Å²	128.7	91%	0.909	78%	0.775	S	S	*	*			trans	-63.9	93.9	170.2	-71.6	176.2	171	170.8	-4	109.9	T608	T608-R610 PolarHBondContact O-N 3.16Å
611	F	36	Very low	37.5	Very low	181 Å²	181	127 Å²	127	79%	0.794	77%	0.771	S	S	*	*			trans	-74.7	127.3	158	-75.1	-78.4	0	0	0	108.9	V609	V609-F611 HydrophobicContact CB-CE2 4.25Å; V609-F611 HydrophobicContact CG1-CD2 3.93Å; V609-F611 HydrophobicContact CG1-CE2 3.51Å; V609-F611 HydrophobicContact CG1-CZ 3.95Å; V609-F611 PolarHBondContact O-N 3.33Å
612	P	37.9	Very low	37.9	Very low	93 Å²	93	127 Å²	127	60%	0.604	77%	0.771	S	S	*	*			trans	-70.5	153.2	-179	29.7	-35	0	0	0	111	I614	P612-I614 PolarHBondContact O-N 3.18Å
613	P	40.7	Very low	38.8	Very low	134 Å²	134	127.8 Å²	127.8	87%	0.87	78%	0.776	S	S	*	*			trans	-73.2	88.2	179.6	30.9	-35	0	0	0	110.6	G615	P613-G615 PolarHBondContact O-N 2.97Å; P613-G615 VanDerWaalsContact O-N 3.16Å
614	I	41.8	Very low	40.4	Very low	156 Å²	156	124.2 Å²	124.2	80%	0.8	77%	0.769	S	S	*	*			trans	-68.9	110.8	170.1	-64.5	179.1	0	0	0	107.9	P612 G616	P612-I614 PolarHBondContact O-N 3.18Å; I614-G616 PolarHBondContact O-N 2.83Å
615	G	33.7	Very low	42.5	Very low	79 Å²	79	119 Å²	119	81%	0.814	74%	0.742	S	S	*	*			trans	-65.1	103.6	-178.1	0	0	0	0	0	112.1	P613	P613-G615 PolarHBondContact O-N 2.97Å; P613-G615 VanDerWaalsContact O-N 3.16Å
616	G	38.5	Very low	44.8	Very low	60 Å²	60	117 Å²	117	62%	0.619	72%	0.723	S	S	*	*			trans	-120.1	66.6	173.1	0	0	0	0	0	110.7	I614 T618	I614-G616 PolarHBondContact O-N 2.83Å; G616-T618 PolarHBondContact O-N 2.97Å
617	S	39.7	Very low	47	Very low	117 Å²	117	115.8 Å²	115.8	82%	0.818	73%	0.726	S	S	*	*			trans	-74.8	56.5	-176.2	60.3	0	0	0	0	113
618	T	40.3	Very low	49.3	Very low	128 Å²	128	114 Å²	114	79%	0.785	70%	0.704	S	S	*	*			trans	-98.8	74.8	164.4	47	0	0	0	0	108.4	G616 S620	G616-T618 PolarHBondContact O-N 2.97Å; T618-S620 PolarHBondContact O-N 3.31Å
619	T	40.8	Very low	51.7	Low	133 Å²	133	108.2 Å²	108.2	82%	0.816	67%	0.668	S	S	*	*			trans	-65.9	85.2	163	49.5	0	0	0	0	107.8	A621	T619-A621 PolarHBondContact O-N 3.15Å
620	S	43.4	Very low	53.9	Low	110 Å²	110	112.5 Å²	112.5	77%	0.769	68%	0.679	S	S	*	*			trans	-56.3	112.5	164.9	41.7	0	0	0	0	107.1	T618	T618-S620 PolarHBondContact O-N 3.31Å
621	A	43.3	Very low	56.3	Low	82 Å²	82	107.3 Å²	107.3	68%	0.678	67%	0.665	S	S	*	*	P	Polyproline II helix	trans	-55.1	137.1	176.5	0	0	0	0	0	108.2	T619	T619-A621 PolarHBondContact O-N 3.15Å
622	P	50.9	Low	58.6	Low	114 Å²	114	100.5 Å²	100.5	74%	0.74	64%	0.635	S	S	*	*	P	Polyproline II helix	trans	-54.8	135.3	178	24	-33.5	0	0	0	108.5	S624	P622-S624 PolarHBondContact O-N 3.39Å; P622-S624 VanDerWaalsContact O-N 3.08Å
623	P	56.3	Low	60.5	Low	127 Å²	127	103.1 Å²	103.1	83%	0.825	64%	0.639	S	S	*	*	P	Polyproline II helix	trans	-55.2	121	-170.2	21.2	-33.1	0	0	0	109.8	L625	P623-L625 PolarHBondContact O-N 2.89Å
624	S	68.4	Low	62.2	Low	112 Å²	112	101.1 Å²	101.1	78%	0.783	63%	0.626	S	S	*	*	P	Polyproline II helix	trans	-59.9	135.4	-176.5	39.9	0	0	0	0	110.1	P622	P622-S624 PolarHBondContact O-N 3.39Å; P622-S624 VanDerWaalsContact O-N 3.08Å
625	L	78.5	Confident	64.1	Low	56 Å²	56	95.7 Å²	95.7	29%	0.293	60%	0.596	S	S	.	*	P	Polyproline II helix	trans	-58.1	130.4	176.3	-170.9	69.6	0	0	0	108.8	P623 S627 L629 Q631 P651 Y849	P623-L625 PolarHBondContact O-N 2.89Å; L625-S627 PolarHBondContact O-N 3.29Å; L625-L629 HydrophobicContact CD1-CB 4.09Å; L625-L629 HydrophobicContact CD1-CD1 4.21Å; L625-L629 HydrophobicContact CD2-CB 4.13Å; L625-L629 VanDerWaalsContact CD2-O 3.31Å; L625-L629 WeakPolarHBondContact CD2-O 3.33Å; L625-L629 HydrophobicContact CG-CB 3.95Å; L625-Q631 HydrophobicContact CD2-CB 4.2Å; L625-P651 HydrophobicContact CD1-CB 3.76Å; L625-P651 HydrophobicContact CD1-CG 3.89Å; L625-Y849 HydrophobicContact CD1-CE2 4.21Å
626	P	81.8	Confident	66.3	Low	33 Å²	33	101.4 Å²	101.4	21%	0.214	60%	0.598	C	S	.	*	P	Polyproline II helix	trans	-53.6	140	176.5	-27.6	34.7	0	0	0	111.6	F628 L629 P651	P626-F628 HydrophobicContact CB-CD1 4.09Å; P626-F628 HydrophobicContact CB-CD2 4.35Å; P626-F628 HydrophobicContact CB-CE1 3.62Å; P626-F628 HydrophobicContact CB-CE2 3.92Å; P626-F628 HydrophobicContact CB-CG 4.44Å; P626-F628 HydrophobicContact CB-CZ 3.53Å; P626-F628 HydrophobicContact CG-CZ 4.21Å; P626-F628 PolarHBondContact O-N 2.93Å; P626-L629 HydrophobicContact CG-CD1 4.36Å; P626-L629 PolarHBondContact O-N 2.93Å; P626-P651 HydrophobicContact CG-CB 4.49Å
627	S	80.6	Confident	68.3	Low	127 Å²	127	99.8 Å²	99.8	89%	0.888	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59	-21.4	-171.3	49.1	0	0	0	0	114.9	L625	L625-S627 PolarHBondContact O-N 3.29Å
628	F	81.9	Confident	70.2	Confident	73 Å²	73	102.7 Å²	102.7	32%	0.32	58%	0.577	S	S	.	*	T	Hydrogen-bonded Turn	trans	-83.5	-6.3	176.1	53.9	-102.2	0	0	0	114.3	P626 L654 E656 T661	P626-F628 HydrophobicContact CB-CD1 4.09Å; P626-F628 HydrophobicContact CB-CD2 4.35Å; P626-F628 HydrophobicContact CB-CE1 3.62Å; P626-F628 HydrophobicContact CB-CE2 3.92Å; P626-F628 HydrophobicContact CB-CG 4.44Å; P626-F628 HydrophobicContact CB-CZ 3.53Å; P626-F628 HydrophobicContact CG-CZ 4.21Å; P626-F628 PolarHBondContact O-N 2.93Å; F628-L654 HydrophobicContact CE2-CB 4.48Å; F628-E656 HydrophobicContact CB-CG 4.28Å; F628-E656 HydrophobicContact CD1-CB 4.39Å; F628-E656 HydrophobicContact CG-CB 4.46Å; F628-E656 HydrophobicContact CG-CG 4.47Å; F628-T661 HydrophobicContact CB-CG2 4.43Å; F628-T661 HydrophobicContact CD2-CG2 3.49Å; F628-T661 VanDerWaalsContact CD2-CG2 3.49Å; F628-T661 HydrophobicContact CE2-CG2 4.13Å; F628-T661 HydrophobicContact CG-CG2 4.31Å
629	L	84	Confident	71.9	Confident	17 Å²	17	99.9 Å²	99.9	9%	0.089	56%	0.56	C	S	.	*	S	Bend	trans	-107.5	135.5	178	-62.5	175.6	0	0	0	111.6	L625 P626 P651 L654 T661 Y849	L625-L629 HydrophobicContact CD1-CB 4.09Å; L625-L629 HydrophobicContact CD1-CD1 4.21Å; L625-L629 HydrophobicContact CD2-CB 4.13Å; L625-L629 VanDerWaalsContact CD2-O 3.31Å; L625-L629 WeakPolarHBondContact CD2-O 3.33Å; L625-L629 HydrophobicContact CG-CB 3.95Å; P626-L629 HydrophobicContact CG-CD1 4.36Å; P626-L629 PolarHBondContact O-N 2.93Å; L629-P651 HydrophobicContact CD1-CB 3.79Å; L629-L654 HydrophobicContact CD1-CD1 3.99Å; L629-L654 HydrophobicContact CD2-CD1 4.25Å; L629-T661 HydrophobicContact CD2-CG2 4.05Å; L629-Y849 HydrophobicContact CB-CE1 4.22Å; L629-Y849 HydrophobicContact CD1-CD1 4.35Å; L629-Y849 HydrophobicContact CD2-CD1 4.2Å
630	K	83	Confident	73.8	Confident	189 Å²	189	98.7 Å²	98.7	82%	0.822	55%	0.553	S	S	*	*			trans	-92.1	133.2	176.3	-62.8	172.9	-175.4	168.9	0	110.2	K632 Y849	K630-K632 PolarHBondContact O-N 3.41Å; K630-K632 VanDerWaalsContact O-N 3.09Å; K630-Y849 WeakPolarHBondContact O-CE1 3.47Å; K630-Y849 PolarHBondContact O-OH 3.43Å
631	Q	80.7	Confident	75.8	Confident	132 Å²	132	93.7 Å²	93.7	62%	0.617	52%	0.517	S	S	*	.			trans	-61.7	112.3	179.3	178.2	54	51.6	0	0	111.8	L625 Y849	L625-Q631 HydrophobicContact CD2-CB 4.2Å; Q631-Y849 WeakPolarHBondContact CA-OH 3.49Å
632	K	83.7	Confident	77.9	Confident	39 Å²	39	90.5 Å²	90.5	17%	0.17	49%	0.488	C	S	.	.	P	Polyproline II helix	trans	-66	145.6	176.6	-67.3	-172.1	173.9	-168.5	0	112.4	K630 E665 N837 L847 A848 Y849	K630-K632 PolarHBondContact O-N 3.41Å; K630-K632 VanDerWaalsContact O-N 3.09Å; K632-E665 WeakPolarHBondContact CE-OE1 3.35Å; K632-E665 IonicContact NZ-OE1 2.71Å; K632-E665 PolarHBondContact NZ-OE1 3.37Å; K632-E665 IonicContact NZ-OE2 3.32Å; K632-E665 PolarHBondContact NZ-OE2 3.24Å; K632-N837 PolarHBondContact NZ-ND2 3Å; K632-L847 HydrophobicContact CB-CB 4.16Å; K632-L847 HydrophobicContact CB-CD1 3.62Å; K632-L847 HydrophobicContact CD-CB 4.33Å; K632-A848 PolarHBondContact NZ-O 3Å; K632-Y849 HydrophobicContact CD-CD1 4.34Å; K632-Y849 HydrophobicContact CD-CE1 4.18Å; K632-Y849 HydrophobicContact CG-CD1 4.49Å; K632-Y849 HydrophobicContact CG-CE1 3.86Å; K632-Y849 PolarHBondContact N-OH 3.36Å
633	Q	78.1	Confident	79.6	Confident	148 Å²	148	89.7 Å²	89.7	69%	0.692	47%	0.473	S	S	*	.	P	Polyproline II helix	trans	-96.8	139.3	178.2	-64.5	-65.7	-10.2	0	0	111.5	L847	Q633-L847 VanDerWaalsContact C-CD1 3.47Å; Q633-L847 VanDerWaalsContact O-CD1 3.31Å; Q633-L847 WeakPolarHBondContact O-CD1 3.47Å
634	P	76.4	Confident	81.2	Confident	92 Å²	92	83.7 Å²	83.7	60%	0.597	43%	0.434	S	S	*	.	P	Polyproline II helix	trans	-77.8	140	-179.2	31.4	-34.5	0	0	0	112.6	L847	P634-L847 HydrophobicContact CB-CD1 4.5Å
635	Y	82.8	Confident	82.1	Confident	42 Å²	42	85 Å²	85	17%	0.165	43%	0.432	C	S	.	.	P	Polyproline II helix	trans	-82.5	162.2	173	-54.5	-78.9	0	0	0	111.6	K669 F674 L834 N837 Y838 S841	Y635-K669 WeakPolarHBondContact OH-CE 3.37Å; Y635-K669 PolarHBondContact OH-NZ 3.34Å; Y635-F674 HydrophobicContact CD1-CZ 4.42Å; Y635-F674 HydrophobicContact CE1-CZ 4.14Å; Y635-L834 WeakPolarHBondContact OH-CD1 3.21Å; Y635-N837 HydrophobicContact CE2-CB 4.17Å; Y635-Y838 AromaticContact CD1-CD2 3.91Å; Y635-Y838 HydrophobicContact CD1-CD2 3.91Å; Y635-Y838 HydrophobicContact CD2-CD2 4.29Å; Y635-Y838 AromaticContact CG-CD2 3.67Å; Y635-Y838 HydrophobicContact CG-CD2 3.67Å; Y635-Y838 HydrophobicContact CG-CE2 4.47Å; Y635-S841 PolarHBondContact O-OG 3.42Å
636	K	80.1	Confident	82.7	Confident	199 Å²	199	83.7 Å²	83.7	87%	0.865	42%	0.423	S	S	*	.			trans	-131.8	87.2	173.9	-65	-179.1	-176.7	176.8	0	109.9
637	P	79.5	Confident	83.2	Confident	26 Å²	26	90.6 Å²	90.6	17%	0.169	45%	0.445	C	S	.	.			trans	-64.6	150.4	169.2	-18.4	32	0	0	0	111.1	T639 L641 E678 Y838 S841	P637-T639 VanDerWaalsContact C-N 3.32Å; P637-L641 HydrophobicContact CB-CD1 4.34Å; P637-E678 WeakPolarHBondContact CA-OE1 3.38Å; P637-E678 WeakPolarHBondContact CB-OE1 3.44Å; P637-Y838 HydrophobicContact CB-CE1 4.2Å; P637-Y838 HydrophobicContact CG-CD1 4.43Å; P637-Y838 HydrophobicContact CG-CE1 3.98Å; P637-Y838 HydrophobicContact CG-CE2 4.19Å; P637-S841 WeakPolarHBondContact CD-OG 3.36Å; P637-S841 WeakPolarHBondContact CG-OG 3.42Å
638	E	79.5	Confident	83.7	Confident	177 Å²	177	87.3 Å²	87.3	83%	0.827	42%	0.417	S	S	*	.	S	Bend	trans	-73.2	-25	174.3	-60	-170.4	175.6	0	0	112	E678	E638-E678 PolarHBondContact N-OE1 3.29Å
639	T	76.2	Confident	84.1	Confident	69 Å²	69	83.9 Å²	83.9	42%	0.423	40%	0.402	S	S	.	.	S	Bend	trans	-130.4	164.6	-173.3	63.3	0	0	0	0	114.1	P637 L641	P637-T639 VanDerWaalsContact C-N 3.32Å; T639-L641 PolarHBondContact O-N 2.95Å; T639-L641 WeakPolarHBondContact OG1-CD2 3.22Å
640	T	81.7	Confident	84.3	Confident	108 Å²	108	88.6 Å²	88.6	66%	0.663	42%	0.422	S	S	*	.			trans	-88.1	101.3	-178.6	42.3	0	0	0	0	112.2	S682	T640-S682 PolarHBondContact O-OG 2.71Å
641	L	85	Confident	84.4	Confident	5 Å²	5	81.4 Å²	81.4	3%	0.026	39%	0.394	C	S	.	.	P	Polyproline II helix	trans	-86	159.7	-172	-51	-174.8	0	0	0	114.5	P637 T639 K643 E678 F681 Y838 M839	P637-L641 HydrophobicContact CB-CD1 4.34Å; T639-L641 PolarHBondContact O-N 2.95Å; T639-L641 WeakPolarHBondContact OG1-CD2 3.22Å; L641-K643 PolarHBondContact O-N 3.46Å; L641-E678 HydrophobicContact CD1-CG 4.2Å; L641-E678 HydrophobicContact CD2-CB 4.43Å; L641-E678 HydrophobicContact CD2-CG 4.27Å; L641-F681 CarbonylContact C-O 3.55Å; L641-F681 VanDerWaalsContact CA-O 3.23Å; L641-F681 WeakPolarHBondContact CA-O 3.38Å; L641-Y838 HydrophobicContact CD1-CD1 4.15Å; L641-Y838 HydrophobicContact CD1-CE1 3.85Å; L641-M839 HydrophobicContact CB-CB 4.39Å; L641-M839 HydrophobicContact CD1-CB 4.46Å; L641-M839 HydrophobicContact CD1-CG 4.09Å
642	R	86.3	Confident	84.6	Confident	16 Å²	16	79.8 Å²	79.8	6%	0.06	40%	0.398	C	S	.	.	P	Polyproline II helix	trans	-58.2	128.2	167.9	-73	-168.7	-175.5	-128.3	2.3	109.6	F681 S682 T683 A684 M839 I862 R863	R642-F681 HydrophobicContact CB-CB 4.27Å; R642-F681 HydrophobicContact CG-CB 4.37Å; R642-F681 PolarHBondContact N-O 3.37Å; R642-S682 VanDerWaalsContact NE-C 3.35Å; R642-S682 PolarHBondContact NE-O 3.02Å; R642-S682 PolarHBondContact NH2-O 2.74Å; R642-T683 WeakPolarHBondContact CA-OG1 3.44Å; R642-T683 HydrophobicContact CG-CG2 4.15Å; R642-T683 WeakPolarHBondContact CG-OG1 3.29Å; R642-A684 PolarHBondContact NH1-O 2.83Å; R642-M839 HydrophobicContact CB-CE 4.46Å; R642-I862 HydrophobicContact CB-CG2 3.81Å; R642-I862 HydrophobicContact CG-CG2 4.43Å; R642-R863 WeakPolarHBondContact CD-O 3.47Å; R642-R863 VanDerWaalsContact CZ-O 3.3Å; R642-R863 PolarHBondContact NE-O 3.19Å
643	K	86.8	Confident	84.8	Confident	96 Å²	96	82.2 Å²	82.2	42%	0.417	41%	0.409	S	S	.	.	P	Polyproline II helix	trans	-77.4	133.1	-179.7	-57.1	-166.2	-174.3	-169.1	0	110.9	L641 N645 N840 T843	L641-K643 PolarHBondContact O-N 3.46Å; K643-N645 PolarHBondContact O-N 2.96Å; K643-N840 WeakPolarHBondContact CA-OD1 3.4Å; K643-N840 WeakPolarHBondContact CB-OD1 3.08Å; K643-T843 WeakPolarHBondContact CE-OG1 3.35Å; K643-T843 PolarHBondContact NZ-OG1 2.88Å
644	V	89.2	Confident	85.3	Confident	2 Å²	2	75.9 Å²	75.9	1%	0.012	38%	0.38	C	S	.	.			trans	-82.2	97	170.7	-179.3	0	0	0	0	106.9	W646 M839 N840 I855 I862 L871	V644-W646 HydrophobicContact CG1-CB 4.35Å; V644-W646 HydrophobicContact CG1-CD2 4.02Å; V644-W646 HydrophobicContact CG1-CE3 3.82Å; V644-W646 HydrophobicContact CG1-CG 4.26Å; V644-W646 HydrophobicContact CG1-CZ3 4.48Å; V644-W646 PolarHBondContact O-N 3.22Å; V644-M839 HydrophobicContact CG2-CB 4.35Å; V644-M839 HydrophobicContact CG2-SD 3.87Å; V644-N840 PolarHBondContact N-OD1 3.42Å; V644-N840 PolarHBondContact O-ND2 3.07Å; V644-I855 HydrophobicContact CG1-CD1 4.09Å; V644-I855 HydrophobicContact CG1-CG1 3.85Å; V644-I862 HydrophobicContact CB-CD1 4.39Å; V644-I862 HydrophobicContact CG1-CD1 4.5Å; V644-I862 HydrophobicContact CG2-CD1 3.98Å; V644-L871 HydrophobicContact CG2-CD2 3.86Å
645	N	88.5	Confident	85.9	Confident	140 Å²	140	74.1 Å²	74.1	75%	0.749	37%	0.37	S	S	*	.			trans	-75.7	53	-174.7	-70	-31.3	0	0	0	112.8	K643	K643-N645 PolarHBondContact O-N 2.96Å
646	W	91.3	Very high	86.1	Confident	28 Å²	28	77.9 Å²	77.9	11%	0.106	39%	0.389	C	S	.	.	P	Polyproline II helix	trans	-78.3	169.3	177.4	58.4	19.2	0	0	0	113.1	V644 L832 L833 G836 N840 A848 Y851 I855	V644-W646 HydrophobicContact CG1-CB 4.35Å; V644-W646 HydrophobicContact CG1-CD2 4.02Å; V644-W646 HydrophobicContact CG1-CE3 3.82Å; V644-W646 HydrophobicContact CG1-CG 4.26Å; V644-W646 HydrophobicContact CG1-CZ3 4.48Å; V644-W646 PolarHBondContact O-N 3.22Å; W646-L832 WeakPolarHBondContact CZ3-O 3.37Å; W646-L833 HydrophobicContact CH2-CD1 3.99Å; W646-L833 HydrophobicContact CZ3-CD1 4.31Å; W646-G836 VanDerWaalsContact CH2-C 3.41Å; W646-G836 VanDerWaalsContact CH2-CA 3.46Å; W646-N840 PolarHBondContact NE1-ND2 2.75Å; W646-A848 HydrophobicContact CH2-CB 4.16Å; W646-A848 HydrophobicContact CZ2-CB 3.52Å; W646-Y851 HydrophobicContact CD2-CD1 4.17Å; W646-Y851 HydrophobicContact CD2-CG 4.25Å; W646-Y851 AromaticContact CE3-CD1 3.33Å; W646-Y851 HydrophobicContact CE3-CD1 3.33Å; W646-Y851 HydrophobicContact CE3-CD2 4.46Å; W646-Y851 AromaticContact CE3-CE1 3.97Å; W646-Y851 HydrophobicContact CE3-CE1 3.97Å; W646-Y851 AromaticContact CE3-CG 3.65Å; W646-Y851 HydrophobicContact CE3-CG 3.65Å; W646-Y851 HydrophobicContact CH2-CD1 4.13Å; W646-Y851 AromaticContact CZ3-CD1 3.31Å; W646-Y851 HydrophobicContact CZ3-CD1 3.31Å; W646-Y851 AromaticContact CZ3-CE1 3.66Å; W646-Y851 HydrophobicContact CZ3-CE1 3.66Å; W646-Y851 HydrophobicContact CZ3-CG 4.13Å; W646-I855 HydrophobicContact CB-CB 4.08Å; W646-I855 HydrophobicContact CB-CD1 4.45Å; W646-I855 HydrophobicContact CB-CG1 4.05Å; W646-I855 HydrophobicContact CB-CG2 4.25Å
647	R	91.4	Very high	86.4	Confident	177 Å²	177	74.1 Å²	74.1	67%	0.668	38%	0.375	S	S	*	.	P	Polyproline II helix	trans	-101.9	119.9	165.4	-68.6	177.6	174.2	172.8	-2.6	108.7	Y851 H852	R647-Y851 CarbonylContact O-C 3.5Å; R647-Y851 WeakPolarHBondContact O-CA 3.12Å; R647-Y851 WeakPolarHBondContact O-CB 3.43Å; R647-H852 HydrophobicContact CB-CB 4.27Å; R647-H852 PolarHBondContact O-N 2.84Å
648	I	90.7	Very high	87.1	Confident	58 Å²	58	72.9 Å²	72.9	30%	0.297	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	133.4	-178.2	-59.3	179.1	0	0	0	110.1	S846 A848	I648-S846 WeakPolarHBondContact CD1-O 3.44Å; I648-A848 HydrophobicContact CB-CB 4.38Å; I648-A848 HydrophobicContact CD1-CB 4.02Å; I648-A848 HydrophobicContact CG1-CB 3.87Å; I648-A848 HydrophobicContact CG2-CB 3.81Å
649	I	91.2	Very high	87.8	Confident	1 Å²	1	65 Å²	65	1%	0.005	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	129	168.2	-53.2	169.5	0	0	0	108	E653 L654 W660 G850 A974 F975	I649-E653 HydrophobicContact CG2-CB 3.94Å; I649-L654 HydrophobicContact CG2-CD2 3.72Å; I649-L654 HydrophobicContact CG2-CG 4.21Å; I649-W660 HydrophobicContact CD1-CG 4.35Å; I649-W660 HydrophobicContact CD1-CZ2 4.48Å; I649-G850 PolarHBondContact N-O 3.47Å; I649-A974 HydrophobicContact CG2-CB 4.25Å; I649-F975 HydrophobicContact CD1-CD1 4.31Å; I649-F975 HydrophobicContact CD1-CE1 3.77Å; I649-F975 HydrophobicContact CG1-CE1 4.41Å
650	K	87.8	Confident	88.6	Confident	117 Å²	117	62 Å²	62	51%	0.509	31%	0.311	S	S	.	.	P	Polyproline II helix	trans	-75.5	149.5	-177.9	-56	-174.7	-159.5	100.5	0	110.8	S652 E653	K650-S652 PolarHBondContact O-N 3.36Å; K650-S652 VanDerWaalsContact O-N 3.09Å; K650-E653 HydrophobicContact CB-CG 4.14Å; K650-E653 WeakPolarHBondContact CB-OE2 3.1Å; K650-E653 WeakPolarHBondContact CG-OE2 3.27Å; K650-E653 PolarHBondContact N-OE2 2.91Å; K650-E653 IonicContact NZ-OE1 3.72Å; K650-E653 PolarHBondContact NZ-OE1 2.97Å; K650-E653 WeakPolarHBondContact O-CB 3.18Å; K650-E653 PolarHBondContact O-N 3.13Å
651	P	85.1	Confident	88.9	Confident	38 Å²	38	58.1 Å²	58.1	25%	0.247	29%	0.287	C	S	.	.	G	3₁₀ helix	trans	-52	-33.2	172.5	-29.7	36.7	0	0	0	114.4	L625 P626 L629 E653 L654 Y849	L625-P651 HydrophobicContact CD1-CB 3.76Å; L625-P651 HydrophobicContact CD1-CG 3.89Å; P626-P651 HydrophobicContact CG-CB 4.49Å; L629-P651 HydrophobicContact CD1-CB 3.79Å; P651-E653 PolarHBondContact O-N 3.37Å; P651-L654 PolarHBondContact O-N 2.85Å; P651-Y849 HydrophobicContact CG-CD2 3.76Å; P651-Y849 HydrophobicContact CG-CE2 3.95Å
652	S	85.4	Confident	89	Confident	98 Å²	98	65.3 Å²	65.3	69%	0.685	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-72.9	-9.6	176.5	59.1	0	0	0	0	115.1	K650	K650-S652 PolarHBondContact O-N 3.36Å; K650-S652 VanDerWaalsContact O-N 3.09Å
653	E	88	Confident	88.9	Confident	89 Å²	89	65.4 Å²	65.4	42%	0.416	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	-102.3	-7.4	179.1	-65	159.7	174.6	0	0	111.1	I649 K650 P651	I649-E653 HydrophobicContact CG2-CB 3.94Å; K650-E653 HydrophobicContact CB-CG 4.14Å; K650-E653 WeakPolarHBondContact CB-OE2 3.1Å; K650-E653 WeakPolarHBondContact CG-OE2 3.27Å; K650-E653 PolarHBondContact N-OE2 2.91Å; K650-E653 IonicContact NZ-OE1 3.72Å; K650-E653 PolarHBondContact NZ-OE1 2.97Å; K650-E653 WeakPolarHBondContact O-CB 3.18Å; K650-E653 PolarHBondContact O-N 3.13Å; P651-E653 PolarHBondContact O-N 3.37Å
654	L	89	Confident	88.7	Confident	15 Å²	15	65.5 Å²	65.5	8%	0.079	32%	0.318	C	S	.	.			trans	-88.3	151.6	178	-64.7	-179.1	0	0	0	112.3	F628 L629 I649 P651 W660 A974	F628-L654 HydrophobicContact CE2-CB 4.48Å; L629-L654 HydrophobicContact CD1-CD1 3.99Å; L629-L654 HydrophobicContact CD2-CD1 4.25Å; I649-L654 HydrophobicContact CG2-CD2 3.72Å; I649-L654 HydrophobicContact CG2-CG 4.21Å; P651-L654 PolarHBondContact O-N 2.85Å; L654-W660 HydrophobicContact CD1-CB 4.28Å; L654-W660 HydrophobicContact CD2-CB 3.83Å; L654-W660 HydrophobicContact CD2-CG 4.24Å; L654-A974 HydrophobicContact CD2-CB 3.6Å
655	S	88.5	Confident	88.4	Confident	56 Å²	56	66 Å²	66	39%	0.392	32%	0.321	S	S	.	.			trans	-118.4	161.4	170.1	71	0	0	0	0	111	H657 A658 T661	S655-H657 PolarHBondContact O-N 3.43Å; S655-A658 WeakPolarHBondContact O-CB 3.38Å; S655-A658 PolarHBondContact O-N 3.11Å; S655-A658 VanDerWaalsContact O-N 3.11Å; S655-A658 PolarHBondContact OG-N 3.42Å; S655-T661 WeakPolarHBondContact O-CB 3.46Å; S655-T661 PolarHBondContact O-OG1 2.86Å
656	E	87.5	Confident	88	Confident	120 Å²	120	64.5 Å²	64.5	56%	0.561	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-18.7	177.8	-162.2	-172.9	141.3	0	0	113.8	F628	F628-E656 HydrophobicContact CB-CG 4.28Å; F628-E656 HydrophobicContact CD1-CB 4.39Å; F628-E656 HydrophobicContact CG-CB 4.46Å; F628-E656 HydrophobicContact CG-CG 4.47Å
657	H	86.6	Confident	87.6	Confident	120 Å²	120	70.1 Å²	70.1	56%	0.556	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.6	1.7	-176.9	-57.1	-3.4	0	0	0	113.1	S655 R662	S655-H657 PolarHBondContact O-N 3.43Å; H657-R662 PolarHBondContact ND1-NH2 3.15Å
658	A	92.6	Very high	87.2	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	31%	0.314	C	S	.	.	S	Bend	trans	-71.5	148.1	172.5	0	0	0	0	0	111.5	S655 W660 T661 Y972 A974	S655-A658 WeakPolarHBondContact O-CB 3.38Å; S655-A658 PolarHBondContact O-N 3.11Å; S655-A658 VanDerWaalsContact O-N 3.11Å; S655-A658 PolarHBondContact OG-N 3.42Å; A658-W660 VanDerWaalsContact C-N 3.33Å; A658-W660 PolarHBondContact O-N 2.93Å; A658-T661 WeakPolarHBondContact O-CB 3.39Å; A658-T661 PolarHBondContact O-N 3.32Å; A658-T661 VanDerWaalsContact O-N 3.1Å; A658-Y972 CarbonylContact C-O 3.5Å; A658-Y972 VanDerWaalsContact CA-O 3.25Å; A658-Y972 WeakPolarHBondContact CA-O 3.47Å; A658-A974 HydrophobicContact CB-CB 4.28Å
659	F	94.8	Very high	87	Confident	12 Å²	12	64.1 Å²	64.1	5%	0.053	32%	0.316	C	S	.	.	H	α-helix	trans	-47	-53.3	175.3	173.9	-104.2	0	0	0	112.2	T661 R662 S663 L829 E830 Y972 F973	F659-T661 PolarHBondContact O-N 3.28Å; F659-T661 VanDerWaalsContact O-N 3.12Å; F659-R662 PolarHBondContact O-N 3.39Å; F659-S663 PolarHBondContact O-N 3.45Å; F659-S663 VanDerWaalsContact O-N 3.09Å; F659-L829 HydrophobicContact CD1-CD1 4.36Å; F659-L829 HydrophobicContact CE1-CB 3.76Å; F659-L829 HydrophobicContact CE1-CD1 3.76Å; F659-L829 HydrophobicContact CE1-CG 4.45Å; F659-L829 HydrophobicContact CZ-CB 3.91Å; F659-L829 HydrophobicContact CZ-CD1 4.02Å; F659-E830 HydrophobicContact CZ-CG 4.25Å; F659-Y972 HydrophobicContact CB-CD1 4.28Å; F659-Y972 HydrophobicContact CB-CE1 3.94Å; F659-Y972 HydrophobicContact CB-CE2 4.26Å; F659-Y972 HydrophobicContact CD2-CE1 4.17Å; F659-Y972 HydrophobicContact CG-CE1 4.39Å; F659-Y972 PolarHBondContact N-O 2.93Å; F659-F973 HydrophobicContact CB-CD1 3.9Å; F659-F973 HydrophobicContact CB-CE1 4.06Å; F659-F973 HydrophobicContact CD1-CD1 4.05Å; F659-F973 HydrophobicContact CD1-CE1 4.01Å; F659-F973 HydrophobicContact CD2-CE1 4.31Å; F659-F973 HydrophobicContact CG-CD1 4.04Å; F659-F973 AromaticContact CG-CE1 3.85Å; F659-F973 HydrophobicContact CG-CE1 3.85Å
660	W	94	Very high	86.7	Confident	6 Å²	6	65.4 Å²	65.4	2%	0.023	33%	0.325	C	S	.	.	H	α-helix	trans	-62.2	-17.6	-178.2	-53.2	115.4	0	0	0	115.5	I649 L654 A658 S663 L829 L833 Y849 G850 Y851 F853 F973	I649-W660 HydrophobicContact CD1-CG 4.35Å; I649-W660 HydrophobicContact CD1-CZ2 4.48Å; L654-W660 HydrophobicContact CD1-CB 4.28Å; L654-W660 HydrophobicContact CD2-CB 3.83Å; L654-W660 HydrophobicContact CD2-CG 4.24Å; A658-W660 VanDerWaalsContact C-N 3.33Å; A658-W660 PolarHBondContact O-N 2.93Å; W660-S663 WeakPolarHBondContact CA-OG 3.27Å; W660-S663 PolarHBondContact O-OG 3.04Å; W660-S663 VanDerWaalsContact O-OG 3.14Å; W660-L829 HydrophobicContact CH2-CB 4.32Å; W660-L829 HydrophobicContact CH2-CD2 4.39Å; W660-L829 HydrophobicContact CZ3-CB 4.45Å; W660-L833 HydrophobicContact CE3-CD2 3.89Å; W660-L833 HydrophobicContact CZ3-CD2 4.01Å; W660-Y849 WeakPolarHBondContact CB-O 3.35Å; W660-G850 VanDerWaalsContact CD2-CA 3.43Å; W660-G850 VanDerWaalsContact CE3-CA 3.5Å; W660-Y851 HydrophobicContact CH2-CD1 4.12Å; W660-Y851 HydrophobicContact CH2-CD2 4.22Å; W660-Y851 AromaticContact CH2-CE1 3.79Å; W660-Y851 HydrophobicContact CH2-CE1 3.79Å; W660-Y851 AromaticContact CH2-CE2 3.9Å; W660-Y851 HydrophobicContact CH2-CE2 3.9Å; W660-Y851 HydrophobicContact CH2-CG 4.29Å; W660-Y851 AromaticContact CH2-CZ 3.64Å; W660-Y851 VanDerWaalsContact CZ2-O 3.24Å; W660-Y851 WeakPolarHBondContact CZ2-O 3.43Å; W660-Y851 HydrophobicContact CZ3-CD1 4.35Å; W660-Y851 AromaticContact CZ3-CE1 3.94Å; W660-Y851 HydrophobicContact CZ3-CE1 3.94Å; W660-F853 HydrophobicContact CH2-CE1 4.36Å; W660-F853 AromaticContact CZ2-CE1 3.93Å; W660-F853 HydrophobicContact CZ2-CE1 3.93Å; W660-F973 PolarHBondContact NE1-O 3.34Å
661	T	88.3	Confident	86.6	Confident	26 Å²	26	65.2 Å²	65.2	16%	0.16	33%	0.329	C	S	.	.	H	α-helix	trans	-84.2	-19.6	175.2	-57.8	0	0	0	0	111.7	F628 L629 S655 A658 F659	F628-T661 HydrophobicContact CB-CG2 4.43Å; F628-T661 HydrophobicContact CD2-CG2 3.49Å; F628-T661 VanDerWaalsContact CD2-CG2 3.49Å; F628-T661 HydrophobicContact CE2-CG2 4.13Å; F628-T661 HydrophobicContact CG-CG2 4.31Å; L629-T661 HydrophobicContact CD2-CG2 4.05Å; S655-T661 WeakPolarHBondContact O-CB 3.46Å; S655-T661 PolarHBondContact O-OG1 2.86Å; A658-T661 WeakPolarHBondContact O-CB 3.39Å; A658-T661 PolarHBondContact O-N 3.32Å; A658-T661 VanDerWaalsContact O-N 3.1Å; F659-T661 PolarHBondContact O-N 3.28Å; F659-T661 VanDerWaalsContact O-N 3.12Å
662	R	85.9	Confident	86.7	Confident	156 Å²	156	68 Å²	68	59%	0.589	34%	0.342	S	S	*	.	H	α-helix	trans	-108.8	-9.5	-176.5	-60.9	-180	178.6	-172.7	-2.9	113.4	H657 F659	H657-R662 PolarHBondContact ND1-NH2 3.15Å; F659-R662 PolarHBondContact O-N 3.39Å
663	S	84.9	Confident	87	Confident	18 Å²	18	63.4 Å²	63.4	13%	0.126	31%	0.31	C	S	.	.			trans	-68.8	137.7	179.4	48.6	0	0	0	0	112.7	F659 W660 E830	F659-S663 PolarHBondContact O-N 3.45Å; F659-S663 VanDerWaalsContact O-N 3.09Å; W660-S663 WeakPolarHBondContact CA-OG 3.27Å; W660-S663 PolarHBondContact O-OG 3.04Å; W660-S663 VanDerWaalsContact O-OG 3.14Å; S663-E830 WeakPolarHBondContact CA-OE1 3.5Å; S663-E830 WeakPolarHBondContact CB-OE1 3.2Å
664	E	81.7	Confident	87.2	Confident	98 Å²	98	60.2 Å²	60.2	46%	0.458	30%	0.295	S	S	.	.			trans	-123.1	62.9	-174.6	-72.4	-173.9	-101.1	0	0	112.2	D666 K667 E830	E664-D666 PolarHBondContact O-N 3.4Å; E664-K667 HydrophobicContact CB-CD 3.93Å; E664-K667 HydrophobicContact CB-CG 4.26Å; E664-K667 VanDerWaalsContact CD-CE 3.49Å; E664-K667 WeakPolarHBondContact O-CB 3.38Å; E664-K667 PolarHBondContact O-N 3.21Å; E664-K667 IonicContact OE1-NZ 2.72Å; E664-K667 PolarHBondContact OE1-NZ 3.35Å; E664-K667 WeakPolarHBondContact OE2-CE 3.31Å; E664-K667 IonicContact OE2-NZ 3.23Å; E664-K667 PolarHBondContact OE2-NZ 3.33Å; E664-E830 PolarHBondContact N-OE1 3.19Å
665	E	82.7	Confident	87.2	Confident	13 Å²	13	65.1 Å²	65.1	6%	0.061	32%	0.316	C	S	.	.	G	3₁₀ helix	trans	-42.1	-34.9	174.2	-73.9	146	-92.9	0	0	114.5	K632 K667 L668 L833 L834 N837	K632-E665 WeakPolarHBondContact CE-OE1 3.35Å; K632-E665 IonicContact NZ-OE1 2.71Å; K632-E665 PolarHBondContact NZ-OE1 3.37Å; K632-E665 IonicContact NZ-OE2 3.32Å; K632-E665 PolarHBondContact NZ-OE2 3.24Å; E665-K667 PolarHBondContact O-N 2.97Å; E665-L668 PolarHBondContact O-N 3.43Å; E665-L833 VanDerWaalsContact CD-CD2 3.41Å; E665-L833 VanDerWaalsContact CD-CG 3.46Å; E665-L833 HydrophobicContact CG-CB 3.99Å; E665-L833 HydrophobicContact CG-CD2 4.04Å; E665-L833 HydrophobicContact CG-CG 4.08Å; E665-L833 WeakPolarHBondContact OE1-CD2 3.49Å; E665-L833 WeakPolarHBondContact OE2-CG 3.48Å; E665-L834 HydrophobicContact CB-CB 4.1Å; E665-L834 HydrophobicContact CB-CD1 4.47Å; E665-L834 HydrophobicContact CG-CB 4.1Å; E665-N837 PolarHBondContact OE2-ND2 3.41Å
666	D	80.6	Confident	87.2	Confident	109 Å²	109	65.7 Å²	65.7	58%	0.583	31%	0.314	S	S	*	.	G	3₁₀ helix	trans	-57.6	-29.1	-179.3	-70.6	-42.1	0	0	0	112.6	E664 L668 K669	E664-D666 PolarHBondContact O-N 3.4Å; D666-L668 PolarHBondContact O-N 3.24Å; D666-K669 WeakPolarHBondContact O-CB 3.07Å; D666-K669 PolarHBondContact O-N 2.72Å; D666-K669 WeakPolarHBondContact OD1-CE 3.3Å; D666-K669 IonicContact OD1-NZ 2.74Å; D666-K669 PolarHBondContact OD1-NZ 2.86Å
667	K	83.2	Confident	87.3	Confident	146 Å²	146	60 Å²	60	64%	0.635	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	-70.1	-17.3	175.6	-68.4	175.5	177.2	162.5	0	113.8	E664 E665	E664-K667 HydrophobicContact CB-CD 3.93Å; E664-K667 HydrophobicContact CB-CG 4.26Å; E664-K667 VanDerWaalsContact CD-CE 3.49Å; E664-K667 WeakPolarHBondContact O-CB 3.38Å; E664-K667 PolarHBondContact O-N 3.21Å; E664-K667 IonicContact OE1-NZ 2.72Å; E664-K667 PolarHBondContact OE1-NZ 3.35Å; E664-K667 WeakPolarHBondContact OE2-CE 3.31Å; E664-K667 IonicContact OE2-NZ 3.23Å; E664-K667 PolarHBondContact OE2-NZ 3.33Å; E665-K667 PolarHBondContact O-N 2.97Å
668	L	83.2	Confident	87.4	Confident	30 Å²	30	56 Å²	56	16%	0.157	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-99.1	-3.2	-178.6	-59.1	177.2	0	0	0	112.9	E665 D666 E830 L831 L834 R882	E665-L668 PolarHBondContact O-N 3.43Å; D666-L668 PolarHBondContact O-N 3.24Å; L668-E830 HydrophobicContact CD1-CB 3.65Å; L668-L831 HydrophobicContact CB-CD1 4.36Å; L668-L831 HydrophobicContact CD1-CB 4.01Å; L668-L831 HydrophobicContact CD1-CD1 4.45Å; L668-L834 HydrophobicContact CB-CD2 3.9Å; L668-R882 PolarHBondContact O-NH1 3.22Å
669	K	85.6	Confident	87.2	Confident	79 Å²	79	62.8 Å²	62.8	34%	0.343	30%	0.304	S	S	.	.			trans	-61.8	146.4	179.6	-74.5	179.7	170.6	175.8	0	113.2	Y635 D666 F674 L834	Y635-K669 WeakPolarHBondContact OH-CE 3.37Å; Y635-K669 PolarHBondContact OH-NZ 3.34Å; D666-K669 WeakPolarHBondContact O-CB 3.07Å; D666-K669 PolarHBondContact O-N 2.72Å; D666-K669 WeakPolarHBondContact OD1-CE 3.3Å; D666-K669 IonicContact OD1-NZ 2.74Å; D666-K669 PolarHBondContact OD1-NZ 2.86Å; K669-F674 HydrophobicContact CG-CZ 4.37Å; K669-L834 HydrophobicContact CG-CD1 3.85Å; K669-L834 HydrophobicContact CG-CD2 4.06Å
670	S	85.2	Confident	86.9	Confident	28 Å²	28	64.4 Å²	64.4	20%	0.196	31%	0.312	C	S	.	.			trans	-173.9	142.2	167.5	127	0	0	0	0	108.7	D672 L673 F674 R882	S670-D672 PolarHBondContact O-N 3.27Å; S670-D672 PolarHBondContact OG-N 2.68Å; S670-L673 WeakPolarHBondContact O-CB 3.34Å; S670-L673 PolarHBondContact O-N 2.9Å; S670-F674 PolarHBondContact O-N 2.79Å; S670-R882 VanDerWaalsContact CB-NH2 3.3Å; S670-R882 PolarHBondContact OG-NH2 3.17Å
671	D	85.5	Confident	86.6	Confident	112 Å²	112	64.1 Å²	64.1	60%	0.599	31%	0.31	S	S	*	.	H	α-helix	trans	-67	-26.6	-174.6	-56.8	-25.4	0	0	0	112.4	F674 K675	D671-F674 PolarHBondContact O-N 3.03Å; D671-K675 VanDerWaalsContact O-CG 3.31Å; D671-K675 WeakPolarHBondContact O-CG 3.45Å; D671-K675 PolarHBondContact O-N 2.76Å
672	D	88.1	Confident	86.3	Confident	96 Å²	96	65.3 Å²	65.3	51%	0.513	32%	0.32	S	S	.	.	H	α-helix	trans	-70	-33.8	177.5	-46.3	-52.2	0	0	0	112	S670 F674 K675 I676	S670-D672 PolarHBondContact O-N 3.27Å; S670-D672 PolarHBondContact OG-N 2.68Å; D672-F674 VanDerWaalsContact C-N 3.33Å; D672-K675 IonicContact OD1-NZ 2.82Å; D672-K675 PolarHBondContact OD1-NZ 2.73Å; D672-I676 WeakPolarHBondContact O-CB 3.5Å; D672-I676 WeakPolarHBondContact O-CD1 3.4Å; D672-I676 WeakPolarHBondContact O-CG1 3.4Å; D672-I676 PolarHBondContact O-N 3.42Å
673	L	90.9	Very high	85.1	Confident	2 Å²	2	62.4 Å²	62.4	1%	0.01	32%	0.32	C	S	.	.	H	α-helix	trans	-61.7	-44.1	171	173	61.7	0	0	0	110.6	S670 I676 L677 L831 L834 V835 V878	S670-L673 WeakPolarHBondContact O-CB 3.34Å; S670-L673 PolarHBondContact O-N 2.9Å; L673-I676 PolarHBondContact O-N 3.43Å; L673-L677 WeakPolarHBondContact O-CG 3.25Å; L673-L677 PolarHBondContact O-N 3.38Å; L673-L677 VanDerWaalsContact O-N 3.15Å; L673-L831 HydrophobicContact CD2-CD1 3.93Å; L673-L834 HydrophobicContact CD2-CD2 4.11Å; L673-V835 HydrophobicContact CD1-CG2 4.32Å; L673-V835 HydrophobicContact CD2-CG2 4.17Å; L673-V878 HydrophobicContact CD1-CG1 4.24Å; L673-V878 HydrophobicContact CD1-CG2 3.71Å
674	F	92	Very high	83.6	Confident	22 Å²	22	64 Å²	64	10%	0.096	33%	0.334	C	S	.	.	H	α-helix	trans	-65.8	-46.9	179.9	-63.2	-36.4	0	0	0	112	Y635 K669 S670 D671 D672 I676 L677 E678 L834 Y838	Y635-F674 HydrophobicContact CD1-CZ 4.42Å; Y635-F674 HydrophobicContact CE1-CZ 4.14Å; K669-F674 HydrophobicContact CG-CZ 4.37Å; S670-F674 PolarHBondContact O-N 2.79Å; D671-F674 PolarHBondContact O-N 3.03Å; D672-F674 VanDerWaalsContact C-N 3.33Å; F674-I676 VanDerWaalsContact C-N 3.3Å; F674-I676 PolarHBondContact O-N 2.98Å; F674-L677 HydrophobicContact CD1-CD1 4.45Å; F674-L677 WeakPolarHBondContact O-CB 3.43Å; F674-L677 PolarHBondContact O-N 3.29Å; F674-E678 WeakPolarHBondContact O-CG 3.14Å; F674-E678 PolarHBondContact O-N 2.91Å; F674-L834 HydrophobicContact CE1-CD1 4.4Å; F674-L834 HydrophobicContact CZ-CD1 4.26Å; F674-Y838 HydrophobicContact CB-CE1 4.1Å; F674-Y838 HydrophobicContact CB-CE2 3.9Å; F674-Y838 AromaticContact CD1-CD1 3.82Å; F674-Y838 HydrophobicContact CD1-CD1 3.82Å; F674-Y838 AromaticContact CD1-CD2 3.33Å; F674-Y838 HydrophobicContact CD1-CD2 3.33Å; F674-Y838 AromaticContact CD1-CE1 3.97Å; F674-Y838 HydrophobicContact CD1-CE1 3.97Å; F674-Y838 AromaticContact CD1-CE2 3.51Å; F674-Y838 HydrophobicContact CD1-CE2 3.51Å; F674-Y838 AromaticContact CD1-CG 3.51Å; F674-Y838 HydrophobicContact CD1-CG 3.51Å; F674-Y838 AromaticContact CD1-CZ 3.84Å; F674-Y838 HydrophobicContact CD2-CD2 4.38Å; F674-Y838 HydrophobicContact CD2-CE2 4.05Å; F674-Y838 HydrophobicContact CE1-CD1 4.39Å; F674-Y838 AromaticContact CE1-CD2 3.4Å; F674-Y838 HydrophobicContact CE1-CD2 3.4Å; F674-Y838 VanDerWaalsContact CE1-CD2 3.4Å; F674-Y838 AromaticContact CE1-CE2 4Å; F674-Y838 HydrophobicContact CE1-CE2 4Å; F674-Y838 AromaticContact CE1-CG 3.65Å; F674-Y838 HydrophobicContact CE1-CG 3.65Å; F674-Y838 HydrophobicContact CE2-CD2 4.43Å; F674-Y838 HydrophobicContact CE2-CE2 4.47Å; F674-Y838 AromaticContact CG-CD2 3.87Å; F674-Y838 HydrophobicContact CG-CD2 3.87Å; F674-Y838 HydrophobicContact CG-CE1 4.31Å; F674-Y838 AromaticContact CG-CE2 3.55Å; F674-Y838 HydrophobicContact CG-CE2 3.55Å; F674-Y838 HydrophobicContact CG-CG 4.39Å; F674-Y838 AromaticContact CG-CZ 3.8Å; F674-Y838 AromaticContact CZ-CD2 3.98Å; F674-Y838 HydrophobicContact CZ-CD2 3.98Å; F674-Y838 HydrophobicContact CZ-CE2 4.44Å
675	K	89.1	Confident	81.7	Confident	119 Å²	119	67.1 Å²	67.1	52%	0.517	35%	0.354	S	S	.	.	H	α-helix	trans	-57.8	-38.8	174.6	-66.8	164.3	-163.4	160.8	0	112.9	D671 D672 E678 L679	D671-K675 VanDerWaalsContact O-CG 3.31Å; D671-K675 WeakPolarHBondContact O-CG 3.45Å; D671-K675 PolarHBondContact O-N 2.76Å; D672-K675 IonicContact OD1-NZ 2.82Å; D672-K675 PolarHBondContact OD1-NZ 2.73Å; K675-E678 PolarHBondContact O-N 2.95Å; K675-L679 WeakPolarHBondContact O-CB 3.4Å; K675-L679 PolarHBondContact O-N 3.07Å
676	I	89.9	Confident	79.4	Confident	68 Å²	68	70.5 Å²	70.5	35%	0.349	38%	0.384	S	S	.	.	H	α-helix	trans	-62.9	-43.8	175.5	-71.7	163.9	0	0	0	110.7	D672 L673 F674 E678 Q680 V874	D672-I676 WeakPolarHBondContact O-CB 3.5Å; D672-I676 WeakPolarHBondContact O-CD1 3.4Å; D672-I676 WeakPolarHBondContact O-CG1 3.4Å; D672-I676 PolarHBondContact O-N 3.42Å; L673-I676 PolarHBondContact O-N 3.43Å; F674-I676 VanDerWaalsContact C-N 3.3Å; F674-I676 PolarHBondContact O-N 2.98Å; I676-E678 VanDerWaalsContact C-N 3.35Å; I676-E678 PolarHBondContact O-N 3.03Å; I676-Q680 VanDerWaalsContact O-CB 3.23Å; I676-Q680 WeakPolarHBondContact O-CB 3.2Å; I676-Q680 WeakPolarHBondContact O-CG 3.19Å; I676-Q680 PolarHBondContact O-N 3.47Å; I676-Q680 VanDerWaalsContact O-N 3.07Å; I676-V874 HydrophobicContact CG2-CG1 3.77Å
677	L	89.5	Confident	77.4	Confident	1 Å²	1	72.5 Å²	72.5	1%	0.005	40%	0.4	C	S	.	.	H	α-helix	trans	-63.5	-41.1	177.6	-65.3	170	0	0	0	112.2	L673 F674 Q680 F681 V835 Y838 M839 L871	L673-L677 WeakPolarHBondContact O-CG 3.25Å; L673-L677 PolarHBondContact O-N 3.38Å; L673-L677 VanDerWaalsContact O-N 3.15Å; F674-L677 HydrophobicContact CD1-CD1 4.45Å; F674-L677 WeakPolarHBondContact O-CB 3.43Å; F674-L677 PolarHBondContact O-N 3.29Å; L677-Q680 PolarHBondContact O-N 3.43Å; L677-F681 HydrophobicContact CD2-CD2 4.11Å; L677-F681 HydrophobicContact CD2-CE2 4.19Å; L677-F681 PolarHBondContact O-N 3.13Å; L677-V835 HydrophobicContact CD1-CB 4.38Å; L677-V835 HydrophobicContact CD1-CG1 3.88Å; L677-V835 HydrophobicContact CD1-CG2 4.17Å; L677-V835 HydrophobicContact CD2-CG1 3.73Å; L677-V835 HydrophobicContact CG-CG1 4.47Å; L677-Y838 HydrophobicContact CD1-CD1 3.8Å; L677-Y838 HydrophobicContact CD1-CE1 4.36Å; L677-M839 HydrophobicContact CD1-CG 4.34Å; L677-M839 HydrophobicContact CD2-SD 4.11Å; L677-L871 HydrophobicContact CD2-CD1 3.75Å
678	E	88.7	Confident	74.6	Confident	34 Å²	34	71.3 Å²	71.3	16%	0.159	41%	0.41	C	S	.	.	H	α-helix	trans	-68.1	-44.8	-179.3	-69.5	179.2	129.8	0	0	113	P637 E638 L641 F674 K675 I676 Q680 Y838	P637-E678 WeakPolarHBondContact CA-OE1 3.38Å; P637-E678 WeakPolarHBondContact CB-OE1 3.44Å; E638-E678 PolarHBondContact N-OE1 3.29Å; L641-E678 HydrophobicContact CD1-CG 4.2Å; L641-E678 HydrophobicContact CD2-CB 4.43Å; L641-E678 HydrophobicContact CD2-CG 4.27Å; F674-E678 WeakPolarHBondContact O-CG 3.14Å; F674-E678 PolarHBondContact O-N 2.91Å; K675-E678 PolarHBondContact O-N 2.95Å; I676-E678 VanDerWaalsContact C-N 3.35Å; I676-E678 PolarHBondContact O-N 3.03Å; E678-Q680 VanDerWaalsContact C-N 3.25Å; E678-Q680 PolarHBondContact O-N 2.93Å; E678-Y838 HydrophobicContact CG-CE1 4.2Å; E678-Y838 PolarHBondContact OE1-OH 2.84Å
679	L	87.2	Confident	71.9	Confident	143 Å²	143	73.3 Å²	73.3	75%	0.749	44%	0.438	S	S	*	.	H	α-helix	trans	-63.1	-34.2	174.1	-178.5	61.5	0	0	0	111.8	K675	K675-L679 WeakPolarHBondContact O-CB 3.4Å; K675-L679 PolarHBondContact O-N 3.07Å
680	Q	88	Confident	69	Low	46 Å²	46	76.1 Å²	76.1	22%	0.215	46%	0.461	C	S	.	.	H	α-helix	trans	-98.6	-28.1	-166.8	-68	-171.7	-18.7	0	0	116.4	I676 L677 E678 S864 V865	I676-Q680 VanDerWaalsContact O-CB 3.23Å; I676-Q680 WeakPolarHBondContact O-CB 3.2Å; I676-Q680 WeakPolarHBondContact O-CG 3.19Å; I676-Q680 PolarHBondContact O-N 3.47Å; I676-Q680 VanDerWaalsContact O-N 3.07Å; L677-Q680 PolarHBondContact O-N 3.43Å; E678-Q680 VanDerWaalsContact C-N 3.25Å; E678-Q680 PolarHBondContact O-N 2.93Å; Q680-S864 CarbonylContact O-C 3.54Å; Q680-S864 WeakPolarHBondContact O-CA 3.28Å; Q680-S864 VanDerWaalsContact O-CB 3.24Å; Q680-S864 WeakPolarHBondContact O-CB 3.43Å; Q680-V865 PolarHBondContact O-N 3.18Å
681	F	88.5	Confident	66.2	Low	0 Å²	0	79.9 Å²	79.9	0%	0	49%	0.488	C	S	.	.			trans	-124.4	91.6	-165.1	-65.4	-77	0	0	0	116.9	L641 R642 L677 M839 I862 R863 L871 V874	L641-F681 CarbonylContact C-O 3.55Å; L641-F681 VanDerWaalsContact CA-O 3.23Å; L641-F681 WeakPolarHBondContact CA-O 3.38Å; R642-F681 HydrophobicContact CB-CB 4.27Å; R642-F681 HydrophobicContact CG-CB 4.37Å; R642-F681 PolarHBondContact N-O 3.37Å; L677-F681 HydrophobicContact CD2-CD2 4.11Å; L677-F681 HydrophobicContact CD2-CE2 4.19Å; L677-F681 PolarHBondContact O-N 3.13Å; F681-M839 HydrophobicContact CB-CE 3.48Å; F681-M839 VanDerWaalsContact CB-CE 3.48Å; F681-M839 HydrophobicContact CD2-CE 4.01Å; F681-M839 HydrophobicContact CG-CE 3.77Å; F681-I862 HydrophobicContact CD1-CG2 3.96Å; F681-I862 HydrophobicContact CE1-CG2 4.45Å; F681-I862 WeakPolarHBondContact CE1-O 3.46Å; F681-R863 WeakPolarHBondContact CD1-O 3.42Å; F681-L871 HydrophobicContact CD2-CD1 4.19Å; F681-L871 HydrophobicContact CE1-CB 4.14Å; F681-L871 HydrophobicContact CE2-CD1 3.82Å; F681-L871 HydrophobicContact CZ-CB 4.18Å; F681-L871 HydrophobicContact CZ-CD1 4.02Å; F681-V874 HydrophobicContact CE2-CB 4.24Å; F681-V874 HydrophobicContact CE2-CG1 4.47Å; F681-V874 HydrophobicContact CE2-CG2 3.8Å; F681-V874 HydrophobicContact CZ-CB 4.26Å; F681-V874 HydrophobicContact CZ-CG2 3.65Å
682	S	81.3	Confident	63.4	Low	51 Å²	51	84.1 Å²	84.1	36%	0.357	50%	0.5	S	S	.	.			trans	-132.7	157.7	165.6	-157.9	0	0	0	0	114.1	T640 R642	T640-S682 PolarHBondContact O-OG 2.71Å; R642-S682 VanDerWaalsContact NE-C 3.35Å; R642-S682 PolarHBondContact NE-O 3.02Å; R642-S682 PolarHBondContact NH2-O 2.74Å
683	T	61.6	Low	60.5	Low	95 Å²	95	83.4 Å²	83.4	58%	0.583	51%	0.508	S	S	*	.				-104.1	134.3	-129.8	-42.6	0	0	0	0	120.1	R642	R642-T683 WeakPolarHBondContact CA-OG1 3.44Å; R642-T683 HydrophobicContact CG-CG2 4.15Å; R642-T683 WeakPolarHBondContact CG-OG1 3.29Å
684	A	54	Low	57.6	Low	52 Å²	52	90.4 Å²	90.4	43%	0.43	55%	0.545	S	S	.	.			trans	-166.6	147	159.8	0	0	0	0	0	116.1	R642	R642-A684 PolarHBondContact NH1-O 2.83Å
685	N	41	Very low	54.5	Low	164 Å²	164	95 Å²	95	88%	0.877	57%	0.57	S	S	*	*			trans	60.9	135.7	151.6	-54.2	-13.6	0	0	0	125.1
686	A	35.2	Very low	51.7	Low	83 Å²	83	99.5 Å²	99.5	69%	0.686	58%	0.584	S	S	*	*			trans	-167.6	164.1	175.8	0	0	0	0	0	117.1
687	V	38.4	Very low	49	Very low	152 Å²	152	105 Å²	105	92%	0.921	61%	0.605	S	S	*	*			trans	-154.3	175.2	-174.7	-155.2	0	0	0	0	116.5
688	S	24.2	Very low	46.3	Very low	121 Å²	121	110.1 Å²	110.1	85%	0.846	64%	0.636	S	S	*	*			trans	-151.8	-174.5	173.7	66.3	0	0	0	0	112.7
689	G	25.1	Very low	43.8	Very low	72 Å²	72	114.8 Å²	114.8	74%	0.742	66%	0.656	S	S	*	*			cis	167.8	-172.4	11.6	0	0	0	0	0	109.9
690	V	24.5	Very low	41.6	Very low	138 Å²	138	112.3 Å²	112.3	84%	0.836	65%	0.647	S	S	*	*			cis	-169.6	155.2	-12.5	-158.2	0	0	0	0	112.2
691	S	28.2	Very low	39.2	Very low	107 Å²	107	113.9 Å²	113.9	75%	0.748	66%	0.657	S	S	*	*			trans	81	166.9	151.5	86.8	0	0	0	0	122.5
692	K	25.9	Very low	37.4	Very low	200 Å²	200	122 Å²	122	87%	0.87	69%	0.694	S	S	*	*			cis	-173.8	143.2	-14.5	-114.6	175.7	-175.5	179.2	0	117.1
693	A	26.8	Very low	36.3	Very low	82 Å²	82	123.7 Å²	123.7	68%	0.678	70%	0.702	S	S	*	*			trans	67.2	157.9	140	0	0	0	0	0	128.8
694	N	29.5	Very low	36.2	Very low	148 Å²	148	119.6 Å²	119.6	79%	0.791	68%	0.677	S	S	*	*			trans	89	167.9	151.4	-61.7	-49.5	0	0	0	125.9
695	I	28.7	Very low	36.9	Very low	120 Å²	120	120.8 Å²	120.8	62%	0.615	67%	0.673	S	S	*	*				-174.5	152.1	-57.5	-142.2	173.1	0	0	0	117.7
696	R	30	Very low	38.5	Very low	212 Å²	212	115.3 Å²	115.3	80%	0.8	64%	0.642	S	S	*	*			trans	77	167.6	160.6	-66.9	167.7	-172.9	156.5	-0.7	121.6
697	K	32.5	Very low	40.6	Very low	184 Å²	184	115.3 Å²	115.3	80%	0.8	63%	0.627	S	S	*	*			cis	-170.8	160.2	-3.2	-124.6	-170.8	168.3	-169.7	0	117
698	V	32.3	Very low	42.6	Very low	109 Å²	109	108.7 Å²	108.7	66%	0.661	59%	0.588	S	S	*	*			trans	86.5	144.9	138.1	159.5	0	0	0	0	129
699	K	37.8	Very low	45.3	Very low	132 Å²	132	103.3 Å²	103.3	57%	0.574	55%	0.551	S	S	*	*			trans	-167.7	-171.2	148.8	-110.6	176.1	-178.2	-179	0	117	K707	K699-K707 VanDerWaalsContact O-CD 3.3Å; K699-K707 WeakPolarHBondContact O-CD 3.37Å; K699-K707 WeakPolarHBondContact O-CE 3.19Å; K699-K707 PolarHBondContact O-NZ 2.81Å
700	T	40.6	Very low	48	Very low	91 Å²	91	103.9 Å²	103.9	56%	0.558	53%	0.534	S	S	*	.			trans	-162.2	143.4	-162.9	48.2	0	0	0	0	119.8	H706	T700-H706 WeakPolarHBondContact O-CB 3.37Å; T700-H706 PolarHBondContact O-CD2 3.31Å
701	L	37.7	Very low	51	Low	79 Å²	79	98.2 Å²	98.2	41%	0.414	50%	0.502	S	S	.	.			trans	-129.4	-115.3	176.9	-114	179	0	0	0	117.4	L704 H706 A709	L701-L704 WeakPolarHBondContact CB-O 3.14Å; L701-H706 HydrophobicContact CB-CB 3.24Å; L701-H706 HydrophobicContact CD1-CB 3.64Å; L701-H706 HydrophobicContact CG-CB 3.22Å; L701-A709 HydrophobicContact CD1-CB 4.13Å
