A0A077Z877_TRITR Loading...

RNA helicase

AlphaFold DB , UniProt , Accession A0A077Z877, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,096 aa.

						>A0A077Z877_TRITR|A0A077Z877
MEEEPVYVLPHDTANAFVLPPRKKKAKKEGNDKIKESKQKAAISKKKQKKLKKLLEKRKKKAECADIFERLKRCQIEPSEMLLMTSVAKMQQKDPKRLPIVPEAPVCKSIAGSRKGMLSREQAFERSTPYFETDSSSGSDEEDADDKVPEISNGNNPSLIQSDPLQSASCSNEPAKEKLFESTIPKPETACTTAVDSKVISCPAVHVPVFRSDEIEKGRLKLPVVAEEQAIIEAIKENQVVIVCGETGSGKSTQVPQFLYEAGFTTAGKMIGVTEPRRVAAINISHRVADEMNLSRDVVSYQIRFEGNVTEKTKIKFMTDGVLLKEIQKDFLLSSYSAILIDEAHERSMYSDVLIGLLSRIILIRERRQDKLHLVIMSATLRVEDFLMPKLFKQTPTVIKVDSRQYPVTAYFSRHTMHDYLQAAYRKVCQVHRLLPRGSILVFVSGQKEVHTLLSWLKKRFPLNAKASEPKPDKKSLGKRKKKLVNLDDYKEDSLHIFEEVDLNDQDAPDLDIFDVEELECPDIPTASLEPDEPLFCLPLYSLMPSGKQARVFQEPPAGYRCCVIATNVAETSVTIPNVRYVIDTGKEKVRLYDPVTGISKFVVQWISKASASQRAGRAGRLGPGHCYRLYSSAVYNDFEKYSRPEILTEPLDDLVLQMKAMCILKVCNFPFPTALDVDSLRCAEERLVKLGLLENALDSNGRQVARITKLGRTVALLPLAPRYGKMVALACQQGLLAYAICLVSALSVREPLLNPSTIECKDIEKKKEKIAECLRSRRALAGQGHSLLLGDLMVLLKASLAAEQELTVSFCEKHGFRYKAMVEICKMRRQLTKIVNALCTEADLAIGTQLKPPTDEQAELLRQLVLTGLCENVARRADDCFAQTGCKPSRLAYRSAAVEDPLWIHPTSVLFRAQPEWLVYQEIVDSNGKKCMLNVMAIESEWLVALARGCCSMGEPLKEPAPFYSETKDQIVCHVDCTYGLAAWPLPRQEVAHPVDIMYYRYFASEFLEGRVISKLAKYRSSLITPPSILFKPWARLQSKTGSLLGVLVSNEVTSKEALIRFWKEKPNFLCNEYLEWVAQSKHNDVLFDWPPLEK
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.9	Very low	36.4	Very low	230 Å²	230	161.7 Å²	161.7	100%	1.133	82%	0.819	S	S	*	*				0	73.8	0	-57	-159.6	-58.7	0	0	105.1
2	E	33.9	Very low	36.4	Very low	173 Å²	173	162.3 Å²	162.3	81%	0.808	83%	0.826	S	S	*	*				109.3	128.2	85.8	-91.9	173	-158.6	0	0	105.1
3	E	36	Very low	36.2	Very low	181 Å²	181	158.5 Å²	158.5	85%	0.846	82%	0.816	S	S	*	*			cis	-167.3	132	-9.1	-114.9	175.6	-173.1	0	0	104.3
4	E	34.6	Very low	36.3	Very low	190 Å²	190	154.1 Å²	154.1	89%	0.888	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-92.3	136.4	170	-79.4	-171.8	154.6	0	0	109.7
5	P	48.2	Very low	36.4	Very low	111 Å²	111	154.5 Å²	154.5	72%	0.721	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-88.8	123.2	171	32.3	-28.3	0	0	0	111.5
6	V	31.8	Very low	36.5	Very low	118 Å²	118	150.8 Å²	150.8	72%	0.715	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-59.8	134	168.2	177.3	0	0	0	0	111.1	V8	V6-V8 HydrophobicContact CG1-CG2 3.65Å
7	Y	35.9	Very low	36.4	Very low	229 Å²	229	154 Å²	154	90%	0.898	82%	0.82	S	S	*	*			trans	-118.3	116	154.8	-93	-84.9	0	0	0	110.2
8	V	34	Very low	36.5	Very low	116 Å²	116	152.8 Å²	152.8	70%	0.703	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-80.2	130.8	-176.8	179.5	0	0	0	0	110	V6	V6-V8 HydrophobicContact CG1-CG2 3.65Å
9	L	32.2	Very low	36.3	Very low	162 Å²	162	153.3 Å²	153.3	85%	0.848	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-95.8	130.5	161.2	-80.2	165.7	0	0	0	108.9
10	P	42.5	Very low	36.6	Very low	108 Å²	108	151.4 Å²	151.4	70%	0.701	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-84.1	118.6	168.5	-1.8	20.4	0	0	0	110.7
11	H	36.1	Very low	36.7	Very low	161 Å²	161	150.4 Å²	150.4	75%	0.745	82%	0.819	S	S	*	*			trans	25.6	118.1	137.5	-63.8	-82.7	0	0	0	118.8
12	D	36.6	Very low	36.8	Very low	169 Å²	169	151 Å²	151	90%	0.904	81%	0.808	S	S	*	*				-151.3	135.1	115.9	-118.2	-20.8	0	0	0	113.3
13	T	34.5	Very low	37	Very low	113 Å²	113	152.3 Å²	152.3	69%	0.693	81%	0.811	S	S	*	*			trans	-98.7	135.4	-158.9	45.6	0	0	0	0	112.7
14	A	37	Very low	37	Very low	96 Å²	96	153.2 Å²	153.2	79%	0.793	81%	0.812	S	S	*	*			trans	-163.4	89.1	149.9	0	0	0	0	0	113
15	N	37.7	Very low	37.1	Very low	161 Å²	161	153.8 Å²	153.8	86%	0.861	81%	0.812	S	S	*	*			trans	48	111.4	143	-66.1	-17.9	0	0	0	122.1
16	A	37.6	Very low	36.6	Very low	94 Å²	94	153.1 Å²	153.1	78%	0.777	82%	0.816	S	S	*	*			trans	-83.2	145.7	164.1	0	0	0	0	0	112.7
17	F	35.4	Very low	36.8	Very low	206 Å²	206	156.7 Å²	156.7	90%	0.904	82%	0.822	S	S	*	*			trans	-112.5	102.8	157.8	-89.9	-83.8	0	0	0	109.1
18	V	37.5	Very low	36.8	Very low	133 Å²	133	154.6 Å²	154.6	81%	0.806	82%	0.817	S	S	*	*			trans	-126.6	116	163	177.7	0	0	0	0	107.3
19	L	33.3	Very low	37	Very low	161 Å²	161	157.6 Å²	157.6	84%	0.843	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-83.1	133.6	172.2	-72	163.6	0	0	0	110
20	P	42.4	Very low	37.2	Very low	116 Å²	116	153.6 Å²	153.6	75%	0.753	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-93.5	163.1	167.9	34.2	-28.5	0	0	0	112.6
21	P	38.3	Very low	36.9	Very low	131 Å²	131	155.4 Å²	155.4	85%	0.851	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-94.8	159.3	-162.6	36.2	-33.1	0	0	0	116.3
22	R	37.5	Very low	37	Very low	241 Å²	241	155.7 Å²	155.7	91%	0.909	83%	0.832	S	S	*	*			trans	-39.6	147.8	177.6	-66.7	170.1	161.8	-178.3	-6.3	118.5
23	K	37.5	Very low	37	Very low	201 Å²	201	156.6 Å²	156.6	87%	0.874	83%	0.828	S	S	*	*				-169.7	113.4	125.9	-104	169.4	-172.7	179.9	0	115
24	K	36.5	Very low	37.1	Very low	200 Å²	200	159.6 Å²	159.6	87%	0.87	84%	0.838	S	S	*	*			trans	36.3	128	139.1	-62.8	-178	175.3	-177.7	0	122.8
25	K	37	Very low	37.1	Very low	202 Å²	202	163.4 Å²	163.4	88%	0.878	84%	0.837	S	S	*	*				172.6	116.7	109.9	-91.4	173.5	-179.5	-178.2	0	109.5
26	A	37.4	Very low	37	Very low	97 Å²	97	164 Å²	164	80%	0.802	83%	0.834	S	S	*	*				67.3	135.8	108	0	0	0	0	0	114.2
27	K	36	Very low	36.8	Very low	193 Å²	193	164.8 Å²	164.8	84%	0.839	83%	0.834	S	S	*	*			cis	-175.5	169.9	23.6	-139.9	178.3	-175.9	-175.6	0	109.4
28	K	37.1	Very low	36.9	Very low	186 Å²	186	165.2 Å²	165.2	81%	0.809	84%	0.836	S	S	*	*			trans	85	139.3	167.4	-67.3	-176.2	173.1	-176.4	0	117.6
29	E	38	Very low	36.9	Very low	178 Å²	178	168.2 Å²	168.2	83%	0.832	84%	0.841	S	S	*	*			cis	177	140.5	-25.4	-119.4	166.7	-164.4	0	0	104.3
30	G	36.5	Very low	37.1	Very low	78 Å²	78	170.4 Å²	170.4	80%	0.804	84%	0.844	S	S	*	*			trans	164.4	92.1	177.4	0	0	0	0	0	112.3
31	N	34.5	Very low	37.2	Very low	146 Å²	146	169.7 Å²	169.7	78%	0.781	85%	0.847	S	S	*	*			trans	-61.3	143.6	176.8	-94.3	-31.3	0	0	0	112.6
32	D	39.1	Very low	38.1	Very low	168 Å²	168	168.1 Å²	168.1	90%	0.898	85%	0.846	S	S	*	*				-168	136.3	111.8	-93	-23.9	0	0	0	112.3
33	K	35.8	Very low	39.5	Very low	187 Å²	187	161.2 Å²	161.2	81%	0.813	83%	0.826	S	S	*	*			trans	-95.4	125.2	-173.6	-68.5	169.5	175.6	171.1	0	110.2
34	I	38.1	Very low	41.5	Very low	176 Å²	176	155.1 Å²	155.1	90%	0.903	81%	0.808	S	S	*	*			trans	-146.4	138.8	143.9	-61.4	-171.6	0	0	0	109.6
35	K	36.2	Very low	43.5	Very low	177 Å²	177	154.2 Å²	154.2	77%	0.77	80%	0.804	S	S	*	*			trans	-77.1	166.3	-171.4	-70.7	171.1	169.5	175.8	0	114
36	E	35.5	Very low	45.4	Very low	172 Å²	172	152.9 Å²	152.9	80%	0.804	80%	0.799	S	S	*	*			trans	110.8	109.9	144.2	-84.2	162	-153.2	0	0	121.1
37	S	32.4	Very low	47.3	Very low	112 Å²	112	155.4 Å²	155.4	78%	0.783	79%	0.791	S	S	*	*			trans	65.6	95.2	147.5	69.7	0	0	0	0	120.1
38	K	37.9	Very low	49.3	Very low	215 Å²	215	151.6 Å²	151.6	94%	0.935	78%	0.777	S	S	*	*			trans	-133.9	131.8	152.5	-74.9	-171.9	178.8	175.2	0	111.4
39	Q	37.5	Very low	51.5	Low	195 Å²	195	149.1 Å²	149.1	91%	0.911	77%	0.766	S	S	*	*			trans	-60.1	141.7	-165.4	-66.2	158.4	-18.5	0	0	113.8	A41	Q39-A41 PolarHBondContact O-N 2.74Å
40	K	38.9	Very low	53.6	Low	208 Å²	208	148 Å²	148	90%	0.904	76%	0.758	S	S	*	*			trans	-63.2	113.1	169.2	-71.8	177.2	178.9	174.2	0	109	A42	K40-A42 PolarHBondContact O-N 3.4Å
41	A	44.1	Very low	55.7	Low	100 Å²	100	149 Å²	149	83%	0.826	75%	0.745	S	S	*	*			trans	-61	111.6	173.5	0	0	0	0	0	110.2	Q39 I43	Q39-A41 PolarHBondContact O-N 2.74Å; A41-I43 PolarHBondContact O-N 3.05Å
42	A	55.6	Low	58.1	Low	99 Å²	99	149.6 Å²	149.6	82%	0.818	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-61.7	123.5	175.9	0	0	0	0	0	110.1	K40 S44	K40-A42 PolarHBondContact O-N 3.4Å; A42-S44 PolarHBondContact O-N 3.22Å
43	I	68.5	Low	60.3	Low	96 Å²	96	148.5 Å²	148.5	49%	0.492	73%	0.728	S	S	.	*	P	Polyproline II helix	trans	-61.9	119.4	171.7	-71.4	173.6	0	0	0	108.1	A41 K45 K47 Q48	A41-I43 PolarHBondContact O-N 3.05Å; I43-K45 PolarHBondContact O-N 3.01Å; I43-K47 HydrophobicContact CG2-CB 3.49Å; I43-K47 VanDerWaalsContact CG2-CB 3.49Å; I43-Q48 HydrophobicContact CB-CG 4.45Å; I43-Q48 HydrophobicContact CG2-CB 4.41Å; I43-Q48 HydrophobicContact CG2-CG 3.82Å
44	S	78.6	Confident	62.5	Low	72 Å²	72	144.7 Å²	144.7	50%	0.503	72%	0.716	S	S	.	*	P	Polyproline II helix	trans	-46.7	138.3	172.9	164.5	0	0	0	0	111.6	A42 K46 K47 Q48	A42-S44 PolarHBondContact O-N 3.22Å; S44-K46 PolarHBondContact O-N 3.2Å; S44-K46 PolarHBondContact OG-N 3.27Å; S44-K47 WeakPolarHBondContact O-CA 3.46Å; S44-K47 WeakPolarHBondContact O-CB 3.34Å; S44-K47 PolarHBondContact O-N 3Å; S44-Q48 PolarHBondContact O-N 3.12Å
45	K	78	Confident	64.7	Low	181 Å²	181	141.2 Å²	141.2	79%	0.787	70%	0.698	S	S	*	*	H	α-helix	trans	-47.5	-32.7	174.1	-70	-177	178.7	177.5	0	112.2	I43 Q48 K49	I43-K45 PolarHBondContact O-N 3.01Å; K45-Q48 PolarHBondContact O-N 3.49Å; K45-K49 PolarHBondContact O-N 2.81Å
46	K	77.8	Confident	67	Low	174 Å²	174	137.5 Å²	137.5	76%	0.757	68%	0.684	S	S	*	*	H	α-helix	trans	-69.3	-41	176.9	-152	169.8	-171.9	169.6	0	112.3	S44 K50	S44-K46 PolarHBondContact O-N 3.2Å; S44-K46 PolarHBondContact OG-N 3.27Å; K46-K50 PolarHBondContact O-N 3.08Å
47	K	78.3	Confident	69.3	Low	150 Å²	150	136.7 Å²	136.7	65%	0.652	68%	0.678	S	S	*	*	H	α-helix	trans	-68.2	-39.3	172.1	-97.4	-175.9	174.7	176.2	0	111.5	I43 S44 K50 L51	I43-K47 HydrophobicContact CG2-CB 3.49Å; I43-K47 VanDerWaalsContact CG2-CB 3.49Å; S44-K47 WeakPolarHBondContact O-CA 3.46Å; S44-K47 WeakPolarHBondContact O-CB 3.34Å; S44-K47 PolarHBondContact O-N 3Å; K47-K50 PolarHBondContact O-N 3.35Å; K47-L51 WeakPolarHBondContact O-CB 3.4Å; K47-L51 PolarHBondContact O-N 2.89Å
48	Q	77.7	Confident	71.8	Confident	113 Å²	113	140.5 Å²	140.5	53%	0.528	68%	0.675	S	S	.	*	H	α-helix	trans	-61.8	-46.6	173.8	-95.4	178.2	0.3	0	0	112.2	I43 S44 K45 K50 L51 K52	I43-Q48 HydrophobicContact CB-CG 4.45Å; I43-Q48 HydrophobicContact CG2-CB 4.41Å; I43-Q48 HydrophobicContact CG2-CG 3.82Å; S44-Q48 PolarHBondContact O-N 3.12Å; K45-Q48 PolarHBondContact O-N 3.49Å; Q48-K50 PolarHBondContact O-N 3.3Å; Q48-L51 PolarHBondContact O-N 3.28Å; Q48-K52 WeakPolarHBondContact O-CB 3.41Å; Q48-K52 PolarHBondContact O-N 2.87Å
49	K	82.8	Confident	74.1	Confident	134 Å²	134	137 Å²	137	58%	0.583	66%	0.66	S	S	*	*	H	α-helix	trans	-59.5	-43.6	173.6	-93.5	-175.7	175.6	178.5	0	111.8	K45 K52 K53	K45-K49 PolarHBondContact O-N 2.81Å; K49-K52 PolarHBondContact O-N 3.04Å; K49-K53 PolarHBondContact O-N 2.98Å
50	K	82.3	Confident	76.4	Confident	154 Å²	154	133.6 Å²	133.6	67%	0.67	64%	0.642	S	S	*	*	H	α-helix	trans	-61.5	-43.8	175	-98.6	-174.1	175.2	-177.9	0	112.3	K46 K47 Q48 K53 L54	K46-K50 PolarHBondContact O-N 3.08Å; K47-K50 PolarHBondContact O-N 3.35Å; Q48-K50 PolarHBondContact O-N 3.3Å; K50-K53 PolarHBondContact O-N 2.97Å; K50-L54 PolarHBondContact O-N 2.91Å
51	L	80.5	Confident	78.6	Confident	100 Å²	100	131.6 Å²	131.6	52%	0.524	63%	0.633	S	S	.	*	H	α-helix	trans	-64.5	-41.6	178.2	-166.5	77.3	0	0	0	111.4	K47 Q48 L54 L55	K47-L51 WeakPolarHBondContact O-CB 3.4Å; K47-L51 PolarHBondContact O-N 2.89Å; Q48-L51 PolarHBondContact O-N 3.28Å; L51-L54 PolarHBondContact O-N 3.48Å; L51-L55 PolarHBondContact O-N 2.84Å
52	K	85.5	Confident	80.5	Confident	159 Å²	159	129.8 Å²	129.8	69%	0.691	62%	0.618	S	S	*	*	H	α-helix	trans	-63.3	-44.6	177.2	-152.1	177.7	-175.3	-176.1	0	111.5	Q48 K49 L54 L55 E56	Q48-K52 WeakPolarHBondContact O-CB 3.41Å; Q48-K52 PolarHBondContact O-N 2.87Å; K49-K52 PolarHBondContact O-N 3.04Å; K52-L54 PolarHBondContact O-N 3.5Å; K52-L55 PolarHBondContact O-N 2.94Å; K52-E56 WeakPolarHBondContact O-CB 3.31Å; K52-E56 PolarHBondContact O-N 2.96Å
53	K	84.4	Confident	81.9	Confident	144 Å²	144	130.4 Å²	130.4	63%	0.626	60%	0.604	S	S	*	*	H	α-helix	trans	-62.1	-38	173.5	-76.4	-171.4	175.7	-172.3	0	112.9	K49 K50 K57	K49-K53 PolarHBondContact O-N 2.98Å; K50-K53 PolarHBondContact O-N 2.97Å; K53-K57 PolarHBondContact O-N 3.49Å
54	L	82.7	Confident	82.4	Confident	108 Å²	108	129.1 Å²	129.1	57%	0.565	60%	0.603	S	S	*	*	H	α-helix	trans	-67.6	-41.6	176.4	-101.2	160.9	0	0	0	112.4	K50 L51 K52 K57 R58	K50-L54 PolarHBondContact O-N 2.91Å; L51-L54 PolarHBondContact O-N 3.48Å; K52-L54 PolarHBondContact O-N 3.5Å; L54-K57 PolarHBondContact O-N 2.66Å; L54-R58 PolarHBondContact O-N 3.15Å
55	L	82.9	Confident	82.6	Confident	102 Å²	102	128.4 Å²	128.4	53%	0.534	60%	0.601	S	S	.	*	H	α-helix	trans	-64.3	-41	174.8	-79	169.1	0	0	0	111.8	L51 K52 R58 K59	L51-L55 PolarHBondContact O-N 2.84Å; K52-L55 PolarHBondContact O-N 2.94Å; L55-R58 PolarHBondContact O-N 3.31Å; L55-K59 PolarHBondContact O-N 2.82Å
56	E	85.8	Confident	83	Confident	100 Å²	100	123 Å²	123	47%	0.467	58%	0.581	S	S	.	*	H	α-helix	trans	-65.6	-41.9	176.9	-157.6	-168.9	143.1	0	0	112	K52 R58 K59 K60	K52-E56 WeakPolarHBondContact O-CB 3.31Å; K52-E56 PolarHBondContact O-N 2.96Å; E56-R58 VanDerWaalsContact C-N 3.31Å; E56-R58 PolarHBondContact O-N 2.86Å; E56-K59 PolarHBondContact O-N 3.41Å; E56-K60 PolarHBondContact O-N 3.39Å; E56-K60 IonicContact OE1-NZ 3.79Å; E56-K60 PolarHBondContact OE1-NZ 3.28Å
57	K	83.6	Confident	83.1	Confident	155 Å²	155	119.3 Å²	119.3	67%	0.674	57%	0.569	S	S	*	*	H	α-helix	trans	-60.4	-38.5	171.7	-85.5	-170.9	174.3	-173.3	0	112.6	K53 L54 K61	K53-K57 PolarHBondContact O-N 3.49Å; L54-K57 PolarHBondContact O-N 2.66Å; K57-K61 WeakPolarHBondContact O-CG 3.33Å; K57-K61 PolarHBondContact O-N 3.03Å; K57-K61 VanDerWaalsContact O-N 3.07Å
58	R	84.1	Confident	83.1	Confident	191 Å²	191	119 Å²	119	72%	0.721	57%	0.568	S	S	*	*	H	α-helix	trans	-68.5	-40.9	176	-83.5	-172.2	169.2	176.6	-3.2	112.2	L54 L55 E56 K61 A62	L54-R58 PolarHBondContact O-N 3.15Å; L55-R58 PolarHBondContact O-N 3.31Å; E56-R58 VanDerWaalsContact C-N 3.31Å; E56-R58 PolarHBondContact O-N 2.86Å; R58-K61 PolarHBondContact O-N 3.1Å; R58-A62 PolarHBondContact O-N 3.28Å
59	K	87.4	Confident	83.3	Confident	143 Å²	143	118.5 Å²	118.5	62%	0.622	57%	0.565	S	S	*	*	H	α-helix	trans	-61.1	-49.7	174	-78.1	-169.6	173.2	-167.3	0	111.8	L55 E56 K61 A62 E63	L55-K59 PolarHBondContact O-N 2.82Å; E56-K59 PolarHBondContact O-N 3.41Å; K59-K61 VanDerWaalsContact C-N 3.29Å; K59-K61 PolarHBondContact O-N 3.36Å; K59-A62 PolarHBondContact O-N 3.16Å; K59-E63 WeakPolarHBondContact O-CG 3.4Å; K59-E63 PolarHBondContact O-N 2.64Å
60	K	85.7	Confident	83.3	Confident	122 Å²	122	119.4 Å²	119.4	53%	0.53	57%	0.565	S	S	.	*	H	α-helix	trans	-58.4	-38.5	176.5	-75.4	174.2	169.1	162.8	0	112.7	E56 C64	E56-K60 PolarHBondContact O-N 3.39Å; E56-K60 IonicContact OE1-NZ 3.79Å; E56-K60 PolarHBondContact OE1-NZ 3.28Å; K60-C64 VanDerWaalsContact O-CB 3.24Å; K60-C64 WeakPolarHBondContact O-CB 3.47Å; K60-C64 PolarHBondContact O-N 3.22Å
61	K	85	Confident	83	Confident	166 Å²	166	117 Å²	117	72%	0.722	56%	0.559	S	S	*	*	H	α-helix	trans	-67	-38.7	173.7	-80	-170	174.4	-165.1	0	113	K57 R58 K59 A65	K57-K61 WeakPolarHBondContact O-CG 3.33Å; K57-K61 PolarHBondContact O-N 3.03Å; K57-K61 VanDerWaalsContact O-N 3.07Å; R58-K61 PolarHBondContact O-N 3.1Å; K59-K61 VanDerWaalsContact C-N 3.29Å; K59-K61 PolarHBondContact O-N 3.36Å; K61-A65 WeakPolarHBondContact O-CB 3.19Å; K61-A65 PolarHBondContact O-N 2.86Å
62	A	84.2	Confident	82.9	Confident	62 Å²	62	119.6 Å²	119.6	51%	0.512	57%	0.566	S	S	.	*	H	α-helix	trans	-70	-41.7	177.3	0	0	0	0	0	111.9	R58 K59 A65 D66	R58-A62 PolarHBondContact O-N 3.28Å; K59-A62 PolarHBondContact O-N 3.16Å; A62-A65 PolarHBondContact O-N 3.21Å; A62-D66 PolarHBondContact O-N 3.02Å
63	E	84.3	Confident	82.6	Confident	113 Å²	113	120.9 Å²	120.9	53%	0.528	57%	0.567	S	S	.	*	H	α-helix	trans	-62.2	-44.1	173.5	-73.1	165.9	-173.8	0	0	111.1	K59 A65 D66 I67	K59-E63 WeakPolarHBondContact O-CG 3.4Å; K59-E63 PolarHBondContact O-N 2.64Å; E63-A65 VanDerWaalsContact C-N 3.32Å; E63-A65 PolarHBondContact O-N 3.43Å; E63-D66 PolarHBondContact O-N 3.22Å; E63-I67 WeakPolarHBondContact O-CB 3.41Å; E63-I67 WeakPolarHBondContact O-CD1 3.15Å; E63-I67 WeakPolarHBondContact O-CG1 3.44Å; E63-I67 PolarHBondContact O-N 3.1Å
64	C	79	Confident	82.2	Confident	68 Å²	68	118.8 Å²	118.8	46%	0.459	57%	0.569	S	S	.	*	H	α-helix	trans	-63.9	-36.9	176.1	-162.1	0	0	0	0	112.1	K60 F68	K60-C64 VanDerWaalsContact O-CB 3.24Å; K60-C64 WeakPolarHBondContact O-CB 3.47Å; K60-C64 PolarHBondContact O-N 3.22Å; C64-F68 WeakPolarHBondContact O-CB 3.09Å; C64-F68 PolarHBondContact O-N 3.27Å
65	A	83	Confident	81.2	Confident	58 Å²	58	120.6 Å²	120.6	48%	0.479	57%	0.574	S	S	.	*	H	α-helix	trans	-68.6	-42.2	174.7	0	0	0	0	0	112.6	K61 A62 E63 F68 E69	K61-A65 WeakPolarHBondContact O-CB 3.19Å; K61-A65 PolarHBondContact O-N 2.86Å; A62-A65 PolarHBondContact O-N 3.21Å; E63-A65 VanDerWaalsContact C-N 3.32Å; E63-A65 PolarHBondContact O-N 3.43Å; A65-F68 PolarHBondContact O-N 2.79Å; A65-E69 PolarHBondContact O-N 2.9Å
66	D	85.5	Confident	80.7	Confident	68 Å²	68	119.1 Å²	119.1	36%	0.364	57%	0.566	S	S	.	*	H	α-helix	trans	-64.7	-40.8	175.4	-173.5	34.5	0	0	0	111.2	A62 E63 E69 R70	A62-D66 PolarHBondContact O-N 3.02Å; E63-D66 PolarHBondContact O-N 3.22Å; D66-E69 PolarHBondContact O-N 3.42Å; D66-R70 WeakPolarHBondContact O-CB 3.48Å; D66-R70 VanDerWaalsContact O-CG 3.31Å; D66-R70 WeakPolarHBondContact O-CG 3.44Å; D66-R70 PolarHBondContact O-N 2.79Å; D66-R70 IonicContact OD1-NE 2.95Å; D66-R70 PolarHBondContact OD1-NE 3.4Å; D66-R70 IonicContact OD1-NH2 3.88Å; D66-R70 IonicContact OD2-CZ 3.1Å; D66-R70 VanDerWaalsContact OD2-CZ 3.3Å; D66-R70 IonicContact OD2-NE 3.06Å; D66-R70 PolarHBondContact OD2-NE 3.19Å; D66-R70 IonicContact OD2-NH2 3.28Å; D66-R70 PolarHBondContact OD2-NH2 3.25Å
67	I	80.7	Confident	80.3	Confident	96 Å²	96	120.1 Å²	120.1	49%	0.492	57%	0.571	S	S	.	*	H	α-helix	trans	-61.4	-45.7	172.8	-68.5	164.5	0	0	0	110.6	E63 E69 R70 L71	E63-I67 WeakPolarHBondContact O-CB 3.41Å; E63-I67 WeakPolarHBondContact O-CD1 3.15Å; E63-I67 WeakPolarHBondContact O-CG1 3.44Å; E63-I67 PolarHBondContact O-N 3.1Å; I67-E69 VanDerWaalsContact C-N 3.33Å; I67-E69 PolarHBondContact O-N 2.98Å; I67-R70 PolarHBondContact O-N 3.2Å; I67-L71 HydrophobicContact CG2-CD1 3.81Å; I67-L71 HydrophobicContact CG2-CG 4.34Å; I67-L71 WeakPolarHBondContact O-CB 3.25Å; I67-L71 VanDerWaalsContact O-CG 3.32Å; I67-L71 WeakPolarHBondContact O-CG 3.41Å; I67-L71 PolarHBondContact O-N 3.39Å
68	F	78.3	Confident	79.6	Confident	144 Å²	144	116.9 Å²	116.9	63%	0.632	57%	0.566	S	S	*	*	H	α-helix	trans	-61.4	-40.2	176.2	-109.8	-82.5	0	0	0	112.2	C64 A65 L71 K72	C64-F68 WeakPolarHBondContact O-CB 3.09Å; C64-F68 PolarHBondContact O-N 3.27Å; A65-F68 PolarHBondContact O-N 2.79Å; F68-L71 PolarHBondContact O-N 3.14Å; F68-K72 WeakPolarHBondContact O-CB 3.37Å; F68-K72 PolarHBondContact O-N 3.01Å
69	E	82.1	Confident	79.2	Confident	101 Å²	101	110.9 Å²	110.9	47%	0.472	55%	0.553	S	S	.	*	H	α-helix	trans	-68	-41.2	178.3	-139.5	-160	143.5	0	0	111.7	A65 D66 I67 K72 R73	A65-E69 PolarHBondContact O-N 2.9Å; D66-E69 PolarHBondContact O-N 3.42Å; I67-E69 VanDerWaalsContact C-N 3.33Å; I67-E69 PolarHBondContact O-N 2.98Å; E69-K72 PolarHBondContact O-N 3.25Å; E69-R73 WeakPolarHBondContact O-CG 3.42Å; E69-R73 PolarHBondContact O-N 3.29Å; E69-R73 IonicContact OE1-CZ 3.16Å; E69-R73 IonicContact OE1-NE 2.79Å; E69-R73 IonicContact OE1-NH2 3.29Å; E69-R73 PolarHBondContact OE1-NH2 2.87Å; E69-R73 IonicContact OE2-NH2 2.64Å
70	R	81.5	Confident	78.4	Confident	153 Å²	153	109.5 Å²	109.5	58%	0.577	55%	0.549	S	S	*	.	H	α-helix	trans	-64.9	-42.5	174.4	-71.5	178.7	-165.3	-165.5	5.2	112.2	D66 I67 K72 R73 C74	D66-R70 WeakPolarHBondContact O-CB 3.48Å; D66-R70 VanDerWaalsContact O-CG 3.31Å; D66-R70 WeakPolarHBondContact O-CG 3.44Å; D66-R70 PolarHBondContact O-N 2.79Å; D66-R70 IonicContact OD1-NE 2.95Å; D66-R70 PolarHBondContact OD1-NE 3.4Å; D66-R70 IonicContact OD1-NH2 3.88Å; D66-R70 IonicContact OD2-CZ 3.1Å; D66-R70 VanDerWaalsContact OD2-CZ 3.3Å; D66-R70 IonicContact OD2-NE 3.06Å; D66-R70 PolarHBondContact OD2-NE 3.19Å; D66-R70 IonicContact OD2-NH2 3.28Å; D66-R70 PolarHBondContact OD2-NH2 3.25Å; I67-R70 PolarHBondContact O-N 3.2Å; R70-K72 VanDerWaalsContact C-N 3.29Å; R70-K72 PolarHBondContact O-N 3.03Å; R70-R73 PolarHBondContact O-N 3.24Å; R70-C74 PolarHBondContact O-N 3.45Å; R70-C74 VanDerWaalsContact O-N 3.14Å; R70-C74 PolarHBondContact O-SG 2.9Å
71	L	76.6	Confident	77.6	Confident	103 Å²	103	108.6 Å²	108.6	54%	0.539	55%	0.548	S	S	.	.	H	α-helix	trans	-61.8	-39.4	174.2	-77.3	168.7	0	0	0	111.2	I67 F68 R73 C74 Q75	I67-L71 HydrophobicContact CG2-CD1 3.81Å; I67-L71 HydrophobicContact CG2-CG 4.34Å; I67-L71 WeakPolarHBondContact O-CB 3.25Å; I67-L71 VanDerWaalsContact O-CG 3.32Å; I67-L71 WeakPolarHBondContact O-CG 3.41Å; I67-L71 PolarHBondContact O-N 3.39Å; F68-L71 PolarHBondContact O-N 3.14Å; L71-R73 VanDerWaalsContact C-N 3.32Å; L71-R73 PolarHBondContact O-N 3.45Å; L71-C74 CarbonylContact O-C 3.52Å; L71-C74 PolarHBondContact O-N 2.82Å; L71-C74 VanDerWaalsContact O-N 3.16Å; L71-Q75 PolarHBondContact O-N 3.16Å
72	K	79.4	Confident	76.9	Confident	156 Å²	156	106.7 Å²	106.7	68%	0.678	55%	0.545	S	S	*	.	H	α-helix	trans	-66.3	-32.3	176.9	-141.5	177.2	-173.1	-175.8	0	112.8	F68 E69 R70 C74	F68-K72 WeakPolarHBondContact O-CB 3.37Å; F68-K72 PolarHBondContact O-N 3.01Å; E69-K72 PolarHBondContact O-N 3.25Å; R70-K72 VanDerWaalsContact C-N 3.29Å; R70-K72 PolarHBondContact O-N 3.03Å; K72-C74 VanDerWaalsContact C-N 3.33Å
73	R	78.6	Confident	76.3	Confident	186 Å²	186	109 Å²	109	70%	0.702	55%	0.548	S	S	*	.	H	α-helix	trans	-73.8	-23.2	173.2	-69.4	179.2	-164.3	171.8	7.5	113.4	E69 R70 L71	E69-R73 WeakPolarHBondContact O-CG 3.42Å; E69-R73 PolarHBondContact O-N 3.29Å; E69-R73 IonicContact OE1-CZ 3.16Å; E69-R73 IonicContact OE1-NE 2.79Å; E69-R73 IonicContact OE1-NH2 3.29Å; E69-R73 PolarHBondContact OE1-NH2 2.87Å; E69-R73 IonicContact OE2-NH2 2.64Å; R70-R73 PolarHBondContact O-N 3.24Å; L71-R73 VanDerWaalsContact C-N 3.32Å; L71-R73 PolarHBondContact O-N 3.45Å
74	C	75.5	Confident	75.1	Confident	100 Å²	100	109.1 Å²	109.1	68%	0.676	55%	0.55	S	S	*	.	S	Bend	trans	-97.7	-0.6	177.5	-55.4	0	0	0	0	112.9	R70 L71 K72 I76	R70-C74 PolarHBondContact O-N 3.45Å; R70-C74 VanDerWaalsContact O-N 3.14Å; R70-C74 PolarHBondContact O-SG 2.9Å; L71-C74 CarbonylContact O-C 3.52Å; L71-C74 PolarHBondContact O-N 2.82Å; L71-C74 VanDerWaalsContact O-N 3.16Å; K72-C74 VanDerWaalsContact C-N 3.33Å; C74-I76 PolarHBondContact O-N 2.92Å; C74-I76 VanDerWaalsContact O-N 3.14Å
75	Q	62.1	Low	74	Confident	145 Å²	145	108.7 Å²	108.7	68%	0.678	55%	0.545	S	S	*	.			trans	-70.7	110.5	176.6	-96.5	-177.9	-19.3	0	0	109.3	L71	L71-Q75 PolarHBondContact O-N 3.16Å
76	I	72.3	Confident	73	Confident	71 Å²	71	108.7 Å²	108.7	36%	0.364	54%	0.542	S	S	.	.			trans	-63.3	136.3	170.8	-63.8	170.4	0	0	0	108.4	C74 E80 M81 M84	C74-I76 PolarHBondContact O-N 2.92Å; C74-I76 VanDerWaalsContact O-N 3.14Å; I76-E80 HydrophobicContact CG2-CB 3.26Å; I76-E80 HydrophobicContact CG2-CG 4.44Å; I76-M81 HydrophobicContact CG2-CB 4.48Å; I76-M84 HydrophobicContact CD1-SD 3.6Å
77	E	76.5	Confident	71.5	Confident	121 Å²	121	108.7 Å²	108.7	57%	0.565	54%	0.544	S	S	*	.			trans	-52.8	138.1	176.5	-119.5	-77.9	147.5	0	0	109.7	S79 E80 M81	E77-S79 PolarHBondContact O-N 3.27Å; E77-S79 PolarHBondContact OE2-OG 2.98Å; E77-E80 WeakPolarHBondContact O-CA 3.35Å; E77-E80 PolarHBondContact O-N 3.33Å; E77-M81 PolarHBondContact O-N 3.44Å
78	P	69.8	Low	70	Confident	87 Å²	87	106.1 Å²	106.1	57%	0.565	54%	0.537	S	S	*	.	H	α-helix	trans	-53.1	-30.5	-176.8	-27.6	34.3	0	0	0	114.1	M81 L82	P78-M81 PolarHBondContact O-N 2.84Å; P78-L82 PolarHBondContact O-N 3.03Å
79	S	76	Confident	68.5	Low	66 Å²	66	106.4 Å²	106.4	46%	0.462	54%	0.538	S	S	.	.	H	α-helix	trans	-66.5	-43	174.5	52.8	0	0	0	0	113	E77 L82 L83	E77-S79 PolarHBondContact O-N 3.27Å; E77-S79 PolarHBondContact OE2-OG 2.98Å; S79-L82 PolarHBondContact O-N 3.04Å; S79-L83 PolarHBondContact O-N 2.91Å
80	E	70.9	Confident	66.7	Low	114 Å²	114	108.8 Å²	108.8	53%	0.533	55%	0.551	S	S	.	*	H	α-helix	trans	-71.7	-33	172.7	-78.5	-174.2	157.5	0	0	112.1	I76 E77 L82 L83 M84	I76-E80 HydrophobicContact CG2-CB 3.26Å; I76-E80 HydrophobicContact CG2-CG 4.44Å; E77-E80 WeakPolarHBondContact O-CA 3.35Å; E77-E80 PolarHBondContact O-N 3.33Å; E80-L82 VanDerWaalsContact C-N 3.3Å; E80-L82 PolarHBondContact O-N 3.25Å; E80-L83 CarbonylContact O-C 3.53Å; E80-L83 WeakPolarHBondContact O-CB 3.45Å; E80-L83 PolarHBondContact O-N 3.36Å; E80-M84 WeakPolarHBondContact O-CG 3.38Å; E80-M84 PolarHBondContact O-N 3.44Å
81	M	67.1	Low	65	Low	103 Å²	103	108.7 Å²	108.7	51%	0.507	56%	0.557	S	S	.	*	H	α-helix	trans	-63.1	-38.5	173.8	-164.4	-171.2	-60.8	0	0	110.7	I76 E77 P78 M84 T85	I76-M81 HydrophobicContact CG2-CB 4.48Å; E77-M81 PolarHBondContact O-N 3.44Å; P78-M81 PolarHBondContact O-N 2.84Å; M81-M84 PolarHBondContact O-N 3.37Å; M81-T85 VanDerWaalsContact O-CB 3.31Å; M81-T85 WeakPolarHBondContact O-CB 3.35Å; M81-T85 PolarHBondContact O-N 3.28Å; M81-T85 PolarHBondContact O-OG1 2.81Å
82	L	71.4	Confident	63.3	Low	126 Å²	126	111.9 Å²	111.9	66%	0.66	57%	0.57	S	S	*	*	H	α-helix	trans	-64.1	-38.5	173.4	-83.8	158.9	0	0	0	112.5	P78 S79 E80 T85 S86	P78-L82 PolarHBondContact O-N 3.03Å; S79-L82 PolarHBondContact O-N 3.04Å; E80-L82 VanDerWaalsContact C-N 3.3Å; E80-L82 PolarHBondContact O-N 3.25Å; L82-T85 PolarHBondContact O-N 2.99Å; L82-S86 PolarHBondContact O-N 3.43Å
83	L	71	Confident	61.2	Low	110 Å²	110	112.2 Å²	112.2	58%	0.576	57%	0.571	S	S	*	*	H	α-helix	trans	-67.4	-42.5	172.6	-84.6	149.9	0	0	0	111.9	S79 E80 T85 S86 V87	S79-L83 PolarHBondContact O-N 2.91Å; E80-L83 CarbonylContact O-C 3.53Å; E80-L83 WeakPolarHBondContact O-CB 3.45Å; E80-L83 PolarHBondContact O-N 3.36Å; L83-T85 VanDerWaalsContact C-N 3.3Å; L83-T85 PolarHBondContact O-N 2.99Å; L83-S86 PolarHBondContact O-N 3.46Å; L83-S86 PolarHBondContact O-OG 2.95Å; L83-V87 VanDerWaalsContact O-CG2 3.27Å; L83-V87 WeakPolarHBondContact O-CG2 3.28Å; L83-V87 PolarHBondContact O-N 3.09Å
84	M	59.2	Low	59	Low	115 Å²	115	107.6 Å²	107.6	57%	0.567	56%	0.56	S	S	*	*	H	α-helix	trans	-69.5	-29.6	174.8	-68.6	-158.4	89.4	0	0	112	I76 E80 M81 V87 A88	I76-M84 HydrophobicContact CD1-SD 3.6Å; E80-M84 WeakPolarHBondContact O-CG 3.38Å; E80-M84 PolarHBondContact O-N 3.44Å; M81-M84 PolarHBondContact O-N 3.37Å; M84-V87 PolarHBondContact O-N 2.8Å; M84-A88 WeakPolarHBondContact O-CB 3.38Å; M84-A88 PolarHBondContact O-N 3.24Å
85	T	55.7	Low	57.2	Low	60 Å²	60	109.1 Å²	109.1	37%	0.368	57%	0.569	S	S	.	*	H	α-helix	trans	-72.4	-32.8	174.2	-49.8	0	0	0	0	110.8	M81 L82 L83 K89	M81-T85 VanDerWaalsContact O-CB 3.31Å; M81-T85 WeakPolarHBondContact O-CB 3.35Å; M81-T85 PolarHBondContact O-N 3.28Å; M81-T85 PolarHBondContact O-OG1 2.81Å; L82-T85 PolarHBondContact O-N 2.99Å; L83-T85 VanDerWaalsContact C-N 3.3Å; L83-T85 PolarHBondContact O-N 2.99Å; T85-K89 HydrophobicContact CG2-CD 4.44Å; T85-K89 VanDerWaalsContact O-CB 3.25Å; T85-K89 WeakPolarHBondContact O-CB 3.48Å; T85-K89 WeakPolarHBondContact O-CG 3.48Å; T85-K89 PolarHBondContact O-N 3.32Å
86	S	62.1	Low	55.7	Low	58 Å²	58	110.9 Å²	110.9	41%	0.406	57%	0.574	S	S	.	*	H	α-helix	trans	-71.8	-38.7	172.6	77.5	0	0	0	0	111.5	L82 L83 K89 M90	L82-S86 PolarHBondContact O-N 3.43Å; L83-S86 PolarHBondContact O-N 3.46Å; L83-S86 PolarHBondContact O-OG 2.95Å; S86-K89 PolarHBondContact O-N 3.35Å; S86-M90 WeakPolarHBondContact O-CG 3.4Å; S86-M90 PolarHBondContact O-N 2.84Å
87	V	53.8	Low	53.6	Low	68 Å²	68	116.6 Å²	116.6	41%	0.412	59%	0.591	S	S	.	*	H	α-helix	trans	-69.3	-38.6	174.1	177.1	0	0	0	0	111.5	L83 M84 M90 Q91	L83-V87 VanDerWaalsContact O-CG2 3.27Å; L83-V87 WeakPolarHBondContact O-CG2 3.28Å; L83-V87 PolarHBondContact O-N 3.09Å; M84-V87 PolarHBondContact O-N 2.8Å; V87-M90 CarbonylContact O-C 3.55Å; V87-M90 WeakPolarHBondContact O-CA 3.48Å; V87-M90 WeakPolarHBondContact O-CB 3.22Å; V87-M90 PolarHBondContact O-N 3.47Å; V87-M90 VanDerWaalsContact O-N 3.13Å; V87-Q91 HydrophobicContact CG1-CG 4.31Å; V87-Q91 WeakPolarHBondContact O-CB 3.4Å; V87-Q91 VanDerWaalsContact O-CG 3.31Å; V87-Q91 WeakPolarHBondContact O-CG 3.29Å; V87-Q91 PolarHBondContact O-N 3.24Å
88	A	49.5	Very low	51.4	Low	42 Å²	42	117.3 Å²	117.3	35%	0.347	60%	0.598	S	S	.	*	H	α-helix	trans	-69.7	-35.2	174.6	0	0	0	0	0	111.9	M84 M90 Q91 Q92	M84-A88 WeakPolarHBondContact O-CB 3.38Å; M84-A88 PolarHBondContact O-N 3.24Å; A88-M90 VanDerWaalsContact C-N 3.27Å; A88-M90 PolarHBondContact O-N 3.38Å; A88-Q91 PolarHBondContact O-N 3.05Å; A88-Q92 WeakPolarHBondContact O-CB 3.4Å; A88-Q92 WeakPolarHBondContact O-CG 3.45Å; A88-Q92 PolarHBondContact O-N 2.91Å
89	K	47.9	Very low	49.5	Very low	150 Å²	150	118.4 Å²	118.4	65%	0.652	61%	0.605	S	S	*	*	H	α-helix	trans	-69.4	-24.2	168.8	-76.5	176.9	179.1	-180	0	112.8	T85 S86	T85-K89 HydrophobicContact CG2-CD 4.44Å; T85-K89 VanDerWaalsContact O-CB 3.25Å; T85-K89 WeakPolarHBondContact O-CB 3.48Å; T85-K89 WeakPolarHBondContact O-CG 3.48Å; T85-K89 PolarHBondContact O-N 3.32Å; S86-K89 PolarHBondContact O-N 3.35Å
90	M	44.1	Very low	47.3	Very low	150 Å²	150	121.5 Å²	121.5	74%	0.739	62%	0.615	S	S	*	*	H	α-helix	trans	-80.1	-30.8	168.7	-77	-169.9	74.4	0	0	112.8	S86 V87 A88	S86-M90 WeakPolarHBondContact O-CG 3.4Å; S86-M90 PolarHBondContact O-N 2.84Å; V87-M90 CarbonylContact O-C 3.55Å; V87-M90 WeakPolarHBondContact O-CA 3.48Å; V87-M90 WeakPolarHBondContact O-CB 3.22Å; V87-M90 PolarHBondContact O-N 3.47Å; V87-M90 VanDerWaalsContact O-N 3.13Å; A88-M90 VanDerWaalsContact C-N 3.27Å; A88-M90 PolarHBondContact O-N 3.38Å
91	Q	45.3	Very low	45.3	Very low	152 Å²	152	121.7 Å²	121.7	71%	0.71	62%	0.624	S	S	*	*	H	α-helix	trans	-88.6	-18.2	-179	-74.4	177.8	-14.6	0	0	113.8	V87 A88 K93	V87-Q91 HydrophobicContact CG1-CG 4.31Å; V87-Q91 WeakPolarHBondContact O-CB 3.4Å; V87-Q91 VanDerWaalsContact O-CG 3.31Å; V87-Q91 WeakPolarHBondContact O-CG 3.29Å; V87-Q91 PolarHBondContact O-N 3.24Å; A88-Q91 PolarHBondContact O-N 3.05Å; Q91-K93 VanDerWaalsContact C-N 3.27Å
92	Q	41.9	Very low	43.6	Very low	170 Å²	170	121.9 Å²	121.9	79%	0.794	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.6	9.6	169.3	-72.7	-172.2	-22.1	0	0	113.3	A88 D94	A88-Q92 WeakPolarHBondContact O-CB 3.4Å; A88-Q92 WeakPolarHBondContact O-CG 3.45Å; A88-Q92 PolarHBondContact O-N 2.91Å; Q92-D94 PolarHBondContact O-N 2.99Å
93	K	33.8	Very low	41.6	Very low	162 Å²	162	124.9 Å²	124.9	70%	0.704	64%	0.644	S	S	*	*	S	Bend	trans	-83.3	103.1	157.2	-83.1	-176.1	172.5	-179	0	108.6	Q91	Q91-K93 VanDerWaalsContact C-N 3.27Å
94	D	34	Very low	39.7	Very low	89 Å²	89	123.3 Å²	123.3	48%	0.476	65%	0.647	S	S	.	*			trans	56.6	126.7	163.9	-59.7	-32.3	0	0	0	116.5	Q92 K96	Q92-D94 PolarHBondContact O-N 2.99Å; D94-K96 VanDerWaalsContact C-N 3.27Å; D94-K96 PolarHBondContact O-N 3.35Å
95	P	36.5	Very low	38.4	Very low	133 Å²	133	124 Å²	124	86%	0.864	66%	0.659	S	S	*	*	S	Bend	trans	-62.7	98.2	159.3	26.9	-29	0	0	0	107.6
96	K	30.9	Very low	37.2	Very low	181 Å²	181	127.9 Å²	127.9	79%	0.787	68%	0.683	S	S	*	*			trans	41.8	83.7	167.2	-62.4	177.2	179.8	177.8	0	113.6	D94 L98	D94-K96 VanDerWaalsContact C-N 3.27Å; D94-K96 PolarHBondContact O-N 3.35Å; K96-L98 VanDerWaalsContact C-N 3.33Å; K96-L98 PolarHBondContact O-N 3.33Å
97	R	28.1	Very low	35.7	Very low	192 Å²	192	130.6 Å²	130.6	73%	0.725	70%	0.7	S	S	*	*			trans	-57.1	110.3	139.5	-82.6	-173.2	-178.4	-151.2	-2.7	106
98	L	30.4	Very low	34.3	Very low	136 Å²	136	137.5 Å²	137.5	71%	0.712	73%	0.725	S	S	*	*			trans	-41.4	140.6	158	-77	156.1	0	0	0	108.1	K96 I100	K96-L98 VanDerWaalsContact C-N 3.33Å; K96-L98 PolarHBondContact O-N 3.33Å; L98-I100 PolarHBondContact O-N 3.09Å
99	P	30.4	Very low	33.5	Very low	110 Å²	110	140.1 Å²	140.1	71%	0.714	74%	0.741	S	S	*	*			trans	-54.7	120.3	-179.2	23.1	-30.1	0	0	0	107.5	V101	P99-V101 VanDerWaalsContact C-N 3.25Å; P99-V101 PolarHBondContact O-N 2.52Å
100	I	28.5	Very low	32.8	Very low	131 Å²	131	140.7 Å²	140.7	67%	0.672	75%	0.749	S	S	*	*			trans	-53	105.3	160.9	-65.9	170.8	0	0	0	103.7	L98	L98-I100 PolarHBondContact O-N 3.09Å
101	V	30.3	Very low	32.1	Very low	117 Å²	117	138.4 Å²	138.4	71%	0.709	75%	0.754	S	S	*	*			trans	-50.6	125.1	168.7	175.2	0	0	0	0	104.9	P99 E103	P99-V101 VanDerWaalsContact C-N 3.25Å; P99-V101 PolarHBondContact O-N 2.52Å; V101-E103 PolarHBondContact O-N 3.18Å
102	P	30.8	Very low	31.4	Very low	108 Å²	108	134.6 Å²	134.6	70%	0.701	76%	0.755	S	S	*	*			trans	-55.8	122.9	179.9	22.2	-30	0	0	0	107	A104	P102-A104 PolarHBondContact O-N 3.29Å
103	E	30	Very low	30.8	Very low	189 Å²	189	131.9 Å²	131.9	88%	0.883	76%	0.755	S	S	*	*			trans	-47.7	112.5	167.4	-76.6	-177.3	158.4	0	0	106.9	V101	V101-E103 PolarHBondContact O-N 3.18Å
104	A	31.3	Very low	30.8	Very low	77 Å²	77	136.1 Å²	136.1	64%	0.636	77%	0.767	S	S	*	*			trans	-58.2	141.5	172.6	0	0	0	0	0	107.8	P102 V106	P102-A104 PolarHBondContact O-N 3.29Å; A104-V106 PolarHBondContact O-N 3.05Å
105	P	31.5	Very low	30.5	Very low	128 Å²	128	141.7 Å²	141.7	83%	0.831	79%	0.787	S	S	*	*			trans	-67.5	109.3	-173.5	28.6	-32.1	0	0	0	108.6	C107	P105-C107 PolarHBondContact O-N 3.47Å
106	V	31.2	Very low	30.1	Very low	142 Å²	142	139 Å²	139	86%	0.861	78%	0.783	S	S	*	*			trans	-70.4	118.6	165.9	177.7	0	0	0	0	107.2	A104 K108	A104-V106 PolarHBondContact O-N 3.05Å; V106-K108 PolarHBondContact O-N 3.27Å
107	C	28.6	Very low	30.1	Very low	115 Å²	115	138.2 Å²	138.2	78%	0.777	78%	0.784	S	S	*	*			trans	-42.8	126.9	-178.1	-91.7	0	0	0	0	113.7	P105 S109	P105-C107 PolarHBondContact O-N 3.47Å; C107-S109 PolarHBondContact O-N 2.79Å
108	K	25.7	Very low	30.2	Very low	213 Å²	213	136.2 Å²	136.2	93%	0.926	79%	0.787	S	S	*	*			trans	-65.8	111.2	157.4	-67.1	175.2	178.4	176.9	0	108.9	V106	V106-K108 PolarHBondContact O-N 3.27Å
109	S	31.6	Very low	30.2	Very low	97 Å²	97	134.7 Å²	134.7	68%	0.678	79%	0.788	S	S	*	*			trans	-174.6	138.3	147.3	49.8	0	0	0	0	111.4	C107	C107-S109 PolarHBondContact O-N 2.79Å
110	I	33.6	Very low	30.1	Very low	163 Å²	163	140.9 Å²	140.9	84%	0.836	80%	0.797	S	S	*	*			trans	97	79.7	167.8	-50.4	164	0	0	0	114.1
111	A	29	Very low	30.2	Very low	102 Å²	102	142.6 Å²	142.6	84%	0.843	80%	0.802	S	S	*	*			trans	-50.6	142.6	147	0	0	0	0	0	111.2
112	G	30.8	Very low	30.2	Very low	71 Å²	71	146.2 Å²	146.2	73%	0.732	81%	0.811	S	S	*	*			trans	162.7	74.3	170.7	0	0	0	0	0	115.3
113	S	30.3	Very low	30	Very low	113 Å²	113	145 Å²	145	79%	0.79	81%	0.811	S	S	*	*			trans	31.5	112.2	134	-158.2	0	0	0	0	117.9
114	R	33	Very low	30.1	Very low	251 Å²	251	146.1 Å²	146.1	95%	0.947	81%	0.813	S	S	*	*			trans	-164.4	124.3	130.1	-105.1	160.6	-162.7	-158.5	4.9	112.8
115	K	28.4	Very low	30	Very low	207 Å²	207	150.7 Å²	150.7	90%	0.9	82%	0.821	S	S	*	*			trans	-72.3	158.2	171.8	-69.3	170.9	168	178.1	0	111.5
116	G	27.9	Very low	29.7	Very low	76 Å²	76	156.1 Å²	156.1	78%	0.784	83%	0.825	S	S	*	*			trans	87.3	131.8	162.6	0	0	0	0	0	112.4
117	M	30.4	Very low	29.7	Very low	165 Å²	165	155.3 Å²	155.3	81%	0.813	83%	0.826	S	S	*	*			cis	-166.9	137.6	41.1	-126.2	162.7	52.1	0	0	108.6
118	L	30.7	Very low	29.7	Very low	149 Å²	149	156.1 Å²	156.1	78%	0.78	83%	0.827	S	S	*	*			trans	41.5	137	132.7	-60.1	172.2	0	0	0	118.1
119	S	29.3	Very low	30.1	Very low	105 Å²	105	151 Å²	151	73%	0.734	82%	0.815	S	S	*	*			cis	168.1	141	8.7	43.8	0	0	0	0	105.1
120	R	29.8	Very low	29.8	Very low	240 Å²	240	155.5 Å²	155.5	91%	0.906	82%	0.819	S	S	*	*				174.7	112.4	120.5	-172.2	158.6	164.4	171.7	-7.1	110.1
121	E	29.3	Very low	29.8	Very low	167 Å²	167	155.4 Å²	155.4	78%	0.78	81%	0.813	S	S	*	*			trans	-57	161.7	177.6	-62.3	157.2	147.8	0	0	112.6
122	Q	31.4	Very low	29.7	Very low	192 Å²	192	157.4 Å²	157.4	90%	0.897	81%	0.805	S	S	*	*				-170.7	153.2	76.1	-91.1	179.6	-8.3	0	0	112.2
123	A	26.9	Very low	29.8	Very low	84 Å²	84	158.9 Å²	158.9	69%	0.694	80%	0.8	S	S	*	*			trans	-96.1	165.5	-160.8	0	0	0	0	0	113.4
124	F	30.8	Very low	29.8	Very low	211 Å²	211	156.9 Å²	156.9	93%	0.925	78%	0.78	S	S	*	*			trans	-150.8	141.6	135	-127.3	-87.5	0	0	0	112.4
125	E	29.9	Very low	29.6	Very low	174 Å²	174	150.3 Å²	150.3	81%	0.813	77%	0.773	S	S	*	*			trans	-83.7	164.1	-160.8	-71.2	174.3	131.2	0	0	115.8
126	R	25.7	Very low	29.7	Very low	242 Å²	242	145 Å²	145	91%	0.913	76%	0.762	S	S	*	*			trans	-76.7	140	178.5	-71.1	171.6	168.5	170.5	-4	113.2
127	S	30.1	Very low	29.7	Very low	124 Å²	124	147.4 Å²	147.4	87%	0.867	77%	0.766	S	S	*	*			trans	-153.5	136.4	134	56	0	0	0	0	111
128	T	30.1	Very low	29.7	Very low	133 Å²	133	143 Å²	143	82%	0.816	76%	0.763	S	S	*	*			trans	-91.4	174.2	-166.8	46.5	0	0	0	0	113.7
129	P	32.4	Very low	29.5	Very low	104 Å²	104	141 Å²	141	68%	0.675	76%	0.762	S	S	*	*			cis	-139.1	170.6	4.3	41.2	-22.5	0	0	0	117.5
130	Y	27.1	Very low	29.6	Very low	192 Å²	192	144.1 Å²	144.1	75%	0.753	77%	0.77	S	S	*	*	S	Bend	trans	81.7	81.3	153	-91	-80.8	0	0	0	121.4
131	F	33.2	Very low	29.5	Very low	162 Å²	162	141.4 Å²	141.4	71%	0.711	77%	0.768	S	S	*	*				163.6	115	113.5	-111.6	-91.2	0	0	0	108.2	T133	F131-T133 PolarHBondContact O-N 3.37Å