702	Q	50.7	Low	53.7	Low	170 Å²	170	93.1 Å²	93.1	79%	0.794	47%	0.467	S	S	*	.	S	Bend	trans	-149.9	-52.2	-143.7	-88	174.1	-1.9	0	0	116.1	L704	Q702-L704 PolarHBondContact N-O 3.43Å; Q702-L704 VanDerWaalsContact N-O 3.08Å
703	V	58.1	Low	56.5	Low	87 Å²	87	87.5 Å²	87.5	53%	0.527	45%	0.446	S	S	.	.	S	Bend	trans	-131.7	-68	174.1	178.8	0	0	0	0	106.9
704	L	58.1	Low	59.3	Low	9 Å²	9	88.5 Å²	88.5	5%	0.047	44%	0.439	C	S	.	.	S	Bend	trans	-65.4	146.9	144.8	-66.7	167.4	0	0	0	109.5	L701 Q702 A708 A709 L712 P751 E773 V776	L701-L704 WeakPolarHBondContact CB-O 3.14Å; Q702-L704 PolarHBondContact N-O 3.43Å; Q702-L704 VanDerWaalsContact N-O 3.08Å; L704-A708 HydrophobicContact CB-CB 4.29Å; L704-A708 HydrophobicContact CD2-CB 4.43Å; L704-A709 HydrophobicContact CB-CB 3.54Å; L704-A709 HydrophobicContact CD1-CB 3.93Å; L704-A709 HydrophobicContact CG-CB 4.38Å; L704-L712 HydrophobicContact CD1-CD1 4.45Å; L704-P751 HydrophobicContact CD2-CB 3.73Å; L704-P751 HydrophobicContact CD2-CG 3.86Å; L704-E773 HydrophobicContact CD1-CG 4.21Å; L704-V776 HydrophobicContact CD1-CG2 4.22Å
705	E	69.8	Low	62	Low	76 Å²	76	81.9 Å²	81.9	36%	0.355	40%	0.404	S	S	.	.			trans	-77	171.8	174.5	-140.6	-160.9	167.9	0	0	113	K707 A708 A709	E705-K707 CarbonylContact O-C 3.36Å; E705-K707 IonicContact OE1-NZ 2.68Å; E705-K707 PolarHBondContact OE1-NZ 3.31Å; E705-K707 WeakPolarHBondContact OE2-CE 3.2Å; E705-K707 VanDerWaalsContact OE2-CG 3.25Å; E705-K707 WeakPolarHBondContact OE2-CG 3.31Å; E705-K707 IonicContact OE2-NZ 2.79Å; E705-K707 PolarHBondContact OE2-NZ 2.83Å; E705-A708 HydrophobicContact CB-CB 4.17Å; E705-A708 CarbonylContact O-C 3.49Å; E705-A708 VanDerWaalsContact O-CA 3.28Å; E705-A708 WeakPolarHBondContact O-CA 3.16Å; E705-A708 WeakPolarHBondContact O-CB 3.16Å; E705-A708 PolarHBondContact O-N 2.89Å; E705-A709 PolarHBondContact O-N 2.87Å
706	H	73.6	Confident	64.6	Low	49 Å²	49	78 Å²	78	23%	0.227	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.3	24.8	179.1	132.1	42.9	0	0	0	113.1	T700 L701 Q710	T700-H706 WeakPolarHBondContact O-CB 3.37Å; T700-H706 PolarHBondContact O-CD2 3.31Å; L701-H706 HydrophobicContact CB-CB 3.24Å; L701-H706 HydrophobicContact CD1-CB 3.64Å; L701-H706 HydrophobicContact CG-CB 3.22Å; H706-Q710 HydrophobicContact CB-CB 3.98Å; H706-Q710 VanDerWaalsContact CE1-CD 3.47Å; H706-Q710 PolarHBondContact CE1-OE1 2.82Å; H706-Q710 VanDerWaalsContact ND1-CD 3.3Å; H706-Q710 PolarHBondContact ND1-OE1 3.44Å
707	K	79.9	Confident	67	Low	84 Å²	84	70.6 Å²	70.6	37%	0.365	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn		-72.7	-76	114.5	16.8	-94	-166.1	-100	0	108.9	K699 E705 Q710 A711	K699-K707 VanDerWaalsContact O-CD 3.3Å; K699-K707 WeakPolarHBondContact O-CD 3.37Å; K699-K707 WeakPolarHBondContact O-CE 3.19Å; K699-K707 PolarHBondContact O-NZ 2.81Å; E705-K707 CarbonylContact O-C 3.36Å; E705-K707 IonicContact OE1-NZ 2.68Å; E705-K707 PolarHBondContact OE1-NZ 3.31Å; E705-K707 WeakPolarHBondContact OE2-CE 3.2Å; E705-K707 VanDerWaalsContact OE2-CG 3.25Å; E705-K707 WeakPolarHBondContact OE2-CG 3.31Å; E705-K707 IonicContact OE2-NZ 2.79Å; E705-K707 PolarHBondContact OE2-NZ 2.83Å; K707-Q710 PolarHBondContact O-N 3.49Å; K707-A711 VanDerWaalsContact O-CB 3.29Å; K707-A711 WeakPolarHBondContact O-CB 3.47Å; K707-A711 PolarHBondContact O-N 3.41Å
708	A	80.3	Confident	69.4	Low	13 Å²	13	65.7 Å²	65.7	11%	0.107	36%	0.361	C	S	.	.	H	α-helix	trans	-37	-80.9	-167	0	0	0	0	0	117.9	L704 E705 Q710 A711 L712 N749	L704-A708 HydrophobicContact CB-CB 4.29Å; L704-A708 HydrophobicContact CD2-CB 4.43Å; E705-A708 HydrophobicContact CB-CB 4.17Å; E705-A708 CarbonylContact O-C 3.49Å; E705-A708 VanDerWaalsContact O-CA 3.28Å; E705-A708 WeakPolarHBondContact O-CA 3.16Å; E705-A708 WeakPolarHBondContact O-CB 3.16Å; E705-A708 PolarHBondContact O-N 2.89Å; A708-Q710 PolarHBondContact O-N 3.2Å; A708-A711 PolarHBondContact O-N 2.89Å; A708-A711 VanDerWaalsContact O-N 3.17Å; A708-L712 VanDerWaalsContact O-CG 3.31Å; A708-L712 WeakPolarHBondContact O-CG 3.35Å; A708-L712 PolarHBondContact O-N 3.26Å; A708-N749 WeakPolarHBondContact CA-OD1 2.9Å; A708-N749 HydrophobicContact CB-CB 4.22Å; A708-N749 PolarHBondContact N-OD1 3.3Å
709	A	80.9	Confident	71.7	Confident	8 Å²	8	62.2 Å²	62.2	7%	0.066	34%	0.34	C	S	.	.	H	α-helix	trans	-61.2	-39	-177.9	0	0	0	0	0	113.3	L701 L704 E705 A711 L712 D713 V772	L701-A709 HydrophobicContact CD1-CB 4.13Å; L704-A709 HydrophobicContact CB-CB 3.54Å; L704-A709 HydrophobicContact CD1-CB 3.93Å; L704-A709 HydrophobicContact CG-CB 4.38Å; E705-A709 PolarHBondContact O-N 2.87Å; A709-A711 VanDerWaalsContact C-N 3.3Å; A709-A711 PolarHBondContact O-N 3.22Å; A709-L712 PolarHBondContact O-N 3.28Å; A709-D713 WeakPolarHBondContact O-CB 3.42Å; A709-D713 PolarHBondContact O-N 3.44Å; A709-V772 HydrophobicContact CB-CG1 4.04Å; A709-V772 HydrophobicContact CB-CG2 4.36Å
710	Q	82.9	Confident	73.7	Confident	83 Å²	83	64.8 Å²	64.8	39%	0.388	35%	0.352	S	S	.	.	H	α-helix	trans	-64.1	-38.5	176.1	-179.5	170.3	69.6	0	0	111.4	H706 K707 A708 I714	H706-Q710 HydrophobicContact CB-CB 3.98Å; H706-Q710 VanDerWaalsContact CE1-CD 3.47Å; H706-Q710 PolarHBondContact CE1-OE1 2.82Å; H706-Q710 VanDerWaalsContact ND1-CD 3.3Å; H706-Q710 PolarHBondContact ND1-OE1 3.44Å; K707-Q710 PolarHBondContact O-N 3.49Å; A708-Q710 PolarHBondContact O-N 3.2Å; Q710-I714 HydrophobicContact CG-CD1 3.82Å; Q710-I714 WeakPolarHBondContact O-CB 3.27Å; Q710-I714 WeakPolarHBondContact O-CD1 3.46Å; Q710-I714 WeakPolarHBondContact O-CG1 3.39Å; Q710-I714 PolarHBondContact O-N 3.17Å
711	A	85.7	Confident	75.6	Confident	20 Å²	20	61.7 Å²	61.7	17%	0.165	33%	0.331	C	S	.	.	H	α-helix	trans	-71.1	-35.3	176.8	0	0	0	0	0	112.3	K707 A708 A709 L715 N749	K707-A711 VanDerWaalsContact O-CB 3.29Å; K707-A711 WeakPolarHBondContact O-CB 3.47Å; K707-A711 PolarHBondContact O-N 3.41Å; A708-A711 PolarHBondContact O-N 2.89Å; A708-A711 VanDerWaalsContact O-N 3.17Å; A709-A711 VanDerWaalsContact C-N 3.3Å; A709-A711 PolarHBondContact O-N 3.22Å; A711-L715 WeakPolarHBondContact O-CB 3.27Å; A711-L715 PolarHBondContact O-N 2.88Å; A711-N749 WeakPolarHBondContact CB-ND2 3.29Å
712	L	86.1	Confident	77.9	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-71.5	-38.4	175.7	-69.6	168.3	0	0	0	112.6	L704 A708 A709 L715 Q716 L746 N749 V772 F775 V776	L704-L712 HydrophobicContact CD1-CD1 4.45Å; A708-L712 VanDerWaalsContact O-CG 3.31Å; A708-L712 WeakPolarHBondContact O-CG 3.35Å; A708-L712 PolarHBondContact O-N 3.26Å; A709-L712 PolarHBondContact O-N 3.28Å; L712-L715 HydrophobicContact CD2-CD2 4.22Å; L712-L715 WeakPolarHBondContact O-CB 3.21Å; L712-L715 PolarHBondContact O-N 2.99Å; L712-Q716 WeakPolarHBondContact O-CB 3.41Å; L712-Q716 PolarHBondContact O-N 3.42Å; L712-L746 HydrophobicContact CD2-CD1 3.64Å; L712-N749 HydrophobicContact CD1-CB 4.09Å; L712-N749 WeakPolarHBondContact CD1-O 3.31Å; L712-N749 HydrophobicContact CD2-CB 3.93Å; L712-N749 HydrophobicContact CG-CB 3.69Å; L712-V772 HydrophobicContact CB-CG2 3.37Å; L712-V772 HydrophobicContact CD1-CG2 4.44Å; L712-F775 HydrophobicContact CD2-CE1 4.27Å; L712-V776 HydrophobicContact CD1-CG2 3.7Å
713	D	83.8	Confident	79.4	Confident	82 Å²	82	52.7 Å²	52.7	44%	0.439	29%	0.294	S	S	.	.	H	α-helix	trans	-63.5	-48	173.7	-177.7	55.1	0	0	0	110.7	A709 L715 Q716 G717 V772	A709-D713 WeakPolarHBondContact O-CB 3.42Å; A709-D713 PolarHBondContact O-N 3.44Å; D713-L715 VanDerWaalsContact C-N 3.3Å; D713-L715 PolarHBondContact O-N 2.87Å; D713-Q716 PolarHBondContact O-N 2.57Å; D713-G717 PolarHBondContact O-N 3.37Å; D713-V772 HydrophobicContact CB-CB 4.11Å; D713-V772 HydrophobicContact CB-CG2 4.21Å
714	I	85.6	Confident	80.8	Confident	103 Å²	103	54.5 Å²	54.5	53%	0.528	30%	0.3	S	S	.	.	H	α-helix	trans	-60.6	-38.2	171.5	-69.7	168.3	0	0	0	111.4	Q710 S718	Q710-I714 HydrophobicContact CG-CD1 3.82Å; Q710-I714 WeakPolarHBondContact O-CB 3.27Å; Q710-I714 WeakPolarHBondContact O-CD1 3.46Å; Q710-I714 WeakPolarHBondContact O-CG1 3.39Å; Q710-I714 PolarHBondContact O-N 3.17Å; I714-S718 WeakPolarHBondContact O-CB 3.18Å; I714-S718 PolarHBondContact O-N 2.89Å; I714-S718 PolarHBondContact O-OG 3.42Å
715	L	85.8	Confident	82.2	Confident	9 Å²	9	59 Å²	59	5%	0.047	32%	0.321	C	S	.	.	H	α-helix	trans	-65.9	-47.2	178.9	175.3	64.3	0	0	0	112.2	A711 L712 D713 S718 T719 W726 A742 Q745 L746	A711-L715 WeakPolarHBondContact O-CB 3.27Å; A711-L715 PolarHBondContact O-N 2.88Å; L712-L715 HydrophobicContact CD2-CD2 4.22Å; L712-L715 WeakPolarHBondContact O-CB 3.21Å; L712-L715 PolarHBondContact O-N 2.99Å; D713-L715 VanDerWaalsContact C-N 3.3Å; D713-L715 PolarHBondContact O-N 2.87Å; L715-S718 PolarHBondContact O-OG 2.9Å; L715-T719 HydrophobicContact CD1-CG2 4.45Å; L715-T719 PolarHBondContact O-N 2.84Å; L715-T719 PolarHBondContact O-OG1 2.94Å; L715-W726 HydrophobicContact CD1-CH2 4.16Å; L715-W726 HydrophobicContact CD1-CZ2 3.97Å; L715-W726 HydrophobicContact CD2-CH2 4.09Å; L715-W726 HydrophobicContact CD2-CZ2 4.18Å; L715-W726 HydrophobicContact CG-CH2 4.19Å; L715-W726 HydrophobicContact CG-CZ2 3.84Å; L715-A742 HydrophobicContact CD1-CB 3.64Å; L715-Q745 HydrophobicContact CD1-CB 4.38Å; L715-Q745 HydrophobicContact CD2-CB 4.12Å; L715-L746 HydrophobicContact CD2-CB 3.95Å; L715-L746 HydrophobicContact CD2-CD1 4.46Å
716	Q	83.9	Confident	83.1	Confident	38 Å²	38	55.5 Å²	55.5	18%	0.178	30%	0.304	C	S	.	.	H	α-helix	trans	-65.1	-46.9	176.6	-173	-176.8	-4.9	0	0	110.8	L712 D713 S718 T719 K720 F775	L712-Q716 WeakPolarHBondContact O-CB 3.41Å; L712-Q716 PolarHBondContact O-N 3.42Å; D713-Q716 PolarHBondContact O-N 2.57Å; Q716-S718 PolarHBondContact O-N 3.34Å; Q716-T719 PolarHBondContact O-N 3.47Å; Q716-T719 PolarHBondContact O-OG1 3.22Å; Q716-K720 PolarHBondContact O-N 2.99Å; Q716-F775 HydrophobicContact CB-CD2 4.38Å; Q716-F775 HydrophobicContact CB-CE1 4.47Å; Q716-F775 HydrophobicContact CB-CE2 4.31Å; Q716-F775 HydrophobicContact CB-CZ 4.36Å; Q716-F775 HydrophobicContact CG-CD2 3.94Å; Q716-F775 HydrophobicContact CG-CE2 4.13Å; Q716-F775 HydrophobicContact CG-CG 4.33Å; Q716-F775 VanDerWaalsContact OE1-CG 3.31Å
717	G	81.4	Confident	83.9	Confident	56 Å²	56	56.5 Å²	56.5	58%	0.577	31%	0.308	S	S	*	.	H	α-helix	trans	-64.6	-34.6	178.3	0	0	0	0	0	114.3	D713	D713-G717 PolarHBondContact O-N 3.37Å
718	S	82.2	Confident	84.4	Confident	81 Å²	81	57.8 Å²	57.8	57%	0.566	31%	0.313	S	S	*	.	H	α-helix	trans	-78.3	-34	178.1	57.4	0	0	0	0	113.5	I714 L715 Q716 K720	I714-S718 WeakPolarHBondContact O-CB 3.18Å; I714-S718 PolarHBondContact O-N 2.89Å; I714-S718 PolarHBondContact O-OG 3.42Å; L715-S718 PolarHBondContact O-OG 2.9Å; Q716-S718 PolarHBondContact O-N 3.34Å; S718-K720 VanDerWaalsContact C-N 3.33Å
719	T	80.1	Confident	84.8	Confident	36 Å²	36	57.4 Å²	57.4	22%	0.221	31%	0.31	C	S	.	.	H	α-helix	trans	-74.8	-21.1	172.6	49	0	0	0	0	113.4	L715 Q716 M721 W726 A742	L715-T719 HydrophobicContact CD1-CG2 4.45Å; L715-T719 PolarHBondContact O-N 2.84Å; L715-T719 PolarHBondContact O-OG1 2.94Å; Q716-T719 PolarHBondContact O-N 3.47Å; Q716-T719 PolarHBondContact O-OG1 3.22Å; T719-M721 PolarHBondContact O-N 3.4Å; T719-W726 HydrophobicContact CG2-CZ2 3.72Å; T719-W726 PolarHBondContact OG1-NE1 2.71Å; T719-A742 HydrophobicContact CG2-CB 4.46Å
720	K	80.3	Confident	85.3	Confident	187 Å²	187	57 Å²	57	81%	0.813	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.3	27.9	-179.4	-56.3	-179.7	178.4	178	0	114.1	Q716 S718	Q716-K720 PolarHBondContact O-N 2.99Å; S718-K720 VanDerWaalsContact C-N 3.33Å
721	M	80.2	Confident	85.6	Confident	25 Å²	25	53.9 Å²	53.9	12%	0.123	29%	0.293	C	S	.	.			trans	-108.7	144.2	-179.7	-67.2	164	65.1	0	0	110.8	T719 E725 W726 A729 V737	T719-M721 PolarHBondContact O-N 3.4Å; M721-E725 HydrophobicContact CB-CB 4.26Å; M721-E725 HydrophobicContact CE-CB 4.05Å; M721-W726 VanDerWaalsContact CB-CD1 3.48Å; M721-W726 HydrophobicContact CB-CG 4.48Å; M721-W726 HydrophobicContact CE-CB 4.27Å; M721-W726 HydrophobicContact CE-CD2 4.28Å; M721-W726 HydrophobicContact CE-CG 3.84Å; M721-W726 HydrophobicContact SD-CG 4.49Å; M721-A729 HydrophobicContact CE-CB 4.23Å; M721-V737 HydrophobicContact CE-CG1 3.29Å; M721-V737 HydrophobicContact CG-CG1 4.47Å; M721-V737 HydrophobicContact SD-CG1 3.23Å; M721-V737 WeakPolarHBondContact SD-CG1 3.18Å
722	S	86	Confident	85.9	Confident	48 Å²	48	54 Å²	54	34%	0.336	29%	0.29	S	S	.	.			trans	-65.7	159.7	164.7	68.6	0	0	0	0	111.5	I724 E725 W726	S722-I724 PolarHBondContact O-N 3.26Å; S722-E725 WeakPolarHBondContact CB-OE2 3.26Å; S722-E725 PolarHBondContact N-OE2 2.97Å; S722-E725 PolarHBondContact O-N 3.44Å; S722-E725 WeakPolarHBondContact OG-CG 3.39Å; S722-E725 PolarHBondContact OG-N 2.96Å; S722-E725 VanDerWaalsContact OG-N 3.16Å; S722-E725 PolarHBondContact OG-OE2 3.47Å; S722-W726 PolarHBondContact O-N 3.47Å
723	A	82.9	Confident	85.9	Confident	12 Å²	12	54.5 Å²	54.5	10%	0.099	29%	0.292	C	S	.	.	H	α-helix	trans	-61	-26.8	174.1	0	0	0	0	0	113	K727 F775 T778	A723-K727 WeakPolarHBondContact O-CB 3.43Å; A723-K727 PolarHBondContact O-N 3.49Å; A723-F775 HydrophobicContact CB-CB 4.26Å; A723-F775 HydrophobicContact CB-CD2 3.7Å; A723-F775 HydrophobicContact CB-CG 4.44Å; A723-T778 HydrophobicContact CB-CG2 3.7Å; A723-T778 WeakPolarHBondContact O-CG2 3.44Å
724	I	87	Confident	86.1	Confident	126 Å²	126	53.4 Å²	53.4	65%	0.646	29%	0.287	S	S	*	.	H	α-helix	trans	-73.3	-43.3	177.5	-60.1	174.2	0	0	0	110.5	S722 K727 K728	S722-I724 PolarHBondContact O-N 3.26Å; I724-K727 PolarHBondContact O-N 3.42Å; I724-K728 WeakPolarHBondContact O-CB 3.45Å; I724-K728 PolarHBondContact O-N 3.04Å
725	E	87.8	Confident	86.1	Confident	104 Å²	104	52.6 Å²	52.6	49%	0.486	28%	0.281	S	S	.	.	H	α-helix	trans	-64.9	-41	175	-72.1	158.8	125.1	0	0	111.4	M721 S722 K728 A729	M721-E725 HydrophobicContact CB-CB 4.26Å; M721-E725 HydrophobicContact CE-CB 4.05Å; S722-E725 WeakPolarHBondContact CB-OE2 3.26Å; S722-E725 PolarHBondContact N-OE2 2.97Å; S722-E725 PolarHBondContact O-N 3.44Å; S722-E725 WeakPolarHBondContact OG-CG 3.39Å; S722-E725 PolarHBondContact OG-N 2.96Å; S722-E725 VanDerWaalsContact OG-N 3.16Å; S722-E725 PolarHBondContact OG-OE2 3.47Å; E725-K728 PolarHBondContact O-N 2.93Å; E725-A729 WeakPolarHBondContact O-CB 3.34Å; E725-A729 PolarHBondContact O-N 2.89Å
726	W	89.3	Confident	85.9	Confident	2 Å²	2	57.3 Å²	57.3	1%	0.008	31%	0.314	C	S	.	.	H	α-helix	trans	-59.2	-48.1	171.3	-95.1	97.6	0	0	0	112.1	L715 T719 M721 S722 K728 A729 I730 L738 A742 L743 L746 F775 L779	L715-W726 HydrophobicContact CD1-CH2 4.16Å; L715-W726 HydrophobicContact CD1-CZ2 3.97Å; L715-W726 HydrophobicContact CD2-CH2 4.09Å; L715-W726 HydrophobicContact CD2-CZ2 4.18Å; L715-W726 HydrophobicContact CG-CH2 4.19Å; L715-W726 HydrophobicContact CG-CZ2 3.84Å; T719-W726 HydrophobicContact CG2-CZ2 3.72Å; T719-W726 PolarHBondContact OG1-NE1 2.71Å; M721-W726 VanDerWaalsContact CB-CD1 3.48Å; M721-W726 HydrophobicContact CB-CG 4.48Å; M721-W726 HydrophobicContact CE-CB 4.27Å; M721-W726 HydrophobicContact CE-CD2 4.28Å; M721-W726 HydrophobicContact CE-CG 3.84Å; M721-W726 HydrophobicContact SD-CG 4.49Å; S722-W726 PolarHBondContact O-N 3.47Å; W726-K728 VanDerWaalsContact C-N 3.3Å; W726-K728 PolarHBondContact O-N 3.46Å; W726-A729 PolarHBondContact O-N 3.38Å; W726-I730 HydrophobicContact CE3-CD1 4.02Å; W726-I730 HydrophobicContact CE3-CG1 4.47Å; W726-I730 WeakPolarHBondContact O-CD1 3.19Å; W726-I730 VanDerWaalsContact O-CG1 3.3Å; W726-I730 WeakPolarHBondContact O-CG1 3.4Å; W726-I730 PolarHBondContact O-N 3.21Å; W726-L738 HydrophobicContact CE3-CD2 3.86Å; W726-L738 HydrophobicContact CZ3-CD2 3.82Å; W726-A742 HydrophobicContact CH2-CB 3.98Å; W726-A742 HydrophobicContact CZ2-CB 4.47Å; W726-L743 HydrophobicContact CZ3-CD2 4.42Å; W726-L746 HydrophobicContact CE3-CD2 4.15Å; W726-L746 HydrophobicContact CH2-CD2 4.4Å; W726-L746 HydrophobicContact CZ3-CD2 3.71Å; W726-F775 HydrophobicContact CB-CE2 4.1Å; W726-F775 AromaticContact CD1-CE2 3.6Å; W726-F775 HydrophobicContact CD2-CE2 4.18Å; W726-F775 HydrophobicContact CD2-CZ 4.23Å; W726-F775 AromaticContact CG-CE2 3.73Å; W726-F775 HydrophobicContact CG-CE2 3.73Å; W726-F775 HydrophobicContact CG-CZ 4.27Å; W726-F775 AromaticContact NE1-CE2 3.95Å; W726-L779 HydrophobicContact CB-CD2 3.78Å
727	K	90	Very high	85.9	Confident	69 Å²	69	58.1 Å²	58.1	30%	0.3	32%	0.322	S	S	.	.	H	α-helix	trans	-57	-43.7	175.7	173.9	172.2	179	174.3	0	111.5	A723 I724 L731 T778 L779 S781 I782	A723-K727 WeakPolarHBondContact O-CB 3.43Å; A723-K727 PolarHBondContact O-N 3.49Å; I724-K727 PolarHBondContact O-N 3.42Å; K727-L731 HydrophobicContact CG-CD1 4.04Å; K727-L731 WeakPolarHBondContact O-CD1 3.41Å; K727-L731 WeakPolarHBondContact O-CG 3.48Å; K727-L731 PolarHBondContact O-N 3.01Å; K727-T778 HydrophobicContact CB-CG2 4.42Å; K727-T778 HydrophobicContact CD-CG2 4.38Å; K727-L779 HydrophobicContact CB-CD2 4.1Å; K727-S781 WeakPolarHBondContact CE-OG 3.28Å; K727-S781 PolarHBondContact NZ-OG 3.01Å; K727-I782 HydrophobicContact CG-CD1 4.06Å; K727-I782 HydrophobicContact CG-CG1 4.13Å
728	K	89.7	Confident	86.2	Confident	111 Å²	111	55.7 Å²	55.7	48%	0.483	30%	0.296	S	S	.	.	H	α-helix	trans	-62.6	-49.6	176.4	-172.8	-168.3	171.6	-161.8	0	111.3	I724 E725 W726 I730 L731 E732	I724-K728 WeakPolarHBondContact O-CB 3.45Å; I724-K728 PolarHBondContact O-N 3.04Å; E725-K728 PolarHBondContact O-N 2.93Å; W726-K728 VanDerWaalsContact C-N 3.3Å; W726-K728 PolarHBondContact O-N 3.46Å; K728-I730 VanDerWaalsContact C-N 3.29Å; K728-I730 PolarHBondContact O-N 3.24Å; K728-L731 PolarHBondContact O-N 3.26Å; K728-E732 WeakPolarHBondContact CE-OE1 3.41Å; K728-E732 WeakPolarHBondContact CE-OE2 3.25Å; K728-E732 WeakPolarHBondContact CG-OE1 3.33Å; K728-E732 IonicContact NZ-OE1 3.73Å; K728-E732 IonicContact NZ-OE2 2.72Å; K728-E732 PolarHBondContact O-N 3.15Å
729	A	90	Very high	86.5	Confident	6 Å²	6	54.8 Å²	54.8	5%	0.05	29%	0.289	C	S	.	.	H	α-helix	trans	-59.6	-36.6	-178.8	0	0	0	0	0	112.6	M721 E725 W726 I733 D734 V737 L738	M721-A729 HydrophobicContact CE-CB 4.23Å; E725-A729 WeakPolarHBondContact O-CB 3.34Å; E725-A729 PolarHBondContact O-N 2.89Å; W726-A729 PolarHBondContact O-N 3.38Å; A729-I733 WeakPolarHBondContact O-CA 3.48Å; A729-I733 PolarHBondContact O-N 2.94Å; A729-D734 HydrophobicContact CB-CB 4.1Å; A729-D734 PolarHBondContact O-N 3.46Å; A729-V737 HydrophobicContact CB-CG1 4.35Å; A729-L738 HydrophobicContact CB-CD1 4.37Å; A729-L738 HydrophobicContact CB-CD2 3.83Å; A729-L738 HydrophobicContact CB-CG 3.95Å; A729-L738 WeakPolarHBondContact O-CD1 3.27Å
730	I	91.6	Very high	86.8	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-72.1	-26.5	176.2	-64.2	159.5	0	0	0	112.9	W726 K728 L738 L746 L779 I782 L785 R788 L789 I792	W726-I730 HydrophobicContact CE3-CD1 4.02Å; W726-I730 HydrophobicContact CE3-CG1 4.47Å; W726-I730 WeakPolarHBondContact O-CD1 3.19Å; W726-I730 VanDerWaalsContact O-CG1 3.3Å; W726-I730 WeakPolarHBondContact O-CG1 3.4Å; W726-I730 PolarHBondContact O-N 3.21Å; K728-I730 VanDerWaalsContact C-N 3.29Å; K728-I730 PolarHBondContact O-N 3.24Å; I730-L738 HydrophobicContact CG1-CD1 4.32Å; I730-L738 HydrophobicContact CG1-CD2 4.24Å; I730-L746 HydrophobicContact CD1-CD2 4.21Å; I730-L779 HydrophobicContact CD1-CD1 4.49Å; I730-L779 HydrophobicContact CD1-CD2 4.16Å; I730-I782 HydrophobicContact CB-CD1 3.88Å; I730-I782 HydrophobicContact CD1-CD1 4.39Å; I730-I782 HydrophobicContact CG2-CD1 3.65Å; I730-L785 HydrophobicContact CD1-CD1 4.32Å; I730-L785 HydrophobicContact CG2-CD1 4.29Å; I730-R788 HydrophobicContact CG2-CG 4.21Å; I730-L789 HydrophobicContact CD1-CD2 3.82Å; I730-L789 HydrophobicContact CG1-CD2 3.87Å; I730-L789 HydrophobicContact CG2-CD2 4.09Å; I730-I792 HydrophobicContact CG2-CD1 4.2Å
731	L	89.2	Confident	87.2	Confident	16 Å²	16	49.7 Å²	49.7	8%	0.084	27%	0.273	C	S	.	.	H	α-helix	trans	-84.3	-40.9	177.1	-69.3	166.7	0	0	0	112	K727 K728 I782 Q931 D935 R936	K727-L731 HydrophobicContact CG-CD1 4.04Å; K727-L731 WeakPolarHBondContact O-CD1 3.41Å; K727-L731 WeakPolarHBondContact O-CG 3.48Å; K727-L731 PolarHBondContact O-N 3.01Å; K728-L731 PolarHBondContact O-N 3.26Å; L731-I782 HydrophobicContact CD2-CD1 4.47Å; L731-I782 HydrophobicContact CD2-CG1 4.49Å; L731-I782 HydrophobicContact CD2-CG2 4.38Å; L731-I782 HydrophobicContact CG-CD1 4.22Å; L731-Q931 HydrophobicContact CD2-CB 4.33Å; L731-D935 WeakPolarHBondContact O-CA 3.24Å; L731-R936 PolarHBondContact O-N 3.28Å
732	E	90.2	Very high	87.6	Confident	24 Å²	24	48.8 Å²	48.8	11%	0.112	27%	0.27	C	S	.	.	H	α-helix	trans	-86	-13.3	-179.8	-73.5	175.3	-151.5	0	0	113.5	K728 N934 R936	K728-E732 WeakPolarHBondContact CE-OE1 3.41Å; K728-E732 WeakPolarHBondContact CE-OE2 3.25Å; K728-E732 WeakPolarHBondContact CG-OE1 3.33Å; K728-E732 IonicContact NZ-OE1 3.73Å; K728-E732 IonicContact NZ-OE2 2.72Å; K728-E732 PolarHBondContact O-N 3.15Å; E732-N934 HydrophobicContact CG-CB 3.99Å; E732-N934 WeakPolarHBondContact CG-O 3.35Å; E732-N934 PolarHBondContact OE1-ND2 2.91Å; E732-R936 WeakPolarHBondContact O-CD 3.18Å
733	I	87.7	Confident	87.9	Confident	9 Å²	9	46.5 Å²	46.5	5%	0.046	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	53.9	68.2	-168.9	-48.1	-176.1	0	0	0	110.8	A729 E735 I792 F937 L940 M941	A729-I733 WeakPolarHBondContact O-CA 3.48Å; A729-I733 PolarHBondContact O-N 2.94Å; I733-E735 HydrophobicContact CG2-CG 4Å; I733-E735 PolarHBondContact O-N 2.92Å; I733-I792 HydrophobicContact CD1-CD1 4.49Å; I733-I792 HydrophobicContact CD1-CG1 4.1Å; I733-I792 HydrophobicContact CG1-CD1 4.15Å; I733-I792 HydrophobicContact CG1-CG1 4.23Å; I733-I792 HydrophobicContact CG2-CG1 4.44Å; I733-I792 HydrophobicContact CG2-CG2 4.05Å; I733-F937 HydrophobicContact CD1-CB 4.3Å; I733-F937 HydrophobicContact CD1-CD2 3.94Å; I733-F937 HydrophobicContact CD1-CG 4.48Å; I733-L940 HydrophobicContact CB-CD1 3.86Å; I733-L940 HydrophobicContact CD1-CB 4.21Å; I733-L940 HydrophobicContact CD1-CD1 4.22Å; I733-L940 HydrophobicContact CG1-CD1 4.32Å; I733-M941 HydrophobicContact CD1-CE 3.89Å; I733-M941 HydrophobicContact CD1-CG 4.45Å
734	D	86.2	Confident	88.2	Confident	59 Å²	59	49 Å²	49	32%	0.316	26%	0.264	S	S	.	.			trans	-82.8	90.3	175.7	-164.6	-23.6	0	0	0	111.1	A729 S736 V737 L738	A729-D734 HydrophobicContact CB-CB 4.1Å; A729-D734 PolarHBondContact O-N 3.46Å; D734-S736 PolarHBondContact O-N 3.02Å; D734-S736 WeakPolarHBondContact OD1-CB 3.5Å; D734-S736 PolarHBondContact OD1-N 3.06Å; D734-S736 PolarHBondContact OD1-OG 3.49Å; D734-V737 HydrophobicContact CB-CB 4.21Å; D734-V737 HydrophobicContact CB-CG2 4.4Å; D734-V737 PolarHBondContact O-N 2.85Å; D734-V737 VanDerWaalsContact O-N 3.1Å; D734-L738 PolarHBondContact O-N 2.83Å
735	E	85.6	Confident	88.3	Confident	87 Å²	87	46.3 Å²	46.3	41%	0.407	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-10.8	178.9	-56.2	-177.7	-137.5	0	0	113.3	I733 V737 K795 L796	I733-E735 HydrophobicContact CG2-CG 4Å; I733-E735 PolarHBondContact O-N 2.92Å; E735-V737 VanDerWaalsContact C-N 3.29Å; E735-K795 VanDerWaalsContact OE1-CE 3.22Å; E735-K795 WeakPolarHBondContact OE1-CE 3.2Å; E735-K795 IonicContact OE1-NZ 2.73Å; E735-K795 PolarHBondContact OE1-NZ 2.78Å; E735-K795 IonicContact OE2-NZ 3.6Å; E735-K795 PolarHBondContact OE2-NZ 2.8Å; E735-L796 HydrophobicContact CB-CD2 4.18Å; E735-L796 HydrophobicContact CG-CD2 4Å
736	S	83.2	Confident	88.4	Confident	107 Å²	107	41.4 Å²	41.4	75%	0.748	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.6	-9.7	172.2	75.6	0	0	0	0	113.2	D734	D734-S736 PolarHBondContact O-N 3.02Å; D734-S736 WeakPolarHBondContact OD1-CB 3.5Å; D734-S736 PolarHBondContact OD1-N 3.06Å; D734-S736 PolarHBondContact OD1-OG 3.49Å
737	V	82.6	Confident	88.4	Confident	56 Å²	56	42.3 Å²	42.3	34%	0.339	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-125.2	-42.1	-171.5	176.7	0	0	0	0	111.7	M721 A729 D734 E735 S739	M721-V737 HydrophobicContact CE-CG1 3.29Å; M721-V737 HydrophobicContact CG-CG1 4.47Å; M721-V737 HydrophobicContact SD-CG1 3.23Å; M721-V737 WeakPolarHBondContact SD-CG1 3.18Å; A729-V737 HydrophobicContact CB-CG1 4.35Å; D734-V737 HydrophobicContact CB-CB 4.21Å; D734-V737 HydrophobicContact CB-CG2 4.4Å; D734-V737 PolarHBondContact O-N 2.85Å; D734-V737 VanDerWaalsContact O-N 3.1Å; E735-V737 VanDerWaalsContact C-N 3.29Å; V737-S739 PolarHBondContact O-N 3.01Å
738	L	87.3	Confident	88.3	Confident	5 Å²	5	44.1 Å²	44.1	3%	0.026	24%	0.242	C	C	.	.			trans	-80.4	109.5	174.8	-61.5	-179.3	0	0	0	110.3	W726 A729 I730 D734 L743 I792 L796	W726-L738 HydrophobicContact CE3-CD2 3.86Å; W726-L738 HydrophobicContact CZ3-CD2 3.82Å; A729-L738 HydrophobicContact CB-CD1 4.37Å; A729-L738 HydrophobicContact CB-CD2 3.83Å; A729-L738 HydrophobicContact CB-CG 3.95Å; A729-L738 WeakPolarHBondContact O-CD1 3.27Å; I730-L738 HydrophobicContact CG1-CD1 4.32Å; I730-L738 HydrophobicContact CG1-CD2 4.24Å; D734-L738 PolarHBondContact O-N 2.83Å; L738-L743 HydrophobicContact CB-CD1 4.34Å; L738-L743 HydrophobicContact CB-CD2 4.45Å; L738-L743 HydrophobicContact CB-CG 4.45Å; L738-L743 HydrophobicContact CD1-CD2 4.36Å; L738-L743 HydrophobicContact CD2-CD2 4.22Å; L738-I792 HydrophobicContact CD1-CG2 4.15Å; L738-L796 WeakPolarHBondContact O-CD1 3.43Å
739	S	88.7	Confident	88.2	Confident	62 Å²	62	39.3 Å²	39.3	43%	0.434	22%	0.222	S	C	.	.			trans	-91.7	151.8	170.7	73	0	0	0	0	112.4	V737 S741 A742 L743	V737-S739 PolarHBondContact O-N 3.01Å; S739-S741 PolarHBondContact O-N 3.37Å; S739-A742 WeakPolarHBondContact O-CB 3.42Å; S739-A742 PolarHBondContact O-N 3.45Å; S739-A742 VanDerWaalsContact O-N 3.12Å; S739-A742 WeakPolarHBondContact OG-CB 3.2Å; S739-A742 PolarHBondContact OG-N 2.92Å; S739-L743 WeakPolarHBondContact O-CG 3.23Å; S739-L743 PolarHBondContact O-N 3.28Å
740	E	88	Confident	88.1	Confident	46 Å²	46	39.7 Å²	39.7	22%	0.215	22%	0.223	C	C	.	.	H	α-helix	trans	-55.8	-51.2	-178	-177.5	-79.8	152.6	0	0	112	A742 L743 Q744 L796 K797	E740-A742 VanDerWaalsContact C-N 3.34Å; E740-A742 PolarHBondContact O-N 2.8Å; E740-L743 PolarHBondContact O-N 3.35Å; E740-Q744 PolarHBondContact O-N 3.35Å; E740-Q744 PolarHBondContact OE1-NE2 3.49Å; E740-L796 HydrophobicContact CB-CB 4.04Å; E740-L796 HydrophobicContact CB-CD1 4.31Å; E740-L796 HydrophobicContact CG-CB 4.38Å; E740-K797 HydrophobicContact CG-CG 3.55Å; E740-K797 WeakPolarHBondContact OE1-CE 3.29Å; E740-K797 WeakPolarHBondContact OE1-CG 3.26Å
741	S	88.2	Confident	87.6	Confident	69 Å²	69	40.7 Å²	40.7	48%	0.483	23%	0.229	S	C	.	.	H	α-helix	trans	-60.8	-38.3	174.7	-179.3	0	0	0	0	113	S739 Q744 Q745	S739-S741 PolarHBondContact O-N 3.37Å; S741-Q744 PolarHBondContact O-N 3Å; S741-Q745 WeakPolarHBondContact O-CG 3.32Å; S741-Q745 PolarHBondContact O-N 3.39Å
742	A	88.8	Confident	87.2	Confident	7 Å²	7	44.6 Å²	44.6	6%	0.058	25%	0.25	C	S	.	.	H	α-helix	trans	-64.7	-41.4	176.5	0	0	0	0	0	111.8	L715 T719 W726 S739 E740 Q745 L746	L715-A742 HydrophobicContact CD1-CB 3.64Å; T719-A742 HydrophobicContact CG2-CB 4.46Å; W726-A742 HydrophobicContact CH2-CB 3.98Å; W726-A742 HydrophobicContact CZ2-CB 4.47Å; S739-A742 WeakPolarHBondContact O-CB 3.42Å; S739-A742 PolarHBondContact O-N 3.45Å; S739-A742 VanDerWaalsContact O-N 3.12Å; S739-A742 WeakPolarHBondContact OG-CB 3.2Å; S739-A742 PolarHBondContact OG-N 2.92Å; E740-A742 VanDerWaalsContact C-N 3.34Å; E740-A742 PolarHBondContact O-N 2.8Å; A742-Q745 PolarHBondContact O-N 3.03Å; A742-L746 PolarHBondContact O-N 3.09Å
743	L	91.3	Very high	86.5	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-67.3	-40.6	173.2	-65.4	175.6	0	0	0	112.1	W726 L738 S739 E740 Q745 L746 I747 L789 I792 C793 L796	W726-L743 HydrophobicContact CZ3-CD2 4.42Å; L738-L743 HydrophobicContact CB-CD1 4.34Å; L738-L743 HydrophobicContact CB-CD2 4.45Å; L738-L743 HydrophobicContact CB-CG 4.45Å; L738-L743 HydrophobicContact CD1-CD2 4.36Å; L738-L743 HydrophobicContact CD2-CD2 4.22Å; S739-L743 WeakPolarHBondContact O-CG 3.23Å; S739-L743 PolarHBondContact O-N 3.28Å; E740-L743 PolarHBondContact O-N 3.35Å; L743-Q745 PolarHBondContact O-N 3.48Å; L743-L746 PolarHBondContact O-N 3.27Å; L743-I747 WeakPolarHBondContact O-CB 3.23Å; L743-I747 WeakPolarHBondContact O-CD1 3.21Å; L743-I747 WeakPolarHBondContact O-CG1 3.23Å; L743-I747 PolarHBondContact O-N 3.26Å; L743-L789 HydrophobicContact CD2-CD2 3.62Å; L743-I792 HydrophobicContact CD1-CB 4.08Å; L743-I792 HydrophobicContact CD1-CG2 3.56Å; L743-C793 HydrophobicContact CB-CB 4.07Å; L743-C793 HydrophobicContact CD1-CB 4.27Å; L743-L796 HydrophobicContact CD1-CD1 3.66Å
744	Q	89.3	Confident	86.1	Confident	65 Å²	65	51.8 Å²	51.8	30%	0.304	30%	0.297	S	S	.	.	H	α-helix	trans	-55.9	-50.9	173	-73.6	-160.9	16.1	0	0	111.1	E740 S741 L746 I747 I748	E740-Q744 PolarHBondContact O-N 3.35Å; E740-Q744 PolarHBondContact OE1-NE2 3.49Å; S741-Q744 PolarHBondContact O-N 3Å; Q744-L746 VanDerWaalsContact C-N 3.29Å; Q744-L746 PolarHBondContact O-N 3.01Å; Q744-I747 PolarHBondContact O-N 3.2Å; Q744-I748 WeakPolarHBondContact O-CB 3.1Å; Q744-I748 WeakPolarHBondContact O-CD1 3.28Å; Q744-I748 VanDerWaalsContact O-CG1 3.24Å; Q744-I748 WeakPolarHBondContact O-CG1 3.36Å; Q744-I748 PolarHBondContact O-N 3.4Å
745	Q	88.6	Confident	85.6	Confident	69 Å²	69	50 Å²	50	32%	0.322	29%	0.289	S	S	.	.	H	α-helix	trans	-61.1	-39.4	179.2	-68.3	-50.6	-49.4	0	0	111.5	L715 S741 A742 L743 N749	L715-Q745 HydrophobicContact CD1-CB 4.38Å; L715-Q745 HydrophobicContact CD2-CB 4.12Å; S741-Q745 WeakPolarHBondContact O-CG 3.32Å; S741-Q745 PolarHBondContact O-N 3.39Å; A742-Q745 PolarHBondContact O-N 3.03Å; L743-Q745 PolarHBondContact O-N 3.48Å; Q745-N749 VanDerWaalsContact O-CB 3.23Å; Q745-N749 WeakPolarHBondContact O-CB 3.34Å; Q745-N749 PolarHBondContact O-N 3.44Å; Q745-N749 PolarHBondContact O-ND2 3.01Å; Q745-N749 PolarHBondContact OE1-ND2 2.87Å; Q745-N749 VanDerWaalsContact OE1-ND2 3.17Å
746	L	89.9	Confident	85.2	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-63.8	-48.6	175.2	-171.3	57.7	0	0	0	111.8	L712 L715 W726 I730 A742 L743 Q744 I748 N749 L750 F775 L779 L789	L712-L746 HydrophobicContact CD2-CD1 3.64Å; L715-L746 HydrophobicContact CD2-CB 3.95Å; L715-L746 HydrophobicContact CD2-CD1 4.46Å; W726-L746 HydrophobicContact CE3-CD2 4.15Å; W726-L746 HydrophobicContact CH2-CD2 4.4Å; W726-L746 HydrophobicContact CZ3-CD2 3.71Å; I730-L746 HydrophobicContact CD1-CD2 4.21Å; A742-L746 PolarHBondContact O-N 3.09Å; L743-L746 PolarHBondContact O-N 3.27Å; Q744-L746 VanDerWaalsContact C-N 3.29Å; Q744-L746 PolarHBondContact O-N 3.01Å; L746-I748 VanDerWaalsContact C-N 3.34Å; L746-I748 PolarHBondContact O-N 2.85Å; L746-N749 PolarHBondContact O-N 2.97Å; L746-L750 HydrophobicContact CD1-CD1 4.46Å; L746-L750 HydrophobicContact CD1-CD2 4.23Å; L746-L750 HydrophobicContact CD1-CG 3.98Å; L746-L750 HydrophobicContact CG-CD1 4.21Å; L746-L750 HydrophobicContact CG-CG 4.21Å; L746-L750 VanDerWaalsContact O-CB 3.32Å; L746-L750 WeakPolarHBondContact O-CB 3.31Å; L746-L750 WeakPolarHBondContact O-CG 3.16Å; L746-L750 PolarHBondContact O-N 3.49Å; L746-F775 HydrophobicContact CD1-CE1 4.28Å; L746-L779 HydrophobicContact CD1-CD1 3.84Å; L746-L779 HydrophobicContact CD2-CD1 3.88Å; L746-L789 HydrophobicContact CB-CD1 4.47Å; L746-L789 HydrophobicContact CD2-CD1 3.59Å; L746-L789 HydrophobicContact CD2-CD2 3.78Å; L746-L789 HydrophobicContact CD2-CG 4.37Å; L746-L789 HydrophobicContact CG-CD1 3.72Å
747	I	90.5	Very high	84.9	Confident	22 Å²	22	46.6 Å²	46.6	11%	0.113	26%	0.262	C	S	.	.	H	α-helix	trans	-60.9	-40.6	-179.8	-67	158.7	0	0	0	112.1	L743 Q744 K786 L789 Q790 C793	L743-I747 WeakPolarHBondContact O-CB 3.23Å; L743-I747 WeakPolarHBondContact O-CD1 3.21Å; L743-I747 WeakPolarHBondContact O-CG1 3.23Å; L743-I747 PolarHBondContact O-N 3.26Å; Q744-I747 PolarHBondContact O-N 3.2Å; I747-K786 WeakPolarHBondContact O-CE 3.47Å; I747-K786 PolarHBondContact O-NZ 2.82Å; I747-L789 HydrophobicContact CD1-CB 4.02Å; I747-L789 HydrophobicContact CG1-CB 3.62Å; I747-L789 HydrophobicContact CG1-CD1 4.33Å; I747-Q790 HydrophobicContact CD1-CG 3.98Å; I747-Q790 HydrophobicContact CG1-CG 4.25Å; I747-Q790 HydrophobicContact CG2-CG 3.88Å; I747-C793 HydrophobicContact CD1-CB 3.77Å
748	I	88.3	Confident	84.6	Confident	107 Å²	107	48.7 Å²	48.7	55%	0.549	27%	0.267	S	S	.	.	H	α-helix	trans	-70.5	-42.3	-179.1	-70.2	166.6	0	0	0	111.2	Q744 L746	Q744-I748 WeakPolarHBondContact O-CB 3.1Å; Q744-I748 WeakPolarHBondContact O-CD1 3.28Å; Q744-I748 VanDerWaalsContact O-CG1 3.24Å; Q744-I748 WeakPolarHBondContact O-CG1 3.36Å; Q744-I748 PolarHBondContact O-N 3.4Å; L746-I748 VanDerWaalsContact C-N 3.34Å; L746-I748 PolarHBondContact O-N 2.85Å
749	N	88	Confident	83.9	Confident	9 Å²	9	48.6 Å²	48.6	5%	0.048	27%	0.267	C	S	.	.	H	α-helix	trans	-98.3	-10.1	-168.9	-63.6	-62.6	0	0	0	114.3	A708 A711 L712 Q745 L746	A708-N749 WeakPolarHBondContact CA-OD1 2.9Å; A708-N749 HydrophobicContact CB-CB 4.22Å; A708-N749 PolarHBondContact N-OD1 3.3Å; A711-N749 WeakPolarHBondContact CB-ND2 3.29Å; L712-N749 HydrophobicContact CD1-CB 4.09Å; L712-N749 WeakPolarHBondContact CD1-O 3.31Å; L712-N749 HydrophobicContact CD2-CB 3.93Å; L712-N749 HydrophobicContact CG-CB 3.69Å; Q745-N749 VanDerWaalsContact O-CB 3.23Å; Q745-N749 WeakPolarHBondContact O-CB 3.34Å; Q745-N749 PolarHBondContact O-N 3.44Å; Q745-N749 PolarHBondContact O-ND2 3.01Å; Q745-N749 PolarHBondContact OE1-ND2 2.87Å; Q745-N749 VanDerWaalsContact OE1-ND2 3.17Å; L746-N749 PolarHBondContact O-N 2.97Å
750	L	86.7	Confident	83.2	Confident	15 Å²	15	49.5 Å²	49.5	8%	0.079	26%	0.263	C	S	.	.	S	Bend	trans	-55.7	133.4	171.6	-92.1	171.9	0	0	0	111.6	L746 L785 K786 L789	L746-L750 HydrophobicContact CD1-CD1 4.46Å; L746-L750 HydrophobicContact CD1-CD2 4.23Å; L746-L750 HydrophobicContact CD1-CG 3.98Å; L746-L750 HydrophobicContact CG-CD1 4.21Å; L746-L750 HydrophobicContact CG-CG 4.21Å; L746-L750 VanDerWaalsContact O-CB 3.32Å; L746-L750 WeakPolarHBondContact O-CB 3.31Å; L746-L750 WeakPolarHBondContact O-CG 3.16Å; L746-L750 PolarHBondContact O-N 3.49Å; L750-L785 HydrophobicContact CD1-CD2 3.64Å; L750-L785 HydrophobicContact CD1-CG 4.01Å; L750-L785 HydrophobicContact CD2-CD2 3.74Å; L750-L785 HydrophobicContact CG-CD2 4.36Å; L750-K786 HydrophobicContact CD1-CB 4.49Å; L750-L789 HydrophobicContact CD1-CD1 3.5Å
751	P	81.9	Confident	82.5	Confident	20 Å²	20	51.1 Å²	51.1	13%	0.13	28%	0.284	C	S	.	.	P	Polyproline II helix	trans	-60.8	160.9	178.6	18.8	-27.9	0	0	0	114.2	L704 V756 L759 V776	L704-P751 HydrophobicContact CD2-CB 3.73Å; L704-P751 HydrophobicContact CD2-CG 3.86Å; P751-V756 HydrophobicContact CB-CG2 4.13Å; P751-V756 HydrophobicContact CG-CG2 3.76Å; P751-L759 HydrophobicContact CG-CD1 4.15Å; P751-V776 HydrophobicContact CG-CG1 3.63Å
752	D	79.7	Confident	81.2	Confident	99 Å²	99	52.5 Å²	52.5	53%	0.529	28%	0.281	S	S	.	.	P	Polyproline II helix	trans	-74.8	171.2	166.7	59.9	24	0	0	0	112.3	E754 S755 V756	D752-E754 VanDerWaalsContact C-N 3.33Å; D752-E754 PolarHBondContact O-N 2.78Å; D752-S755 PolarHBondContact O-N 3.38Å; D752-S755 WeakPolarHBondContact OD1-CB 3.48Å; D752-S755 PolarHBondContact OD1-N 2.78Å; D752-S755 PolarHBondContact OD1-OG 3.33Å; D752-V756 WeakPolarHBondContact O-CB 3.46Å; D752-V756 WeakPolarHBondContact O-CG2 3.23Å; D752-V756 PolarHBondContact O-N 2.73Å
753	G	76.5	Confident	79.9	Confident	50 Å²	50	55.1 Å²	55.1	52%	0.515	30%	0.299	S	S	.	.	H	α-helix	trans	-58.1	-40.9	-176.8	0	0	0	0	0	113.4	V756 E757	G753-V756 WeakPolarHBondContact O-CB 3.08Å; G753-V756 PolarHBondContact O-N 2.85Å; G753-E757 WeakPolarHBondContact O-CG 3.47Å; G753-E757 PolarHBondContact O-N 2.69Å
754	E	79.2	Confident	78.6	Confident	134 Å²	134	62.2 Å²	62.2	63%	0.626	34%	0.337	S	S	*	.	H	α-helix	trans	-66.6	-41.4	178	-69.4	-169.6	-160.2	0	0	112.8	D752 V756 E757 K758	D752-E754 VanDerWaalsContact C-N 3.33Å; D752-E754 PolarHBondContact O-N 2.78Å; E754-V756 VanDerWaalsContact C-N 3.3Å; E754-E757 PolarHBondContact O-N 2.72Å; E754-K758 WeakPolarHBondContact O-CB 3.05Å; E754-K758 WeakPolarHBondContact O-CD 3.49Å; E754-K758 WeakPolarHBondContact O-CG 3.37Å; E754-K758 PolarHBondContact O-N 2.73Å; E754-K758 IonicContact OE2-NZ 3.01Å; E754-K758 PolarHBondContact OE2-NZ 3.23Å
755	S	76.1	Confident	77.2	Confident	20 Å²	20	67 Å²	67	14%	0.14	35%	0.353	C	S	.	.	H	α-helix	trans	-70.9	-30.8	177.8	-53.1	0	0	0	0	111.2	D752 L759	D752-S755 PolarHBondContact O-N 3.38Å; D752-S755 WeakPolarHBondContact OD1-CB 3.48Å; D752-S755 PolarHBondContact OD1-N 2.78Å; D752-S755 PolarHBondContact OD1-OG 3.33Å; S755-L759 WeakPolarHBondContact O-CB 3.32Å; S755-L759 VanDerWaalsContact O-CG 3.31Å; S755-L759 WeakPolarHBondContact O-CG 3.23Å; S755-L759 PolarHBondContact O-N 3.12Å
756	V	76.1	Confident	75.8	Confident	18 Å²	18	66.8 Å²	66.8	11%	0.109	35%	0.353	C	S	.	.	H	α-helix	trans	-62.7	-47.8	167.6	162.5	0	0	0	0	111.8	P751 D752 G753 E754 K758 L759 K760 V780	P751-V756 HydrophobicContact CB-CG2 4.13Å; P751-V756 HydrophobicContact CG-CG2 3.76Å; D752-V756 WeakPolarHBondContact O-CB 3.46Å; D752-V756 WeakPolarHBondContact O-CG2 3.23Å; D752-V756 PolarHBondContact O-N 2.73Å; G753-V756 WeakPolarHBondContact O-CB 3.08Å; G753-V756 PolarHBondContact O-N 2.85Å; E754-V756 VanDerWaalsContact C-N 3.3Å; V756-K758 VanDerWaalsContact C-N 3.35Å; V756-K758 PolarHBondContact O-N 2.71Å; V756-L759 PolarHBondContact O-N 2.69Å; V756-K760 HydrophobicContact CG1-CD 3.92Å; V756-K760 HydrophobicContact CG1-CG 4.46Å; V756-K760 WeakPolarHBondContact O-CB 3.47Å; V756-K760 VanDerWaalsContact O-CG 3.32Å; V756-K760 WeakPolarHBondContact O-CG 3.32Å; V756-K760 PolarHBondContact O-N 2.89Å; V756-V780 HydrophobicContact CG1-CG1 3.61Å; V756-V780 HydrophobicContact CG2-CG1 4.47Å; V756-V780 HydrophobicContact CG2-CG2 3.91Å
757	E	77.5	Confident	74.5	Confident	105 Å²	105	74.1 Å²	74.1	49%	0.491	39%	0.392	S	S	.	.	H	α-helix	trans	-67.1	-35	177.1	-59.8	-39.1	125	0	0	112.1	G753 E754 K760 A761	G753-E757 WeakPolarHBondContact O-CG 3.47Å; G753-E757 PolarHBondContact O-N 2.69Å; E754-E757 PolarHBondContact O-N 2.72Å; E757-K760 PolarHBondContact O-N 2.82Å; E757-K760 IonicContact OE1-NZ 2.63Å; E757-K760 PolarHBondContact OE1-NZ 3.05Å; E757-K760 WeakPolarHBondContact OE2-CD 3.34Å; E757-K760 IonicContact OE2-NZ 2.98Å; E757-K760 PolarHBondContact OE2-NZ 2.71Å; E757-A761 PolarHBondContact O-N 2.78Å
758	K	75.6	Confident	73	Confident	100 Å²	100	76.8 Å²	76.8	44%	0.435	41%	0.413	S	S	.	.	H	α-helix	trans	-61.1	-45	171.5	-70.4	159.5	-162.2	156.2	0	111.4	E754 V756 A761 F762	E754-K758 WeakPolarHBondContact O-CB 3.05Å; E754-K758 WeakPolarHBondContact O-CD 3.49Å; E754-K758 WeakPolarHBondContact O-CG 3.37Å; E754-K758 PolarHBondContact O-N 2.73Å; E754-K758 IonicContact OE2-NZ 3.01Å; E754-K758 PolarHBondContact OE2-NZ 3.23Å; V756-K758 VanDerWaalsContact C-N 3.35Å; V756-K758 PolarHBondContact O-N 2.71Å; K758-A761 WeakPolarHBondContact O-CB 3.34Å; K758-A761 PolarHBondContact O-N 3.28Å; K758-F762 WeakPolarHBondContact O-CD2 3.27Å; K758-F762 WeakPolarHBondContact O-CE2 3.42Å
759	L	72	Confident	71.8	Confident	4 Å²	4	72.7 Å²	72.7	2%	0.021	39%	0.392	C	S	.	.	H	α-helix	trans	-64.8	-42	175.1	-76.2	167	0	0	0	112.1	P751 S755 V756 A761 F762 E773 V776 L777	P751-L759 HydrophobicContact CG-CD1 4.15Å; S755-L759 WeakPolarHBondContact O-CB 3.32Å; S755-L759 VanDerWaalsContact O-CG 3.31Å; S755-L759 WeakPolarHBondContact O-CG 3.23Å; S755-L759 PolarHBondContact O-N 3.12Å; V756-L759 PolarHBondContact O-N 2.69Å; L759-A761 VanDerWaalsContact C-N 3.27Å; L759-A761 PolarHBondContact O-N 2.94Å; L759-F762 PolarHBondContact O-N 2.82Å; L759-E773 HydrophobicContact CD2-CB 3.9Å; L759-E773 HydrophobicContact CD2-CG 3.91Å; L759-V776 HydrophobicContact CD1-CG1 3.78Å; L759-L777 HydrophobicContact CB-CD2 3.98Å; L759-L777 HydrophobicContact CB-CG 4.28Å
760	K	74.4	Confident	70.8	Confident	81 Å²	81	74.8 Å²	74.8	35%	0.352	41%	0.411	S	S	.	.	H	α-helix	trans	-61.2	-33.6	175.7	-75.4	163.4	168.7	179.1	0	112.5	V756 E757 F762 S763 L777	V756-K760 HydrophobicContact CG1-CD 3.92Å; V756-K760 HydrophobicContact CG1-CG 4.46Å; V756-K760 WeakPolarHBondContact O-CB 3.47Å; V756-K760 VanDerWaalsContact O-CG 3.32Å; V756-K760 WeakPolarHBondContact O-CG 3.32Å; V756-K760 PolarHBondContact O-N 2.89Å; E757-K760 PolarHBondContact O-N 2.82Å; E757-K760 IonicContact OE1-NZ 2.63Å; E757-K760 PolarHBondContact OE1-NZ 3.05Å; E757-K760 WeakPolarHBondContact OE2-CD 3.34Å; E757-K760 IonicContact OE2-NZ 2.98Å; E757-K760 PolarHBondContact OE2-NZ 2.71Å; K760-F762 PolarHBondContact O-N 3.36Å; K760-F762 VanDerWaalsContact O-N 3.07Å; K760-S763 VanDerWaalsContact O-CB 3.28Å; K760-S763 WeakPolarHBondContact O-CB 3.46Å; K760-S763 PolarHBondContact O-N 2.96Å; K760-S763 PolarHBondContact O-OG 3.08Å; K760-L777 HydrophobicContact CG-CD2 4.22Å
761	A	73.9	Confident	70.2	Confident	79 Å²	79	79.3 Å²	79.3	65%	0.653	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-9.9	173.7	0	0	0	0	0	113.9	E757 K758 L759	E757-A761 PolarHBondContact O-N 2.78Å; K758-A761 WeakPolarHBondContact O-CB 3.34Å; K758-A761 PolarHBondContact O-N 3.28Å; L759-A761 VanDerWaalsContact C-N 3.27Å; L759-A761 PolarHBondContact O-N 2.94Å
762	F	59.8	Low	70.1	Confident	98 Å²	98	78.9 Å²	78.9	43%	0.43	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.5	8.2	170.7	-61.2	-75	0	0	0	113.7	K758 L759 K760 D764 R765 L766 L769	K758-F762 WeakPolarHBondContact O-CD2 3.27Å; K758-F762 WeakPolarHBondContact O-CE2 3.42Å; L759-F762 PolarHBondContact O-N 2.82Å; K760-F762 PolarHBondContact O-N 3.36Å; K760-F762 VanDerWaalsContact O-N 3.07Å; F762-D764 PolarHBondContact O-N 3.4Å; F762-D764 VanDerWaalsContact O-N 3.15Å; F762-R765 CarbonylContact O-C 3.55Å; F762-R765 WeakPolarHBondContact O-CA 3.19Å; F762-R765 PolarHBondContact O-N 3.4Å; F762-L766 PolarHBondContact O-N 2.98Å; F762-L769 HydrophobicContact CB-CD1 3.87Å; F762-L769 HydrophobicContact CB-CD2 3.79Å; F762-L769 HydrophobicContact CB-CG 4.15Å; F762-L769 HydrophobicContact CD2-CD2 4.35Å; F762-L769 HydrophobicContact CG-CD2 4.05Å
763	S	63.2	Low	70.3	Confident	63 Å²	63	75.8 Å²	75.8	44%	0.441	41%	0.414	S	S	.	.	G	3₁₀ helix	trans	-54.4	-36.2	-179.9	56.1	0	0	0	0	113.2	K760 R765 L766	K760-S763 VanDerWaalsContact O-CB 3.28Å; K760-S763 WeakPolarHBondContact O-CB 3.46Å; K760-S763 PolarHBondContact O-N 2.96Å; K760-S763 PolarHBondContact O-OG 3.08Å; S763-R765 PolarHBondContact O-N 2.87Å; S763-R765 VanDerWaalsContact O-N 3.11Å; S763-L766 PolarHBondContact O-N 3.07Å
764	D	62.5	Low	70.4	Confident	149 Å²	149	75.8 Å²	75.8	80%	0.797	40%	0.401	S	S	*	.	G	3₁₀ helix	trans	-72	-4.7	-177.6	-51.6	-5.6	0	0	0	112.1	F762	F762-D764 PolarHBondContact O-N 3.4Å; F762-D764 VanDerWaalsContact O-N 3.15Å
765	R	60.2	Low	70.8	Confident	166 Å²	166	69.4 Å²	69.4	63%	0.626	37%	0.371	S	S	*	.	G	3₁₀ helix	trans	-135.1	31.4	-176.5	-50.9	-174.4	67.2	175.8	1.7	111.1	F762 S763 D767 S768	F762-R765 CarbonylContact O-C 3.55Å; F762-R765 WeakPolarHBondContact O-CA 3.19Å; F762-R765 PolarHBondContact O-N 3.4Å; S763-R765 PolarHBondContact O-N 2.87Å; S763-R765 VanDerWaalsContact O-N 3.11Å; R765-D767 PolarHBondContact O-N 3.37Å; R765-D767 VanDerWaalsContact O-N 3.15Å; R765-S768 WeakPolarHBondContact CB-OG 3.38Å; R765-S768 WeakPolarHBondContact O-CB 3.3Å; R765-S768 PolarHBondContact O-N 3.14Å; R765-S768 PolarHBondContact O-OG 3.38Å
766	L	59.4	Low	71.3	Confident	64 Å²	64	68.5 Å²	68.5	34%	0.335	37%	0.365	S	S	.	.	G	3₁₀ helix	trans	-44.8	-47.4	-176.3	-173.1	67	0	0	0	112.8	F762 S763 S768 L769 Q774 L777	F762-L766 PolarHBondContact O-N 2.98Å; S763-L766 PolarHBondContact O-N 3.07Å; L766-S768 PolarHBondContact O-N 3.19Å; L766-L769 PolarHBondContact O-N 3.05Å; L766-L769 VanDerWaalsContact O-N 3.11Å; L766-Q774 HydrophobicContact CD1-CB 3.97Å; L766-Q774 HydrophobicContact CD1-CG 3.9Å; L766-Q774 HydrophobicContact CG-CG 4.2Å; L766-Q774 WeakPolarHBondContact O-CG 3.29Å; L766-Q774 PolarHBondContact O-NE2 2.81Å; L766-L777 HydrophobicContact CD1-CB 4.49Å; L766-L777 HydrophobicContact CD1-CD1 3.85Å
767	D	62.1	Low	71.7	Confident	154 Å²	154	68.9 Å²	68.9	82%	0.824	37%	0.366	S	S	*	.	G	3₁₀ helix	trans	-63.1	-6.9	-179.9	-49.3	-27.8	0	0	0	115	R765	R765-D767 PolarHBondContact O-N 3.37Å; R765-D767 VanDerWaalsContact O-N 3.15Å
768	S	59.9	Low	72.1	Confident	78 Å²	78	65.5 Å²	65.5	55%	0.545	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-109.8	-1	178.8	70.1	0	0	0	0	114.5	R765 L766	R765-S768 WeakPolarHBondContact CB-OG 3.38Å; R765-S768 WeakPolarHBondContact O-CB 3.3Å; R765-S768 PolarHBondContact O-N 3.14Å; R765-S768 PolarHBondContact O-OG 3.38Å; L766-S768 PolarHBondContact O-N 3.19Å
769	L	62.4	Low	72.8	Confident	21 Å²	21	60.8 Å²	60.8	11%	0.11	33%	0.332	C	S	.	.	S	Bend	trans	-88.6	157.7	173.1	-65.5	174.5	0	0	0	110.9	F762 L766 E773 Q774 L777	F762-L769 HydrophobicContact CB-CD1 3.87Å; F762-L769 HydrophobicContact CB-CD2 3.79Å; F762-L769 HydrophobicContact CB-CG 4.15Å; F762-L769 HydrophobicContact CD2-CD2 4.35Å; F762-L769 HydrophobicContact CG-CD2 4.05Å; L766-L769 PolarHBondContact O-N 3.05Å; L766-L769 VanDerWaalsContact O-N 3.11Å; L769-E773 HydrophobicContact CB-CB 4.02Å; L769-Q774 HydrophobicContact CB-CG 4.1Å; L769-Q774 PolarHBondContact O-NE2 2.75Å; L769-L777 HydrophobicContact CD1-CD1 3.42Å; L769-L777 VanDerWaalsContact CD1-CD1 3.42Å
770	A	67.7	Low	73.5	Confident	53 Å²	53	62.2 Å²	62.2	44%	0.438	34%	0.341	S	S	.	.			trans	-63	149.8	173.4	0	0	0	0	0	111	V772 E773 Q774	A770-V772 HydrophobicContact CB-CG1 4.13Å; A770-V772 PolarHBondContact O-N 2.83Å; A770-V772 VanDerWaalsContact O-N 3.07Å; A770-E773 HydrophobicContact CB-CG 4.37Å; A770-E773 PolarHBondContact N-OE2 3.44Å; A770-E773 WeakPolarHBondContact O-CA 3.42Å; A770-E773 WeakPolarHBondContact O-CB 3.47Å; A770-E773 PolarHBondContact O-N 3.25Å; A770-Q774 PolarHBondContact O-N 3.47Å
771	D	73.3	Confident	74.1	Confident	110 Å²	110	61.2 Å²	61.2	59%	0.588	34%	0.344	S	S	*	.	H	α-helix	trans	-52.3	-38.5	-176.3	-61.4	-39.9	0	0	0	112.5	E773 Q774 F775	D771-E773 PolarHBondContact O-N 3.06Å; D771-Q774 PolarHBondContact O-N 2.62Å; D771-F775 WeakPolarHBondContact O-CB 3.34Å; D771-F775 PolarHBondContact O-N 3.32Å
772	V	81.2	Confident	74.7	Confident	11 Å²	11	57.7 Å²	57.7	7%	0.067	31%	0.314	C	S	.	.	H	α-helix	trans	-65.8	-30.8	175.6	66.1	0	0	0	0	114.2	A709 L712 D713 A770 V776	A709-V772 HydrophobicContact CB-CG1 4.04Å; A709-V772 HydrophobicContact CB-CG2 4.36Å; L712-V772 HydrophobicContact CB-CG2 3.37Å; L712-V772 HydrophobicContact CD1-CG2 4.44Å; D713-V772 HydrophobicContact CB-CB 4.11Å; D713-V772 HydrophobicContact CB-CG2 4.21Å; A770-V772 HydrophobicContact CB-CG1 4.13Å; A770-V772 PolarHBondContact O-N 2.83Å; A770-V772 VanDerWaalsContact O-N 3.07Å; V772-V776 VanDerWaalsContact O-CG2 3.3Å; V772-V776 WeakPolarHBondContact O-CG2 3.46Å; V772-V776 PolarHBondContact O-N 2.81Å
773	E	82.3	Confident	76	Confident	33 Å²	33	61.2 Å²	61.2	15%	0.154	33%	0.325	C	S	.	.	H	α-helix	trans	-78.1	-37.5	176.3	-67.8	178.9	135.9	0	0	110.8	L704 L759 L769 A770 D771 F775 V776 L777	L704-E773 HydrophobicContact CD1-CG 4.21Å; L759-E773 HydrophobicContact CD2-CB 3.9Å; L759-E773 HydrophobicContact CD2-CG 3.91Å; L769-E773 HydrophobicContact CB-CB 4.02Å; A770-E773 HydrophobicContact CB-CG 4.37Å; A770-E773 PolarHBondContact N-OE2 3.44Å; A770-E773 WeakPolarHBondContact O-CA 3.42Å; A770-E773 WeakPolarHBondContact O-CB 3.47Å; A770-E773 PolarHBondContact O-N 3.25Å; D771-E773 PolarHBondContact O-N 3.06Å; E773-F775 VanDerWaalsContact C-N 3.33Å; E773-V776 PolarHBondContact O-N 2.82Å; E773-L777 WeakPolarHBondContact O-CB 3.42Å; E773-L777 WeakPolarHBondContact O-CG 3.45Å; E773-L777 PolarHBondContact O-N 3.19Å
774	Q	80.5	Confident	77.2	Confident	50 Å²	50	62.6 Å²	62.6	23%	0.234	32%	0.32	C	S	.	.	H	α-helix	trans	-62.6	-40.4	169.8	-56.5	178.5	32.4	0	0	111.5	L766 L769 A770 D771 L777 T778	L766-Q774 HydrophobicContact CD1-CB 3.97Å; L766-Q774 HydrophobicContact CD1-CG 3.9Å; L766-Q774 HydrophobicContact CG-CG 4.2Å; L766-Q774 WeakPolarHBondContact O-CG 3.29Å; L766-Q774 PolarHBondContact O-NE2 2.81Å; L769-Q774 HydrophobicContact CB-CG 4.1Å; L769-Q774 PolarHBondContact O-NE2 2.75Å; A770-Q774 PolarHBondContact O-N 3.47Å; D771-Q774 PolarHBondContact O-N 2.62Å; Q774-L777 PolarHBondContact O-N 3.02Å; Q774-T778 PolarHBondContact O-N 2.78Å; Q774-T778 PolarHBondContact O-OG1 3.35Å
775	F	87	Confident	78.6	Confident	1 Å²	1	56.1 Å²	56.1	0%	0.004	29%	0.285	C	S	.	.	H	α-helix	trans	-59.7	-52.4	172.6	169.7	-108.5	0	0	0	111.8	L712 Q716 A723 W726 L746 D771 E773 L777 T778 L779	L712-F775 HydrophobicContact CD2-CE1 4.27Å; Q716-F775 HydrophobicContact CB-CD2 4.38Å; Q716-F775 HydrophobicContact CB-CE1 4.47Å; Q716-F775 HydrophobicContact CB-CE2 4.31Å; Q716-F775 HydrophobicContact CB-CZ 4.36Å; Q716-F775 HydrophobicContact CG-CD2 3.94Å; Q716-F775 HydrophobicContact CG-CE2 4.13Å; Q716-F775 HydrophobicContact CG-CG 4.33Å; Q716-F775 VanDerWaalsContact OE1-CG 3.31Å; A723-F775 HydrophobicContact CB-CB 4.26Å; A723-F775 HydrophobicContact CB-CD2 3.7Å; A723-F775 HydrophobicContact CB-CG 4.44Å; W726-F775 HydrophobicContact CB-CE2 4.1Å; W726-F775 AromaticContact CD1-CE2 3.6Å; W726-F775 HydrophobicContact CD2-CE2 4.18Å; W726-F775 HydrophobicContact CD2-CZ 4.23Å; W726-F775 AromaticContact CG-CE2 3.73Å; W726-F775 HydrophobicContact CG-CE2 3.73Å; W726-F775 HydrophobicContact CG-CZ 4.27Å; W726-F775 AromaticContact NE1-CE2 3.95Å; L746-F775 HydrophobicContact CD1-CE1 4.28Å; D771-F775 WeakPolarHBondContact O-CB 3.34Å; D771-F775 PolarHBondContact O-N 3.32Å; E773-F775 VanDerWaalsContact C-N 3.33Å; F775-L777 PolarHBondContact O-N 3.31Å; F775-T778 WeakPolarHBondContact O-CB 3.47Å; F775-T778 PolarHBondContact O-N 3.02Å; F775-L779 HydrophobicContact CD2-CD1 4.35Å; F775-L779 HydrophobicContact CE1-CD1 3.99Å; F775-L779 HydrophobicContact CE2-CD1 3.77Å; F775-L779 HydrophobicContact CE2-CG 4.35Å; F775-L779 HydrophobicContact CZ-CD1 3.58Å; F775-L779 WeakPolarHBondContact O-CG 3.46Å; F775-L779 PolarHBondContact O-N 2.85Å; F775-L779 VanDerWaalsContact O-N 3.09Å
776	V	86.7	Confident	80.1	Confident	1 Å²	1	52.3 Å²	52.3	1%	0.006	27%	0.274	C	S	.	.	H	α-helix	trans	-56.8	-47.5	176	164.9	0	0	0	0	111.8	L704 L712 P751 L759 V772 E773 T778 L779 V780	L704-V776 HydrophobicContact CD1-CG2 4.22Å; L712-V776 HydrophobicContact CD1-CG2 3.7Å; P751-V776 HydrophobicContact CG-CG1 3.63Å; L759-V776 HydrophobicContact CD1-CG1 3.78Å; V772-V776 VanDerWaalsContact O-CG2 3.3Å; V772-V776 WeakPolarHBondContact O-CG2 3.46Å; V772-V776 PolarHBondContact O-N 2.81Å; E773-V776 PolarHBondContact O-N 2.82Å; V776-T778 VanDerWaalsContact C-N 3.3Å; V776-T778 PolarHBondContact O-N 2.81Å; V776-L779 PolarHBondContact O-N 3.07Å; V776-V780 HydrophobicContact CG1-CG2 4.02Å; V776-V780 VanDerWaalsContact O-CB 3.32Å; V776-V780 WeakPolarHBondContact O-CB 3.39Å; V776-V780 WeakPolarHBondContact O-CG2 3.42Å; V776-V780 PolarHBondContact O-N 3.3Å
777	L	84.1	Confident	81.6	Confident	25 Å²	25	50.9 Å²	50.9	13%	0.131	27%	0.268	C	S	.	.	H	α-helix	trans	-58.1	-41.9	177.5	-82.6	172	0	0	0	112.6	L759 K760 L766 L769 E773 Q774 F775 L779 V780 S781	L759-L777 HydrophobicContact CB-CD2 3.98Å; L759-L777 HydrophobicContact CB-CG 4.28Å; K760-L777 HydrophobicContact CG-CD2 4.22Å; L766-L777 HydrophobicContact CD1-CB 4.49Å; L766-L777 HydrophobicContact CD1-CD1 3.85Å; L769-L777 HydrophobicContact CD1-CD1 3.42Å; L769-L777 VanDerWaalsContact CD1-CD1 3.42Å; E773-L777 WeakPolarHBondContact O-CB 3.42Å; E773-L777 WeakPolarHBondContact O-CG 3.45Å; E773-L777 PolarHBondContact O-N 3.19Å; Q774-L777 PolarHBondContact O-N 3.02Å; F775-L777 PolarHBondContact O-N 3.31Å; L777-L779 PolarHBondContact O-N 3.14Å; L777-V780 PolarHBondContact O-N 2.89Å; L777-S781 PolarHBondContact O-N 3.46Å
778	T	86.8	Confident	83.1	Confident	35 Å²	35	43.8 Å²	43.8	22%	0.215	23%	0.23	C	C	.	.	H	α-helix	trans	-61.6	-44	177.2	-57.4	0	0	0	0	111.4	A723 K727 Q774 F775 V776 S781	A723-T778 HydrophobicContact CB-CG2 3.7Å; A723-T778 WeakPolarHBondContact O-CG2 3.44Å; K727-T778 HydrophobicContact CB-CG2 4.42Å; K727-T778 HydrophobicContact CD-CG2 4.38Å; Q774-T778 PolarHBondContact O-N 2.78Å; Q774-T778 PolarHBondContact O-OG1 3.35Å; F775-T778 WeakPolarHBondContact O-CB 3.47Å; F775-T778 PolarHBondContact O-N 3.02Å; V776-T778 VanDerWaalsContact C-N 3.3Å; V776-T778 PolarHBondContact O-N 2.81Å; T778-S781 PolarHBondContact O-OG 2.8Å
779	L	89.6	Confident	84.8	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-73.7	-38	-179.7	-58	-172	0	0	0	112.9	W726 K727 I730 L746 F775 V776 L777 S781 I782 L785	W726-L779 HydrophobicContact CB-CD2 3.78Å; K727-L779 HydrophobicContact CB-CD2 4.1Å; I730-L779 HydrophobicContact CD1-CD1 4.49Å; I730-L779 HydrophobicContact CD1-CD2 4.16Å; L746-L779 HydrophobicContact CD1-CD1 3.84Å; L746-L779 HydrophobicContact CD2-CD1 3.88Å; F775-L779 HydrophobicContact CD2-CD1 4.35Å; F775-L779 HydrophobicContact CE1-CD1 3.99Å; F775-L779 HydrophobicContact CE2-CD1 3.77Å; F775-L779 HydrophobicContact CE2-CG 4.35Å; F775-L779 HydrophobicContact CZ-CD1 3.58Å; F775-L779 WeakPolarHBondContact O-CG 3.46Å; F775-L779 PolarHBondContact O-N 2.85Å; F775-L779 VanDerWaalsContact O-N 3.09Å; V776-L779 PolarHBondContact O-N 3.07Å; L777-L779 PolarHBondContact O-N 3.14Å; L779-S781 PolarHBondContact O-N 3.15Å; L779-S781 VanDerWaalsContact O-N 3.08Å; L779-I782 WeakPolarHBondContact O-CB 3.42Å; L779-I782 WeakPolarHBondContact O-CG1 3.42Å; L779-I782 PolarHBondContact O-N 3.44Å; L779-L785 HydrophobicContact CB-CD2 3.95Å
780	V	86.9	Confident	86.3	Confident	34 Å²	34	42.5 Å²	42.5	21%	0.206	22%	0.215	C	C	.	.	H	α-helix	trans	-57.4	-21.7	176.3	159.8	0	0	0	0	112.9	V756 V776 L777 I782	V756-V780 HydrophobicContact CG1-CG1 3.61Å; V756-V780 HydrophobicContact CG2-CG1 4.47Å; V756-V780 HydrophobicContact CG2-CG2 3.91Å; V776-V780 HydrophobicContact CG1-CG2 4.02Å; V776-V780 VanDerWaalsContact O-CB 3.32Å; V776-V780 WeakPolarHBondContact O-CB 3.39Å; V776-V780 WeakPolarHBondContact O-CG2 3.42Å; V776-V780 PolarHBondContact O-N 3.3Å; L777-V780 PolarHBondContact O-N 2.89Å; V780-I782 PolarHBondContact O-N 3.35Å
781	S	85.9	Confident	87.7	Confident	61 Å²	61	40 Å²	40	43%	0.427	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-13.1	172.1	74	0	0	0	0	114.5	K727 L777 T778 L779	K727-S781 WeakPolarHBondContact CE-OG 3.28Å; K727-S781 PolarHBondContact NZ-OG 3.01Å; L777-S781 PolarHBondContact O-N 3.46Å; T778-S781 PolarHBondContact O-OG 2.8Å; L779-S781 PolarHBondContact O-N 3.15Å; L779-S781 VanDerWaalsContact O-N 3.08Å
782	I	87.8	Confident	88.7	Confident	4 Å²	4	34.9 Å²	34.9	2%	0.021	17%	0.166	C	C	.	.	S	Bend	trans	-79.2	119.1	169.1	-57.8	179	0	0	0	109	K727 I730 L731 L779 V780 L785	K727-I782 HydrophobicContact CG-CD1 4.06Å; K727-I782 HydrophobicContact CG-CG1 4.13Å; I730-I782 HydrophobicContact CB-CD1 3.88Å; I730-I782 HydrophobicContact CD1-CD1 4.39Å; I730-I782 HydrophobicContact CG2-CD1 3.65Å; L731-I782 HydrophobicContact CD2-CD1 4.47Å; L731-I782 HydrophobicContact CD2-CG1 4.49Å; L731-I782 HydrophobicContact CD2-CG2 4.38Å; L731-I782 HydrophobicContact CG-CD1 4.22Å; L779-I782 WeakPolarHBondContact O-CB 3.42Å; L779-I782 WeakPolarHBondContact O-CG1 3.42Å; L779-I782 PolarHBondContact O-N 3.44Å; V780-I782 PolarHBondContact O-N 3.35Å; I782-L785 HydrophobicContact CB-CB 4.36Å; I782-L785 HydrophobicContact CB-CD1 4.1Å; I782-L785 HydrophobicContact CD1-CD1 4.06Å; I782-L785 HydrophobicContact CG2-CD1 4.39Å; I782-L785 WeakPolarHBondContact O-CB 3.27Å; I782-L785 PolarHBondContact O-N 2.95Å
783	R	87	Confident	89.4	Confident	173 Å²	173	34.8 Å²	34.8	65%	0.653	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.3	138.5	174.8	-56.4	-177.2	-175.7	-178.6	2.6	109.7	L785 Q931	R783-L785 PolarHBondContact O-N 3.47Å; R783-Q931 PolarHBondContact O-NE2 3.48Å
784	R	88.8	Confident	90	Very high	92 Å²	92	33.5 Å²	33.5	35%	0.347	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.7	31.3	-178	-46.9	179.8	69.9	104.7	-0	113.7	K786 P787 R788 E924 Q927	R784-K786 PolarHBondContact O-N 2.84Å; R784-P787 WeakPolarHBondContact O-CD 3.45Å; R784-R788 WeakPolarHBondContact O-CB 3.45Å; R784-R788 PolarHBondContact O-N 2.94Å; R784-E924 IonicContact CZ-OE1 3.43Å; R784-E924 IonicContact CZ-OE2 2.62Å; R784-E924 IonicContact NE-OE1 3.15Å; R784-E924 PolarHBondContact NE-OE1 3.36Å; R784-E924 IonicContact NE-OE2 3.97Å; R784-E924 PolarHBondContact NE-OE2 2.89Å; R784-E924 IonicContact NH2-OE1 3.21Å; R784-E924 PolarHBondContact NH2-OE1 3.31Å; R784-E924 IonicContact NH2-OE2 3.8Å; R784-Q927 VanDerWaalsContact CZ-OE1 3.23Å
785	L	90.7	Very high	90.7	Very high	12 Å²	12	33.4 Å²	33.4	6%	0.063	16%	0.159	C	C	.	.	H	α-helix	trans	-44.7	-53.4	-177.7	177.1	67.7	0	0	0	113.5	I730 L750 L779 I782 R783 R788 L789	I730-L785 HydrophobicContact CD1-CD1 4.32Å; I730-L785 HydrophobicContact CG2-CD1 4.29Å; L750-L785 HydrophobicContact CD1-CD2 3.64Å; L750-L785 HydrophobicContact CD1-CG 4.01Å; L750-L785 HydrophobicContact CD2-CD2 3.74Å; L750-L785 HydrophobicContact CG-CD2 4.36Å; L779-L785 HydrophobicContact CB-CD2 3.95Å; I782-L785 HydrophobicContact CB-CB 4.36Å; I782-L785 HydrophobicContact CB-CD1 4.1Å; I782-L785 HydrophobicContact CD1-CD1 4.06Å; I782-L785 HydrophobicContact CG2-CD1 4.39Å; I782-L785 WeakPolarHBondContact O-CB 3.27Å; I782-L785 PolarHBondContact O-N 2.95Å; R783-L785 PolarHBondContact O-N 3.47Å; L785-R788 PolarHBondContact O-N 3.47Å; L785-L789 HydrophobicContact CD1-CD1 3.77Å; L785-L789 HydrophobicContact CD1-CD2 4.34Å; L785-L789 HydrophobicContact CD1-CG 3.89Å; L785-L789 HydrophobicContact CD2-CD1 4.41Å; L785-L789 HydrophobicContact CG-CD1 3.74Å; L785-L789 HydrophobicContact CG-CG 4.24Å; L785-L789 WeakPolarHBondContact O-CB 3.24Å; L785-L789 VanDerWaalsContact O-CG 3.25Å; L785-L789 WeakPolarHBondContact O-CG 3.33Å; L785-L789 PolarHBondContact O-N 3.01Å
786	K	91.3	Very high	91	Very high	87 Å²	87	35.2 Å²	35.2	38%	0.378	17%	0.168	S	C	.	.	H	α-helix	trans	-64.4	-51.1	-172.2	-173.7	164.8	-170.1	151.9	0	112.9	I747 L750 R784 R788 L789 Q790	I747-K786 WeakPolarHBondContact O-CE 3.47Å; I747-K786 PolarHBondContact O-NZ 2.82Å; L750-K786 HydrophobicContact CD1-CB 4.49Å; R784-K786 PolarHBondContact O-N 2.84Å; K786-R788 PolarHBondContact O-N 3.48Å; K786-L789 PolarHBondContact O-N 3.03Å; K786-Q790 WeakPolarHBondContact O-CG 3.24Å; K786-Q790 PolarHBondContact O-N 2.95Å; K786-Q790 PolarHBondContact O-OE1 3.28Å
787	P	92.2	Very high	91.4	Very high	34 Å²	34	37.3 Å²	37.3	22%	0.221	18%	0.177	C	C	.	.	H	α-helix	trans	-56.6	-44.6	168.8	-29.2	36.2	0	0	0	114.5	R784 L789 Q790 C791 E924	R784-P787 WeakPolarHBondContact O-CD 3.45Å; P787-L789 VanDerWaalsContact C-N 3.33Å; P787-L789 PolarHBondContact O-N 3.31Å; P787-Q790 WeakPolarHBondContact O-CB 3.42Å; P787-Q790 PolarHBondContact O-N 3.47Å; P787-C791 PolarHBondContact O-N 2.94Å; P787-C791 PolarHBondContact O-SG 3.33Å; P787-C791 VanDerWaalsContact O-SG 3.35Å; P787-E924 HydrophobicContact CB-CG 3.67Å; P787-E924 VanDerWaalsContact CB-OE1 3.27Å; P787-E924 WeakPolarHBondContact CB-OE1 3.21Å; P787-E924 WeakPolarHBondContact CB-OE2 3.46Å
788	R	93.7	Very high	91.9	Very high	5 Å²	5	36.9 Å²	36.9	2%	0.019	17%	0.174	C	C	.	.	H	α-helix	trans	-56.1	-46.3	176.3	170.6	174.2	-71.9	-131.6	8.4	111.9	I730 R784 L785 K786 Q790 C791 I792 D935 F937	I730-R788 HydrophobicContact CG2-CG 4.21Å; R784-R788 WeakPolarHBondContact O-CB 3.45Å; R784-R788 PolarHBondContact O-N 2.94Å; L785-R788 PolarHBondContact O-N 3.47Å; K786-R788 PolarHBondContact O-N 3.48Å; R788-Q790 VanDerWaalsContact C-N 3.34Å; R788-C791 PolarHBondContact O-N 2.93Å; R788-I792 HydrophobicContact CG-CD1 3.98Å; R788-I792 WeakPolarHBondContact O-CG1 3.44Å; R788-I792 PolarHBondContact O-N 3.13Å; R788-D935 IonicContact CZ-OD1 2.93Å; R788-D935 IonicContact CZ-OD2 3.5Å; R788-D935 IonicContact NH1-OD1 3.08Å; R788-D935 PolarHBondContact NH1-OD1 2.86Å; R788-D935 IonicContact NH1-OD2 4Å; R788-D935 VanDerWaalsContact NH2-CG 3.34Å; R788-D935 IonicContact NH2-OD1 3.52Å; R788-D935 PolarHBondContact NH2-OD1 2.95Å; R788-D935 VanDerWaalsContact NH2-OD1 3.09Å; R788-D935 IonicContact NH2-OD2 2.72Å; R788-D935 PolarHBondContact NH2-OD2 3.09Å; R788-F937 HydrophobicContact CB-CE2 4.24Å; R788-F937 HydrophobicContact CG-CD2 3.8Å; R788-F937 HydrophobicContact CG-CE2 3.73Å
789	L	94.8	Very high	92.3	Very high	0 Å²	0	38 Å²	38	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-62.6	-39.9	175.7	-69.5	170.8	0	0	0	111.9	I730 L743 L746 I747 L750 L785 K786 P787 C791 I792 C793	I730-L789 HydrophobicContact CD1-CD2 3.82Å; I730-L789 HydrophobicContact CG1-CD2 3.87Å; I730-L789 HydrophobicContact CG2-CD2 4.09Å; L743-L789 HydrophobicContact CD2-CD2 3.62Å; L746-L789 HydrophobicContact CB-CD1 4.47Å; L746-L789 HydrophobicContact CD2-CD1 3.59Å; L746-L789 HydrophobicContact CD2-CD2 3.78Å; L746-L789 HydrophobicContact CD2-CG 4.37Å; L746-L789 HydrophobicContact CG-CD1 3.72Å; I747-L789 HydrophobicContact CD1-CB 4.02Å; I747-L789 HydrophobicContact CG1-CB 3.62Å; I747-L789 HydrophobicContact CG1-CD1 4.33Å; L750-L789 HydrophobicContact CD1-CD1 3.5Å; L785-L789 HydrophobicContact CD1-CD1 3.77Å; L785-L789 HydrophobicContact CD1-CD2 4.34Å; L785-L789 HydrophobicContact CD1-CG 3.89Å; L785-L789 HydrophobicContact CD2-CD1 4.41Å; L785-L789 HydrophobicContact CG-CD1 3.74Å; L785-L789 HydrophobicContact CG-CG 4.24Å; L785-L789 WeakPolarHBondContact O-CB 3.24Å; L785-L789 VanDerWaalsContact O-CG 3.25Å; L785-L789 WeakPolarHBondContact O-CG 3.33Å; L785-L789 PolarHBondContact O-N 3.01Å; K786-L789 PolarHBondContact O-N 3.03Å; P787-L789 VanDerWaalsContact C-N 3.33Å; P787-L789 PolarHBondContact O-N 3.31Å; L789-C791 VanDerWaalsContact C-N 3.35Å; L789-I792 PolarHBondContact O-N 2.88Å; L789-C793 VanDerWaalsContact O-CB 3.22Å; L789-C793 WeakPolarHBondContact O-CB 3.48Å; L789-C793 PolarHBondContact O-N 3.32Å
790	Q	95.1	Very high	92.5	Very high	72 Å²	72	43.9 Å²	43.9	34%	0.336	22%	0.215	S	C	.	.	H	α-helix	trans	-63.4	-39.2	175.9	-70	171.1	-87.9	0	0	111.9	I747 K786 P787 R788 F794 L920	I747-Q790 HydrophobicContact CD1-CG 3.98Å; I747-Q790 HydrophobicContact CG1-CG 4.25Å; I747-Q790 HydrophobicContact CG2-CG 3.88Å; K786-Q790 WeakPolarHBondContact O-CG 3.24Å; K786-Q790 PolarHBondContact O-N 2.95Å; K786-Q790 PolarHBondContact O-OE1 3.28Å; P787-Q790 WeakPolarHBondContact O-CB 3.42Å; P787-Q790 PolarHBondContact O-N 3.47Å; R788-Q790 VanDerWaalsContact C-N 3.34Å; Q790-F794 WeakPolarHBondContact O-CB 3.12Å; Q790-F794 PolarHBondContact O-N 2.87Å; Q790-L920 HydrophobicContact CB-CD2 3.57Å; Q790-L920 HydrophobicContact CG-CD2 4.45Å
791	C	95.9	Very high	92.9	Very high	1 Å²	1	43.1 Å²	43.1	1%	0.007	21%	0.209	C	C	.	.	H	α-helix	trans	-64	-43.7	173.1	-64.6	0	0	0	0	112.4	P787 R788 L789 F794 K795 V921 F937 M941	P787-C791 PolarHBondContact O-N 2.94Å; P787-C791 PolarHBondContact O-SG 3.33Å; P787-C791 VanDerWaalsContact O-SG 3.35Å; R788-C791 PolarHBondContact O-N 2.93Å; L789-C791 VanDerWaalsContact C-N 3.35Å; C791-F794 PolarHBondContact O-N 2.84Å; C791-K795 PolarHBondContact O-N 3.47Å; C791-V921 HydrophobicContact CB-CG2 3.93Å; C791-F937 HydrophobicContact CB-CE2 3.84Å; C791-F937 HydrophobicContact CB-CZ 3.82Å; C791-M941 HydrophobicContact CB-CE 4.11Å; C791-M941 HydrophobicContact CB-SD 4.09Å; C791-M941 WeakPolarHBondContact O-CE 3.41Å
792	I	95.2	Very high	93.4	Very high	1 Å²	1	40.8 Å²	40.8	1%	0.005	19%	0.192	C	C	.	.	H	α-helix	trans	-66.5	-42.9	177.1	-59.2	163.9	0	0	0	110.7	I730 I733 L738 L743 R788 L789 F794 K795 L796 F937 M941	I730-I792 HydrophobicContact CG2-CD1 4.2Å; I733-I792 HydrophobicContact CD1-CD1 4.49Å; I733-I792 HydrophobicContact CD1-CG1 4.1Å; I733-I792 HydrophobicContact CG1-CD1 4.15Å; I733-I792 HydrophobicContact CG1-CG1 4.23Å; I733-I792 HydrophobicContact CG2-CG1 4.44Å; I733-I792 HydrophobicContact CG2-CG2 4.05Å; L738-I792 HydrophobicContact CD1-CG2 4.15Å; L743-I792 HydrophobicContact CD1-CB 4.08Å; L743-I792 HydrophobicContact CD1-CG2 3.56Å; R788-I792 HydrophobicContact CG-CD1 3.98Å; R788-I792 WeakPolarHBondContact O-CG1 3.44Å; R788-I792 PolarHBondContact O-N 3.13Å; L789-I792 PolarHBondContact O-N 2.88Å; I792-F794 PolarHBondContact O-N 3.24Å; I792-K795 WeakPolarHBondContact O-CB 3.43Å; I792-K795 PolarHBondContact O-N 3.28Å; I792-K795 VanDerWaalsContact O-N 3.14Å; I792-L796 PolarHBondContact O-N 3.38Å; I792-F937 HydrophobicContact CG1-CE2 4.44Å; I792-M941 HydrophobicContact CB-CE 4.36Å; I792-M941 HydrophobicContact CG1-CE 3.86Å
793	C	94.4	Very high	93.7	Very high	9 Å²	9	46 Å²	46	6%	0.061	22%	0.22	C	C	.	.	H	α-helix	trans	-60.3	-43.5	175.2	-174.9	0	0	0	0	111.6	L743 I747 L789 K795 L796 K797	L743-C793 HydrophobicContact CB-CB 4.07Å; L743-C793 HydrophobicContact CD1-CB 4.27Å; I747-C793 HydrophobicContact CD1-CB 3.77Å; L789-C793 VanDerWaalsContact O-CB 3.22Å; L789-C793 WeakPolarHBondContact O-CB 3.48Å; L789-C793 PolarHBondContact O-N 3.32Å; C793-K795 VanDerWaalsContact C-N 3.35Å; C793-K795 PolarHBondContact O-N 3.39Å; C793-L796 PolarHBondContact O-N 2.91Å; C793-K797 WeakPolarHBondContact O-CB 3.06Å; C793-K797 WeakPolarHBondContact O-CG 3.42Å; C793-K797 PolarHBondContact O-N 3.46Å
794	F	96	Very high	94	Very high	7 Å²	7	42.4 Å²	42.4	3%	0.031	21%	0.214	C	C	.	.	H	α-helix	trans	-60	-41.6	172.6	173.9	-119.9	0	0	0	112.4	Q790 C791 I792 K797 F798 M801 M914 S917 I918 V921 F944 A948	Q790-F794 WeakPolarHBondContact O-CB 3.12Å; Q790-F794 PolarHBondContact O-N 2.87Å; C791-F794 PolarHBondContact O-N 2.84Å; I792-F794 PolarHBondContact O-N 3.24Å; F794-K797 PolarHBondContact O-N 2.93Å; F794-F798 HydrophobicContact CE2-CD2 4.38Å; F794-F798 HydrophobicContact CZ-CD2 4.09Å; F794-F798 WeakPolarHBondContact O-CB 3.5Å; F794-F798 PolarHBondContact O-N 3.39Å; F794-F798 VanDerWaalsContact O-N 3.07Å; F794-M801 HydrophobicContact CD2-CE 3.52Å; F794-M801 HydrophobicContact CE2-CE 3.49Å; F794-M801 VanDerWaalsContact CE2-CE 3.49Å; F794-M914 HydrophobicContact CE2-CG 4.21Å; F794-M914 HydrophobicContact CZ-CG 4.23Å; F794-S917 VanDerWaalsContact CE2-CB 3.47Å; F794-I918 HydrophobicContact CE1-CG1 3.93Å; F794-I918 HydrophobicContact CZ-CG1 3.77Å; F794-V921 HydrophobicContact CD1-CG2 3.83Å; F794-V921 HydrophobicContact CE1-CG2 4.36Å; F794-F944 AromaticContact CD1-CE1 3.55Å; F794-F944 HydrophobicContact CD1-CE1 3.55Å; F794-F944 AromaticContact CD1-CZ 3.71Å; F794-F944 HydrophobicContact CD1-CZ 3.71Å; F794-F944 AromaticContact CE1-CE1 3.63Å; F794-F944 HydrophobicContact CE1-CE1 3.63Å; F794-F944 AromaticContact CE1-CZ 3.52Å; F794-F944 HydrophobicContact CE1-CZ 3.52Å; F794-F944 HydrophobicContact CG-CZ 4.48Å; F794-F944 HydrophobicContact CZ-CZ 4.18Å; F794-A948 HydrophobicContact CE1-CB 4.37Å; F794-A948 HydrophobicContact CZ-CB 4.47Å
795	K	95.4	Very high	94.4	Very high	48 Å²	48	38 Å²	38	21%	0.209	20%	0.198	C	C	.	.	H	α-helix	trans	-59.4	-46.6	174.6	-174.7	-177.7	-175.6	-63.8	0	112.2	E735 C791 I792 C793 F798 M941 F944	E735-K795 VanDerWaalsContact OE1-CE 3.22Å; E735-K795 WeakPolarHBondContact OE1-CE 3.2Å; E735-K795 IonicContact OE1-NZ 2.73Å; E735-K795 PolarHBondContact OE1-NZ 2.78Å; E735-K795 IonicContact OE2-NZ 3.6Å; E735-K795 PolarHBondContact OE2-NZ 2.8Å; C791-K795 PolarHBondContact O-N 3.47Å; I792-K795 WeakPolarHBondContact O-CB 3.43Å; I792-K795 PolarHBondContact O-N 3.28Å; I792-K795 VanDerWaalsContact O-N 3.14Å; C793-K795 VanDerWaalsContact C-N 3.35Å; C793-K795 PolarHBondContact O-N 3.39Å; K795-F798 WeakPolarHBondContact O-CB 3.46Å; K795-F798 PolarHBondContact O-N 3.33Å; K795-M941 HydrophobicContact CB-CE 4.1Å; K795-M941 HydrophobicContact CD-CE 4.41Å; K795-F944 HydrophobicContact CB-CD1 3.96Å; K795-F944 HydrophobicContact CB-CE1 3.76Å; K795-F944 HydrophobicContact CB-CE2 4.4Å; K795-F944 HydrophobicContact CB-CG 4.36Å; K795-F944 HydrophobicContact CB-CZ 4.02Å; K795-F944 HydrophobicContact CD-CB 4.39Å; K795-F944 HydrophobicContact CD-CD1 4.42Å; K795-F944 HydrophobicContact CD-CG 4.18Å; K795-F944 HydrophobicContact CG-CD1 4Å; K795-F944 HydrophobicContact CG-CD2 3.92Å; K795-F944 HydrophobicContact CG-CE1 4.15Å; K795-F944 HydrophobicContact CG-CE2 4.09Å; K795-F944 HydrophobicContact CG-CG 3.88Å; K795-F944 HydrophobicContact CG-CZ 4.21Å
796	L	93.3	Very high	94.7	Very high	38 Å²	38	39.4 Å²	39.4	20%	0.199	20%	0.203	C	C	.	.	H	α-helix	trans	-66.3	-41.9	-179.6	-63.1	-177	0	0	0	112	E735 L738 E740 L743 I792 C793 F798	E735-L796 HydrophobicContact CB-CD2 4.18Å; E735-L796 HydrophobicContact CG-CD2 4Å; L738-L796 WeakPolarHBondContact O-CD1 3.43Å; E740-L796 HydrophobicContact CB-CB 4.04Å; E740-L796 HydrophobicContact CB-CD1 4.31Å; E740-L796 HydrophobicContact CG-CB 4.38Å; L743-L796 HydrophobicContact CD1-CD1 3.66Å; I792-L796 PolarHBondContact O-N 3.38Å; C793-L796 PolarHBondContact O-N 2.91Å; L796-F798 PolarHBondContact O-N 3.07Å
797	K	93.8	Very high	94.9	Very high	45 Å²	45	38.7 Å²	38.7	20%	0.196	21%	0.207	C	C	.	.	H	α-helix	trans	-65.6	-21.3	175.7	-75.1	-174.4	166.1	-163	0	114.6	E740 C793 F794 A799 E800 M801 E913	E740-K797 HydrophobicContact CG-CG 3.55Å; E740-K797 WeakPolarHBondContact OE1-CE 3.29Å; E740-K797 WeakPolarHBondContact OE1-CG 3.26Å; C793-K797 WeakPolarHBondContact O-CB 3.06Å; C793-K797 WeakPolarHBondContact O-CG 3.42Å; C793-K797 PolarHBondContact O-N 3.46Å; F794-K797 PolarHBondContact O-N 2.93Å; K797-A799 VanDerWaalsContact C-N 3.33Å; K797-A799 PolarHBondContact O-N 2.89Å; K797-E800 PolarHBondContact O-N 3.37Å; K797-E800 VanDerWaalsContact O-N 3.14Å; K797-M801 HydrophobicContact CB-CE 3.55Å; K797-M801 HydrophobicContact CB-SD 4.36Å; K797-M801 PolarHBondContact O-N 3.23Å; K797-E913 IonicContact NZ-OE1 3.76Å
798	F	96.4	Very high	95.1	Very high	16 Å²	16	38.8 Å²	38.8	7%	0.07	21%	0.208	C	C	.	.	H	α-helix	trans	-59.5	-40.8	-161.4	175.9	-103.3	0	0	0	113.6	F794 K795 L796 M801 V802 M914 F944 E947 A948 Q951	F794-F798 HydrophobicContact CE2-CD2 4.38Å; F794-F798 HydrophobicContact CZ-CD2 4.09Å; F794-F798 WeakPolarHBondContact O-CB 3.5Å; F794-F798 PolarHBondContact O-N 3.39Å; F794-F798 VanDerWaalsContact O-N 3.07Å; K795-F798 WeakPolarHBondContact O-CB 3.46Å; K795-F798 PolarHBondContact O-N 3.33Å; L796-F798 PolarHBondContact O-N 3.07Å; F798-M801 PolarHBondContact O-N 2.86Å; F798-V802 HydrophobicContact CE1-CG2 4.14Å; F798-V802 HydrophobicContact CE2-CG2 4.09Å; F798-V802 HydrophobicContact CZ-CG2 3.88Å; F798-V802 WeakPolarHBondContact O-CG2 3.27Å; F798-V802 PolarHBondContact O-N 3.1Å; F798-V802 VanDerWaalsContact O-N 3.08Å; F798-M914 HydrophobicContact CD2-CE 4.33Å; F798-M914 HydrophobicContact CE2-CE 4.17Å; F798-M914 HydrophobicContact CE2-SD 4.27Å; F798-F944 HydrophobicContact CB-CE2 3.69Å; F798-F944 HydrophobicContact CB-CZ 3.86Å; F798-F944 AromaticContact CD1-CE2 3.75Å; F798-F944 HydrophobicContact CD1-CE2 3.75Å; F798-F944 HydrophobicContact CD2-CE2 4.02Å; F798-F944 HydrophobicContact CD2-CZ 4.15Å; F798-F944 HydrophobicContact CE1-CE2 4.37Å; F798-F944 AromaticContact CG-CE2 3.54Å; F798-F944 HydrophobicContact CG-CE2 3.54Å; F798-F944 AromaticContact CG-CZ 3.96Å; F798-F944 HydrophobicContact CG-CZ 3.96Å; F798-E947 HydrophobicContact CE1-CG 4.41Å; F798-A948 HydrophobicContact CD2-CB 4.23Å; F798-A948 HydrophobicContact CE2-CB 3.74Å; F798-A948 HydrophobicContact CZ-CB 4.09Å; F798-Q951 HydrophobicContact CZ-CB 3.82Å; F798-Q951 HydrophobicContact CZ-CG 3.95Å
799	A	94.1	Very high	95.3	Very high	58 Å²	58	38.5 Å²	38.5	48%	0.479	21%	0.208	S	C	.	.	H	α-helix	trans	-63	-48.3	177.2	0	0	0	0	0	111.4	K797 M801 V802 D803	K797-A799 VanDerWaalsContact C-N 3.33Å; K797-A799 PolarHBondContact O-N 2.89Å; A799-M801 VanDerWaalsContact C-N 3.35Å; A799-M801 PolarHBondContact O-N 3.45Å; A799-V802 WeakPolarHBondContact O-CB 3.32Å; A799-V802 PolarHBondContact O-N 3.15Å; A799-D803 PolarHBondContact O-N 3.27Å
800	E	93.7	Very high	95.4	Very high	124 Å²	124	38.8 Å²	38.8	58%	0.579	21%	0.209	S	C	*	.	H	α-helix	trans	-60.5	-41.7	178.4	-59.3	-176	157.6	0	0	111.8	K797 V802 D803 D804	K797-E800 PolarHBondContact O-N 3.37Å; K797-E800 VanDerWaalsContact O-N 3.14Å; E800-V802 VanDerWaalsContact C-N 3.31Å; E800-V802 PolarHBondContact O-N 3.46Å; E800-D803 CarbonylContact O-C 3.33Å; E800-D803 PolarHBondContact O-N 3.47Å; E800-D804 PolarHBondContact O-N 3.46Å
801	M	96.2	Very high	95.5	Very high	19 Å²	19	35.6 Å²	35.6	9%	0.094	20%	0.195	C	C	.	.	H	α-helix	trans	-64.6	-32.8	174.8	-72.6	-179.5	-64.3	0	0	113	F794 K797 F798 A799 I805 M914	F794-M801 HydrophobicContact CD2-CE 3.52Å; F794-M801 HydrophobicContact CE2-CE 3.49Å; F794-M801 VanDerWaalsContact CE2-CE 3.49Å; K797-M801 HydrophobicContact CB-CE 3.55Å; K797-M801 HydrophobicContact CB-SD 4.36Å; K797-M801 PolarHBondContact O-N 3.23Å; F798-M801 PolarHBondContact O-N 2.86Å; A799-M801 VanDerWaalsContact C-N 3.35Å; A799-M801 PolarHBondContact O-N 3.45Å; M801-I805 VanDerWaalsContact O-CB 3.24Å; M801-I805 WeakPolarHBondContact O-CB 3.42Å; M801-I805 VanDerWaalsContact O-CD1 3.27Å; M801-I805 WeakPolarHBondContact O-CD1 3.49Å; M801-I805 WeakPolarHBondContact O-CG1 3.19Å; M801-I805 PolarHBondContact O-N 3.45Å; M801-I805 VanDerWaalsContact O-N 3.12Å; M801-M914 HydrophobicContact CB-CE 3.79Å
802	V	96.7	Very high	95.6	Very high	12 Å²	12	35.5 Å²	35.5	7%	0.073	20%	0.195	C	C	.	.	H	α-helix	trans	-70.4	-40.1	173.6	171.1	0	0	0	0	110.8	F798 A799 E800 I805 K806 M914 Q951 L955	F798-V802 HydrophobicContact CE1-CG2 4.14Å; F798-V802 HydrophobicContact CE2-CG2 4.09Å; F798-V802 HydrophobicContact CZ-CG2 3.88Å; F798-V802 WeakPolarHBondContact O-CG2 3.27Å; F798-V802 PolarHBondContact O-N 3.1Å; F798-V802 VanDerWaalsContact O-N 3.08Å; A799-V802 WeakPolarHBondContact O-CB 3.32Å; A799-V802 PolarHBondContact O-N 3.15Å; E800-V802 VanDerWaalsContact C-N 3.31Å; E800-V802 PolarHBondContact O-N 3.46Å; V802-I805 PolarHBondContact O-N 3.47Å; V802-K806 WeakPolarHBondContact O-CB 3.32Å; V802-K806 PolarHBondContact O-N 3.04Å; V802-M914 HydrophobicContact CG2-CE 4.02Å; V802-Q951 HydrophobicContact CG1-CG 4.28Å; V802-Q951 HydrophobicContact CG2-CG 3.67Å; V802-L955 HydrophobicContact CG1-CD1 4.46Å; V802-L955 HydrophobicContact CG2-CD1 4.15Å
803	D	93.6	Very high	95.7	Very high	112 Å²	112	36.4 Å²	36.4	60%	0.599	20%	0.2	S	C	*	.	H	α-helix	trans	-76.5	-21.2	-179.6	-70.8	-19.5	0	0	0	113.5	A799 E800 P807	A799-D803 PolarHBondContact O-N 3.27Å; E800-D803 CarbonylContact O-C 3.33Å; E800-D803 PolarHBondContact O-N 3.47Å; D803-P807 WeakPolarHBondContact O-CD 3.21Å; D803-P807 WeakPolarHBondContact O-CG 3.28Å
804	D	92.7	Very high	95.8	Very high	99 Å²	99	36.3 Å²	36.3	53%	0.529	20%	0.2	S	C	.	.	H	α-helix	trans	-76.8	-47.6	166.3	-86.2	-16.7	0	0	0	111.9	E800 S808	E800-D804 PolarHBondContact O-N 3.46Å; D804-S808 WeakPolarHBondContact O-CB 3.32Å; D804-S808 PolarHBondContact O-OG 3.26Å
805	I	97.5	Very high	95.9	Very high	0 Å²	0	36 Å²	36	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-75	-46	-172	-68	169.3	0	0	0	111.3	M801 V802 S808 I809 L907 N910 L911 M914 L955	M801-I805 VanDerWaalsContact O-CB 3.24Å; M801-I805 WeakPolarHBondContact O-CB 3.42Å; M801-I805 VanDerWaalsContact O-CD1 3.27Å; M801-I805 WeakPolarHBondContact O-CD1 3.49Å; M801-I805 WeakPolarHBondContact O-CG1 3.19Å; M801-I805 PolarHBondContact O-N 3.45Å; M801-I805 VanDerWaalsContact O-N 3.12Å; V802-I805 PolarHBondContact O-N 3.47Å; I805-S808 PolarHBondContact O-N 3.34Å; I805-I809 HydrophobicContact CG2-CD1 3.58Å; I805-I809 HydrophobicContact CG2-CG1 4.4Å; I805-I809 WeakPolarHBondContact O-CG1 3.43Å; I805-I809 PolarHBondContact O-N 3Å; I805-I809 VanDerWaalsContact O-N 3.14Å; I805-L907 HydrophobicContact CB-CD1 4.19Å; I805-L907 HydrophobicContact CG1-CD1 4.29Å; I805-L907 HydrophobicContact CG2-CD1 3.88Å; I805-N910 HydrophobicContact CD1-CB 3.85Å; I805-N910 HydrophobicContact CG1-CB 3.86Å; I805-L911 HydrophobicContact CD1-CD2 4.23Å; I805-L911 HydrophobicContact CD1-CG 4.24Å; I805-L911 HydrophobicContact CG2-CD2 3.85Å; I805-L911 HydrophobicContact CG2-CG 4.02Å; I805-M914 HydrophobicContact CD1-CE 3.93Å; I805-L955 HydrophobicContact CB-CD1 4.36Å; I805-L955 HydrophobicContact CG2-CB 4.23Å; I805-L955 HydrophobicContact CG2-CD1 4Å; I805-L955 HydrophobicContact CG2-CD2 4.25Å; I805-L955 HydrophobicContact CG2-CG 4.39Å
806	K	96.8	Very high	96.1	Very high	40 Å²	40	33.7 Å²	33.7	17%	0.174	19%	0.188	C	C	.	.	H	α-helix	trans	-64.8	-51.2	-170.9	-166.5	-169.8	-58.3	-170.6	0	112.8	T485 E489 V802 S808 I809 V810 L955 M958	T485-K806 HydrophobicContact CG2-CD 4.3Å; E489-K806 WeakPolarHBondContact OE1-CE 3.26Å; E489-K806 IonicContact OE1-NZ 2.81Å; E489-K806 PolarHBondContact OE1-NZ 2.55Å; V802-K806 WeakPolarHBondContact O-CB 3.32Å; V802-K806 PolarHBondContact O-N 3.04Å; K806-S808 VanDerWaalsContact C-N 3.28Å; K806-S808 PolarHBondContact O-N 3.13Å; K806-I809 PolarHBondContact O-N 2.63Å; K806-V810 HydrophobicContact CG-CG2 4.32Å; K806-V810 VanDerWaalsContact O-CG2 3.31Å; K806-V810 WeakPolarHBondContact O-CG2 3.44Å; K806-V810 PolarHBondContact O-N 3.12Å; K806-L955 HydrophobicContact CB-CD2 3.77Å; K806-L955 HydrophobicContact CG-CD2 3.92Å; K806-M958 HydrophobicContact CG-CE 4.22Å
807	P	95.2	Very high	96.2	Very high	73 Å²	73	34.9 Å²	34.9	47%	0.474	19%	0.193	S	C	.	.	H	α-helix	trans	-64.9	-34.1	-179.1	-21.6	36.5	0	0	0	112.1	D803 I809 V810 A811	D803-P807 WeakPolarHBondContact O-CD 3.21Å; D803-P807 WeakPolarHBondContact O-CG 3.28Å; P807-I809 PolarHBondContact O-N 3.12Å; P807-V810 PolarHBondContact O-N 2.86Å; P807-A811 VanDerWaalsContact O-CB 3.28Å; P807-A811 WeakPolarHBondContact O-CB 3.48Å; P807-A811 PolarHBondContact O-N 3.27Å
808	S	96.6	Very high	96.3	Very high	35 Å²	35	33.8 Å²	33.8	25%	0.245	19%	0.189	C	C	.	.	H	α-helix	trans	-59.1	-46	174.2	-62.2	0	0	0	0	112.1	D804 I805 K806 V812	D804-S808 WeakPolarHBondContact O-CB 3.32Å; D804-S808 PolarHBondContact O-OG 3.26Å; I805-S808 PolarHBondContact O-N 3.34Å; K806-S808 VanDerWaalsContact C-N 3.28Å; K806-S808 PolarHBondContact O-N 3.13Å; S808-V812 PolarHBondContact O-N 3.1Å
809	I	98.2	Very high	96.4	Very high	0 Å²	0	33 Å²	33	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-66.1	-45.1	175.1	-65.4	166.5	0	0	0	111.3	I805 K806 P807 A811 T813 L907 L955 M958 H959 M962	I805-I809 HydrophobicContact CG2-CD1 3.58Å; I805-I809 HydrophobicContact CG2-CG1 4.4Å; I805-I809 WeakPolarHBondContact O-CG1 3.43Å; I805-I809 PolarHBondContact O-N 3Å; I805-I809 VanDerWaalsContact O-N 3.14Å; K806-I809 PolarHBondContact O-N 2.63Å; P807-I809 PolarHBondContact O-N 3.12Å; I809-A811 PolarHBondContact O-N 2.94Å; I809-T813 WeakPolarHBondContact O-CB 3.44Å; I809-T813 PolarHBondContact O-N 3.2Å; I809-T813 VanDerWaalsContact O-N 3.08Å; I809-T813 PolarHBondContact O-OG1 2.76Å; I809-L907 HydrophobicContact CG1-CD1 4.14Å; I809-L907 HydrophobicContact CG1-CD2 3.84Å; I809-L907 HydrophobicContact CG1-CG 4.33Å; I809-L955 HydrophobicContact CD1-CB 4.45Å; I809-L955 HydrophobicContact CD1-CD2 4.35Å; I809-M958 HydrophobicContact CD1-CB 4.42Å; I809-M958 HydrophobicContact CG2-CB 3.68Å; I809-M958 HydrophobicContact CG2-CE 4.47Å; I809-H959 HydrophobicContact CD1-CB 3.93Å; I809-H959 HydrophobicContact CG1-CB 4.34Å; I809-M962 HydrophobicContact CB-SD 4.45Å; I809-M962 HydrophobicContact CG1-SD 4.36Å; I809-M962 HydrophobicContact CG2-CB 4.06Å; I809-M962 HydrophobicContact CG2-CG 4.5Å; I809-M962 HydrophobicContact CG2-SD 4.43Å
810	V	97	Very high	96.5	Very high	5 Å²	5	35.1 Å²	35.1	3%	0.03	18%	0.181	C	C	.	.	H	α-helix	trans	-61.4	-45.2	-177.5	168.4	0	0	0	0	111.1	I484 T485 Q488 K806 P807 T813 A814 M958	I484-V810 HydrophobicContact CG2-CG1 4.31Å; T485-V810 HydrophobicContact CG2-CG2 4.21Å; Q488-V810 PolarHBondContact NE2-O 2.93Å; K806-V810 HydrophobicContact CG-CG2 4.32Å; K806-V810 VanDerWaalsContact O-CG2 3.31Å; K806-V810 WeakPolarHBondContact O-CG2 3.44Å; K806-V810 PolarHBondContact O-N 3.12Å; P807-V810 PolarHBondContact O-N 2.86Å; V810-T813 PolarHBondContact O-N 3.17Å; V810-A814 WeakPolarHBondContact O-CB 3.24Å; V810-A814 PolarHBondContact O-N 3.45Å; V810-M958 HydrophobicContact CG2-CE 3.88Å
811	A	96.8	Very high	96.5	Very high	5 Å²	5	33 Å²	33	4%	0.041	18%	0.177	C	C	.	.	H	α-helix	trans	-61.3	-50.7	-179	0	0	0	0	0	112.5	P807 I809 T813 A814 A815 H895 A898	P807-A811 VanDerWaalsContact O-CB 3.28Å; P807-A811 WeakPolarHBondContact O-CB 3.48Å; P807-A811 PolarHBondContact O-N 3.27Å; I809-A811 PolarHBondContact O-N 2.94Å; A811-T813 PolarHBondContact O-N 2.76Å; A811-A814 PolarHBondContact O-N 3.12Å; A811-A815 WeakPolarHBondContact O-CB 3.39Å; A811-A815 PolarHBondContact O-N 3.3Å; A811-H895 HydrophobicContact CB-CB 4.42Å; A811-H895 WeakPolarHBondContact O-CB 3.43Å; A811-A898 HydrophobicContact CB-CB 3.72Å
812	V	98.5	Very high	96.5	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-63.3	-44.4	179.3	175.1	0	0	0	0	110.9	S808 A814 C816 A899 V902 M962 I982 F986	S808-V812 PolarHBondContact O-N 3.1Å; V812-A814 PolarHBondContact O-N 3.44Å; V812-C816 WeakPolarHBondContact O-CB 3.35Å; V812-C816 PolarHBondContact O-N 3.15Å; V812-C816 PolarHBondContact O-SG 3.31Å; V812-A899 HydrophobicContact CG2-CB 4.07Å; V812-V902 HydrophobicContact CG2-CB 3.82Å; V812-V902 HydrophobicContact CG2-CG1 3.82Å; V812-V902 HydrophobicContact CG2-CG2 4.07Å; V812-M962 HydrophobicContact CB-CG 3.69Å; V812-M962 HydrophobicContact CB-SD 3.82Å; V812-M962 HydrophobicContact CG1-CG 3.51Å; V812-M962 HydrophobicContact CG1-SD 3.98Å; V812-M962 HydrophobicContact CG2-SD 4.26Å; V812-I982 HydrophobicContact CG1-CD1 4.27Å; V812-I982 HydrophobicContact CG1-CG2 3.92Å; V812-I982 HydrophobicContact CG2-CG2 3.76Å; V812-F986 HydrophobicContact CG1-CE2 4.24Å
813	T	97.7	Very high	96.3	Very high	19 Å²	19	37.8 Å²	37.8	12%	0.117	20%	0.197	C	C	.	.	H	α-helix	trans	-66.3	-39.2	-178.6	-52.6	0	0	0	0	112.2	Q488 I809 V810 A811 E817 M962	Q488-T813 HydrophobicContact CG-CG2 4.36Å; I809-T813 WeakPolarHBondContact O-CB 3.44Å; I809-T813 PolarHBondContact O-N 3.2Å; I809-T813 VanDerWaalsContact O-N 3.08Å; I809-T813 PolarHBondContact O-OG1 2.76Å; V810-T813 PolarHBondContact O-N 3.17Å; A811-T813 PolarHBondContact O-N 2.76Å; T813-E817 PolarHBondContact O-N 3.37Å; T813-M962 WeakPolarHBondContact OG1-CA 3.42Å; T813-M962 VanDerWaalsContact OG1-CB 3.26Å; T813-M962 WeakPolarHBondContact OG1-CB 3.36Å; T813-M962 WeakPolarHBondContact OG1-CG 3.37Å
814	A	96.7	Very high	96.4	Very high	7 Å²	7	32.6 Å²	32.6	6%	0.058	17%	0.169	C	C	.	.	H	α-helix	trans	-69.6	-48.7	176.3	0	0	0	0	0	111.7	I484 V810 A811 V812 C816 E817 E818 H895	I484-A814 HydrophobicContact CG2-CB 3.67Å; V810-A814 WeakPolarHBondContact O-CB 3.24Å; V810-A814 PolarHBondContact O-N 3.45Å; A811-A814 PolarHBondContact O-N 3.12Å; V812-A814 PolarHBondContact O-N 3.44Å; A814-C816 PolarHBondContact O-N 2.88Å; A814-E817 WeakPolarHBondContact O-CA 3.42Å; A814-E817 WeakPolarHBondContact O-CB 3.48Å; A814-E817 PolarHBondContact O-N 3.04Å; A814-E818 WeakPolarHBondContact O-CG 3.46Å; A814-E818 PolarHBondContact O-N 2.99Å; A814-H895 HydrophobicContact CB-CB 3.88Å; A814-H895 VanDerWaalsContact CB-CG 3.49Å; A814-H895 WeakPolarHBondContact CB-ND1 3.42Å
815	A	97.9	Very high	96.6	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-60.9	-32.8	178.6	0	0	0	0	0	112.5	A811 V819 H895 V896 A899 F986	A811-A815 WeakPolarHBondContact O-CB 3.39Å; A811-A815 PolarHBondContact O-N 3.3Å; A815-V819 WeakPolarHBondContact O-CB 3.29Å; A815-V819 WeakPolarHBondContact O-CG2 3.37Å; A815-V819 PolarHBondContact O-N 3.27Å; A815-V819 VanDerWaalsContact O-N 3.17Å; A815-H895 HydrophobicContact CB-CB 4.04Å; A815-V896 HydrophobicContact CB-CG2 4.09Å; A815-A899 HydrophobicContact CB-CB 3.61Å; A815-F986 HydrophobicContact CB-CD1 3.9Å; A815-F986 HydrophobicContact CB-CE1 3.41Å; A815-F986 VanDerWaalsContact CB-CE1 3.41Å; A815-F986 HydrophobicContact CB-CZ 3.79Å
816	C	98.4	Very high	96.5	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-59.7	-45.1	169.7	-75	0	0	0	0	112.1	V812 A814 R820 S965 L969	V812-C816 WeakPolarHBondContact O-CB 3.35Å; V812-C816 PolarHBondContact O-N 3.15Å; V812-C816 PolarHBondContact O-SG 3.31Å; A814-C816 PolarHBondContact O-N 2.88Å; C816-R820 WeakPolarHBondContact O-CB 3.19Å; C816-R820 PolarHBondContact O-N 3.43Å; C816-R820 VanDerWaalsContact O-N 3.1Å; C816-S965 WeakPolarHBondContact CB-OG 3.5Å; C816-L969 HydrophobicContact CB-CD2 4.19Å; C816-L969 WeakPolarHBondContact O-CD1 3.38Å
817	E	95.9	Very high	96.4	Very high	63 Å²	63	28.4 Å²	28.4	29%	0.294	15%	0.15	S	C	.	.	H	α-helix	trans	-70.9	-47.1	-179.7	-172.2	71.7	159.9	0	0	111.8	T813 A814 V819 R820 T821	T813-E817 PolarHBondContact O-N 3.37Å; A814-E817 WeakPolarHBondContact O-CA 3.42Å; A814-E817 WeakPolarHBondContact O-CB 3.48Å; A814-E817 PolarHBondContact O-N 3.04Å; E817-V819 VanDerWaalsContact C-N 3.33Å; E817-V819 PolarHBondContact O-N 2.81Å; E817-R820 PolarHBondContact O-N 2.74Å; E817-R820 VanDerWaalsContact O-N 3.09Å; E817-R820 IonicContact OE1-CZ 2.71Å; E817-R820 IonicContact OE1-NH2 3.01Å; E817-R820 PolarHBondContact OE1-NH2 3.23Å; E817-R820 IonicContact OE2-CZ 3.62Å; E817-R820 IonicContact OE2-NE 2.78Å; E817-R820 PolarHBondContact OE2-NE 3.46Å; E817-R820 IonicContact OE2-NH2 3.63Å; E817-R820 PolarHBondContact OE2-NH2 2.86Å; E817-T821 HydrophobicContact CG-CG2 4.47Å; E817-T821 PolarHBondContact O-N 3.44Å; E817-T821 PolarHBondContact O-OG1 3.18Å
818	E	96.5	Very high	96.5	Very high	22 Å²	22	24.9 Å²	24.9	10%	0.103	13%	0.128	C	C	.	.	H	α-helix	trans	-48.3	-54	175.8	-70.4	169.7	-176.5	0	0	111.2	A814 R820 S822 D892 F893 I894 H895	A814-E818 WeakPolarHBondContact O-CG 3.46Å; A814-E818 PolarHBondContact O-N 2.99Å; E818-R820 PolarHBondContact O-N 2.67Å; E818-S822 VanDerWaalsContact O-CB 3.23Å; E818-S822 WeakPolarHBondContact O-CB 3.36Å; E818-S822 PolarHBondContact O-N 2.9Å; E818-D892 VanDerWaalsContact CD-O 3.24Å; E818-D892 WeakPolarHBondContact CG-O 3.5Å; E818-F893 HydrophobicContact CB-CD1 4.14Å; E818-F893 WeakPolarHBondContact OE2-CA 3.29Å; E818-I894 PolarHBondContact OE1-N 3.24Å; E818-I894 PolarHBondContact OE2-N 3.34Å; E818-H895 IonicContact OE1-CE1 3.47Å; E818-H895 IonicContact OE1-CG 3.33Å; E818-H895 PolarHBondContact OE1-N 2.86Å; E818-H895 VanDerWaalsContact OE1-N 3.11Å; E818-H895 IonicContact OE1-ND1 3.44Å; E818-H895 PolarHBondContact OE1-ND1 3.31Å; E818-H895 PolarHBondContact OE2-N 3.48Å