132	E	26.2	Very low	29.7	Very low	144 Å²	144	142.4 Å²	142.4	67%	0.673	77%	0.773	S	S	*	*			trans	-71.2	117.2	178.7	-72	172.3	167.1	0	0	111.4
133	T	32.6	Very low	29.6	Very low	102 Å²	102	141 Å²	141	63%	0.626	77%	0.771	S	S	*	*			trans	-124.2	105.3	154	37	0	0	0	0	107.9	F131 S135	F131-T133 PolarHBondContact O-N 3.37Å; T133-S135 PolarHBondContact O-N 3.34Å; T133-S135 VanDerWaalsContact O-N 3.11Å
134	D	29.9	Very low	29.9	Very low	71 Å²	71	141.8 Å²	141.8	38%	0.38	78%	0.778	S	S	.	*			trans	-66.5	100	171.8	-68.3	-33.6	0	0	0	109.7	S700	D134-S700 VanDerWaalsContact OD2-CB 3.26Å; D134-S700 WeakPolarHBondContact OD2-CB 3.41Å; D134-S700 PolarHBondContact OD2-OG 3.1Å
135	S	29.3	Very low	29.8	Very low	112 Å²	112	138.9 Å²	138.9	78%	0.783	77%	0.772	S	S	*	*			trans	-93.5	105	160.6	-75.2	0	0	0	0	108.2	T133	T133-S135 PolarHBondContact O-N 3.34Å; T133-S135 VanDerWaalsContact O-N 3.11Å
136	S	31.1	Very low	30	Very low	97 Å²	97	138 Å²	138	68%	0.678	77%	0.773	S	S	*	*			trans	-89	120.5	161.6	60.7	0	0	0	0	109.1
137	S	27.5	Very low	30.2	Very low	125 Å²	125	135.4 Å²	135.4	87%	0.874	77%	0.768	S	S	*	*			trans	-49.6	141.5	170.4	39.1	0	0	0	0	113.6
138	G	30.1	Very low	30.3	Very low	73 Å²	73	135.4 Å²	135.4	75%	0.753	76%	0.762	S	S	*	*			trans	-133.2	115.3	159.8	0	0	0	0	0	106.9
139	S	28	Very low	30.4	Very low	107 Å²	107	134.7 Å²	134.7	75%	0.748	76%	0.76	S	S	*	*			trans	-46.3	136.7	-176.9	49.2	0	0	0	0	116.5
140	D	31.1	Very low	30.2	Very low	170 Å²	170	138.5 Å²	138.5	91%	0.909	77%	0.769	S	S	*	*			trans	-126.8	120.9	145.3	-73.3	-36.9	0	0	0	107
141	E	27.8	Very low	30.4	Very low	183 Å²	183	137.1 Å²	137.1	86%	0.855	77%	0.773	S	S	*	*			trans	-80.9	134.3	168.9	-66.2	-174.2	164.7	0	0	108.6
142	E	33.5	Very low	30.4	Very low	189 Å²	189	134.7 Å²	134.7	88%	0.883	78%	0.776	S	S	*	*				178.1	142.3	128	-95.2	-179.4	-160.3	0	0	111.1
143	D	27.5	Very low	30.6	Very low	162 Å²	162	135.7 Å²	135.7	87%	0.866	79%	0.786	S	S	*	*			trans	-73.2	151.9	-158.2	-58.5	-70.8	0	0	0	116.8
144	A	33.7	Very low	30.6	Very low	100 Å²	100	134.8 Å²	134.8	83%	0.826	80%	0.797	S	S	*	*				179.8	131.1	125.6	0	0	0	0	0	112.4
145	D	28.8	Very low	30.8	Very low	150 Å²	150	138.2 Å²	138.2	80%	0.802	82%	0.815	S	S	*	*			trans	-55.8	143.2	-179	-67.9	-66.5	0	0	0	116.3
146	D	34.6	Very low	30.9	Very low	157 Å²	157	140.3 Å²	140.3	84%	0.84	82%	0.818	S	S	*	*				-178	107.5	113.8	-97.5	-27.9	0	0	0	115.2
147	K	30	Very low	31.1	Very low	186 Å²	186	141.5 Å²	141.5	81%	0.809	82%	0.823	S	S	*	*			trans	2.3	133.8	144.6	-85.3	178.7	180	168.6	0	123.9
148	V	31.8	Very low	31.3	Very low	124 Å²	124	141.4 Å²	141.4	75%	0.752	82%	0.823	S	S	*	*				102	142.7	121	169	0	0	0	0	119.4
149	P	32.9	Very low	31.2	Very low	118 Å²	118	145 Å²	145	77%	0.766	82%	0.823	S	S	*	*			cis	-141.1	-176.5	-44	45.2	-25.4	0	0	0	114.6
150	E	27.6	Very low	31.4	Very low	184 Å²	184	148.2 Å²	148.2	86%	0.86	83%	0.831	S	S	*	*			trans	-73.8	160.8	-174.9	-58	174.5	142.7	0	0	118.1
151	I	31.9	Very low	31.2	Very low	163 Å²	163	147.7 Å²	147.7	84%	0.836	82%	0.823	S	S	*	*			trans	-137.8	103.4	152.3	-61.7	-177.1	0	0	0	111.9
152	S	32.8	Very low	31.3	Very low	111 Å²	111	143.5 Å²	143.5	78%	0.776	81%	0.814	S	S	*	*			trans	44.9	131.3	138.2	71.4	0	0	0	0	125.7
153	N	29.8	Very low	31.1	Very low	165 Å²	165	141.9 Å²	141.9	88%	0.882	81%	0.811	S	S	*	*			trans	-60.9	163.1	173.2	-72.5	-36	0	0	0	119.2
154	G	33.3	Very low	31.2	Very low	83 Å²	83	140 Å²	140	86%	0.856	81%	0.807	S	S	*	*			trans	-159.1	104.4	155.7	0	0	0	0	0	113.4
155	N	32.9	Very low	31.1	Very low	143 Å²	143	143.8 Å²	143.8	77%	0.765	81%	0.813	S	S	*	*			trans	-72.1	149.9	179.9	-87.1	-19.9	0	0	0	115
156	N	32.5	Very low	30.9	Very low	157 Å²	157	145 Å²	145	84%	0.84	81%	0.814	S	S	*	*				176.4	137.2	110.5	-94.4	-18.2	0	0	0	113.7
157	P	34.2	Very low	30.5	Very low	121 Å²	121	143 Å²	143	79%	0.786	81%	0.812	S	S	*	*			trans	-109.7	162.8	179.8	39.5	-30.6	0	0	0	114.3
158	S	33.5	Very low	30.5	Very low	124 Å²	124	139 Å²	139	87%	0.867	81%	0.814	S	S	*	*			trans	-149.8	136.9	158.9	55.7	0	0	0	0	113.4
159	L	26.2	Very low	30.1	Very low	147 Å²	147	138.4 Å²	138.4	77%	0.77	82%	0.815	S	S	*	*			trans	-62.8	150.9	-180	-80.3	75.1	0	0	0	114.6
160	I	32.4	Very low	29.8	Very low	176 Å²	176	139.2 Å²	139.2	90%	0.903	82%	0.822	S	S	*	*			trans	-147	138.3	131.3	-60.9	-169.7	0	0	0	110.2
161	Q	28	Very low	29.7	Very low	159 Å²	159	135.2 Å²	135.2	74%	0.743	81%	0.814	S	S	*	*			trans	-89.5	154.7	-173.5	-64.5	168	-54.1	0	0	114.9
162	S	28.5	Very low	29.7	Very low	94 Å²	94	135.1 Å²	135.1	66%	0.657	82%	0.815	S	S	*	*			trans	51.5	126.4	137.2	61.6	0	0	0	0	123.1
163	D	29.6	Very low	29.4	Very low	156 Å²	156	138.6 Å²	138.6	83%	0.834	82%	0.819	S	S	*	*				-178.3	144.1	103.3	-91.8	-19.3	0	0	0	113.2
164	P	29.8	Very low	29.4	Very low	121 Å²	121	136.9 Å²	136.9	79%	0.786	82%	0.818	S	S	*	*			trans	-107.4	142.1	173.1	36.5	-25.7	0	0	0	112.7
165	L	32.5	Very low	29.3	Very low	181 Å²	181	138 Å²	138	95%	0.948	82%	0.819	S	S	*	*			trans	-121.1	134	174.5	-88	164.9	0	0	0	113.3
166	Q	24.3	Very low	29	Very low	176 Å²	176	140.6 Å²	140.6	82%	0.822	82%	0.823	S	S	*	*			trans	-88.8	158	176.6	-74.5	174.6	-14.3	0	0	112.7
167	S	26.5	Very low	28.9	Very low	115 Å²	115	142.1 Å²	142.1	80%	0.804	83%	0.825	S	S	*	*			trans	70.5	125.8	145.5	69.6	0	0	0	0	120.5
168	A	28.9	Very low	28.6	Very low	102 Å²	102	145.8 Å²	145.8	84%	0.843	83%	0.829	S	S	*	*				179.6	132.4	109.8	0	0	0	0	0	111.6
169	S	23.9	Very low	28.2	Very low	111 Å²	111	147.5 Å²	147.5	78%	0.776	83%	0.827	S	S	*	*			trans	-71.3	146.4	168.3	48.6	0	0	0	0	112.5
170	C	27	Very low	28.4	Very low	134 Å²	134	150.2 Å²	150.2	91%	0.905	83%	0.833	S	S	*	*			trans	-164.8	135.2	140.5	-98.9	0	0	0	0	112.4
171	S	24.4	Very low	28.1	Very low	100 Å²	100	150.6 Å²	150.6	70%	0.699	83%	0.831	S	S	*	*			trans	-72.3	146.9	169.1	45	0	0	0	0	112.5
172	N	32.2	Very low	28.2	Very low	161 Å²	161	147.1 Å²	147.1	86%	0.861	83%	0.825	S	S	*	*				-178.9	155.4	127.3	-90.8	-9.7	0	0	0	113.1
173	E	27.5	Very low	28.2	Very low	184 Å²	184	149.3 Å²	149.3	86%	0.86	83%	0.834	S	S	*	*			trans	-60.5	166.3	-163.3	-73.4	179.6	139.1	0	0	118.9
174	P	29.8	Very low	28.2	Very low	130 Å²	130	149.3 Å²	149.3	84%	0.844	83%	0.832	S	S	*	*			trans	-94.2	141.4	-171	36.2	-29.9	0	0	0	113.4
175	A	30.9	Very low	28.2	Very low	106 Å²	106	149.1 Å²	149.1	88%	0.876	83%	0.831	S	S	*	*			trans	-114.4	139.3	169.8	0	0	0	0	0	111.7
176	K	25.2	Very low	28	Very low	197 Å²	197	150.3 Å²	150.3	86%	0.857	83%	0.829	S	S	*	*			trans	-78.6	152.2	-178.6	-62.6	164.4	174.3	171.1	0	111.6
177	E	31.2	Very low	28.3	Very low	190 Å²	190	147.5 Å²	147.5	89%	0.888	83%	0.826	S	S	*	*			trans	-175.8	105.4	147.3	-104.2	158.5	-157.2	0	0	108.9
178	K	27.7	Very low	28.4	Very low	198 Å²	198	150.9 Å²	150.9	86%	0.861	83%	0.829	S	S	*	*				56.8	105.7	87.2	-83.3	-168.2	179.4	-179.6	0	116.8
179	L	25.7	Very low	28.6	Very low	160 Å²	160	152.9 Å²	152.9	84%	0.838	83%	0.831	S	S	*	*			trans	-3	128.7	147.3	-75.4	141.2	0	0	0	117.9
180	F	30.7	Very low	28.9	Very low	204 Å²	204	152.1 Å²	152.1	90%	0.895	83%	0.831	S	S	*	*			trans	-147.6	126.4	142.5	-119.2	-88.7	0	0	0	110.8
181	E	25	Very low	28.8	Very low	183 Å²	183	151.8 Å²	151.8	86%	0.855	83%	0.829	S	S	*	*			trans	-102.5	120.3	171.8	-175	165.8	-156.1	0	0	106.7
182	S	30.8	Very low	29.1	Very low	87 Å²	87	153.8 Å²	153.8	61%	0.608	84%	0.837	S	S	*	*			trans	-163.7	117	162.2	58.1	0	0	0	0	111.3
183	T	27.6	Very low	29.1	Very low	140 Å²	140	152.8 Å²	152.8	86%	0.859	84%	0.837	S	S	*	*			trans	-38.6	133	153.9	31.8	0	0	0	0	113.3
184	I	31	Very low	29.3	Very low	155 Å²	155	148.6 Å²	148.6	80%	0.795	83%	0.834	S	S	*	*			trans	-154	145.4	153	-87.4	136.9	0	0	0	108.3
185	P	28.8	Very low	29.5	Very low	117 Å²	117	149 Å²	149	76%	0.76	83%	0.833	S	S	*	*			trans	-94.4	168.5	-162.4	26.3	-9.9	0	0	0	114.2
186	K	28.4	Very low	29.4	Very low	206 Å²	206	151.3 Å²	151.3	90%	0.896	83%	0.831	S	S	*	*			trans	-47.4	145.7	179.6	-73.5	177.5	174.2	179	0	114.1
187	P	31.6	Very low	29.7	Very low	117 Å²	117	147.1 Å²	147.1	76%	0.76	83%	0.827	S	S	*	*			trans	-119	134.7	144.7	33.2	-20.5	0	0	0	111.7
188	E	27.8	Very low	29.6	Very low	187 Å²	187	147.2 Å²	147.2	87%	0.874	82%	0.824	S	S	*	*			trans	-70.4	134.2	164.5	-64	173.5	160.9	0	0	109.2
189	T	32.9	Very low	29.9	Very low	143 Å²	143	144.4 Å²	144.4	88%	0.877	82%	0.824	S	S	*	*			trans	-152.9	138.1	153.7	-25.5	0	0	0	0	112.6
190	A	30.1	Very low	30.2	Very low	96 Å²	96	144.1 Å²	144.1	79%	0.793	82%	0.821	S	S	*	*			trans	-45.1	154.3	-171	0	0	0	0	0	120
191	C	25.3	Very low	30.8	Very low	126 Å²	126	139.4 Å²	139.4	85%	0.851	81%	0.814	S	S	*	*			trans	-40	142.8	174.1	-65.1	0	0	0	0	117.3
192	T	31.8	Very low	31.7	Very low	142 Å²	142	136.1 Å²	136.1	87%	0.871	81%	0.81	S	S	*	*			trans	-138.3	137.3	136	25.8	0	0	0	0	109.9
193	T	30.9	Very low	32.8	Very low	140 Å²	140	137.4 Å²	137.4	86%	0.859	82%	0.816	S	S	*	*			trans	-64.6	128.4	-169	45.3	0	0	0	0	114.4
194	A	32.3	Very low	34.5	Very low	96 Å²	96	135 Å²	135	79%	0.793	81%	0.81	S	S	*	*			trans	-151.3	97.3	163.1	0	0	0	0	0	112
195	V	33.7	Very low	36.9	Very low	138 Å²	138	131.1 Å²	131.1	84%	0.836	79%	0.794	S	S	*	*			trans	39.1	99.9	151.7	-163.4	0	0	0	0	118.4	S197	V195-S197 PolarHBondContact O-N 2.9Å
196	D	28.1	Very low	39.6	Very low	156 Å²	156	131.7 Å²	131.7	83%	0.834	79%	0.786	S	S	*	*			trans	-57.3	111.1	167.4	-80.4	-40.1	0	0	0	112.7
197	S	31.9	Very low	42.6	Very low	109 Å²	109	123.2 Å²	123.2	76%	0.762	75%	0.751	S	S	*	*			trans	-96	93.1	157	-52.1	0	0	0	0	107.7	V195 V199	V195-S197 PolarHBondContact O-N 2.9Å; S197-V199 PolarHBondContact O-N 3.36Å
198	K	30.3	Very low	45.3	Very low	192 Å²	192	121.4 Å²	121.4	84%	0.835	74%	0.74	S	S	*	*			trans	-56.7	106.4	175.5	-81	-178.9	176.7	176.4	0	110.2	I200	K198-I200 PolarHBondContact O-N 3.08Å
199	V	33.5	Very low	48.3	Very low	139 Å²	139	113.7 Å²	113.7	84%	0.842	71%	0.705	S	S	*	*			trans	-65.9	110.1	163.7	179.6	0	0	0	0	107	S197 S201	S197-V199 PolarHBondContact O-N 3.36Å; V199-S201 PolarHBondContact O-N 3.38Å; V199-S201 VanDerWaalsContact O-N 3.11Å
200	I	32.6	Very low	51.1	Low	153 Å²	153	114.7 Å²	114.7	79%	0.785	70%	0.697	S	S	*	*			trans	-64	110.2	174.6	-62.2	168.7	0	0	0	107.2	K198 C202	K198-I200 PolarHBondContact O-N 3.08Å; I200-C202 PolarHBondContact O-N 2.94Å
201	S	41.6	Very low	54	Low	106 Å²	106	111.7 Å²	111.7	74%	0.741	67%	0.666	S	S	*	*			trans	-69.2	112.7	177.3	63.5	0	0	0	0	109.9	V199	V199-S201 PolarHBondContact O-N 3.38Å; V199-S201 VanDerWaalsContact O-N 3.11Å
202	C	44.2	Very low	57.2	Low	114 Å²	114	108.3 Å²	108.3	77%	0.77	64%	0.643	S	S	*	*			trans	-62.2	136.7	167	-66.4	0	0	0	0	109.5	I200 A204	I200-C202 PolarHBondContact O-N 2.94Å; C202-A204 PolarHBondContact O-N 2.84Å
203	P	54.3	Low	60	Low	114 Å²	114	107.6 Å²	107.6	74%	0.74	63%	0.634	S	S	*	*			trans	-59.3	131.5	179.3	22.6	-31.2	0	0	0	110.4	V205	P203-V205 PolarHBondContact O-N 3.15Å; P203-V205 VanDerWaalsContact O-N 3.08Å
204	A	64.2	Low	62.8	Low	90 Å²	90	109 Å²	109	74%	0.744	63%	0.631	S	S	*	*			trans	-66.8	108.2	177.2	0	0	0	0	0	109.5	C202	C202-A204 PolarHBondContact O-N 2.84Å
205	V	79.9	Confident	65.6	Low	73 Å²	73	106.7 Å²	106.7	44%	0.442	61%	0.605	S	S	.	*			trans	-83.4	123	172.7	-177.9	0	0	0	0	107.9	P203 A262 T266	P203-V205 PolarHBondContact O-N 3.15Å; P203-V205 VanDerWaalsContact O-N 3.08Å; V205-A262 CarbonylContact O-C 3.57Å; V205-A262 VanDerWaalsContact O-C 3.28Å; V205-T266 HydrophobicContact CG1-CG2 3.84Å
206	H	87	Confident	68.2	Low	129 Å²	129	102.8 Å²	102.8	60%	0.597	58%	0.577	S	S	*	*			trans	-119.8	124.5	176.7	180	-86.5	0	0	0	110.1	E261	H206-E261 CarbonylContact C-O 3.35Å; H206-E261 VanDerWaalsContact CA-O 3.27Å; H206-E261 WeakPolarHBondContact CA-O 3.41Å
207	V	90.2	Very high	71.2	Confident	27 Å²	27	102.1 Å²	102.1	16%	0.164	57%	0.567	C	S	.	*			trans	-98.4	115.1	176.2	-176.9	0	0	0	0	108.6	Y260 E261 T266	V207-Y260 HydrophobicContact CB-CD1 4.48Å; V207-Y260 HydrophobicContact CB-CE1 4.25Å; V207-Y260 HydrophobicContact CG1-CD1 4.23Å; V207-Y260 HydrophobicContact CG1-CE1 3.53Å; V207-E261 PolarHBondContact N-O 3.21Å; V207-T266 HydrophobicContact CG2-CG2 3.93Å
208	P	89.4	Confident	73.8	Confident	80 Å²	80	98.7 Å²	98.7	52%	0.519	55%	0.549	S	S	.	.			trans	-69.3	137.8	-178.9	28.3	-33.8	0	0	0	111.8	F210	P208-F210 HydrophobicContact CB-CE2 4.45Å; P208-F210 HydrophobicContact CB-CZ 4.3Å
209	V	91	Very high	76.6	Confident	24 Å²	24	90.4 Å²	90.4	15%	0.145	51%	0.512	C	S	.	.			trans	-122.1	120.7	174	-179.5	0	0	0	0	108.8	R211 Y260 E261 M292	V209-R211 HydrophobicContact CG1-CG 3.96Å; V209-R211 PolarHBondContact O-N 3.46Å; V209-Y260 HydrophobicContact CG2-CD1 3.92Å; V209-Y260 HydrophobicContact CG2-CE1 3.9Å; V209-E261 HydrophobicContact CG2-CG 3.79Å; V209-M292 HydrophobicContact CG1-CB 3.93Å; V209-M292 HydrophobicContact CG1-CE 4.48Å; V209-M292 HydrophobicContact CG1-CG 4.34Å; V209-M292 VanDerWaalsContact CG1-O 3.3Å; V209-M292 WeakPolarHBondContact CG1-O 3.5Å; V209-M292 HydrophobicContact CG2-CE 3.94Å
210	F	90.7	Very high	79.3	Confident	164 Å²	164	89.5 Å²	89.5	72%	0.719	50%	0.502	S	S	*	.			trans	-94.7	89.1	-175.8	-60.5	-77.4	0	0	0	111.3	P208 N293	P208-F210 HydrophobicContact CB-CE2 4.45Å; P208-F210 HydrophobicContact CB-CZ 4.3Å; F210-N293 WeakPolarHBondContact O-CB 3.12Å; F210-N293 PolarHBondContact O-ND2 3.19Å; F210-N293 VanDerWaalsContact O-ND2 3.14Å
211	R	91.8	Very high	81.8	Confident	34 Å²	34	89.3 Å²	89.3	13%	0.128	50%	0.496	C	S	.	.			trans	-84.2	155.9	-179.2	-57.3	-179.1	175.3	94.9	-4	111.5	V209 E216 E261 E291	V209-R211 HydrophobicContact CG1-CG 3.96Å; V209-R211 PolarHBondContact O-N 3.46Å; R211-E216 WeakPolarHBondContact CB-OE2 2.93Å; R211-E216 WeakPolarHBondContact CD-OE2 3.39Å; R211-E261 IonicContact CZ-OE1 3.98Å; R211-E261 IonicContact CZ-OE2 3.01Å; R211-E261 IonicContact NH1-OE1 3.37Å; R211-E261 IonicContact NH1-OE2 2.86Å; R211-E261 PolarHBondContact NH1-OE2 3.21Å; R211-E261 IonicContact NH2-OE1 3.36Å; R211-E261 PolarHBondContact NH2-OE1 2.98Å; R211-E261 IonicContact NH2-OE2 2.78Å; R211-E261 PolarHBondContact NH2-OE2 3.34Å; R211-E291 WeakPolarHBondContact CG-O 3.34Å
212	S	91.7	Very high	83.9	Confident	54 Å²	54	85.2 Å²	85.2	38%	0.378	47%	0.466	S	S	.	.			trans	-79.2	152.2	170.9	68.8	0	0	0	0	111.2	E214 I215 E216	S212-E214 PolarHBondContact O-N 2.84Å; S212-I215 PolarHBondContact O-N 2.89Å; S212-I215 VanDerWaalsContact OG-CD1 3.32Å; S212-I215 WeakPolarHBondContact OG-CD1 3.47Å; S212-I215 VanDerWaalsContact OG-CG1 3.27Å; S212-I215 WeakPolarHBondContact OG-CG1 3.28Å; S212-E216 PolarHBondContact O-N 3.36Å
213	D	90.8	Very high	85.8	Confident	127 Å²	127	81.2 Å²	81.2	68%	0.679	44%	0.438	S	S	*	.	H	α-helix	trans	-57.7	-33.6	-178.6	-68.3	-16.3	0	0	0	113.3	K217	D213-K217 WeakPolarHBondContact O-CB 3.15Å; D213-K217 VanDerWaalsContact O-CG 3.27Å; D213-K217 WeakPolarHBondContact O-CG 3.27Å; D213-K217 PolarHBondContact O-N 3.42Å; D213-K217 VanDerWaalsContact O-N 3.14Å
214	E	90.6	Very high	87.6	Confident	169 Å²	169	75.8 Å²	75.8	79%	0.79	40%	0.403	S	S	*	.	H	α-helix	trans	-66.9	-42.9	177.4	-65.8	-176.8	174.7	0	0	111.6	S212 G218	S212-E214 PolarHBondContact O-N 2.84Å; E214-G218 PolarHBondContact O-N 3.3Å; E214-G218 VanDerWaalsContact O-N 3.15Å
215	I	89.3	Confident	88.9	Confident	48 Å²	48	72.5 Å²	72.5	25%	0.246	37%	0.374	C	S	.	.	H	α-helix	trans	-69.3	-42.6	178.9	-68.3	172.5	0	0	0	110.1	S212 K217 G218 R219 D290 E291	S212-I215 PolarHBondContact O-N 2.89Å; S212-I215 VanDerWaalsContact OG-CD1 3.32Å; S212-I215 WeakPolarHBondContact OG-CD1 3.47Å; S212-I215 VanDerWaalsContact OG-CG1 3.27Å; S212-I215 WeakPolarHBondContact OG-CG1 3.28Å; I215-K217 PolarHBondContact O-N 2.89Å; I215-G218 CarbonylContact O-C 3.53Å; I215-G218 WeakPolarHBondContact O-CA 3.5Å; I215-G218 PolarHBondContact O-N 3.05Å; I215-R219 WeakPolarHBondContact O-CB 3.38Å; I215-R219 PolarHBondContact O-N 3.44Å; I215-D290 WeakPolarHBondContact CD1-O 3.36Å; I215-E291 HydrophobicContact CG2-CB 4.22Å; I215-E291 HydrophobicContact CG2-CG 4.23Å
216	E	90.1	Very high	89.4	Confident	56 Å²	56	73.2 Å²	73.2	26%	0.262	39%	0.387	S	S	.	.	H	α-helix	trans	-61.5	-44.5	179.1	-160.7	64.9	-133.2	0	0	111.4	R211 S212 G218 R219 L220	R211-E216 WeakPolarHBondContact CB-OE2 2.93Å; R211-E216 WeakPolarHBondContact CD-OE2 3.39Å; S212-E216 PolarHBondContact O-N 3.36Å; E216-G218 PolarHBondContact O-N 3.29Å; E216-R219 PolarHBondContact O-N 2.94Å; E216-R219 IonicContact OE1-NH1 2.73Å; E216-R219 PolarHBondContact OE1-NH1 3.49Å; E216-R219 VanDerWaalsContact OE1-NH1 3.11Å; E216-L220 WeakPolarHBondContact O-CG 3.29Å; E216-L220 PolarHBondContact O-N 3.29Å
217	K	90.4	Very high	89.7	Confident	142 Å²	142	70 Å²	70	62%	0.617	37%	0.372	S	S	*	.	H	α-helix	trans	-61.7	-32.5	174.1	-73.8	172.2	-175.2	170.6	0	112.8	D213 I215 K221	D213-K217 WeakPolarHBondContact O-CB 3.15Å; D213-K217 VanDerWaalsContact O-CG 3.27Å; D213-K217 WeakPolarHBondContact O-CG 3.27Å; D213-K217 PolarHBondContact O-N 3.42Å; D213-K217 VanDerWaalsContact O-N 3.14Å; I215-K217 PolarHBondContact O-N 2.89Å; K217-K221 WeakPolarHBondContact O-CG 3.43Å
218	G	86	Confident	89.9	Confident	37 Å²	37	71.2 Å²	71.2	38%	0.381	38%	0.376	S	S	.	.	H	α-helix	trans	-70.5	-44.7	173.9	0	0	0	0	0	112.3	E214 I215 E216 K221	E214-G218 PolarHBondContact O-N 3.3Å; E214-G218 VanDerWaalsContact O-N 3.15Å; I215-G218 CarbonylContact O-C 3.53Å; I215-G218 WeakPolarHBondContact O-CA 3.5Å; I215-G218 PolarHBondContact O-N 3.05Å; E216-G218 PolarHBondContact O-N 3.29Å; G218-K221 WeakPolarHBondContact O-CB 3.39Å; G218-K221 PolarHBondContact O-N 2.88Å
219	R	89.4	Confident	90.1	Very high	18 Å²	18	73.2 Å²	73.2	7%	0.068	38%	0.378	C	S	.	.	H	α-helix	trans	-60.9	-47	179.1	179.8	173.3	178.3	-121	3	111.8	I215 E216 K221 L222 V225 E228 Q254 E261	I215-R219 WeakPolarHBondContact O-CB 3.38Å; I215-R219 PolarHBondContact O-N 3.44Å; E216-R219 PolarHBondContact O-N 2.94Å; E216-R219 IonicContact OE1-NH1 2.73Å; E216-R219 PolarHBondContact OE1-NH1 3.49Å; E216-R219 VanDerWaalsContact OE1-NH1 3.11Å; R219-K221 PolarHBondContact O-N 2.86Å; R219-L222 VanDerWaalsContact O-CB 3.31Å; R219-L222 WeakPolarHBondContact O-CB 3.43Å; R219-L222 PolarHBondContact O-N 3.46Å; R219-V225 HydrophobicContact CG-CG2 3.83Å; R219-V225 WeakPolarHBondContact O-CG2 3.46Å; R219-E228 IonicContact NH2-OE1 3.73Å; R219-E228 IonicContact NH2-OE2 2.9Å; R219-E228 PolarHBondContact NH2-OE2 3.47Å; R219-Q254 VanDerWaalsContact NE-OE1 3.12Å; R219-E261 IonicContact NH2-OE1 3.78Å; R219-E261 PolarHBondContact NH2-OE1 3.17Å; R219-E261 IonicContact NH2-OE2 3.44Å