819	V	97.8	Very high	96.5	Very high	1 Å²	1	23.2 Å²	23.2	1%	0.006	12%	0.116	C	C	.	.	H	α-helix	trans	-70.2	-32.3	-178.3	178.9	0	0	0	0	112.1	A815 E817 F825 F893 V896 F973 F985 F986 L989	A815-V819 WeakPolarHBondContact O-CB 3.29Å; A815-V819 WeakPolarHBondContact O-CG2 3.37Å; A815-V819 PolarHBondContact O-N 3.27Å; A815-V819 VanDerWaalsContact O-N 3.17Å; E817-V819 VanDerWaalsContact C-N 3.33Å; E817-V819 PolarHBondContact O-N 2.81Å; V819-F825 HydrophobicContact CG1-CD1 4.06Å; V819-F825 HydrophobicContact CG1-CE1 3.72Å; V819-F893 HydrophobicContact CB-CE1 4.44Å; V819-F893 HydrophobicContact CB-CZ 4.43Å; V819-F893 HydrophobicContact CG2-CD1 4.41Å; V819-F893 HydrophobicContact CG2-CE1 3.95Å; V819-F893 HydrophobicContact CG2-CE2 4.37Å; V819-F893 HydrophobicContact CG2-CZ 3.93Å; V819-V896 HydrophobicContact CG2-CG2 3.84Å; V819-F973 HydrophobicContact CG1-CE2 3.97Å; V819-F973 HydrophobicContact CG1-CZ 4.32Å; V819-F985 HydrophobicContact CG1-CZ 4.16Å; V819-F986 HydrophobicContact CG2-CE1 4.35Å; V819-L989 HydrophobicContact CB-CD1 4.46Å; V819-L989 HydrophobicContact CG1-CD1 3.8Å; V819-L989 HydrophobicContact CG2-CD1 3.8Å
820	R	96	Very high	96.4	Very high	101 Å²	101	25 Å²	25	38%	0.381	12%	0.124	S	C	.	.	H	α-helix	trans	-72.9	-33.9	178.5	-168.5	-174.8	69.6	75.3	-3.3	113.2	C816 E817 E818 L969 Y972	C816-R820 WeakPolarHBondContact O-CB 3.19Å; C816-R820 PolarHBondContact O-N 3.43Å; C816-R820 VanDerWaalsContact O-N 3.1Å; E817-R820 PolarHBondContact O-N 2.74Å; E817-R820 VanDerWaalsContact O-N 3.09Å; E817-R820 IonicContact OE1-CZ 2.71Å; E817-R820 IonicContact OE1-NH2 3.01Å; E817-R820 PolarHBondContact OE1-NH2 3.23Å; E817-R820 IonicContact OE2-CZ 3.62Å; E817-R820 IonicContact OE2-NE 2.78Å; E817-R820 PolarHBondContact OE2-NE 3.46Å; E817-R820 IonicContact OE2-NH2 3.63Å; E817-R820 PolarHBondContact OE2-NH2 2.86Å; E818-R820 PolarHBondContact O-N 2.67Å; R820-L969 HydrophobicContact CB-CD1 3.74Å; R820-L969 HydrophobicContact CG-CD1 4.28Å; R820-Y972 HydrophobicContact CG-CD1 4.29Å; R820-Y972 HydrophobicContact CG-CE1 4.39Å
821	T	94.2	Very high	96.3	Very high	80 Å²	80	25 Å²	25	49%	0.491	12%	0.124	S	C	.	.	H	α-helix	trans	-102.6	-9.9	-175.3	60.4	0	0	0	0	114.4	E817 K823	E817-T821 HydrophobicContact CG-CG2 4.47Å; E817-T821 PolarHBondContact O-N 3.44Å; E817-T821 PolarHBondContact O-OG1 3.18Å; T821-K823 PolarHBondContact O-N 2.94Å; T821-K823 VanDerWaalsContact O-N 3.08Å
822	S	95.9	Very high	96.3	Very high	7 Å²	7	24.7 Å²	24.7	5%	0.049	12%	0.122	C	C	.	.			trans	-65.6	109.7	-179.7	-179.6	0	0	0	0	112.6	E818 F825 S826	E818-S822 VanDerWaalsContact O-CB 3.23Å; E818-S822 WeakPolarHBondContact O-CB 3.36Å; E818-S822 PolarHBondContact O-N 2.9Å; S822-F825 WeakPolarHBondContact OG-CB 3.48Å; S822-F825 PolarHBondContact OG-N 3.37Å; S822-S826 PolarHBondContact O-N 3.4Å; S822-S826 PolarHBondContact O-OG 3.4Å
823	K	93.8	Very high	96.1	Very high	125 Å²	125	24.7 Å²	24.7	54%	0.543	12%	0.122	S	C	.	.	H	α-helix	trans	-70.7	-41.2	179	-177.4	-175.6	165.4	-150.9	0	112.2	T821 S826 I827 E886	T821-K823 PolarHBondContact O-N 2.94Å; T821-K823 VanDerWaalsContact O-N 3.08Å; K823-S826 WeakPolarHBondContact O-CB 2.93Å; K823-S826 PolarHBondContact O-N 2.93Å; K823-I827 HydrophobicContact CG-CD1 4.18Å; K823-I827 WeakPolarHBondContact O-CG1 3.26Å; K823-I827 PolarHBondContact O-N 3.43Å; K823-E886 VanDerWaalsContact CD-OE2 3.29Å; K823-E886 WeakPolarHBondContact CD-OE2 3.36Å; K823-E886 WeakPolarHBondContact CE-OE1 3.36Å; K823-E886 WeakPolarHBondContact CG-OE2 3.34Å; K823-E886 IonicContact NZ-OE1 2.81Å; K823-E886 PolarHBondContact NZ-OE1 2.89Å; K823-E886 IonicContact NZ-OE2 2.62Å
824	G	94.3	Very high	96	Very high	2 Å²	2	23.8 Å²	23.8	2%	0.021	12%	0.117	C	C	.	.	H	α-helix	trans	-65.5	-36.9	174.8	0	0	0	0	0	113	I827 F828	G824-I827 PolarHBondContact O-N 3Å; G824-F828 PolarHBondContact O-N 3.39Å
825	F	97.4	Very high	95.8	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-64.8	-42.5	171.5	-175.1	-128.5	0	0	0	111.4	V819 S822 I827 F828 L829 F853 L856 F889 F893 F973 L989 F992	V819-F825 HydrophobicContact CG1-CD1 4.06Å; V819-F825 HydrophobicContact CG1-CE1 3.72Å; S822-F825 WeakPolarHBondContact OG-CB 3.48Å; S822-F825 PolarHBondContact OG-N 3.37Å; F825-I827 PolarHBondContact O-N 2.82Å; F825-F828 WeakPolarHBondContact O-CB 3.43Å; F825-F828 PolarHBondContact O-N 3.49Å; F825-F828 VanDerWaalsContact O-N 3.17Å; F825-L829 HydrophobicContact CD1-CD1 4.04Å; F825-L829 HydrophobicContact CD1-CG 4.47Å; F825-L829 HydrophobicContact CD2-CG 4.33Å; F825-L829 HydrophobicContact CE1-CD1 3.68Å; F825-L829 HydrophobicContact CE1-CD2 4.45Å; F825-L829 HydrophobicContact CE1-CG 4.19Å; F825-L829 HydrophobicContact CE2-CD1 4.41Å; F825-L829 HydrophobicContact CE2-CD2 3.89Å; F825-L829 HydrophobicContact CE2-CG 4.02Å; F825-L829 HydrophobicContact CZ-CD1 3.88Å; F825-L829 HydrophobicContact CZ-CD2 3.79Å; F825-L829 HydrophobicContact CZ-CG 3.95Å; F825-L829 WeakPolarHBondContact O-CG 3.48Å; F825-L829 PolarHBondContact O-N 2.87Å; F825-F853 AromaticContact CE1-CE2 3.87Å; F825-F853 HydrophobicContact CE1-CE2 3.87Å; F825-F853 AromaticContact CE1-CZ 3.84Å; F825-F853 HydrophobicContact CE1-CZ 3.84Å; F825-F853 HydrophobicContact CZ-CD2 4.35Å; F825-F853 HydrophobicContact CZ-CE1 4.39Å; F825-F853 AromaticContact CZ-CE2 3.82Å; F825-F853 HydrophobicContact CZ-CE2 3.82Å; F825-F853 AromaticContact CZ-CZ 3.85Å; F825-F853 HydrophobicContact CZ-CZ 3.85Å; F825-L856 HydrophobicContact CE2-CD1 3.99Å; F825-L856 HydrophobicContact CZ-CD1 3.96Å; F825-F889 HydrophobicContact CB-CD2 3.65Å; F825-F889 HydrophobicContact CB-CE2 3.65Å; F825-F889 HydrophobicContact CB-CG 4.33Å; F825-F889 HydrophobicContact CB-CZ 4.3Å; F825-F889 HydrophobicContact CD2-CD2 4.49Å; F825-F889 AromaticContact CD2-CE2 3.64Å; F825-F889 HydrophobicContact CD2-CE2 3.64Å; F825-F889 AromaticContact CD2-CZ 3.98Å; F825-F889 HydrophobicContact CD2-CZ 3.98Å; F825-F889 HydrophobicContact CG-CD2 4.48Å; F825-F889 HydrophobicContact CG-CE2 4.05Å; F825-F893 HydrophobicContact CB-CZ 3.79Å; F825-F893 AromaticContact CD1-CZ 3.87Å; F825-F893 HydrophobicContact CD1-CZ 3.87Å; F825-F893 HydrophobicContact CD2-CE2 4.31Å; F825-F893 HydrophobicContact CD2-CZ 4.21Å; F825-F893 HydrophobicContact CG-CE2 4.25Å; F825-F893 AromaticContact CG-CZ 3.7Å; F825-F893 HydrophobicContact CG-CZ 3.7Å; F825-F973 HydrophobicContact CE1-CZ 4.37Å; F825-L989 HydrophobicContact CE1-CD2 4.38Å; F825-L989 HydrophobicContact CE2-CD2 4.25Å; F825-L989 HydrophobicContact CZ-CD2 3.67Å; F825-F992 AromaticContact CD2-CE1 3.83Å; F825-F992 HydrophobicContact CD2-CE1 3.83Å; F825-F992 HydrophobicContact CD2-CZ 4.34Å; F825-F992 HydrophobicContact CE2-CD1 4.24Å; F825-F992 AromaticContact CE2-CE1 3.55Å; F825-F992 HydrophobicContact CE2-CE1 3.55Å; F825-F992 HydrophobicContact CE2-CZ 4.11Å
826	S	95.8	Very high	95.6	Very high	24 Å²	24	23.5 Å²	23.5	17%	0.168	11%	0.114	C	C	.	.	H	α-helix	trans	-55.4	-48.8	174.1	-61	0	0	0	0	111.7	S822 K823 F828 L829 E830	S822-S826 PolarHBondContact O-N 3.4Å; S822-S826 PolarHBondContact O-OG 3.4Å; K823-S826 WeakPolarHBondContact O-CB 2.93Å; K823-S826 PolarHBondContact O-N 2.93Å; S826-F828 VanDerWaalsContact C-N 3.35Å; S826-F828 PolarHBondContact O-N 3.37Å; S826-L829 PolarHBondContact O-N 3.49Å; S826-L829 VanDerWaalsContact O-N 3.17Å; S826-E830 WeakPolarHBondContact O-CG 3.44Å; S826-E830 PolarHBondContact O-N 3.36Å
827	I	95.1	Very high	95.3	Very high	27 Å²	27	23.8 Å²	23.8	14%	0.138	12%	0.115	C	C	.	.	H	α-helix	trans	-63.2	-39	177.2	-67	162.4	0	0	0	111.6	K823 G824 F825 L829 E830 L831 E886	K823-I827 HydrophobicContact CG-CD1 4.18Å; K823-I827 WeakPolarHBondContact O-CG1 3.26Å; K823-I827 PolarHBondContact O-N 3.43Å; G824-I827 PolarHBondContact O-N 3Å; F825-I827 PolarHBondContact O-N 2.82Å; I827-L829 VanDerWaalsContact C-N 3.34Å; I827-E830 PolarHBondContact O-N 3.44Å; I827-L831 VanDerWaalsContact O-CB 3.32Å; I827-L831 WeakPolarHBondContact O-CB 3.45Å; I827-L831 PolarHBondContact O-N 3.46Å; I827-E886 HydrophobicContact CD1-CB 4.21Å; I827-E886 HydrophobicContact CD1-CG 3.79Å
828	F	96.5	Very high	95	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-61.5	-43.1	173.9	-174.7	-83.9	0	0	0	111.7	G824 F825 S826 L831 L832 L856 L859 M872 L875 I879 F889 F992 Y996	G824-F828 PolarHBondContact O-N 3.39Å; F825-F828 WeakPolarHBondContact O-CB 3.43Å; F825-F828 PolarHBondContact O-N 3.49Å; F825-F828 VanDerWaalsContact O-N 3.17Å; S826-F828 VanDerWaalsContact C-N 3.35Å; S826-F828 PolarHBondContact O-N 3.37Å; F828-L831 PolarHBondContact O-N 3.23Å; F828-L832 HydrophobicContact CE1-CB 4.49Å; F828-L832 HydrophobicContact CE1-CD2 4.21Å; F828-L832 WeakPolarHBondContact O-CB 3.44Å; F828-L832 PolarHBondContact O-N 3.35Å; F828-L856 HydrophobicContact CD1-CD2 4.31Å; F828-L856 HydrophobicContact CE1-CD2 3.86Å; F828-L859 HydrophobicContact CE1-CD1 3.88Å; F828-L859 HydrophobicContact CZ-CD1 3.63Å; F828-M872 HydrophobicContact CE2-CE 3.95Å; F828-M872 HydrophobicContact CE2-SD 4.26Å; F828-M872 HydrophobicContact CZ-CE 3.84Å; F828-M872 HydrophobicContact CZ-SD 3.81Å; F828-L875 HydrophobicContact CE2-CB 3.85Å; F828-L875 HydrophobicContact CE2-CD1 4.21Å; F828-L875 HydrophobicContact CZ-CB 4.36Å; F828-L875 HydrophobicContact CZ-CD1 3.87Å; F828-I879 HydrophobicContact CB-CD1 4.03Å; F828-I879 HydrophobicContact CD2-CD1 3.56Å; F828-I879 HydrophobicContact CE2-CD1 4.5Å; F828-I879 HydrophobicContact CG-CD1 4.26Å; F828-F889 HydrophobicContact CB-CE1 4Å; F828-F889 HydrophobicContact CB-CZ 4.1Å; F828-F889 HydrophobicContact CG-CE1 4.47Å; F828-F889 HydrophobicContact CG-CZ 4.35Å; F828-F992 HydrophobicContact CD1-CE2 4.15Å; F828-F992 AromaticContact CD1-CZ 3.74Å; F828-F992 HydrophobicContact CD1-CZ 3.74Å; F828-F992 AromaticContact CE1-CE2 3.54Å; F828-F992 HydrophobicContact CE1-CE2 3.54Å; F828-F992 AromaticContact CE1-CZ 3.64Å; F828-F992 HydrophobicContact CE1-CZ 3.64Å; F828-F992 HydrophobicContact CE2-CE2 4.43Å; F828-F992 HydrophobicContact CE2-CZ 4.47Å; F828-F992 HydrophobicContact CG-CZ 4.24Å; F828-F992 AromaticContact CZ-CE2 3.71Å; F828-F992 HydrophobicContact CZ-CE2 3.71Å; F828-F992 HydrophobicContact CZ-CZ 4.03Å; F828-Y996 HydrophobicContact CD2-CD2 4.43Å; F828-Y996 AromaticContact CD2-CE2 3.62Å; F828-Y996 HydrophobicContact CD2-CE2 3.62Å; F828-Y996 HydrophobicContact CE2-CD2 4.26Å; F828-Y996 AromaticContact CE2-CE2 3.76Å; F828-Y996 HydrophobicContact CE2-CE2 3.76Å; F828-Y996 HydrophobicContact CG-CE2 4.42Å
829	L	96.8	Very high	94.7	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-64.3	-43	179.4	-69.6	177.7	0	0	0	112.1	F659 W660 F825 S826 I827 L833 Y851 F853 L856 F973	F659-L829 HydrophobicContact CD1-CD1 4.36Å; F659-L829 HydrophobicContact CE1-CB 3.76Å; F659-L829 HydrophobicContact CE1-CD1 3.76Å; F659-L829 HydrophobicContact CE1-CG 4.45Å; F659-L829 HydrophobicContact CZ-CB 3.91Å; F659-L829 HydrophobicContact CZ-CD1 4.02Å; W660-L829 HydrophobicContact CH2-CB 4.32Å; W660-L829 HydrophobicContact CH2-CD2 4.39Å; W660-L829 HydrophobicContact CZ3-CB 4.45Å; F825-L829 HydrophobicContact CD1-CD1 4.04Å; F825-L829 HydrophobicContact CD1-CG 4.47Å; F825-L829 HydrophobicContact CD2-CG 4.33Å; F825-L829 HydrophobicContact CE1-CD1 3.68Å; F825-L829 HydrophobicContact CE1-CD2 4.45Å; F825-L829 HydrophobicContact CE1-CG 4.19Å; F825-L829 HydrophobicContact CE2-CD1 4.41Å; F825-L829 HydrophobicContact CE2-CD2 3.89Å; F825-L829 HydrophobicContact CE2-CG 4.02Å; F825-L829 HydrophobicContact CZ-CD1 3.88Å; F825-L829 HydrophobicContact CZ-CD2 3.79Å; F825-L829 HydrophobicContact CZ-CG 3.95Å; F825-L829 WeakPolarHBondContact O-CG 3.48Å; F825-L829 PolarHBondContact O-N 2.87Å; S826-L829 PolarHBondContact O-N 3.49Å; S826-L829 VanDerWaalsContact O-N 3.17Å; I827-L829 VanDerWaalsContact C-N 3.34Å; L829-L833 WeakPolarHBondContact O-CB 3.36Å; L829-L833 PolarHBondContact O-N 2.87Å; L829-Y851 WeakPolarHBondContact CA-OH 3.27Å; L829-Y851 HydrophobicContact CD2-CE2 4.13Å; L829-Y851 WeakPolarHBondContact CD2-OH 3.49Å; L829-Y851 PolarHBondContact O-OH 2.9Å; L829-F853 HydrophobicContact CD1-CE1 3.76Å; L829-F853 HydrophobicContact CD1-CZ 3.68Å; L829-F853 HydrophobicContact CD2-CD1 4.09Å; L829-F853 HydrophobicContact CD2-CE1 3.54Å; L829-F853 HydrophobicContact CD2-CZ 4.14Å; L829-F853 HydrophobicContact CG-CE1 4.32Å; L829-L856 HydrophobicContact CD2-CD1 4.27Å; L829-L856 HydrophobicContact CD2-CD2 3.97Å; L829-F973 HydrophobicContact CD1-CE1 3.83Å; L829-F973 HydrophobicContact CD1-CZ 4.47Å
830	E	95.5	Very high	94.3	Very high	36 Å²	36	21.3 Å²	21.3	17%	0.168	10%	0.104	C	C	.	.	H	α-helix	trans	-63.9	-45.4	174.6	-68.6	-171.4	137.1	0	0	112.2	F659 S663 E664 L668 S826 I827 L832 L833 L834	F659-E830 HydrophobicContact CZ-CG 4.25Å; S663-E830 WeakPolarHBondContact CA-OE1 3.5Å; S663-E830 WeakPolarHBondContact CB-OE1 3.2Å; E664-E830 PolarHBondContact N-OE1 3.19Å; L668-E830 HydrophobicContact CD1-CB 3.65Å; S826-E830 WeakPolarHBondContact O-CG 3.44Å; S826-E830 PolarHBondContact O-N 3.36Å; I827-E830 PolarHBondContact O-N 3.44Å; E830-L832 PolarHBondContact O-N 2.9Å; E830-L833 WeakPolarHBondContact O-CB 3.37Å; E830-L833 PolarHBondContact O-N 3.11Å; E830-L833 VanDerWaalsContact O-N 3.14Å; E830-L834 PolarHBondContact O-N 3.02Å
831	L	95.6	Very high	93.5	Very high	5 Å²	5	17.7 Å²	17.7	3%	0.026	9%	0.094	C	C	.	.	H	α-helix	trans	-62.3	-44	179	-175.8	64.6	0	0	0	111	L668 L673 I827 F828 L833 L834 V835 L875 V878 I879	L668-L831 HydrophobicContact CB-CD1 4.36Å; L668-L831 HydrophobicContact CD1-CB 4.01Å; L668-L831 HydrophobicContact CD1-CD1 4.45Å; L673-L831 HydrophobicContact CD2-CD1 3.93Å; I827-L831 VanDerWaalsContact O-CB 3.32Å; I827-L831 WeakPolarHBondContact O-CB 3.45Å; I827-L831 PolarHBondContact O-N 3.46Å; F828-L831 PolarHBondContact O-N 3.23Å; L831-L833 VanDerWaalsContact C-N 3.32Å; L831-L833 PolarHBondContact O-N 3.35Å; L831-L834 PolarHBondContact O-N 3.37Å; L831-V835 HydrophobicContact CD1-CG2 4.3Å; L831-V835 HydrophobicContact CG-CG2 4.39Å; L831-V835 WeakPolarHBondContact O-CB 3.25Å; L831-V835 WeakPolarHBondContact O-CG2 3.17Å; L831-V835 PolarHBondContact O-N 2.91Å; L831-L875 HydrophobicContact CB-CD2 4.45Å; L831-L875 HydrophobicContact CD2-CB 4.46Å; L831-L875 HydrophobicContact CD2-CD2 3.74Å; L831-L875 HydrophobicContact CG-CD2 3.67Å; L831-V878 HydrophobicContact CD1-CG1 4.02Å; L831-V878 HydrophobicContact CD2-CB 4.11Å; L831-V878 HydrophobicContact CD2-CG1 3.73Å; L831-I879 HydrophobicContact CD2-CD1 4.16Å; L831-I879 HydrophobicContact CD2-CG1 3.78Å
832	L	96.2	Very high	92.2	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-65.6	-34.4	174.7	175.6	60.3	0	0	0	112	W646 F828 E830 G836 Y851 I855 L856 L859 L875	W646-L832 WeakPolarHBondContact CZ3-O 3.37Å; F828-L832 HydrophobicContact CE1-CB 4.49Å; F828-L832 HydrophobicContact CE1-CD2 4.21Å; F828-L832 WeakPolarHBondContact O-CB 3.44Å; F828-L832 PolarHBondContact O-N 3.35Å; E830-L832 PolarHBondContact O-N 2.9Å; L832-G836 PolarHBondContact O-N 2.9Å; L832-Y851 HydrophobicContact CD2-CE1 4.45Å; L832-Y851 HydrophobicContact CD2-CE2 3.94Å; L832-Y851 WeakPolarHBondContact CD2-OH 3.47Å; L832-Y851 HydrophobicContact CG-CE1 4.17Å; L832-I855 HydrophobicContact CD2-CG2 4.22Å; L832-L856 HydrophobicContact CD2-CD2 3.63Å; L832-L859 HydrophobicContact CD1-CD1 4.36Å; L832-L859 HydrophobicContact CD1-CD2 3.65Å; L832-L859 HydrophobicContact CD2-CD1 3.81Å; L832-L859 HydrophobicContact CD2-CD2 4.1Å; L832-L875 HydrophobicContact CB-CD1 4.47Å; L832-L875 HydrophobicContact CD1-CD1 4.05Å
833	L	94.8	Very high	90.4	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-64.4	-44.2	175.1	-168	62.6	0	0	0	111.1	W646 W660 E665 L829 E830 L831 N837 A848 Y849 Y851	W646-L833 HydrophobicContact CH2-CD1 3.99Å; W646-L833 HydrophobicContact CZ3-CD1 4.31Å; W660-L833 HydrophobicContact CE3-CD2 3.89Å; W660-L833 HydrophobicContact CZ3-CD2 4.01Å; E665-L833 VanDerWaalsContact CD-CD2 3.41Å; E665-L833 VanDerWaalsContact CD-CG 3.46Å; E665-L833 HydrophobicContact CG-CB 3.99Å; E665-L833 HydrophobicContact CG-CD2 4.04Å; E665-L833 HydrophobicContact CG-CG 4.08Å; E665-L833 WeakPolarHBondContact OE1-CD2 3.49Å; E665-L833 WeakPolarHBondContact OE2-CG 3.48Å; L829-L833 WeakPolarHBondContact O-CB 3.36Å; L829-L833 PolarHBondContact O-N 2.87Å; E830-L833 WeakPolarHBondContact O-CB 3.37Å; E830-L833 PolarHBondContact O-N 3.11Å; E830-L833 VanDerWaalsContact O-N 3.14Å; L831-L833 VanDerWaalsContact C-N 3.32Å; L831-L833 PolarHBondContact O-N 3.35Å; L833-N837 WeakPolarHBondContact O-CB 3.25Å; L833-N837 VanDerWaalsContact O-CG 3.25Å; L833-N837 PolarHBondContact O-N 3.42Å; L833-N837 PolarHBondContact O-ND2 3.48Å; L833-N837 VanDerWaalsContact O-ND2 3.07Å; L833-A848 HydrophobicContact CD1-CB 3.96Å; L833-Y849 WeakPolarHBondContact CD2-O 3.41Å; L833-Y851 HydrophobicContact CB-CE1 3.86Å; L833-Y851 HydrophobicContact CD1-CD1 3.58Å; L833-Y851 HydrophobicContact CD1-CE1 3.79Å; L833-Y851 HydrophobicContact CG-CE1 4.4Å
834	L	94.2	Very high	88.8	Confident	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-60.8	-53.3	173.8	174.6	62.6	0	0	0	111.4	Y635 E665 L668 K669 L673 F674 E830 L831 N837 Y838	Y635-L834 WeakPolarHBondContact OH-CD1 3.21Å; E665-L834 HydrophobicContact CB-CB 4.1Å; E665-L834 HydrophobicContact CB-CD1 4.47Å; E665-L834 HydrophobicContact CG-CB 4.1Å; L668-L834 HydrophobicContact CB-CD2 3.9Å; K669-L834 HydrophobicContact CG-CD1 3.85Å; K669-L834 HydrophobicContact CG-CD2 4.06Å; L673-L834 HydrophobicContact CD2-CD2 4.11Å; F674-L834 HydrophobicContact CE1-CD1 4.4Å; F674-L834 HydrophobicContact CZ-CD1 4.26Å; E830-L834 PolarHBondContact O-N 3.02Å; L831-L834 PolarHBondContact O-N 3.37Å; L834-N837 PolarHBondContact O-N 3.29Å; L834-Y838 PolarHBondContact O-N 3.29Å
835	V	93.8	Very high	87.2	Confident	1 Å²	1	26 Å²	26	1%	0.006	14%	0.144	C	C	.	.	H	α-helix	trans	-63.4	-45.8	-176	166.9	0	0	0	0	111.4	L673 L677 L831 Y838 M839 L871 L875	L673-V835 HydrophobicContact CD1-CG2 4.32Å; L673-V835 HydrophobicContact CD2-CG2 4.17Å; L677-V835 HydrophobicContact CD1-CB 4.38Å; L677-V835 HydrophobicContact CD1-CG1 3.88Å; L677-V835 HydrophobicContact CD1-CG2 4.17Å; L677-V835 HydrophobicContact CD2-CG1 3.73Å; L677-V835 HydrophobicContact CG-CG1 4.47Å; L831-V835 HydrophobicContact CD1-CG2 4.3Å; L831-V835 HydrophobicContact CG-CG2 4.39Å; L831-V835 WeakPolarHBondContact O-CB 3.25Å; L831-V835 WeakPolarHBondContact O-CG2 3.17Å; L831-V835 PolarHBondContact O-N 2.91Å; V835-Y838 PolarHBondContact O-N 3.06Å; V835-M839 HydrophobicContact CG1-CG 4.39Å; V835-M839 HydrophobicContact CG1-SD 3.74Å; V835-M839 VanDerWaalsContact O-CG 3.29Å; V835-M839 WeakPolarHBondContact O-CG 3.38Å; V835-M839 PolarHBondContact O-N 2.92Å; V835-L871 HydrophobicContact CG1-CD1 3.91Å; V835-L871 HydrophobicContact CG1-CD2 4.41Å; V835-L875 HydrophobicContact CB-CD2 4.25Å; V835-L875 HydrophobicContact CG1-CD2 4.4Å; V835-L875 HydrophobicContact CG2-CD2 3.92Å
836	G	92.4	Very high	85.9	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-68.7	-33.6	177.5	0	0	0	0	0	113.4	W646 L832 Y838 N840	W646-G836 VanDerWaalsContact CH2-C 3.41Å; W646-G836 VanDerWaalsContact CH2-CA 3.46Å; L832-G836 PolarHBondContact O-N 2.9Å; G836-Y838 VanDerWaalsContact C-N 3.35Å; G836-N840 VanDerWaalsContact O-CB 3.24Å; G836-N840 WeakPolarHBondContact O-CB 3.48Å; G836-N840 PolarHBondContact O-N 3.04Å; G836-N840 VanDerWaalsContact O-N 3.08Å; G836-N840 PolarHBondContact O-ND2 3.46Å
837	N	92.2	Very high	85.3	Confident	5 Å²	5	30.8 Å²	30.8	3%	0.027	18%	0.175	C	C	.	.	H	α-helix	trans	-66.6	-36.9	171.7	-83.4	-35.8	0	0	0	111.8	K632 Y635 E665 L833 L834 S841 L847 A848	K632-N837 PolarHBondContact NZ-ND2 3Å; Y635-N837 HydrophobicContact CE2-CB 4.17Å; E665-N837 PolarHBondContact OE2-ND2 3.41Å; L833-N837 WeakPolarHBondContact O-CB 3.25Å; L833-N837 VanDerWaalsContact O-CG 3.25Å; L833-N837 PolarHBondContact O-N 3.42Å; L833-N837 PolarHBondContact O-ND2 3.48Å; L833-N837 VanDerWaalsContact O-ND2 3.07Å; L834-N837 PolarHBondContact O-N 3.29Å; N837-S841 PolarHBondContact O-N 3.16Å; N837-L847 HydrophobicContact CB-CD2 4.31Å; N837-A848 PolarHBondContact ND2-O 3.46Å; N837-A848 PolarHBondContact OD1-N 3.13Å
838	Y	90.9	Very high	85.1	Confident	13 Å²	13	29.5 Å²	29.5	5%	0.051	17%	0.168	C	C	.	.	H	α-helix	trans	-67.5	-55.1	174.2	-177.1	-94.1	0	0	0	111.6	Y635 P637 L641 F674 L677 E678 L834 V835 G836 N840 S841	Y635-Y838 AromaticContact CD1-CD2 3.91Å; Y635-Y838 HydrophobicContact CD1-CD2 3.91Å; Y635-Y838 HydrophobicContact CD2-CD2 4.29Å; Y635-Y838 AromaticContact CG-CD2 3.67Å; Y635-Y838 HydrophobicContact CG-CD2 3.67Å; Y635-Y838 HydrophobicContact CG-CE2 4.47Å; P637-Y838 HydrophobicContact CB-CE1 4.2Å; P637-Y838 HydrophobicContact CG-CD1 4.43Å; P637-Y838 HydrophobicContact CG-CE1 3.98Å; P637-Y838 HydrophobicContact CG-CE2 4.19Å; L641-Y838 HydrophobicContact CD1-CD1 4.15Å; L641-Y838 HydrophobicContact CD1-CE1 3.85Å; F674-Y838 HydrophobicContact CB-CE1 4.1Å; F674-Y838 HydrophobicContact CB-CE2 3.9Å; F674-Y838 AromaticContact CD1-CD1 3.82Å; F674-Y838 HydrophobicContact CD1-CD1 3.82Å; F674-Y838 AromaticContact CD1-CD2 3.33Å; F674-Y838 HydrophobicContact CD1-CD2 3.33Å; F674-Y838 AromaticContact CD1-CE1 3.97Å; F674-Y838 HydrophobicContact CD1-CE1 3.97Å; F674-Y838 AromaticContact CD1-CE2 3.51Å; F674-Y838 HydrophobicContact CD1-CE2 3.51Å; F674-Y838 AromaticContact CD1-CG 3.51Å; F674-Y838 HydrophobicContact CD1-CG 3.51Å; F674-Y838 AromaticContact CD1-CZ 3.84Å; F674-Y838 HydrophobicContact CD2-CD2 4.38Å; F674-Y838 HydrophobicContact CD2-CE2 4.05Å; F674-Y838 HydrophobicContact CE1-CD1 4.39Å; F674-Y838 AromaticContact CE1-CD2 3.4Å; F674-Y838 HydrophobicContact CE1-CD2 3.4Å; F674-Y838 VanDerWaalsContact CE1-CD2 3.4Å; F674-Y838 AromaticContact CE1-CE2 4Å; F674-Y838 HydrophobicContact CE1-CE2 4Å; F674-Y838 AromaticContact CE1-CG 3.65Å; F674-Y838 HydrophobicContact CE1-CG 3.65Å; F674-Y838 HydrophobicContact CE2-CD2 4.43Å; F674-Y838 HydrophobicContact CE2-CE2 4.47Å; F674-Y838 AromaticContact CG-CD2 3.87Å; F674-Y838 HydrophobicContact CG-CD2 3.87Å; F674-Y838 HydrophobicContact CG-CE1 4.31Å; F674-Y838 AromaticContact CG-CE2 3.55Å; F674-Y838 HydrophobicContact CG-CE2 3.55Å; F674-Y838 HydrophobicContact CG-CG 4.39Å; F674-Y838 AromaticContact CG-CZ 3.8Å; F674-Y838 AromaticContact CZ-CD2 3.98Å; F674-Y838 HydrophobicContact CZ-CD2 3.98Å; F674-Y838 HydrophobicContact CZ-CE2 4.44Å; L677-Y838 HydrophobicContact CD1-CD1 3.8Å; L677-Y838 HydrophobicContact CD1-CE1 4.36Å; E678-Y838 HydrophobicContact CG-CE1 4.2Å; E678-Y838 PolarHBondContact OE1-OH 2.84Å; L834-Y838 PolarHBondContact O-N 3.29Å; V835-Y838 PolarHBondContact O-N 3.06Å; G836-Y838 VanDerWaalsContact C-N 3.35Å; Y838-N840 VanDerWaalsContact C-N 3.32Å; Y838-N840 PolarHBondContact O-N 3.45Å; Y838-S841 WeakPolarHBondContact O-CB 3.4Å; Y838-S841 PolarHBondContact O-N 2.97Å; Y838-S841 VanDerWaalsContact O-N 3.14Å; Y838-S841 PolarHBondContact O-OG 3.38Å
839	M	89.5	Confident	84.9	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-61.2	-36.4	-176.9	-65.2	175.4	92.8	0	0	113.4	L641 R642 V644 L677 F681 V835 S842 L871	L641-M839 HydrophobicContact CB-CB 4.39Å; L641-M839 HydrophobicContact CD1-CB 4.46Å; L641-M839 HydrophobicContact CD1-CG 4.09Å; R642-M839 HydrophobicContact CB-CE 4.46Å; V644-M839 HydrophobicContact CG2-CB 4.35Å; V644-M839 HydrophobicContact CG2-SD 3.87Å; L677-M839 HydrophobicContact CD1-CG 4.34Å; L677-M839 HydrophobicContact CD2-SD 4.11Å; F681-M839 HydrophobicContact CB-CE 3.48Å; F681-M839 VanDerWaalsContact CB-CE 3.48Å; F681-M839 HydrophobicContact CD2-CE 4.01Å; F681-M839 HydrophobicContact CG-CE 3.77Å; V835-M839 HydrophobicContact CG1-CG 4.39Å; V835-M839 HydrophobicContact CG1-SD 3.74Å; V835-M839 VanDerWaalsContact O-CG 3.29Å; V835-M839 WeakPolarHBondContact O-CG 3.38Å; V835-M839 PolarHBondContact O-N 2.92Å; M839-S842 PolarHBondContact O-OG 2.85Å; M839-L871 HydrophobicContact CE-CD1 4.15Å; M839-L871 HydrophobicContact CE-CD2 4.44Å; M839-L871 HydrophobicContact SD-CD1 3.83Å; M839-L871 HydrophobicContact SD-CD2 3.84Å
840	N	88.6	Confident	84.7	Confident	21 Å²	21	30.3 Å²	30.3	11%	0.112	17%	0.172	C	C	.	.	H	α-helix	trans	-81.3	-10.7	179.7	-71.1	-32.3	0	0	0	114.4	K643 V644 W646 G836 Y838 S842 T843	K643-N840 WeakPolarHBondContact CA-OD1 3.4Å; K643-N840 WeakPolarHBondContact CB-OD1 3.08Å; V644-N840 PolarHBondContact N-OD1 3.42Å; V644-N840 PolarHBondContact O-ND2 3.07Å; W646-N840 PolarHBondContact NE1-ND2 2.75Å; G836-N840 VanDerWaalsContact O-CB 3.24Å; G836-N840 WeakPolarHBondContact O-CB 3.48Å; G836-N840 PolarHBondContact O-N 3.04Å; G836-N840 VanDerWaalsContact O-N 3.08Å; G836-N840 PolarHBondContact O-ND2 3.46Å; Y838-N840 VanDerWaalsContact C-N 3.32Å; Y838-N840 PolarHBondContact O-N 3.45Å; N840-S842 PolarHBondContact O-N 3.29Å; N840-S842 VanDerWaalsContact O-N 3.16Å; N840-T843 PolarHBondContact O-N 2.92Å
841	S	80	Confident	84.7	Confident	25 Å²	25	28.6 Å²	28.6	18%	0.175	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-14	-176.6	67.9	0	0	0	0	114.9	Y635 P637 N837 Y838 T843	Y635-S841 PolarHBondContact O-OG 3.42Å; P637-S841 WeakPolarHBondContact CD-OG 3.36Å; P637-S841 WeakPolarHBondContact CG-OG 3.42Å; N837-S841 PolarHBondContact O-N 3.16Å; Y838-S841 WeakPolarHBondContact O-CB 3.4Å; Y838-S841 PolarHBondContact O-N 2.97Å; Y838-S841 VanDerWaalsContact O-N 3.14Å; Y838-S841 PolarHBondContact O-OG 3.38Å; S841-T843 PolarHBondContact O-N 2.78Å
842	S	66.1	Low	84.7	Confident	55 Å²	55	30.6 Å²	30.6	39%	0.385	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-4.5	168.9	60.3	0	0	0	0	114.4	M839 N840	M839-S842 PolarHBondContact O-OG 2.85Å; N840-S842 PolarHBondContact O-N 3.29Å; N840-S842 VanDerWaalsContact O-N 3.16Å
843	T	58.9	Low	84.7	Confident	62 Å²	62	30.6 Å²	30.6	38%	0.38	17%	0.173	S	C	.	.	S	Bend	trans	-125.9	157.6	-179.8	-51.1	0	0	0	0	109.9	K643 N840 S841 A845	K643-T843 WeakPolarHBondContact CE-OG1 3.35Å; K643-T843 PolarHBondContact NZ-OG1 2.88Å; N840-T843 PolarHBondContact O-N 2.92Å; S841-T843 PolarHBondContact O-N 2.78Å; T843-A845 PolarHBondContact O-N 3Å
844	K	59.4	Low	84.5	Confident	218 Å²	218	33 Å²	33	95%	0.948	18%	0.184	S	C	*	.	S	Bend	trans	-66.8	32.6	170.1	-62.5	-175.2	177.3	-178.8	0	114
845	A	60.9	Low	84.5	Confident	53 Å²	53	33.6 Å²	33.6	44%	0.438	19%	0.187	S	C	.	.	P	Polyproline II helix	trans	-74.7	142.2	176.9	0	0	0	0	0	110.2	T843	T843-A845 PolarHBondContact O-N 3Å
846	S	70	Confident	84.7	Confident	95 Å²	95	33.5 Å²	33.5	66%	0.664	19%	0.187	S	C	*	.	P	Polyproline II helix	trans	-66.5	133.7	165.7	43.8	0	0	0	0	109.7	I648	I648-S846 WeakPolarHBondContact CD1-O 3.44Å
847	L	85	Confident	84.4	Confident	30 Å²	30	34.1 Å²	34.1	16%	0.157	19%	0.191	C	C	.	.	P	Polyproline II helix	trans	-61.5	136.6	175.1	-61	167.4	0	0	0	109.9	K632 Q633 P634 N837	K632-L847 HydrophobicContact CB-CB 4.16Å; K632-L847 HydrophobicContact CB-CD1 3.62Å; K632-L847 HydrophobicContact CD-CB 4.33Å; Q633-L847 VanDerWaalsContact C-CD1 3.47Å; Q633-L847 VanDerWaalsContact O-CD1 3.31Å; Q633-L847 WeakPolarHBondContact O-CD1 3.47Å; P634-L847 HydrophobicContact CB-CD1 4.5Å; N837-L847 HydrophobicContact CB-CD2 4.31Å
848	A	90.6	Very high	84.4	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.208	C	C	.	.	P	Polyproline II helix	trans	-78.2	132.8	-178.5	0	0	0	0	0	110.9	K632 W646 I648 L833 N837	K632-A848 PolarHBondContact NZ-O 3Å; W646-A848 HydrophobicContact CH2-CB 4.16Å; W646-A848 HydrophobicContact CZ2-CB 3.52Å; I648-A848 HydrophobicContact CB-CB 4.38Å; I648-A848 HydrophobicContact CD1-CB 4.02Å; I648-A848 HydrophobicContact CG1-CB 3.87Å; I648-A848 HydrophobicContact CG2-CB 3.81Å; L833-A848 HydrophobicContact CD1-CB 3.96Å; N837-A848 PolarHBondContact ND2-O 3.46Å; N837-A848 PolarHBondContact OD1-N 3.13Å
849	Y	91.4	Very high	84.6	Confident	17 Å²	17	37.6 Å²	37.6	7%	0.067	21%	0.206	C	C	.	.	S	Bend	trans	-87.8	-26.4	166.3	-70.2	-93.7	0	0	0	111.6	L625 L629 K630 Q631 K632 P651 W660 L833	L625-Y849 HydrophobicContact CD1-CE2 4.21Å; L629-Y849 HydrophobicContact CB-CE1 4.22Å; L629-Y849 HydrophobicContact CD1-CD1 4.35Å; L629-Y849 HydrophobicContact CD2-CD1 4.2Å; K630-Y849 WeakPolarHBondContact O-CE1 3.47Å; K630-Y849 PolarHBondContact O-OH 3.43Å; Q631-Y849 WeakPolarHBondContact CA-OH 3.49Å; K632-Y849 HydrophobicContact CD-CD1 4.34Å; K632-Y849 HydrophobicContact CD-CE1 4.18Å; K632-Y849 HydrophobicContact CG-CD1 4.49Å; K632-Y849 HydrophobicContact CG-CE1 3.86Å; K632-Y849 PolarHBondContact N-OH 3.36Å; P651-Y849 HydrophobicContact CG-CD2 3.76Å; P651-Y849 HydrophobicContact CG-CE2 3.95Å; W660-Y849 WeakPolarHBondContact CB-O 3.35Å; L833-Y849 WeakPolarHBondContact CD2-O 3.41Å
850	G	93.1	Very high	84.8	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161	172.6	168.7	0	0	0	0	0	111	I649 W660	I649-G850 PolarHBondContact N-O 3.47Å; W660-G850 VanDerWaalsContact CD2-CA 3.43Å; W660-G850 VanDerWaalsContact CE3-CA 3.5Å
851	Y	95.2	Very high	85	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	160.7	178.5	56.6	-99.7	0	0	0	113	W646 R647 W660 L829 L832 L833 I855 L856	W646-Y851 HydrophobicContact CD2-CD1 4.17Å; W646-Y851 HydrophobicContact CD2-CG 4.25Å; W646-Y851 AromaticContact CE3-CD1 3.33Å; W646-Y851 HydrophobicContact CE3-CD1 3.33Å; W646-Y851 HydrophobicContact CE3-CD2 4.46Å; W646-Y851 AromaticContact CE3-CE1 3.97Å; W646-Y851 HydrophobicContact CE3-CE1 3.97Å; W646-Y851 AromaticContact CE3-CG 3.65Å; W646-Y851 HydrophobicContact CE3-CG 3.65Å; W646-Y851 HydrophobicContact CH2-CD1 4.13Å; W646-Y851 AromaticContact CZ3-CD1 3.31Å; W646-Y851 HydrophobicContact CZ3-CD1 3.31Å; W646-Y851 AromaticContact CZ3-CE1 3.66Å; W646-Y851 HydrophobicContact CZ3-CE1 3.66Å; W646-Y851 HydrophobicContact CZ3-CG 4.13Å; R647-Y851 CarbonylContact O-C 3.5Å; R647-Y851 WeakPolarHBondContact O-CA 3.12Å; R647-Y851 WeakPolarHBondContact O-CB 3.43Å; W660-Y851 HydrophobicContact CH2-CD1 4.12Å; W660-Y851 HydrophobicContact CH2-CD2 4.22Å; W660-Y851 AromaticContact CH2-CE1 3.79Å; W660-Y851 HydrophobicContact CH2-CE1 3.79Å; W660-Y851 AromaticContact CH2-CE2 3.9Å; W660-Y851 HydrophobicContact CH2-CE2 3.9Å; W660-Y851 HydrophobicContact CH2-CG 4.29Å; W660-Y851 AromaticContact CH2-CZ 3.64Å; W660-Y851 VanDerWaalsContact CZ2-O 3.24Å; W660-Y851 WeakPolarHBondContact CZ2-O 3.43Å; W660-Y851 HydrophobicContact CZ3-CD1 4.35Å; W660-Y851 AromaticContact CZ3-CE1 3.94Å; W660-Y851 HydrophobicContact CZ3-CE1 3.94Å; L829-Y851 WeakPolarHBondContact CA-OH 3.27Å; L829-Y851 HydrophobicContact CD2-CE2 4.13Å; L829-Y851 WeakPolarHBondContact CD2-OH 3.49Å; L829-Y851 PolarHBondContact O-OH 2.9Å; L832-Y851 HydrophobicContact CD2-CE1 4.45Å; L832-Y851 HydrophobicContact CD2-CE2 3.94Å; L832-Y851 WeakPolarHBondContact CD2-OH 3.47Å; L832-Y851 HydrophobicContact CG-CE1 4.17Å; L833-Y851 HydrophobicContact CB-CE1 3.86Å; L833-Y851 HydrophobicContact CD1-CD1 3.58Å; L833-Y851 HydrophobicContact CD1-CE1 3.79Å; L833-Y851 HydrophobicContact CG-CE1 4.4Å; Y851-I855 HydrophobicContact CD2-CG2 3.69Å; Y851-I855 HydrophobicContact CE2-CG2 3.95Å; Y851-L856 HydrophobicContact CE2-CD2 4.21Å
852	H	95.3	Very high	85.6	Confident	47 Å²	47	43 Å²	43	22%	0.218	23%	0.231	C	C	.	.			trans	-80.3	143.6	173.9	-64.4	-89.9	0	0	0	113.1	R647 Q854 F975	R647-H852 HydrophobicContact CB-CB 4.27Å; R647-H852 PolarHBondContact O-N 2.84Å; H852-Q854 VanDerWaalsContact C-N 3.26Å; H852-Q854 PolarHBondContact O-N 3.37Å; H852-Q854 VanDerWaalsContact O-N 3.12Å; H852-F975 HydrophobicContact CB-CE1 4.22Å; H852-F975 AromaticContact CE1-CD1 3.66Å; H852-F975 AromaticContact CE1-CE1 3.99Å; H852-F975 AromaticContact CG-CE1 3.87Å; H852-F975 AromaticContact ND1-CD1 3.31Å; H852-F975 VanDerWaalsContact ND1-CD1 3.31Å; H852-F975 WeakPolarHBondContact ND1-CD1 3.46Å; H852-F975 AromaticContact ND1-CE1 3.33Å; H852-F975 VanDerWaalsContact ND1-CE1 3.33Å; H852-F975 WeakPolarHBondContact ND1-CE1 3.29Å
853	F	95.8	Very high	86.8	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-67.8	-9.4	-171.3	-70.3	-4.4	0	0	0	116	W660 F825 L829 I855 L856 F973 F975 F985 L989	W660-F853 HydrophobicContact CH2-CE1 4.36Å; W660-F853 AromaticContact CZ2-CE1 3.93Å; W660-F853 HydrophobicContact CZ2-CE1 3.93Å; F825-F853 AromaticContact CE1-CE2 3.87Å; F825-F853 HydrophobicContact CE1-CE2 3.87Å; F825-F853 AromaticContact CE1-CZ 3.84Å; F825-F853 HydrophobicContact CE1-CZ 3.84Å; F825-F853 HydrophobicContact CZ-CD2 4.35Å; F825-F853 HydrophobicContact CZ-CE1 4.39Å; F825-F853 AromaticContact CZ-CE2 3.82Å; F825-F853 HydrophobicContact CZ-CE2 3.82Å; F825-F853 AromaticContact CZ-CZ 3.85Å; F825-F853 HydrophobicContact CZ-CZ 3.85Å; L829-F853 HydrophobicContact CD1-CE1 3.76Å; L829-F853 HydrophobicContact CD1-CZ 3.68Å; L829-F853 HydrophobicContact CD2-CD1 4.09Å; L829-F853 HydrophobicContact CD2-CE1 3.54Å; L829-F853 HydrophobicContact CD2-CZ 4.14Å; L829-F853 HydrophobicContact CG-CE1 4.32Å; F853-I855 PolarHBondContact O-N 2.9Å; F853-L856 HydrophobicContact CB-CD1 3.69Å; F853-L856 HydrophobicContact CB-CG 4.27Å; F853-L856 HydrophobicContact CD1-CD1 3.89Å; F853-L856 HydrophobicContact CD2-CD1 4.24Å; F853-L856 HydrophobicContact CG-CD1 3.68Å; F853-L856 WeakPolarHBondContact O-CB 3.47Å; F853-L856 VanDerWaalsContact O-CG 3.32Å; F853-L856 WeakPolarHBondContact O-CG 3.25Å; F853-L856 PolarHBondContact O-N 3.26Å; F853-F973 HydrophobicContact CE1-CD1 4.34Å; F853-F973 HydrophobicContact CE2-CD2 4.14Å; F853-F973 HydrophobicContact CE2-CE2 4.19Å; F853-F973 HydrophobicContact CE2-CG 4.31Å; F853-F973 HydrophobicContact CE2-CZ 4.43Å; F853-F973 AromaticContact CZ-CD1 3.66Å; F853-F973 HydrophobicContact CZ-CD1 3.66Å; F853-F973 HydrophobicContact CZ-CD2 4.05Å; F853-F973 AromaticContact CZ-CE1 3.76Å; F853-F973 HydrophobicContact CZ-CE1 3.76Å; F853-F973 HydrophobicContact CZ-CE2 4.13Å; F853-F973 AromaticContact CZ-CG 3.82Å; F853-F973 HydrophobicContact CZ-CG 3.82Å; F853-F973 AromaticContact CZ-CZ 3.99Å; F853-F973 HydrophobicContact CZ-CZ 3.99Å; F853-F975 HydrophobicContact CD1-CE2 4.17Å; F853-F975 AromaticContact CD1-CZ 3.84Å; F853-F975 HydrophobicContact CD1-CZ 3.84Å; F853-F975 AromaticContact CD2-CE2 3.98Å; F853-F975 HydrophobicContact CD2-CE2 3.98Å; F853-F975 HydrophobicContact CD2-CZ 4.47Å; F853-F975 HydrophobicContact CE1-CE2 4.25Å; F853-F975 HydrophobicContact CE1-CZ 4.03Å; F853-F975 HydrophobicContact CE2-CE2 4.08Å; F853-F975 HydrophobicContact CG-CE2 4.03Å; F853-F975 HydrophobicContact CG-CZ 4.08Å; F853-F975 HydrophobicContact CZ-CE2 4.21Å; F853-F975 HydrophobicContact CZ-CZ 4.43Å; F853-F985 HydrophobicContact CD2-CD2 4.34Å; F853-F985 AromaticContact CD2-CE2 3.58Å; F853-F985 HydrophobicContact CD2-CE2 3.58Å; F853-F985 HydrophobicContact CD2-CZ 4.18Å; F853-F985 AromaticContact CE2-CE2 3.68Å; F853-F985 HydrophobicContact CE2-CE2 3.68Å; F853-F985 AromaticContact CE2-CZ 3.96Å; F853-F985 HydrophobicContact CE2-CZ 3.96Å; F853-L989 HydrophobicContact CD2-CD1 4.38Å; F853-L989 HydrophobicContact CD2-CD2 3.77Å; F853-L989 HydrophobicContact CD2-CG 4.22Å; F853-L989 HydrophobicContact CE2-CD2 4.21Å
854	Q	91.9	Very high	88.3	Confident	52 Å²	52	42.7 Å²	42.7	24%	0.243	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-56.8	-16.4	173.5	-74.7	82.4	40.7	0	0	114.7	H852 K858 Y980 D988	H852-Q854 VanDerWaalsContact C-N 3.26Å; H852-Q854 PolarHBondContact O-N 3.37Å; H852-Q854 VanDerWaalsContact O-N 3.12Å; Q854-K858 WeakPolarHBondContact O-CD 3.21Å; Q854-Y980 PolarHBondContact NE2-OH 2.93Å; Q854-D988 WeakPolarHBondContact CG-OD2 3.44Å; Q854-D988 PolarHBondContact NE2-OD2 3.05Å
855	I	94.5	Very high	89.6	Confident	11 Å²	11	36.4 Å²	36.4	6%	0.056	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-78	-25.6	175.7	-167.8	62.6	0	0	0	112.7	V644 W646 L832 Y851 F853 S857 K858 L859	V644-I855 HydrophobicContact CG1-CD1 4.09Å; V644-I855 HydrophobicContact CG1-CG1 3.85Å; W646-I855 HydrophobicContact CB-CB 4.08Å; W646-I855 HydrophobicContact CB-CD1 4.45Å; W646-I855 HydrophobicContact CB-CG1 4.05Å; W646-I855 HydrophobicContact CB-CG2 4.25Å; L832-I855 HydrophobicContact CD2-CG2 4.22Å; Y851-I855 HydrophobicContact CD2-CG2 3.69Å; Y851-I855 HydrophobicContact CE2-CG2 3.95Å; F853-I855 PolarHBondContact O-N 2.9Å; I855-S857 PolarHBondContact O-N 3.14Å; I855-K858 HydrophobicContact CD1-CB 4.48Å; I855-K858 WeakPolarHBondContact O-CA 3.45Å; I855-K858 WeakPolarHBondContact O-CB 3.26Å; I855-K858 PolarHBondContact O-N 3.34Å; I855-L859 HydrophobicContact CG1-CD2 4.21Å; I855-L859 PolarHBondContact O-N 3.22Å
856	L	96.4	Very high	90.8	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.199	C	C	.	.	G	3₁₀ helix	trans	-62.3	-47.3	-166.1	-65.4	176.9	0	0	0	112.8	F825 F828 L829 L832 Y851 F853 K858 L859 L989 F992	F825-L856 HydrophobicContact CE2-CD1 3.99Å; F825-L856 HydrophobicContact CZ-CD1 3.96Å; F828-L856 HydrophobicContact CD1-CD2 4.31Å; F828-L856 HydrophobicContact CE1-CD2 3.86Å; L829-L856 HydrophobicContact CD2-CD1 4.27Å; L829-L856 HydrophobicContact CD2-CD2 3.97Å; L832-L856 HydrophobicContact CD2-CD2 3.63Å; Y851-L856 HydrophobicContact CE2-CD2 4.21Å; F853-L856 HydrophobicContact CB-CD1 3.69Å; F853-L856 HydrophobicContact CB-CG 4.27Å; F853-L856 HydrophobicContact CD1-CD1 3.89Å; F853-L856 HydrophobicContact CD2-CD1 4.24Å; F853-L856 HydrophobicContact CG-CD1 3.68Å; F853-L856 WeakPolarHBondContact O-CB 3.47Å; F853-L856 VanDerWaalsContact O-CG 3.32Å; F853-L856 WeakPolarHBondContact O-CG 3.25Å; F853-L856 PolarHBondContact O-N 3.26Å; L856-K858 PolarHBondContact O-N 3.19Å; L856-L859 WeakPolarHBondContact O-CD1 3.35Å; L856-L859 WeakPolarHBondContact O-CG 3.44Å; L856-L989 HydrophobicContact CD1-CD2 3.97Å; L856-F992 HydrophobicContact CB-CB 4Å; L856-F992 HydrophobicContact CB-CD2 3.53Å; L856-F992 HydrophobicContact CB-CE2 4.02Å; L856-F992 HydrophobicContact CB-CG 3.8Å; L856-F992 HydrophobicContact CD1-CD1 4.42Å; L856-F992 HydrophobicContact CD1-CG 4.4Å; L856-F992 HydrophobicContact CD2-CE2 4.37Å
857	S	86.9	Confident	91.5	Very high	12 Å²	12	38.6 Å²	38.6	8%	0.084	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	-71.3	-9.3	175.9	53	0	0	0	0	113.9	I855 T860	I855-S857 PolarHBondContact O-N 3.14Å; S857-T860 PolarHBondContact O-OG1 3.38Å
858	K	92.1	Very high	91.6	Very high	91 Å²	91	40.3 Å²	40.3	40%	0.396	20%	0.203	S	C	.	.	G	3₁₀ helix	trans	-102.3	0.7	-175.8	-56.4	-169.4	171.6	-140.5	0	114.2	Q854 I855 L856 T860 E861	Q854-K858 WeakPolarHBondContact O-CD 3.21Å; I855-K858 HydrophobicContact CD1-CB 4.48Å; I855-K858 WeakPolarHBondContact O-CA 3.45Å; I855-K858 WeakPolarHBondContact O-CB 3.26Å; I855-K858 PolarHBondContact O-N 3.34Å; L856-K858 PolarHBondContact O-N 3.19Å; K858-T860 PolarHBondContact O-N 3.47Å; K858-T860 VanDerWaalsContact O-N 3.09Å; K858-E861 HydrophobicContact CB-CG 4.19Å; K858-E861 WeakPolarHBondContact CD-OE1 3.42Å; K858-E861 WeakPolarHBondContact CG-OE1 3.4Å; K858-E861 IonicContact NZ-OE1 2.7Å; K858-E861 VanDerWaalsContact O-CB 3.28Å; K858-E861 WeakPolarHBondContact O-CB 3.46Å; K858-E861 PolarHBondContact O-N 2.91Å
859	L	96.1	Very high	91.6	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-11.1	175.8	-57.6	169.4	0	0	0	112.4	F828 L832 I855 L856 L871 M872 L875	F828-L859 HydrophobicContact CE1-CD1 3.88Å; F828-L859 HydrophobicContact CZ-CD1 3.63Å; L832-L859 HydrophobicContact CD1-CD1 4.36Å; L832-L859 HydrophobicContact CD1-CD2 3.65Å; L832-L859 HydrophobicContact CD2-CD1 3.81Å; L832-L859 HydrophobicContact CD2-CD2 4.1Å; I855-L859 HydrophobicContact CG1-CD2 4.21Å; I855-L859 PolarHBondContact O-N 3.22Å; L856-L859 WeakPolarHBondContact O-CD1 3.35Å; L856-L859 WeakPolarHBondContact O-CG 3.44Å; L859-L871 HydrophobicContact CD2-CD2 4.1Å; L859-L871 PolarHBondContact O-N 3.25Å; L859-M872 HydrophobicContact CB-CB 3.98Å; L859-M872 HydrophobicContact CB-SD 3.84Å; L859-M872 HydrophobicContact CD1-SD 3.74Å; L859-M872 HydrophobicContact CG-SD 4.4Å; L859-M872 PolarHBondContact O-N 2.84Å; L859-L875 HydrophobicContact CD1-CD1 3.93Å
860	T	92.4	Very high	91.8	Very high	40 Å²	40	41.3 Å²	41.3	25%	0.245	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-22.7	168	45.5	0	0	0	0	114.5	S857 K858 M872 V995 V999	S857-T860 PolarHBondContact O-OG1 3.38Å; K858-T860 PolarHBondContact O-N 3.47Å; K858-T860 VanDerWaalsContact O-N 3.09Å; T860-M872 HydrophobicContact CG2-CB 4.13Å; T860-V995 HydrophobicContact CG2-CG1 3.49Å; T860-V995 VanDerWaalsContact CG2-CG1 3.49Å; T860-V999 HydrophobicContact CG2-CG2 4.23Å
861	E	92.2	Very high	92	Very high	104 Å²	104	41.3 Å²	41.3	49%	0.486	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-29.1	171	-56.5	177.2	-165.8	0	0	110.6	K858 R863	K858-E861 HydrophobicContact CB-CG 4.19Å; K858-E861 WeakPolarHBondContact CD-OE1 3.42Å; K858-E861 WeakPolarHBondContact CG-OE1 3.4Å; K858-E861 IonicContact NZ-OE1 2.7Å; K858-E861 VanDerWaalsContact O-CB 3.28Å; K858-E861 WeakPolarHBondContact O-CB 3.46Å; K858-E861 PolarHBondContact O-N 2.91Å; E861-R863 PolarHBondContact O-N 2.66Å; E861-R863 VanDerWaalsContact O-N 3.09Å
862	I	92.6	Very high	92.1	Very high	16 Å²	16	41.3 Å²	41.3	8%	0.082	21%	0.207	C	C	.	.	S	Bend	trans	-84.1	82.1	177.6	-52.1	-179.5	0	0	0	109.3	R642 V644 F681 T870 L871	R642-I862 HydrophobicContact CB-CG2 3.81Å; R642-I862 HydrophobicContact CG-CG2 4.43Å; V644-I862 HydrophobicContact CB-CD1 4.39Å; V644-I862 HydrophobicContact CG1-CD1 4.5Å; V644-I862 HydrophobicContact CG2-CD1 3.98Å; F681-I862 HydrophobicContact CD1-CG2 3.96Å; F681-I862 HydrophobicContact CE1-CG2 4.45Å; F681-I862 WeakPolarHBondContact CE1-O 3.46Å; I862-T870 CarbonylContact O-C 3.18Å; I862-T870 VanDerWaalsContact O-CA 3.31Å; I862-T870 WeakPolarHBondContact O-CA 3.42Å; I862-L871 HydrophobicContact CB-CB 3.95Å; I862-L871 HydrophobicContact CB-CD2 4.49Å; I862-L871 HydrophobicContact CD1-CD2 3.97Å; I862-L871 HydrophobicContact CG2-CB 3.96Å; I862-L871 HydrophobicContact CG2-CD2 4.22Å; I862-L871 PolarHBondContact O-N 3.11Å
863	R	91.3	Very high	92.2	Very high	111 Å²	111	39.5 Å²	39.5	42%	0.419	20%	0.199	S	C	.	.	B	Isolated β-bridge	trans	-80	154.6	177.3	-64.9	-166.9	165	-87.1	-9.3	113.6	R642 F681 E861 Q867 K869 T870	R642-R863 WeakPolarHBondContact CD-O 3.47Å; R642-R863 VanDerWaalsContact CZ-O 3.3Å; R642-R863 PolarHBondContact NE-O 3.19Å; F681-R863 WeakPolarHBondContact CD1-O 3.42Å; E861-R863 PolarHBondContact O-N 2.66Å; E861-R863 VanDerWaalsContact O-N 3.09Å; R863-Q867 VanDerWaalsContact CB-OE1 3.22Å; R863-K869 WeakPolarHBondContact CA-O 3.43Å; R863-T870 HydrophobicContact CG-CG2 4.23Å
864	S	90.5	Very high	92.1	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.201	C	C	.	.			trans	-67.6	171	172.4	59.3	0	0	0	0	112.2	Q680 D866 Q867 S868 K869	Q680-S864 CarbonylContact O-C 3.54Å; Q680-S864 WeakPolarHBondContact O-CA 3.28Å; Q680-S864 VanDerWaalsContact O-CB 3.24Å; Q680-S864 WeakPolarHBondContact O-CB 3.43Å; S864-D866 WeakPolarHBondContact CB-OD1 2.77Å; S864-D866 PolarHBondContact OG-OD1 3.45Å; S864-Q867 PolarHBondContact O-N 3Å; S864-Q867 PolarHBondContact O-NE2 3.47Å; S864-Q867 PolarHBondContact OG-N 3.49Å; S864-S868 PolarHBondContact OG-N 3.36Å; S864-S868 VanDerWaalsContact OG-N 3.13Å; S864-K869 PolarHBondContact N-O 3.11Å; S864-K869 PolarHBondContact OG-N 3.4Å; S864-K869 PolarHBondContact OG-O 2.91Å
865	V	88	Confident	92.3	Very high	86 Å²	86	37.4 Å²	37.4	52%	0.521	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-49.1	-179.8	172.1	0	0	0	0	110.5	Q680 Q867	Q680-V865 PolarHBondContact O-N 3.18Å; V865-Q867 PolarHBondContact O-N 3.31Å; V865-Q867 PolarHBondContact O-NE2 2.99Å
866	D	85.2	Confident	92.4	Very high	103 Å²	103	36.9 Å²	36.9	55%	0.551	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.8	-0.3	173.9	68.8	-21.8	0	0	0	114	S864 S868	S864-D866 WeakPolarHBondContact CB-OD1 2.77Å; S864-D866 PolarHBondContact OG-OD1 3.45Å; D866-S868 PolarHBondContact O-N 2.95Å; D866-S868 VanDerWaalsContact O-N 3.08Å; D866-S868 PolarHBondContact OD1-N 3.49Å; D866-S868 PolarHBondContact OD1-OG 3.25Å; D866-S868 VanDerWaalsContact OD1-OG 3.14Å; D866-S868 WeakPolarHBondContact OD2-CB 3.17Å; D866-S868 PolarHBondContact OD2-OG 2.85Å
867	Q	85.4	Confident	92.3	Very high	91 Å²	91	38 Å²	38	43%	0.425	19%	0.193	S	C	.	.	S	Bend	trans	61.3	2.3	-175.5	-48.3	-52.6	-56.8	0	0	116.3	R863 S864 V865 K869	R863-Q867 VanDerWaalsContact CB-OE1 3.22Å; S864-Q867 PolarHBondContact O-N 3Å; S864-Q867 PolarHBondContact O-NE2 3.47Å; S864-Q867 PolarHBondContact OG-N 3.49Å; V865-Q867 PolarHBondContact O-N 3.31Å; V865-Q867 PolarHBondContact O-NE2 2.99Å; Q867-K869 PolarHBondContact O-N 2.73Å
868	S	87.8	Confident	92.6	Very high	66 Å²	66	38 Å²	38	46%	0.462	19%	0.193	S	C	.	.	S	Bend	trans	-70.9	-25.6	-173.5	71.5	0	0	0	0	114.5	S864 D866	S864-S868 PolarHBondContact OG-N 3.36Å; S864-S868 VanDerWaalsContact OG-N 3.13Å; D866-S868 PolarHBondContact O-N 2.95Å; D866-S868 VanDerWaalsContact O-N 3.08Å; D866-S868 PolarHBondContact OD1-N 3.49Å; D866-S868 PolarHBondContact OD1-OG 3.25Å; D866-S868 VanDerWaalsContact OD1-OG 3.14Å; D866-S868 WeakPolarHBondContact OD2-CB 3.17Å; D866-S868 PolarHBondContact OD2-OG 2.85Å
869	K	90.4	Very high	92.7	Very high	35 Å²	35	33.9 Å²	33.9	15%	0.152	18%	0.175	C	C	.	.			trans	-135.2	171.5	-178.8	-76.6	-166.6	172	-171.5	0	111.4	R863 S864 Q867 H873 D877	R863-K869 WeakPolarHBondContact CA-O 3.43Å; S864-K869 PolarHBondContact N-O 3.11Å; S864-K869 PolarHBondContact OG-N 3.4Å; S864-K869 PolarHBondContact OG-O 2.91Å; Q867-K869 PolarHBondContact O-N 2.73Å; K869-H873 HydrophobicContact CB-CB 3.96Å; K869-H873 HydrophobicContact CD-CB 4.05Å; K869-H873 HydrophobicContact CG-CB 4.04Å; K869-D877 IonicContact NZ-OD2 2.69Å; K869-D877 PolarHBondContact NZ-OD2 3.42Å
870	T	95.8	Very high	92.5	Very high	2 Å²	2	35.1 Å²	35.1	1%	0.012	18%	0.183	C	C	.	.	B	Isolated β-bridge	trans	-123.1	167.1	170.4	74.1	0	0	0	0	110.4	I862 R863 M872 H873 V874	I862-T870 CarbonylContact O-C 3.18Å; I862-T870 VanDerWaalsContact O-CA 3.31Å; I862-T870 WeakPolarHBondContact O-CA 3.42Å; R863-T870 HydrophobicContact CG-CG2 4.23Å; T870-M872 PolarHBondContact O-N 2.79Å; T870-M872 VanDerWaalsContact OG1-CB 3.3Å; T870-M872 WeakPolarHBondContact OG1-CB 3.37Å; T870-M872 PolarHBondContact OG1-N 3.49Å; T870-H873 PolarHBondContact N-ND1 2.96Å; T870-H873 WeakPolarHBondContact O-CB 3.46Å; T870-H873 PolarHBondContact O-N 3.34Å; T870-H873 PolarHBondContact OG1-N 2.87Å; T870-H873 PolarHBondContact OG1-ND1 3.02Å; T870-V874 PolarHBondContact O-N 3.32Å
871	L	96.5	Very high	92.3	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-58.4	-31.8	176	-168.4	61.3	0	0	0	110.8	V644 L677 F681 V835 M839 L859 I862 V874 L875	V644-L871 HydrophobicContact CG2-CD2 3.86Å; L677-L871 HydrophobicContact CD2-CD1 3.75Å; F681-L871 HydrophobicContact CD2-CD1 4.19Å; F681-L871 HydrophobicContact CE1-CB 4.14Å; F681-L871 HydrophobicContact CE2-CD1 3.82Å; F681-L871 HydrophobicContact CZ-CB 4.18Å; F681-L871 HydrophobicContact CZ-CD1 4.02Å; V835-L871 HydrophobicContact CG1-CD1 3.91Å; V835-L871 HydrophobicContact CG1-CD2 4.41Å; M839-L871 HydrophobicContact CE-CD1 4.15Å; M839-L871 HydrophobicContact CE-CD2 4.44Å; M839-L871 HydrophobicContact SD-CD1 3.83Å; M839-L871 HydrophobicContact SD-CD2 3.84Å; L859-L871 HydrophobicContact CD2-CD2 4.1Å; L859-L871 PolarHBondContact O-N 3.25Å; I862-L871 HydrophobicContact CB-CB 3.95Å; I862-L871 HydrophobicContact CB-CD2 4.49Å; I862-L871 HydrophobicContact CD1-CD2 3.97Å; I862-L871 HydrophobicContact CG2-CB 3.96Å; I862-L871 HydrophobicContact CG2-CD2 4.22Å; I862-L871 PolarHBondContact O-N 3.11Å; L871-V874 PolarHBondContact O-N 3Å; L871-L875 HydrophobicContact CG-CD1 4.15Å; L871-L875 HydrophobicContact CG-CG 4.49Å; L871-L875 WeakPolarHBondContact O-CB 3.2Å; L871-L875 WeakPolarHBondContact O-CD1 3.45Å; L871-L875 VanDerWaalsContact O-CG 3.24Å; L871-L875 WeakPolarHBondContact O-CG 3.48Å; L871-L875 PolarHBondContact O-N 3.36Å
872	M	97.2	Very high	92.2	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-57.5	-46.2	170.1	-159.5	64.7	-167	0	0	113.1	F828 L859 T860 T870 V874 I876 F992 V995 Y996 V999	F828-M872 HydrophobicContact CE2-CE 3.95Å; F828-M872 HydrophobicContact CE2-SD 4.26Å; F828-M872 HydrophobicContact CZ-CE 3.84Å; F828-M872 HydrophobicContact CZ-SD 3.81Å; L859-M872 HydrophobicContact CB-CB 3.98Å; L859-M872 HydrophobicContact CB-SD 3.84Å; L859-M872 HydrophobicContact CD1-SD 3.74Å; L859-M872 HydrophobicContact CG-SD 4.4Å; L859-M872 PolarHBondContact O-N 2.84Å; T860-M872 HydrophobicContact CG2-CB 4.13Å; T870-M872 PolarHBondContact O-N 2.79Å; T870-M872 VanDerWaalsContact OG1-CB 3.3Å; T870-M872 WeakPolarHBondContact OG1-CB 3.37Å; T870-M872 PolarHBondContact OG1-N 3.49Å; M872-V874 VanDerWaalsContact C-N 3.31Å; M872-V874 PolarHBondContact O-N 3.43Å; M872-I876 HydrophobicContact CE-CD1 3.97Å; M872-I876 HydrophobicContact CG-CD1 4.23Å; M872-I876 WeakPolarHBondContact O-CB 3.41Å; M872-I876 WeakPolarHBondContact O-CG1 3.22Å; M872-I876 PolarHBondContact O-N 2.91Å; M872-F992 HydrophobicContact CE-CD2 4Å; M872-F992 HydrophobicContact CE-CE2 3.47Å; M872-F992 VanDerWaalsContact CE-CE2 3.47Å; M872-F992 HydrophobicContact CE-CZ 4.29Å; M872-F992 HydrophobicContact SD-CE2 4.26Å; M872-V995 HydrophobicContact CG-CG1 4.21Å; M872-Y996 HydrophobicContact CE-CD2 3.21Å; M872-Y996 HydrophobicContact CE-CE2 3.99Å; M872-Y996 HydrophobicContact CE-CG 3.73Å; M872-V999 HydrophobicContact CB-CG1 4.33Å; M872-V999 HydrophobicContact CB-CG2 4.33Å; M872-V999 HydrophobicContact CG-CB 4.19Å; M872-V999 HydrophobicContact CG-CG1 4.14Å; M872-V999 HydrophobicContact CG-CG2 4.04Å
873	H	96.4	Very high	92	Very high	9 Å²	9	40.2 Å²	40.2	4%	0.042	21%	0.207	C	C	.	.	H	α-helix	trans	-61.1	-42.1	178.6	-71.1	62	0	0	0	111.2	K869 T870 I876 D877 V999 E1002 N1003	K869-H873 HydrophobicContact CB-CB 3.96Å; K869-H873 HydrophobicContact CD-CB 4.05Å; K869-H873 HydrophobicContact CG-CB 4.04Å; T870-H873 PolarHBondContact N-ND1 2.96Å; T870-H873 WeakPolarHBondContact O-CB 3.46Å; T870-H873 PolarHBondContact O-N 3.34Å; T870-H873 PolarHBondContact OG1-N 2.87Å; T870-H873 PolarHBondContact OG1-ND1 3.02Å; H873-I876 PolarHBondContact O-N 3.46Å; H873-D877 PolarHBondContact O-N 2.67Å; H873-V999 VanDerWaalsContact CA-CG1 3.49Å; H873-V999 HydrophobicContact CB-CG1 4.05Å; H873-V999 WeakPolarHBondContact ND1-CG1 3.47Å; H873-E1002 IonicContact CE1-OE2 2.72Å; H873-E1002 PolarHBondContact CE1-OE2 3.27Å; H873-E1002 IonicContact NE2-OE2 2.69Å; H873-E1002 PolarHBondContact NE2-OE2 2.98Å; H873-N1003 PolarHBondContact CD2-OD1 3.25Å; H873-N1003 VanDerWaalsContact CD2-OD1 3.3Å; H873-N1003 PolarHBondContact O-ND2 3.42Å
874	V	95.2	Very high	91.9	Very high	6 Å²	6	38.8 Å²	38.8	4%	0.036	21%	0.212	C	C	.	.	H	α-helix	trans	-73.4	-41.7	-175.7	176.7	0	0	0	0	111.4	I676 F681 T870 L871 M872 I876 D877 V878	I676-V874 HydrophobicContact CG2-CG1 3.77Å; F681-V874 HydrophobicContact CE2-CB 4.24Å; F681-V874 HydrophobicContact CE2-CG1 4.47Å; F681-V874 HydrophobicContact CE2-CG2 3.8Å; F681-V874 HydrophobicContact CZ-CB 4.26Å; F681-V874 HydrophobicContact CZ-CG2 3.65Å; T870-V874 PolarHBondContact O-N 3.32Å; L871-V874 PolarHBondContact O-N 3Å; M872-V874 VanDerWaalsContact C-N 3.31Å; M872-V874 PolarHBondContact O-N 3.43Å; V874-I876 VanDerWaalsContact C-N 3.3Å; V874-I876 PolarHBondContact O-N 3.37Å; V874-D877 PolarHBondContact O-N 3.34Å; V874-V878 HydrophobicContact CG1-CG2 4.4Å; V874-V878 WeakPolarHBondContact O-CB 3.44Å; V874-V878 WeakPolarHBondContact O-CG2 3.22Å; V874-V878 PolarHBondContact O-N 3.42Å
875	L	96.2	Very high	91.8	Very high	2 Å²	2	48.4 Å²	48.4	1%	0.01	25%	0.254	C	S	.	.	H	α-helix	trans	-59.7	-42.3	172.4	-68.9	165.5	0	0	0	111.4	F828 L831 L832 V835 L859 L871 V878 I879	F828-L875 HydrophobicContact CE2-CB 3.85Å; F828-L875 HydrophobicContact CE2-CD1 4.21Å; F828-L875 HydrophobicContact CZ-CB 4.36Å; F828-L875 HydrophobicContact CZ-CD1 3.87Å; L831-L875 HydrophobicContact CB-CD2 4.45Å; L831-L875 HydrophobicContact CD2-CB 4.46Å; L831-L875 HydrophobicContact CD2-CD2 3.74Å; L831-L875 HydrophobicContact CG-CD2 3.67Å; L832-L875 HydrophobicContact CB-CD1 4.47Å; L832-L875 HydrophobicContact CD1-CD1 4.05Å; V835-L875 HydrophobicContact CB-CD2 4.25Å; V835-L875 HydrophobicContact CG1-CD2 4.4Å; V835-L875 HydrophobicContact CG2-CD2 3.92Å; L859-L875 HydrophobicContact CD1-CD1 3.93Å; L871-L875 HydrophobicContact CG-CD1 4.15Å; L871-L875 HydrophobicContact CG-CG 4.49Å; L871-L875 WeakPolarHBondContact O-CB 3.2Å; L871-L875 WeakPolarHBondContact O-CD1 3.45Å; L871-L875 VanDerWaalsContact O-CG 3.24Å; L871-L875 WeakPolarHBondContact O-CG 3.48Å; L871-L875 PolarHBondContact O-N 3.36Å; L875-V878 PolarHBondContact O-N 3.42Å; L875-I879 WeakPolarHBondContact O-CG1 3.29Å; L875-I879 PolarHBondContact O-N 3.29Å
876	I	96.6	Very high	92	Very high	1 Å²	1	46.1 Å²	46.1	1%	0.005	24%	0.237	C	C	.	.	H	α-helix	trans	-65	-45.8	176.3	-78	172.5	0	0	0	112	M872 H873 V874 V878 I879 S880 L887 Y996 V999 L1000 N1003	M872-I876 HydrophobicContact CE-CD1 3.97Å; M872-I876 HydrophobicContact CG-CD1 4.23Å; M872-I876 WeakPolarHBondContact O-CB 3.41Å; M872-I876 WeakPolarHBondContact O-CG1 3.22Å; M872-I876 PolarHBondContact O-N 2.91Å; H873-I876 PolarHBondContact O-N 3.46Å; V874-I876 VanDerWaalsContact C-N 3.3Å; V874-I876 PolarHBondContact O-N 3.37Å; I876-V878 VanDerWaalsContact C-N 3.32Å; I876-V878 PolarHBondContact O-N 3.45Å; I876-I879 PolarHBondContact O-N 2.86Å; I876-S880 VanDerWaalsContact O-CB 3.32Å; I876-S880 WeakPolarHBondContact O-CB 3.34Å; I876-S880 PolarHBondContact O-N 3.04Å; I876-L887 HydrophobicContact CG2-CD1 4.15Å; I876-Y996 HydrophobicContact CD1-CD1 3.94Å; I876-Y996 HydrophobicContact CD1-CD2 4.16Å; I876-Y996 HydrophobicContact CD1-CE1 3.93Å; I876-Y996 HydrophobicContact CD1-CE2 4.13Å; I876-Y996 HydrophobicContact CD1-CG 4.01Å; I876-Y996 HydrophobicContact CG1-CD2 4.43Å; I876-Y996 HydrophobicContact CG1-CE1 4.02Å; I876-Y996 HydrophobicContact CG1-CE2 3.91Å; I876-V999 HydrophobicContact CD1-CB 3.91Å; I876-V999 HydrophobicContact CD1-CG1 3.67Å; I876-L1000 HydrophobicContact CD1-CG 4.41Å; I876-L1000 HydrophobicContact CG2-CD2 3.71Å; I876-L1000 HydrophobicContact CG2-CG 4.39Å; I876-N1003 WeakPolarHBondContact CG2-ND2 3.46Å
877	D	93.8	Very high	92.4	Very high	24 Å²	24	42 Å²	42	13%	0.128	22%	0.215	C	C	.	.	H	α-helix	trans	-63.2	-38.5	176.5	-81.2	-30.5	0	0	0	111.9	K869 H873 V874 S880 N881 N1003 R1007	K869-D877 IonicContact NZ-OD2 2.69Å; K869-D877 PolarHBondContact NZ-OD2 3.42Å; H873-D877 PolarHBondContact O-N 2.67Å; V874-D877 PolarHBondContact O-N 3.34Å; D877-S880 PolarHBondContact O-N 2.97Å; D877-N881 WeakPolarHBondContact O-CB 3.49Å; D877-N881 VanDerWaalsContact O-CG 3.22Å; D877-N881 PolarHBondContact O-N 3.35Å; D877-N881 PolarHBondContact O-ND2 3.44Å; D877-N881 VanDerWaalsContact O-ND2 3.14Å; D877-N1003 PolarHBondContact OD1-ND2 3.02Å; D877-N1003 PolarHBondContact OD2-OD1 2.9Å; D877-R1007 IonicContact OD1-NH1 2.72Å; D877-R1007 PolarHBondContact OD1-NH1 2.99Å
878	V	93.1	Very high	92.7	Very high	12 Å²	12	42.2 Å²	42.2	7%	0.073	21%	0.212	C	C	.	.	H	α-helix	trans	-65.8	-41.2	177.7	170.6	0	0	0	0	111.4	L673 L831 V874 L875 I876 N881 R882	L673-V878 HydrophobicContact CD1-CG1 4.24Å; L673-V878 HydrophobicContact CD1-CG2 3.71Å; L831-V878 HydrophobicContact CD1-CG1 4.02Å; L831-V878 HydrophobicContact CD2-CB 4.11Å; L831-V878 HydrophobicContact CD2-CG1 3.73Å; V874-V878 HydrophobicContact CG1-CG2 4.4Å; V874-V878 WeakPolarHBondContact O-CB 3.44Å; V874-V878 WeakPolarHBondContact O-CG2 3.22Å; V874-V878 PolarHBondContact O-N 3.42Å; L875-V878 PolarHBondContact O-N 3.42Å; I876-V878 VanDerWaalsContact C-N 3.32Å; I876-V878 PolarHBondContact O-N 3.45Å; V878-N881 PolarHBondContact O-N 2.71Å; V878-R882 WeakPolarHBondContact O-CB 3.38Å; V878-R882 VanDerWaalsContact O-CG 3.31Å; V878-R882 WeakPolarHBondContact O-CG 3.28Å; V878-R882 PolarHBondContact O-N 3.26Å
879	I	93.4	Very high	93	Very high	3 Å²	3	39.3 Å²	39.3	2%	0.015	19%	0.191	C	C	.	.	H	α-helix	trans	-65.8	-44.3	172.4	-70.4	169.3	0	0	0	110.6	F828 L831 L875 I876 N881 R882 C883 L887	F828-I879 HydrophobicContact CB-CD1 4.03Å; F828-I879 HydrophobicContact CD2-CD1 3.56Å; F828-I879 HydrophobicContact CE2-CD1 4.5Å; F828-I879 HydrophobicContact CG-CD1 4.26Å; L831-I879 HydrophobicContact CD2-CD1 4.16Å; L831-I879 HydrophobicContact CD2-CG1 3.78Å; L875-I879 WeakPolarHBondContact O-CG1 3.29Å; L875-I879 PolarHBondContact O-N 3.29Å; I876-I879 PolarHBondContact O-N 2.86Å; I879-N881 PolarHBondContact O-N 2.9Å; I879-R882 PolarHBondContact O-N 2.57Å; I879-C883 CarbonylContact O-C 3.2Å; I879-C883 VanDerWaalsContact O-C 3.25Å; I879-C883 WeakPolarHBondContact O-CA 3.21Å; I879-C883 PolarHBondContact O-N 3.39Å; I879-L887 HydrophobicContact CB-CD1 4.22Å; I879-L887 HydrophobicContact CG2-CB 4.23Å; I879-L887 HydrophobicContact CG2-CD1 3.78Å
880	S	91.9	Very high	93.2	Very high	26 Å²	26	37.7 Å²	37.7	18%	0.182	18%	0.184	C	C	.	.	H	α-helix	trans	-58.1	-34.3	178.2	-171.7	0	0	0	0	112.6	I876 D877 P884	I876-S880 VanDerWaalsContact O-CB 3.32Å; I876-S880 WeakPolarHBondContact O-CB 3.34Å; I876-S880 PolarHBondContact O-N 3.04Å; D877-S880 PolarHBondContact O-N 2.97Å; S880-P884 WeakPolarHBondContact O-CB 3.26Å
881	N	89.8	Confident	92.9	Very high	133 Å²	133	40.7 Å²	40.7	71%	0.711	20%	0.2	S	C	*	.	H	α-helix	trans	-85.8	-29.2	179.9	-68.3	-28.4	0	0	0	113.6	D877 V878 I879	D877-N881 WeakPolarHBondContact O-CB 3.49Å; D877-N881 VanDerWaalsContact O-CG 3.22Å; D877-N881 PolarHBondContact O-N 3.35Å; D877-N881 PolarHBondContact O-ND2 3.44Å; D877-N881 VanDerWaalsContact O-ND2 3.14Å; V878-N881 PolarHBondContact O-N 2.71Å; I879-N881 PolarHBondContact O-N 2.9Å
882	R	88.8	Confident	92.5	Very high	107 Å²	107	45.4 Å²	45.4	40%	0.404	23%	0.225	S	C	.	.	H	α-helix	trans	-100.4	-33.8	-173.9	-66	179	-174.2	-136.6	-6.6	114.2	L668 S670 V878 I879	L668-R882 PolarHBondContact O-NH1 3.22Å; S670-R882 VanDerWaalsContact CB-NH2 3.3Å; S670-R882 PolarHBondContact OG-NH2 3.17Å; V878-R882 WeakPolarHBondContact O-CB 3.38Å; V878-R882 VanDerWaalsContact O-CG 3.31Å; V878-R882 WeakPolarHBondContact O-CG 3.28Å; V878-R882 PolarHBondContact O-N 3.26Å; I879-R882 PolarHBondContact O-N 2.57Å
883	C	88.6	Confident	92.3	Very high	28 Å²	28	45.4 Å²	45.4	19%	0.189	23%	0.225	C	C	.	.			trans	-148.3	58.1	-174.8	47	0	0	0	0	111.6	I879 K885 E886	I879-C883 CarbonylContact O-C 3.2Å; I879-C883 VanDerWaalsContact O-C 3.25Å; I879-C883 WeakPolarHBondContact O-CA 3.21Å; I879-C883 PolarHBondContact O-N 3.39Å; C883-K885 PolarHBondContact O-N 3.23Å; C883-E886 HydrophobicContact CB-CB 4.34Å; C883-E886 HydrophobicContact CB-CG 3.97Å; C883-E886 WeakPolarHBondContact O-CB 3.49Å; C883-E886 PolarHBondContact O-N 3.48Å
884	P	89.2	Confident	92.1	Very high	81 Å²	81	46.8 Å²	46.8	53%	0.526	23%	0.233	S	C	.	.	G	3₁₀ helix	trans	-56.2	-27.2	-174.3	19.1	-32.1	0	0	0	114.9	S880 E886 L887	S880-P884 WeakPolarHBondContact O-CB 3.26Å; P884-E886 PolarHBondContact O-N 3.44Å; P884-L887 VanDerWaalsContact O-CB 3.24Å; P884-L887 WeakPolarHBondContact O-CB 3.43Å; P884-L887 PolarHBondContact O-N 3.39Å
885	K	89.1	Confident	92.2	Very high	202 Å²	202	47.3 Å²	47.3	88%	0.878	23%	0.234	S	C	*	.	G	3₁₀ helix	trans	-62.5	-27.3	174.3	-65.3	-173	178	-175.8	0	113.4	C883	C883-K885 PolarHBondContact O-N 3.23Å
886	E	91.4	Very high	92.2	Very high	38 Å²	38	47.2 Å²	47.2	18%	0.178	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-96.6	-4.4	-176.3	-46	-69.8	154.4	0	0	111.7	K823 I827 C883 P884 R888 F889	K823-E886 VanDerWaalsContact CD-OE2 3.29Å; K823-E886 WeakPolarHBondContact CD-OE2 3.36Å; K823-E886 WeakPolarHBondContact CE-OE1 3.36Å; K823-E886 WeakPolarHBondContact CG-OE2 3.34Å; K823-E886 IonicContact NZ-OE1 2.81Å; K823-E886 PolarHBondContact NZ-OE1 2.89Å; K823-E886 IonicContact NZ-OE2 2.62Å; I827-E886 HydrophobicContact CD1-CB 4.21Å; I827-E886 HydrophobicContact CD1-CG 3.79Å; C883-E886 HydrophobicContact CB-CB 4.34Å; C883-E886 HydrophobicContact CB-CG 3.97Å; C883-E886 WeakPolarHBondContact O-CB 3.49Å; C883-E886 PolarHBondContact O-N 3.48Å; P884-E886 PolarHBondContact O-N 3.44Å; E886-R888 VanDerWaalsContact C-N 3.3Å; E886-R888 PolarHBondContact O-N 2.79Å; E886-F889 WeakPolarHBondContact O-CD1 3.31Å
887	L	93.2	Very high	92.2	Very high	17 Å²	17	51.7 Å²	51.7	9%	0.089	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-28	-173.2	-177.9	66.4	0	0	0	113.9	I876 I879 P884 Y996 L1000	I876-L887 HydrophobicContact CG2-CD1 4.15Å; I879-L887 HydrophobicContact CB-CD1 4.22Å; I879-L887 HydrophobicContact CG2-CB 4.23Å; I879-L887 HydrophobicContact CG2-CD1 3.78Å; P884-L887 VanDerWaalsContact O-CB 3.24Å; P884-L887 WeakPolarHBondContact O-CB 3.43Å; P884-L887 PolarHBondContact O-N 3.39Å; L887-Y996 WeakPolarHBondContact O-CE1 3.35Å; L887-Y996 PolarHBondContact O-OH 3.43Å; L887-L1000 HydrophobicContact CD1-CD2 3.82Å; L887-L1000 HydrophobicContact CD2-CD2 4.08Å; L887-L1000 HydrophobicContact CG-CD2 3.76Å
888	R	91.7	Very high	92.3	Very high	95 Å²	95	52.8 Å²	52.8	36%	0.358	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.2	23	-174.1	-70.8	-73	178.4	163.6	-0.8	113.2	E886 T890 D891 E1004	E886-R888 VanDerWaalsContact C-N 3.3Å; E886-R888 PolarHBondContact O-N 2.79Å; R888-T890 PolarHBondContact O-N 3.11Å; R888-D891 WeakPolarHBondContact O-CB 3.46Å; R888-D891 PolarHBondContact O-N 3.44Å; R888-E1004 IonicContact NH2-OE2 3.65Å
889	F	94.8	Very high	92.5	Very high	5 Å²	5	52.2 Å²	52.2	2%	0.022	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-16.1	-177.5	75.3	-102.2	0	0	0	115.1	F825 F828 E886 D891 D892 F893 F992 Y996	F825-F889 HydrophobicContact CB-CD2 3.65Å; F825-F889 HydrophobicContact CB-CE2 3.65Å; F825-F889 HydrophobicContact CB-CG 4.33Å; F825-F889 HydrophobicContact CB-CZ 4.3Å; F825-F889 HydrophobicContact CD2-CD2 4.49Å; F825-F889 AromaticContact CD2-CE2 3.64Å; F825-F889 HydrophobicContact CD2-CE2 3.64Å; F825-F889 AromaticContact CD2-CZ 3.98Å; F825-F889 HydrophobicContact CD2-CZ 3.98Å; F825-F889 HydrophobicContact CG-CD2 4.48Å; F825-F889 HydrophobicContact CG-CE2 4.05Å; F828-F889 HydrophobicContact CB-CE1 4Å; F828-F889 HydrophobicContact CB-CZ 4.1Å; F828-F889 HydrophobicContact CG-CE1 4.47Å; F828-F889 HydrophobicContact CG-CZ 4.35Å; E886-F889 WeakPolarHBondContact O-CD1 3.31Å; F889-D891 VanDerWaalsContact C-N 3.29Å; F889-D892 PolarHBondContact O-N 3.15Å; F889-F893 HydrophobicContact CD2-CE2 4.27Å; F889-F893 HydrophobicContact CD2-CZ 4.2Å; F889-F893 HydrophobicContact CE2-CE2 4.07Å; F889-F893 HydrophobicContact CE2-CZ 4.31Å; F889-F992 HydrophobicContact CE2-CE1 4.08Å; F889-F992 HydrophobicContact CZ-CE1 4.05Å; F889-F992 HydrophobicContact CZ-CZ 4.03Å; F889-Y996 HydrophobicContact CD1-CE2 4.48Å; F889-Y996 HydrophobicContact CE1-CD2 4.18Å; F889-Y996 HydrophobicContact CE1-CE1 4.35Å; F889-Y996 AromaticContact CE1-CE2 3.36Å; F889-Y996 HydrophobicContact CE1-CE2 3.36Å; F889-Y996 AromaticContact CE1-CZ 3.48Å; F889-Y996 VanDerWaalsContact CE1-CZ 3.48Å; F889-Y996 WeakPolarHBondContact CE1-OH 3.27Å; F889-Y996 AromaticContact CZ-CD2 3.81Å; F889-Y996 HydrophobicContact CZ-CD2 3.81Å; F889-Y996 AromaticContact CZ-CE2 3.44Å; F889-Y996 HydrophobicContact CZ-CE2 3.44Å; F889-Y996 VanDerWaalsContact CZ-CE2 3.44Å; F889-Y996 AromaticContact CZ-CZ 3.98Å
890	T	94.5	Very high	92.7	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-16.9	175.2	59.7	0	0	0	0	113.1	R888 D892 F893 K993 Y996 E997	R888-T890 PolarHBondContact O-N 3.11Å; T890-D892 VanDerWaalsContact C-N 3.25Å; T890-D892 PolarHBondContact O-N 3.08Å; T890-F893 PolarHBondContact O-N 3.17Å; T890-K993 HydrophobicContact CG2-CG 4.36Å; T890-K993 WeakPolarHBondContact O-CE 3.48Å; T890-K993 PolarHBondContact O-NZ 3.1Å; T890-K993 VanDerWaalsContact O-NZ 3.11Å; T890-Y996 HydrophobicContact CG2-CD1 3.75Å; T890-Y996 HydrophobicContact CG2-CD2 4.21Å; T890-Y996 HydrophobicContact CG2-CE1 4.37Å; T890-Y996 HydrophobicContact CG2-CG 3.72Å; T890-E997 WeakPolarHBondContact CB-OE1 3.36Å; T890-E997 WeakPolarHBondContact OG1-CG 3.25Å; T890-E997 PolarHBondContact OG1-OE1 2.89Å
891	D	89.8	Confident	92.9	Very high	65 Å²	65	57.3 Å²	57.3	35%	0.348	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-26.9	172.2	-69.5	-38.1	0	0	0	111.4	R888 F889 F893	R888-D891 WeakPolarHBondContact O-CB 3.46Å; R888-D891 PolarHBondContact O-N 3.44Å; F889-D891 VanDerWaalsContact C-N 3.29Å; D891-F893 VanDerWaalsContact C-N 3.32Å
892	D	87.4	Confident	93.3	Very high	100 Å²	100	51.7 Å²	51.7	54%	0.535	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-16.7	172.6	-58.1	-43.5	0	0	0	113.2	E818 F889 T890 I894	E818-D892 VanDerWaalsContact CD-O 3.24Å; E818-D892 WeakPolarHBondContact CG-O 3.5Å; F889-D892 PolarHBondContact O-N 3.15Å; T890-D892 VanDerWaalsContact C-N 3.25Å; T890-D892 PolarHBondContact O-N 3.08Å; D892-I894 PolarHBondContact O-N 3.34Å
893	F	94.5	Very high	93.6	Very high	0 Å²	0	49 Å²	49	0%	0	26%	0.258	C	S	.	.			trans	-83.6	57.8	-178.7	-74.8	1.4	0	0	0	111.4	E818 V819 F825 F889 T890 D891 V896 K993	E818-F893 HydrophobicContact CB-CD1 4.14Å; E818-F893 WeakPolarHBondContact OE2-CA 3.29Å; V819-F893 HydrophobicContact CB-CE1 4.44Å; V819-F893 HydrophobicContact CB-CZ 4.43Å; V819-F893 HydrophobicContact CG2-CD1 4.41Å; V819-F893 HydrophobicContact CG2-CE1 3.95Å; V819-F893 HydrophobicContact CG2-CE2 4.37Å; V819-F893 HydrophobicContact CG2-CZ 3.93Å; F825-F893 HydrophobicContact CB-CZ 3.79Å; F825-F893 AromaticContact CD1-CZ 3.87Å; F825-F893 HydrophobicContact CD1-CZ 3.87Å; F825-F893 HydrophobicContact CD2-CE2 4.31Å; F825-F893 HydrophobicContact CD2-CZ 4.21Å; F825-F893 HydrophobicContact CG-CE2 4.25Å; F825-F893 AromaticContact CG-CZ 3.7Å; F825-F893 HydrophobicContact CG-CZ 3.7Å; F889-F893 HydrophobicContact CD2-CE2 4.27Å; F889-F893 HydrophobicContact CD2-CZ 4.2Å; F889-F893 HydrophobicContact CE2-CE2 4.07Å; F889-F893 HydrophobicContact CE2-CZ 4.31Å; T890-F893 PolarHBondContact O-N 3.17Å; D891-F893 VanDerWaalsContact C-N 3.32Å; F893-V896 HydrophobicContact CB-CB 4.22Å; F893-V896 HydrophobicContact CB-CG2 3.76Å; F893-V896 HydrophobicContact CD1-CG2 4.43Å; F893-V896 HydrophobicContact CD2-CG2 4.24Å; F893-V896 HydrophobicContact CG-CG2 3.93Å; F893-K993 HydrophobicContact CB-CD 4.12Å; F893-K993 HydrophobicContact CB-CG 4.47Å; F893-K993 WeakPolarHBondContact O-CE 3.46Å
894	I	92.3	Very high	93.8	Very high	38 Å²	38	49.3 Å²	49.3	20%	0.195	26%	0.259	C	S	.	.	S	Bend	trans	-66.7	-51.7	-174.3	-59.9	168.4	0	0	0	110.3	L480 E481 E818 D892	L480-I894 HydrophobicContact CD2-CD1 3.47Å; L480-I894 VanDerWaalsContact CD2-CD1 3.47Å; L480-I894 HydrophobicContact CG-CD1 4.01Å; E481-I894 HydrophobicContact CG-CG2 4.06Å; E818-I894 PolarHBondContact OE1-N 3.24Å; E818-I894 PolarHBondContact OE2-N 3.34Å; D892-I894 PolarHBondContact O-N 3.34Å
895	H	96.1	Very high	94	Very high	16 Å²	16	51.6 Å²	51.6	7%	0.074	27%	0.267	C	S	.	.	S	Bend	trans	-88	-12.1	-170.6	-63.2	81.9	0	0	0	113.8	A811 A814 A815 E818 K897 A898 A899	A811-H895 HydrophobicContact CB-CB 4.42Å; A811-H895 WeakPolarHBondContact O-CB 3.43Å; A814-H895 HydrophobicContact CB-CB 3.88Å; A814-H895 VanDerWaalsContact CB-CG 3.49Å; A814-H895 WeakPolarHBondContact CB-ND1 3.42Å; A815-H895 HydrophobicContact CB-CB 4.04Å; E818-H895 IonicContact OE1-CE1 3.47Å; E818-H895 IonicContact OE1-CG 3.33Å; E818-H895 PolarHBondContact OE1-N 2.86Å; E818-H895 VanDerWaalsContact OE1-N 3.11Å; E818-H895 IonicContact OE1-ND1 3.44Å; E818-H895 PolarHBondContact OE1-ND1 3.31Å; E818-H895 PolarHBondContact OE2-N 3.48Å; H895-K897 VanDerWaalsContact C-N 3.27Å; H895-K897 PolarHBondContact O-N 3.34Å; H895-K897 VanDerWaalsContact O-N 3.16Å; H895-A898 PolarHBondContact O-N 3.34Å; H895-A899 WeakPolarHBondContact O-CB 3.21Å; H895-A899 PolarHBondContact O-N 3.04Å
896	V	97.3	Very high	94.3	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-51.9	-39.4	-177.4	170.4	0	0	0	0	113.3	A815 V819 F893 A900 F986 L989	A815-V896 HydrophobicContact CB-CG2 4.09Å; V819-V896 HydrophobicContact CG2-CG2 3.84Å; F893-V896 HydrophobicContact CB-CB 4.22Å; F893-V896 HydrophobicContact CB-CG2 3.76Å; F893-V896 HydrophobicContact CD1-CG2 4.43Å; F893-V896 HydrophobicContact CD2-CG2 4.24Å; F893-V896 HydrophobicContact CG-CG2 3.93Å; V896-A900 PolarHBondContact O-N 3.35Å; V896-F986 HydrophobicContact CG1-CD1 4.34Å; V896-F986 HydrophobicContact CG2-CD1 4.44Å; V896-L989 HydrophobicContact CG1-CB 3.86Å
897	K	95.9	Very high	94.5	Very high	96 Å²	96	44.1 Å²	44.1	42%	0.417	24%	0.241	S	C	.	.	H	α-helix	trans	-70.3	-39.3	178.5	176.3	63.8	-154	81.7	0	112.6	H895 A900 D901 S990	H895-K897 VanDerWaalsContact C-N 3.27Å; H895-K897 PolarHBondContact O-N 3.34Å; H895-K897 VanDerWaalsContact O-N 3.16Å; K897-A900 WeakPolarHBondContact O-CB 3.45Å; K897-A900 PolarHBondContact O-N 2.87Å; K897-D901 IonicContact NZ-OD1 2.78Å; K897-D901 PolarHBondContact NZ-OD1 3.44Å; K897-D901 IonicContact NZ-OD2 3.49Å; K897-D901 PolarHBondContact NZ-OD2 2.85Å; K897-S990 WeakPolarHBondContact CD-OG 3.34Å
898	A	95.5	Very high	94.6	Very high	46 Å²	46	45.4 Å²	45.4	38%	0.38	25%	0.253	S	S	.	.	H	α-helix	trans	-70.5	-44.1	178.3	0	0	0	0	0	110.8	A811 H895 A900 D901 V902	A811-A898 HydrophobicContact CB-CB 3.72Å; H895-A898 PolarHBondContact O-N 3.34Å; A898-A900 PolarHBondContact O-N 2.89Å; A898-A900 VanDerWaalsContact O-N 3.13Å; A898-D901 PolarHBondContact O-N 3.37Å; A898-V902 PolarHBondContact O-N 3.29Å
899	A	98	Very high	94.8	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-58.8	-24.2	175.3	0	0	0	0	0	113.8	V812 A815 H895 F986	V812-A899 HydrophobicContact CG2-CB 4.07Å; A815-A899 HydrophobicContact CB-CB 3.61Å; H895-A899 WeakPolarHBondContact O-CB 3.21Å; H895-A899 PolarHBondContact O-N 3.04Å; A899-F986 HydrophobicContact CB-CB 4.06Å; A899-F986 HydrophobicContact CB-CD1 4.09Å; A899-F986 HydrophobicContact CB-CD2 3.68Å; A899-F986 HydrophobicContact CB-CE2 4.12Å; A899-F986 HydrophobicContact CB-CG 3.66Å
900	A	97.3	Very high	94.9	Very high	16 Å²	16	45.1 Å²	45.1	13%	0.132	27%	0.266	C	S	.	.	H	α-helix	trans	-72.2	-28.9	174.1	0	0	0	0	0	113.9	V896 K897 A898 F986	V896-A900 PolarHBondContact O-N 3.35Å; K897-A900 WeakPolarHBondContact O-CB 3.45Å; K897-A900 PolarHBondContact O-N 2.87Å; A898-A900 PolarHBondContact O-N 2.89Å; A898-A900 VanDerWaalsContact O-N 3.13Å; A900-F986 HydrophobicContact CB-CB 3.92Å
901	D	96	Very high	95.1	Very high	120 Å²	120	45.7 Å²	45.7	64%	0.642	27%	0.27	S	S	*	.	H	α-helix	trans	-89.3	-16.5	-179.2	-61.1	-29.6	0	0	0	112.6	K897 A898 S903	K897-D901 IonicContact NZ-OD1 2.78Å; K897-D901 PolarHBondContact NZ-OD1 3.44Å; K897-D901 IonicContact NZ-OD2 3.49Å; K897-D901 PolarHBondContact NZ-OD2 2.85Å; A898-D901 PolarHBondContact O-N 3.37Å; D901-S903 PolarHBondContact O-N 3.07Å
902	V	97	Very high	95.4	Very high	16 Å²	16	48.9 Å²	48.9	10%	0.097	28%	0.28	C	S	.	.			trans	-68.1	117.5	-179.6	174.5	0	0	0	0	111.2	V812 A898 P904 L907	V812-V902 HydrophobicContact CG2-CB 3.82Å; V812-V902 HydrophobicContact CG2-CG1 3.82Å; V812-V902 HydrophobicContact CG2-CG2 4.07Å; A898-V902 PolarHBondContact O-N 3.29Å; V902-P904 WeakPolarHBondContact O-CD 3.48Å; V902-L907 HydrophobicContact CG1-CD2 4.08Å
903	S	95.4	Very high	95.8	Very high	51 Å²	51	48.5 Å²	48.5	36%	0.357	28%	0.275	S	S	.	.			trans	-87.5	114.7	167.2	177.5	0	0	0	0	110.1	D901 D905 V906 L907	D901-S903 PolarHBondContact O-N 3.07Å; S903-D905 VanDerWaalsContact C-N 3.26Å; S903-D905 PolarHBondContact O-N 3.21Å; S903-V906 PolarHBondContact O-N 3.43Å; S903-L907 WeakPolarHBondContact O-CB 3.24Å; S903-L907 PolarHBondContact O-N 3.14Å
904	P	92.9	Very high	96	Very high	33 Å²	33	48.5 Å²	48.5	21%	0.214	28%	0.275	C	S	.	.	H	α-helix	trans	-66.4	-28.8	178.7	27.1	-34.4	0	0	0	112.5	V902 L907 A908 I982	V902-P904 WeakPolarHBondContact O-CD 3.48Å; P904-L907 PolarHBondContact O-N 2.82Å; P904-A908 VanDerWaalsContact O-CB 3.31Å; P904-A908 WeakPolarHBondContact O-CB 3.5Å; P904-A908 PolarHBondContact O-N 2.9Å; P904-I982 HydrophobicContact CB-CD1 4.08Å; P904-I982 HydrophobicContact CG-CD1 4.28Å
905	D	94.6	Very high	96.3	Very high	129 Å²	129	50.8 Å²	50.8	69%	0.69	29%	0.285	S	S	*	.	H	α-helix	trans	-68	-40.3	177.5	-56	-64.6	0	0	0	111.8	S903 A909	S903-D905 VanDerWaalsContact C-N 3.26Å; S903-D905 PolarHBondContact O-N 3.21Å; D905-A909 WeakPolarHBondContact O-CB 3.3Å; D905-A909 PolarHBondContact O-N 3.42Å
906	V	95	Very high	96.3	Very high	79 Å²	79	54.5 Å²	54.5	48%	0.479	31%	0.305	S	S	.	.	H	α-helix	trans	-68.3	-44	173.6	176.7	0	0	0	0	110.3	S903 A908 A909 N910	S903-V906 PolarHBondContact O-N 3.43Å; V906-A908 VanDerWaalsContact C-N 3.35Å; V906-A908 PolarHBondContact O-N 2.97Å; V906-A909 WeakPolarHBondContact O-CB 3.4Å; V906-A909 PolarHBondContact O-N 2.88Å; V906-A909 VanDerWaalsContact O-N 3.09Å; V906-N910 PolarHBondContact O-N 3.22Å; V906-N910 PolarHBondContact O-OD1 3.44Å
907	L	95.2	Very high	96.3	Very high	5 Å²	5	55.6 Å²	55.6	3%	0.026	31%	0.313	C	S	.	.	H	α-helix	trans	-60.2	-43.7	179.5	-172.1	57.5	0	0	0	112.3	I805 I809 V902 S903 P904 L911 M962	I805-L907 HydrophobicContact CB-CD1 4.19Å; I805-L907 HydrophobicContact CG1-CD1 4.29Å; I805-L907 HydrophobicContact CG2-CD1 3.88Å; I809-L907 HydrophobicContact CG1-CD1 4.14Å; I809-L907 HydrophobicContact CG1-CD2 3.84Å; I809-L907 HydrophobicContact CG1-CG 4.33Å; V902-L907 HydrophobicContact CG1-CD2 4.08Å; S903-L907 WeakPolarHBondContact O-CB 3.24Å; S903-L907 PolarHBondContact O-N 3.14Å; P904-L907 PolarHBondContact O-N 2.82Å; L907-L911 WeakPolarHBondContact O-CG 3.41Å; L907-L911 PolarHBondContact O-N 3.27Å; L907-L911 VanDerWaalsContact O-N 3.12Å; L907-M962 HydrophobicContact CD2-CE 3.99Å; L907-M962 HydrophobicContact CD2-SD 3.75Å
908	A	95.9	Very high	96.4	Very high	43 Å²	43	51.4 Å²	51.4	36%	0.355	30%	0.295	S	S	.	.	H	α-helix	trans	-68.4	-32.8	174.1	0	0	0	0	0	112.9	P904 V906 K912	P904-A908 VanDerWaalsContact O-CB 3.31Å; P904-A908 WeakPolarHBondContact O-CB 3.5Å; P904-A908 PolarHBondContact O-N 2.9Å; V906-A908 VanDerWaalsContact C-N 3.35Å; V906-A908 PolarHBondContact O-N 2.97Å; A908-K912 WeakPolarHBondContact O-CB 3.39Å; A908-K912 PolarHBondContact O-N 3.46Å; A908-K912 VanDerWaalsContact O-N 3.14Å
909	A	96.6	Very high	96.4	Very high	52 Å²	52	53.1 Å²	53.1	43%	0.43	30%	0.295	S	S	.	.	H	α-helix	trans	-67.3	-45.7	174	0	0	0	0	0	111.9	D905 V906 K912 E913	D905-A909 WeakPolarHBondContact O-CB 3.3Å; D905-A909 PolarHBondContact O-N 3.42Å; V906-A909 WeakPolarHBondContact O-CB 3.4Å; V906-A909 PolarHBondContact O-N 2.88Å; V906-A909 VanDerWaalsContact O-N 3.09Å; A909-K912 CarbonylContact O-C 3.44Å; A909-K912 WeakPolarHBondContact O-CB 3.26Å; A909-K912 PolarHBondContact O-N 3.46Å; A909-K912 VanDerWaalsContact O-N 3.13Å; A909-E913 PolarHBondContact O-N 3.26Å
910	N	96.5	Very high	96.3	Very high	42 Å²	42	55.3 Å²	55.3	23%	0.225	31%	0.306	C	S	.	.	H	α-helix	trans	-64.7	-42.2	179.7	-67.8	14.9	0	0	0	111.6	I805 V906 K912 E913 M914	I805-N910 HydrophobicContact CD1-CB 3.85Å; I805-N910 HydrophobicContact CG1-CB 3.86Å; V906-N910 PolarHBondContact O-N 3.22Å; V906-N910 PolarHBondContact O-OD1 3.44Å; N910-K912 VanDerWaalsContact C-N 3.29Å; N910-K912 PolarHBondContact O-N 3.17Å; N910-E913 PolarHBondContact O-N 2.95Å; N910-M914 PolarHBondContact O-N 3.4Å
911	L	97.2	Very high	96.3	Very high	13 Å²	13	54.6 Å²	54.6	7%	0.068	30%	0.3	C	S	.	.	H	α-helix	trans	-58.4	-40.9	171.5	-80.2	166.7	0	0	0	112.1	I805 L907 M914 Q915 L955 H959	I805-L911 HydrophobicContact CD1-CD2 4.23Å; I805-L911 HydrophobicContact CD1-CG 4.24Å; I805-L911 HydrophobicContact CG2-CD2 3.85Å; I805-L911 HydrophobicContact CG2-CG 4.02Å; L907-L911 WeakPolarHBondContact O-CG 3.41Å; L907-L911 PolarHBondContact O-N 3.27Å; L907-L911 VanDerWaalsContact O-N 3.12Å; L911-M914 PolarHBondContact O-N 2.87Å; L911-Q915 PolarHBondContact O-N 2.94Å; L911-L955 HydrophobicContact CD2-CB 3.86Å; L911-H959 HydrophobicContact CD1-CB 3.61Å; L911-H959 VanDerWaalsContact CD1-CG 3.46Å
912	K	97.1	Very high	96.2	Very high	131 Å²	131	50.6 Å²	50.6	57%	0.57	28%	0.278	S	S	*	.	H	α-helix	trans	-71.3	-35.1	177.9	-171.7	176.1	-179.1	178.7	0	113	A908 A909 N910 Q915 L916	A908-K912 WeakPolarHBondContact O-CB 3.39Å; A908-K912 PolarHBondContact O-N 3.46Å; A908-K912 VanDerWaalsContact O-N 3.14Å; A909-K912 CarbonylContact O-C 3.44Å; A909-K912 WeakPolarHBondContact O-CB 3.26Å; A909-K912 PolarHBondContact O-N 3.46Å; A909-K912 VanDerWaalsContact O-N 3.13Å; N910-K912 VanDerWaalsContact C-N 3.29Å; N910-K912 PolarHBondContact O-N 3.17Å; K912-Q915 PolarHBondContact O-N 2.88Å; K912-L916 HydrophobicContact CG-CD1 4.2Å; K912-L916 WeakPolarHBondContact O-CB 3.32Å; K912-L916 VanDerWaalsContact O-CG 3.28Å; K912-L916 WeakPolarHBondContact O-CG 3.49Å; K912-L916 PolarHBondContact O-N 3.02Å
913	E	96.4	Very high	96.1	Very high	92 Å²	92	53.2 Å²	53.2	43%	0.43	29%	0.291	S	S	.	.	H	α-helix	trans	-61.4	-49	171.2	-175.2	169.5	165.7	0	0	109.9	K797 A909 N910 Q915 L916 S917	K797-E913 IonicContact NZ-OE1 3.76Å; A909-E913 PolarHBondContact O-N 3.26Å; N910-E913 PolarHBondContact O-N 2.95Å; E913-Q915 VanDerWaalsContact C-N 3.33Å; E913-Q915 PolarHBondContact O-N 3.46Å; E913-L916 PolarHBondContact O-N 3.33Å; E913-L916 VanDerWaalsContact O-N 3.16Å; E913-S917 WeakPolarHBondContact O-CB 3.44Å; E913-S917 PolarHBondContact O-N 3.18Å; E913-S917 PolarHBondContact O-OG 3.34Å
914	M	97.8	Very high	96	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-55.8	-44.8	174.8	-174.7	-178.8	-73	0	0	112.2	F794 F798 M801 V802 I805 N910 L911 L916 S917 I918 H952 L955	F794-M914 HydrophobicContact CE2-CG 4.21Å; F794-M914 HydrophobicContact CZ-CG 4.23Å; F798-M914 HydrophobicContact CD2-CE 4.33Å; F798-M914 HydrophobicContact CE2-CE 4.17Å; F798-M914 HydrophobicContact CE2-SD 4.27Å; M801-M914 HydrophobicContact CB-CE 3.79Å; V802-M914 HydrophobicContact CG2-CE 4.02Å; I805-M914 HydrophobicContact CD1-CE 3.93Å; N910-M914 PolarHBondContact O-N 3.4Å; L911-M914 PolarHBondContact O-N 2.87Å; M914-L916 PolarHBondContact O-N 3.19Å; M914-S917 PolarHBondContact O-N 3.02Å; M914-I918 HydrophobicContact CG-CD1 4.12Å; M914-I918 VanDerWaalsContact O-CG1 3.3Å; M914-I918 WeakPolarHBondContact O-CG1 3.42Å; M914-I918 PolarHBondContact O-N 2.84Å; M914-H952 HydrophobicContact CG-CB 4.36Å; M914-H952 HydrophobicContact SD-CB 3.92Å; M914-L955 HydrophobicContact CE-CD1 4.35Å; M914-L955 HydrophobicContact SD-CD1 4.43Å
915	Q	97.7	Very high	95.9	Very high	86 Å²	86	50.8 Å²	50.8	40%	0.402	27%	0.272	S	S	.	.	H	α-helix	trans	-59.8	-46.3	176.2	-166.1	-174.5	23.1	0	0	112.6	L911 K912 E913 I918 Q919	L911-Q915 PolarHBondContact O-N 2.94Å; K912-Q915 PolarHBondContact O-N 2.88Å; E913-Q915 VanDerWaalsContact C-N 3.33Å; E913-Q915 PolarHBondContact O-N 3.46Å; Q915-I918 PolarHBondContact O-N 3.39Å; Q915-Q919 WeakPolarHBondContact O-CG 3.14Å; Q915-Q919 PolarHBondContact O-N 2.98Å; Q915-Q919 VanDerWaalsContact O-N 3.1Å
916	L	97.6	Very high	95.8	Very high	94 Å²	94	51.4 Å²	51.4	49%	0.492	27%	0.269	S	S	.	.	H	α-helix	trans	-69	-35.5	-179.2	-70.6	169.2	0	0	0	111.9	K912 E913 M914 Q919 L920	K912-L916 HydrophobicContact CG-CD1 4.2Å; K912-L916 WeakPolarHBondContact O-CB 3.32Å; K912-L916 VanDerWaalsContact O-CG 3.28Å; K912-L916 WeakPolarHBondContact O-CG 3.49Å; K912-L916 PolarHBondContact O-N 3.02Å; E913-L916 PolarHBondContact O-N 3.33Å; E913-L916 VanDerWaalsContact O-N 3.16Å; M914-L916 PolarHBondContact O-N 3.19Å; L916-Q919 PolarHBondContact O-N 2.93Å; L916-L920 PolarHBondContact O-N 3.01Å
917	S	96.8	Very high	95.5	Very high	23 Å²	23	52 Å²	52	16%	0.161	27%	0.266	C	S	.	.	H	α-helix	trans	-71.7	-34.4	175.6	-61.7	0	0	0	0	113	F794 E913 M914 L920 V921	F794-S917 VanDerWaalsContact CE2-CB 3.47Å; E913-S917 WeakPolarHBondContact O-CB 3.44Å; E913-S917 PolarHBondContact O-N 3.18Å; E913-S917 PolarHBondContact O-OG 3.34Å; M914-S917 PolarHBondContact O-N 3.02Å; S917-L920 WeakPolarHBondContact O-CB 3.49Å; S917-L920 PolarHBondContact O-N 2.92Å; S917-V921 WeakPolarHBondContact O-CG2 3.48Å; S917-V921 PolarHBondContact O-N 3.36Å
918	I	97.6	Very high	95.2	Very high	8 Å²	8	53.3 Å²	53.3	4%	0.041	27%	0.272	C	S	.	.	H	α-helix	trans	-59.3	-49.2	168.3	-73.8	166.8	0	0	0	110.1	F794 M914 Q915 L920 V921 E922 L945 A948 R949 H952	F794-I918 HydrophobicContact CE1-CG1 3.93Å; F794-I918 HydrophobicContact CZ-CG1 3.77Å; M914-I918 HydrophobicContact CG-CD1 4.12Å; M914-I918 VanDerWaalsContact O-CG1 3.3Å; M914-I918 WeakPolarHBondContact O-CG1 3.42Å; M914-I918 PolarHBondContact O-N 2.84Å; Q915-I918 PolarHBondContact O-N 3.39Å; I918-L920 PolarHBondContact O-N 2.93Å; I918-V921 PolarHBondContact O-N 3.22Å; I918-V921 VanDerWaalsContact O-N 3.15Å; I918-E922 WeakPolarHBondContact O-CG 3.29Å; I918-E922 PolarHBondContact O-N 2.93Å; I918-L945 HydrophobicContact CG2-CD1 3.83Å; I918-A948 HydrophobicContact CD1-CB 4.23Å; I918-A948 WeakPolarHBondContact CD1-O 3.48Å; I918-A948 HydrophobicContact CG1-CB 4.11Å; I918-R949 HydrophobicContact CG2-CG 3.93Å; I918-H952 HydrophobicContact CD1-CB 3.48Å; I918-H952 VanDerWaalsContact CD1-CB 3.48Å
919	Q	96.8	Very high	94.8	Very high	82 Å²	82	56.4 Å²	56.4	38%	0.383	28%	0.279	S	S	.	.	H	α-helix	trans	-60.3	-33.1	176.5	-70.3	173.4	1	0	0	112.8	Q915 L916 N923	Q915-Q919 WeakPolarHBondContact O-CG 3.14Å; Q915-Q919 PolarHBondContact O-N 2.98Å; Q915-Q919 VanDerWaalsContact O-N 3.1Å; L916-Q919 PolarHBondContact O-N 2.93Å; Q919-N923 WeakPolarHBondContact O-CB 3.33Å; Q919-N923 PolarHBondContact O-N 3.34Å; Q919-N923 PolarHBondContact O-ND2 3.41Å
920	L	95.8	Very high	94.4	Very high	46 Å²	46	59.3 Å²	59.3	24%	0.241	29%	0.287	C	S	.	.	H	α-helix	trans	-65.8	-47.6	173.6	-176.9	60.8	0	0	0	111.8	Q790 L916 S917 I918 E922 N923 E924	Q790-L920 HydrophobicContact CB-CD2 3.57Å; Q790-L920 HydrophobicContact CG-CD2 4.45Å; L916-L920 PolarHBondContact O-N 3.01Å; S917-L920 WeakPolarHBondContact O-CB 3.49Å; S917-L920 PolarHBondContact O-N 2.92Å; I918-L920 PolarHBondContact O-N 2.93Å; L920-E922 VanDerWaalsContact C-N 3.33Å; L920-E922 PolarHBondContact O-N 3.3Å; L920-N923 PolarHBondContact O-N 3.49Å; L920-E924 HydrophobicContact CD1-CG 4.44Å; L920-E924 PolarHBondContact O-N 3.31Å
921	V	96.1	Very high	93.9	Very high	1 Å²	1	60.2 Å²	60.2	1%	0.006	29%	0.29	C	S	.	.	H	α-helix	trans	-59.5	-43.1	175.6	176.2	0	0	0	0	111.2	C791 F794 S917 I918 N923 E924 L925 M941 L945	C791-V921 HydrophobicContact CB-CG2 3.93Å; F794-V921 HydrophobicContact CD1-CG2 3.83Å; F794-V921 HydrophobicContact CE1-CG2 4.36Å; S917-V921 WeakPolarHBondContact O-CG2 3.48Å; S917-V921 PolarHBondContact O-N 3.36Å; I918-V921 PolarHBondContact O-N 3.22Å; I918-V921 VanDerWaalsContact O-N 3.15Å; V921-N923 VanDerWaalsContact C-N 3.33Å; V921-N923 PolarHBondContact O-N 3.24Å; V921-E924 PolarHBondContact O-N 3.34Å; V921-L925 HydrophobicContact CG1-CD1 3.9Å; V921-L925 HydrophobicContact CG1-CG 4.42Å; V921-L925 WeakPolarHBondContact O-CB 3.27Å; V921-L925 WeakPolarHBondContact O-CG 3.38Å; V921-L925 PolarHBondContact O-N 3.25Å; V921-M941 HydrophobicContact CG1-CB 4.2Å; V921-M941 HydrophobicContact CG1-SD 4.2Å; V921-M941 HydrophobicContact CG2-SD 4.43Å; V921-L945 HydrophobicContact CB-CD1 4.45Å; V921-L945 HydrophobicContact CG1-CB 4.1Å; V921-L945 HydrophobicContact CG1-CD1 4.28Å; V921-L945 HydrophobicContact CG1-CD2 4.44Å
922	E	95	Very high	93.2	Very high	36 Å²	36	62 Å²	62	17%	0.168	30%	0.303	C	S	.	.	H	α-helix	trans	-58.7	-42.9	175.1	-70.9	-177.7	-173.3	0	0	113	I918 L920 K926 L945 R949	I918-E922 WeakPolarHBondContact O-CG 3.29Å; I918-E922 PolarHBondContact O-N 2.93Å; L920-E922 VanDerWaalsContact C-N 3.33Å; L920-E922 PolarHBondContact O-N 3.3Å; E922-K926 WeakPolarHBondContact O-CB 3.43Å; E922-K926 WeakPolarHBondContact O-CD 3.35Å; E922-K926 WeakPolarHBondContact O-CG 3.36Å; E922-K926 PolarHBondContact O-N 2.92Å; E922-K926 IonicContact OE2-NZ 3.36Å; E922-K926 PolarHBondContact OE2-NZ 3.13Å; E922-L945 HydrophobicContact CG-CD1 3.85Å; E922-L945 HydrophobicContact CG-CD2 3.8Å; E922-L945 HydrophobicContact CG-CG 4.47Å; E922-R949 IonicContact OE1-CZ 3.09Å; E922-R949 VanDerWaalsContact OE1-CZ 3.23Å; E922-R949 IonicContact OE1-NE 3.62Å; E922-R949 PolarHBondContact OE1-NE 2.99Å; E922-R949 IonicContact OE1-NH2 3.58Å; E922-R949 PolarHBondContact OE1-NH2 2.99Å; E922-R949 IonicContact OE2-NH2 2.78Å
923	N	93.8	Very high	92.5	Very high	71 Å²	71	64.9 Å²	64.9	38%	0.38	32%	0.318	S	S	.	.	H	α-helix	trans	-73.9	-33.4	-177.9	-71.4	-29.7	0	0	0	112.3	Q919 L920 V921 Q927	Q919-N923 WeakPolarHBondContact O-CB 3.33Å; Q919-N923 PolarHBondContact O-N 3.34Å; Q919-N923 PolarHBondContact O-ND2 3.41Å; L920-N923 PolarHBondContact O-N 3.49Å; V921-N923 VanDerWaalsContact C-N 3.33Å; V921-N923 PolarHBondContact O-N 3.24Å; N923-Q927 WeakPolarHBondContact O-CB 3.48Å; N923-Q927 WeakPolarHBondContact O-CG 3.47Å; N923-Q927 PolarHBondContact O-N 3.03Å
924	E	92.7	Very high	91.8	Very high	12 Å²	12	64.4 Å²	64.4	6%	0.056	32%	0.319	C	S	.	.	H	α-helix	trans	-70.9	-36.3	172.2	-70.1	-53.2	119	0	0	112.6	R784 P787 L920 V921 Q927 F928 F937	R784-E924 IonicContact CZ-OE1 3.43Å; R784-E924 IonicContact CZ-OE2 2.62Å; R784-E924 IonicContact NE-OE1 3.15Å; R784-E924 PolarHBondContact NE-OE1 3.36Å; R784-E924 IonicContact NE-OE2 3.97Å; R784-E924 PolarHBondContact NE-OE2 2.89Å; R784-E924 IonicContact NH2-OE1 3.21Å; R784-E924 PolarHBondContact NH2-OE1 3.31Å; R784-E924 IonicContact NH2-OE2 3.8Å; P787-E924 HydrophobicContact CB-CG 3.67Å; P787-E924 VanDerWaalsContact CB-OE1 3.27Å; P787-E924 WeakPolarHBondContact CB-OE1 3.21Å; P787-E924 WeakPolarHBondContact CB-OE2 3.46Å; L920-E924 HydrophobicContact CD1-CG 4.44Å; L920-E924 PolarHBondContact O-N 3.31Å; V921-E924 PolarHBondContact O-N 3.34Å; E924-Q927 CarbonylContact O-C 3.25Å; E924-Q927 PolarHBondContact O-N 3.26Å; E924-F928 WeakPolarHBondContact O-CA 3.23Å; E924-F928 PolarHBondContact O-N 3.33Å; E924-F937 HydrophobicContact CB-CE1 4.34Å; E924-F937 HydrophobicContact CB-CZ 4.24Å