220	L	89.9	Confident	90.2	Very high	120 Å²	120	74 Å²	74	63%	0.628	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-17.9	179.1	-70.8	171.7	0	0	0	114.4	E216 L222	E216-L220 WeakPolarHBondContact O-CG 3.29Å; E216-L220 PolarHBondContact O-N 3.29Å; L220-L222 VanDerWaalsContact C-N 3.35Å
221	K	85.7	Confident	90.4	Very high	150 Å²	150	66.1 Å²	66.1	65%	0.652	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-14.2	174.9	-64.3	173.4	-176.4	177.5	0	112.9	K217 G218 R219 Q405	K217-K221 WeakPolarHBondContact O-CG 3.43Å; G218-K221 WeakPolarHBondContact O-CB 3.39Å; G218-K221 PolarHBondContact O-N 2.88Å; R219-K221 PolarHBondContact O-N 2.86Å; K221-Q405 PolarHBondContact O-NE2 3.49Å
222	L	84.8	Confident	90.6	Very high	20 Å²	20	65.1 Å²	65.1	11%	0.105	35%	0.349	C	S	.	.	S	Bend	trans	-80.6	127	-175.5	-64.1	173.5	0	0	0	110.4	R219 L220 V224 V225 Q254	R219-L222 VanDerWaalsContact O-CB 3.31Å; R219-L222 WeakPolarHBondContact O-CB 3.43Å; R219-L222 PolarHBondContact O-N 3.46Å; L220-L222 VanDerWaalsContact C-N 3.35Å; L222-V224 HydrophobicContact CB-CG1 4.45Å; L222-V224 PolarHBondContact O-N 2.85Å; L222-V224 VanDerWaalsContact O-N 3.14Å; L222-V225 HydrophobicContact CB-CG2 4.09Å; L222-V225 PolarHBondContact O-N 3.14Å; L222-V225 VanDerWaalsContact O-N 3.11Å; L222-Q254 HydrophobicContact CD1-CG 3.78Å
223	P	85.8	Confident	90.7	Very high	30 Å²	30	66.9 Å²	66.9	20%	0.195	35%	0.352	C	S	.	.	H	α-helix	trans	-55	-35.2	-178	-28.3	34.1	0	0	0	114.6	V225 A226 V401 Q405	P223-V225 PolarHBondContact O-N 3.23Å; P223-A226 PolarHBondContact O-N 3.09Å; P223-V401 HydrophobicContact CB-CG1 4.21Å; P223-Q405 HydrophobicContact CG-CG 4.42Å
224	V	90.5	Very high	90.9	Very high	0 Å²	0	61.2 Å²	61.2	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-65.4	-21.7	-177.5	73.5	0	0	0	0	113.8	L222 A226 E227 E228 I231 S249 K251 Q254 V255 F258 V401	L222-V224 HydrophobicContact CB-CG1 4.45Å; L222-V224 PolarHBondContact O-N 2.85Å; L222-V224 VanDerWaalsContact O-N 3.14Å; V224-A226 VanDerWaalsContact C-N 3.33Å; V224-E227 PolarHBondContact O-N 2.87Å; V224-E228 PolarHBondContact O-N 3.17Å; V224-I231 HydrophobicContact CG2-CD1 3.75Å; V224-S249 WeakPolarHBondContact CB-O 3.23Å; V224-S249 VanDerWaalsContact CG1-O 3.24Å; V224-S249 WeakPolarHBondContact CG1-O 3.18Å; V224-S249 PolarHBondContact N-O 3.46Å; V224-S249 VanDerWaalsContact N-O 3.16Å; V224-K251 HydrophobicContact CG2-CG 4.47Å; V224-Q254 HydrophobicContact CG1-CB 3.61Å; V224-Q254 HydrophobicContact CG1-CG 3.57Å; V224-V255 HydrophobicContact CG2-CG2 4.37Å; V224-F258 HydrophobicContact CG1-CZ 4.4Å; V224-F258 HydrophobicContact CG2-CE2 4.15Å; V224-V401 HydrophobicContact CB-CG1 4.01Å; V224-V401 HydrophobicContact CG2-CG1 4.32Å; V224-V401 HydrophobicContact CG2-CG2 4.09Å
225	V	91.8	Very high	91.1	Very high	21 Å²	21	53.2 Å²	53.2	13%	0.127	29%	0.285	C	S	.	.	H	α-helix	trans	-70.9	-31.5	-178.2	177.9	0	0	0	0	111.3	R219 L222 P223 E227 E228 Q254 F258	R219-V225 HydrophobicContact CG-CG2 3.83Å; R219-V225 WeakPolarHBondContact O-CG2 3.46Å; L222-V225 HydrophobicContact CB-CG2 4.09Å; L222-V225 PolarHBondContact O-N 3.14Å; L222-V225 VanDerWaalsContact O-N 3.11Å; P223-V225 PolarHBondContact O-N 3.23Å; V225-E227 PolarHBondContact O-N 3.17Å; V225-E228 WeakPolarHBondContact O-CB 3.4Å; V225-E228 PolarHBondContact O-N 3.48Å; V225-Q254 HydrophobicContact CG2-CG 4.21Å; V225-F258 HydrophobicContact CG2-CZ 4.27Å
226	A	91.3	Very high	91.2	Very high	87 Å²	87	56.1 Å²	56.1	72%	0.719	30%	0.296	S	S	*	.	H	α-helix	trans	-63.4	-27.6	173.3	0	0	0	0	0	112.4	P223 V224	P223-A226 PolarHBondContact O-N 3.09Å; V224-A226 VanDerWaalsContact C-N 3.33Å
227	E	92.3	Very high	91.4	Very high	62 Å²	62	60.7 Å²	60.7	29%	0.29	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.6	7.9	-178.3	-59.4	-60	147.7	0	0	112.9	V224 V225 Q229 A230 I231	V224-E227 PolarHBondContact O-N 2.87Å; V225-E227 PolarHBondContact O-N 3.17Å; E227-Q229 PolarHBondContact O-N 3.22Å; E227-A230 PolarHBondContact O-N 3.28Å; E227-I231 HydrophobicContact CB-CD1 4.07Å; E227-I231 HydrophobicContact CB-CG1 4.37Å; E227-I231 WeakPolarHBondContact O-CB 3.41Å; E227-I231 VanDerWaalsContact O-CG1 3.25Å; E227-I231 WeakPolarHBondContact O-CG1 3.43Å; E227-I231 PolarHBondContact O-N 3.47Å
228	E	94.2	Very high	91.5	Very high	53 Å²	53	55 Å²	55	25%	0.248	29%	0.294	C	S	.	.	H	α-helix	trans	-53.5	-50.1	-175.9	174.5	169.8	-174.4	0	0	112.1	R219 V224 V225 I231 I232 F258	R219-E228 IonicContact NH2-OE1 3.73Å; R219-E228 IonicContact NH2-OE2 2.9Å; R219-E228 PolarHBondContact NH2-OE2 3.47Å; V224-E228 PolarHBondContact O-N 3.17Å; V225-E228 WeakPolarHBondContact O-CB 3.4Å; V225-E228 PolarHBondContact O-N 3.48Å; E228-I231 PolarHBondContact O-N 3.48Å; E228-I232 WeakPolarHBondContact O-CG1 3.43Å; E228-I232 PolarHBondContact O-N 3.02Å; E228-F258 HydrophobicContact CB-CD1 4.28Å; E228-F258 HydrophobicContact CB-CD2 4.35Å; E228-F258 HydrophobicContact CB-CE1 3.96Å; E228-F258 HydrophobicContact CB-CE2 4.04Å; E228-F258 HydrophobicContact CB-CG 4.48Å; E228-F258 HydrophobicContact CB-CZ 3.84Å; E228-F258 VanDerWaalsContact CD-CD1 3.41Å; E228-F258 HydrophobicContact CG-CB 4.4Å; E228-F258 HydrophobicContact CG-CD1 3.61Å; E228-F258 HydrophobicContact CG-CD2 4.16Å; E228-F258 HydrophobicContact CG-CE1 3.76Å; E228-F258 HydrophobicContact CG-CE2 4.29Å; E228-F258 HydrophobicContact CG-CG 3.83Å; E228-F258 HydrophobicContact CG-CZ 4.11Å; E228-F258 WeakPolarHBondContact OE1-CD1 3.46Å
229	Q	93.2	Very high	91.7	Very high	122 Å²	122	54.9 Å²	54.9	57%	0.57	28%	0.283	S	S	*	.	H	α-helix	trans	-63.7	-45.4	-178.7	-173.1	63	23	0	0	111.7	E227 I231 I232 E233	E227-Q229 PolarHBondContact O-N 3.22Å; Q229-I231 VanDerWaalsContact C-N 3.34Å; Q229-I231 PolarHBondContact O-N 3.01Å; Q229-I232 PolarHBondContact O-N 3.43Å; Q229-E233 HydrophobicContact CG-CG 4.46Å; Q229-E233 WeakPolarHBondContact CG-OE1 3.42Å; Q229-E233 PolarHBondContact NE2-OE1 2.89Å; Q229-E233 WeakPolarHBondContact O-CB 3.13Å; Q229-E233 WeakPolarHBondContact O-CG 3.34Å; Q229-E233 PolarHBondContact O-N 3.14Å
230	A	94.4	Very high	92	Very high	39 Å²	39	54.8 Å²	54.8	32%	0.322	29%	0.285	S	S	.	.	H	α-helix	trans	-63.3	-38.9	178.9	0	0	0	0	0	112.2	E227 A234	E227-A230 PolarHBondContact O-N 3.28Å; A230-A234 VanDerWaalsContact O-CB 3.31Å; A230-A234 WeakPolarHBondContact O-CB 3.17Å; A230-A234 PolarHBondContact O-N 2.97Å
231	I	94.8	Very high	92.3	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-64.1	-47.2	175.8	-68.7	166.9	0	0	0	110.7	V224 E227 E228 Q229 A234 I235 V243 V255 F258 I399	V224-I231 HydrophobicContact CG2-CD1 3.75Å; E227-I231 HydrophobicContact CB-CD1 4.07Å; E227-I231 HydrophobicContact CB-CG1 4.37Å; E227-I231 WeakPolarHBondContact O-CB 3.41Å; E227-I231 VanDerWaalsContact O-CG1 3.25Å; E227-I231 WeakPolarHBondContact O-CG1 3.43Å; E227-I231 PolarHBondContact O-N 3.47Å; E228-I231 PolarHBondContact O-N 3.48Å; Q229-I231 VanDerWaalsContact C-N 3.34Å; Q229-I231 PolarHBondContact O-N 3.01Å; I231-A234 PolarHBondContact O-N 3.14Å; I231-I235 HydrophobicContact CG2-CD1 3.71Å; I231-I235 WeakPolarHBondContact O-CD1 3.25Å; I231-I235 WeakPolarHBondContact O-CG1 3.39Å; I231-I235 PolarHBondContact O-N 2.77Å; I231-V243 HydrophobicContact CD1-CG1 4.4Å; I231-V255 HydrophobicContact CG2-CG1 4.49Å; I231-F258 HydrophobicContact CD1-CE2 4.27Å; I231-I399 HydrophobicContact CB-CD1 4.25Å; I231-I399 HydrophobicContact CG1-CD1 3.84Å; I231-I399 HydrophobicContact CG1-CG2 4.13Å
232	I	95.2	Very high	92.7	Very high	12 Å²	12	42 Å²	42	6%	0.062	22%	0.224	C	C	.	.	H	α-helix	trans	-69.1	-40.1	-178.5	-68.4	-58.1	0	0	0	112.2	E228 Q229 I235 K236 F258 L259 A262	E228-I232 WeakPolarHBondContact O-CG1 3.43Å; E228-I232 PolarHBondContact O-N 3.02Å; Q229-I232 PolarHBondContact O-N 3.43Å; I232-I235 PolarHBondContact O-N 3.39Å; I232-K236 HydrophobicContact CG2-CD 4.04Å; I232-K236 HydrophobicContact CG2-CG 4.49Å; I232-K236 WeakPolarHBondContact O-CB 3.31Å; I232-K236 WeakPolarHBondContact O-CG 3.12Å; I232-K236 PolarHBondContact O-N 2.75Å; I232-F258 HydrophobicContact CD1-CB 3.77Å; I232-F258 HydrophobicContact CG1-CB 4.06Å; I232-L259 HydrophobicContact CD1-CD2 4.13Å; I232-A262 HydrophobicContact CD1-CB 3.92Å; I232-A262 HydrophobicContact CG1-CB 4.42Å; I232-A262 HydrophobicContact CG2-CB 4.02Å
233	E	94.7	Very high	93.2	Very high	92 Å²	92	41 Å²	41	43%	0.43	22%	0.219	S	C	.	.	H	α-helix	trans	-59.7	-49.9	174	-75.4	173.2	179.6	0	0	110.8	Q229 I235 K236 E237	Q229-E233 HydrophobicContact CG-CG 4.46Å; Q229-E233 WeakPolarHBondContact CG-OE1 3.42Å; Q229-E233 PolarHBondContact NE2-OE1 2.89Å; Q229-E233 WeakPolarHBondContact O-CB 3.13Å; Q229-E233 WeakPolarHBondContact O-CG 3.34Å; Q229-E233 PolarHBondContact O-N 3.14Å; E233-I235 VanDerWaalsContact C-N 3.3Å; E233-I235 PolarHBondContact O-N 2.97Å; E233-K236 PolarHBondContact O-N 3.13Å; E233-K236 VanDerWaalsContact O-N 3.12Å; E233-E237 WeakPolarHBondContact O-CB 3.29Å; E233-E237 WeakPolarHBondContact O-CG 3.3Å; E233-E237 PolarHBondContact O-N 2.77Å
234	A	94.7	Very high	93.4	Very high	7 Å²	7	39.7 Å²	39.7	6%	0.058	21%	0.21	C	C	.	.	H	α-helix	trans	-60.7	-38.2	179.1	0	0	0	0	0	113	A230 I231 N238 V241 T397 I399	A230-A234 VanDerWaalsContact O-CB 3.31Å; A230-A234 WeakPolarHBondContact O-CB 3.17Å; A230-A234 PolarHBondContact O-N 2.97Å; I231-A234 PolarHBondContact O-N 3.14Å; A234-N238 VanDerWaalsContact O-CB 3.3Å; A234-N238 WeakPolarHBondContact O-CB 3.16Å; A234-N238 PolarHBondContact O-N 3.46Å; A234-N238 PolarHBondContact O-ND2 3.09Å; A234-V241 HydrophobicContact CB-CG1 4.27Å; A234-V241 HydrophobicContact CB-CG2 4.15Å; A234-V241 WeakPolarHBondContact O-CG2 3.45Å; A234-T397 HydrophobicContact CB-CG2 4.44Å; A234-I399 HydrophobicContact CB-CD1 3.6Å; A234-I399 HydrophobicContact CB-CG1 4.4Å
235	I	94.5	Very high	93.1	Very high	1 Å²	1	40 Å²	40	1%	0.005	21%	0.214	C	C	.	.	H	α-helix	trans	-71.4	-34.3	177.9	-65.7	167.7	0	0	0	111.3	I231 I232 E233 V241 L259 F264 H373 V375	I231-I235 HydrophobicContact CG2-CD1 3.71Å; I231-I235 WeakPolarHBondContact O-CD1 3.25Å; I231-I235 WeakPolarHBondContact O-CG1 3.39Å; I231-I235 PolarHBondContact O-N 2.77Å; I232-I235 PolarHBondContact O-N 3.39Å; E233-I235 VanDerWaalsContact C-N 3.3Å; E233-I235 PolarHBondContact O-N 2.97Å; I235-V241 HydrophobicContact CB-CG2 4.48Å; I235-V241 HydrophobicContact CG1-CB 4.11Å; I235-V241 HydrophobicContact CG1-CG1 4.4Å; I235-V241 HydrophobicContact CG1-CG2 3.89Å; I235-L259 HydrophobicContact CD1-CD2 3.9Å; I235-L259 HydrophobicContact CG2-CD2 4.07Å; I235-F264 HydrophobicContact CG2-CE1 4.05Å; I235-F264 HydrophobicContact CG2-CZ 3.77Å; I235-H373 HydrophobicContact CG2-CB 4.07Å; I235-H373 PolarHBondContact O-CD2 3.46Å; I235-V375 HydrophobicContact CD1-CG2 3.69Å; I235-V375 HydrophobicContact CG1-CG2 4.07Å
236	K	92.3	Very high	92.4	Very high	109 Å²	109	41.8 Å²	41.8	47%	0.474	22%	0.221	S	C	.	.	H	α-helix	trans	-70.7	-35.1	175.4	-75.6	175.6	177.6	175.4	0	112.2	I232 E233 F264	I232-K236 HydrophobicContact CG2-CD 4.04Å; I232-K236 HydrophobicContact CG2-CG 4.49Å; I232-K236 WeakPolarHBondContact O-CB 3.31Å; I232-K236 WeakPolarHBondContact O-CG 3.12Å; I232-K236 PolarHBondContact O-N 2.75Å; E233-K236 PolarHBondContact O-N 3.13Å; E233-K236 VanDerWaalsContact O-N 3.12Å; K236-F264 HydrophobicContact CG-CZ 4.46Å
237	E	92.8	Very high	91.7	Very high	153 Å²	153	39 Å²	39	72%	0.715	19%	0.194	S	C	*	.	H	α-helix	trans	-80.1	-35	179.8	-70.6	178.3	176.5	0	0	113.1	E233	E233-E237 WeakPolarHBondContact O-CB 3.29Å; E233-E237 WeakPolarHBondContact O-CG 3.3Å; E233-E237 PolarHBondContact O-N 2.77Å
238	N	92.2	Very high	90.8	Very high	23 Å²	23	38.3 Å²	38.3	12%	0.123	21%	0.205	C	C	.	.			trans	-122	137	-172.3	-54.5	-81.4	0	0	0	111.4	A234 V240 V241 T397	A234-N238 VanDerWaalsContact O-CB 3.3Å; A234-N238 WeakPolarHBondContact O-CB 3.16Å; A234-N238 PolarHBondContact O-N 3.46Å; A234-N238 PolarHBondContact O-ND2 3.09Å; N238-V240 VanDerWaalsContact C-N 3.26Å; N238-V240 PolarHBondContact O-N 3.25Å; N238-V241 HydrophobicContact CB-CG2 4.05Å; N238-T397 PolarHBondContact ND2-OG1 3.5Å; N238-T397 PolarHBondContact OD1-OG1 3Å
239	Q	91.6	Very high	90.1	Very high	33 Å²	33	35.9 Å²	35.9	15%	0.154	19%	0.193	C	C	.	.	S	Bend	trans	-69.2	-25.2	174.4	-71.9	174.8	-0.8	0	0	113.1	I362 E366 H373 L374	Q239-I362 HydrophobicContact CB-CG2 3.91Å; Q239-I362 HydrophobicContact CG-CG2 4.36Å; Q239-E366 VanDerWaalsContact NE2-CD 3.26Å; Q239-E366 PolarHBondContact NE2-OE1 2.93Å; Q239-H373 CarbonylContact O-C 3.56Å; Q239-H373 WeakPolarHBondContact O-CA 3.47Å; Q239-L374 PolarHBondContact O-N 2.87Å
240	V	94.8	Very high	89.8	Confident	17 Å²	17	30.5 Å²	30.5	10%	0.103	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	122.3	-179.1	-170.4	0	0	0	0	109.6	N238 I362 L374 F392 P396	N238-V240 VanDerWaalsContact C-N 3.26Å; N238-V240 PolarHBondContact O-N 3.25Å; V240-I362 HydrophobicContact CG2-CD1 3.96Å; V240-L374 WeakPolarHBondContact CA-O 3.39Å; V240-L374 HydrophobicContact CG1-CB 4.45Å; V240-L374 HydrophobicContact CG1-CD2 4.17Å; V240-L374 HydrophobicContact CG1-CG 4.34Å; V240-L374 HydrophobicContact CG2-CB 4.39Å; V240-F392 HydrophobicContact CB-CE1 4.47Å; V240-F392 HydrophobicContact CG1-CD1 4.33Å; V240-F392 HydrophobicContact CG1-CE1 3.91Å; V240-F392 HydrophobicContact CG1-CE2 4.11Å; V240-F392 HydrophobicContact CG1-CZ 3.8Å; V240-F392 HydrophobicContact CG2-CD1 3.89Å; V240-F392 HydrophobicContact CG2-CE1 3.83Å; V240-P396 HydrophobicContact CB-CB 4.24Å; V240-P396 HydrophobicContact CB-CG 4.21Å; V240-P396 HydrophobicContact CG1-CB 3.9Å; V240-P396 HydrophobicContact CG1-CG 3.77Å
241	V	95.8	Very high	89.6	Confident	1 Å²	1	28.8 Å²	28.8	1%	0.006	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	139.9	178.6	178.8	0	0	0	0	109.6	A234 I235 N238 V243 L374 V375 I376 I399	A234-V241 HydrophobicContact CB-CG1 4.27Å; A234-V241 HydrophobicContact CB-CG2 4.15Å; A234-V241 WeakPolarHBondContact O-CG2 3.45Å; I235-V241 HydrophobicContact CB-CG2 4.48Å; I235-V241 HydrophobicContact CG1-CB 4.11Å; I235-V241 HydrophobicContact CG1-CG1 4.4Å; I235-V241 HydrophobicContact CG1-CG2 3.89Å; N238-V241 HydrophobicContact CB-CG2 4.05Å; V241-V243 HydrophobicContact CG1-CG2 4.19Å; V241-L374 PolarHBondContact N-O 3.18Å; V241-V375 CarbonylContact O-C 3.58Å; V241-V375 VanDerWaalsContact O-CA 3.3Å; V241-V375 WeakPolarHBondContact O-CA 3.38Å; V241-I376 PolarHBondContact O-N 2.98Å; V241-I399 HydrophobicContact CG1-CD1 4.14Å; V241-I399 HydrophobicContact CG1-CG1 4.42Å
242	I	95	Very high	89.5	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	118.2	176.2	-52.7	-179.5	0	0	0	109	I376 V383 F386 L387 P396 T397 V398 I399	I242-I376 CarbonylContact C-O 3.57Å; I242-I376 VanDerWaalsContact CA-O 3.3Å; I242-I376 WeakPolarHBondContact CA-O 3.44Å; I242-I376 HydrophobicContact CG1-CB 4.26Å; I242-I376 HydrophobicContact CG2-CB 4.4Å; I242-V383 HydrophobicContact CD1-CB 4.41Å; I242-V383 HydrophobicContact CG2-CB 4.32Å; I242-V383 HydrophobicContact CG2-CG1 3.63Å; I242-F386 HydrophobicContact CD1-CB 3.77Å; I242-L387 HydrophobicContact CD1-CD2 4Å; I242-P396 HydrophobicContact CD1-CB 3.89Å; I242-P396 HydrophobicContact CD1-CG 4.28Å; I242-P396 HydrophobicContact CG1-CB 3.85Å; I242-T397 PolarHBondContact N-O 3Å; I242-V398 HydrophobicContact CB-CG2 4.3Å; I242-V398 HydrophobicContact CD1-CG2 4.4Å; I242-V398 CarbonylContact O-C 3.56Å; I242-V398 WeakPolarHBondContact O-CA 3.38Å; I242-I399 PolarHBondContact O-N 2.88Å
243	V	94.4	Very high	89.4	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	107.4	178.9	-177.3	0	0	0	0	109.4	I231 V241 K251 V375 I376 M377 S378 V401	I231-V243 HydrophobicContact CD1-CG1 4.4Å; V241-V243 HydrophobicContact CG1-CG2 4.19Å; V243-K251 HydrophobicContact CG1-CD 4.28Å; V243-K251 HydrophobicContact CG1-CG 4.27Å; V243-V375 HydrophobicContact CG2-CG1 3.77Å; V243-I376 PolarHBondContact N-O 2.82Å; V243-M377 HydrophobicContact CB-CG 4.35Å; V243-M377 WeakPolarHBondContact O-CA 3.46Å; V243-S378 PolarHBondContact O-N 3.04Å; V243-V401 HydrophobicContact CG1-CG2 3.9Å
244	C	91	Very high	89.4	Confident	2 Å²	2	25.3 Å²	25.3	1%	0.014	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	131.7	178.3	-64	0	0	0	0	110.6	S378 L381 V383 I399 V401	C244-S378 WeakPolarHBondContact CA-O 3.29Å; C244-L381 HydrophobicContact CB-CD2 4.16Å; C244-V383 WeakPolarHBondContact SG-CG1 3.41Å; C244-I399 PolarHBondContact N-O 3.4Å; C244-V401 WeakPolarHBondContact O-CB 3.32Å; C244-V401 PolarHBondContact O-N 3.41Å
245	G	84.6	Confident	89.4	Confident	7 Å²	7	25 Å²	25	7%	0.072	14%	0.14	C	C	.	.			trans	-176.2	149.2	169.1	0	0	0	0	0	110.7	K251 S378 A379	G245-K251 WeakPolarHBondContact O-CD 3.37Å; G245-K251 WeakPolarHBondContact O-CE 3.25Å; G245-K251 PolarHBondContact O-NZ 3.26Å; G245-S378 PolarHBondContact N-O 3.22Å; G245-A379 VanDerWaalsContact O-CA 3.26Å; G245-A379 WeakPolarHBondContact O-CA 3.48Å
246	E	77.6	Confident	89.6	Confident	58 Å²	58	24.9 Å²	24.9	27%	0.271	14%	0.139	S	C	.	.			trans	-63.9	162.3	-172.8	-60.8	-166.6	166.9	0	0	113.5	G248 S249 K251 R404	E246-G248 PolarHBondContact O-N 3.44Å; E246-S249 WeakPolarHBondContact O-CB 3.31Å; E246-S249 PolarHBondContact O-N 3.06Å; E246-S249 VanDerWaalsContact O-N 3.12Å; E246-S249 PolarHBondContact O-OG 2.6Å; E246-K251 PolarHBondContact O-NZ 2.77Å; E246-R404 IonicContact OE1-NE 3.57Å; E246-R404 IonicContact OE1-NH2 3.32Å; E246-R404 WeakPolarHBondContact OE2-CD 3.22Å; E246-R404 WeakPolarHBondContact OE2-CG 3.33Å; E246-R404 IonicContact OE2-CZ 3.96Å; E246-R404 IonicContact OE2-NE 3.93Å; E246-R404 PolarHBondContact OE2-NE 2.9Å; E246-R404 IonicContact OE2-NH2 3.37Å; E246-R404 PolarHBondContact OE2-NH2 3.28Å
247	T	75.5	Confident	89.8	Confident	27 Å²	27	19.7 Å²	19.7	17%	0.166	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	131.6	173.9	63.2	0	0	0	0	110.4	A379 R621	T247-A379 HydrophobicContact CG2-CB 3.8Å; T247-R621 PolarHBondContact OG1-NH2 2.91Å
248	G	72.6	Confident	89.9	Confident	49 Å²	49	12.5 Å²	12.5	51%	0.505	8%	0.083	S	C	.	.	T	Hydrogen-bonded Turn	trans	95.9	-6.6	-174.3	0	0	0	0	0	114.8	E246 G250	E246-G248 PolarHBondContact O-N 3.44Å; G248-G250 PolarHBondContact O-N 3.35Å