925	L	92.2	Very high	91.5	Very high	22 Å²	22	65 Å²	65	12%	0.115	32%	0.321	C	S	.	.	H	α-helix	trans	-67.2	-45.6	172.8	-75	170.8	0	0	0	111.8	V921 Q927 F928 F937 E938 M941 L945	V921-L925 HydrophobicContact CG1-CD1 3.9Å; V921-L925 HydrophobicContact CG1-CG 4.42Å; V921-L925 WeakPolarHBondContact O-CB 3.27Å; V921-L925 WeakPolarHBondContact O-CG 3.38Å; V921-L925 PolarHBondContact O-N 3.25Å; L925-Q927 PolarHBondContact O-N 2.87Å; L925-Q927 VanDerWaalsContact O-N 3.12Å; L925-F928 WeakPolarHBondContact O-CB 3.45Å; L925-F928 PolarHBondContact O-N 3.01Å; L925-F937 HydrophobicContact CD2-CE1 4.45Å; L925-E938 HydrophobicContact CD2-CB 4.36Å; L925-E938 HydrophobicContact CD2-CG 4.23Å; L925-M941 HydrophobicContact CD1-CB 4.22Å; L925-M941 HydrophobicContact CD2-CB 4.02Å; L925-M941 HydrophobicContact CG-CB 4.33Å; L925-L945 HydrophobicContact CD1-CB 4.42Å; L925-L945 HydrophobicContact CD1-CD2 3.68Å
926	K	91.4	Very high	91.1	Very high	142 Å²	142	67.4 Å²	67.4	62%	0.617	33%	0.327	S	S	*	.	H	α-helix	trans	-58.8	-23.2	173.7	-72.6	161.7	-169.5	158.7	0	113.3	E922	E922-K926 WeakPolarHBondContact O-CB 3.43Å; E922-K926 WeakPolarHBondContact O-CD 3.35Å; E922-K926 WeakPolarHBondContact O-CG 3.36Å; E922-K926 PolarHBondContact O-N 2.92Å; E922-K926 IonicContact OE2-NZ 3.36Å; E922-K926 PolarHBondContact OE2-NZ 3.13Å
927	Q	89.2	Confident	90.8	Very high	90 Å²	90	63.1 Å²	63.1	42%	0.421	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117	21.5	-178.2	-58.6	179.4	28.9	0	0	112.4	R784 N923 E924 L925 Q929	R784-Q927 VanDerWaalsContact CZ-OE1 3.23Å; N923-Q927 WeakPolarHBondContact O-CB 3.48Å; N923-Q927 WeakPolarHBondContact O-CG 3.47Å; N923-Q927 PolarHBondContact O-N 3.03Å; E924-Q927 CarbonylContact O-C 3.25Å; E924-Q927 PolarHBondContact O-N 3.26Å; L925-Q927 PolarHBondContact O-N 2.87Å; L925-Q927 VanDerWaalsContact O-N 3.12Å; Q927-Q929 VanDerWaalsContact C-NE2 3.34Å; Q927-Q929 PolarHBondContact O-NE2 3.49Å
928	F	89.4	Confident	90.6	Very high	33 Å²	33	66.4 Å²	66.4	15%	0.145	32%	0.317	C	S	.	.			trans	-73.1	143.2	178.8	179	-102.6	0	0	0	111.7	E924 L925 L930 F937 E938	E924-F928 WeakPolarHBondContact O-CA 3.23Å; E924-F928 PolarHBondContact O-N 3.33Å; L925-F928 WeakPolarHBondContact O-CB 3.45Å; L925-F928 PolarHBondContact O-N 3.01Å; F928-L930 HydrophobicContact CE1-CB 4.27Å; F928-L930 HydrophobicContact CE1-CD1 4.44Å; F928-L930 HydrophobicContact CZ-CB 4.45Å; F928-L930 HydrophobicContact CZ-CD1 4.18Å; F928-F937 AromaticContact CD2-CD1 3.83Å; F928-F937 HydrophobicContact CD2-CD1 3.83Å; F928-F937 HydrophobicContact CD2-CE1 4.46Å; F928-F937 HydrophobicContact CE2-CB 4.14Å; F928-F937 AromaticContact CE2-CD1 3.97Å; F928-F937 HydrophobicContact CE2-CD1 3.97Å; F928-F937 HydrophobicContact CE2-CG 4.5Å; F928-E938 HydrophobicContact CD1-CB 3.77Å; F928-E938 HydrophobicContact CD1-CG 4.12Å; F928-E938 HydrophobicContact CD2-CB 4.31Å; F928-E938 HydrophobicContact CE1-CB 3.52Å; F928-E938 HydrophobicContact CE1-CG 4.19Å; F928-E938 WeakPolarHBondContact CE1-OE2 3.41Å; F928-E938 HydrophobicContact CE2-CB 4.08Å; F928-E938 HydrophobicContact CG-CB 4.16Å; F928-E938 HydrophobicContact CZ-CB 3.69Å
929	Q	87	Confident	90.2	Very high	108 Å²	108	73.5 Å²	73.5	51%	0.505	35%	0.348	S	S	.	.			trans	-137.7	135.7	160.8	-63.8	84.6	61.1	0	0	107.5	Q927 Q931	Q927-Q929 VanDerWaalsContact C-NE2 3.34Å; Q927-Q929 PolarHBondContact O-NE2 3.49Å; Q929-Q931 WeakPolarHBondContact O-CG 3.44Å; Q929-Q931 PolarHBondContact O-N 3.25Å
930	L	89	Confident	90	Very high	114 Å²	114	72.3 Å²	72.3	60%	0.597	34%	0.344	S	S	*	.			trans	-59.8	123.1	177.5	-170.7	75.2	0	0	0	110.4	F928 D935	F928-L930 HydrophobicContact CE1-CB 4.27Å; F928-L930 HydrophobicContact CE1-CD1 4.44Å; F928-L930 HydrophobicContact CZ-CB 4.45Å; F928-L930 HydrophobicContact CZ-CD1 4.18Å; L930-D935 HydrophobicContact CD1-CB 3.95Å
931	Q	85.7	Confident	89.9	Confident	61 Å²	61	70.1 Å²	70.1	29%	0.285	33%	0.332	S	S	.	.			trans	-95.4	-25.9	-176	-56.3	-166.2	42.5	0	0	113.8	L731 R783 Q929 D935	L731-Q931 HydrophobicContact CD2-CB 4.33Å; R783-Q931 PolarHBondContact O-NE2 3.48Å; Q929-Q931 WeakPolarHBondContact O-CG 3.44Å; Q929-Q931 PolarHBondContact O-N 3.25Å; Q931-D935 PolarHBondContact N-OD2 3.25Å
932	C	82.6	Confident	89.7	Confident	51 Å²	51	73.7 Å²	73.7	35%	0.345	35%	0.351	S	S	.	.	S	Bend	trans	-160.8	170.6	171.4	64.7	0	0	0	0	110.1	N934 D935	C932-N934 PolarHBondContact O-N 2.9Å; C932-D935 WeakPolarHBondContact O-CB 3.25Å; C932-D935 PolarHBondContact O-N 3.14Å
933	E	82.2	Confident	89.5	Confident	191 Å²	191	77 Å²	77	89%	0.893	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-26.6	179.6	-59.9	178.8	167.1	0	0	113.6
934	N	82.5	Confident	89.6	Confident	82 Å²	82	74.1 Å²	74.1	44%	0.439	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.4	2.1	178.5	-75.6	18.1	0	0	0	114.1	E732 C932 R936	E732-N934 HydrophobicContact CG-CB 3.99Å; E732-N934 WeakPolarHBondContact CG-O 3.35Å; E732-N934 PolarHBondContact OE1-ND2 2.91Å; C932-N934 PolarHBondContact O-N 2.9Å; N934-R936 PolarHBondContact O-N 2.83Å
935	D	90.2	Very high	89.7	Confident	11 Å²	11	74.1 Å²	74.1	6%	0.059	35%	0.354	C	S	.	.			trans	-72.6	101.4	-179.1	-174.8	0.2	0	0	0	110.9	L731 R788 L930 Q931 C932 F937	L731-D935 WeakPolarHBondContact O-CA 3.24Å; R788-D935 IonicContact CZ-OD1 2.93Å; R788-D935 IonicContact CZ-OD2 3.5Å; R788-D935 IonicContact NH1-OD1 3.08Å; R788-D935 PolarHBondContact NH1-OD1 2.86Å; R788-D935 IonicContact NH1-OD2 4Å; R788-D935 VanDerWaalsContact NH2-CG 3.34Å; R788-D935 IonicContact NH2-OD1 3.52Å; R788-D935 PolarHBondContact NH2-OD1 2.95Å; R788-D935 VanDerWaalsContact NH2-OD1 3.09Å; R788-D935 IonicContact NH2-OD2 2.72Å; R788-D935 PolarHBondContact NH2-OD2 3.09Å; L930-D935 HydrophobicContact CD1-CB 3.95Å; Q931-D935 PolarHBondContact N-OD2 3.25Å; C932-D935 WeakPolarHBondContact O-CB 3.25Å; C932-D935 PolarHBondContact O-N 3.14Å; D935-F937 VanDerWaalsContact OD1-CB 3.31Å; D935-F937 WeakPolarHBondContact OD1-CB 3.26Å; D935-F937 PolarHBondContact OD1-N 2.83Å
936	R	90	Very high	89.6	Confident	138 Å²	138	75.9 Å²	75.9	52%	0.521	37%	0.369	S	S	.	.			trans	-91.2	-1.1	-174.5	-68.6	175	-176.8	178.2	3.5	113.6	L731 E732 N934 E938 K939 L940	L731-R936 PolarHBondContact O-N 3.28Å; E732-R936 WeakPolarHBondContact O-CD 3.18Å; N934-R936 PolarHBondContact O-N 2.83Å; R936-E938 PolarHBondContact O-N 3.18Å; R936-K939 PolarHBondContact O-N 3.45Å; R936-L940 HydrophobicContact CB-CD1 3.86Å; R936-L940 HydrophobicContact CB-CG 4.34Å; R936-L940 PolarHBondContact O-N 3.01Å; R936-L940 VanDerWaalsContact O-N 3.14Å
937	F	92	Very high	89.6	Confident	3 Å²	3	75 Å²	75	1%	0.013	37%	0.367	C	S	.	.	H	α-helix	trans	-56.3	-51.3	-167.4	177.9	-88.1	0	0	0	113.1	I733 R788 C791 I792 E924 L925 F928 D935 K939 L940 M941	I733-F937 HydrophobicContact CD1-CB 4.3Å; I733-F937 HydrophobicContact CD1-CD2 3.94Å; I733-F937 HydrophobicContact CD1-CG 4.48Å; R788-F937 HydrophobicContact CB-CE2 4.24Å; R788-F937 HydrophobicContact CG-CD2 3.8Å; R788-F937 HydrophobicContact CG-CE2 3.73Å; C791-F937 HydrophobicContact CB-CE2 3.84Å; C791-F937 HydrophobicContact CB-CZ 3.82Å; I792-F937 HydrophobicContact CG1-CE2 4.44Å; E924-F937 HydrophobicContact CB-CE1 4.34Å; E924-F937 HydrophobicContact CB-CZ 4.24Å; L925-F937 HydrophobicContact CD2-CE1 4.45Å; F928-F937 AromaticContact CD2-CD1 3.83Å; F928-F937 HydrophobicContact CD2-CD1 3.83Å; F928-F937 HydrophobicContact CD2-CE1 4.46Å; F928-F937 HydrophobicContact CE2-CB 4.14Å; F928-F937 AromaticContact CE2-CD1 3.97Å; F928-F937 HydrophobicContact CE2-CD1 3.97Å; F928-F937 HydrophobicContact CE2-CG 4.5Å; D935-F937 VanDerWaalsContact OD1-CB 3.31Å; D935-F937 WeakPolarHBondContact OD1-CB 3.26Å; D935-F937 PolarHBondContact OD1-N 2.83Å; F937-K939 PolarHBondContact O-N 2.89Å; F937-L940 PolarHBondContact O-N 3.47Å; F937-M941 HydrophobicContact CD1-CG 4.2Å; F937-M941 HydrophobicContact CD2-CE 4.45Å; F937-M941 HydrophobicContact CD2-CG 3.9Å; F937-M941 HydrophobicContact CE1-CB 4.43Å; F937-M941 HydrophobicContact CE1-CG 4.06Å; F937-M941 HydrophobicContact CE2-CE 4.12Å; F937-M941 HydrophobicContact CE2-CG 3.73Å; F937-M941 HydrophobicContact CE2-SD 4.4Å; F937-M941 HydrophobicContact CG-CG 4.13Å; F937-M941 HydrophobicContact CZ-CG 3.82Å; F937-M941 WeakPolarHBondContact O-CB 3.29Å; F937-M941 VanDerWaalsContact O-CG 3.29Å; F937-M941 WeakPolarHBondContact O-CG 3.24Å; F937-M941 PolarHBondContact O-N 3.44Å
938	E	91.9	Very high	89.9	Confident	92 Å²	92	70.7 Å²	70.7	43%	0.43	35%	0.347	S	S	.	.	H	α-helix	trans	-57.2	-46.3	-178.9	177	178.8	-141.4	0	0	112.7	L925 F928 R936 N942	L925-E938 HydrophobicContact CD2-CB 4.36Å; L925-E938 HydrophobicContact CD2-CG 4.23Å; F928-E938 HydrophobicContact CD1-CB 3.77Å; F928-E938 HydrophobicContact CD1-CG 4.12Å; F928-E938 HydrophobicContact CD2-CB 4.31Å; F928-E938 HydrophobicContact CE1-CB 3.52Å; F928-E938 HydrophobicContact CE1-CG 4.19Å; F928-E938 WeakPolarHBondContact CE1-OE2 3.41Å; F928-E938 HydrophobicContact CE2-CB 4.08Å; F928-E938 HydrophobicContact CG-CB 4.16Å; F928-E938 HydrophobicContact CZ-CB 3.69Å; R936-E938 PolarHBondContact O-N 3.18Å; E938-N942 WeakPolarHBondContact CG-ND2 3.39Å; E938-N942 VanDerWaalsContact O-CB 3.32Å; E938-N942 WeakPolarHBondContact O-CB 3.37Å; E938-N942 PolarHBondContact O-N 2.89Å; E938-N942 PolarHBondContact O-ND2 3.27Å
939	K	89.4	Confident	90.2	Very high	158 Å²	158	74.3 Å²	74.3	69%	0.687	36%	0.359	S	S	*	.	H	α-helix	trans	-66.3	-45.7	-177.8	-178	175.8	179.1	177.3	0	112.1	R936 F937 N943	R936-K939 PolarHBondContact O-N 3.45Å; F937-K939 PolarHBondContact O-N 2.89Å; K939-N943 PolarHBondContact O-N 3.5Å
940	L	92	Very high	90.3	Very high	56 Å²	56	70.9 Å²	70.9	29%	0.293	34%	0.344	S	S	.	.	H	α-helix	trans	-72.8	-39	-178.2	-66.1	173.9	0	0	0	111.5	I733 R936 F937 F944	I733-L940 HydrophobicContact CB-CD1 3.86Å; I733-L940 HydrophobicContact CD1-CB 4.21Å; I733-L940 HydrophobicContact CD1-CD1 4.22Å; I733-L940 HydrophobicContact CG1-CD1 4.32Å; R936-L940 HydrophobicContact CB-CD1 3.86Å; R936-L940 HydrophobicContact CB-CG 4.34Å; R936-L940 PolarHBondContact O-N 3.01Å; R936-L940 VanDerWaalsContact O-N 3.14Å; F937-L940 PolarHBondContact O-N 3.47Å; L940-F944 WeakPolarHBondContact O-CB 3.45Å; L940-F944 PolarHBondContact O-N 2.89Å
941	M	93.2	Very high	90.6	Very high	0 Å²	0	67 Å²	67	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-73.4	-32.7	178.9	-71.3	-70.7	162.4	0	0	113.3	I733 C791 I792 K795 V921 L925 F937 F944 L945	I733-M941 HydrophobicContact CD1-CE 3.89Å; I733-M941 HydrophobicContact CD1-CG 4.45Å; C791-M941 HydrophobicContact CB-CE 4.11Å; C791-M941 HydrophobicContact CB-SD 4.09Å; C791-M941 WeakPolarHBondContact O-CE 3.41Å; I792-M941 HydrophobicContact CB-CE 4.36Å; I792-M941 HydrophobicContact CG1-CE 3.86Å; K795-M941 HydrophobicContact CB-CE 4.1Å; K795-M941 HydrophobicContact CD-CE 4.41Å; V921-M941 HydrophobicContact CG1-CB 4.2Å; V921-M941 HydrophobicContact CG1-SD 4.2Å; V921-M941 HydrophobicContact CG2-SD 4.43Å; L925-M941 HydrophobicContact CD1-CB 4.22Å; L925-M941 HydrophobicContact CD2-CB 4.02Å; L925-M941 HydrophobicContact CG-CB 4.33Å; F937-M941 HydrophobicContact CD1-CG 4.2Å; F937-M941 HydrophobicContact CD2-CE 4.45Å; F937-M941 HydrophobicContact CD2-CG 3.9Å; F937-M941 HydrophobicContact CE1-CB 4.43Å; F937-M941 HydrophobicContact CE1-CG 4.06Å; F937-M941 HydrophobicContact CE2-CE 4.12Å; F937-M941 HydrophobicContact CE2-CG 3.73Å; F937-M941 HydrophobicContact CE2-SD 4.4Å; F937-M941 HydrophobicContact CG-CG 4.13Å; F937-M941 HydrophobicContact CZ-CG 3.82Å; F937-M941 WeakPolarHBondContact O-CB 3.29Å; F937-M941 VanDerWaalsContact O-CG 3.29Å; F937-M941 WeakPolarHBondContact O-CG 3.24Å; F937-M941 PolarHBondContact O-N 3.44Å; M941-F944 HydrophobicContact SD-CD1 3.9Å; M941-L945 WeakPolarHBondContact O-CB 3.38Å; M941-L945 PolarHBondContact O-N 3.13Å
942	N	92.8	Very high	91.1	Very high	76 Å²	76	65.5 Å²	65.5	41%	0.406	32%	0.315	S	S	.	.	H	α-helix	trans	-64.3	-46	172.7	-87.2	-65.7	0	0	0	111.8	E938 L945 S946	E938-N942 WeakPolarHBondContact CG-ND2 3.39Å; E938-N942 VanDerWaalsContact O-CB 3.32Å; E938-N942 WeakPolarHBondContact O-CB 3.37Å; E938-N942 PolarHBondContact O-N 2.89Å; E938-N942 PolarHBondContact O-ND2 3.27Å; N942-L945 PolarHBondContact O-N 3.26Å; N942-S946 PolarHBondContact O-N 3.08Å
943	N	90.6	Very high	91.6	Very high	107 Å²	107	67.9 Å²	67.9	57%	0.572	32%	0.321	S	S	*	.	H	α-helix	trans	-58.6	-51.9	176.3	-71.9	1.5	0	0	0	110.9	K939 L945 S946 E947	K939-N943 PolarHBondContact O-N 3.5Å; N943-L945 PolarHBondContact O-N 3.23Å; N943-S946 PolarHBondContact O-N 3.08Å; N943-E947 PolarHBondContact O-N 2.71Å
944	F	95.1	Very high	92.2	Very high	9 Å²	9	58.9 Å²	58.9	4%	0.039	28%	0.279	C	S	.	.	H	α-helix	trans	-62.6	-39.1	178.9	167.2	-115.6	0	0	0	112.9	F794 K795 F798 L940 M941 S946 E947 A948	F794-F944 AromaticContact CD1-CE1 3.55Å; F794-F944 HydrophobicContact CD1-CE1 3.55Å; F794-F944 AromaticContact CD1-CZ 3.71Å; F794-F944 HydrophobicContact CD1-CZ 3.71Å; F794-F944 AromaticContact CE1-CE1 3.63Å; F794-F944 HydrophobicContact CE1-CE1 3.63Å; F794-F944 AromaticContact CE1-CZ 3.52Å; F794-F944 HydrophobicContact CE1-CZ 3.52Å; F794-F944 HydrophobicContact CG-CZ 4.48Å; F794-F944 HydrophobicContact CZ-CZ 4.18Å; K795-F944 HydrophobicContact CB-CD1 3.96Å; K795-F944 HydrophobicContact CB-CE1 3.76Å; K795-F944 HydrophobicContact CB-CE2 4.4Å; K795-F944 HydrophobicContact CB-CG 4.36Å; K795-F944 HydrophobicContact CB-CZ 4.02Å; K795-F944 HydrophobicContact CD-CB 4.39Å; K795-F944 HydrophobicContact CD-CD1 4.42Å; K795-F944 HydrophobicContact CD-CG 4.18Å; K795-F944 HydrophobicContact CG-CD1 4Å; K795-F944 HydrophobicContact CG-CD2 3.92Å; K795-F944 HydrophobicContact CG-CE1 4.15Å; K795-F944 HydrophobicContact CG-CE2 4.09Å; K795-F944 HydrophobicContact CG-CG 3.88Å; K795-F944 HydrophobicContact CG-CZ 4.21Å; F798-F944 HydrophobicContact CB-CE2 3.69Å; F798-F944 HydrophobicContact CB-CZ 3.86Å; F798-F944 AromaticContact CD1-CE2 3.75Å; F798-F944 HydrophobicContact CD1-CE2 3.75Å; F798-F944 HydrophobicContact CD2-CE2 4.02Å; F798-F944 HydrophobicContact CD2-CZ 4.15Å; F798-F944 HydrophobicContact CE1-CE2 4.37Å; F798-F944 AromaticContact CG-CE2 3.54Å; F798-F944 HydrophobicContact CG-CE2 3.54Å; F798-F944 AromaticContact CG-CZ 3.96Å; F798-F944 HydrophobicContact CG-CZ 3.96Å; L940-F944 WeakPolarHBondContact O-CB 3.45Å; L940-F944 PolarHBondContact O-N 2.89Å; M941-F944 HydrophobicContact SD-CD1 3.9Å; F944-S946 VanDerWaalsContact C-N 3.3Å; F944-S946 PolarHBondContact O-N 3.38Å; F944-E947 PolarHBondContact O-N 2.65Å; F944-A948 HydrophobicContact CE2-CB 4.04Å; F944-A948 HydrophobicContact CZ-CB 4.06Å; F944-A948 VanDerWaalsContact O-CB 3.3Å; F944-A948 WeakPolarHBondContact O-CB 3.43Å; F944-A948 PolarHBondContact O-N 3.46Å
945	L	95.1	Very high	92.9	Very high	12 Å²	12	55 Å²	55	6%	0.063	26%	0.259	C	S	.	.	H	α-helix	trans	-62.2	-36.9	177.7	174.6	62.7	0	0	0	111.9	I918 V921 E922 L925 M941 N942 N943 R949	I918-L945 HydrophobicContact CG2-CD1 3.83Å; V921-L945 HydrophobicContact CB-CD1 4.45Å; V921-L945 HydrophobicContact CG1-CB 4.1Å; V921-L945 HydrophobicContact CG1-CD1 4.28Å; V921-L945 HydrophobicContact CG1-CD2 4.44Å; E922-L945 HydrophobicContact CG-CD1 3.85Å; E922-L945 HydrophobicContact CG-CD2 3.8Å; E922-L945 HydrophobicContact CG-CG 4.47Å; L925-L945 HydrophobicContact CD1-CB 4.42Å; L925-L945 HydrophobicContact CD1-CD2 3.68Å; M941-L945 WeakPolarHBondContact O-CB 3.38Å; M941-L945 PolarHBondContact O-N 3.13Å; N942-L945 PolarHBondContact O-N 3.26Å; N943-L945 PolarHBondContact O-N 3.23Å; L945-R949 HydrophobicContact CD1-CG 3.95Å; L945-R949 HydrophobicContact CG-CG 4.41Å; L945-R949 VanDerWaalsContact O-CB 3.3Å; L945-R949 WeakPolarHBondContact O-CB 3.34Å; L945-R949 WeakPolarHBondContact O-CD 3.46Å; L945-R949 VanDerWaalsContact O-CG 3.22Å; L945-R949 WeakPolarHBondContact O-CG 3.33Å; L945-R949 PolarHBondContact O-N 2.92Å
946	S	90.7	Very high	93.2	Very high	60 Å²	60	56.1 Å²	56.1	42%	0.42	27%	0.27	S	S	.	.	H	α-helix	trans	-63.8	-45.5	176.1	-165	0	0	0	0	111.7	N942 N943 F944 E950	N942-S946 PolarHBondContact O-N 3.08Å; N943-S946 PolarHBondContact O-N 3.08Å; F944-S946 VanDerWaalsContact C-N 3.3Å; F944-S946 PolarHBondContact O-N 3.38Å; S946-E950 PolarHBondContact O-N 3.3Å
947	E	91.2	Very high	93.4	Very high	122 Å²	122	51.4 Å²	51.4	57%	0.57	25%	0.253	S	S	*	.	H	α-helix	trans	-63.8	-47.9	176.2	-177.8	-179.9	-178.8	0	0	111.6	F798 N943 F944 R949 E950 Q951	F798-E947 HydrophobicContact CE1-CG 4.41Å; N943-E947 PolarHBondContact O-N 2.71Å; F944-E947 PolarHBondContact O-N 2.65Å; E947-R949 PolarHBondContact O-N 3.39Å; E947-E950 PolarHBondContact O-N 3.4Å; E947-Q951 WeakPolarHBondContact O-CB 3.31Å; E947-Q951 PolarHBondContact O-N 3.07Å
948	A	95.8	Very high	93.6	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-62.4	-39.5	179.9	0	0	0	0	0	112.7	F794 F798 I918 F944 H952	F794-A948 HydrophobicContact CE1-CB 4.37Å; F794-A948 HydrophobicContact CZ-CB 4.47Å; F798-A948 HydrophobicContact CD2-CB 4.23Å; F798-A948 HydrophobicContact CE2-CB 3.74Å; F798-A948 HydrophobicContact CZ-CB 4.09Å; I918-A948 HydrophobicContact CD1-CB 4.23Å; I918-A948 WeakPolarHBondContact CD1-O 3.48Å; I918-A948 HydrophobicContact CG1-CB 4.11Å; F944-A948 HydrophobicContact CE2-CB 4.04Å; F944-A948 HydrophobicContact CZ-CB 4.06Å; F944-A948 VanDerWaalsContact O-CB 3.3Å; F944-A948 WeakPolarHBondContact O-CB 3.43Å; F944-A948 PolarHBondContact O-N 3.46Å; A948-H952 WeakPolarHBondContact O-CB 3.43Å; A948-H952 PolarHBondContact O-N 3.06Å
949	R	94.5	Very high	93.9	Very high	109 Å²	109	48.4 Å²	48.4	41%	0.411	24%	0.239	S	C	.	.	H	α-helix	trans	-63.1	-49.6	174.7	-80	168.3	161.1	-164.1	-12.1	112.1	I918 E922 L945 E947 H952 Q953	I918-R949 HydrophobicContact CG2-CG 3.93Å; E922-R949 IonicContact OE1-CZ 3.09Å; E922-R949 VanDerWaalsContact OE1-CZ 3.23Å; E922-R949 IonicContact OE1-NE 3.62Å; E922-R949 PolarHBondContact OE1-NE 2.99Å; E922-R949 IonicContact OE1-NH2 3.58Å; E922-R949 PolarHBondContact OE1-NH2 2.99Å; E922-R949 IonicContact OE2-NH2 2.78Å; L945-R949 HydrophobicContact CD1-CG 3.95Å; L945-R949 HydrophobicContact CG-CG 4.41Å; L945-R949 VanDerWaalsContact O-CB 3.3Å; L945-R949 WeakPolarHBondContact O-CB 3.34Å; L945-R949 WeakPolarHBondContact O-CD 3.46Å; L945-R949 VanDerWaalsContact O-CG 3.22Å; L945-R949 WeakPolarHBondContact O-CG 3.33Å; L945-R949 PolarHBondContact O-N 2.92Å; E947-R949 PolarHBondContact O-N 3.39Å; R949-H952 PolarHBondContact O-N 3.32Å; R949-Q953 WeakPolarHBondContact O-CB 3.46Å; R949-Q953 VanDerWaalsContact O-CG 3.28Å; R949-Q953 WeakPolarHBondContact O-CG 3.3Å; R949-Q953 PolarHBondContact O-N 3.22Å
950	E	90.7	Very high	94.2	Very high	37 Å²	37	45.2 Å²	45.2	17%	0.173	23%	0.226	C	C	.	.	H	α-helix	trans	-61.4	-47.8	-179.9	-174.6	175.8	141.3	0	0	111.1	S531 G533 T534 S946 E947 Q953 L954	S531-E950 WeakPolarHBondContact CB-OE2 3.34Å; S531-E950 PolarHBondContact OG-OE2 2.82Å; G533-E950 VanDerWaalsContact CA-OE1 3.22Å; G533-E950 WeakPolarHBondContact CA-OE1 3.44Å; G533-E950 WeakPolarHBondContact CA-OE2 3.4Å; G533-E950 PolarHBondContact N-OE2 3.32Å; T534-E950 PolarHBondContact N-OE1 3.12Å; S946-E950 PolarHBondContact O-N 3.3Å; E947-E950 PolarHBondContact O-N 3.4Å; E950-Q953 PolarHBondContact O-N 3.19Å; E950-L954 WeakPolarHBondContact O-CB 3.36Å; E950-L954 PolarHBondContact O-N 3.2Å
951	Q	94.1	Very high	94.4	Very high	33 Å²	33	46.2 Å²	46.2	15%	0.154	23%	0.228	C	C	.	.	H	α-helix	trans	-68.1	-37	-178.9	-172.5	57.8	26.5	0	0	112.3	F798 V802 E947 L954 L955	F798-Q951 HydrophobicContact CZ-CB 3.82Å; F798-Q951 HydrophobicContact CZ-CG 3.95Å; V802-Q951 HydrophobicContact CG1-CG 4.28Å; V802-Q951 HydrophobicContact CG2-CG 3.67Å; E947-Q951 WeakPolarHBondContact O-CB 3.31Å; E947-Q951 PolarHBondContact O-N 3.07Å; Q951-L954 PolarHBondContact O-N 3.04Å; Q951-L955 HydrophobicContact CG-CD1 4.2Å; Q951-L955 WeakPolarHBondContact O-CB 3.36Å; Q951-L955 VanDerWaalsContact O-CG 3.28Å; Q951-L955 WeakPolarHBondContact O-CG 3.05Å; Q951-L955 PolarHBondContact O-N 3.05Å
952	H	96.6	Very high	94.6	Very high	28 Å²	28	46.2 Å²	46.2	13%	0.13	23%	0.228	C	C	.	.	H	α-helix	trans	-64.1	-45.1	171.8	169.5	-91.2	0	0	0	111.7	M914 I918 A948 R949 L954 L955 A956	M914-H952 HydrophobicContact CG-CB 4.36Å; M914-H952 HydrophobicContact SD-CB 3.92Å; I918-H952 HydrophobicContact CD1-CB 3.48Å; I918-H952 VanDerWaalsContact CD1-CB 3.48Å; A948-H952 WeakPolarHBondContact O-CB 3.43Å; A948-H952 PolarHBondContact O-N 3.06Å; R949-H952 PolarHBondContact O-N 3.32Å; H952-L954 VanDerWaalsContact C-N 3.27Å; H952-L954 PolarHBondContact O-N 2.94Å; H952-L955 PolarHBondContact O-N 3.2Å; H952-A956 VanDerWaalsContact O-CB 3.24Å; H952-A956 WeakPolarHBondContact O-CB 3.36Å; H952-A956 PolarHBondContact O-N 3.41Å
953	Q	93.9	Very high	94.8	Very high	101 Å²	101	45.6 Å²	45.6	47%	0.472	22%	0.224	S	C	.	.	H	α-helix	trans	-60.3	-38.1	175.3	-74.9	173.6	-5.9	0	0	111.8	Q496 R949 E950 K957	Q496-Q953 PolarHBondContact NE2-O 3.05Å; Q496-Q953 VanDerWaalsContact NE2-O 3.08Å; R949-Q953 WeakPolarHBondContact O-CB 3.46Å; R949-Q953 VanDerWaalsContact O-CG 3.28Å; R949-Q953 WeakPolarHBondContact O-CG 3.3Å; R949-Q953 PolarHBondContact O-N 3.22Å; E950-Q953 PolarHBondContact O-N 3.19Å; Q953-K957 WeakPolarHBondContact O-CB 3.49Å; Q953-K957 WeakPolarHBondContact O-CG 3.15Å; Q953-K957 PolarHBondContact O-N 3.05Å
954	L	93.9	Very high	95.1	Very high	3 Å²	3	45 Å²	45	2%	0.016	22%	0.221	C	C	.	.	H	α-helix	trans	-63.9	-54.2	174.6	179.4	58.7	0	0	0	111.5	E489 A492 K493 E950 Q951 H952 A956 K957 M958	E489-L954 HydrophobicContact CG-CD2 4.24Å; A492-L954 HydrophobicContact CB-CD1 3.72Å; K493-L954 HydrophobicContact CD-CD1 4.42Å; K493-L954 HydrophobicContact CG-CD1 3.78Å; E950-L954 WeakPolarHBondContact O-CB 3.36Å; E950-L954 PolarHBondContact O-N 3.2Å; Q951-L954 PolarHBondContact O-N 3.04Å; H952-L954 VanDerWaalsContact C-N 3.27Å; H952-L954 PolarHBondContact O-N 2.94Å; L954-A956 VanDerWaalsContact C-N 3.35Å; L954-A956 PolarHBondContact O-N 3.45Å; L954-K957 PolarHBondContact O-N 3.46Å; L954-M958 HydrophobicContact CD1-CG 4.3Å; L954-M958 HydrophobicContact CD1-SD 4.15Å; L954-M958 HydrophobicContact CG-SD 3.99Å; L954-M958 VanDerWaalsContact O-CG 3.32Å; L954-M958 WeakPolarHBondContact O-CG 3.17Å; L954-M958 PolarHBondContact O-N 3.22Å
955	L	97.4	Very high	95.2	Very high	0 Å²	0	46 Å²	46	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-64.6	-37.2	-178.2	-66.4	173	0	0	0	112.2	V802 I805 K806 I809 L911 M914 Q951 H952 M958 H959	V802-L955 HydrophobicContact CG1-CD1 4.46Å; V802-L955 HydrophobicContact CG2-CD1 4.15Å; I805-L955 HydrophobicContact CB-CD1 4.36Å; I805-L955 HydrophobicContact CG2-CB 4.23Å; I805-L955 HydrophobicContact CG2-CD1 4Å; I805-L955 HydrophobicContact CG2-CD2 4.25Å; I805-L955 HydrophobicContact CG2-CG 4.39Å; K806-L955 HydrophobicContact CB-CD2 3.77Å; K806-L955 HydrophobicContact CG-CD2 3.92Å; I809-L955 HydrophobicContact CD1-CB 4.45Å; I809-L955 HydrophobicContact CD1-CD2 4.35Å; L911-L955 HydrophobicContact CD2-CB 3.86Å; M914-L955 HydrophobicContact CE-CD1 4.35Å; M914-L955 HydrophobicContact SD-CD1 4.43Å; Q951-L955 HydrophobicContact CG-CD1 4.2Å; Q951-L955 WeakPolarHBondContact O-CB 3.36Å; Q951-L955 VanDerWaalsContact O-CG 3.28Å; Q951-L955 WeakPolarHBondContact O-CG 3.05Å; Q951-L955 PolarHBondContact O-N 3.05Å; H952-L955 PolarHBondContact O-N 3.2Å; L955-M958 HydrophobicContact CD2-SD 4.3Å; L955-M958 PolarHBondContact O-N 3.48Å; L955-H959 VanDerWaalsContact O-CB 3.31Å; L955-H959 WeakPolarHBondContact O-CB 3.25Å; L955-H959 PolarHBondContact O-N 2.96Å
956	A	96.5	Very high	95.3	Very high	35 Å²	35	45.8 Å²	45.8	29%	0.289	23%	0.228	S	C	.	.	H	α-helix	trans	-61.4	-44	173.9	0	0	0	0	0	112	H952 L954 H959 E960	H952-A956 VanDerWaalsContact O-CB 3.24Å; H952-A956 WeakPolarHBondContact O-CB 3.36Å; H952-A956 PolarHBondContact O-N 3.41Å; L954-A956 VanDerWaalsContact C-N 3.35Å; L954-A956 PolarHBondContact O-N 3.45Å; A956-H959 PolarHBondContact O-N 3.22Å; A956-E960 PolarHBondContact O-N 3.05Å
957	K	94.3	Very high	95.6	Very high	38 Å²	38	45.4 Å²	45.4	17%	0.165	22%	0.221	C	C	.	.	H	α-helix	trans	-70.7	-32.1	176.3	-77.7	-78.3	158.8	-170	0	113.2	A492 Q496 E499 Q953 L954 E960 K961	A492-K957 HydrophobicContact CB-CB 4.46Å; Q496-K957 HydrophobicContact CG-CG 3.99Å; E499-K957 WeakPolarHBondContact OE1-CE 3.38Å; E499-K957 IonicContact OE1-NZ 2.71Å; E499-K957 PolarHBondContact OE1-NZ 3.48Å; E499-K957 WeakPolarHBondContact OE2-CE 3.3Å; E499-K957 IonicContact OE2-NZ 2.74Å; E499-K957 PolarHBondContact OE2-NZ 3.4Å; Q953-K957 WeakPolarHBondContact O-CB 3.49Å; Q953-K957 WeakPolarHBondContact O-CG 3.15Å; Q953-K957 PolarHBondContact O-N 3.05Å; L954-K957 PolarHBondContact O-N 3.46Å; K957-E960 VanDerWaalsContact CD-OE2 3.3Å; K957-E960 WeakPolarHBondContact CD-OE2 3.4Å; K957-E960 WeakPolarHBondContact CE-OE2 3.28Å; K957-E960 IonicContact NZ-OE1 3.83Å; K957-E960 IonicContact NZ-OE2 2.83Å; K957-E960 PolarHBondContact NZ-OE2 2.74Å; K957-K961 WeakPolarHBondContact O-CG 3.35Å; K957-K961 PolarHBondContact O-N 2.79Å
958	M	96.6	Very high	95.9	Very high	4 Å²	4	43 Å²	43	2%	0.02	22%	0.217	C	C	.	.	H	α-helix	trans	-67.2	-40.8	170.2	-66	173	67.8	0	0	111.1	Q488 E489 A492 K806 I809 V810 L954 L955 K961 M962	Q488-M958 HydrophobicContact CB-CE 4.15Å; E489-M958 HydrophobicContact CG-CE 4.32Å; E489-M958 HydrophobicContact CG-SD 4.09Å; A492-M958 HydrophobicContact CB-CB 4.48Å; A492-M958 HydrophobicContact CB-CG 3.41Å; A492-M958 VanDerWaalsContact CB-CG 3.41Å; K806-M958 HydrophobicContact CG-CE 4.22Å; I809-M958 HydrophobicContact CD1-CB 4.42Å; I809-M958 HydrophobicContact CG2-CB 3.68Å; I809-M958 HydrophobicContact CG2-CE 4.47Å; V810-M958 HydrophobicContact CG2-CE 3.88Å; L954-M958 HydrophobicContact CD1-CG 4.3Å; L954-M958 HydrophobicContact CD1-SD 4.15Å; L954-M958 HydrophobicContact CG-SD 3.99Å; L954-M958 VanDerWaalsContact O-CG 3.32Å; L954-M958 WeakPolarHBondContact O-CG 3.17Å; L954-M958 PolarHBondContact O-N 3.22Å; L955-M958 HydrophobicContact CD2-SD 4.3Å; L955-M958 PolarHBondContact O-N 3.48Å; M958-K961 PolarHBondContact O-N 2.87Å; M958-M962 WeakPolarHBondContact O-CB 3.47Å; M958-M962 PolarHBondContact O-N 2.71Å
959	H	98	Very high	96	Very high	28 Å²	28	43 Å²	43	13%	0.13	22%	0.217	C	C	.	.	H	α-helix	trans	-66.9	-39.8	177.9	176.7	-98.2	0	0	0	113.1	I809 L911 L955 A956 M962 L963	I809-H959 HydrophobicContact CD1-CB 3.93Å; I809-H959 HydrophobicContact CG1-CB 4.34Å; L911-H959 HydrophobicContact CD1-CB 3.61Å; L911-H959 VanDerWaalsContact CD1-CG 3.46Å; L955-H959 VanDerWaalsContact O-CB 3.31Å; L955-H959 WeakPolarHBondContact O-CB 3.25Å; L955-H959 PolarHBondContact O-N 2.96Å; A956-H959 PolarHBondContact O-N 3.22Å; H959-M962 VanDerWaalsContact CD2-CE 3.48Å; H959-M962 WeakPolarHBondContact CD2-CE 3.32Å; H959-M962 WeakPolarHBondContact O-CB 3.27Å; H959-M962 PolarHBondContact O-N 2.95Å; H959-L963 WeakPolarHBondContact O-CG 3.31Å; H959-L963 PolarHBondContact O-N 2.71Å; H959-L963 VanDerWaalsContact O-N 3.1Å
960	E	96.1	Very high	96.1	Very high	91 Å²	91	37.9 Å²	37.9	43%	0.425	20%	0.198	S	C	.	.	H	α-helix	trans	-56.7	-50.1	170.7	-175.2	176.3	-163.7	0	0	110.9	A956 K957 M962 L963 D964	A956-E960 PolarHBondContact O-N 3.05Å; K957-E960 VanDerWaalsContact CD-OE2 3.3Å; K957-E960 WeakPolarHBondContact CD-OE2 3.4Å; K957-E960 WeakPolarHBondContact CE-OE2 3.28Å; K957-E960 IonicContact NZ-OE1 3.83Å; K957-E960 IonicContact NZ-OE2 2.83Å; K957-E960 PolarHBondContact NZ-OE2 2.74Å; E960-M962 VanDerWaalsContact C-N 3.33Å; E960-M962 PolarHBondContact O-N 3.01Å; E960-L963 PolarHBondContact O-N 2.95Å; E960-D964 PolarHBondContact O-N 3.04Å
961	K	95.1	Very high	96.3	Very high	77 Å²	77	42.9 Å²	42.9	34%	0.335	22%	0.219	S	C	.	.	H	α-helix	trans	-64.2	-32.6	177.1	-72.8	-173.5	172.2	-156.3	0	114.2	Q491 K957 M958 S965	Q491-K961 PolarHBondContact O-NZ 3.29Å; K957-K961 WeakPolarHBondContact O-CG 3.35Å; K957-K961 PolarHBondContact O-N 2.79Å; M958-K961 PolarHBondContact O-N 2.87Å; K961-S965 WeakPolarHBondContact O-CB 3.41Å; K961-S965 PolarHBondContact O-N 3.29Å
962	M	97.7	Very high	96.4	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-62.7	-47	173.5	-179.6	-157.2	70.8	0	0	111.3	I809 V812 T813 L907 M958 H959 E960 S965 Y966	I809-M962 HydrophobicContact CB-SD 4.45Å; I809-M962 HydrophobicContact CG1-SD 4.36Å; I809-M962 HydrophobicContact CG2-CB 4.06Å; I809-M962 HydrophobicContact CG2-CG 4.5Å; I809-M962 HydrophobicContact CG2-SD 4.43Å; V812-M962 HydrophobicContact CB-CG 3.69Å; V812-M962 HydrophobicContact CB-SD 3.82Å; V812-M962 HydrophobicContact CG1-CG 3.51Å; V812-M962 HydrophobicContact CG1-SD 3.98Å; V812-M962 HydrophobicContact CG2-SD 4.26Å; T813-M962 WeakPolarHBondContact OG1-CA 3.42Å; T813-M962 VanDerWaalsContact OG1-CB 3.26Å; T813-M962 WeakPolarHBondContact OG1-CB 3.36Å; T813-M962 WeakPolarHBondContact OG1-CG 3.37Å; L907-M962 HydrophobicContact CD2-CE 3.99Å; L907-M962 HydrophobicContact CD2-SD 3.75Å; M958-M962 WeakPolarHBondContact O-CB 3.47Å; M958-M962 PolarHBondContact O-N 2.71Å; H959-M962 VanDerWaalsContact CD2-CE 3.48Å; H959-M962 WeakPolarHBondContact CD2-CE 3.32Å; H959-M962 WeakPolarHBondContact O-CB 3.27Å; H959-M962 PolarHBondContact O-N 2.95Å; E960-M962 VanDerWaalsContact C-N 3.33Å; E960-M962 PolarHBondContact O-N 3.01Å; M962-S965 PolarHBondContact O-N 2.9Å; M962-Y966 PolarHBondContact O-N 3.32Å
963	L	97.6	Very high	96.4	Very high	63 Å²	63	43 Å²	43	33%	0.33	22%	0.218	S	C	.	.	H	α-helix	trans	-64.6	-42.4	177	-67.4	176	0	0	0	111.4	H959 E960 Y966 N967 I982	H959-L963 WeakPolarHBondContact O-CG 3.31Å; H959-L963 PolarHBondContact O-N 2.71Å; H959-L963 VanDerWaalsContact O-N 3.1Å; E960-L963 PolarHBondContact O-N 2.95Å; L963-Y966 PolarHBondContact O-N 3.45Å; L963-N967 WeakPolarHBondContact O-CB 3.47Å; L963-N967 VanDerWaalsContact O-CG 3.32Å; L963-N967 PolarHBondContact O-N 2.88Å; L963-N967 PolarHBondContact O-ND2 3.45Å; L963-I982 HydrophobicContact CD2-CD1 4.5Å
964	D	96.4	Very high	96.5	Very high	94 Å²	94	39.1 Å²	39.1	50%	0.503	20%	0.202	S	C	.	.	H	α-helix	trans	-65	-43.2	175.7	-85.3	-18	0	0	0	112.7	E960 Y966 N967 C968	E960-D964 PolarHBondContact O-N 3.04Å; D964-Y966 VanDerWaalsContact C-N 3.32Å; D964-Y966 PolarHBondContact O-N 3.46Å; D964-N967 PolarHBondContact O-N 3.46Å; D964-C968 WeakPolarHBondContact O-CB 3.4Å; D964-C968 PolarHBondContact O-N 3.18Å
965	S	96.3	Very high	96.6	Very high	31 Å²	31	39.6 Å²	39.6	22%	0.217	20%	0.204	C	C	.	.	H	α-helix	trans	-57.3	-45.9	174.9	-172.4	0	0	0	0	111.1	C816 K961 M962 C968 L969	C816-S965 WeakPolarHBondContact CB-OG 3.5Å; K961-S965 WeakPolarHBondContact O-CB 3.41Å; K961-S965 PolarHBondContact O-N 3.29Å; M962-S965 PolarHBondContact O-N 2.9Å; S965-C968 PolarHBondContact O-N 3.44Å; S965-L969 WeakPolarHBondContact O-CB 3.45Å; S965-L969 PolarHBondContact O-N 3.11Å
966	Y	98.4	Very high	96.4	Very high	8 Å²	8	42.2 Å²	42.2	3%	0.031	22%	0.218	C	C	.	.	H	α-helix	trans	-64.6	-43.6	175.1	-171.7	-101.7	0	0	0	112.9	M962 L963 D964 C968 L969 M970 P977 Y980 T981 I982 F985 F986	M962-Y966 PolarHBondContact O-N 3.32Å; L963-Y966 PolarHBondContact O-N 3.45Å; D964-Y966 VanDerWaalsContact C-N 3.32Å; D964-Y966 PolarHBondContact O-N 3.46Å; Y966-C968 VanDerWaalsContact C-N 3.31Å; Y966-C968 PolarHBondContact O-N 2.96Å; Y966-L969 WeakPolarHBondContact O-CB 3.45Å; Y966-L969 PolarHBondContact O-N 3.45Å; Y966-M970 HydrophobicContact CD1-CG 4.02Å; Y966-M970 HydrophobicContact CD2-CE 4.21Å; Y966-M970 HydrophobicContact CE1-CE 4.42Å; Y966-M970 HydrophobicContact CE1-CG 3.55Å; Y966-M970 HydrophobicContact CE1-SD 4.11Å; Y966-M970 HydrophobicContact CE2-CE 3.6Å; Y966-M970 HydrophobicContact CE2-CG 4.39Å; Y966-M970 HydrophobicContact CE2-SD 4.23Å; Y966-M970 WeakPolarHBondContact O-CG 3.36Å; Y966-M970 PolarHBondContact O-N 3.34Å; Y966-M970 PolarHBondContact OH-SD 2.95Å; Y966-P977 HydrophobicContact CE1-CB 4.22Å; Y966-Y980 PolarHBondContact OH-O 3.2Å; Y966-T981 PolarHBondContact OH-O 2.95Å; Y966-I982 HydrophobicContact CD1-CD1 4.42Å; Y966-I982 HydrophobicContact CD1-CG1 3.77Å; Y966-I982 HydrophobicContact CD2-CG1 3.7Å; Y966-I982 HydrophobicContact CE1-CG1 3.83Å; Y966-I982 HydrophobicContact CE2-CB 4.31Å; Y966-I982 HydrophobicContact CE2-CG1 3.75Å; Y966-I982 HydrophobicContact CG-CD1 4.32Å; Y966-I982 HydrophobicContact CG-CG1 3.7Å; Y966-I982 PolarHBondContact OH-N 3.22Å; Y966-F985 HydrophobicContact CE2-CB 4.19Å; Y966-F985 HydrophobicContact CE2-CD1 4.04Å; Y966-F985 HydrophobicContact CE2-CG 4.25Å; Y966-F985 WeakPolarHBondContact OH-CB 3.43Å; Y966-F986 HydrophobicContact CD2-CE2 4Å; Y966-F986 HydrophobicContact CE2-CE2 4.01Å
967	N	97.1	Very high	96.3	Very high	52 Å²	52	42.7 Å²	42.7	28%	0.278	22%	0.218	S	C	.	.	H	α-helix	trans	-63	-36.9	176.5	-78.3	-49.7	0	0	0	112.1	L963 D964 K971	L963-N967 WeakPolarHBondContact O-CB 3.47Å; L963-N967 VanDerWaalsContact O-CG 3.32Å; L963-N967 PolarHBondContact O-N 2.88Å; L963-N967 PolarHBondContact O-ND2 3.45Å; D964-N967 PolarHBondContact O-N 3.46Å; N967-K971 WeakPolarHBondContact O-CB 3.4Å; N967-K971 WeakPolarHBondContact O-CD 3.38Å; N967-K971 WeakPolarHBondContact O-CG 3.33Å; N967-K971 PolarHBondContact O-N 3.12Å
968	C	96.5	Very high	96.1	Very high	71 Å²	71	49.9 Å²	49.9	48%	0.48	25%	0.25	S	C	.	.	H	α-helix	trans	-67.5	-39.9	172.5	-80.1	0	0	0	0	112.2	D964 S965 Y966 K971 Y972	D964-C968 WeakPolarHBondContact O-CB 3.4Å; D964-C968 PolarHBondContact O-N 3.18Å; S965-C968 PolarHBondContact O-N 3.44Å; Y966-C968 VanDerWaalsContact C-N 3.31Å; Y966-C968 PolarHBondContact O-N 2.96Å; C968-K971 PolarHBondContact O-N 2.87Å; C968-Y972 WeakPolarHBondContact O-CB 3.25Å; C968-Y972 PolarHBondContact O-N 3.43Å
969	L	97.4	Very high	96	Very high	1 Å²	1	57.5 Å²	57.5	1%	0.005	28%	0.283	C	S	.	.	H	α-helix	trans	-62.8	-44.3	174.5	-168.1	70.7	0	0	0	112.2	C816 R820 S965 Y966 Y972 F973 F985 F986	C816-L969 HydrophobicContact CB-CD2 4.19Å; C816-L969 WeakPolarHBondContact O-CD1 3.38Å; R820-L969 HydrophobicContact CB-CD1 3.74Å; R820-L969 HydrophobicContact CG-CD1 4.28Å; S965-L969 WeakPolarHBondContact O-CB 3.45Å; S965-L969 PolarHBondContact O-N 3.11Å; Y966-L969 WeakPolarHBondContact O-CB 3.45Å; Y966-L969 PolarHBondContact O-N 3.45Å; L969-Y972 WeakPolarHBondContact O-CB 3.45Å; L969-Y972 PolarHBondContact O-N 3.14Å; L969-F973 HydrophobicContact CD1-CD2 4.14Å; L969-F973 HydrophobicContact CD1-CE2 3.72Å; L969-F973 HydrophobicContact CG-CD2 4.21Å; L969-F973 HydrophobicContact CG-CE2 4.24Å; L969-F973 PolarHBondContact O-N 2.96Å; L969-F985 HydrophobicContact CD2-CD1 4.26Å; L969-F985 HydrophobicContact CD2-CE1 3.36Å; L969-F985 HydrophobicContact CD2-CZ 3.64Å; L969-F985 HydrophobicContact CG-CE1 4.42Å; L969-F985 HydrophobicContact CG-CZ 4.23Å; L969-F986 HydrophobicContact CD2-CZ 4.21Å
970	M	97.1	Very high	95.9	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-65.2	-42	177.1	-66.7	-52.4	99.4	0	0	111.4	Y966 Y972 F973 A974 F975 P977 F985	Y966-M970 HydrophobicContact CD1-CG 4.02Å; Y966-M970 HydrophobicContact CD2-CE 4.21Å; Y966-M970 HydrophobicContact CE1-CE 4.42Å; Y966-M970 HydrophobicContact CE1-CG 3.55Å; Y966-M970 HydrophobicContact CE1-SD 4.11Å; Y966-M970 HydrophobicContact CE2-CE 3.6Å; Y966-M970 HydrophobicContact CE2-CG 4.39Å; Y966-M970 HydrophobicContact CE2-SD 4.23Å; Y966-M970 WeakPolarHBondContact O-CG 3.36Å; Y966-M970 PolarHBondContact O-N 3.34Å; Y966-M970 PolarHBondContact OH-SD 2.95Å; M970-Y972 VanDerWaalsContact C-N 3.31Å; M970-Y972 PolarHBondContact O-N 2.89Å; M970-F973 PolarHBondContact O-N 2.94Å; M970-A974 PolarHBondContact O-N 2.9Å; M970-F975 HydrophobicContact CB-CB 4.42Å; M970-F975 PolarHBondContact O-N 3.28Å; M970-F975 HydrophobicContact SD-CB 3.86Å; M970-F975 HydrophobicContact SD-CD2 4.12Å; M970-P977 HydrophobicContact CB-CB 4.17Å; M970-P977 HydrophobicContact CG-CB 3.91Å; M970-F985 HydrophobicContact CE-CD1 4Å; M970-F985 HydrophobicContact CE-CD2 3.6Å; M970-F985 HydrophobicContact CE-CE1 4Å; M970-F985 HydrophobicContact CE-CE2 3.59Å; M970-F985 HydrophobicContact CE-CG 3.8Å; M970-F985 HydrophobicContact CE-CZ 3.78Å; M970-F985 HydrophobicContact SD-CD2 4.18Å
971	K	95.3	Very high	95.8	Very high	142 Å²	142	55.4 Å²	55.4	62%	0.617	28%	0.277	S	S	*	.	H	α-helix	trans	-59.7	-40.8	171.6	-71.8	164.4	-173.3	170.6	0	112	N967 C968 A974	N967-K971 WeakPolarHBondContact O-CB 3.4Å; N967-K971 WeakPolarHBondContact O-CD 3.38Å; N967-K971 WeakPolarHBondContact O-CG 3.33Å; N967-K971 PolarHBondContact O-N 3.12Å; C968-K971 PolarHBondContact O-N 2.87Å; K971-A974 PolarHBondContact O-N 3.28Å
972	Y	96.5	Very high	95.9	Very high	64 Å²	64	52 Å²	52	25%	0.251	26%	0.263	S	S	.	.	H	α-helix	trans	-64.1	-43.1	-179.5	-178.5	-112.7	0	0	0	112.6	A658 F659 R820 C968 L969 M970 A974	A658-Y972 CarbonylContact C-O 3.5Å; A658-Y972 VanDerWaalsContact CA-O 3.25Å; A658-Y972 WeakPolarHBondContact CA-O 3.47Å; F659-Y972 HydrophobicContact CB-CD1 4.28Å; F659-Y972 HydrophobicContact CB-CE1 3.94Å; F659-Y972 HydrophobicContact CB-CE2 4.26Å; F659-Y972 HydrophobicContact CD2-CE1 4.17Å; F659-Y972 HydrophobicContact CG-CE1 4.39Å; F659-Y972 PolarHBondContact N-O 2.93Å; R820-Y972 HydrophobicContact CG-CD1 4.29Å; R820-Y972 HydrophobicContact CG-CE1 4.39Å; C968-Y972 WeakPolarHBondContact O-CB 3.25Å; C968-Y972 PolarHBondContact O-N 3.43Å; L969-Y972 WeakPolarHBondContact O-CB 3.45Å; L969-Y972 PolarHBondContact O-N 3.14Å; M970-Y972 VanDerWaalsContact C-N 3.31Å; M970-Y972 PolarHBondContact O-N 2.89Å; Y972-A974 VanDerWaalsContact C-N 3.34Å
973	F	97.1	Very high	95.8	Very high	1 Å²	1	53.3 Å²	53.3	0%	0.004	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89	7.1	175	-66.3	-63.2	0	0	0	114.6	F659 W660 V819 F825 L829 F853 L969 M970 F975 F985	F659-F973 HydrophobicContact CB-CD1 3.9Å; F659-F973 HydrophobicContact CB-CE1 4.06Å; F659-F973 HydrophobicContact CD1-CD1 4.05Å; F659-F973 HydrophobicContact CD1-CE1 4.01Å; F659-F973 HydrophobicContact CD2-CE1 4.31Å; F659-F973 HydrophobicContact CG-CD1 4.04Å; F659-F973 AromaticContact CG-CE1 3.85Å; F659-F973 HydrophobicContact CG-CE1 3.85Å; W660-F973 PolarHBondContact NE1-O 3.34Å; V819-F973 HydrophobicContact CG1-CE2 3.97Å; V819-F973 HydrophobicContact CG1-CZ 4.32Å; F825-F973 HydrophobicContact CE1-CZ 4.37Å; L829-F973 HydrophobicContact CD1-CE1 3.83Å; L829-F973 HydrophobicContact CD1-CZ 4.47Å; F853-F973 HydrophobicContact CE1-CD1 4.34Å; F853-F973 HydrophobicContact CE2-CD2 4.14Å; F853-F973 HydrophobicContact CE2-CE2 4.19Å; F853-F973 HydrophobicContact CE2-CG 4.31Å; F853-F973 HydrophobicContact CE2-CZ 4.43Å; F853-F973 AromaticContact CZ-CD1 3.66Å; F853-F973 HydrophobicContact CZ-CD1 3.66Å; F853-F973 HydrophobicContact CZ-CD2 4.05Å; F853-F973 AromaticContact CZ-CE1 3.76Å; F853-F973 HydrophobicContact CZ-CE1 3.76Å; F853-F973 HydrophobicContact CZ-CE2 4.13Å; F853-F973 AromaticContact CZ-CG 3.82Å; F853-F973 HydrophobicContact CZ-CG 3.82Å; F853-F973 AromaticContact CZ-CZ 3.99Å; F853-F973 HydrophobicContact CZ-CZ 3.99Å; L969-F973 HydrophobicContact CD1-CD2 4.14Å; L969-F973 HydrophobicContact CD1-CE2 3.72Å; L969-F973 HydrophobicContact CG-CD2 4.21Å; L969-F973 HydrophobicContact CG-CE2 4.24Å; L969-F973 PolarHBondContact O-N 2.96Å; M970-F973 PolarHBondContact O-N 2.94Å; F973-F975 HydrophobicContact CB-CD2 3.7Å; F973-F975 HydrophobicContact CB-CE2 3.53Å; F973-F975 HydrophobicContact CB-CG 4.28Å; F973-F975 HydrophobicContact CB-CZ 3.99Å; F973-F975 HydrophobicContact CG-CE2 4.31Å; F973-F975 WeakPolarHBondContact O-CD1 3.22Å; F973-F985 HydrophobicContact CD2-CZ 4.5Å
974	A	95.8	Very high	95.7	Very high	18 Å²	18	55 Å²	55	15%	0.149	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	55.8	44.4	-176.8	0	0	0	0	0	114.2	I649 L654 A658 M970 K971 Y972	I649-A974 HydrophobicContact CG2-CB 4.25Å; L654-A974 HydrophobicContact CD2-CB 3.6Å; A658-A974 HydrophobicContact CB-CB 4.28Å; M970-A974 PolarHBondContact O-N 2.9Å; K971-A974 PolarHBondContact O-N 3.28Å; Y972-A974 VanDerWaalsContact C-N 3.34Å
975	F	95.6	Very high	95.7	Very high	13 Å²	13	50.5 Å²	50.5	6%	0.057	26%	0.261	C	S	.	.			trans	-105.7	154.3	174.9	-59.8	-30.1	0	0	0	112.2	I649 H852 F853 M970 F973 P977 Y980 F985	I649-F975 HydrophobicContact CD1-CD1 4.31Å; I649-F975 HydrophobicContact CD1-CE1 3.77Å; I649-F975 HydrophobicContact CG1-CE1 4.41Å; H852-F975 HydrophobicContact CB-CE1 4.22Å; H852-F975 AromaticContact CE1-CD1 3.66Å; H852-F975 AromaticContact CE1-CE1 3.99Å; H852-F975 AromaticContact CG-CE1 3.87Å; H852-F975 AromaticContact ND1-CD1 3.31Å; H852-F975 VanDerWaalsContact ND1-CD1 3.31Å; H852-F975 WeakPolarHBondContact ND1-CD1 3.46Å; H852-F975 AromaticContact ND1-CE1 3.33Å; H852-F975 VanDerWaalsContact ND1-CE1 3.33Å; H852-F975 WeakPolarHBondContact ND1-CE1 3.29Å; F853-F975 HydrophobicContact CD1-CE2 4.17Å; F853-F975 AromaticContact CD1-CZ 3.84Å; F853-F975 HydrophobicContact CD1-CZ 3.84Å; F853-F975 AromaticContact CD2-CE2 3.98Å; F853-F975 HydrophobicContact CD2-CE2 3.98Å; F853-F975 HydrophobicContact CD2-CZ 4.47Å; F853-F975 HydrophobicContact CE1-CE2 4.25Å; F853-F975 HydrophobicContact CE1-CZ 4.03Å; F853-F975 HydrophobicContact CE2-CE2 4.08Å; F853-F975 HydrophobicContact CG-CE2 4.03Å; F853-F975 HydrophobicContact CG-CZ 4.08Å; F853-F975 HydrophobicContact CZ-CE2 4.21Å; F853-F975 HydrophobicContact CZ-CZ 4.43Å; M970-F975 HydrophobicContact CB-CB 4.42Å; M970-F975 PolarHBondContact O-N 3.28Å; M970-F975 HydrophobicContact SD-CB 3.86Å; M970-F975 HydrophobicContact SD-CD2 4.12Å; F973-F975 HydrophobicContact CB-CD2 3.7Å; F973-F975 HydrophobicContact CB-CE2 3.53Å; F973-F975 HydrophobicContact CB-CG 4.28Å; F973-F975 HydrophobicContact CB-CZ 3.99Å; F973-F975 HydrophobicContact CG-CE2 4.31Å; F973-F975 WeakPolarHBondContact O-CD1 3.22Å; F975-P977 WeakPolarHBondContact O-CD 3.33Å; F975-Y980 HydrophobicContact CB-CD1 4.2Å; F975-Y980 AromaticContact CD2-CD1 3.7Å; F975-Y980 HydrophobicContact CD2-CD1 3.7Å; F975-Y980 AromaticContact CD2-CE1 3.86Å; F975-Y980 HydrophobicContact CD2-CE1 3.86Å; F975-Y980 HydrophobicContact CE2-CD1 4.24Å; F975-Y980 AromaticContact CE2-CE1 3.91Å; F975-Y980 HydrophobicContact CE2-CE1 3.91Å; F975-Y980 AromaticContact CG-CD1 3.95Å; F975-Y980 HydrophobicContact CG-CD1 3.95Å; F975-Y980 HydrophobicContact CG-CE1 4.41Å; F975-Y980 HydrophobicContact CZ-CE1 4.49Å; F975-F985 HydrophobicContact CD2-CD2 4.41Å; F975-F985 HydrophobicContact CD2-CE2 4.18Å; F975-F985 HydrophobicContact CE2-CE2 4.07Å
976	D	93.6	Very high	95.8	Very high	56 Å²	56	49 Å²	49	30%	0.299	25%	0.25	S	S	.	.			trans	-89.8	111.7	175	179.3	-13.9	0	0	0	110	K978 K979 Y980	D976-K978 PolarHBondContact O-N 3.38Å; D976-K978 VanDerWaalsContact O-N 3.11Å; D976-K978 WeakPolarHBondContact OD1-CB 3.34Å; D976-K978 PolarHBondContact OD1-N 3.32Å; D976-K979 HydrophobicContact CB-CB 4.22Å; D976-K979 HydrophobicContact CB-CD 4.37Å; D976-K979 HydrophobicContact CB-CG 4.24Å; D976-K979 PolarHBondContact O-N 3.41Å; D976-K979 WeakPolarHBondContact OD2-CG 3.27Å; D976-K979 IonicContact OD2-NZ 3.25Å; D976-K979 PolarHBondContact OD2-NZ 2.92Å; D976-Y980 PolarHBondContact O-N 3.2Å
977	P	93.5	Very high	95.7	Very high	45 Å²	45	50 Å²	50	29%	0.292	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-17.3	-177.4	25.8	-34.5	0	0	0	113.9	Y966 M970 F975	Y966-P977 HydrophobicContact CE1-CB 4.22Å; M970-P977 HydrophobicContact CB-CB 4.17Å; M970-P977 HydrophobicContact CG-CB 3.91Å; F975-P977 WeakPolarHBondContact O-CD 3.33Å
978	K	91.5	Very high	95.7	Very high	189 Å²	189	49.2 Å²	49.2	82%	0.822	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-24.2	176	-58.9	-178.1	179	-178.7	0	112.7	D976	D976-K978 PolarHBondContact O-N 3.38Å; D976-K978 VanDerWaalsContact O-N 3.11Å; D976-K978 WeakPolarHBondContact OD1-CB 3.34Å; D976-K978 PolarHBondContact OD1-N 3.32Å
979	K	93.4	Very high	95.8	Very high	163 Å²	163	45.8 Å²	45.8	71%	0.709	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.9	-34.4	176.9	-63.9	-173.4	-174.3	88.3	0	112.1	D976	D976-K979 HydrophobicContact CB-CB 4.22Å; D976-K979 HydrophobicContact CB-CD 4.37Å; D976-K979 HydrophobicContact CB-CG 4.24Å; D976-K979 PolarHBondContact O-N 3.41Å; D976-K979 WeakPolarHBondContact OD2-CG 3.27Å; D976-K979 IonicContact OD2-NZ 3.25Å; D976-K979 PolarHBondContact OD2-NZ 2.92Å
980	Y	95.1	Very high	95.7	Very high	12 Å²	12	46.6 Å²	46.6	5%	0.047	24%	0.241	C	C	.	.	S	Bend	trans	-110.5	92.7	177.8	-149.6	179.2	0	0	0	107.7	Q854 Y966 F975 D976 L984 F985 D988	Q854-Y980 PolarHBondContact NE2-OH 2.93Å; Y966-Y980 PolarHBondContact OH-O 3.2Å; F975-Y980 HydrophobicContact CB-CD1 4.2Å; F975-Y980 AromaticContact CD2-CD1 3.7Å; F975-Y980 HydrophobicContact CD2-CD1 3.7Å; F975-Y980 AromaticContact CD2-CE1 3.86Å; F975-Y980 HydrophobicContact CD2-CE1 3.86Å; F975-Y980 HydrophobicContact CE2-CD1 4.24Å; F975-Y980 AromaticContact CE2-CE1 3.91Å; F975-Y980 HydrophobicContact CE2-CE1 3.91Å; F975-Y980 AromaticContact CG-CD1 3.95Å; F975-Y980 HydrophobicContact CG-CD1 3.95Å; F975-Y980 HydrophobicContact CG-CE1 4.41Å; F975-Y980 HydrophobicContact CZ-CE1 4.49Å; D976-Y980 PolarHBondContact O-N 3.2Å; Y980-L984 HydrophobicContact CD2-CB 3.9Å; Y980-L984 HydrophobicContact CE2-CB 4.12Å; Y980-F985 AromaticContact CD1-CD2 3.99Å; Y980-F985 HydrophobicContact CD1-CD2 3.99Å; Y980-F985 HydrophobicContact CD2-CB 3.98Å; Y980-F985 AromaticContact CE1-CD2 3.63Å; Y980-F985 HydrophobicContact CE1-CD2 3.63Å; Y980-F985 HydrophobicContact CE1-CE2 4.42Å; Y980-F985 HydrophobicContact CE2-CB 3.93Å; Y980-F985 HydrophobicContact CE2-CD2 4.45Å; Y980-F985 HydrophobicContact CG-CB 4.33Å; Y980-F985 AromaticContact CZ-CD2 3.88Å; Y980-D988 VanDerWaalsContact CE2-OD2 3.24Å; Y980-D988 WeakPolarHBondContact CE2-OD2 3.26Å; Y980-D988 WeakPolarHBondContact OH-CB 3.41Å; Y980-D988 PolarHBondContact OH-OD2 3.45Å
981	T	95.4	Very high	95.7	Very high	63 Å²	63	50.6 Å²	50.6	39%	0.387	26%	0.263	S	S	.	.			trans	-81.1	159.8	-179.1	59.6	0	0	0	0	111.3	Y966 G983 L984 F985	Y966-T981 PolarHBondContact OH-O 2.95Å; T981-G983 PolarHBondContact O-N 3.13Å; T981-L984 WeakPolarHBondContact O-CA 3.41Å; T981-L984 WeakPolarHBondContact O-CB 3.46Å; T981-L984 PolarHBondContact O-N 3.22Å; T981-L984 WeakPolarHBondContact OG1-CD1 3.28Å; T981-L984 WeakPolarHBondContact OG1-CG 3.36Å; T981-F985 PolarHBondContact O-N 3.34Å
982	I	97.3	Very high	95.8	Very high	7 Å²	7	43.9 Å²	43.9	4%	0.036	23%	0.233	C	C	.	.	H	α-helix	trans	-45.3	-57.8	-175.6	-68.1	164.7	0	0	0	112.2	V812 P904 L963 Y966 L984 F985 F986	V812-I982 HydrophobicContact CG1-CD1 4.27Å; V812-I982 HydrophobicContact CG1-CG2 3.92Å; V812-I982 HydrophobicContact CG2-CG2 3.76Å; P904-I982 HydrophobicContact CB-CD1 4.08Å; P904-I982 HydrophobicContact CG-CD1 4.28Å; L963-I982 HydrophobicContact CD2-CD1 4.5Å; Y966-I982 HydrophobicContact CD1-CD1 4.42Å; Y966-I982 HydrophobicContact CD1-CG1 3.77Å; Y966-I982 HydrophobicContact CD2-CG1 3.7Å; Y966-I982 HydrophobicContact CE1-CG1 3.83Å; Y966-I982 HydrophobicContact CE2-CB 4.31Å; Y966-I982 HydrophobicContact CE2-CG1 3.75Å; Y966-I982 HydrophobicContact CG-CD1 4.32Å; Y966-I982 HydrophobicContact CG-CG1 3.7Å; Y966-I982 PolarHBondContact OH-N 3.22Å; I982-L984 VanDerWaalsContact C-N 3.3Å; I982-L984 PolarHBondContact O-N 3.41Å; I982-F985 PolarHBondContact O-N 2.87Å; I982-F986 HydrophobicContact CG2-CD2 3.84Å; I982-F986 HydrophobicContact CG2-CE2 4.14Å; I982-F986 WeakPolarHBondContact O-CD2 3.49Å; I982-F986 PolarHBondContact O-N 3.32Å
983	G	94.7	Very high	95.7	Very high	27 Å²	27	42.2 Å²	42.2	28%	0.278	23%	0.228	S	C	.	.	H	α-helix	trans	-65.9	-24.9	179.9	0	0	0	0	0	115	T981 G987	T981-G983 PolarHBondContact O-N 3.13Å; G983-G987 WeakPolarHBondContact O-CA 3.27Å; G983-G987 PolarHBondContact O-N 2.81Å
984	L	95.2	Very high	95.6	Very high	98 Å²	98	45 Å²	45	51%	0.513	25%	0.251	S	S	.	.	H	α-helix	trans	-75.3	-44.3	172.2	-69.4	176.8	0	0	0	111.2	Y980 T981 I982 G987 D988	Y980-L984 HydrophobicContact CD2-CB 3.9Å; Y980-L984 HydrophobicContact CE2-CB 4.12Å; T981-L984 WeakPolarHBondContact O-CA 3.41Å; T981-L984 WeakPolarHBondContact O-CB 3.46Å; T981-L984 PolarHBondContact O-N 3.22Å; T981-L984 WeakPolarHBondContact OG1-CD1 3.28Å; T981-L984 WeakPolarHBondContact OG1-CG 3.36Å; I982-L984 VanDerWaalsContact C-N 3.3Å; I982-L984 PolarHBondContact O-N 3.41Å; L984-G987 PolarHBondContact O-N 3.47Å; L984-D988 PolarHBondContact O-N 2.93Å
985	F	97.8	Very high	95.6	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-65.3	-52.2	-179.9	175.7	-96.4	0	0	0	111.9	V819 F853 Y966 L969 M970 F973 F975 Y980 T981 I982 G987 D988 L989	V819-F985 HydrophobicContact CG1-CZ 4.16Å; F853-F985 HydrophobicContact CD2-CD2 4.34Å; F853-F985 AromaticContact CD2-CE2 3.58Å; F853-F985 HydrophobicContact CD2-CE2 3.58Å; F853-F985 HydrophobicContact CD2-CZ 4.18Å; F853-F985 AromaticContact CE2-CE2 3.68Å; F853-F985 HydrophobicContact CE2-CE2 3.68Å; F853-F985 AromaticContact CE2-CZ 3.96Å; F853-F985 HydrophobicContact CE2-CZ 3.96Å; Y966-F985 HydrophobicContact CE2-CB 4.19Å; Y966-F985 HydrophobicContact CE2-CD1 4.04Å; Y966-F985 HydrophobicContact CE2-CG 4.25Å; Y966-F985 WeakPolarHBondContact OH-CB 3.43Å; L969-F985 HydrophobicContact CD2-CD1 4.26Å; L969-F985 HydrophobicContact CD2-CE1 3.36Å; L969-F985 HydrophobicContact CD2-CZ 3.64Å; L969-F985 HydrophobicContact CG-CE1 4.42Å; L969-F985 HydrophobicContact CG-CZ 4.23Å; M970-F985 HydrophobicContact CE-CD1 4Å; M970-F985 HydrophobicContact CE-CD2 3.6Å; M970-F985 HydrophobicContact CE-CE1 4Å; M970-F985 HydrophobicContact CE-CE2 3.59Å; M970-F985 HydrophobicContact CE-CG 3.8Å; M970-F985 HydrophobicContact CE-CZ 3.78Å; M970-F985 HydrophobicContact SD-CD2 4.18Å; F973-F985 HydrophobicContact CD2-CZ 4.5Å; F975-F985 HydrophobicContact CD2-CD2 4.41Å; F975-F985 HydrophobicContact CD2-CE2 4.18Å; F975-F985 HydrophobicContact CE2-CE2 4.07Å; Y980-F985 AromaticContact CD1-CD2 3.99Å; Y980-F985 HydrophobicContact CD1-CD2 3.99Å; Y980-F985 HydrophobicContact CD2-CB 3.98Å; Y980-F985 AromaticContact CE1-CD2 3.63Å; Y980-F985 HydrophobicContact CE1-CD2 3.63Å; Y980-F985 HydrophobicContact CE1-CE2 4.42Å; Y980-F985 HydrophobicContact CE2-CB 3.93Å; Y980-F985 HydrophobicContact CE2-CD2 4.45Å; Y980-F985 HydrophobicContact CG-CB 4.33Å; Y980-F985 AromaticContact CZ-CD2 3.88Å; T981-F985 PolarHBondContact O-N 3.34Å; I982-F985 PolarHBondContact O-N 2.87Å; F985-G987 VanDerWaalsContact C-N 3.32Å; F985-G987 PolarHBondContact O-N 3.28Å; F985-D988 PolarHBondContact O-N 2.87Å; F985-L989 HydrophobicContact CD1-CD1 4.05Å; F985-L989 HydrophobicContact CE1-CD1 3.42Å; F985-L989 VanDerWaalsContact CE1-CD1 3.42Å; F985-L989 HydrophobicContact CE2-CD1 4.17Å; F985-L989 HydrophobicContact CZ-CD1 3.51Å; F985-L989 PolarHBondContact O-N 3.34Å; F985-L989 VanDerWaalsContact O-N 3.11Å
986	F	98.2	Very high	95.7	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-72.9	-25.3	176.9	-67.4	-64.2	0	0	0	112.4	V812 A815 V819 V896 A899 A900 Y966 L969 I982 L989 S990	V812-F986 HydrophobicContact CG1-CE2 4.24Å; A815-F986 HydrophobicContact CB-CD1 3.9Å; A815-F986 HydrophobicContact CB-CE1 3.41Å; A815-F986 VanDerWaalsContact CB-CE1 3.41Å; A815-F986 HydrophobicContact CB-CZ 3.79Å; V819-F986 HydrophobicContact CG2-CE1 4.35Å; V896-F986 HydrophobicContact CG1-CD1 4.34Å; V896-F986 HydrophobicContact CG2-CD1 4.44Å; A899-F986 HydrophobicContact CB-CB 4.06Å; A899-F986 HydrophobicContact CB-CD1 4.09Å; A899-F986 HydrophobicContact CB-CD2 3.68Å; A899-F986 HydrophobicContact CB-CE2 4.12Å; A899-F986 HydrophobicContact CB-CG 3.66Å; A900-F986 HydrophobicContact CB-CB 3.92Å; Y966-F986 HydrophobicContact CD2-CE2 4Å; Y966-F986 HydrophobicContact CE2-CE2 4.01Å; L969-F986 HydrophobicContact CD2-CZ 4.21Å; I982-F986 HydrophobicContact CG2-CD2 3.84Å; I982-F986 HydrophobicContact CG2-CE2 4.14Å; I982-F986 WeakPolarHBondContact O-CD2 3.49Å; I982-F986 PolarHBondContact O-N 3.32Å; F986-L989 HydrophobicContact CD1-CD1 4.45Å; F986-L989 PolarHBondContact O-N 3.14Å; F986-S990 WeakPolarHBondContact O-CB 3.29Å; F986-S990 PolarHBondContact O-N 3.1Å
987	G	96.7	Very high	95.7	Very high	29 Å²	29	44.3 Å²	44.3	30%	0.299	24%	0.244	S	C	.	.	H	α-helix	trans	-63.1	-47.6	169.9	0	0	0	0	0	113.1	G983 L984 F985 S990 N991	G983-G987 WeakPolarHBondContact O-CA 3.27Å; G983-G987 PolarHBondContact O-N 2.81Å; L984-G987 PolarHBondContact O-N 3.47Å; F985-G987 VanDerWaalsContact C-N 3.32Å; F985-G987 PolarHBondContact O-N 3.28Å; G987-S990 PolarHBondContact O-N 3.08Å; G987-N991 WeakPolarHBondContact O-CB 3.28Å; G987-N991 PolarHBondContact O-N 2.94Å; G987-N991 VanDerWaalsContact O-N 3.09Å
988	D	96.1	Very high	95.7	Very high	34 Å²	34	45 Å²	45	18%	0.182	25%	0.251	C	S	.	.	H	α-helix	trans	-60.8	-45	174.2	-77.9	-36.7	0	0	0	111.4	Q854 Y980 L984 F985 N991 F992	Q854-D988 WeakPolarHBondContact CG-OD2 3.44Å; Q854-D988 PolarHBondContact NE2-OD2 3.05Å; Y980-D988 VanDerWaalsContact CE2-OD2 3.24Å; Y980-D988 WeakPolarHBondContact CE2-OD2 3.26Å; Y980-D988 WeakPolarHBondContact OH-CB 3.41Å; Y980-D988 PolarHBondContact OH-OD2 3.45Å; L984-D988 PolarHBondContact O-N 2.93Å; F985-D988 PolarHBondContact O-N 2.87Å; D988-N991 PolarHBondContact O-N 3.02Å; D988-F992 WeakPolarHBondContact O-CB 3.42Å; D988-F992 PolarHBondContact O-N 3.04Å
989	L	97.7	Very high	95.9	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-69.6	-36.4	179.3	-72.7	178.7	0	0	0	113.6	V819 F825 F853 L856 V896 F985 F986 N991 F992 K993	V819-L989 HydrophobicContact CB-CD1 4.46Å; V819-L989 HydrophobicContact CG1-CD1 3.8Å; V819-L989 HydrophobicContact CG2-CD1 3.8Å; F825-L989 HydrophobicContact CE1-CD2 4.38Å; F825-L989 HydrophobicContact CE2-CD2 4.25Å; F825-L989 HydrophobicContact CZ-CD2 3.67Å; F853-L989 HydrophobicContact CD2-CD1 4.38Å; F853-L989 HydrophobicContact CD2-CD2 3.77Å; F853-L989 HydrophobicContact CD2-CG 4.22Å; F853-L989 HydrophobicContact CE2-CD2 4.21Å; L856-L989 HydrophobicContact CD1-CD2 3.97Å; V896-L989 HydrophobicContact CG1-CB 3.86Å; F985-L989 HydrophobicContact CD1-CD1 4.05Å; F985-L989 HydrophobicContact CE1-CD1 3.42Å; F985-L989 VanDerWaalsContact CE1-CD1 3.42Å; F985-L989 HydrophobicContact CE2-CD1 4.17Å; F985-L989 HydrophobicContact CZ-CD1 3.51Å; F985-L989 PolarHBondContact O-N 3.34Å; F985-L989 VanDerWaalsContact O-N 3.11Å; F986-L989 HydrophobicContact CD1-CD1 4.45Å; F986-L989 PolarHBondContact O-N 3.14Å; L989-N991 VanDerWaalsContact C-N 3.34Å; L989-F992 HydrophobicContact CD2-CD1 4.42Å; L989-F992 WeakPolarHBondContact O-CB 3.39Å; L989-F992 PolarHBondContact O-N 2.87Å; L989-K993 WeakPolarHBondContact O-CB 3.17Å; L989-K993 PolarHBondContact O-N 2.86Å
990	S	97	Very high	95.9	Very high	17 Å²	17	28.4 Å²	28.4	12%	0.119	18%	0.179	C	C	.	.	H	α-helix	trans	-68.4	-35.5	176	-178.4	0	0	0	0	111.9	K897 F986 G987 A994	K897-S990 WeakPolarHBondContact CD-OG 3.34Å; F986-S990 WeakPolarHBondContact O-CB 3.29Å; F986-S990 PolarHBondContact O-N 3.1Å; G987-S990 PolarHBondContact O-N 3.08Å; S990-A994 PolarHBondContact O-N 3.17Å
991	N	95.9	Very high	95.7	Very high	85 Å²	85	31.9 Å²	31.9	46%	0.455	19%	0.194	S	C	.	.	H	α-helix	trans	-66.7	-45.5	172.8	-172.9	7.6	0	0	0	110.2	G987 D988 L989 K993 A994 V995	G987-N991 WeakPolarHBondContact O-CB 3.28Å; G987-N991 PolarHBondContact O-N 2.94Å; G987-N991 VanDerWaalsContact O-N 3.09Å; D988-N991 PolarHBondContact O-N 3.02Å; L989-N991 VanDerWaalsContact C-N 3.34Å; N991-K993 PolarHBondContact O-N 3.48Å; N991-A994 PolarHBondContact O-N 3.49Å; N991-V995 WeakPolarHBondContact O-CB 3.49Å; N991-V995 WeakPolarHBondContact O-CG2 3.5Å; N991-V995 PolarHBondContact O-N 3.35Å
992	F	97.2	Very high	95.5	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-56.8	-45.7	172.7	167.3	-111	0	0	0	113.1	F825 F828 L856 M872 F889 D988 L989 A994 V995 Y996	F825-F992 AromaticContact CD2-CE1 3.83Å; F825-F992 HydrophobicContact CD2-CE1 3.83Å; F825-F992 HydrophobicContact CD2-CZ 4.34Å; F825-F992 HydrophobicContact CE2-CD1 4.24Å; F825-F992 AromaticContact CE2-CE1 3.55Å; F825-F992 HydrophobicContact CE2-CE1 3.55Å; F825-F992 HydrophobicContact CE2-CZ 4.11Å; F828-F992 HydrophobicContact CD1-CE2 4.15Å; F828-F992 AromaticContact CD1-CZ 3.74Å; F828-F992 HydrophobicContact CD1-CZ 3.74Å; F828-F992 AromaticContact CE1-CE2 3.54Å; F828-F992 HydrophobicContact CE1-CE2 3.54Å; F828-F992 AromaticContact CE1-CZ 3.64Å; F828-F992 HydrophobicContact CE1-CZ 3.64Å; F828-F992 HydrophobicContact CE2-CE2 4.43Å; F828-F992 HydrophobicContact CE2-CZ 4.47Å; F828-F992 HydrophobicContact CG-CZ 4.24Å; F828-F992 AromaticContact CZ-CE2 3.71Å; F828-F992 HydrophobicContact CZ-CE2 3.71Å; F828-F992 HydrophobicContact CZ-CZ 4.03Å; L856-F992 HydrophobicContact CB-CB 4Å; L856-F992 HydrophobicContact CB-CD2 3.53Å; L856-F992 HydrophobicContact CB-CE2 4.02Å; L856-F992 HydrophobicContact CB-CG 3.8Å; L856-F992 HydrophobicContact CD1-CD1 4.42Å; L856-F992 HydrophobicContact CD1-CG 4.4Å; L856-F992 HydrophobicContact CD2-CE2 4.37Å; M872-F992 HydrophobicContact CE-CD2 4Å; M872-F992 HydrophobicContact CE-CE2 3.47Å; M872-F992 VanDerWaalsContact CE-CE2 3.47Å; M872-F992 HydrophobicContact CE-CZ 4.29Å; M872-F992 HydrophobicContact SD-CE2 4.26Å; F889-F992 HydrophobicContact CE2-CE1 4.08Å; F889-F992 HydrophobicContact CZ-CE1 4.05Å; F889-F992 HydrophobicContact CZ-CZ 4.03Å; D988-F992 WeakPolarHBondContact O-CB 3.42Å; D988-F992 PolarHBondContact O-N 3.04Å; L989-F992 HydrophobicContact CD2-CD1 4.42Å; L989-F992 WeakPolarHBondContact O-CB 3.39Å; L989-F992 PolarHBondContact O-N 2.87Å; F992-A994 PolarHBondContact O-N 3.42Å; F992-V995 PolarHBondContact O-N 3.21Å; F992-Y996 HydrophobicContact CE1-CD2 4.38Å; F992-Y996 HydrophobicContact CE2-CD2 4.01Å; F992-Y996 AromaticContact CZ-CD2 3.72Å; F992-Y996 HydrophobicContact CZ-CD2 3.72Å; F992-Y996 HydrophobicContact CZ-CE2 4.35Å; F992-Y996 WeakPolarHBondContact O-CB 3.35Å; F992-Y996 PolarHBondContact O-N 3.02Å
993	K	95.8	Very high	95.3	Very high	30 Å²	30	32 Å²	32	13%	0.13	19%	0.19	C	C	.	.	H	α-helix	trans	-55.4	-52.1	177.7	-170.5	-161.5	-174.4	-54.3	0	111.4	T890 F893 L989 N991 V995 Y996 E997	T890-K993 HydrophobicContact CG2-CG 4.36Å; T890-K993 WeakPolarHBondContact O-CE 3.48Å; T890-K993 PolarHBondContact O-NZ 3.1Å; T890-K993 VanDerWaalsContact O-NZ 3.11Å; F893-K993 HydrophobicContact CB-CD 4.12Å; F893-K993 HydrophobicContact CB-CG 4.47Å; F893-K993 WeakPolarHBondContact O-CE 3.46Å; L989-K993 WeakPolarHBondContact O-CB 3.17Å; L989-K993 PolarHBondContact O-N 2.86Å; N991-K993 PolarHBondContact O-N 3.48Å; K993-V995 VanDerWaalsContact C-N 3.34Å; K993-V995 PolarHBondContact O-N 3.14Å; K993-Y996 WeakPolarHBondContact O-CB 2.88Å; K993-Y996 PolarHBondContact O-N 3.44Å; K993-E997 IonicContact NZ-OE1 2.73Å; K993-E997 PolarHBondContact NZ-OE1 2.95Å; K993-E997 IonicContact NZ-OE2 3.28Å; K993-E997 PolarHBondContact NZ-OE2 3.08Å; K993-E997 WeakPolarHBondContact O-CB 3.24Å; K993-E997 WeakPolarHBondContact O-CG 2.89Å; K993-E997 PolarHBondContact O-N 2.89Å
994	A	95.2	Very high	94.8	Very high	60 Å²	60	34.3 Å²	34.3	50%	0.496	19%	0.194	S	C	.	.	H	α-helix	trans	-62.4	-40	179.2	0	0	0	0	0	112.5	S990 N991 F992 E997 S998	S990-A994 PolarHBondContact O-N 3.17Å; N991-A994 PolarHBondContact O-N 3.49Å; F992-A994 PolarHBondContact O-N 3.42Å; A994-E997 PolarHBondContact O-N 3.33Å; A994-S998 PolarHBondContact O-N 3.38Å
995	V	95.4	Very high	94.5	Very high	27 Å²	27	35 Å²	35	16%	0.164	19%	0.194	C	C	.	.	H	α-helix	trans	-66	-41.7	175.2	167.1	0	0	0	0	111.9	T860 M872 N991 F992 K993 E997 V999	T860-V995 HydrophobicContact CG2-CG1 3.49Å; T860-V995 VanDerWaalsContact CG2-CG1 3.49Å; M872-V995 HydrophobicContact CG-CG1 4.21Å; N991-V995 WeakPolarHBondContact O-CB 3.49Å; N991-V995 WeakPolarHBondContact O-CG2 3.5Å; N991-V995 PolarHBondContact O-N 3.35Å; F992-V995 PolarHBondContact O-N 3.21Å; K993-V995 VanDerWaalsContact C-N 3.34Å; K993-V995 PolarHBondContact O-N 3.14Å; V995-E997 VanDerWaalsContact C-N 3.35Å; V995-V999 WeakPolarHBondContact O-CB 3.19Å; V995-V999 VanDerWaalsContact O-CG2 3.29Å; V995-V999 WeakPolarHBondContact O-CG2 3.33Å; V995-V999 PolarHBondContact O-N 2.85Å; V995-V999 VanDerWaalsContact O-N 3.08Å
996	Y	97.1	Very high	93.9	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-60.3	-45.6	176.2	-164.7	-69.4	0	0	0	111	F828 M872 I876 L887 F889 T890 F992 K993 V999 L1000	F828-Y996 HydrophobicContact CD2-CD2 4.43Å; F828-Y996 AromaticContact CD2-CE2 3.62Å; F828-Y996 HydrophobicContact CD2-CE2 3.62Å; F828-Y996 HydrophobicContact CE2-CD2 4.26Å; F828-Y996 AromaticContact CE2-CE2 3.76Å; F828-Y996 HydrophobicContact CE2-CE2 3.76Å; F828-Y996 HydrophobicContact CG-CE2 4.42Å; M872-Y996 HydrophobicContact CE-CD2 3.21Å; M872-Y996 HydrophobicContact CE-CE2 3.99Å; M872-Y996 HydrophobicContact CE-CG 3.73Å; I876-Y996 HydrophobicContact CD1-CD1 3.94Å; I876-Y996 HydrophobicContact CD1-CD2 4.16Å; I876-Y996 HydrophobicContact CD1-CE1 3.93Å; I876-Y996 HydrophobicContact CD1-CE2 4.13Å; I876-Y996 HydrophobicContact CD1-CG 4.01Å; I876-Y996 HydrophobicContact CG1-CD2 4.43Å; I876-Y996 HydrophobicContact CG1-CE1 4.02Å; I876-Y996 HydrophobicContact CG1-CE2 3.91Å; L887-Y996 WeakPolarHBondContact O-CE1 3.35Å; L887-Y996 PolarHBondContact O-OH 3.43Å; F889-Y996 HydrophobicContact CD1-CE2 4.48Å; F889-Y996 HydrophobicContact CE1-CD2 4.18Å; F889-Y996 HydrophobicContact CE1-CE1 4.35Å; F889-Y996 AromaticContact CE1-CE2 3.36Å; F889-Y996 HydrophobicContact CE1-CE2 3.36Å; F889-Y996 AromaticContact CE1-CZ 3.48Å; F889-Y996 VanDerWaalsContact CE1-CZ 3.48Å; F889-Y996 WeakPolarHBondContact CE1-OH 3.27Å; F889-Y996 AromaticContact CZ-CD2 3.81Å; F889-Y996 HydrophobicContact CZ-CD2 3.81Å; F889-Y996 AromaticContact CZ-CE2 3.44Å; F889-Y996 HydrophobicContact CZ-CE2 3.44Å; F889-Y996 VanDerWaalsContact CZ-CE2 3.44Å; F889-Y996 AromaticContact CZ-CZ 3.98Å; T890-Y996 HydrophobicContact CG2-CD1 3.75Å; T890-Y996 HydrophobicContact CG2-CD2 4.21Å; T890-Y996 HydrophobicContact CG2-CE1 4.37Å; T890-Y996 HydrophobicContact CG2-CG 3.72Å; F992-Y996 HydrophobicContact CE1-CD2 4.38Å; F992-Y996 HydrophobicContact CE2-CD2 4.01Å; F992-Y996 AromaticContact CZ-CD2 3.72Å; F992-Y996 HydrophobicContact CZ-CD2 3.72Å; F992-Y996 HydrophobicContact CZ-CE2 4.35Å; F992-Y996 WeakPolarHBondContact O-CB 3.35Å; F992-Y996 PolarHBondContact O-N 3.02Å; K993-Y996 WeakPolarHBondContact O-CB 2.88Å; K993-Y996 PolarHBondContact O-N 3.44Å; Y996-V999 PolarHBondContact O-N 3.4Å; Y996-L1000 HydrophobicContact CD1-CD1 3.64Å; Y996-L1000 HydrophobicContact CD1-CG 3.78Å; Y996-L1000 HydrophobicContact CE1-CD1 3.6Å; Y996-L1000 HydrophobicContact CE1-CD2 4.05Å; Y996-L1000 HydrophobicContact CE1-CG 3.66Å; Y996-L1000 WeakPolarHBondContact O-CG 3Å; Y996-L1000 PolarHBondContact O-N 2.95Å
997	E	94.2	Very high	93.2	Very high	44 Å²	44	42.1 Å²	42.1	21%	0.206	23%	0.225	C	C	.	.	H	α-helix	trans	-72.7	-32.8	-175.7	-72.5	169.7	170.2	0	0	113.1	T890 K993 A994 V995 K1001	T890-E997 WeakPolarHBondContact CB-OE1 3.36Å; T890-E997 WeakPolarHBondContact OG1-CG 3.25Å; T890-E997 PolarHBondContact OG1-OE1 2.89Å; K993-E997 IonicContact NZ-OE1 2.73Å; K993-E997 PolarHBondContact NZ-OE1 2.95Å; K993-E997 IonicContact NZ-OE2 3.28Å; K993-E997 PolarHBondContact NZ-OE2 3.08Å; K993-E997 WeakPolarHBondContact O-CB 3.24Å; K993-E997 WeakPolarHBondContact O-CG 2.89Å; K993-E997 PolarHBondContact O-N 2.89Å; A994-E997 PolarHBondContact O-N 3.33Å; V995-E997 VanDerWaalsContact C-N 3.35Å; E997-K1001 WeakPolarHBondContact O-CG 3.36Å; E997-K1001 PolarHBondContact O-N 2.72Å
998	S	93.9	Very high	92.5	Very high	60 Å²	60	44 Å²	44	42%	0.42	23%	0.227	S	C	.	.	H	α-helix	trans	-62.6	-53.3	167.6	-167	0	0	0	0	110.7	A994 L1000 K1001 E1002	A994-S998 PolarHBondContact O-N 3.38Å; S998-L1000 VanDerWaalsContact C-N 3.3Å; S998-L1000 PolarHBondContact O-N 2.92Å; S998-K1001 WeakPolarHBondContact O-CB 3.19Å; S998-K1001 PolarHBondContact O-N 3.49Å; S998-E1002 WeakPolarHBondContact CB-OE1 3.19Å; S998-E1002 WeakPolarHBondContact O-CG 3.47Å; S998-E1002 PolarHBondContact O-N 2.7Å; S998-E1002 PolarHBondContact OG-OE1 2.9Å
999	V	95.4	Very high	91.6	Very high	2 Å²	2	50.4 Å²	50.4	1%	0.012	25%	0.248	C	C	.	.	H	α-helix	trans	-66.7	-29.3	-175.6	174	0	0	0	0	112.7	T860 M872 H873 I876 V995 Y996 E1002 N1003	T860-V999 HydrophobicContact CG2-CG2 4.23Å; M872-V999 HydrophobicContact CB-CG1 4.33Å; M872-V999 HydrophobicContact CB-CG2 4.33Å; M872-V999 HydrophobicContact CG-CB 4.19Å; M872-V999 HydrophobicContact CG-CG1 4.14Å; M872-V999 HydrophobicContact CG-CG2 4.04Å; H873-V999 VanDerWaalsContact CA-CG1 3.49Å; H873-V999 HydrophobicContact CB-CG1 4.05Å; H873-V999 WeakPolarHBondContact ND1-CG1 3.47Å; I876-V999 HydrophobicContact CD1-CB 3.91Å; I876-V999 HydrophobicContact CD1-CG1 3.67Å; V995-V999 WeakPolarHBondContact O-CB 3.19Å; V995-V999 VanDerWaalsContact O-CG2 3.29Å; V995-V999 WeakPolarHBondContact O-CG2 3.33Å; V995-V999 PolarHBondContact O-N 2.85Å; V995-V999 VanDerWaalsContact O-N 3.08Å; Y996-V999 PolarHBondContact O-N 3.4Å; V999-E1002 PolarHBondContact N-OE1 3.1Å; V999-N1003 WeakPolarHBondContact O-CB 3.45Å; V999-N1003 PolarHBondContact O-N 2.89Å
1000	L	93	Very high	90.8	Very high	2 Å²	2	56 Å²	56	1%	0.01	27%	0.274	C	S	.	.	H	α-helix	trans	-57.4	-47.2	168.6	-87.8	175.9	0	0	0	112	I876 L887 Y996 S998 E1004	I876-L1000 HydrophobicContact CD1-CG 4.41Å; I876-L1000 HydrophobicContact CG2-CD2 3.71Å; I876-L1000 HydrophobicContact CG2-CG 4.39Å; L887-L1000 HydrophobicContact CD1-CD2 3.82Å; L887-L1000 HydrophobicContact CD2-CD2 4.08Å; L887-L1000 HydrophobicContact CG-CD2 3.76Å; Y996-L1000 HydrophobicContact CD1-CD1 3.64Å; Y996-L1000 HydrophobicContact CD1-CG 3.78Å; Y996-L1000 HydrophobicContact CE1-CD1 3.6Å; Y996-L1000 HydrophobicContact CE1-CD2 4.05Å; Y996-L1000 HydrophobicContact CE1-CG 3.66Å; Y996-L1000 WeakPolarHBondContact O-CG 3Å; Y996-L1000 PolarHBondContact O-N 2.95Å; S998-L1000 VanDerWaalsContact C-N 3.3Å; S998-L1000 PolarHBondContact O-N 2.92Å; L1000-E1004 PolarHBondContact O-N 3.46Å; L1000-E1004 VanDerWaalsContact O-N 3.15Å
1001	K	90.6	Very high	89.8	Confident	84 Å²	84	60 Å²	60	37%	0.365	29%	0.291	S	S	.	.	H	α-helix	trans	-69.3	-45.1	-180	-67.2	179	176.6	-171.2	0	110.9	E469 E997 S998 N1003 E1004 E1005	E469-K1001 WeakPolarHBondContact OE1-CE 3.33Å; E469-K1001 IonicContact OE1-NZ 3.15Å; E469-K1001 PolarHBondContact OE1-NZ 3.43Å; E469-K1001 IonicContact OE2-NZ 3.64Å; E469-K1001 PolarHBondContact OE2-NZ 2.77Å; E997-K1001 WeakPolarHBondContact O-CG 3.36Å; E997-K1001 PolarHBondContact O-N 2.72Å; S998-K1001 WeakPolarHBondContact O-CB 3.19Å; S998-K1001 PolarHBondContact O-N 3.49Å; K1001-N1003 VanDerWaalsContact C-N 3.35Å; K1001-N1003 PolarHBondContact O-N 2.83Å; K1001-E1004 WeakPolarHBondContact O-CB 3.06Å; K1001-E1004 PolarHBondContact O-N 3.24Å; K1001-E1004 VanDerWaalsContact O-N 3.08Å; K1001-E1005 PolarHBondContact O-N 2.85Å
1002	E	91.6	Very high	88.8	Confident	72 Å²	72	62.5 Å²	62.5	34%	0.336	29%	0.294	S	S	.	.	H	α-helix	trans	-55.4	-46.7	174.8	-67.9	162.2	-117.1	0	0	111.6	H873 S998 V999 E1004 E1005 I1006	H873-E1002 IonicContact CE1-OE2 2.72Å; H873-E1002 PolarHBondContact CE1-OE2 3.27Å; H873-E1002 IonicContact NE2-OE2 2.69Å; H873-E1002 PolarHBondContact NE2-OE2 2.98Å; S998-E1002 WeakPolarHBondContact CB-OE1 3.19Å; S998-E1002 WeakPolarHBondContact O-CG 3.47Å; S998-E1002 PolarHBondContact O-N 2.7Å; S998-E1002 PolarHBondContact OG-OE1 2.9Å; V999-E1002 PolarHBondContact N-OE1 3.1Å; E1002-E1004 VanDerWaalsContact C-N 3.34Å; E1002-E1004 PolarHBondContact O-N 3Å; E1002-E1005 PolarHBondContact O-N 3.29Å; E1002-I1006 WeakPolarHBondContact O-CD1 3.24Å; E1002-I1006 VanDerWaalsContact O-CG1 3.24Å; E1002-I1006 WeakPolarHBondContact O-CG1 3.07Å; E1002-I1006 PolarHBondContact O-N 2.9Å
1003	N	92	Very high	87.9	Confident	1 Å²	1	66.9 Å²	66.9	1%	0.005	32%	0.317	C	S	.	.	H	α-helix	trans	-64.8	-33.6	176.2	-92	-19.6	0	0	0	113.3	H873 I876 D877 V999 K1001 R1007	H873-N1003 PolarHBondContact CD2-OD1 3.25Å; H873-N1003 VanDerWaalsContact CD2-OD1 3.3Å; H873-N1003 PolarHBondContact O-ND2 3.42Å; I876-N1003 WeakPolarHBondContact CG2-ND2 3.46Å; D877-N1003 PolarHBondContact OD1-ND2 3.02Å; D877-N1003 PolarHBondContact OD2-OD1 2.9Å; V999-N1003 WeakPolarHBondContact O-CB 3.45Å; V999-N1003 PolarHBondContact O-N 2.89Å; K1001-N1003 VanDerWaalsContact C-N 3.35Å; K1001-N1003 PolarHBondContact O-N 2.83Å; N1003-R1007 WeakPolarHBondContact O-CG 3.29Å; N1003-R1007 PolarHBondContact O-N 3.4Å; N1003-R1007 VanDerWaalsContact O-N 3.12Å
1004	E	85.8	Confident	87	Confident	76 Å²	76	69.7 Å²	69.7	36%	0.355	33%	0.333	S	S	.	.	H	α-helix	trans	-69.1	-43	175.7	-163.4	179.2	130.1	0	0	111.6	R888 L1000 K1001 E1002 I1006 R1007 M1008	R888-E1004 IonicContact NH2-OE2 3.65Å; L1000-E1004 PolarHBondContact O-N 3.46Å; L1000-E1004 VanDerWaalsContact O-N 3.15Å; K1001-E1004 WeakPolarHBondContact O-CB 3.06Å; K1001-E1004 PolarHBondContact O-N 3.24Å; K1001-E1004 VanDerWaalsContact O-N 3.08Å; E1002-E1004 VanDerWaalsContact C-N 3.34Å; E1002-E1004 PolarHBondContact O-N 3Å; E1004-I1006 PolarHBondContact O-N 3.47Å; E1004-R1007 PolarHBondContact O-N 3.44Å; E1004-M1008 WeakPolarHBondContact O-CG 3.43Å; E1004-M1008 PolarHBondContact O-N 2.76Å
1005	E	87.3	Confident	85.7	Confident	111 Å²	111	72.3 Å²	72.3	52%	0.519	34%	0.335	S	S	.	.	H	α-helix	trans	-62.6	-39.5	173.6	-70.4	-177.9	-168.3	0	0	112.6	K1001 E1002 M1008 R1009	K1001-E1005 PolarHBondContact O-N 2.85Å; E1002-E1005 PolarHBondContact O-N 3.29Å; E1005-M1008 PolarHBondContact O-N 3.19Å; E1005-R1009 VanDerWaalsContact O-CB 3.27Å; E1005-R1009 WeakPolarHBondContact O-CB 3.4Å; E1005-R1009 PolarHBondContact O-N 3.1Å
1006	I	86.6	Confident	84.5	Confident	57 Å²	57	73.9 Å²	73.9	29%	0.292	35%	0.35	S	S	.	.	H	α-helix	trans	-60.1	-45.7	174.3	-71.5	164.3	0	0	0	110.7	E1002 E1004 R1009 H1010	E1002-I1006 WeakPolarHBondContact O-CD1 3.24Å; E1002-I1006 VanDerWaalsContact O-CG1 3.24Å; E1002-I1006 WeakPolarHBondContact O-CG1 3.07Å; E1002-I1006 PolarHBondContact O-N 2.9Å; E1004-I1006 PolarHBondContact O-N 3.47Å; I1006-R1009 PolarHBondContact O-N 3.23Å; I1006-H1010 WeakPolarHBondContact O-CB 3.35Å; I1006-H1010 PolarHBondContact O-N 3.49Å
1007	R	83	Confident	83.4	Confident	93 Å²	93	77.2 Å²	77.2	35%	0.351	37%	0.366	S	S	.	.	H	α-helix	trans	-62.6	-46.8	176.2	-73.3	-177.1	-67	-99.6	1.8	112	D877 N1003 E1004 R1009 H1010 Q1011	D877-R1007 IonicContact OD1-NH1 2.72Å; D877-R1007 PolarHBondContact OD1-NH1 2.99Å; N1003-R1007 WeakPolarHBondContact O-CG 3.29Å; N1003-R1007 PolarHBondContact O-N 3.4Å; N1003-R1007 VanDerWaalsContact O-N 3.12Å; E1004-R1007 PolarHBondContact O-N 3.44Å; R1007-R1009 PolarHBondContact O-N 3.3Å; R1007-H1010 PolarHBondContact O-N 2.84Å; R1007-Q1011 PolarHBondContact O-N 2.81Å
1008	M	82	Confident	82.4	Confident	70 Å²	70	78.1 Å²	78.1	35%	0.345	38%	0.381	S	S	.	.	H	α-helix	trans	-63.4	-39.9	178.5	-71	-60.8	-61.4	0	0	112.7	E1004 E1005 R1012	E1004-M1008 WeakPolarHBondContact O-CG 3.43Å; E1004-M1008 PolarHBondContact O-N 2.76Å; E1005-M1008 PolarHBondContact O-N 3.19Å; M1008-R1012 WeakPolarHBondContact O-CB 3.29Å; M1008-R1012 WeakPolarHBondContact O-CG 3.46Å; M1008-R1012 PolarHBondContact O-N 3.5Å
1009	R	77	Confident	81.1	Confident	168 Å²	168	78.1 Å²	78.1	63%	0.634	39%	0.385	S	S	*	.	H	α-helix	trans	-63.9	-41.5	175.4	-177.9	176.9	-76.8	119.2	-2.1	111.4	E1005 I1006 R1007 L1013	E1005-R1009 VanDerWaalsContact O-CB 3.27Å; E1005-R1009 WeakPolarHBondContact O-CB 3.4Å; E1005-R1009 PolarHBondContact O-N 3.1Å; I1006-R1009 PolarHBondContact O-N 3.23Å; R1007-R1009 PolarHBondContact O-N 3.3Å; R1009-L1013 PolarHBondContact O-N 3.13Å
1010	H	80.6	Confident	80	Confident	117 Å²	117	85.3 Å²	85.3	54%	0.542	41%	0.412	S	S	.	.	H	α-helix	trans	-65.5	-45.7	176.7	-175.9	59.3	0	0	0	112.3	I1006 R1007 R1012 L1013 L1014	I1006-H1010 WeakPolarHBondContact O-CB 3.35Å; I1006-H1010 PolarHBondContact O-N 3.49Å; R1007-H1010 PolarHBondContact O-N 2.84Å; H1010-R1012 PolarHBondContact O-N 2.84Å; H1010-L1013 PolarHBondContact O-N 2.84Å; H1010-L1014 PolarHBondContact O-N 3.46Å; H1010-L1014 VanDerWaalsContact O-N 3.15Å
1011	Q	75.8	Confident	79.1	Confident	102 Å²	102	93.8 Å²	93.8	48%	0.477	44%	0.444	S	S	.	.	H	α-helix	trans	-61.2	-44.2	177.9	-172.6	179	17	0	0	112.3	R1007 L1013 L1014 Q1015	R1007-Q1011 PolarHBondContact O-N 2.81Å; Q1011-L1013 VanDerWaalsContact C-N 3.3Å; Q1011-L1013 PolarHBondContact O-N 3.31Å; Q1011-L1014 PolarHBondContact O-N 3.31Å; Q1011-Q1015 WeakPolarHBondContact O-CG 3.45Å; Q1011-Q1015 PolarHBondContact O-N 3.05Å
1012	R	76.2	Confident	78.2	Confident	137 Å²	137	95.8 Å²	95.8	52%	0.517	46%	0.458	S	S	.	.	H	α-helix	trans	-59.6	-38.9	175.7	-77.4	175.2	169.6	-169.7	-5	112.5	M1008 H1010 Q1015 A1016	M1008-R1012 WeakPolarHBondContact O-CB 3.29Å; M1008-R1012 WeakPolarHBondContact O-CG 3.46Å; M1008-R1012 PolarHBondContact O-N 3.5Å; H1010-R1012 PolarHBondContact O-N 2.84Å; R1012-Q1015 PolarHBondContact O-N 3.47Å; R1012-A1016 WeakPolarHBondContact O-CB 3.24Å; R1012-A1016 PolarHBondContact O-N 3.26Å
1013	L	76.9	Confident	77.2	Confident	92 Å²	92	95.2 Å²	95.2	48%	0.482	47%	0.465	S	S	.	.	H	α-helix	trans	-65.9	-44.3	179	-168.1	151.3	0	0	0	111.2	R1009 H1010 Q1011 Q1015 A1016 E1017	R1009-L1013 PolarHBondContact O-N 3.13Å; H1010-L1013 PolarHBondContact O-N 2.84Å; Q1011-L1013 VanDerWaalsContact C-N 3.3Å; Q1011-L1013 PolarHBondContact O-N 3.31Å; L1013-Q1015 VanDerWaalsContact C-N 3.34Å; L1013-Q1015 PolarHBondContact O-N 3.49Å; L1013-A1016 PolarHBondContact O-N 3.11Å; L1013-E1017 HydrophobicContact CD2-CG 4.28Å; L1013-E1017 WeakPolarHBondContact O-CG 3.45Å; L1013-E1017 PolarHBondContact O-N 3.08Å
1014	L	77.6	Confident	76.4	Confident	89 Å²	89	98.9 Å²	98.9	47%	0.466	48%	0.482	S	S	.	.	H	α-helix	trans	-61.8	-39.9	174.8	-65.7	173.1	0	0	0	112.5	H1010 Q1011 E1017 A1018	H1010-L1014 PolarHBondContact O-N 3.46Å; H1010-L1014 VanDerWaalsContact O-N 3.15Å; Q1011-L1014 PolarHBondContact O-N 3.31Å; L1014-E1017 PolarHBondContact O-N 3.46Å; L1014-A1018 PolarHBondContact O-N 2.85Å
1015	Q	68.1	Low	75.9	Confident	115 Å²	115	100.8 Å²	100.8	54%	0.537	49%	0.491	S	S	.	.	H	α-helix	trans	-64.9	-43.1	175.2	-73.1	174.5	-37.2	0	0	112	Q1011 R1012 L1013 E1017 A1018 A1019	Q1011-Q1015 WeakPolarHBondContact O-CG 3.45Å; Q1011-Q1015 PolarHBondContact O-N 3.05Å; R1012-Q1015 PolarHBondContact O-N 3.47Å; L1013-Q1015 VanDerWaalsContact C-N 3.34Å; L1013-Q1015 PolarHBondContact O-N 3.49Å; Q1015-E1017 VanDerWaalsContact C-N 3.34Å; Q1015-E1017 PolarHBondContact O-N 3.23Å; Q1015-A1018 PolarHBondContact O-N 2.69Å; Q1015-A1019 WeakPolarHBondContact O-CB 3.4Å; Q1015-A1019 PolarHBondContact O-N 3.32Å
1016	A	69.8	Low	75.2	Confident	59 Å²	59	99.1 Å²	99.1	49%	0.488	48%	0.483	S	S	.	.	H	α-helix	trans	-63.7	-37.1	176.3	0	0	0	0	0	112.4	R1012 L1013 R1020	R1012-A1016 WeakPolarHBondContact O-CB 3.24Å; R1012-A1016 PolarHBondContact O-N 3.26Å; L1013-A1016 PolarHBondContact O-N 3.11Å; A1016-R1020 VanDerWaalsContact O-CB 3.27Å; A1016-R1020 WeakPolarHBondContact O-CB 3.5Å; A1016-R1020 PolarHBondContact O-N 2.76Å
1017	E	74.8	Confident	74.6	Confident	71 Å²	71	103.5 Å²	103.5	33%	0.332	50%	0.496	S	S	.	.	H	α-helix	trans	-67.6	-38.9	174.2	-72.1	-168.9	160.8	0	0	113	L1013 L1014 Q1015 R1021	L1013-E1017 HydrophobicContact CD2-CG 4.28Å; L1013-E1017 WeakPolarHBondContact O-CG 3.45Å; L1013-E1017 PolarHBondContact O-N 3.08Å; L1014-E1017 PolarHBondContact O-N 3.46Å; Q1015-E1017 VanDerWaalsContact C-N 3.34Å; Q1015-E1017 PolarHBondContact O-N 3.23Å; E1017-R1021 WeakPolarHBondContact O-CG 3.44Å; E1017-R1021 PolarHBondContact O-N 3.01Å; E1017-R1021 VanDerWaalsContact O-N 3.15Å
1018	A	71.8	Confident	74.3	Confident	62 Å²	62	103.4 Å²	103.4	51%	0.512	50%	0.499	S	S	.	.	H	α-helix	trans	-65.1	-47.4	175	0	0	0	0	0	111.7	L1014 Q1015 R1020 R1021 L1022	L1014-A1018 PolarHBondContact O-N 2.85Å; Q1015-A1018 PolarHBondContact O-N 2.69Å; A1018-R1020 PolarHBondContact O-N 3.3Å; A1018-R1021 PolarHBondContact O-N 2.75Å; A1018-L1022 PolarHBondContact O-N 3.43Å
1019	A	68.1	Low	74.1	Confident	61 Å²	61	103.6 Å²	103.6	50%	0.504	50%	0.502	S	S	.	.	H	α-helix	trans	-60.6	-42.6	176	0	0	0	0	0	112.1	Q1015 R1021 L1022 A1023	Q1015-A1019 WeakPolarHBondContact O-CB 3.4Å; Q1015-A1019 PolarHBondContact O-N 3.32Å; A1019-R1021 VanDerWaalsContact C-N 3.32Å; A1019-R1021 PolarHBondContact O-N 3.32Å; A1019-L1022 PolarHBondContact O-N 3.14Å; A1019-A1023 PolarHBondContact O-N 2.78Å
1020	R	71.6	Confident	73.8	Confident	153 Å²	153	97.1 Å²	97.1	58%	0.577	48%	0.478	S	S	*	.	H	α-helix	trans	-59.4	-40.2	176.2	-172.6	177.2	70.8	-146.2	-4.5	112.2	A1016 A1018 E1024	A1016-R1020 VanDerWaalsContact O-CB 3.27Å; A1016-R1020 WeakPolarHBondContact O-CB 3.5Å; A1016-R1020 PolarHBondContact O-N 2.76Å; A1018-R1020 PolarHBondContact O-N 3.3Å; R1020-E1024 WeakPolarHBondContact O-CB 3.49Å; R1020-E1024 PolarHBondContact O-N 3.29Å
1021	R	74.9	Confident	73.6	Confident	180 Å²	180	96.7 Å²	96.7	68%	0.679	48%	0.476	S	S	*	.	H	α-helix	trans	-65.3	-42	177.2	-73.7	177.5	-176.3	178.9	4.9	112.5	E1017 A1018 A1019 E1024 Q1025	E1017-R1021 WeakPolarHBondContact O-CG 3.44Å; E1017-R1021 PolarHBondContact O-N 3.01Å; E1017-R1021 VanDerWaalsContact O-N 3.15Å; A1018-R1021 PolarHBondContact O-N 2.75Å; A1019-R1021 VanDerWaalsContact C-N 3.32Å; A1019-R1021 PolarHBondContact O-N 3.32Å; R1021-E1024 PolarHBondContact O-N 3.39Å; R1021-Q1025 PolarHBondContact O-N 3.31Å
1022	L	70.9	Confident	73.8	Confident	126 Å²	126	97.6 Å²	97.6	66%	0.66	48%	0.478	S	S	*	.	H	α-helix	trans	-65.2	-49.2	178.2	-177.7	62.4	0	0	0	111.4	A1018 A1019 E1024 Q1025 E1026	A1018-L1022 PolarHBondContact O-N 3.43Å; A1019-L1022 PolarHBondContact O-N 3.14Å; L1022-E1024 VanDerWaalsContact C-N 3.28Å; L1022-E1024 PolarHBondContact O-N 2.69Å; L1022-Q1025 PolarHBondContact O-N 2.87Å; L1022-E1026 PolarHBondContact O-N 2.99Å
1023	A	70.1	Confident	73.7	Confident	59 Å²	59	92.8 Å²	92.8	49%	0.488	46%	0.462	S	S	.	.	H	α-helix	trans	-62.6	-34.6	177	0	0	0	0	0	112.5	A1019 R1027	A1019-A1023 PolarHBondContact O-N 2.78Å; A1023-R1027 VanDerWaalsContact O-CB 3.23Å; A1023-R1027 WeakPolarHBondContact O-CB 3.2Å; A1023-R1027 PolarHBondContact O-N 3.16Å
1024	E	76.2	Confident	73.6	Confident	78 Å²	78	92.6 Å²	92.6	36%	0.364	46%	0.457	S	S	.	.	H	α-helix	trans	-67.4	-38.7	174.6	177.9	147.6	-119.2	0	0	112.7	R1020 R1021 L1022 R1027 Q1028	R1020-E1024 WeakPolarHBondContact O-CB 3.49Å; R1020-E1024 PolarHBondContact O-N 3.29Å; R1021-E1024 PolarHBondContact O-N 3.39Å; L1022-E1024 VanDerWaalsContact C-N 3.28Å; L1022-E1024 PolarHBondContact O-N 2.69Å; E1024-R1027 IonicContact OE1-CZ 2.69Å; E1024-R1027 IonicContact OE1-NH2 2.86Å; E1024-R1027 PolarHBondContact OE1-NH2 3.18Å; E1024-Q1028 WeakPolarHBondContact O-CG 3.13Å; E1024-Q1028 PolarHBondContact O-N 2.64Å
1025	Q	74.4	Confident	73.4	Confident	117 Å²	117	93 Å²	93	55%	0.547	46%	0.458	S	S	.	.	H	α-helix	trans	-64.8	-48.4	174.4	-176.5	178.2	-20	0	0	111.5	R1021 L1022 R1027 Q1028 D1029	R1021-Q1025 PolarHBondContact O-N 3.31Å; L1022-Q1025 PolarHBondContact O-N 2.87Å; Q1025-R1027 VanDerWaalsContact C-N 3.3Å; Q1025-R1027 PolarHBondContact O-N 3.45Å; Q1025-Q1028 WeakPolarHBondContact O-CB 3.38Å; Q1025-Q1028 PolarHBondContact O-N 2.86Å; Q1025-Q1028 VanDerWaalsContact O-N 3.1Å; Q1025-D1029 PolarHBondContact O-N 2.87Å; Q1025-D1029 VanDerWaalsContact O-N 3.07Å
1026	E	72.1	Confident	73.7	Confident	75 Å²	75	91.7 Å²	91.7	35%	0.35	45%	0.451	S	S	.	.	H	α-helix	trans	-60.4	-42.4	177.8	-168	-171.4	172	0	0	111.3	L1022 Q1028 D1029 R1030	L1022-E1026 PolarHBondContact O-N 2.99Å; E1026-Q1028 VanDerWaalsContact C-N 3.3Å; E1026-Q1028 PolarHBondContact O-N 2.78Å; E1026-D1029 PolarHBondContact O-N 3.47Å; E1026-R1030 WeakPolarHBondContact O-CG 3.4Å; E1026-R1030 PolarHBondContact O-N 3.13Å; E1026-R1030 IonicContact OE1-CZ 2.7Å; E1026-R1030 IonicContact OE1-NE 3.49Å; E1026-R1030 PolarHBondContact OE1-NE 2.92Å; E1026-R1030 IonicContact OE1-NH2 2.72Å; E1026-R1030 PolarHBondContact OE1-NH2 3.46Å
1027	R	75.3	Confident	73.9	Confident	149 Å²	149	89.3 Å²	89.3	56%	0.562	43%	0.43	S	S	*	.	H	α-helix	trans	-57.4	-41.7	174.2	-177.8	179.2	67.8	158.2	-1.1	112	A1023 E1024 Q1025 Q1031	A1023-R1027 VanDerWaalsContact O-CB 3.23Å; A1023-R1027 WeakPolarHBondContact O-CB 3.2Å; A1023-R1027 PolarHBondContact O-N 3.16Å; E1024-R1027 IonicContact OE1-CZ 2.69Å; E1024-R1027 IonicContact OE1-NH2 2.86Å; E1024-R1027 PolarHBondContact OE1-NH2 3.18Å; Q1025-R1027 VanDerWaalsContact C-N 3.3Å; Q1025-R1027 PolarHBondContact O-N 3.45Å; R1027-Q1031 WeakPolarHBondContact O-CB 3.48Å; R1027-Q1031 PolarHBondContact O-N 2.79Å
1028	Q	77	Confident	73.7	Confident	91 Å²	91	89 Å²	89	43%	0.425	43%	0.431	S	S	.	.	H	α-helix	trans	-65.3	-42.6	177	-74.5	175.6	24.8	0	0	112.4	E1024 Q1025 E1026 Q1031 K1032	E1024-Q1028 WeakPolarHBondContact O-CG 3.13Å; E1024-Q1028 PolarHBondContact O-N 2.64Å; Q1025-Q1028 WeakPolarHBondContact O-CB 3.38Å; Q1025-Q1028 PolarHBondContact O-N 2.86Å; Q1025-Q1028 VanDerWaalsContact O-N 3.1Å; E1026-Q1028 VanDerWaalsContact C-N 3.3Å; E1026-Q1028 PolarHBondContact O-N 2.78Å; Q1028-Q1031 PolarHBondContact O-N 2.76Å; Q1028-K1032 VanDerWaalsContact O-CG 3.32Å; Q1028-K1032 WeakPolarHBondContact O-CG 3.47Å; Q1028-K1032 PolarHBondContact O-N 3.4Å
1029	D	75.8	Confident	73.6	Confident	75 Å²	75	87.6 Å²	87.6	40%	0.401	42%	0.419	S	S	.	.	H	α-helix	trans	-70.5	-37.6	-179.9	-71.5	-32.4	0	0	0	112.1	Q1025 E1026 K1032 Q1033	Q1025-D1029 PolarHBondContact O-N 2.87Å; Q1025-D1029 VanDerWaalsContact O-N 3.07Å; E1026-D1029 PolarHBondContact O-N 3.47Å; D1029-K1032 PolarHBondContact O-N 3.21Å; D1029-K1032 IonicContact OD1-NZ 2.8Å; D1029-K1032 PolarHBondContact OD1-NZ 3.48Å; D1029-Q1033 PolarHBondContact O-N 2.73Å
1030	R	72.5	Confident	73.6	Confident	32 Å²	32	87.3 Å²	87.3	12%	0.121	41%	0.408	C	S	.	.	H	α-helix	trans	-62.7	-41.2	167.9	-70.1	178.8	-179.1	-86.6	-3.3	112.1	S315 D316 R321 E1026 K1032 Q1033 K1034	S315-R1030 PolarHBondContact O-NH1 3.46Å; S315-R1030 VanDerWaalsContact O-NH1 3.14Å; D316-R1030 WeakPolarHBondContact OD1-CD 3.28Å; R321-R1030 VanDerWaalsContact NH2-NH2 3.19Å; E1026-R1030 WeakPolarHBondContact O-CG 3.4Å; E1026-R1030 PolarHBondContact O-N 3.13Å; E1026-R1030 IonicContact OE1-CZ 2.7Å; E1026-R1030 IonicContact OE1-NE 3.49Å; E1026-R1030 PolarHBondContact OE1-NE 2.92Å; E1026-R1030 IonicContact OE1-NH2 2.72Å; E1026-R1030 PolarHBondContact OE1-NH2 3.46Å; R1030-K1032 VanDerWaalsContact C-N 3.34Å; R1030-K1032 PolarHBondContact O-N 3.15Å; R1030-Q1033 PolarHBondContact O-N 2.96Å; R1030-K1034 WeakPolarHBondContact O-CG 3.35Å; R1030-K1034 PolarHBondContact O-N 3.28Å
1031	Q	75.6	Confident	73.3	Confident	108 Å²	108	80.2 Å²	80.2	51%	0.505	38%	0.381	S	S	.	.	H	α-helix	trans	-63.8	-37.8	177.3	-172	175.2	6.8	0	0	111.9	R1027 Q1028 K1034 I1035	R1027-Q1031 WeakPolarHBondContact O-CB 3.48Å; R1027-Q1031 PolarHBondContact O-N 2.79Å; Q1028-Q1031 PolarHBondContact O-N 2.76Å; Q1031-K1034 PolarHBondContact O-N 3.12Å; Q1031-I1035 HydrophobicContact CG-CD1 3.96Å; Q1031-I1035 HydrophobicContact CG-CG1 4.46Å; Q1031-I1035 WeakPolarHBondContact O-CB 3.12Å; Q1031-I1035 VanDerWaalsContact O-CG1 3.25Å; Q1031-I1035 WeakPolarHBondContact O-CG1 3.36Å; Q1031-I1035 PolarHBondContact O-N 3.37Å
1032	K	79	Confident	72.8	Confident	120 Å²	120	77.6 Å²	77.6	52%	0.522	38%	0.376	S	S	.	.	H	α-helix	trans	-60.5	-45.2	172.7	-67.7	162.9	-157.4	165.6	0	111.8	Q1028 D1029 R1030 I1035 K1036	Q1028-K1032 VanDerWaalsContact O-CG 3.32Å; Q1028-K1032 WeakPolarHBondContact O-CG 3.47Å; Q1028-K1032 PolarHBondContact O-N 3.4Å; D1029-K1032 PolarHBondContact O-N 3.21Å; D1029-K1032 IonicContact OD1-NZ 2.8Å; D1029-K1032 PolarHBondContact OD1-NZ 3.48Å; R1030-K1032 VanDerWaalsContact C-N 3.34Å; R1030-K1032 PolarHBondContact O-N 3.15Å; K1032-I1035 PolarHBondContact O-N 3.15Å; K1032-K1036 PolarHBondContact O-N 3.4Å
1033	Q	75.2	Confident	72.1	Confident	37 Å²	37	77.5 Å²	77.5	17%	0.173	38%	0.376	C	S	.	.	H	α-helix	trans	-66.1	-40.4	176.2	-178.8	67.2	0.3	0	0	111.9	D1029 R1030 K1036 L1037 Q1060 A1061 P1063	D1029-Q1033 PolarHBondContact O-N 2.73Å; R1030-Q1033 PolarHBondContact O-N 2.96Å; Q1033-K1036 PolarHBondContact O-N 2.9Å; Q1033-L1037 WeakPolarHBondContact O-CB 3.34Å; Q1033-L1037 PolarHBondContact O-N 2.81Å; Q1033-Q1060 PolarHBondContact NE2-O 3.11Å; Q1033-A1061 VanDerWaalsContact NE2-C 3.33Å; Q1033-A1061 PolarHBondContact NE2-O 3.11Å; Q1033-P1063 HydrophobicContact CG-CG 4.29Å
1034	K	74.1	Confident	71.3	Confident	87 Å²	87	76.1 Å²	76.1	38%	0.378	36%	0.364	S	S	.	.	H	α-helix	trans	-63.1	-39.1	173.8	-73.5	-175.6	-178.7	-176	0	112.4	D316 R1030 Q1031 L1037 L1038	D316-K1034 VanDerWaalsContact CG-NZ 3.26Å; D316-K1034 VanDerWaalsContact OD1-CE 3.28Å; D316-K1034 WeakPolarHBondContact OD1-CE 3.35Å; D316-K1034 IonicContact OD1-NZ 2.69Å; D316-K1034 PolarHBondContact OD1-NZ 2.8Å; D316-K1034 VanDerWaalsContact OD1-NZ 3.12Å; D316-K1034 IonicContact OD2-NZ 3.71Å; D316-K1034 PolarHBondContact OD2-NZ 3.04Å; R1030-K1034 WeakPolarHBondContact O-CG 3.35Å; R1030-K1034 PolarHBondContact O-N 3.28Å; Q1031-K1034 PolarHBondContact O-N 3.12Å; K1034-L1037 PolarHBondContact O-N 2.93Å; K1034-L1038 WeakPolarHBondContact O-CB 3.47Å; K1034-L1038 PolarHBondContact O-N 3.2Å
1035	I	74.2	Confident	70.3	Confident	97 Å²	97	75.4 Å²	75.4	50%	0.497	36%	0.36	S	S	.	.	H	α-helix	trans	-65.7	-44.9	173.9	-70.9	164.9	0	0	0	110.8	Q1031 K1032 L1037 L1038 A1039	Q1031-I1035 HydrophobicContact CG-CD1 3.96Å; Q1031-I1035 HydrophobicContact CG-CG1 4.46Å; Q1031-I1035 WeakPolarHBondContact O-CB 3.12Å; Q1031-I1035 VanDerWaalsContact O-CG1 3.25Å; Q1031-I1035 WeakPolarHBondContact O-CG1 3.36Å; Q1031-I1035 PolarHBondContact O-N 3.37Å; K1032-I1035 PolarHBondContact O-N 3.15Å; I1035-L1037 VanDerWaalsContact C-N 3.29Å; I1035-L1037 PolarHBondContact O-N 3.31Å; I1035-L1038 PolarHBondContact O-N 2.78Å; I1035-A1039 WeakPolarHBondContact O-CB 3.47Å; I1035-A1039 PolarHBondContact O-N 3.16Å
1036	K	75.1	Confident	69.9	Low	88 Å²	88	70.1 Å²	70.1	38%	0.383	34%	0.335	S	S	.	.	H	α-helix	trans	-55.6	-45.6	174.9	-175	-167.3	173.4	-165.3	0	111.1	K1032 Q1033 M1040	K1032-K1036 PolarHBondContact O-N 3.4Å; Q1033-K1036 PolarHBondContact O-N 2.9Å; K1036-M1040 WeakPolarHBondContact O-CG 3.13Å; K1036-M1040 PolarHBondContact O-N 2.89Å