249	S	81.4	Confident	90.1	Very high	2 Å²	2	11.4 Å²	11.4	1%	0.014	8%	0.077	C	C	.	.	S	Bend	trans	-69.5	-15.9	172.6	64.2	0	0	0	0	114.1	V224 E246 K251	V224-S249 WeakPolarHBondContact CB-O 3.23Å; V224-S249 VanDerWaalsContact CG1-O 3.24Å; V224-S249 WeakPolarHBondContact CG1-O 3.18Å; V224-S249 PolarHBondContact N-O 3.46Å; V224-S249 VanDerWaalsContact N-O 3.16Å; E246-S249 WeakPolarHBondContact O-CB 3.31Å; E246-S249 PolarHBondContact O-N 3.06Å; E246-S249 VanDerWaalsContact O-N 3.12Å; E246-S249 PolarHBondContact O-OG 2.6Å; S249-K251 WeakPolarHBondContact OG-CG 3.37Å; S249-K251 PolarHBondContact OG-NZ 2.94Å; S249-K251 VanDerWaalsContact OG-NZ 3.11Å
250	G	86	Confident	90.3	Very high	9 Å²	9	11.2 Å²	11.2	9%	0.093	8%	0.075	C	C	.	.	S	Bend	trans	102	-1	177.5	0	0	0	0	0	115.8	G248 S252 T253 Q254	G248-G250 PolarHBondContact O-N 3.35Å; G250-S252 PolarHBondContact O-N 3.45Å; G250-T253 PolarHBondContact O-N 3.42Å; G250-T253 VanDerWaalsContact O-N 3.14Å; G250-T253 PolarHBondContact O-OG1 2.9Å; G250-Q254 WeakPolarHBondContact O-CB 3.19Å; G250-Q254 WeakPolarHBondContact O-CG 3.22Å; G250-Q254 PolarHBondContact O-N 2.79Å
251	K	90.9	Very high	90.3	Very high	3 Å²	3	11 Å²	11	1%	0.013	7%	0.073	C	C	.	.	H	α-helix	trans	-46.3	-60.2	-175.2	-59.7	171.1	-49.2	-58.4	0	114	V224 V243 G245 E246 S249 T253 Q254 V255 M377	V224-K251 HydrophobicContact CG2-CG 4.47Å; V243-K251 HydrophobicContact CG1-CD 4.28Å; V243-K251 HydrophobicContact CG1-CG 4.27Å; G245-K251 WeakPolarHBondContact O-CD 3.37Å; G245-K251 WeakPolarHBondContact O-CE 3.25Å; G245-K251 PolarHBondContact O-NZ 3.26Å; E246-K251 PolarHBondContact O-NZ 2.77Å; S249-K251 WeakPolarHBondContact OG-CG 3.37Å; S249-K251 PolarHBondContact OG-NZ 2.94Å; S249-K251 VanDerWaalsContact OG-NZ 3.11Å; K251-T253 PolarHBondContact O-N 2.92Å; K251-T253 VanDerWaalsContact O-N 3.15Å; K251-Q254 PolarHBondContact O-N 3.18Å; K251-V255 HydrophobicContact CB-CG2 4.47Å; K251-V255 WeakPolarHBondContact O-CB 3.31Å; K251-V255 VanDerWaalsContact O-CG2 3.32Å; K251-V255 WeakPolarHBondContact O-CG2 3.31Å; K251-V255 PolarHBondContact O-N 2.93Å; K251-M377 HydrophobicContact CB-SD 4.25Å
252	S	91.6	Very high	90.2	Very high	21 Å²	21	11.9 Å²	11.9	15%	0.147	8%	0.08	C	C	.	.	H	α-helix	trans	-55.9	-33.8	-176.7	-39.5	0	0	0	0	113.3	G250 P256 D342	G250-S252 PolarHBondContact O-N 3.45Å; S252-P256 WeakPolarHBondContact O-CD 3.28Å; S252-P256 WeakPolarHBondContact O-CG 3.41Å; S252-D342 WeakPolarHBondContact CA-OD2 3.48Å; S252-D342 WeakPolarHBondContact CB-OD2 3.46Å; S252-D342 PolarHBondContact OG-OD2 2.98Å
253	T	92.7	Very high	90.1	Very high	9 Å²	9	12.2 Å²	12.2	6%	0.055	8%	0.084	C	C	.	.	H	α-helix	trans	-89.8	-37.9	-177.9	47.6	0	0	0	0	113	G250 K251 Q257 I284 R287 V288	G250-T253 PolarHBondContact O-N 3.42Å; G250-T253 VanDerWaalsContact O-N 3.14Å; G250-T253 PolarHBondContact O-OG1 2.9Å; K251-T253 PolarHBondContact O-N 2.92Å; K251-T253 VanDerWaalsContact O-N 3.15Å; T253-Q257 WeakPolarHBondContact O-CG 3.42Å; T253-Q257 PolarHBondContact O-NE2 2.84Å; T253-I284 HydrophobicContact CG2-CG2 4.36Å; T253-R287 HydrophobicContact CG2-CG 4.26Å; T253-V288 HydrophobicContact CG2-CG2 4.39Å; T253-V288 WeakPolarHBondContact O-CG2 3.4Å
254	Q	94.7	Very high	90	Very high	0 Å²	0	13.4 Å²	13.4	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-96.5	-37.2	-168.7	-57.9	-52.1	-53.5	0	0	113.2	R219 L222 V224 V225 G250 K251 Q257 F258 E291	R219-Q254 VanDerWaalsContact NE-OE1 3.12Å; L222-Q254 HydrophobicContact CD1-CG 3.78Å; V224-Q254 HydrophobicContact CG1-CB 3.61Å; V224-Q254 HydrophobicContact CG1-CG 3.57Å; V225-Q254 HydrophobicContact CG2-CG 4.21Å; G250-Q254 WeakPolarHBondContact O-CB 3.19Å; G250-Q254 WeakPolarHBondContact O-CG 3.22Å; G250-Q254 PolarHBondContact O-N 2.79Å; K251-Q254 PolarHBondContact O-N 3.18Å; Q254-Q257 WeakPolarHBondContact O-CA 3.14Å; Q254-Q257 WeakPolarHBondContact O-CB 3.4Å; Q254-Q257 PolarHBondContact O-N 2.82Å; Q254-F258 HydrophobicContact CB-CE1 3.93Å; Q254-F258 HydrophobicContact CB-CE2 3.99Å; Q254-F258 HydrophobicContact CB-CZ 3.55Å; Q254-F258 HydrophobicContact CG-CZ 4.48Å; Q254-F258 WeakPolarHBondContact O-CD1 3.46Å; Q254-F258 VanDerWaalsContact O-CG 3.26Å; Q254-F258 WeakPolarHBondContact O-CG 3.44Å; Q254-F258 PolarHBondContact O-N 2.72Å; Q254-E291 PolarHBondContact NE2-OE2 2.68Å
255	V	96.3	Very high	90.1	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-59.7	-41.3	-178.3	-179.5	0	0	0	0	112.3	V224 I231 K251 Q257 F258 L259 L340 V375 M377	V224-V255 HydrophobicContact CG2-CG2 4.37Å; I231-V255 HydrophobicContact CG2-CG1 4.49Å; K251-V255 HydrophobicContact CB-CG2 4.47Å; K251-V255 WeakPolarHBondContact O-CB 3.31Å; K251-V255 VanDerWaalsContact O-CG2 3.32Å; K251-V255 WeakPolarHBondContact O-CG2 3.31Å; K251-V255 PolarHBondContact O-N 2.93Å; V255-Q257 VanDerWaalsContact C-N 3.28Å; V255-Q257 PolarHBondContact O-N 3.3Å; V255-F258 PolarHBondContact O-N 3.29Å; V255-L259 WeakPolarHBondContact O-CG 3.36Å; V255-L259 PolarHBondContact O-N 3.25Å; V255-L259 VanDerWaalsContact O-N 3.15Å; V255-L340 HydrophobicContact CB-CD2 4.22Å; V255-L340 HydrophobicContact CG1-CD2 3.7Å; V255-V375 HydrophobicContact CG1-CG1 4.45Å; V255-M377 HydrophobicContact CB-SD 3.98Å; V255-M377 HydrophobicContact CG1-SD 4.22Å; V255-M377 HydrophobicContact CG2-SD 4.09Å
256	P	96.9	Very high	90.1	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-61.4	-34.4	172.1	-22.8	34	0	0	0	113.5	S252 Y260 V273 I315 F317 L340	S252-P256 WeakPolarHBondContact O-CD 3.28Å; S252-P256 WeakPolarHBondContact O-CG 3.41Å; P256-Y260 PolarHBondContact O-N 3.2Å; P256-Y260 VanDerWaalsContact O-N 3.08Å; P256-V273 HydrophobicContact CB-CG2 4.13Å; P256-V273 HydrophobicContact CG-CG2 3.74Å; P256-I315 HydrophobicContact CB-CD1 4.49Å; P256-I315 HydrophobicContact CB-CG2 4.19Å; P256-F317 HydrophobicContact CB-CZ 4.47Å; P256-F317 HydrophobicContact CG-CZ 4.13Å; P256-L340 HydrophobicContact CG-CD2 4.04Å
257	Q	96.6	Very high	90.2	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-68.5	-45.7	177.1	-60.5	-176.5	49	0	0	110.8	T253 Q254 V255 L259 Y260 E261 V288 E291 M292	T253-Q257 WeakPolarHBondContact O-CG 3.42Å; T253-Q257 PolarHBondContact O-NE2 2.84Å; Q254-Q257 WeakPolarHBondContact O-CA 3.14Å; Q254-Q257 WeakPolarHBondContact O-CB 3.4Å; Q254-Q257 PolarHBondContact O-N 2.82Å; V255-Q257 VanDerWaalsContact C-N 3.28Å; V255-Q257 PolarHBondContact O-N 3.3Å; Q257-L259 VanDerWaalsContact C-N 3.27Å; Q257-L259 PolarHBondContact O-N 3.2Å; Q257-Y260 WeakPolarHBondContact O-CA 3.4Å; Q257-Y260 WeakPolarHBondContact O-CB 3.23Å; Q257-Y260 PolarHBondContact O-N 3.46Å; Q257-E261 PolarHBondContact O-N 2.88Å; Q257-V288 HydrophobicContact CG-CG1 4.08Å; Q257-E291 PolarHBondContact NE2-OE2 2.81Å; Q257-M292 HydrophobicContact CG-CG 3.74Å; Q257-M292 HydrophobicContact CG-SD 3.78Å
258	F	96.2	Very high	90.8	Very high	1 Å²	1	20 Å²	20	0%	0.004	15%	0.152	C	C	.	.	H	α-helix	trans	-57.1	-42.4	177.2	-54.4	-26.9	0	0	0	111.5	V224 V225 E228 I231 I232 Q254 V255 E261 A262	V224-F258 HydrophobicContact CG1-CZ 4.4Å; V224-F258 HydrophobicContact CG2-CE2 4.15Å; V225-F258 HydrophobicContact CG2-CZ 4.27Å; E228-F258 HydrophobicContact CB-CD1 4.28Å; E228-F258 HydrophobicContact CB-CD2 4.35Å; E228-F258 HydrophobicContact CB-CE1 3.96Å; E228-F258 HydrophobicContact CB-CE2 4.04Å; E228-F258 HydrophobicContact CB-CG 4.48Å; E228-F258 HydrophobicContact CB-CZ 3.84Å; E228-F258 VanDerWaalsContact CD-CD1 3.41Å; E228-F258 HydrophobicContact CG-CB 4.4Å; E228-F258 HydrophobicContact CG-CD1 3.61Å; E228-F258 HydrophobicContact CG-CD2 4.16Å; E228-F258 HydrophobicContact CG-CE1 3.76Å; E228-F258 HydrophobicContact CG-CE2 4.29Å; E228-F258 HydrophobicContact CG-CG 3.83Å; E228-F258 HydrophobicContact CG-CZ 4.11Å; E228-F258 WeakPolarHBondContact OE1-CD1 3.46Å; I231-F258 HydrophobicContact CD1-CE2 4.27Å; I232-F258 HydrophobicContact CD1-CB 3.77Å; I232-F258 HydrophobicContact CG1-CB 4.06Å; Q254-F258 HydrophobicContact CB-CE1 3.93Å; Q254-F258 HydrophobicContact CB-CE2 3.99Å; Q254-F258 HydrophobicContact CB-CZ 3.55Å; Q254-F258 HydrophobicContact CG-CZ 4.48Å; Q254-F258 WeakPolarHBondContact O-CD1 3.46Å; Q254-F258 VanDerWaalsContact O-CG 3.26Å; Q254-F258 WeakPolarHBondContact O-CG 3.44Å; Q254-F258 PolarHBondContact O-N 2.72Å; V255-F258 PolarHBondContact O-N 3.29Å; F258-E261 PolarHBondContact O-N 2.88Å; F258-A262 WeakPolarHBondContact O-CB 3.5Å; F258-A262 PolarHBondContact O-N 3.13Å
259	L	96	Very high	91.7	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-66.7	-37.8	176.6	-71.7	172.9	0	0	0	112.6	I232 I235 V255 Q257 G263 F264 I271 A338 L340	I232-L259 HydrophobicContact CD1-CD2 4.13Å; I235-L259 HydrophobicContact CD1-CD2 3.9Å; I235-L259 HydrophobicContact CG2-CD2 4.07Å; V255-L259 WeakPolarHBondContact O-CG 3.36Å; V255-L259 PolarHBondContact O-N 3.25Å; V255-L259 VanDerWaalsContact O-N 3.15Å; Q257-L259 VanDerWaalsContact C-N 3.27Å; Q257-L259 PolarHBondContact O-N 3.2Å; L259-G263 PolarHBondContact O-N 2.92Å; L259-F264 HydrophobicContact CB-CD2 4.3Å; L259-F264 HydrophobicContact CB-CG 4.48Å; L259-F264 HydrophobicContact CD2-CD1 4.24Å; L259-F264 HydrophobicContact CD2-CD2 3.71Å; L259-F264 HydrophobicContact CD2-CE1 4.16Å; L259-F264 HydrophobicContact CD2-CE2 3.61Å; L259-F264 HydrophobicContact CD2-CG 4.03Å; L259-F264 HydrophobicContact CD2-CZ 3.86Å; L259-F264 WeakPolarHBondContact O-CB 3.47Å; L259-F264 VanDerWaalsContact O-CD2 3.28Å; L259-F264 WeakPolarHBondContact O-CD2 3.38Å; L259-F264 PolarHBondContact O-N 2.84Å; L259-F264 VanDerWaalsContact O-N 3.14Å; L259-I271 HydrophobicContact CB-CD1 3.61Å; L259-I271 HydrophobicContact CB-CG1 4.38Å; L259-I271 HydrophobicContact CD1-CG2 4.33Å; L259-A338 HydrophobicContact CD1-CB 4.15Å; L259-L340 HydrophobicContact CD1-CD1 3.67Å; L259-L340 HydrophobicContact CD1-CD2 4.12Å; L259-L340 HydrophobicContact CD1-CG 4.21Å
260	Y	95.4	Very high	92.4	Very high	29 Å²	29	20.6 Å²	20.6	11%	0.114	14%	0.141	C	C	.	.	H	α-helix	trans	-64.6	-48.5	174.8	-178.5	-87.5	0	0	0	111.2	V207 V209 P256 Q257 A262 G263 T265 M292 L294 K314 I315	V207-Y260 HydrophobicContact CB-CD1 4.48Å; V207-Y260 HydrophobicContact CB-CE1 4.25Å; V207-Y260 HydrophobicContact CG1-CD1 4.23Å; V207-Y260 HydrophobicContact CG1-CE1 3.53Å; V209-Y260 HydrophobicContact CG2-CD1 3.92Å; V209-Y260 HydrophobicContact CG2-CE1 3.9Å; P256-Y260 PolarHBondContact O-N 3.2Å; P256-Y260 VanDerWaalsContact O-N 3.08Å; Q257-Y260 WeakPolarHBondContact O-CA 3.4Å; Q257-Y260 WeakPolarHBondContact O-CB 3.23Å; Q257-Y260 PolarHBondContact O-N 3.46Å; Y260-A262 VanDerWaalsContact C-N 3.32Å; Y260-A262 PolarHBondContact O-N 3.05Å; Y260-G263 PolarHBondContact O-N 2.56Å; Y260-G263 VanDerWaalsContact O-N 3.08Å; Y260-T265 HydrophobicContact CD2-CG2 3.95Å; Y260-M292 HydrophobicContact CD1-CE 3.3Å; Y260-M292 HydrophobicContact CD2-CE 4.29Å; Y260-M292 HydrophobicContact CE1-CE 3.77Å; Y260-M292 HydrophobicContact CG-CE 3.6Å; Y260-L294 HydrophobicContact CE1-CD1 4.37Å; Y260-K314 HydrophobicContact CD2-CB 4.2Å; Y260-K314 HydrophobicContact CE2-CB 3.79Å; Y260-K314 HydrophobicContact CE2-CG 4.18Å; Y260-I315 HydrophobicContact CD2-CD1 4.13Å; Y260-I315 HydrophobicContact CD2-CG1 4.11Å; Y260-I315 HydrophobicContact CG-CD1 4.27Å
261	E	94.8	Very high	93	Very high	14 Å²	14	20.2 Å²	20.2	7%	0.065	14%	0.137	C	C	.	.	H	α-helix	trans	-61.4	-37.8	176.8	-74.8	168.7	-93.5	0	0	111.6	H206 V207 V209 R211 R219 Q257 F258 G263	H206-E261 CarbonylContact C-O 3.35Å; H206-E261 VanDerWaalsContact CA-O 3.27Å; H206-E261 WeakPolarHBondContact CA-O 3.41Å; V207-E261 PolarHBondContact N-O 3.21Å; V209-E261 HydrophobicContact CG2-CG 3.79Å; R211-E261 IonicContact CZ-OE1 3.98Å; R211-E261 IonicContact CZ-OE2 3.01Å; R211-E261 IonicContact NH1-OE1 3.37Å; R211-E261 IonicContact NH1-OE2 2.86Å; R211-E261 PolarHBondContact NH1-OE2 3.21Å; R211-E261 IonicContact NH2-OE1 3.36Å; R211-E261 PolarHBondContact NH2-OE1 2.98Å; R211-E261 IonicContact NH2-OE2 2.78Å; R211-E261 PolarHBondContact NH2-OE2 3.34Å; R219-E261 IonicContact NH2-OE1 3.78Å; R219-E261 PolarHBondContact NH2-OE1 3.17Å; R219-E261 IonicContact NH2-OE2 3.44Å; Q257-E261 PolarHBondContact O-N 2.88Å; F258-E261 PolarHBondContact O-N 2.88Å; E261-G263 PolarHBondContact O-N 3.02Å
262	A	93.7	Very high	93.3	Very high	19 Å²	19	20 Å²	20	16%	0.157	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.1	4.5	175.8	0	0	0	0	0	114.6	V205 I232 F258 Y260 F264	V205-A262 CarbonylContact O-C 3.57Å; V205-A262 VanDerWaalsContact O-C 3.28Å; I232-A262 HydrophobicContact CD1-CB 3.92Å; I232-A262 HydrophobicContact CG1-CB 4.42Å; I232-A262 HydrophobicContact CG2-CB 4.02Å; F258-A262 WeakPolarHBondContact O-CB 3.5Å; F258-A262 PolarHBondContact O-N 3.13Å; Y260-A262 VanDerWaalsContact C-N 3.32Å; Y260-A262 PolarHBondContact O-N 3.05Å; A262-F264 HydrophobicContact CB-CD2 3.92Å; A262-F264 HydrophobicContact CB-CE2 3.86Å
263	G	92.7	Very high	93.6	Very high	7 Å²	7	19 Å²	19	7%	0.072	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	83.7	16.2	169.7	0	0	0	0	0	115.9	L259 Y260 E261 T265 T266	L259-G263 PolarHBondContact O-N 2.92Å; Y260-G263 PolarHBondContact O-N 2.56Å; Y260-G263 VanDerWaalsContact O-N 3.08Å; E261-G263 PolarHBondContact O-N 3.02Å; G263-T265 PolarHBondContact O-N 3.04Å; G263-T266 WeakPolarHBondContact O-CG2 3.08Å; G263-T266 PolarHBondContact O-N 3.38Å; G263-T266 PolarHBondContact O-OG1 3.3Å
264	F	93.3	Very high	93.8	Very high	25 Å²	25	18.6 Å²	18.6	11%	0.11	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-11	179.8	-77.2	-104.5	0	0	0	113.7	I235 K236 L259 A262 I271 S337 A338 H373	I235-F264 HydrophobicContact CG2-CE1 4.05Å; I235-F264 HydrophobicContact CG2-CZ 3.77Å; K236-F264 HydrophobicContact CG-CZ 4.46Å; L259-F264 HydrophobicContact CB-CD2 4.3Å; L259-F264 HydrophobicContact CB-CG 4.48Å; L259-F264 HydrophobicContact CD2-CD1 4.24Å; L259-F264 HydrophobicContact CD2-CD2 3.71Å; L259-F264 HydrophobicContact CD2-CE1 4.16Å; L259-F264 HydrophobicContact CD2-CE2 3.61Å; L259-F264 HydrophobicContact CD2-CG 4.03Å; L259-F264 HydrophobicContact CD2-CZ 3.86Å; L259-F264 WeakPolarHBondContact O-CB 3.47Å; L259-F264 VanDerWaalsContact O-CD2 3.28Å; L259-F264 WeakPolarHBondContact O-CD2 3.38Å; L259-F264 PolarHBondContact O-N 2.84Å; L259-F264 VanDerWaalsContact O-N 3.14Å; A262-F264 HydrophobicContact CB-CD2 3.92Å; A262-F264 HydrophobicContact CB-CE2 3.86Å; F264-I271 HydrophobicContact CB-CD1 4.4Å; F264-I271 HydrophobicContact CB-CG1 4.4Å; F264-S337 VanDerWaalsContact O-CB 3.22Å; F264-S337 WeakPolarHBondContact O-CB 3.34Å; F264-S337 PolarHBondContact O-OG 3.04Å; F264-A338 HydrophobicContact CD1-CB 4.37Å; F264-H373 AromaticContact CE1-CE1 3.83Å; F264-H373 AromaticContact CE1-CG 3.92Å; F264-H373 AromaticContact CE1-ND1 3.56Å
265	T	92	Very high	93.7	Very high	7 Å²	7	18.7 Å²	18.7	4%	0.043	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.9	0.6	-178.8	59.8	0	0	0	0	114.1	Y260 G263 K269 I271 K314	Y260-T265 HydrophobicContact CD2-CG2 3.95Å; G263-T265 PolarHBondContact O-N 3.04Å; T265-K269 VanDerWaalsContact CA-O 3.31Å; T265-K269 WeakPolarHBondContact CA-O 3.3Å; T265-I271 HydrophobicContact CG2-CD1 3.56Å; T265-I271 HydrophobicContact CG2-CG1 3.78Å; T265-K314 HydrophobicContact CG2-CB 4.08Å
266	T	84.3	Confident	93.2	Very high	86 Å²	86	20.4 Å²	20.4	53%	0.528	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-28.2	-172.7	55.4	0	0	0	0	114.1	V205 V207 G263 G268	V205-T266 HydrophobicContact CG1-CG2 3.84Å; V207-T266 HydrophobicContact CG2-CG2 3.93Å; G263-T266 WeakPolarHBondContact O-CG2 3.08Å; G263-T266 PolarHBondContact O-N 3.38Å; G263-T266 PolarHBondContact O-OG1 3.3Å; T266-G268 PolarHBondContact O-N 2.98Å
267	A	81.4	Confident	92.5	Very high	80 Å²	80	23.8 Å²	23.8	66%	0.661	15%	0.151	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.6	24.5	177.7	0	0	0	0	0	114.1	K269	A267-K269 PolarHBondContact O-N 3.22Å
268	G	86.6	Confident	91.9	Very high	59 Å²	59	29.1 Å²	29.1	61%	0.608	17%	0.171	S	C	*	.	S	Bend	trans	72	4.5	-173.5	0	0	0	0	0	114.7	T266	T266-G268 PolarHBondContact O-N 2.98Å
269	K	93	Very high	91.1	Very high	30 Å²	30	32.5 Å²	32.5	13%	0.13	19%	0.192	C	C	.	.			trans	-91.5	162.6	-179.5	-64.7	-171.7	172.9	-162.3	0	112.6	T265 A267 S334 S335 D370	T265-K269 VanDerWaalsContact CA-O 3.31Å; T265-K269 WeakPolarHBondContact CA-O 3.3Å; A267-K269 PolarHBondContact O-N 3.22Å; K269-S334 WeakPolarHBondContact CE-O 3.39Å; K269-S335 WeakPolarHBondContact CA-O 3.37Å; K269-D370 IonicContact NZ-OD1 2.79Å; K269-D370 PolarHBondContact NZ-OD1 3.01Å; K269-D370 IonicContact NZ-OD2 3.62Å; K269-D370 PolarHBondContact NZ-OD2 2.95Å
270	M	96	Very high	90.6	Very high	34 Å²	34	32.9 Å²	32.9	17%	0.167	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	160	-180	-61.8	-174.9	-70.6	0	0	112.4	T313 K314 S335 Y336 S337	M270-T313 WeakPolarHBondContact CG-O 3.44Å; M270-T313 HydrophobicContact SD-CG2 3.81Å; M270-T313 VanDerWaalsContact SD-O 3.36Å; M270-K314 WeakPolarHBondContact CA-O 3.31Å; M270-S335 PolarHBondContact N-O 3.44Å; M270-Y336 HydrophobicContact CB-CD1 4.13Å; M270-Y336 HydrophobicContact CB-CE1 4.25Å; M270-Y336 HydrophobicContact CE-CE1 4.38Å; M270-Y336 WeakPolarHBondContact O-CA 3.06Å; M270-S337 PolarHBondContact O-N 3.11Å; M270-S337 PolarHBondContact O-OG 3.33Å
271	I	97.9	Very high	90.3	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	122.4	167.5	-62.3	161.3	0	0	0	107.9	L259 F264 T265 V273 K314 I315 K316 L340	L259-I271 HydrophobicContact CB-CD1 3.61Å; L259-I271 HydrophobicContact CB-CG1 4.38Å; L259-I271 HydrophobicContact CD1-CG2 4.33Å; F264-I271 HydrophobicContact CB-CD1 4.4Å; F264-I271 HydrophobicContact CB-CG1 4.4Å; T265-I271 HydrophobicContact CG2-CD1 3.56Å; T265-I271 HydrophobicContact CG2-CG1 3.78Å; I271-V273 HydrophobicContact CG2-CG2 4.36Å; I271-K314 PolarHBondContact N-O 2.7Å; I271-I315 HydrophobicContact CD1-CG1 4.4Å; I271-K316 PolarHBondContact O-N 3.47Å; I271-L340 HydrophobicContact CG2-CD1 3.46Å; I271-L340 VanDerWaalsContact CG2-CD1 3.46Å
272	G	97.6	Very high	90	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	128	175.6	0	0	0	0	0	111.2	K316 A338 I339 L340	G272-K316 CarbonylContact C-O 3.53Å; G272-K316 WeakPolarHBondContact CA-O 3.47Å; G272-A338 PolarHBondContact N-O 3.27Å; G272-I339 CarbonylContact O-C 3.59Å; G272-I339 WeakPolarHBondContact O-CA 3.39Å; G272-L340 PolarHBondContact O-N 3.01Å
273	V	97.9	Very high	89.7	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	123.5	175.5	-172.6	0	0	0	0	108.8	P256 I271 K316 F317 M318 L340 M377	P256-V273 HydrophobicContact CB-CG2 4.13Å; P256-V273 HydrophobicContact CG-CG2 3.74Å; I271-V273 HydrophobicContact CG2-CG2 4.36Å; V273-K316 PolarHBondContact N-O 2.94Å; V273-F317 HydrophobicContact CB-CD1 3.73Å; V273-F317 HydrophobicContact CB-CE1 3.77Å; V273-F317 HydrophobicContact CB-CG 4.34Å; V273-F317 HydrophobicContact CB-CZ 4.42Å; V273-F317 HydrophobicContact CG1-CD1 3.84Å; V273-F317 HydrophobicContact CG1-CE1 3.66Å; V273-F317 HydrophobicContact CG2-CD1 4.37Å; V273-F317 HydrophobicContact CG2-CE1 4.02Å; V273-F317 HydrophobicContact CG2-CZ 4.2Å; V273-F317 CarbonylContact O-C 3.41Å; V273-F317 WeakPolarHBondContact O-CA 3.36Å; V273-M318 PolarHBondContact O-N 3Å; V273-L340 HydrophobicContact CB-CB 4.47Å; V273-L340 HydrophobicContact CG1-CB 4.21Å; V273-L340 HydrophobicContact CG2-CB 4.28Å; V273-L340 HydrophobicContact CG2-CD1 4.17Å; V273-L340 HydrophobicContact CG2-CD2 4.28Å; V273-L340 HydrophobicContact CG2-CG 4.48Å; V273-M377 HydrophobicContact CG1-CE 4.41Å
274	T	97	Very high	89.6	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	136.9	178	55.9	0	0	0	0	111.6	M318 L323 L340 I341 D342	T274-M318 CarbonylContact C-O 3.55Å; T274-M318 VanDerWaalsContact CA-O 3.28Å; T274-M318 WeakPolarHBondContact CA-O 3.49Å; T274-M318 HydrophobicContact CG2-CG 3.92Å; T274-L323 HydrophobicContact CG2-CB 3.89Å; T274-L323 HydrophobicContact CG2-CD2 3.55Å; T274-L323 HydrophobicContact CG2-CG 4.33Å; T274-L340 PolarHBondContact N-O 3.41Å; T274-L340 PolarHBondContact OG1-O 2.93Å; T274-I341 WeakPolarHBondContact OG1-CA 3.22Å; T274-D342 WeakPolarHBondContact O-CB 3.22Å; T274-D342 PolarHBondContact O-N 2.97Å
275	E	92.3	Very high	89.7	Confident	2 Å²	2	35.2 Å²	35.2	1%	0.009	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	135.7	177.9	-76.2	-71.5	162.8	0	0	109.6	R277 A280 A281 I284 M318 T319 D342	E275-R277 PolarHBondContact O-N 2.85Å; E275-R277 VanDerWaalsContact O-N 3.14Å; E275-A280 HydrophobicContact CB-CB 4.37Å; E275-A280 HydrophobicContact CG-CB 4.38Å; E275-A281 HydrophobicContact CB-CB 4.11Å; E275-A281 HydrophobicContact CG-CB 4.45Å; E275-I284 HydrophobicContact CG-CD1 4.21Å; E275-I284 WeakPolarHBondContact OE1-CD1 3.22Å; E275-M318 PolarHBondContact N-O 3.27Å; E275-T319 VanDerWaalsContact O-CA 3.3Å; E275-T319 WeakPolarHBondContact O-CA 3.45Å; E275-D342 WeakPolarHBondContact OE1-CB 3.37Å; E275-D342 VanDerWaalsContact OE1-OD2 3.07Å
276	P	86.2	Confident	89.7	Confident	36 Å²	36	37 Å²	37	23%	0.234	21%	0.214	C	C	.	.	S	Bend	trans	-64.9	-22.5	179.4	24.3	-33.1	0	0	0	112.5	E343 E346	P276-E343 HydrophobicContact CG-CB 3.94Å; P276-E343 HydrophobicContact CG-CG 4.5Å; P276-E346 WeakPolarHBondContact CG-OE2 3.36Å
277	R	82.6	Confident	90	Very high	71 Å²	71	38.6 Å²	38.6	27%	0.268	21%	0.21	S	C	.	.	S	Bend	trans	-119.7	135.4	-173.1	-61.2	-179.5	-174.2	170.1	-8	112.8	E275 V279 A280 A281 E346 T572 S573	E275-R277 PolarHBondContact O-N 2.85Å; E275-R277 VanDerWaalsContact O-N 3.14Å; R277-V279 PolarHBondContact O-N 3.02Å; R277-A280 HydrophobicContact CB-CB 4.09Å; R277-A280 WeakPolarHBondContact O-CB 3.45Å; R277-A280 PolarHBondContact O-N 3.29Å; R277-A280 VanDerWaalsContact O-N 3.14Å; R277-A281 PolarHBondContact O-N 2.99Å; R277-E346 IonicContact CZ-OE1 2.94Å; R277-E346 IonicContact NE-OE1 3.5Å; R277-E346 IonicContact NH2-OE1 3.42Å; R277-E346 PolarHBondContact NH2-OE1 3.39Å; R277-T572 VanDerWaalsContact NH1-C 3.32Å; R277-T572 PolarHBondContact NH1-O 3.47Å; R277-T572 PolarHBondContact NH1-OG1 3.28Å; R277-T572 PolarHBondContact NH2-OG1 2.91Å; R277-S573 WeakPolarHBondContact CD-OG 3.39Å; R277-S573 PolarHBondContact NH1-OG 2.82Å
278	R	82.7	Confident	90.6	Very high	111 Å²	111	34.8 Å²	34.8	42%	0.419	18%	0.179	S	C	.	.	H	α-helix	trans	-56.9	-44.9	177	-61.5	-176.8	-169.4	-179.7	9	113.1	A280 A281 I282 I303 T319	R278-A280 VanDerWaalsContact C-N 3.29Å; R278-A280 PolarHBondContact O-N 3Å; R278-A281 PolarHBondContact O-N 2.91Å; R278-I282 WeakPolarHBondContact O-CG1 3.49Å; R278-I282 PolarHBondContact O-N 2.83Å; R278-I282 VanDerWaalsContact O-N 3.11Å; R278-I303 HydrophobicContact CB-CB 4.47Å; R278-I303 HydrophobicContact CB-CD1 4.08Å; R278-I303 HydrophobicContact CB-CG2 4.2Å; R278-I303 HydrophobicContact CG-CB 4.2Å; R278-I303 HydrophobicContact CG-CD1 4.36Å; R278-I303 HydrophobicContact CG-CG2 4.31Å; R278-T319 HydrophobicContact CG-CG2 3.88Å
279	V	80.5	Confident	91	Very high	73 Å²	73	32 Å²	32	44%	0.442	15%	0.15	S	C	.	.	H	α-helix	trans	-65.6	-34.8	-179.2	179.5	0	0	0	0	111.4	R277 N283	R277-V279 PolarHBondContact O-N 3.02Å; V279-N283 WeakPolarHBondContact CG1-ND2 3.21Å; V279-N283 VanDerWaalsContact O-CB 3.3Å; V279-N283 WeakPolarHBondContact O-CB 3.44Å; V279-N283 VanDerWaalsContact O-CG 3.27Å; V279-N283 PolarHBondContact O-N 3.19Å; V279-N283 PolarHBondContact O-ND2 3.44Å
280	A	85.2	Confident	91	Very high	8 Å²	8	35.2 Å²	35.2	7%	0.066	17%	0.168	C	C	.	.	H	α-helix	trans	-67.3	-48.9	175.9	0	0	0	0	0	110.5	E275 R277 R278 I282 N283 I284	E275-A280 HydrophobicContact CB-CB 4.37Å; E275-A280 HydrophobicContact CG-CB 4.38Å; R277-A280 HydrophobicContact CB-CB 4.09Å; R277-A280 WeakPolarHBondContact O-CB 3.45Å; R277-A280 PolarHBondContact O-N 3.29Å; R277-A280 VanDerWaalsContact O-N 3.14Å; R278-A280 VanDerWaalsContact C-N 3.29Å; R278-A280 PolarHBondContact O-N 3Å; A280-I282 VanDerWaalsContact C-N 3.33Å; A280-I282 PolarHBondContact O-N 3.43Å; A280-N283 PolarHBondContact O-N 3.18Å; A280-I284 HydrophobicContact CB-CD1 4.13Å; A280-I284 VanDerWaalsContact O-CB 3.3Å; A280-I284 WeakPolarHBondContact O-CB 3.21Å; A280-I284 WeakPolarHBondContact O-CD1 3.21Å; A280-I284 WeakPolarHBondContact O-CG1 3.33Å; A280-I284 PolarHBondContact O-N 3.38Å
281	A	88.8	Confident	90.9	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-54	-45.8	177	0	0	0	0	0	112.8	E275 R277 R278 S285 I303	E275-A281 HydrophobicContact CB-CB 4.11Å; E275-A281 HydrophobicContact CG-CB 4.45Å; R277-A281 PolarHBondContact O-N 2.99Å; R278-A281 PolarHBondContact O-N 2.91Å; A281-S285 WeakPolarHBondContact O-CB 3.33Å; A281-S285 PolarHBondContact O-N 2.89Å; A281-S285 VanDerWaalsContact O-N 3.12Å; A281-I303 HydrophobicContact CB-CG2 4Å
282	I	88.4	Confident	90.6	Very high	31 Å²	31	34.7 Å²	34.7	16%	0.159	17%	0.166	C	C	.	.	H	α-helix	trans	-65.6	-53.8	177.9	-61.5	166.4	0	0	0	110.9	R278 A280 I284 S285 H286 Y301 I303	R278-I282 WeakPolarHBondContact O-CG1 3.49Å; R278-I282 PolarHBondContact O-N 2.83Å; R278-I282 VanDerWaalsContact O-N 3.11Å; A280-I282 VanDerWaalsContact C-N 3.33Å; A280-I282 PolarHBondContact O-N 3.43Å; I282-I284 PolarHBondContact O-N 2.97Å; I282-S285 WeakPolarHBondContact O-CB 3.15Å; I282-S285 PolarHBondContact O-N 3.41Å; I282-H286 PolarHBondContact O-N 2.88Å; I282-Y301 HydrophobicContact CD1-CE2 4.39Å; I282-Y301 HydrophobicContact CG1-CD1 4.44Å; I282-Y301 HydrophobicContact CG1-CD2 3.81Å; I282-Y301 HydrophobicContact CG1-CE1 4.38Å; I282-Y301 HydrophobicContact CG1-CE2 3.74Å; I282-Y301 HydrophobicContact CG1-CG 4.17Å; I282-Y301 HydrophobicContact CG2-CD1 4.46Å; I282-Y301 HydrophobicContact CG2-CE1 4.18Å; I282-I303 HydrophobicContact CD1-CD1 3.82Å; I282-I303 HydrophobicContact CG1-CD1 4.27Å
283	N	87.6	Confident	90.5	Very high	84 Å²	84	40.3 Å²	40.3	45%	0.449	20%	0.196	S	C	.	.	H	α-helix	trans	-67.8	-37.4	-172.3	-73.2	-16.3	0	0	0	112.5	V279 A280 R287	V279-N283 WeakPolarHBondContact CG1-ND2 3.21Å; V279-N283 VanDerWaalsContact O-CB 3.3Å; V279-N283 WeakPolarHBondContact O-CB 3.44Å; V279-N283 VanDerWaalsContact O-CG 3.27Å; V279-N283 PolarHBondContact O-N 3.19Å; V279-N283 PolarHBondContact O-ND2 3.44Å; A280-N283 PolarHBondContact O-N 3.18Å; N283-R287 VanDerWaalsContact O-CB 3.25Å; N283-R287 WeakPolarHBondContact O-CB 3.47Å; N283-R287 PolarHBondContact O-N 3.13Å
284	I	90.8	Very high	90.2	Very high	28 Å²	28	42.9 Å²	42.9	14%	0.144	21%	0.209	C	C	.	.	H	α-helix	trans	-70.9	-41.5	177.8	-61	166.7	0	0	0	109.6	T253 E275 A280 I282 H286 R287 V288 F317	T253-I284 HydrophobicContact CG2-CG2 4.36Å; E275-I284 HydrophobicContact CG-CD1 4.21Å; E275-I284 WeakPolarHBondContact OE1-CD1 3.22Å; A280-I284 HydrophobicContact CB-CD1 4.13Å; A280-I284 VanDerWaalsContact O-CB 3.3Å; A280-I284 WeakPolarHBondContact O-CB 3.21Å; A280-I284 WeakPolarHBondContact O-CD1 3.21Å; A280-I284 WeakPolarHBondContact O-CG1 3.33Å; A280-I284 PolarHBondContact O-N 3.38Å; I282-I284 PolarHBondContact O-N 2.97Å; I284-H286 PolarHBondContact O-N 2.89Å; I284-R287 PolarHBondContact O-N 3.42Å; I284-V288 HydrophobicContact CG2-CG2 4.2Å; I284-V288 WeakPolarHBondContact O-CB 3.28Å; I284-V288 WeakPolarHBondContact O-CG2 3.4Å; I284-V288 PolarHBondContact O-N 2.81Å; I284-F317 HydrophobicContact CB-CD1 4.31Å; I284-F317 HydrophobicContact CB-CE1 4.1Å; I284-F317 HydrophobicContact CG2-CD1 4.02Å; I284-F317 HydrophobicContact CG2-CE1 3.33Å; I284-F317 HydrophobicContact CG2-CZ 3.73Å
285	S	94	Very high	90.1	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-55.6	-51.1	172.9	174.3	0	0	0	0	111.9	A281 I282 R287 V288 A289 V299 S300	A281-S285 WeakPolarHBondContact O-CB 3.33Å; A281-S285 PolarHBondContact O-N 2.89Å; A281-S285 VanDerWaalsContact O-N 3.12Å; I282-S285 WeakPolarHBondContact O-CB 3.15Å; I282-S285 PolarHBondContact O-N 3.41Å; S285-R287 PolarHBondContact O-N 2.95Å; S285-V288 PolarHBondContact O-N 2.96Å; S285-A289 WeakPolarHBondContact O-CB 3.25Å; S285-A289 PolarHBondContact O-N 2.95Å; S285-V299 WeakPolarHBondContact O-CG1 3.46Å; S285-V299 PolarHBondContact OG-O 3.46Å; S285-S300 VanDerWaalsContact OG-C 3.29Å; S285-S300 PolarHBondContact OG-O 2.88Å
286	H	92.3	Very high	90.1	Very high	43 Å²	43	51.5 Å²	51.5	20%	0.199	25%	0.25	C	S	.	.	H	α-helix	trans	-60.4	-45.3	177.1	-69.3	175.1	0	0	0	111.9	I282 I284 V288 A289 D290 Y301	I282-H286 PolarHBondContact O-N 2.88Å; I284-H286 PolarHBondContact O-N 2.89Å; H286-V288 PolarHBondContact O-N 3.13Å; H286-A289 WeakPolarHBondContact O-CB 3.33Å; H286-A289 PolarHBondContact O-N 3.24Å; H286-D290 PolarHBondContact O-N 2.96Å; H286-Y301 AromaticContact NE2-CE1 3.77Å
287	R	90.6	Very high	90.3	Very high	121 Å²	121	53 Å²	53	46%	0.457	26%	0.257	S	S	.	.	H	α-helix	trans	-61.7	-42.1	178.9	179.6	172	174.2	175.3	-0.5	112.4	T253 N283 I284 S285 D290 E291	T253-R287 HydrophobicContact CG2-CG 4.26Å; N283-R287 VanDerWaalsContact O-CB 3.25Å; N283-R287 WeakPolarHBondContact O-CB 3.47Å; N283-R287 PolarHBondContact O-N 3.13Å; I284-R287 PolarHBondContact O-N 3.42Å; S285-R287 PolarHBondContact O-N 2.95Å; R287-D290 PolarHBondContact O-N 3.15Å; R287-E291 HydrophobicContact CG-CG 4.36Å; R287-E291 IonicContact CZ-OE1 3.8Å; R287-E291 IonicContact NE-OE1 3.13Å; R287-E291 PolarHBondContact NE-OE1 3.15Å; R287-E291 IonicContact NH2-OE1 2.85Å; R287-E291 PolarHBondContact NH2-OE1 3.39Å; R287-E291 WeakPolarHBondContact O-CB 3.23Å; R287-E291 WeakPolarHBondContact O-CG 3.23Å; R287-E291 PolarHBondContact O-N 3.43Å
288	V	94.7	Very high	90.9	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-69	-38.1	177.8	172.5	0	0	0	0	111	T253 Q257 I284 S285 H286 D290 E291 M292 V299 I315 F317	T253-V288 HydrophobicContact CG2-CG2 4.39Å; T253-V288 WeakPolarHBondContact O-CG2 3.4Å; Q257-V288 HydrophobicContact CG-CG1 4.08Å; I284-V288 HydrophobicContact CG2-CG2 4.2Å; I284-V288 WeakPolarHBondContact O-CB 3.28Å; I284-V288 WeakPolarHBondContact O-CG2 3.4Å; I284-V288 PolarHBondContact O-N 2.81Å; S285-V288 PolarHBondContact O-N 2.96Å; H286-V288 PolarHBondContact O-N 3.13Å; V288-D290 VanDerWaalsContact C-N 3.35Å; V288-D290 PolarHBondContact O-N 3.21Å; V288-E291 PolarHBondContact O-N 3.48Å; V288-M292 HydrophobicContact CG1-CG 4.2Å; V288-M292 HydrophobicContact CG1-SD 3.67Å; V288-M292 WeakPolarHBondContact O-CB 3.37Å; V288-M292 VanDerWaalsContact O-CG 3.25Å; V288-M292 WeakPolarHBondContact O-CG 3.36Å; V288-M292 PolarHBondContact O-N 3.45Å; V288-V299 HydrophobicContact CB-CG1 4.14Å; V288-V299 HydrophobicContact CG1-CG1 3.99Å; V288-V299 HydrophobicContact CG1-CG2 4.49Å; V288-I315 HydrophobicContact CG1-CD1 4.48Å; V288-F317 HydrophobicContact CB-CE2 4.18Å; V288-F317 HydrophobicContact CB-CZ 4.32Å; V288-F317 HydrophobicContact CG1-CE2 4.4Å; V288-F317 HydrophobicContact CG2-CE2 4.25Å; V288-F317 HydrophobicContact CG2-CZ 3.88Å
289	A	94.8	Very high	91.6	Very high	1 Å²	1	45.5 Å²	45.5	1%	0.008	23%	0.231	C	C	.	.	H	α-helix	trans	-59	-46.7	173.2	0	0	0	0	0	111.5	S285 H286 N293 L294 R296 V299	S285-A289 WeakPolarHBondContact O-CB 3.25Å; S285-A289 PolarHBondContact O-N 2.95Å; H286-A289 WeakPolarHBondContact O-CB 3.33Å; H286-A289 PolarHBondContact O-N 3.24Å; A289-N293 PolarHBondContact O-N 3.17Å; A289-N293 VanDerWaalsContact O-N 3.1Å; A289-L294 PolarHBondContact O-N 3.29Å; A289-R296 HydrophobicContact CB-CG 4.4Å; A289-V299 HydrophobicContact CB-CB 3.93Å; A289-V299 HydrophobicContact CB-CG1 4.27Å
290	D	93	Very high	92.4	Very high	96 Å²	96	42 Å²	42	51%	0.513	21%	0.21	S	C	.	.	H	α-helix	trans	-66.3	-44.3	178.3	-63.6	-20.5	0	0	0	111.3	I215 H286 R287 V288 M292 N293	I215-D290 WeakPolarHBondContact CD1-O 3.36Å; H286-D290 PolarHBondContact O-N 2.96Å; R287-D290 PolarHBondContact O-N 3.15Å; V288-D290 VanDerWaalsContact C-N 3.35Å; V288-D290 PolarHBondContact O-N 3.21Å; D290-M292 VanDerWaalsContact C-N 3.34Å; D290-M292 PolarHBondContact O-N 2.84Å; D290-N293 PolarHBondContact O-N 2.9Å
291	E	93.1	Very high	92.9	Very high	23 Å²	23	42.7 Å²	42.7	11%	0.107	21%	0.211	C	C	.	.	H	α-helix	trans	-64.2	-35	178.3	-77.6	-177.3	-164.7	0	0	113.1	R211 I215 Q254 Q257 R287 V288	R211-E291 WeakPolarHBondContact CG-O 3.34Å; I215-E291 HydrophobicContact CG2-CB 4.22Å; I215-E291 HydrophobicContact CG2-CG 4.23Å; Q254-E291 PolarHBondContact NE2-OE2 2.68Å; Q257-E291 PolarHBondContact NE2-OE2 2.81Å; R287-E291 HydrophobicContact CG-CG 4.36Å; R287-E291 IonicContact CZ-OE1 3.8Å; R287-E291 IonicContact NE-OE1 3.13Å; R287-E291 PolarHBondContact NE-OE1 3.15Å; R287-E291 IonicContact NH2-OE1 2.85Å; R287-E291 PolarHBondContact NH2-OE1 3.39Å; R287-E291 WeakPolarHBondContact O-CB 3.23Å; R287-E291 WeakPolarHBondContact O-CG 3.23Å; R287-E291 PolarHBondContact O-N 3.43Å; V288-E291 PolarHBondContact O-N 3.48Å
292	M	93.7	Very high	93	Very high	1 Å²	1	45.2 Å²	45.2	1%	0.005	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-5.9	177.7	-64.6	180	79.9	0	0	113.5	V209 Q257 Y260 V288 D290 L294 V299 I315	V209-M292 HydrophobicContact CG1-CB 3.93Å; V209-M292 HydrophobicContact CG1-CE 4.48Å; V209-M292 HydrophobicContact CG1-CG 4.34Å; V209-M292 VanDerWaalsContact CG1-O 3.3Å; V209-M292 WeakPolarHBondContact CG1-O 3.5Å; V209-M292 HydrophobicContact CG2-CE 3.94Å; Q257-M292 HydrophobicContact CG-CG 3.74Å; Q257-M292 HydrophobicContact CG-SD 3.78Å; Y260-M292 HydrophobicContact CD1-CE 3.3Å; Y260-M292 HydrophobicContact CD2-CE 4.29Å; Y260-M292 HydrophobicContact CE1-CE 3.77Å; Y260-M292 HydrophobicContact CG-CE 3.6Å; V288-M292 HydrophobicContact CG1-CG 4.2Å; V288-M292 HydrophobicContact CG1-SD 3.67Å; V288-M292 WeakPolarHBondContact O-CB 3.37Å; V288-M292 VanDerWaalsContact O-CG 3.25Å; V288-M292 WeakPolarHBondContact O-CG 3.36Å; V288-M292 PolarHBondContact O-N 3.45Å; D290-M292 VanDerWaalsContact C-N 3.34Å; D290-M292 PolarHBondContact O-N 2.84Å; M292-L294 HydrophobicContact CB-CB 4.3Å; M292-L294 HydrophobicContact CB-CD1 3.88Å; M292-L294 HydrophobicContact CB-CG 3.85Å; M292-L294 HydrophobicContact CE-CD1 3.65Å; M292-L294 PolarHBondContact O-N 3.06Å; M292-L294 HydrophobicContact SD-CD1 4.07Å; M292-V299 HydrophobicContact SD-CG2 4.16Å; M292-I315 HydrophobicContact CE-CD1 4.11Å; M292-I315 HydrophobicContact SD-CD1 3.71Å
293	N	93.7	Very high	93	Very high	117 Å²	117	44 Å²	44	63%	0.626	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.5	41.5	-172	-167.4	28.8	0	0	0	112.2	F210 A289 D290	F210-N293 WeakPolarHBondContact O-CB 3.12Å; F210-N293 PolarHBondContact O-ND2 3.19Å; F210-N293 VanDerWaalsContact O-ND2 3.14Å; A289-N293 PolarHBondContact O-N 3.17Å; A289-N293 VanDerWaalsContact O-N 3.1Å; D290-N293 PolarHBondContact O-N 2.9Å
294	L	93.4	Very high	92.2	Very high	54 Å²	54	44 Å²	44	28%	0.283	21%	0.21	S	C	.	.			trans	-113.4	157.1	-180	-68.1	178.8	0	0	0	111.2	Y260 A289 M292 V298 V299	Y260-L294 HydrophobicContact CE1-CD1 4.37Å; A289-L294 PolarHBondContact O-N 3.29Å; M292-L294 HydrophobicContact CB-CB 4.3Å; M292-L294 HydrophobicContact CB-CD1 3.88Å; M292-L294 HydrophobicContact CB-CG 3.85Å; M292-L294 HydrophobicContact CE-CD1 3.65Å; M292-L294 PolarHBondContact O-N 3.06Å; M292-L294 HydrophobicContact SD-CD1 4.07Å; L294-V298 HydrophobicContact CB-CB 4.49Å; L294-V298 HydrophobicContact CD1-CG1 4.02Å; L294-V299 HydrophobicContact CB-CG2 4.43Å; L294-V299 HydrophobicContact CD1-CG2 4.34Å
295	S	92.9	Very high	91	Very high	57 Å²	57	46.9 Å²	46.9	40%	0.399	22%	0.221	S	C	.	.			trans	-69.8	152.4	175.5	75.5	0	0	0	0	111.5	D297 V298 V299	S295-D297 PolarHBondContact O-N 3.2Å; S295-D297 VanDerWaalsContact O-N 3.09Å; S295-V298 PolarHBondContact O-N 3.44Å; S295-V299 PolarHBondContact O-N 2.89Å
296	R	92.2	Very high	90.2	Very high	126 Å²	126	51.8 Å²	51.8	48%	0.475	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-11.7	174.7	-61.7	-176.1	-177.7	173.6	0.6	113.6	A289 V299 N308	A289-R296 HydrophobicContact CB-CG 4.4Å; R296-V299 CarbonylContact C-O 3.57Å; R296-V299 WeakPolarHBondContact CA-O 3.37Å; R296-V299 CarbonylContact O-C 3.28Å; R296-N308 PolarHBondContact O-ND2 3.27Å
297	D	92.4	Very high	89.8	Confident	69 Å²	69	51.4 Å²	51.4	37%	0.369	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-32	172.4	-55.5	-25.4	0	0	0	111.5	S295 T310 K312 T313	S295-D297 PolarHBondContact O-N 3.2Å; S295-D297 VanDerWaalsContact O-N 3.09Å; D297-T310 PolarHBondContact O-OG1 2.73Å; D297-K312 HydrophobicContact CB-CB 4.47Å; D297-T313 VanDerWaalsContact O-CA 3.23Å; D297-T313 WeakPolarHBondContact O-CA 3.41Å; D297-T313 PolarHBondContact O-N 3.03Å; D297-T313 PolarHBondContact O-OG1 3.45Å
298	V	94.7	Very high	89.8	Confident	24 Å²	24	47.5 Å²	47.5	15%	0.145	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-43.9	179.6	-179.8	0	0	0	0	110.9	L294 S295 K314 I315	L294-V298 HydrophobicContact CB-CB 4.49Å; L294-V298 HydrophobicContact CD1-CG1 4.02Å; S295-V298 PolarHBondContact O-N 3.44Å; V298-K314 HydrophobicContact CG1-CB 4.02Å; V298-K314 HydrophobicContact CG1-CG 4.02Å; V298-K314 PolarHBondContact O-N 2.77Å; V298-I315 PolarHBondContact O-N 2.91Å; V298-I315 VanDerWaalsContact O-N 3.14Å