1037	L	72.2	Confident	69.9	Low	9 Å²	9	67.1 Å²	67.1	5%	0.047	33%	0.325	C	S	.	.	H	α-helix	trans	-74.1	-35.4	-179.6	-168.4	59.9	0	0	0	112.5	V254 I314 Q1033 K1034 I1035 M1040 T1041 L1052	V254-L1037 HydrophobicContact CB-CD2 3.95Å; V254-L1037 HydrophobicContact CG2-CD2 4.22Å; V254-L1037 WeakPolarHBondContact O-CD2 3.36Å; I314-L1037 HydrophobicContact CD1-CD2 4.48Å; Q1033-L1037 WeakPolarHBondContact O-CB 3.34Å; Q1033-L1037 PolarHBondContact O-N 2.81Å; K1034-L1037 PolarHBondContact O-N 2.93Å; I1035-L1037 VanDerWaalsContact C-N 3.29Å; I1035-L1037 PolarHBondContact O-N 3.31Å; L1037-M1040 WeakPolarHBondContact O-CB 3.35Å; L1037-M1040 PolarHBondContact O-N 2.69Å; L1037-T1041 PolarHBondContact O-N 3.48Å; L1037-T1041 PolarHBondContact O-OG1 2.68Å; L1037-L1052 HydrophobicContact CD1-CD2 3.6Å; L1037-L1052 HydrophobicContact CG-CD2 4.46Å
1038	L	71.4	Confident	70.3	Confident	66 Å²	66	60 Å²	60	35%	0.346	30%	0.298	S	S	.	.	H	α-helix	trans	-62	-44	173.5	-173.6	73.5	0	0	0	110.8	P256 K1034 I1035 M1040 T1041 H1042	P256-L1038 HydrophobicContact CG-CB 4.3Å; P256-L1038 HydrophobicContact CG-CD1 3.87Å; K1034-L1038 WeakPolarHBondContact O-CB 3.47Å; K1034-L1038 PolarHBondContact O-N 3.2Å; I1035-L1038 PolarHBondContact O-N 2.78Å; L1038-M1040 VanDerWaalsContact C-N 3.32Å; L1038-M1040 PolarHBondContact O-N 3Å; L1038-T1041 WeakPolarHBondContact CA-OG1 3.35Å; L1038-T1041 CarbonylContact O-C 3.57Å; L1038-T1041 VanDerWaalsContact O-CA 3.27Å; L1038-T1041 WeakPolarHBondContact O-CA 3.27Å; L1038-T1041 PolarHBondContact O-N 2.68Å; L1038-T1041 PolarHBondContact O-OG1 3.17Å; L1038-H1042 WeakPolarHBondContact O-CB 3.49Å; L1038-H1042 PolarHBondContact O-N 3.05Å
1039	A	68.8	Low	70.7	Confident	32 Å²	32	55.7 Å²	55.7	26%	0.264	28%	0.278	S	S	.	.	H	α-helix	trans	-57.4	-42.6	175.3	0	0	0	0	0	112	I1035 T1041 H1042 D1043	I1035-A1039 WeakPolarHBondContact O-CB 3.47Å; I1035-A1039 PolarHBondContact O-N 3.16Å; A1039-T1041 PolarHBondContact O-N 2.96Å; A1039-T1041 VanDerWaalsContact O-N 3.08Å; A1039-H1042 PolarHBondContact O-N 2.77Å; A1039-H1042 VanDerWaalsContact O-N 3.1Å; A1039-D1043 VanDerWaalsContact CB-OD2 3.28Å; A1039-D1043 WeakPolarHBondContact CB-OD2 3.43Å; A1039-D1043 PolarHBondContact O-N 2.75Å
1040	M	68.8	Low	71.2	Confident	55 Å²	55	55 Å²	55	27%	0.271	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-9.8	171.5	-64.4	-178.6	68.3	0	0	114.1	K1036 L1037 L1038 A1055	K1036-M1040 WeakPolarHBondContact O-CG 3.13Å; K1036-M1040 PolarHBondContact O-N 2.89Å; L1037-M1040 WeakPolarHBondContact O-CB 3.35Å; L1037-M1040 PolarHBondContact O-N 2.69Å; L1038-M1040 VanDerWaalsContact C-N 3.32Å; L1038-M1040 PolarHBondContact O-N 3Å; M1040-A1055 HydrophobicContact CE-CB 3.95Å
1041	T	66.2	Low	71.9	Confident	4 Å²	4	55.1 Å²	55.1	3%	0.025	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-122.5	17.1	175.4	66.7	0	0	0	0	113.1	N214 L1037 L1038 A1039 V1048 L1052	N214-T1041 VanDerWaalsContact CG-O 3.28Å; N214-T1041 PolarHBondContact ND2-O 2.9Å; N214-T1041 PolarHBondContact OD1-O 3.17Å; L1037-T1041 PolarHBondContact O-N 3.48Å; L1037-T1041 PolarHBondContact O-OG1 2.68Å; L1038-T1041 WeakPolarHBondContact CA-OG1 3.35Å; L1038-T1041 CarbonylContact O-C 3.57Å; L1038-T1041 VanDerWaalsContact O-CA 3.27Å; L1038-T1041 WeakPolarHBondContact O-CA 3.27Å; L1038-T1041 PolarHBondContact O-N 2.68Å; L1038-T1041 PolarHBondContact O-OG1 3.17Å; A1039-T1041 PolarHBondContact O-N 2.96Å; A1039-T1041 VanDerWaalsContact O-N 3.08Å; T1041-V1048 HydrophobicContact CG2-CG1 3.82Å; T1041-L1052 HydrophobicContact CG2-CD1 4.08Å; T1041-L1052 HydrophobicContact CG2-CD2 4Å; T1041-L1052 HydrophobicContact CG2-CG 4.32Å
1042	H	64	Low	72.5	Confident	124 Å²	124	50 Å²	50	57%	0.574	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-141.5	-56.1	-175.5	-173.2	-84.1	0	0	0	111.8	L1038 A1039 S1044	L1038-H1042 WeakPolarHBondContact O-CB 3.49Å; L1038-H1042 PolarHBondContact O-N 3.05Å; A1039-H1042 PolarHBondContact O-N 2.77Å; A1039-H1042 VanDerWaalsContact O-N 3.1Å; H1042-S1044 PolarHBondContact O-N 3.02Å
1043	D	55.8	Low	72.9	Confident	124 Å²	124	45 Å²	45	66%	0.663	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80	-4.1	-172.6	-52.5	-24.3	0	0	0	112.5	A1039	A1039-D1043 VanDerWaalsContact CB-OD2 3.28Å; A1039-D1043 WeakPolarHBondContact CB-OD2 3.43Å; A1039-D1043 PolarHBondContact O-N 2.75Å
1044	S	52.7	Low	73.6	Confident	31 Å²	31	49.5 Å²	49.5	22%	0.217	26%	0.256	C	S	.	.			trans	-126.4	124.7	158.9	44.2	0	0	0	0	108	N214 H1042 E1046 V1048	N214-S1044 PolarHBondContact ND2-O 2.78Å; H1042-S1044 PolarHBondContact O-N 3.02Å; S1044-E1046 PolarHBondContact O-N 2.76Å; S1044-E1046 VanDerWaalsContact O-N 3.14Å; S1044-V1048 WeakPolarHBondContact O-CG2 3.21Å
1045	E	55.8	Low	74.3	Confident	63 Å²	63	45.6 Å²	45.6	29%	0.294	24%	0.24	S	C	.	.	S	Bend	trans	-66.7	-3	166.1	-72.8	-126.4	113.3	0	0	111.8	I150 K154 N213 N214	I150-E1045 HydrophobicContact CD1-CB 4.06Å; K154-E1045 IonicContact NZ-OE2 2.96Å; N213-E1045 CarbonylContact C-O 3.43Å; N213-E1045 WeakPolarHBondContact CA-O 3.4Å; N214-E1045 PolarHBondContact N-O 3.05Å
1046	E	66.3	Low	75	Confident	5 Å²	5	41 Å²	41	2%	0.023	22%	0.216	C	C	.	.	B	Isolated β-bridge	trans	-133	128.1	-139	-49.4	178.9	126.4	0	0	113.3	N77 L78 T79 K83 S1044 V1048	N77-E1046 VanDerWaalsContact OD1-CA 3.27Å; N77-E1046 WeakPolarHBondContact OD1-CA 3.41Å; L78-E1046 VanDerWaalsContact N-CD 3.35Å; L78-E1046 PolarHBondContact N-OE1 2.86Å; T79-E1046 WeakPolarHBondContact CA-OE2 3.25Å; T79-E1046 HydrophobicContact CG2-CB 4.37Å; T79-E1046 PolarHBondContact N-OE2 3.16Å; T79-E1046 VanDerWaalsContact N-OE2 3.15Å; K83-E1046 VanDerWaalsContact CE-CD 3.46Å; K83-E1046 WeakPolarHBondContact CE-OE1 3.39Å; K83-E1046 WeakPolarHBondContact CE-OE2 3.29Å; K83-E1046 VanDerWaalsContact NZ-CD 3.28Å; K83-E1046 IonicContact NZ-OE1 3.31Å; K83-E1046 PolarHBondContact NZ-OE1 3Å; K83-E1046 IonicContact NZ-OE2 2.9Å; K83-E1046 PolarHBondContact NZ-OE2 2.72Å; S1044-E1046 PolarHBondContact O-N 2.76Å; S1044-E1046 VanDerWaalsContact O-N 3.14Å; E1046-V1048 PolarHBondContact O-N 3.31Å; E1046-V1048 VanDerWaalsContact O-N 3.1Å
1047	G	72.7	Confident	75.7	Confident	12 Å²	12	38.4 Å²	38.4	12%	0.124	21%	0.209	C	C	.	.	S	Bend	trans	64.4	11.3	-178.4	0	0	0	0	0	113.9	N212 M1049 D1050 S1051	N212-G1047 PolarHBondContact O-N 3.33Å; N212-G1047 WeakPolarHBondContact OD1-CA 3.49Å; N212-G1047 PolarHBondContact OD1-O 3.11Å; G1047-M1049 PolarHBondContact O-N 3.33Å; G1047-M1049 VanDerWaalsContact O-N 3.13Å; G1047-D1050 PolarHBondContact O-N 2.8Å; G1047-S1051 PolarHBondContact O-N 3.47Å; G1047-S1051 PolarHBondContact O-OG 2.76Å
1048	V	82.7	Confident	76.5	Confident	0 Å²	0	41 Å²	41	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-50.8	-42.5	-170.1	-177.4	0	0	0	0	112.4	L217 T1041 S1044 E1046 S1051 L1052	L217-V1048 HydrophobicContact CD2-CG1 3.75Å; T1041-V1048 HydrophobicContact CG2-CG1 3.82Å; S1044-V1048 WeakPolarHBondContact O-CG2 3.21Å; E1046-V1048 PolarHBondContact O-N 3.31Å; E1046-V1048 VanDerWaalsContact O-N 3.1Å; V1048-S1051 PolarHBondContact O-N 3.03Å; V1048-L1052 HydrophobicContact CG1-CD1 4.22Å; V1048-L1052 WeakPolarHBondContact O-CB 3.33Å; V1048-L1052 VanDerWaalsContact O-CG 3.26Å; V1048-L1052 WeakPolarHBondContact O-CG 3.35Å; V1048-L1052 PolarHBondContact O-N 3.05Å
1049	M	86	Confident	77.1	Confident	1 Å²	1	38.1 Å²	38.1	1%	0.005	21%	0.212	C	C	.	.	H	α-helix	trans	-65.5	-43.2	179.7	-179.3	67.1	-117.6	0	0	111.3	R208 M211 N212 L248 A251 G1047 L1053	R208-M1049 HydrophobicContact CG-CG 4.11Å; M211-M1049 HydrophobicContact CB-CB 4.36Å; M211-M1049 HydrophobicContact CB-CG 4.21Å; M211-M1049 HydrophobicContact CB-SD 4.06Å; M211-M1049 HydrophobicContact CE-SD 4.36Å; M211-M1049 HydrophobicContact SD-SD 4.42Å; N212-M1049 HydrophobicContact CB-CB 4.05Å; N212-M1049 WeakPolarHBondContact OD1-CB 3.49Å; N212-M1049 PolarHBondContact OD1-N 3.37Å; L248-M1049 HydrophobicContact CD2-CE 3.52Å; L248-M1049 HydrophobicContact CD2-CG 4.29Å; L248-M1049 HydrophobicContact CD2-SD 3.55Å; L248-M1049 VanDerWaalsContact CD2-SD 3.55Å; A251-M1049 HydrophobicContact CB-CE 3.22Å; A251-M1049 HydrophobicContact CB-SD 4.23Å; G1047-M1049 PolarHBondContact O-N 3.33Å; G1047-M1049 VanDerWaalsContact O-N 3.13Å; M1049-L1053 HydrophobicContact CE-CD1 3.8Å; M1049-L1053 HydrophobicContact CE-CD2 3.82Å; M1049-L1053 HydrophobicContact CE-CG 3.61Å; M1049-L1053 VanDerWaalsContact O-CG 3.31Å; M1049-L1053 WeakPolarHBondContact O-CG 3.44Å; M1049-L1053 PolarHBondContact O-N 3.28Å
1050	D	87.1	Confident	78	Confident	59 Å²	59	41.5 Å²	41.5	32%	0.316	22%	0.222	S	C	.	.	H	α-helix	trans	-72.1	-37	176.8	-66.9	-39.3	0	0	0	112.2	R208 N212 G1047 L1052 L1053 E1054	R208-D1050 IonicContact CZ-OD1 2.63Å; R208-D1050 IonicContact NE-OD1 3.82Å; R208-D1050 PolarHBondContact NE-OD1 3.47Å; R208-D1050 IonicContact NH2-OD1 3.83Å; R208-D1050 PolarHBondContact NH2-OD1 3Å; N212-D1050 PolarHBondContact ND2-OD2 3.15Å; N212-D1050 PolarHBondContact OD1-N 2.82Å; G1047-D1050 PolarHBondContact O-N 2.8Å; D1050-L1052 VanDerWaalsContact C-N 3.34Å; D1050-L1052 PolarHBondContact O-N 3.47Å; D1050-L1053 WeakPolarHBondContact O-CB 3.39Å; D1050-L1053 PolarHBondContact O-N 2.97Å; D1050-L1053 VanDerWaalsContact O-N 3.12Å; D1050-E1054 PolarHBondContact O-N 3.06Å
1051	S	86.3	Confident	78.7	Confident	35 Å²	35	38.9 Å²	38.9	25%	0.245	21%	0.21	C	C	.	.	H	α-helix	trans	-60.5	-39.5	173.3	-62.6	0	0	0	0	112.6	G1047 V1048 E1054 A1055	G1047-S1051 PolarHBondContact O-N 3.47Å; G1047-S1051 PolarHBondContact O-OG 2.76Å; V1048-S1051 PolarHBondContact O-N 3.03Å; S1051-E1054 PolarHBondContact O-N 3.49Å; S1051-A1055 WeakPolarHBondContact O-CB 3.29Å; S1051-A1055 PolarHBondContact O-N 2.89Å
1052	L	87.4	Confident	79.7	Confident	1 Å²	1	39 Å²	39	1%	0.005	21%	0.21	C	C	.	.	H	α-helix	trans	-67.4	-37.2	173.1	-71.5	172.1	0	0	0	111.9	L217 A251 V254 V255 L1037 T1041 V1048 D1050 A1055 L1056	L217-L1052 HydrophobicContact CD2-CD1 4.29Å; A251-L1052 HydrophobicContact CB-CB 4.01Å; A251-L1052 HydrophobicContact CB-CD1 4.48Å; V254-L1052 HydrophobicContact CG2-CD2 4.11Å; V255-L1052 HydrophobicContact CG2-CD1 3.89Å; L1037-L1052 HydrophobicContact CD1-CD2 3.6Å; L1037-L1052 HydrophobicContact CG-CD2 4.46Å; T1041-L1052 HydrophobicContact CG2-CD1 4.08Å; T1041-L1052 HydrophobicContact CG2-CD2 4Å; T1041-L1052 HydrophobicContact CG2-CG 4.32Å; V1048-L1052 HydrophobicContact CG1-CD1 4.22Å; V1048-L1052 WeakPolarHBondContact O-CB 3.33Å; V1048-L1052 VanDerWaalsContact O-CG 3.26Å; V1048-L1052 WeakPolarHBondContact O-CG 3.35Å; V1048-L1052 PolarHBondContact O-N 3.05Å; D1050-L1052 VanDerWaalsContact C-N 3.34Å; D1050-L1052 PolarHBondContact O-N 3.47Å; L1052-A1055 PolarHBondContact O-N 3.25Å; L1052-L1056 WeakPolarHBondContact O-CB 3.34Å; L1052-L1056 WeakPolarHBondContact O-CG 3.37Å; L1052-L1056 PolarHBondContact O-N 3.17Å
1053	L	89.1	Confident	80.5	Confident	16 Å²	16	34.9 Å²	34.9	8%	0.084	19%	0.194	C	C	.	.	H	α-helix	trans	-68.4	-34.9	174.9	-68.1	176.3	0	0	0	112.7	K247 A251 M1049 D1050 L1056 S1057	K247-L1053 HydrophobicContact CB-CD2 3.65Å; K247-L1053 HydrophobicContact CD-CD2 4.39Å; K247-L1053 HydrophobicContact CG-CD2 4.1Å; K247-L1053 WeakPolarHBondContact O-CD2 3.31Å; A251-L1053 HydrophobicContact CB-CD2 4.21Å; M1049-L1053 HydrophobicContact CE-CD1 3.8Å; M1049-L1053 HydrophobicContact CE-CD2 3.82Å; M1049-L1053 HydrophobicContact CE-CG 3.61Å; M1049-L1053 VanDerWaalsContact O-CG 3.31Å; M1049-L1053 WeakPolarHBondContact O-CG 3.44Å; M1049-L1053 PolarHBondContact O-N 3.28Å; D1050-L1053 WeakPolarHBondContact O-CB 3.39Å; D1050-L1053 PolarHBondContact O-N 2.97Å; D1050-L1053 VanDerWaalsContact O-N 3.12Å; L1053-L1056 HydrophobicContact CD2-CD1 4.48Å; L1053-S1057 VanDerWaalsContact O-CB 3.29Å; L1053-S1057 WeakPolarHBondContact O-CB 3.2Å; L1053-S1057 PolarHBondContact O-N 3.25Å; L1053-S1057 PolarHBondContact O-OG 3.12Å
1054	E	89.7	Confident	81.2	Confident	130 Å²	130	36.5 Å²	36.5	61%	0.607	20%	0.198	S	C	*	.	H	α-helix	trans	-67.7	-44.3	171.8	-174	173.7	-175.1	0	0	111.1	D1050 S1051 L1056 S1057 T1058	D1050-E1054 PolarHBondContact O-N 3.06Å; S1051-E1054 PolarHBondContact O-N 3.49Å; E1054-L1056 VanDerWaalsContact C-N 3.32Å; E1054-L1056 PolarHBondContact O-N 2.64Å; E1054-S1057 PolarHBondContact O-N 3.2Å; E1054-T1058 HydrophobicContact CG-CG2 4.19Å; E1054-T1058 WeakPolarHBondContact O-CB 3.23Å; E1054-T1058 WeakPolarHBondContact O-CG2 3.33Å; E1054-T1058 PolarHBondContact O-N 3.36Å; E1054-T1058 PolarHBondContact O-OG1 3.45Å
1055	A	88	Confident	81.9	Confident	5 Å²	5	38.6 Å²	38.6	4%	0.041	20%	0.201	C	C	.	.	H	α-helix	trans	-60.7	-38.8	175.7	0	0	0	0	0	112.8	M1040 S1051 L1052 T1058 G1059 Q1060 A1061	M1040-A1055 HydrophobicContact CE-CB 3.95Å; S1051-A1055 WeakPolarHBondContact O-CB 3.29Å; S1051-A1055 PolarHBondContact O-N 2.89Å; L1052-A1055 PolarHBondContact O-N 3.25Å; A1055-T1058 PolarHBondContact O-OG1 3.41Å; A1055-G1059 CarbonylContact O-C 3.54Å; A1055-G1059 PolarHBondContact O-N 2.83Å; A1055-Q1060 PolarHBondContact O-N 2.9Å; A1055-A1061 HydrophobicContact CB-CB 4.18Å; A1055-A1061 PolarHBondContact O-N 2.69Å
1056	L	89.4	Confident	81.6	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-67	-46.7	172.8	-77.4	165.1	0	0	0	111.8	A250 A251 V254 A310 Q351 L1052 L1053 E1054 G1059 A1061 F1062	A250-L1056 HydrophobicContact CB-CD1 3.75Å; A251-L1056 HydrophobicContact CB-CD1 4.15Å; V254-L1056 HydrophobicContact CG1-CD2 3.95Å; A310-L1056 HydrophobicContact CB-CD2 4.36Å; Q351-L1056 PolarHBondContact NE2-O 2.96Å; L1052-L1056 WeakPolarHBondContact O-CB 3.34Å; L1052-L1056 WeakPolarHBondContact O-CG 3.37Å; L1052-L1056 PolarHBondContact O-N 3.17Å; L1053-L1056 HydrophobicContact CD2-CD1 4.48Å; E1054-L1056 VanDerWaalsContact C-N 3.32Å; E1054-L1056 PolarHBondContact O-N 2.64Å; L1056-G1059 PolarHBondContact O-N 3.28Å; L1056-G1059 VanDerWaalsContact O-N 3.14Å; L1056-A1061 HydrophobicContact CD2-CB 4.1Å; L1056-A1061 HydrophobicContact CG-CB 4.33Å; L1056-F1062 HydrophobicContact CD2-CE1 4.24Å; L1056-F1062 HydrophobicContact CD2-CE2 4.27Å; L1056-F1062 HydrophobicContact CD2-CZ 3.58Å
1057	S	88.9	Confident	80.6	Confident	35 Å²	35	50.4 Å²	50.4	25%	0.245	25%	0.252	C	S	.	.	H	α-helix	trans	-67.8	-40.7	-175.4	-57.3	0	0	0	0	112.5	Q306 Q351 L1053 E1054 G1059	Q306-S1057 PolarHBondContact NE2-OG 3.45Å; Q351-S1057 PolarHBondContact NE2-O 2.91Å; L1053-S1057 VanDerWaalsContact O-CB 3.29Å; L1053-S1057 WeakPolarHBondContact O-CB 3.2Å; L1053-S1057 PolarHBondContact O-N 3.25Å; L1053-S1057 PolarHBondContact O-OG 3.12Å; E1054-S1057 PolarHBondContact O-N 3.2Å; S1057-G1059 PolarHBondContact O-N 3.14Å
1058	T	89.2	Confident	78.9	Confident	62 Å²	62	55.2 Å²	55.2	38%	0.38	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77	-7.1	173.5	58.4	0	0	0	0	113.8	E1054 A1055 Q1060	E1054-T1058 HydrophobicContact CG-CG2 4.19Å; E1054-T1058 WeakPolarHBondContact O-CB 3.23Å; E1054-T1058 WeakPolarHBondContact O-CG2 3.33Å; E1054-T1058 PolarHBondContact O-N 3.36Å; E1054-T1058 PolarHBondContact O-OG1 3.45Å; A1055-T1058 PolarHBondContact O-OG1 3.41Å; T1058-Q1060 PolarHBondContact O-N 3.48Å
1059	G	84.5	Confident	76.5	Confident	7 Å²	7	61.8 Å²	61.8	7%	0.072	32%	0.321	C	S	.	.	S	Bend	trans	74.2	-1	-174.9	0	0	0	0	0	115.3	A1055 L1056 S1057 A1061 F1062	A1055-G1059 CarbonylContact O-C 3.54Å; A1055-G1059 PolarHBondContact O-N 2.83Å; L1056-G1059 PolarHBondContact O-N 3.28Å; L1056-G1059 VanDerWaalsContact O-N 3.14Å; S1057-G1059 PolarHBondContact O-N 3.14Å; G1059-A1061 PolarHBondContact O-N 3.45Å; G1059-F1062 WeakPolarHBondContact O-CD2 3.34Å; G1059-F1062 PolarHBondContact O-N 3.37Å
1060	Q	86.9	Confident	73.9	Confident	102 Å²	102	65.1 Å²	65.1	48%	0.477	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-17.7	179.8	-72.4	-161.9	51.1	0	0	115.1	Q1033 A1055 T1058 F1062	Q1033-Q1060 PolarHBondContact NE2-O 3.11Å; A1055-Q1060 PolarHBondContact O-N 2.9Å; T1058-Q1060 PolarHBondContact O-N 3.48Å; Q1060-F1062 PolarHBondContact O-N 2.89Å
1061	A	85.2	Confident	71.4	Confident	1 Å²	1	67.4 Å²	67.4	1%	0.008	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-28	171	0	0	0	0	0	112.2	Q1033 A1055 L1056 G1059	Q1033-A1061 VanDerWaalsContact NE2-C 3.33Å; Q1033-A1061 PolarHBondContact NE2-O 3.11Å; A1055-A1061 HydrophobicContact CB-CB 4.18Å; A1055-A1061 PolarHBondContact O-N 2.69Å; L1056-A1061 HydrophobicContact CD2-CB 4.1Å; L1056-A1061 HydrophobicContact CG-CB 4.33Å; G1059-A1061 PolarHBondContact O-N 3.45Å
1062	F	87	Confident	68.8	Low	5 Å²	5	73.3 Å²	73.3	2%	0.022	40%	0.396	C	S	.	.	S	Bend	trans	-93.9	142.7	-174.6	-50.3	-62.8	0	0	0	112	N309 I313 I354 L1056 G1059 Q1060 Q1064	N309-F1062 HydrophobicContact CB-CE1 3.8Å; N309-F1062 HydrophobicContact CB-CE2 3.95Å; N309-F1062 HydrophobicContact CB-CZ 3.42Å; N309-F1062 VanDerWaalsContact CB-CZ 3.42Å; I313-F1062 HydrophobicContact CB-CD1 3.97Å; I313-F1062 HydrophobicContact CD1-CD1 4.2Å; I313-F1062 HydrophobicContact CD1-CG 4.4Å; I313-F1062 HydrophobicContact CG2-CB 4.18Å; I313-F1062 HydrophobicContact CG2-CD1 3.94Å; I313-F1062 HydrophobicContact CG2-CG 4.42Å; I354-F1062 HydrophobicContact CD1-CD2 4.17Å; I354-F1062 HydrophobicContact CG2-CB 4.32Å; I354-F1062 HydrophobicContact CG2-CD2 3.73Å; I354-F1062 HydrophobicContact CG2-CE2 4.3Å; I354-F1062 HydrophobicContact CG2-CG 4.05Å; L1056-F1062 HydrophobicContact CD2-CE1 4.24Å; L1056-F1062 HydrophobicContact CD2-CE2 4.27Å; L1056-F1062 HydrophobicContact CD2-CZ 3.58Å; G1059-F1062 WeakPolarHBondContact O-CD2 3.34Å; G1059-F1062 PolarHBondContact O-N 3.37Å; Q1060-F1062 PolarHBondContact O-N 2.89Å; F1062-Q1064 PolarHBondContact O-N 2.7Å
1063	P	79.6	Confident	66.5	Low	38 Å²	38	77.5 Å²	77.5	25%	0.247	43%	0.425	C	S	.	.			trans	-71.3	116.4	-179.7	-8.7	22.7	0	0	0	111.1	H358 Q1033 R1065	H358-P1063 PolarHBondContact CE1-O 3.23Å; H358-P1063 PolarHBondContact NE2-O 3.44Å; H358-P1063 VanDerWaalsContact NE2-O 3.16Å; Q1033-P1063 HydrophobicContact CG-CG 4.29Å; P1063-R1065 PolarHBondContact O-N 3.31Å
1064	Q	71.1	Confident	64	Low	159 Å²	159	84.1 Å²	84.1	74%	0.743	46%	0.455	S	S	*	.			trans	-64.7	113.2	-179.7	-71.3	-161.8	-3.9	0	0	112.3	F1062	F1062-Q1064 PolarHBondContact O-N 2.7Å
1065	R	67.6	Low	61.7	Low	75 Å²	75	82 Å²	82	28%	0.283	45%	0.451	S	S	.	.			trans	-91.4	107.8	170.3	-73.5	-176.8	156.4	-140.9	-19.6	109.9	A361 D362 D365 P1063 K1067	A361-R1065 HydrophobicContact CB-CB 4.42Å; D362-R1065 IonicContact OD1-CZ 3.67Å; D362-R1065 VanDerWaalsContact OD1-CZ 3.28Å; D362-R1065 IonicContact OD1-NH1 3.46Å; D362-R1065 PolarHBondContact OD1-NH1 3.24Å; D362-R1065 IonicContact OD1-NH2 3.79Å; D365-R1065 IonicContact OD2-CZ 2.73Å; D365-R1065 IonicContact OD2-NH1 2.78Å; D365-R1065 PolarHBondContact OD2-NH1 3.18Å; D365-R1065 IonicContact OD2-NH2 3.34Å; D365-R1065 PolarHBondContact OD2-NH2 2.8Å; P1063-R1065 PolarHBondContact O-N 3.31Å; R1065-K1067 PolarHBondContact O-N 3.44Å
1066	F	49.3	Very low	59.3	Low	181 Å²	181	90.2 Å²	90.2	79%	0.794	48%	0.481	S	S	*	.	P	Polyproline II helix	trans	-68.7	127.6	171.6	-69.6	-81.9	0	0	0	110.2	T1068	F1066-T1068 PolarHBondContact O-N 2.85Å
1067	K	44.2	Very low	56.5	Low	135 Å²	135	101 Å²	101	59%	0.587	52%	0.522	S	S	*	.	P	Polyproline II helix	trans	-59.8	124.1	164.2	-77.3	169.8	173.5	162.2	0	108.9	E357 R1065 P1069	E357-K1067 WeakPolarHBondContact OE1-CE 3.4Å; E357-K1067 IonicContact OE1-NZ 2.57Å; E357-K1067 PolarHBondContact OE1-NZ 2.98Å; R1065-K1067 PolarHBondContact O-N 3.44Å; K1067-P1069 WeakPolarHBondContact O-CD 3.49Å
1068	T	38.2	Very low	53.9	Low	112 Å²	112	107.9 Å²	107.9	69%	0.687	55%	0.547	S	S	*	.	P	Polyproline II helix	trans	-60.1	118.4	170.9	37.3	0	0	0	0	108.8	F1066 G1070	F1066-T1068 PolarHBondContact O-N 2.85Å; T1068-G1070 VanDerWaalsContact C-N 3.27Å; T1068-G1070 PolarHBondContact O-N 2.87Å
1069	P	31.4	Very low	51.4	Low	139 Å²	139	111.3 Å²	111.3	90%	0.903	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79	75.9	-171.1	31.6	-35.3	0	0	0	110.7	K1067	K1067-P1069 WeakPolarHBondContact O-CD 3.49Å
1070	G	31.6	Very low	48.8	Very low	71 Å²	71	114.9 Å²	114.9	73%	0.732	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-160.1	-14.1	-177	0	0	0	0	0	117.1	T1068	T1068-G1070 VanDerWaalsContact C-N 3.27Å; T1068-G1070 PolarHBondContact O-N 2.87Å
1071	V	35.8	Very low	46	Very low	106 Å²	106	121.1 Å²	121.1	64%	0.642	61%	0.607	S	S	*	*			trans	-129.9	101.3	179.8	-172.8	0	0	0	0	110.8	S1073	V1071-S1073 PolarHBondContact O-N 3.32Å
1072	E	31.5	Very low	43.6	Very low	160 Å²	160	126.8 Å²	126.8	75%	0.748	64%	0.644	S	S	*	*			trans	-70.7	106.2	165.9	-69.7	-167.2	149	0	0	109.6	H1074	E1072-H1074 PolarHBondContact O-N 3.21Å; E1072-H1074 PolarHBondContact O-ND1 2.85Å
1073	S	39.2	Very low	40.7	Very low	89 Å²	89	139.1 Å²	139.1	62%	0.622	69%	0.69	S	S	*	*			trans	-60.4	92.9	-179	-51.6	0	0	0	0	112.5	V1071 T1075 R1076	V1071-S1073 PolarHBondContact O-N 3.32Å; S1073-T1075 PolarHBondContact O-N 3.47Å; S1073-R1076 PolarHBondContact O-N 3.44Å
1074	H	36.1	Very low	38.3	Very low	155 Å²	155	140.4 Å²	140.4	72%	0.718	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.5	0.5	-177.9	-86.3	48.9	0	0	0	114.5	E1072	E1072-H1074 PolarHBondContact O-N 3.21Å; E1072-H1074 PolarHBondContact O-ND1 2.85Å
1075	T	41.4	Very low	36.4	Very low	86 Å²	86	138.4 Å²	138.4	53%	0.528	71%	0.714	S	S	.	*	T	Hydrogen-bonded Turn	trans	-71.9	-49.6	174.6	45.5	0	0	0	0	112.9	S1073 R1077 K1078	S1073-T1075 PolarHBondContact O-N 3.47Å; T1075-R1077 PolarHBondContact O-N 2.92Å; T1075-K1078 PolarHBondContact O-N 3.18Å
1076	R	37.9	Very low	34.4	Very low	176 Å²	176	140.9 Å²	140.9	66%	0.664	74%	0.743	S	S	*	*	G	3₁₀ helix	trans	-60.9	-23.3	-170.1	-162.5	169.9	-175.7	167.3	2.8	113.7	E341 S1073	E341-R1076 IonicContact OE1-CZ 2.62Å; E341-R1076 IonicContact OE1-NH1 3.73Å; E341-R1076 IonicContact OE1-NH2 2.81Å; E341-R1076 PolarHBondContact OE1-NH2 3.47Å; E341-R1076 IonicContact OE2-NH2 3.12Å; E341-R1076 PolarHBondContact OE2-NH2 3.12Å; S1073-R1076 PolarHBondContact O-N 3.44Å
1077	R	30.7	Very low	33.5	Very low	226 Å²	226	137.5 Å²	137.5	85%	0.853	74%	0.742	S	S	*	*	G	3₁₀ helix	trans	-78.1	-11.2	176.9	-91.8	-175.7	173.6	159.9	1.2	115.8	T1075	T1075-R1077 PolarHBondContact O-N 2.92Å
1078	K	34.1	Very low	32.7	Very low	180 Å²	180	135.3 Å²	135.3	78%	0.783	75%	0.749	S	S	*	*	G	3₁₀ helix	trans	-91.1	-12.3	-178	-74.3	-172.3	178.3	177	0	115.4	T1075	T1075-K1078 PolarHBondContact O-N 3.18Å
1079	H	35.8	Very low	32.2	Very low	134 Å²	134	140.2 Å²	140.2	62%	0.62	76%	0.761	S	S	*	*			trans	-89.1	-2.1	-178	-74.1	-98.1	0	0	0	114.5	R1081	H1079-R1081 VanDerWaalsContact C-N 3.25Å; H1079-R1081 PolarHBondContact O-N 3.21Å
1080	A	29.5	Very low	32	Very low	83 Å²	83	138.8 Å²	138.8	69%	0.686	76%	0.761	S	S	*	*	S	Bend	trans	-67	81.4	166.6	0	0	0	0	0	110.8	P1082	A1080-P1082 VanDerWaalsContact O-CD 3.32Å; A1080-P1082 WeakPolarHBondContact O-CD 3.31Å
1081	R	28.3	Very low	31.9	Very low	232 Å²	232	139.5 Å²	139.5	88%	0.875	76%	0.76	S	S	*	*			trans	-49.4	118.1	-178.4	-79.6	-179.3	168.7	171.2	-1.1	111.5	H1079	H1079-R1081 VanDerWaalsContact C-N 3.25Å; H1079-R1081 PolarHBondContact O-N 3.21Å
1082	P	34.2	Very low	31.5	Very low	121 Å²	121	140.4 Å²	140.4	79%	0.786	77%	0.771	S	S	*	*			trans	-59.8	140.2	166.1	-21	33.4	0	0	0	109.8	A1080 G1084	A1080-P1082 VanDerWaalsContact O-CD 3.32Å; A1080-P1082 WeakPolarHBondContact O-CD 3.31Å; P1082-G1084 PolarHBondContact O-N 3.45Å
1083	R	27.9	Very low	31.4	Very low	263 Å²	263	144.4 Å²	144.4	99%	0.992	78%	0.779	S	S	*	*			trans	-71.3	71	174.8	-74.2	-179.4	170.4	173.7	-3.3	111.2
1084	G	28.6	Very low	30.9	Very low	66 Å²	66	149.5 Å²	149.5	68%	0.68	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-85.1	144.8	171.4	0	0	0	0	0	111.9	P1082	P1082-G1084 PolarHBondContact O-N 3.45Å
1085	S	30.2	Very low	30.5	Very low	116 Å²	116	153.4 Å²	153.4	81%	0.811	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-66	135.2	-174.1	55.3	0	0	0	0	113.5	S1087	S1085-S1087 PolarHBondContact O-N 3.06Å
1086	S	27.4	Very low	29.9	Very low	128 Å²	128	154.2 Å²	154.2	90%	0.895	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-61	122.1	172	38	0	0	0	0	112.4
1087	S	28.7	Very low	29.3	Very low	110 Å²	110	153.8 Å²	153.8	77%	0.769	83%	0.828	S	S	*	*			trans	-154.3	134.5	168.5	-172.7	0	0	0	0	110.6	S1085	S1085-S1087 PolarHBondContact O-N 3.06Å
1088	A	28.8	Very low	29.1	Very low	88 Å²	88	147.4 Å²	147.4	73%	0.727	82%	0.823	S	S	*	*	S	Bend	trans	47.7	77.3	163.9	0	0	0	0	0	118.5
1089	F	26.9	Very low	28.8	Very low	215 Å²	215	145 Å²	145	94%	0.943	83%	0.826	S	S	*	*			trans	-159.2	80.7	132.1	-116.8	-73.5	0	0	0	110.9
1090	A	27.9	Very low	28.2	Very low	109 Å²	109	144 Å²	144	90%	0.901	83%	0.834	S	S	*	*			trans	-142	91	174.7	0	0	0	0	0	108.7
1091	A	30	Very low	28.1	Very low	86 Å²	86	147.3 Å²	147.3	71%	0.711	84%	0.841	S	S	*	*			trans	-123.3	144.1	-179.9	0	0	0	0	0	110.1
1092	S	27.5	Very low	28.1	Very low	126 Å²	126	142.8 Å²	142.8	88%	0.881	84%	0.838	S	S	*	*			trans	51	73.5	162.1	-52.7	0	0	0	0	116.9
1093	R	28.7	Very low	27.7	Very low	244 Å²	244	141.2 Å²	141.2	92%	0.921	84%	0.835	S	S	*	*			trans	-120.7	112.2	149.1	-157.2	174.5	-166.6	175.8	4.9	107.9
1094	E	27.6	Very low	27.7	Very low	195 Å²	195	135.3 Å²	135.3	91%	0.911	83%	0.829	S	S	*	*			trans	-61.7	140.5	-176.3	-64.7	174.4	128.9	0	0	110.5
1095	R	28.3	Very low	27.7	Very low	238 Å²	238	138 Å²	138	90%	0.898	83%	0.834	S	S	*	*			trans	-121.4	123.1	173.9	-92.1	-175.9	167	175.2	-3.8	108.3
1096	A	29.4	Very low	27.7	Very low	102 Å²	102	136.2 Å²	136.2	84%	0.843	83%	0.834	S	S	*	*			trans	-66.2	148.3	170.7	0	0	0	0	0	110.9
1097	D	25	Very low	27.6	Very low	168 Å²	168	136.5 Å²	136.5	90%	0.898	83%	0.831	S	S	*	*			trans	-69	143	-174.1	-65.1	-78.1	0	0	0	114.1
1098	A	26.7	Very low	27.7	Very low	91 Å²	91	138 Å²	138	75%	0.752	83%	0.834	S	S	*	*			trans	-135.8	138.4	160.2	0	0	0	0	0	108.1
1099	P	26.9	Very low	27.6	Very low	129 Å²	129	142.8 Å²	142.8	84%	0.838	84%	0.839	S	S	*	*			trans	-76.7	158.1	-156.4	28	-35.8	0	0	0	115.6
1100	S	24.3	Very low	27.5	Very low	115 Å²	115	142.8 Å²	142.8	80%	0.804	84%	0.839	S	S	*	*			trans	-53	148.9	-178.8	49.3	0	0	0	0	115.8
1101	N	27.3	Very low	27.5	Very low	152 Å²	152	143.6 Å²	143.6	81%	0.813	83%	0.832	S	S	*	*			trans	-147.4	122.5	154.1	-125.1	-25.1	0	0	0	112.1
1102	V	28.4	Very low	27.2	Very low	137 Å²	137	151.4 Å²	151.4	83%	0.83	84%	0.843	S	S	*	*			trans	41.2	129	162.1	-170.3	0	0	0	0	119.9
1103	A	24.5	Very low	27.3	Very low	87 Å²	87	156.6 Å²	156.6	72%	0.719	84%	0.843	S	S	*	*			trans	-98.9	160.6	178.1	0	0	0	0	0	114.2
1104	T	29.4	Very low	27.3	Very low	140 Å²	140	149.8 Å²	149.8	86%	0.859	84%	0.84	S	S	*	*			trans	-159.3	143.5	145.1	9.5	0	0	0	0	110.6
1105	P	27.9	Very low	27.3	Very low	123 Å²	123	145.4 Å²	145.4	80%	0.799	84%	0.836	S	S	*	*			trans	-101.3	130.5	-170.1	36.1	-32.3	0	0	0	114.8
1106	G	29.8	Very low	27.3	Very low	78 Å²	78	144 Å²	144	80%	0.804	84%	0.837	S	S	*	*			trans	-99.6	114.2	171.3	0	0	0	0	0	112.8
1107	T	25.7	Very low	27.3	Very low	134 Å²	134	147.8 Å²	147.8	82%	0.822	84%	0.837	S	S	*	*			trans	-90.1	117.2	-178.1	-59.3	0	0	0	0	112.1
1108	V	30.7	Very low	27.5	Very low	140 Å²	140	145.9 Å²	145.9	85%	0.848	83%	0.834	S	S	*	*			trans	-122.5	138.2	171.9	-175.4	0	0	0	0	110.7
1109	K	27.7	Very low	27.7	Very low	190 Å²	190	151.5 Å²	151.5	83%	0.826	84%	0.841	S	S	*	*			trans	-82.4	134.7	-163.2	-63.8	174.9	-179.2	174.5	0	113	V1111	K1109-V1111 PolarHBondContact O-N 2.77Å
1110	K	23.7	Very low	27.8	Very low	214 Å²	214	149.8 Å²	149.8	93%	0.93	84%	0.838	S	S	*	*			trans	-65.4	119.2	169.6	-72.2	178.7	176.1	176	0	110.7
1111	V	28.5	Very low	27.9	Very low	126 Å²	126	149.4 Å²	149.4	76%	0.764	84%	0.842	S	S	*	*			trans	-88.7	112.8	168	177.6	0	0	0	0	109.5	K1109	K1109-V1111 PolarHBondContact O-N 2.77Å
1112	R	24.2	Very low	28.1	Very low	250 Å²	250	147.8 Å²	147.8	94%	0.943	84%	0.843	S	S	*	*			trans	-73.7	121.1	174.2	-133.7	174.8	-178.8	174.4	-1.7	108.6
1113	R	27.9	Very low	28.1	Very low	235 Å²	235	150.2 Å²	150.2	89%	0.887	85%	0.845	S	S	*	*			trans	-110.6	141	162.4	-80.3	-172.6	169.4	-178.6	-2.7	109.4
1114	A	29.2	Very low	28.1	Very low	102 Å²	102	155.4 Å²	155.4	84%	0.843	85%	0.854	S	S	*	*			trans	-76.1	146.4	-165.1	0	0	0	0	0	113
1115	A	27.9	Very low	28.2	Very low	102 Å²	102	154.9 Å²	154.9	84%	0.843	85%	0.85	S	S	*	*			trans	-68.1	136.7	170.9	0	0	0	0	0	110.4
1116	K	29	Very low	28.3	Very low	210 Å²	210	153.4 Å²	153.4	91%	0.913	85%	0.849	S	S	*	*			trans	-98.4	114.3	174.1	-148.4	174.3	-172.7	179.9	0	107.5
1117	Q	28	Very low	28.3	Very low	180 Å²	180	160.7 Å²	160.7	84%	0.841	85%	0.852	S	S	*	*	P	Polyproline II helix	trans	-64.8	149.1	-177.7	-80.5	-179.8	-35.3	0	0	111.9
1118	P	29.8	Very low	28.7	Very low	128 Å²	128	160 Å²	160	83%	0.831	85%	0.85	S	S	*	*	P	Polyproline II helix	trans	-67.8	144.7	177.2	29.6	-35.1	0	0	0	111
1119	K	30.8	Very low	28.8	Very low	209 Å²	209	160.8 Å²	160.8	91%	0.909	85%	0.849	S	S	*	*	P	Polyproline II helix	trans	-85.3	151.8	168.3	-82.2	-166.2	170.1	-169.2	0	110.6
1120	A	29.5	Very low	29.2	Very low	93 Å²	93	157 Å²	157	77%	0.769	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-66.8	161.6	-172.9	0	0	0	0	0	113.8
1121	A	26.1	Very low	30	Very low	108 Å²	108	151.6 Å²	151.6	89%	0.893	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-63.4	142.8	171.9	0	0	0	0	0	111.5
1122	S	30.7	Very low	30.5	Very low	118 Å²	118	148.5 Å²	148.5	83%	0.825	82%	0.821	S	S	*	*			trans	-117.1	148	173.4	-66	0	0	0	0	109.5
1123	Q	28.4	Very low	31.3	Very low	187 Å²	187	143.3 Å²	143.3	87%	0.874	81%	0.805	S	S	*	*			trans	-57.3	139.2	-161	-69	156.9	-66.7	0	0	115.3	V1125	Q1123-V1125 PolarHBondContact O-N 3.25Å
1124	E	25.3	Very low	32.1	Very low	197 Å²	197	137.5 Å²	137.5	92%	0.921	79%	0.791	S	S	*	*			trans	-71	110.9	169.4	-172.3	167.5	-138.1	0	0	109.6
1125	V	32.5	Very low	33.1	Very low	128 Å²	128	136.1 Å²	136.1	78%	0.776	78%	0.775	S	S	*	*			trans	-90.6	107.2	179.2	179	0	0	0	0	109.2	Q1123 R1127	Q1123-V1125 PolarHBondContact O-N 3.25Å; V1125-R1127 PolarHBondContact O-N 2.88Å
1126	A	29.4	Very low	34.3	Very low	92 Å²	92	137.2 Å²	137.2	76%	0.76	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-57.5	122.8	178.7	0	0	0	0	0	111.6
1127	R	29.5	Very low	35.5	Very low	231 Å²	231	129.3 Å²	129.3	87%	0.872	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-88.4	135.2	166.8	-69.9	-175.6	174.3	-170.5	-2.3	109	V1125	V1125-R1127 PolarHBondContact O-N 2.88Å
1128	P	33.6	Very low	37.1	Very low	121 Å²	121	123.9 Å²	123.9	79%	0.786	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-65.8	143.2	178.1	-20	32.3	0	0	0	112.3	D1130	P1128-D1130 PolarHBondContact O-N 2.97Å; P1128-D1130 VanDerWaalsContact O-N 3.1Å
1129	N	33.9	Very low	38.7	Very low	155 Å²	155	122.2 Å²	122.2	83%	0.829	72%	0.718	S	S	*	*			trans	-72.8	95.7	165.6	-83.7	-14.9	0	0	0	109.2	S1131	N1129-S1131 PolarHBondContact O-N 2.89Å
1130	D	36.3	Very low	40.6	Very low	110 Å²	110	114.2 Å²	114.2	59%	0.588	70%	0.695	S	S	*	*			trans	-79	44.9	176.8	-147.1	13.5	0	0	0	111.4	P1128 G1132 K1133	P1128-D1130 PolarHBondContact O-N 2.97Å; P1128-D1130 VanDerWaalsContact O-N 3.1Å; D1130-G1132 PolarHBondContact O-N 2.88Å; D1130-G1132 VanDerWaalsContact O-N 3.09Å; D1130-K1133 IonicContact OD1-NZ 2.66Å; D1130-K1133 IonicContact OD2-NZ 2.92Å; D1130-K1133 PolarHBondContact OD2-NZ 2.97Å
1131	S	39.2	Very low	43.1	Very low	101 Å²	101	111.3 Å²	111.3	71%	0.706	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.4	4.8	-175.5	63.3	0	0	0	0	114.2	N1129	N1129-S1131 PolarHBondContact O-N 2.89Å
1132	G	39	Very low	45.8	Very low	61 Å²	61	111.9 Å²	111.9	63%	0.629	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.1	1.8	-175.5	0	0	0	0	0	115.9	D1130	D1130-G1132 PolarHBondContact O-N 2.88Å; D1130-G1132 VanDerWaalsContact O-N 3.09Å
1133	K	41.1	Very low	48.3	Very low	142 Å²	142	110.5 Å²	110.5	62%	0.617	65%	0.647	S	S	*	*	S	Bend	trans	-114.3	-7.5	-174.9	-71.1	175.3	-172.7	144.7	0	115.7	D1130 S1135	D1130-K1133 IonicContact OD1-NZ 2.66Å; D1130-K1133 IonicContact OD2-NZ 2.92Å; D1130-K1133 PolarHBondContact OD2-NZ 2.97Å; K1133-S1135 VanDerWaalsContact C-N 3.34Å; K1133-S1135 PolarHBondContact O-N 2.89Å
1134	L	44.2	Very low	50.6	Low	112 Å²	112	107.4 Å²	107.4	59%	0.586	64%	0.636	S	S	*	*	H	α-helix	trans	-75.8	-18.3	-176.8	-80.1	161.7	0	0	0	114	A1154	L1134-A1154 HydrophobicContact CD2-CB 4.2Å
1135	S	50.8	Low	53.3	Low	74 Å²	74	101.3 Å²	101.3	52%	0.517	62%	0.619	S	S	.	*	H	α-helix	trans	-67.4	-48.1	176.6	46.1	0	0	0	0	112.8	K1133 G1137 I1138 A1139	K1133-S1135 VanDerWaalsContact C-N 3.34Å; K1133-S1135 PolarHBondContact O-N 2.89Å; S1135-G1137 PolarHBondContact O-N 3.28Å; S1135-I1138 PolarHBondContact O-N 2.84Å; S1135-A1139 PolarHBondContact O-N 2.92Å
1136	D	52.4	Low	56	Low	125 Å²	125	95.8 Å²	95.8	67%	0.668	59%	0.585	S	S	*	*	H	α-helix	trans	-79	-28.8	-161.4	-64.8	17.4	0	0	0	111.9	I1138	D1136-I1138 VanDerWaalsContact C-N 3.32Å; D1136-I1138 PolarHBondContact O-N 3.3Å
1137	G	54.9	Low	58.9	Low	43 Å²	43	94 Å²	94	44%	0.443	56%	0.563	S	S	.	*	H	α-helix	trans	-64.9	-33.2	175.8	0	0	0	0	0	113.6	S1135 R1150	S1135-G1137 PolarHBondContact O-N 3.28Å; G1137-R1150 WeakPolarHBondContact O-CD 3.33Å; G1137-R1150 PolarHBondContact O-NH1 2.76Å
1138	I	61	Low	61.4	Low	66 Å²	66	88 Å²	88	34%	0.338	55%	0.547	S	S	.	.	H	α-helix	trans	-84.6	-36.7	-176.4	-56.3	177.2	0	0	0	111.2	S1135 D1136 G1140 A1141 L1147 L1151	S1135-I1138 PolarHBondContact O-N 2.84Å; D1136-I1138 VanDerWaalsContact C-N 3.32Å; D1136-I1138 PolarHBondContact O-N 3.3Å; I1138-G1140 PolarHBondContact O-N 2.67Å; I1138-G1140 VanDerWaalsContact O-N 3.09Å; I1138-A1141 PolarHBondContact O-N 2.85Å; I1138-L1147 HydrophobicContact CG2-CD1 3.85Å; I1138-L1151 HydrophobicContact CD1-CD2 4.29Å
1139	A	64.6	Low	63.8	Low	93 Å²	93	88.8 Å²	88.8	77%	0.769	53%	0.534	S	S	*	.	H	α-helix	trans	-61.6	-20.6	-174.9	0	0	0	0	0	114.8	S1135	S1135-A1139 PolarHBondContact O-N 2.92Å
1140	G	71.1	Confident	66.4	Low	41 Å²	41	84.5 Å²	84.5	42%	0.423	51%	0.507	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97	17.5	-178.5	0	0	0	0	0	116.1	I1138 R1150	I1138-G1140 PolarHBondContact O-N 2.67Å; I1138-G1140 VanDerWaalsContact O-N 3.09Å; G1140-R1150 VanDerWaalsContact O-CZ 3.3Å; G1140-R1150 PolarHBondContact O-NH1 3.17Å; G1140-R1150 PolarHBondContact O-NH2 3.13Å
1141	A	81.7	Confident	68.5	Low	33 Å²	33	83.7 Å²	83.7	27%	0.273	50%	0.502	S	S	.	.			trans	-70.7	127	-179.2	0	0	0	0	0	112.4	I1138 D1146 L1147	I1138-A1141 PolarHBondContact O-N 2.85Å; A1141-D1146 WeakPolarHBondContact CA-OD2 3.28Å; A1141-L1147 HydrophobicContact CB-CB 3.93Å; A1141-L1147 HydrophobicContact CB-CD1 3.98Å
1142	T	81.8	Confident	70.3	Confident	119 Å²	119	87.6 Å²	87.6	73%	0.73	51%	0.506	S	S	*	.			trans	-83.3	-26.2	-176.3	50.7	0	0	0	0	114.2	D1146	T1142-D1146 PolarHBondContact N-OD2 3.4Å; T1142-D1146 VanDerWaalsContact N-OD2 3.12Å
1143	D	83.9	Confident	72	Confident	89 Å²	89	91.3 Å²	91.3	48%	0.476	51%	0.507	S	S	.	.	S	Bend	trans	-156	-179.7	-179.4	63.2	71.2	0	0	0	111.1	A1145 D1146 L1147	D1143-A1145 WeakPolarHBondContact OD1-CA 3.46Å; D1143-A1145 WeakPolarHBondContact OD1-CB 3.38Å; D1143-A1145 PolarHBondContact OD1-N 2.73Å; D1143-D1146 PolarHBondContact O-N 3.33Å; D1143-D1146 PolarHBondContact OD1-N 2.87Å; D1143-L1147 WeakPolarHBondContact O-CB 3.28Å; D1143-L1147 PolarHBondContact O-N 3.32Å
1144	L	76.2	Confident	73.4	Confident	122 Å²	122	89.3 Å²	89.3	64%	0.639	52%	0.517	S	S	*	.	H	α-helix	trans	-68.8	-31.4	-177.1	-177.3	60.8	0	0	0	113.5	L1147 L1148	L1144-L1147 HydrophobicContact CD1-CD2 4.4Å; L1144-L1148 HydrophobicContact CD1-CD1 4.34Å; L1144-L1148 HydrophobicContact CD1-CG 4.37Å; L1144-L1148 HydrophobicContact CG-CD1 4.15Å; L1144-L1148 WeakPolarHBondContact O-CB 3.35Å; L1144-L1148 VanDerWaalsContact O-CG 3.23Å; L1144-L1148 WeakPolarHBondContact O-CG 3.48Å; L1144-L1148 PolarHBondContact O-N 3.02Å
1145	A	82.2	Confident	74.8	Confident	69 Å²	69	88.2 Å²	88.2	57%	0.57	51%	0.514	S	S	*	.	H	α-helix	trans	-75.2	-39.1	177.5	0	0	0	0	0	110.9	D1143 L1148 R1149	D1143-A1145 WeakPolarHBondContact OD1-CA 3.46Å; D1143-A1145 WeakPolarHBondContact OD1-CB 3.38Å; D1143-A1145 PolarHBondContact OD1-N 2.73Å; A1145-L1148 PolarHBondContact O-N 3.3Å; A1145-R1149 WeakPolarHBondContact O-CB 3.5Å; A1145-R1149 PolarHBondContact O-N 3Å
1146	D	89.2	Confident	76.1	Confident	12 Å²	12	88.9 Å²	88.9	6%	0.064	51%	0.514	C	S	.	.	H	α-helix	trans	-64.5	-40.8	171.8	-172.5	38.8	0	0	0	111.9	A1141 T1142 D1143 R1149 R1150	A1141-D1146 WeakPolarHBondContact CA-OD2 3.28Å; T1142-D1146 PolarHBondContact N-OD2 3.4Å; T1142-D1146 VanDerWaalsContact N-OD2 3.12Å; D1143-D1146 PolarHBondContact O-N 3.33Å; D1143-D1146 PolarHBondContact OD1-N 2.87Å; D1146-R1149 PolarHBondContact O-N 3.21Å; D1146-R1149 IonicContact OD1-CZ 3.14Å; D1146-R1149 IonicContact OD1-NE 3.93Å; D1146-R1149 IonicContact OD1-NH2 2.73Å; D1146-R1149 PolarHBondContact OD1-NH2 2.92Å; D1146-R1150 VanDerWaalsContact CG-NE 3.26Å; D1146-R1150 WeakPolarHBondContact O-CD 3.43Å; D1146-R1150 VanDerWaalsContact O-CG 3.26Å; D1146-R1150 WeakPolarHBondContact O-CG 3.42Å; D1146-R1150 PolarHBondContact O-N 2.98Å; D1146-R1150 IonicContact OD1-CZ 2.78Å; D1146-R1150 IonicContact OD1-NE 2.7Å; D1146-R1150 PolarHBondContact OD1-NE 2.99Å; D1146-R1150 VanDerWaalsContact OD1-NE 3.08Å; D1146-R1150 IonicContact OD1-NH2 2.75Å; D1146-R1150 IonicContact OD2-CZ 3.81Å; D1146-R1150 IonicContact OD2-NE 3.68Å; D1146-R1150 PolarHBondContact OD2-NE 3.16Å; D1146-R1150 IonicContact OD2-NH2 2.73Å; D1146-R1150 PolarHBondContact OD2-NH2 2.63Å
1147	L	89.5	Confident	77.4	Confident	56 Å²	56	86.9 Å²	86.9	29%	0.293	51%	0.505	S	S	.	.	H	α-helix	trans	-60.7	-48.4	172.7	-177.4	67.1	0	0	0	112	I1138 A1141 D1143 L1144 R1149 R1150 L1151	I1138-L1147 HydrophobicContact CG2-CD1 3.85Å; A1141-L1147 HydrophobicContact CB-CB 3.93Å; A1141-L1147 HydrophobicContact CB-CD1 3.98Å; D1143-L1147 WeakPolarHBondContact O-CB 3.28Å; D1143-L1147 PolarHBondContact O-N 3.32Å; L1144-L1147 HydrophobicContact CD1-CD2 4.4Å; L1147-R1149 VanDerWaalsContact C-N 3.3Å; L1147-R1149 PolarHBondContact O-N 2.94Å; L1147-R1150 PolarHBondContact O-N 3.13Å; L1147-L1151 HydrophobicContact CD1-CD1 4.31Å; L1147-L1151 HydrophobicContact CG-CD1 4.01Å; L1147-L1151 WeakPolarHBondContact O-CB 3.15Å; L1147-L1151 WeakPolarHBondContact O-CG 3.3Å; L1147-L1151 PolarHBondContact O-N 3.43Å
1148	L	83	Confident	78.8	Confident	104 Å²	104	89.5 Å²	89.5	55%	0.545	51%	0.509	S	S	.	.	H	α-helix	trans	-66.2	-30.7	178.7	-75	169.9	0	0	0	112.8	L1144 A1145 K1152	L1144-L1148 HydrophobicContact CD1-CD1 4.34Å; L1144-L1148 HydrophobicContact CD1-CG 4.37Å; L1144-L1148 HydrophobicContact CG-CD1 4.15Å; L1144-L1148 WeakPolarHBondContact O-CB 3.35Å; L1144-L1148 VanDerWaalsContact O-CG 3.23Å; L1144-L1148 WeakPolarHBondContact O-CG 3.48Å; L1144-L1148 PolarHBondContact O-N 3.02Å; A1145-L1148 PolarHBondContact O-N 3.3Å; L1148-K1152 WeakPolarHBondContact O-CB 3.47Å; L1148-K1152 PolarHBondContact O-N 2.96Å
1149	R	84.5	Confident	79.9	Confident	137 Å²	137	91 Å²	91	52%	0.517	52%	0.519	S	S	.	.	H	α-helix	trans	-67	-50.4	171.2	177.4	176.3	65.1	132.7	-4.2	111.1	A1145 D1146 L1147 L1151 K1152 E1153	A1145-R1149 WeakPolarHBondContact O-CB 3.5Å; A1145-R1149 PolarHBondContact O-N 3Å; D1146-R1149 PolarHBondContact O-N 3.21Å; D1146-R1149 IonicContact OD1-CZ 3.14Å; D1146-R1149 IonicContact OD1-NE 3.93Å; D1146-R1149 IonicContact OD1-NH2 2.73Å; D1146-R1149 PolarHBondContact OD1-NH2 2.92Å; L1147-R1149 VanDerWaalsContact C-N 3.3Å; L1147-R1149 PolarHBondContact O-N 2.94Å; R1149-L1151 VanDerWaalsContact C-N 3.31Å; R1149-L1151 PolarHBondContact O-N 2.95Å; R1149-K1152 CarbonylContact O-C 3.57Å; R1149-K1152 WeakPolarHBondContact O-CA 3.32Å; R1149-K1152 WeakPolarHBondContact O-CB 3.44Å; R1149-K1152 PolarHBondContact O-N 2.82Å; R1149-E1153 WeakPolarHBondContact CD-OE1 3.48Å; R1149-E1153 HydrophobicContact CG-CG 4.34Å; R1149-E1153 WeakPolarHBondContact CG-OE1 3.35Å; R1149-E1153 IonicContact NH1-OE1 3.2Å; R1149-E1153 PolarHBondContact O-N 3.1Å
1150	R	87.8	Confident	80.9	Confident	66 Å²	66	90.9 Å²	90.9	25%	0.249	50%	0.503	C	S	.	.	H	α-helix	trans	-61.9	-37.7	179.1	-68.8	164.8	-172.7	-130.4	16.6	112.3	G1137 G1140 D1146 L1147 K1152 E1153 A1154	G1137-R1150 WeakPolarHBondContact O-CD 3.33Å; G1137-R1150 PolarHBondContact O-NH1 2.76Å; G1140-R1150 VanDerWaalsContact O-CZ 3.3Å; G1140-R1150 PolarHBondContact O-NH1 3.17Å; G1140-R1150 PolarHBondContact O-NH2 3.13Å; D1146-R1150 VanDerWaalsContact CG-NE 3.26Å; D1146-R1150 WeakPolarHBondContact O-CD 3.43Å; D1146-R1150 VanDerWaalsContact O-CG 3.26Å; D1146-R1150 WeakPolarHBondContact O-CG 3.42Å; D1146-R1150 PolarHBondContact O-N 2.98Å; D1146-R1150 IonicContact OD1-CZ 2.78Å; D1146-R1150 IonicContact OD1-NE 2.7Å; D1146-R1150 PolarHBondContact OD1-NE 2.99Å; D1146-R1150 VanDerWaalsContact OD1-NE 3.08Å; D1146-R1150 IonicContact OD1-NH2 2.75Å; D1146-R1150 IonicContact OD2-CZ 3.81Å; D1146-R1150 IonicContact OD2-NE 3.68Å; D1146-R1150 PolarHBondContact OD2-NE 3.16Å; D1146-R1150 IonicContact OD2-NH2 2.73Å; D1146-R1150 PolarHBondContact OD2-NH2 2.63Å; L1147-R1150 PolarHBondContact O-N 3.13Å; R1150-K1152 PolarHBondContact O-N 2.75Å; R1150-E1153 PolarHBondContact O-N 2.66Å; R1150-A1154 WeakPolarHBondContact O-CB 3.39Å; R1150-A1154 PolarHBondContact O-N 2.88Å
1151	L	81	Confident	81.6	Confident	93 Å²	93	94.4 Å²	94.4	49%	0.487	51%	0.508	S	S	.	.	H	α-helix	trans	-69.9	-2.2	171.9	-73.6	171.6	0	0	0	114.7	I1138 L1147 R1149	I1138-L1151 HydrophobicContact CD1-CD2 4.29Å; L1147-L1151 HydrophobicContact CD1-CD1 4.31Å; L1147-L1151 HydrophobicContact CG-CD1 4.01Å; L1147-L1151 WeakPolarHBondContact O-CB 3.15Å; L1147-L1151 WeakPolarHBondContact O-CG 3.3Å; L1147-L1151 PolarHBondContact O-N 3.43Å; R1149-L1151 VanDerWaalsContact C-N 3.31Å; R1149-L1151 PolarHBondContact O-N 2.95Å
1152	K	76.4	Confident	81.6	Confident	183 Å²	183	99.2 Å²	99.2	80%	0.796	53%	0.527	S	S	*	.	H	α-helix	trans	-118.3	-14.5	176.7	-169.2	177.9	179.4	-177.5	0	112.6	L1148 R1149 R1150	L1148-K1152 WeakPolarHBondContact O-CB 3.47Å; L1148-K1152 PolarHBondContact O-N 2.96Å; R1149-K1152 CarbonylContact O-C 3.57Å; R1149-K1152 WeakPolarHBondContact O-CA 3.32Å; R1149-K1152 WeakPolarHBondContact O-CB 3.44Å; R1149-K1152 PolarHBondContact O-N 2.82Å; R1150-K1152 PolarHBondContact O-N 2.75Å
1153	E	74.4	Confident	81.6	Confident	138 Å²	138	97.5 Å²	97.5	65%	0.645	51%	0.51	S	S	*	.	H	α-helix	trans	-89.9	-18.5	169	-70.3	172.2	-177.2	0	0	111.9	R1149 R1150	R1149-E1153 WeakPolarHBondContact CD-OE1 3.48Å; R1149-E1153 HydrophobicContact CG-CG 4.34Å; R1149-E1153 WeakPolarHBondContact CG-OE1 3.35Å; R1149-E1153 IonicContact NH1-OE1 3.2Å; R1149-E1153 PolarHBondContact O-N 3.1Å; R1150-E1153 PolarHBondContact O-N 2.66Å
1154	A	70.6	Confident	81.3	Confident	101 Å²	101	98.3 Å²	98.3	84%	0.835	51%	0.513	S	S	*	.			trans	-94.7	0	170.7	0	0	0	0	0	112.6	L1134 R1150	L1134-A1154 HydrophobicContact CD2-CB 4.2Å; R1150-A1154 WeakPolarHBondContact O-CB 3.39Å; R1150-A1154 PolarHBondContact O-N 2.88Å

Retrieved 1,154 of 1,154 residues in 755.6 ms (Link to these results)

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