299	V	96.8	Very high	89.7	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	97.1	172.5	-176.8	0	0	0	0	108.1	S285 V288 A289 M292 L294 S295 R296 I315 F317	S285-V299 WeakPolarHBondContact O-CG1 3.46Å; S285-V299 PolarHBondContact OG-O 3.46Å; V288-V299 HydrophobicContact CB-CG1 4.14Å; V288-V299 HydrophobicContact CG1-CG1 3.99Å; V288-V299 HydrophobicContact CG1-CG2 4.49Å; A289-V299 HydrophobicContact CB-CB 3.93Å; A289-V299 HydrophobicContact CB-CG1 4.27Å; M292-V299 HydrophobicContact SD-CG2 4.16Å; L294-V299 HydrophobicContact CB-CG2 4.43Å; L294-V299 HydrophobicContact CD1-CG2 4.34Å; S295-V299 PolarHBondContact O-N 2.89Å; R296-V299 CarbonylContact C-O 3.57Å; R296-V299 WeakPolarHBondContact CA-O 3.37Å; R296-V299 CarbonylContact O-C 3.28Å; V299-I315 WeakPolarHBondContact CA-O 3.15Å; V299-I315 HydrophobicContact CG1-CB 4.34Å; V299-I315 HydrophobicContact CG1-CG2 4.46Å; V299-I315 HydrophobicContact CG2-CB 4.32Å; V299-I315 HydrophobicContact CG2-CD1 4.26Å; V299-F317 HydrophobicContact CG1-CD2 4.28Å; V299-F317 HydrophobicContact CG1-CE2 4.01Å
300	S	96.5	Very high	89.6	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	168.5	-173.4	66.5	0	0	0	0	111.8	S285 N308 T313 I315 K316 F317	S285-S300 VanDerWaalsContact OG-C 3.29Å; S285-S300 PolarHBondContact OG-O 2.88Å; S300-N308 WeakPolarHBondContact CA-OD1 3.46Å; S300-N308 WeakPolarHBondContact CB-O 3.33Å; S300-N308 VanDerWaalsContact CB-OD1 3.24Å; S300-N308 WeakPolarHBondContact CB-OD1 3.24Å; S300-T313 WeakPolarHBondContact OG-CG2 3.46Å; S300-T313 PolarHBondContact OG-OG1 2.65Å; S300-I315 PolarHBondContact N-O 2.84Å; S300-K316 WeakPolarHBondContact O-CA 3.12Å; S300-F317 PolarHBondContact O-N 3.36Å
301	Y	95.6	Very high	89.5	Confident	22 Å²	22	57.6 Å²	57.6	9%	0.086	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	153.3	169.6	71.7	-91.7	0	0	0	111.4	I282 H286 I303 E306 G307 N308 F317	I282-Y301 HydrophobicContact CD1-CE2 4.39Å; I282-Y301 HydrophobicContact CG1-CD1 4.44Å; I282-Y301 HydrophobicContact CG1-CD2 3.81Å; I282-Y301 HydrophobicContact CG1-CE1 4.38Å; I282-Y301 HydrophobicContact CG1-CE2 3.74Å; I282-Y301 HydrophobicContact CG1-CG 4.17Å; I282-Y301 HydrophobicContact CG2-CD1 4.46Å; I282-Y301 HydrophobicContact CG2-CE1 4.18Å; H286-Y301 AromaticContact NE2-CE1 3.77Å; Y301-I303 HydrophobicContact CD2-CG1 4.37Å; Y301-I303 HydrophobicContact CD2-CG2 4.23Å; Y301-I303 HydrophobicContact CE2-CD1 4.46Å; Y301-I303 HydrophobicContact CE2-CG1 4.26Å; Y301-E306 HydrophobicContact CE2-CG 4.12Å; Y301-E306 PolarHBondContact OH-OE1 2.88Å; Y301-E306 VanDerWaalsContact OH-OE1 3.05Å; Y301-G307 WeakPolarHBondContact O-CA 3.11Å; Y301-N308 WeakPolarHBondContact CD1-OD1 3.44Å; Y301-N308 PolarHBondContact N-OD1 3.02Å; Y301-N308 PolarHBondContact O-N 3.27Å; Y301-N308 VanDerWaalsContact O-N 3.09Å; Y301-N308 PolarHBondContact O-OD1 3.26Å; Y301-N308 VanDerWaalsContact O-OD1 3.1Å; Y301-F317 CarbonylContact C-O 3.48Å; Y301-F317 WeakPolarHBondContact CA-O 3.21Å
302	Q	92.6	Very high	89.6	Confident	53 Å²	53	63 Å²	63	25%	0.248	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	114.2	171.3	-172	66.8	47.8	0	0	109.6	E306 V309 F317 M318 T319 V322	Q302-E306 PolarHBondContact NE2-O 2.9Å; Q302-V309 HydrophobicContact CB-CG2 3.8Å; Q302-V309 HydrophobicContact CG-CG2 4.43Å; Q302-F317 PolarHBondContact N-O 3.39Å; Q302-M318 HydrophobicContact CB-CB 4.3Å; Q302-M318 WeakPolarHBondContact O-CA 3.27Å; Q302-M318 VanDerWaalsContact O-CB 3.25Å; Q302-M318 WeakPolarHBondContact O-CB 3.43Å; Q302-T319 PolarHBondContact O-N 2.93Å; Q302-V322 HydrophobicContact CB-CG1 4.13Å; Q302-V322 HydrophobicContact CG-CG1 3.64Å; Q302-V322 HydrophobicContact CG-CG2 4.36Å
303	I	87.3	Confident	89.7	Confident	6 Å²	6	63.1 Å²	63.1	3%	0.031	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	175.8	173.4	62.1	173.3	0	0	0	109.7	R278 A281 I282 Y301 F305 E306 T319	R278-I303 HydrophobicContact CB-CB 4.47Å; R278-I303 HydrophobicContact CB-CD1 4.08Å; R278-I303 HydrophobicContact CB-CG2 4.2Å; R278-I303 HydrophobicContact CG-CB 4.2Å; R278-I303 HydrophobicContact CG-CD1 4.36Å; R278-I303 HydrophobicContact CG-CG2 4.31Å; A281-I303 HydrophobicContact CB-CG2 4Å; I282-I303 HydrophobicContact CD1-CD1 3.82Å; I282-I303 HydrophobicContact CG1-CD1 4.27Å; Y301-I303 HydrophobicContact CD2-CG1 4.37Å; Y301-I303 HydrophobicContact CD2-CG2 4.23Å; Y301-I303 HydrophobicContact CE2-CD1 4.46Å; Y301-I303 HydrophobicContact CE2-CG1 4.26Å; I303-F305 PolarHBondContact O-N 3.34Å; I303-E306 CarbonylContact C-O 3.59Å; I303-E306 HydrophobicContact CD1-CB 4.07Å; I303-E306 HydrophobicContact CG1-CB 3.79Å; I303-E306 VanDerWaalsContact CG1-O 3.31Å; I303-E306 WeakPolarHBondContact CG1-O 3.34Å; I303-E306 PolarHBondContact N-O 2.97Å; I303-E306 PolarHBondContact O-N 3.46Å; I303-T319 HydrophobicContact CB-CG2 4.47Å; I303-T319 HydrophobicContact CG2-CG2 4.01Å
304	R	71.2	Confident	89.8	Confident	82 Å²	82	60.4 Å²	60.4	31%	0.309	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	113.2	175.1	-168.9	177.2	157.6	177.2	-7.7	109.3	P719	R304-P719 PolarHBondContact NH2-O 3.48Å
305	F	65.5	Low	90	Very high	89 Å²	89	57.9 Å²	57.9	39%	0.39	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.6	1.8	176.8	-43.8	-57.4	0	0	0	117.8	I303 P719 Q831 I835	I303-F305 PolarHBondContact O-N 3.34Å; F305-P719 HydrophobicContact CZ-CG 4.43Å; F305-Q831 HydrophobicContact CD2-CG 4.03Å; F305-Q831 HydrophobicContact CE2-CB 4.24Å; F305-Q831 HydrophobicContact CE2-CG 4.06Å; F305-Q831 HydrophobicContact CG-CG 4.33Å; F305-Q831 HydrophobicContact CZ-CB 4.17Å; F305-Q831 HydrophobicContact CZ-CG 4.41Å; F305-I835 HydrophobicContact CE1-CD1 3.58Å; F305-I835 HydrophobicContact CE1-CG1 4.25Å; F305-I835 HydrophobicContact CZ-CD1 3.92Å
306	E	76.8	Confident	90.2	Very high	103 Å²	103	55.7 Å²	55.7	48%	0.481	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	144.8	-178.3	-177.3	-177.6	175.7	0	0	108.9	Y301 Q302 I303	Y301-E306 HydrophobicContact CE2-CG 4.12Å; Y301-E306 PolarHBondContact OH-OE1 2.88Å; Y301-E306 VanDerWaalsContact OH-OE1 3.05Å; Q302-E306 PolarHBondContact NE2-O 2.9Å; I303-E306 CarbonylContact C-O 3.59Å; I303-E306 HydrophobicContact CD1-CB 4.07Å; I303-E306 HydrophobicContact CG1-CB 3.79Å; I303-E306 VanDerWaalsContact CG1-O 3.31Å; I303-E306 WeakPolarHBondContact CG1-O 3.34Å; I303-E306 PolarHBondContact N-O 2.97Å; I303-E306 PolarHBondContact O-N 3.46Å
307	G	83.9	Confident	90.5	Very high	36 Å²	36	49.7 Å²	49.7	37%	0.371	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	176.9	158.1	176.3	0	0	0	0	0	111.3	Y301	Y301-G307 WeakPolarHBondContact O-CA 3.11Å
308	N	91.3	Very high	90.7	Very high	38 Å²	38	46.4 Å²	46.4	20%	0.203	23%	0.228	C	C	.	.			trans	-122	28.1	-179.6	66.5	-28.7	0	0	0	111.4	R296 S300 Y301 T310	R296-N308 PolarHBondContact O-ND2 3.27Å; S300-N308 WeakPolarHBondContact CA-OD1 3.46Å; S300-N308 WeakPolarHBondContact CB-O 3.33Å; S300-N308 VanDerWaalsContact CB-OD1 3.24Å; S300-N308 WeakPolarHBondContact CB-OD1 3.24Å; Y301-N308 WeakPolarHBondContact CD1-OD1 3.44Å; Y301-N308 PolarHBondContact N-OD1 3.02Å; Y301-N308 PolarHBondContact O-N 3.27Å; Y301-N308 VanDerWaalsContact O-N 3.09Å; Y301-N308 PolarHBondContact O-OD1 3.26Å; Y301-N308 VanDerWaalsContact O-OD1 3.1Å; N308-T310 PolarHBondContact O-N 3.37Å
309	V	92.1	Very high	90.6	Very high	50 Å²	50	46 Å²	46	30%	0.303	23%	0.226	S	C	.	.			trans	-68.2	130.8	178.6	-176.3	0	0	0	0	109.6	Q302 T313 K316	Q302-V309 HydrophobicContact CB-CG2 3.8Å; Q302-V309 HydrophobicContact CG-CG2 4.43Å; V309-T313 HydrophobicContact CG1-CG2 4.38Å; V309-K316 HydrophobicContact CG1-CD 4.33Å; V309-K316 HydrophobicContact CG2-CD 3.98Å; V309-K316 HydrophobicContact CG2-CG 4.14Å
310	T	92.9	Very high	90.3	Very high	57 Å²	57	46.4 Å²	46.4	35%	0.35	23%	0.228	S	C	.	.			trans	-131.3	172.4	176.7	66.3	0	0	0	0	109.8	D297 N308 K312 T313	D297-T310 PolarHBondContact O-OG1 2.73Å; N308-T310 PolarHBondContact O-N 3.37Å; T310-K312 PolarHBondContact O-N 3.5Å; T310-K312 VanDerWaalsContact O-N 3.12Å; T310-K312 PolarHBondContact OG1-N 2.55Å; T310-T313 PolarHBondContact N-OG1 3.25Å; T310-T313 VanDerWaalsContact N-OG1 3.1Å; T310-T313 VanDerWaalsContact O-CB 3.22Å; T310-T313 WeakPolarHBondContact O-CB 3.23Å; T310-T313 PolarHBondContact O-N 3.35Å; T310-T313 PolarHBondContact O-OG1 3.03Å
311	E	91.7	Very high	89.9	Confident	202 Å²	202	47.8 Å²	47.8	94%	0.944	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-21.3	173.9	-62.7	178.6	178.8	0	0	113.2	T313	E311-T313 VanDerWaalsContact C-N 3.31Å
312	K	93.6	Very high	89.7	Confident	138 Å²	138	47.6 Å²	47.6	60%	0.6	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81	-10.7	177.3	-63.8	-178.8	-177.8	174.7	0	113.3	D297 T310 K314	D297-K312 HydrophobicContact CB-CB 4.47Å; T310-K312 PolarHBondContact O-N 3.5Å; T310-K312 VanDerWaalsContact O-N 3.12Å; T310-K312 PolarHBondContact OG1-N 2.55Å; K312-K314 PolarHBondContact O-N 3.42Å
313	T	96.1	Very high	89.7	Confident	3 Å²	3	45.1 Å²	45.1	2%	0.018	23%	0.232	C	C	.	.			trans	-60.4	129.8	-176.7	-69	0	0	0	0	110.8	M270 D297 S300 V309 T310 E311 K316	M270-T313 WeakPolarHBondContact CG-O 3.44Å; M270-T313 HydrophobicContact SD-CG2 3.81Å; M270-T313 VanDerWaalsContact SD-O 3.36Å; D297-T313 VanDerWaalsContact O-CA 3.23Å; D297-T313 WeakPolarHBondContact O-CA 3.41Å; D297-T313 PolarHBondContact O-N 3.03Å; D297-T313 PolarHBondContact O-OG1 3.45Å; S300-T313 WeakPolarHBondContact OG-CG2 3.46Å; S300-T313 PolarHBondContact OG-OG1 2.65Å; V309-T313 HydrophobicContact CG1-CG2 4.38Å; T310-T313 PolarHBondContact N-OG1 3.25Å; T310-T313 VanDerWaalsContact N-OG1 3.1Å; T310-T313 VanDerWaalsContact O-CB 3.22Å; T310-T313 WeakPolarHBondContact O-CB 3.23Å; T310-T313 PolarHBondContact O-N 3.35Å; T310-T313 PolarHBondContact O-OG1 3.03Å; E311-T313 VanDerWaalsContact C-N 3.31Å; T313-K316 HydrophobicContact CG2-CB 3.91Å
314	K	96.3	Very high	89.8	Confident	60 Å²	60	45.2 Å²	45.2	26%	0.261	23%	0.232	S	C	.	.	S	Bend	trans	-118	-33.8	175.5	-63	-54.9	-173.1	177.8	0	112	Y260 T265 M270 I271 V298 K312	Y260-K314 HydrophobicContact CD2-CB 4.2Å; Y260-K314 HydrophobicContact CE2-CB 3.79Å; Y260-K314 HydrophobicContact CE2-CG 4.18Å; T265-K314 HydrophobicContact CG2-CB 4.08Å; M270-K314 WeakPolarHBondContact CA-O 3.31Å; I271-K314 PolarHBondContact N-O 2.7Å; V298-K314 HydrophobicContact CG1-CB 4.02Å; V298-K314 HydrophobicContact CG1-CG 4.02Å; V298-K314 PolarHBondContact O-N 2.77Å; K312-K314 PolarHBondContact O-N 3.42Å
315	I	97.7	Very high	90.4	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	123.3	172.9	-54.1	178.8	0	0	0	107.6	P256 Y260 I271 V288 M292 V298 V299 S300 F317	P256-I315 HydrophobicContact CB-CD1 4.49Å; P256-I315 HydrophobicContact CB-CG2 4.19Å; Y260-I315 HydrophobicContact CD2-CD1 4.13Å; Y260-I315 HydrophobicContact CD2-CG1 4.11Å; Y260-I315 HydrophobicContact CG-CD1 4.27Å; I271-I315 HydrophobicContact CD1-CG1 4.4Å; V288-I315 HydrophobicContact CG1-CD1 4.48Å; M292-I315 HydrophobicContact CE-CD1 4.11Å; M292-I315 HydrophobicContact SD-CD1 3.71Å; V298-I315 PolarHBondContact O-N 2.91Å; V298-I315 VanDerWaalsContact O-N 3.14Å; V299-I315 WeakPolarHBondContact CA-O 3.15Å; V299-I315 HydrophobicContact CG1-CB 4.34Å; V299-I315 HydrophobicContact CG1-CG2 4.46Å; V299-I315 HydrophobicContact CG2-CB 4.32Å; V299-I315 HydrophobicContact CG2-CD1 4.26Å; S300-I315 PolarHBondContact N-O 2.84Å; I315-F317 HydrophobicContact CG2-CD2 4.16Å; I315-F317 HydrophobicContact CG2-CE2 3.66Å; I315-F317 HydrophobicContact CG2-CZ 4.37Å
316	K	97.6	Very high	91.6	Very high	11 Å²	11	43.6 Å²	43.6	5%	0.048	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	110	-177.8	-176.3	177.3	164	-176.7	0	110.3	I271 G272 V273 S300 V309 T313 M318 E326 Y336	I271-K316 PolarHBondContact O-N 3.47Å; G272-K316 CarbonylContact C-O 3.53Å; G272-K316 WeakPolarHBondContact CA-O 3.47Å; V273-K316 PolarHBondContact N-O 2.94Å; S300-K316 WeakPolarHBondContact O-CA 3.12Å; V309-K316 HydrophobicContact CG1-CD 4.33Å; V309-K316 HydrophobicContact CG2-CD 3.98Å; V309-K316 HydrophobicContact CG2-CG 4.14Å; T313-K316 HydrophobicContact CG2-CB 3.91Å; K316-M318 HydrophobicContact CB-CE 4.32Å; K316-M318 HydrophobicContact CD-CE 4Å; K316-M318 HydrophobicContact CG-CE 3.99Å; K316-E326 IonicContact NZ-OE1 3.19Å; K316-E326 PolarHBondContact NZ-OE1 3.43Å; K316-E326 IonicContact NZ-OE2 3.54Å; K316-E326 PolarHBondContact NZ-OE2 3.29Å; K316-Y336 WeakPolarHBondContact CD-OH 3.44Å; K316-Y336 PolarHBondContact NZ-OH 3.07Å
317	F	97.8	Very high	92.3	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	138.9	168.2	-72.2	-92.5	0	0	0	109.7	P256 V273 I284 V288 V299 S300 Y301 Q302 I315	P256-F317 HydrophobicContact CB-CZ 4.47Å; P256-F317 HydrophobicContact CG-CZ 4.13Å; V273-F317 HydrophobicContact CB-CD1 3.73Å; V273-F317 HydrophobicContact CB-CE1 3.77Å; V273-F317 HydrophobicContact CB-CG 4.34Å; V273-F317 HydrophobicContact CB-CZ 4.42Å; V273-F317 HydrophobicContact CG1-CD1 3.84Å; V273-F317 HydrophobicContact CG1-CE1 3.66Å; V273-F317 HydrophobicContact CG2-CD1 4.37Å; V273-F317 HydrophobicContact CG2-CE1 4.02Å; V273-F317 HydrophobicContact CG2-CZ 4.2Å; V273-F317 CarbonylContact O-C 3.41Å; V273-F317 WeakPolarHBondContact O-CA 3.36Å; I284-F317 HydrophobicContact CB-CD1 4.31Å; I284-F317 HydrophobicContact CB-CE1 4.1Å; I284-F317 HydrophobicContact CG2-CD1 4.02Å; I284-F317 HydrophobicContact CG2-CE1 3.33Å; I284-F317 HydrophobicContact CG2-CZ 3.73Å; V288-F317 HydrophobicContact CB-CE2 4.18Å; V288-F317 HydrophobicContact CB-CZ 4.32Å; V288-F317 HydrophobicContact CG1-CE2 4.4Å; V288-F317 HydrophobicContact CG2-CE2 4.25Å; V288-F317 HydrophobicContact CG2-CZ 3.88Å; V299-F317 HydrophobicContact CG1-CD2 4.28Å; V299-F317 HydrophobicContact CG1-CE2 4.01Å; S300-F317 PolarHBondContact O-N 3.36Å; Y301-F317 CarbonylContact C-O 3.48Å; Y301-F317 WeakPolarHBondContact CA-O 3.21Å; Q302-F317 PolarHBondContact N-O 3.39Å; I315-F317 HydrophobicContact CG2-CD2 4.16Å; I315-F317 HydrophobicContact CG2-CE2 3.66Å; I315-F317 HydrophobicContact CG2-CZ 4.37Å
318	M	96.1	Very high	92.3	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	164.7	179.2	68.6	-167.5	98.6	0	0	111.7	V273 T274 E275 Q302 K316 V322 L323 Y336	V273-M318 PolarHBondContact O-N 3Å; T274-M318 CarbonylContact C-O 3.55Å; T274-M318 VanDerWaalsContact CA-O 3.28Å; T274-M318 WeakPolarHBondContact CA-O 3.49Å; T274-M318 HydrophobicContact CG2-CG 3.92Å; E275-M318 PolarHBondContact N-O 3.27Å; Q302-M318 HydrophobicContact CB-CB 4.3Å; Q302-M318 WeakPolarHBondContact O-CA 3.27Å; Q302-M318 VanDerWaalsContact O-CB 3.25Å; Q302-M318 WeakPolarHBondContact O-CB 3.43Å; K316-M318 HydrophobicContact CB-CE 4.32Å; K316-M318 HydrophobicContact CD-CE 4Å; K316-M318 HydrophobicContact CG-CE 3.99Å; M318-V322 HydrophobicContact CB-CB 4.13Å; M318-V322 HydrophobicContact CB-CG1 4.04Å; M318-V322 HydrophobicContact CG-CG1 4.49Å; M318-V322 HydrophobicContact SD-CG1 4.16Å; M318-L323 HydrophobicContact CG-CB 4.47Å; M318-L323 HydrophobicContact SD-CB 3.85Å; M318-L323 HydrophobicContact SD-CD1 4.15Å; M318-Y336 HydrophobicContact CE-CE1 3.91Å; M318-Y336 WeakPolarHBondContact CE-OH 3.5Å
319	T	93	Very high	92.1	Very high	16 Å²	16	47.6 Å²	47.6	10%	0.098	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	152.6	168.2	51.1	0	0	0	0	111.5	E275 R278 Q302 I303 G321 V322 L323	E275-T319 VanDerWaalsContact O-CA 3.3Å; E275-T319 WeakPolarHBondContact O-CA 3.45Å; R278-T319 HydrophobicContact CG-CG2 3.88Å; Q302-T319 PolarHBondContact O-N 2.93Å; I303-T319 HydrophobicContact CB-CG2 4.47Å; I303-T319 HydrophobicContact CG2-CG2 4.01Å; T319-G321 PolarHBondContact O-N 2.71Å; T319-G321 VanDerWaalsContact O-N 3.11Å; T319-V322 WeakPolarHBondContact O-CB 3.36Å; T319-V322 PolarHBondContact O-N 2.87Å; T319-V322 WeakPolarHBondContact OG1-CG2 3.26Å; T319-L323 PolarHBondContact O-N 3.29Å
320	D	91.6	Very high	92	Very high	9 Å²	9	47.6 Å²	47.6	5%	0.048	23%	0.231	C	C	.	.	H	α-helix	trans	-45.2	-46.7	177.2	-55.7	-8.9	0	0	0	113	V322 L323 L324 S348 L354	D320-V322 VanDerWaalsContact C-N 3.25Å; D320-V322 PolarHBondContact O-N 2.94Å; D320-L323 PolarHBondContact O-N 3.22Å; D320-L324 PolarHBondContact O-N 2.77Å; D320-S348 PolarHBondContact OD2-OG 2.97Å; D320-S348 VanDerWaalsContact OD2-OG 3.07Å; D320-L354 HydrophobicContact CB-CD1 3.68Å
321	G	87	Confident	91.9	Very high	29 Å²	29	48.9 Å²	48.9	30%	0.299	23%	0.232	S	C	.	.	H	α-helix	trans	-66.6	-19.8	-179.7	0	0	0	0	0	115.1	T319 K325	T319-G321 PolarHBondContact O-N 2.71Å; T319-G321 VanDerWaalsContact O-N 3.11Å; G321-K325 WeakPolarHBondContact O-CG 3.42Å; G321-K325 PolarHBondContact O-N 3.14Å
322	V	90.7	Very high	92	Very high	18 Å²	18	40.7 Å²	40.7	11%	0.109	20%	0.195	C	C	.	.	H	α-helix	trans	-75.4	-46	172.5	169.6	0	0	0	0	109.7	Q302 M318 T319 D320 L324 K325 E326	Q302-V322 HydrophobicContact CB-CG1 4.13Å; Q302-V322 HydrophobicContact CG-CG1 3.64Å; Q302-V322 HydrophobicContact CG-CG2 4.36Å; M318-V322 HydrophobicContact CB-CB 4.13Å; M318-V322 HydrophobicContact CB-CG1 4.04Å; M318-V322 HydrophobicContact CG-CG1 4.49Å; M318-V322 HydrophobicContact SD-CG1 4.16Å; T319-V322 WeakPolarHBondContact O-CB 3.36Å; T319-V322 PolarHBondContact O-N 2.87Å; T319-V322 WeakPolarHBondContact OG1-CG2 3.26Å; D320-V322 VanDerWaalsContact C-N 3.25Å; D320-V322 PolarHBondContact O-N 2.94Å; V322-L324 VanDerWaalsContact C-N 3.28Å; V322-L324 PolarHBondContact O-N 3.41Å; V322-K325 PolarHBondContact O-N 2.97Å; V322-K325 VanDerWaalsContact O-N 3.17Å; V322-E326 PolarHBondContact O-N 2.78Å
323	L	93.9	Very high	92	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-61	-40	176.5	-176	60.9	0	0	0	111.2	T274 M318 T319 D320 K325 E326 I327 L333 I339 L354	T274-L323 HydrophobicContact CG2-CB 3.89Å; T274-L323 HydrophobicContact CG2-CD2 3.55Å; T274-L323 HydrophobicContact CG2-CG 4.33Å; M318-L323 HydrophobicContact CG-CB 4.47Å; M318-L323 HydrophobicContact SD-CB 3.85Å; M318-L323 HydrophobicContact SD-CD1 4.15Å; T319-L323 PolarHBondContact O-N 3.29Å; D320-L323 PolarHBondContact O-N 3.22Å; L323-K325 VanDerWaalsContact C-N 3.31Å; L323-K325 PolarHBondContact O-N 3.48Å; L323-E326 WeakPolarHBondContact O-CB 3.41Å; L323-E326 PolarHBondContact O-N 3.44Å; L323-I327 HydrophobicContact CG-CD1 4.41Å; L323-I327 WeakPolarHBondContact O-CG1 3.44Å; L323-I327 PolarHBondContact O-N 2.73Å; L323-L333 HydrophobicContact CD1-CD1 3.99Å; L323-L333 HydrophobicContact CD1-CD2 3.93Å; L323-I339 HydrophobicContact CD1-CD1 4.17Å; L323-I339 HydrophobicContact CD2-CG2 3.82Å; L323-L354 HydrophobicContact CB-CD1 4.38Å; L323-L354 HydrophobicContact CB-CD2 4.18Å; L323-L354 HydrophobicContact CD2-CD1 4.22Å; L323-L354 HydrophobicContact CD2-CD2 4Å; L323-L354 HydrophobicContact CG-CD2 3.97Å
324	L	89.4	Confident	91.8	Very high	8 Å²	8	37.1 Å²	37.1	4%	0.042	19%	0.187	C	C	.	.	H	α-helix	trans	-59.8	-40.8	176.8	-172.2	65.4	0	0	0	112.4	D320 V322 E326 I327 Q328 Y350 V353 L354 L357 M662	D320-L324 PolarHBondContact O-N 2.77Å; V322-L324 VanDerWaalsContact C-N 3.28Å; V322-L324 PolarHBondContact O-N 3.41Å; L324-E326 VanDerWaalsContact C-N 3.3Å; L324-E326 PolarHBondContact O-N 3.19Å; L324-I327 PolarHBondContact O-N 3.04Å; L324-Q328 PolarHBondContact O-N 3.33Å; L324-Q328 VanDerWaalsContact O-N 3.08Å; L324-Y350 HydrophobicContact CD2-CD1 3.73Å; L324-Y350 HydrophobicContact CD2-CE1 3.93Å; L324-V353 HydrophobicContact CD1-CG1 4.38Å; L324-L354 HydrophobicContact CB-CD2 4.19Å; L324-L354 HydrophobicContact CD1-CD2 4.28Å; L324-L357 HydrophobicContact CD1-CD1 3.54Å; L324-M662 HydrophobicContact CD1-CE 3.92Å; L324-M662 HydrophobicContact CD1-SD 3.77Å; L324-M662 HydrophobicContact CG-SD 4.5Å
325	K	84.1	Confident	91.7	Very high	97 Å²	97	36.6 Å²	36.6	42%	0.422	19%	0.191	S	C	.	.	H	α-helix	trans	-68.3	-29.9	175	-75.2	-170.7	175.2	-154.3	0	112.9	G321 V322 L323 Q328 K329	G321-K325 WeakPolarHBondContact O-CG 3.42Å; G321-K325 PolarHBondContact O-N 3.14Å; V322-K325 PolarHBondContact O-N 2.97Å; V322-K325 VanDerWaalsContact O-N 3.17Å; L323-K325 VanDerWaalsContact C-N 3.31Å; L323-K325 PolarHBondContact O-N 3.48Å; K325-Q328 PolarHBondContact O-N 3.3Å; K325-K329 PolarHBondContact O-N 3.24Å
326	E	91.1	Very high	91.7	Very high	41 Å²	41	36.6 Å²	36.6	19%	0.192	19%	0.191	C	C	.	.	H	α-helix	trans	-71	-40.2	173.4	-72.6	-179.5	-166.7	0	0	111.5	K316 V322 L323 L324 Q328 K329 D330 L333 Y336	K316-E326 IonicContact NZ-OE1 3.19Å; K316-E326 PolarHBondContact NZ-OE1 3.43Å; K316-E326 IonicContact NZ-OE2 3.54Å; K316-E326 PolarHBondContact NZ-OE2 3.29Å; V322-E326 PolarHBondContact O-N 2.78Å; L323-E326 WeakPolarHBondContact O-CB 3.41Å; L323-E326 PolarHBondContact O-N 3.44Å; L324-E326 VanDerWaalsContact C-N 3.3Å; L324-E326 PolarHBondContact O-N 3.19Å; E326-Q328 PolarHBondContact O-N 3.27Å; E326-K329 PolarHBondContact O-N 3.06Å; E326-D330 CarbonylContact O-C 3.54Å; E326-D330 PolarHBondContact O-N 3.25Å; E326-L333 HydrophobicContact CB-CD2 4.2Å; E326-Y336 VanDerWaalsContact OE2-CE2 3.29Å; E326-Y336 WeakPolarHBondContact OE2-CE2 3.21Å; E326-Y336 VanDerWaalsContact OE2-CZ 3.31Å; E326-Y336 PolarHBondContact OE2-OH 3.47Å
327	I	91.1	Very high	91.6	Very high	2 Å²	2	36.6 Å²	36.6	1%	0.01	19%	0.192	C	C	.	.	H	α-helix	trans	-60.1	-36.1	172	-64.9	171.7	0	0	0	111.2	L323 L324 K329 D330 F331 L333 L354 L357 I361	L323-I327 HydrophobicContact CG-CD1 4.41Å; L323-I327 WeakPolarHBondContact O-CG1 3.44Å; L323-I327 PolarHBondContact O-N 2.73Å; L324-I327 PolarHBondContact O-N 3.04Å; I327-K329 VanDerWaalsContact C-N 3.3Å; I327-K329 PolarHBondContact O-N 2.89Å; I327-D330 CarbonylContact O-C 3.21Å; I327-F331 HydrophobicContact CG2-CD2 3.87Å; I327-F331 HydrophobicContact CG2-CE2 4.37Å; I327-F331 WeakPolarHBondContact O-CA 3.38Å; I327-F331 PolarHBondContact O-N 2.98Å; I327-F331 VanDerWaalsContact O-N 3.11Å; I327-L333 HydrophobicContact CD1-CD1 4.2Å; I327-L333 HydrophobicContact CG1-CD1 3.82Å; I327-L333 HydrophobicContact CG1-CD2 3.79Å; I327-L333 HydrophobicContact CG1-CG 3.9Å; I327-L354 HydrophobicContact CD1-CD2 3.72Å; I327-L357 HydrophobicContact CD1-CB 4.33Å; I327-L357 HydrophobicContact CD1-CD1 4.09Å; I327-L357 HydrophobicContact CG2-CD1 4.32Å; I327-I361 HydrophobicContact CD1-CD1 4.08Å; I327-I361 HydrophobicContact CG1-CD1 4.23Å; I327-I361 HydrophobicContact CG2-CD1 4.15Å
328	Q	84.2	Confident	91.6	Very high	68 Å²	68	36.6 Å²	36.6	32%	0.318	19%	0.192	S	C	.	.	H	α-helix	trans	-63.9	-33.1	174.7	-76.7	176.6	-9.8	0	0	113.2	L324 K325 E326 M662	L324-Q328 PolarHBondContact O-N 3.33Å; L324-Q328 VanDerWaalsContact O-N 3.08Å; K325-Q328 PolarHBondContact O-N 3.3Å; E326-Q328 PolarHBondContact O-N 3.27Å; Q328-M662 HydrophobicContact CG-CG 3.59Å; Q328-M662 HydrophobicContact CG-SD 3.94Å
329	K	86.2	Confident	91.6	Very high	190 Å²	190	36.7 Å²	36.7	83%	0.826	19%	0.193	S	C	*	.	H	α-helix	trans	-85.4	-46.5	179.2	-69.2	-178.4	177.8	-172.1	0	112.3	K325 E326 I327	K325-K329 PolarHBondContact O-N 3.24Å; E326-K329 PolarHBondContact O-N 3.06Å; I327-K329 VanDerWaalsContact C-N 3.3Å; I327-K329 PolarHBondContact O-N 2.89Å
330	D	91	Very high	91.9	Very high	50 Å²	50	35.9 Å²	35.9	27%	0.267	19%	0.188	S	C	.	.			trans	-130.1	95.2	176	174.7	13.1	0	0	0	108.7	E326 I327 L332 L333 S334	E326-D330 CarbonylContact O-C 3.54Å; E326-D330 PolarHBondContact O-N 3.25Å; I327-D330 CarbonylContact O-C 3.21Å; D330-L332 PolarHBondContact O-N 3.34Å; D330-L332 VanDerWaalsContact O-N 3.13Å; D330-L332 PolarHBondContact OD1-N 3.27Å; D330-L333 PolarHBondContact O-N 3.47Å; D330-L333 VanDerWaalsContact O-N 3.1Å; D330-L333 PolarHBondContact OD1-N 2.77Å; D330-S334 WeakPolarHBondContact OD2-CB 3.1Å; D330-S334 PolarHBondContact OD2-N 3.19Å; D330-S334 PolarHBondContact OD2-OG 3.46Å
331	F	90.2	Very high	92.1	Very high	84 Å²	84	35.5 Å²	35.5	37%	0.368	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-27.8	-179	-177.5	-98.7	0	0	0	113.1	I327 L357 I361 I364	I327-F331 HydrophobicContact CG2-CD2 3.87Å; I327-F331 HydrophobicContact CG2-CE2 4.37Å; I327-F331 WeakPolarHBondContact O-CA 3.38Å; I327-F331 PolarHBondContact O-N 2.98Å; I327-F331 VanDerWaalsContact O-N 3.11Å; F331-L357 HydrophobicContact CE2-CD2 4.29Å; F331-I361 HydrophobicContact CD1-CG1 4.47Å; F331-I361 HydrophobicContact CE1-CG1 4.04Å; F331-I361 HydrophobicContact CE2-CG1 4.44Å; F331-I361 HydrophobicContact CZ-CG1 4.03Å; F331-I361 VanDerWaalsContact O-CD1 3.22Å; F331-I361 WeakPolarHBondContact O-CD1 3.16Å; F331-I361 WeakPolarHBondContact O-CG1 3.44Å; F331-I364 HydrophobicContact CE1-CD1 3.78Å
332	L	92.7	Very high	92.4	Very high	31 Å²	31	34.2 Å²	34.2	16%	0.162	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-10.4	-177.1	-63.5	175.8	0	0	0	113.1	D330 S334 I364 R365 R368	D330-L332 PolarHBondContact O-N 3.34Å; D330-L332 VanDerWaalsContact O-N 3.13Å; D330-L332 PolarHBondContact OD1-N 3.27Å; L332-S334 PolarHBondContact O-N 3.32Å; L332-I364 HydrophobicContact CD2-CB 4.35Å; L332-I364 HydrophobicContact CD2-CG2 3.62Å; L332-R365 HydrophobicContact CD2-CG 4.44Å; L332-R365 WeakPolarHBondContact O-CD 3.33Å; L332-R368 VanDerWaalsContact CD1-CZ 3.4Å
333	L	94.9	Very high	92.4	Very high	1 Å²	1	33.9 Å²	33.9	1%	0.005	17%	0.169	C	C	.	.			trans	50.9	49	-175.2	-63.6	176.8	0	0	0	111.2	L323 E326 I327 D330 S335 Y336 I339 L358 I361 R365	L323-L333 HydrophobicContact CD1-CD1 3.99Å; L323-L333 HydrophobicContact CD1-CD2 3.93Å; E326-L333 HydrophobicContact CB-CD2 4.2Å; I327-L333 HydrophobicContact CD1-CD1 4.2Å; I327-L333 HydrophobicContact CG1-CD1 3.82Å; I327-L333 HydrophobicContact CG1-CD2 3.79Å; I327-L333 HydrophobicContact CG1-CG 3.9Å; D330-L333 PolarHBondContact O-N 3.47Å; D330-L333 VanDerWaalsContact O-N 3.1Å; D330-L333 PolarHBondContact OD1-N 2.77Å; L333-S335 PolarHBondContact O-N 3.46Å; L333-Y336 HydrophobicContact CB-CD2 4Å; L333-Y336 HydrophobicContact CD2-CD2 4.16Å; L333-Y336 HydrophobicContact CD2-CE2 4.2Å; L333-Y336 PolarHBondContact O-N 3.11Å; L333-I339 HydrophobicContact CD1-CG1 4.37Å; L333-L358 HydrophobicContact CD1-CD2 3.74Å; L333-I361 HydrophobicContact CD1-CD1 4.4Å; L333-R365 PolarHBondContact O-NH1 3.07Å
334	S	92.4	Very high	92.2	Very high	64 Å²	64	34 Å²	34	45%	0.448	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-29.1	-173.5	60	0	0	0	0	113.3	K269 D330 L332 Y336	K269-S334 WeakPolarHBondContact CE-O 3.39Å; D330-S334 WeakPolarHBondContact OD2-CB 3.1Å; D330-S334 PolarHBondContact OD2-N 3.19Å; D330-S334 PolarHBondContact OD2-OG 3.46Å; L332-S334 PolarHBondContact O-N 3.32Å; S334-Y336 VanDerWaalsContact C-N 3.27Å; S334-Y336 PolarHBondContact O-N 3.46Å
335	S	93.5	Very high	92.1	Very high	49 Å²	49	34.9 Å²	34.9	34%	0.343	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-13.5	177.6	58.4	0	0	0	0	114.5	K269 M270 L333	K269-S335 WeakPolarHBondContact CA-O 3.37Å; M270-S335 PolarHBondContact N-O 3.44Å; L333-S335 PolarHBondContact O-N 3.46Å
336	Y	96.8	Very high	92.1	Very high	1 Å²	1	32.6 Å²	32.6	0%	0.004	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	141.1	-175.5	-62.9	-82.7	0	0	0	112.7	M270 K316 M318 E326 L333 S334 I339 R365	M270-Y336 HydrophobicContact CB-CD1 4.13Å; M270-Y336 HydrophobicContact CB-CE1 4.25Å; M270-Y336 HydrophobicContact CE-CE1 4.38Å; M270-Y336 WeakPolarHBondContact O-CA 3.06Å; K316-Y336 WeakPolarHBondContact CD-OH 3.44Å; K316-Y336 PolarHBondContact NZ-OH 3.07Å; M318-Y336 HydrophobicContact CE-CE1 3.91Å; M318-Y336 WeakPolarHBondContact CE-OH 3.5Å; E326-Y336 VanDerWaalsContact OE2-CE2 3.29Å; E326-Y336 WeakPolarHBondContact OE2-CE2 3.21Å; E326-Y336 VanDerWaalsContact OE2-CZ 3.31Å; E326-Y336 PolarHBondContact OE2-OH 3.47Å; L333-Y336 HydrophobicContact CB-CD2 4Å; L333-Y336 HydrophobicContact CD2-CD2 4.16Å; L333-Y336 HydrophobicContact CD2-CE2 4.2Å; L333-Y336 PolarHBondContact O-N 3.11Å; S334-Y336 VanDerWaalsContact C-N 3.27Å; S334-Y336 PolarHBondContact O-N 3.46Å; Y336-I339 HydrophobicContact CD1-CD1 3.7Å; Y336-I339 HydrophobicContact CD2-CD1 4.11Å; Y336-I339 HydrophobicContact CE1-CD1 4.27Å; Y336-I339 HydrophobicContact CG-CD1 3.61Å; Y336-R365 PolarHBondContact O-NH1 2.63Å
337	S	95.7	Very high	91.9	Very high	11 Å²	11	31 Å²	31	8%	0.077	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	-30	170.6	54.7	0	0	0	0	112.4	F264 M270 H373	F264-S337 VanDerWaalsContact O-CB 3.22Å; F264-S337 WeakPolarHBondContact O-CB 3.34Å; F264-S337 PolarHBondContact O-OG 3.04Å; M270-S337 PolarHBondContact O-N 3.11Å; M270-S337 PolarHBondContact O-OG 3.33Å; S337-H373 PolarHBondContact O-N 3.34Å; S337-H373 VanDerWaalsContact O-N 3.08Å; S337-H373 PolarHBondContact O-ND1 3.35Å
338	A	97.1	Very high	91.7	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	140.3	175.6	0	0	0	0	0	111.1	L259 F264 G272 L340 H373	L259-A338 HydrophobicContact CD1-CB 4.15Å; F264-A338 HydrophobicContact CD1-CB 4.37Å; G272-A338 PolarHBondContact N-O 3.27Å; A338-L340 HydrophobicContact CB-CD1 4.47Å; A338-H373 CarbonylContact C-O 3.58Å; A338-H373 VanDerWaalsContact CA-O 3.27Å; A338-H373 WeakPolarHBondContact CA-O 3.27Å; A338-H373 HydrophobicContact CB-CB 4.28Å
339	I	98	Very high	91.8	Very high	1 Å²	1	29 Å²	29	1%	0.005	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	128.1	171.3	-64.4	-64.1	0	0	0	108.7	G272 L323 L333 Y336 I341 L358 L372 H373 L374 V375	G272-I339 CarbonylContact O-C 3.59Å; G272-I339 WeakPolarHBondContact O-CA 3.39Å; L323-I339 HydrophobicContact CD1-CD1 4.17Å; L323-I339 HydrophobicContact CD2-CG2 3.82Å; L333-I339 HydrophobicContact CD1-CG1 4.37Å; Y336-I339 HydrophobicContact CD1-CD1 3.7Å; Y336-I339 HydrophobicContact CD2-CD1 4.11Å; Y336-I339 HydrophobicContact CE1-CD1 4.27Å; Y336-I339 HydrophobicContact CG-CD1 3.61Å; I339-I341 HydrophobicContact CG2-CG1 4.43Å; I339-L358 HydrophobicContact CG1-CD2 4.45Å; I339-L358 HydrophobicContact CG2-CD1 3.86Å; I339-L372 HydrophobicContact CG1-CD1 4.2Å; I339-H373 PolarHBondContact N-O 2.89Å; I339-L374 HydrophobicContact CG2-CD1 4.37Å; I339-L374 WeakPolarHBondContact O-CA 3.29Å; I339-V375 PolarHBondContact O-N 2.86Å
340	L	97.9	Very high	91.9	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	129	175.8	-60.8	74.1	0	0	0	109	V255 P256 L259 I271 G272 V273 T274 A338 V375 M377	V255-L340 HydrophobicContact CB-CD2 4.22Å; V255-L340 HydrophobicContact CG1-CD2 3.7Å; P256-L340 HydrophobicContact CG-CD2 4.04Å; L259-L340 HydrophobicContact CD1-CD1 3.67Å; L259-L340 HydrophobicContact CD1-CD2 4.12Å; L259-L340 HydrophobicContact CD1-CG 4.21Å; I271-L340 HydrophobicContact CG2-CD1 3.46Å; I271-L340 VanDerWaalsContact CG2-CD1 3.46Å; G272-L340 PolarHBondContact O-N 3.01Å; V273-L340 HydrophobicContact CB-CB 4.47Å; V273-L340 HydrophobicContact CG1-CB 4.21Å; V273-L340 HydrophobicContact CG2-CB 4.28Å; V273-L340 HydrophobicContact CG2-CD1 4.17Å; V273-L340 HydrophobicContact CG2-CD2 4.28Å; V273-L340 HydrophobicContact CG2-CG 4.48Å; T274-L340 PolarHBondContact N-O 3.41Å; T274-L340 PolarHBondContact OG1-O 2.93Å; A338-L340 HydrophobicContact CB-CD1 4.47Å; L340-V375 CarbonylContact C-O 3.54Å; L340-V375 VanDerWaalsContact CA-O 3.27Å; L340-V375 WeakPolarHBondContact CA-O 3.19Å; L340-V375 HydrophobicContact CG-CB 4.02Å; L340-V375 HydrophobicContact CG-CG2 4.36Å; L340-M377 HydrophobicContact CB-CE 3.97Å; L340-M377 HydrophobicContact CD2-CE 3.91Å; L340-M377 HydrophobicContact CD2-SD 4.07Å
341	I	96.1	Very high	91.9	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	103.9	172	-60	-172	0	0	0	108.4	T274 I339 A344 L354 I355 L358 L374 V375 M377	T274-I341 WeakPolarHBondContact OG1-CA 3.22Å; I339-I341 HydrophobicContact CG2-CG1 4.43Å; I341-A344 HydrophobicContact CG2-CB 4.38Å; I341-L354 HydrophobicContact CD1-CB 4.04Å; I341-I355 HydrophobicContact CD1-CD1 4.48Å; I341-I355 HydrophobicContact CD1-CG1 3.51Å; I341-L358 HydrophobicContact CD1-CD1 3.66Å; I341-L358 HydrophobicContact CG1-CD1 4.38Å; I341-L374 HydrophobicContact CD1-CD1 4.27Å; I341-L374 HydrophobicContact CG1-CD1 4.22Å; I341-V375 PolarHBondContact N-O 3.39Å; I341-M377 PolarHBondContact O-N 2.74Å
342	D	93.8	Very high	91.9	Very high	2 Å²	2	18.1 Å²	18.1	1%	0.011	10%	0.098	C	C	.	.			trans	-86.2	159.9	178.5	-151.2	-0.8	0	0	0	112.8	S252 T274 E275 A344 M377	S252-D342 WeakPolarHBondContact CA-OD2 3.48Å; S252-D342 WeakPolarHBondContact CB-OD2 3.46Å; S252-D342 PolarHBondContact OG-OD2 2.98Å; T274-D342 WeakPolarHBondContact O-CB 3.22Å; T274-D342 PolarHBondContact O-N 2.97Å; E275-D342 WeakPolarHBondContact OE1-CB 3.37Å; E275-D342 VanDerWaalsContact OE1-OD2 3.07Å; D342-A344 PolarHBondContact O-N 3.37Å; D342-M377 HydrophobicContact CB-CE 3.6Å; D342-M377 VanDerWaalsContact CG-CE 3.48Å; D342-M377 WeakPolarHBondContact OD1-CB 3.18Å
343	E	89.7	Confident	91.8	Very high	12 Å²	12	16.6 Å²	16.6	6%	0.056	9%	0.09	C	C	.	.			trans	52.2	33.4	177.9	-57	-75.5	112.1	0	0	112.6	P276 H345 E346 M377	P276-E343 HydrophobicContact CG-CB 3.94Å; P276-E343 HydrophobicContact CG-CG 4.5Å; E343-H345 PolarHBondContact O-N 3.44Å; E343-H345 IonicContact OE1-CE1 2.77Å; E343-H345 IonicContact OE2-CE1 3.43Å; E343-H345 PolarHBondContact OE2-CE1 3.26Å; E343-H345 VanDerWaalsContact OE2-CE1 3.24Å; E343-H345 IonicContact OE2-NE2 2.84Å; E343-E346 HydrophobicContact CB-CG 4.33Å; E343-E346 WeakPolarHBondContact O-CB 3.42Å; E343-E346 PolarHBondContact O-N 2.82Å; E343-M377 PolarHBondContact N-O 3.12Å
344	A	91.1	Very high	91.7	Very high	1 Å²	1	16.6 Å²	16.6	1%	0.008	9%	0.09	C	C	.	.	G	3₁₀ helix	trans	-59.1	-12.8	-176.5	0	0	0	0	0	114.2	I341 D342 R347 I376 M377 F386	I341-A344 HydrophobicContact CG2-CB 4.38Å; D342-A344 PolarHBondContact O-N 3.37Å; A344-R347 WeakPolarHBondContact O-CD 3.49Å; A344-R347 PolarHBondContact O-N 3.43Å; A344-I376 HydrophobicContact CB-CG2 3.53Å; A344-M377 WeakPolarHBondContact CB-O 3.31Å; A344-M377 PolarHBondContact N-O 3Å; A344-F386 HydrophobicContact CB-CE2 4.26Å; A344-F386 HydrophobicContact CB-CZ 4.08Å
345	H	86.8	Confident	91.8	Very high	27 Å²	27	13.5 Å²	13.5	13%	0.125	7%	0.068	C	C	.	.	G	3₁₀ helix	trans	-76.6	-16.6	173.2	66.5	-78.1	0	0	0	114.2	E343 R347 A379 T380 Q614	E343-H345 PolarHBondContact O-N 3.44Å; E343-H345 IonicContact OE1-CE1 2.77Å; E343-H345 IonicContact OE2-CE1 3.43Å; E343-H345 PolarHBondContact OE2-CE1 3.26Å; E343-H345 VanDerWaalsContact OE2-CE1 3.24Å; E343-H345 IonicContact OE2-NE2 2.84Å; H345-R347 PolarHBondContact O-N 3.02Å; H345-A379 WeakPolarHBondContact CE1-CB 3.5Å; H345-A379 PolarHBondContact ND1-N 3.1Å; H345-A379 VanDerWaalsContact ND1-N 3.16Å; H345-T380 HydrophobicContact CB-CG2 4.02Å; H345-T380 WeakPolarHBondContact CB-OG1 3.5Å; H345-Q614 PolarHBondContact CD2-NE2 3.23Å; H345-Q614 PolarHBondContact NE2-NE2 3.38Å
346	E	83.2	Confident	91.7	Very high	50 Å²	50	11.2 Å²	11.2	23%	0.234	5%	0.052	C	C	.	.	G	3₁₀ helix	trans	-66.7	-25.5	170.9	-70.3	-160.7	166	0	0	111	P276 R277 E343 S348 T572	P276-E346 WeakPolarHBondContact CG-OE2 3.36Å; R277-E346 IonicContact CZ-OE1 2.94Å; R277-E346 IonicContact NE-OE1 3.5Å; R277-E346 IonicContact NH2-OE1 3.42Å; R277-E346 PolarHBondContact NH2-OE1 3.39Å; E343-E346 HydrophobicContact CB-CG 4.33Å; E343-E346 WeakPolarHBondContact O-CB 3.42Å; E343-E346 PolarHBondContact O-N 2.82Å; E346-S348 PolarHBondContact O-N 3.41Å; E346-T572 WeakPolarHBondContact OE1-CB 3.44Å; E346-T572 PolarHBondContact OE1-OG1 3.42Å
347	R	88.6	Confident	91.5	Very high	6 Å²	6	11.3 Å²	11.3	2%	0.023	5%	0.053	C	C	.	.			trans	54.2	49.3	176.5	-61.4	-61	-57.8	-73.4	-8.7	112.6	A344 H345 D352 D385 P645 E646 T674	A344-R347 WeakPolarHBondContact O-CD 3.49Å; A344-R347 PolarHBondContact O-N 3.43Å; H345-R347 PolarHBondContact O-N 3.02Å; R347-D352 IonicContact CZ-OD1 2.72Å; R347-D352 IonicContact CZ-OD2 3.24Å; R347-D352 IonicContact NE-OD1 3.52Å; R347-D352 PolarHBondContact NE-OD1 2.84Å; R347-D352 IonicContact NE-OD2 3.5Å; R347-D352 IonicContact NH2-OD1 3.14Å; R347-D352 PolarHBondContact NH2-OD1 3.04Å; R347-D352 IonicContact NH2-OD2 3.96Å; R347-D352 PolarHBondContact NH2-OD2 3.27Å; R347-D385 IonicContact CZ-OD2 3.32Å; R347-D385 IonicContact NH1-OD2 3.45Å; R347-D385 PolarHBondContact NH1-OD2 2.69Å; R347-P645 HydrophobicContact CB-CB 3.95Å; R347-P645 HydrophobicContact CB-CG 4.3Å; R347-E646 PolarHBondContact O-N 2.97Å; R347-E646 VanDerWaalsContact O-N 3.09Å; R347-T674 PolarHBondContact NH2-OG1 3.31Å
348	S	86.7	Confident	91.4	Very high	11 Å²	11	10.8 Å²	10.8	8%	0.077	5%	0.049	C	C	.	.			trans	-65	148.8	174.1	82.2	0	0	0	0	110.4	D320 E346 Y350 S351 D352 E646	D320-S348 PolarHBondContact OD2-OG 2.97Å; D320-S348 VanDerWaalsContact OD2-OG 3.07Å; E346-S348 PolarHBondContact O-N 3.41Å; S348-Y350 VanDerWaalsContact C-N 3.26Å; S348-Y350 PolarHBondContact O-N 3.36Å; S348-S351 PolarHBondContact N-OG 2.86Å; S348-S351 VanDerWaalsContact N-OG 3.14Å; S348-S351 PolarHBondContact O-N 3.45Å; S348-S351 PolarHBondContact O-OG 2.81Å; S348-S351 WeakPolarHBondContact OG-CB 3.41Å; S348-S351 PolarHBondContact OG-N 2.66Å; S348-S351 PolarHBondContact OG-OG 2.51Å; S348-D352 PolarHBondContact O-N 2.6Å; S348-D352 VanDerWaalsContact O-N 3.17Å; S348-E646 VanDerWaalsContact CA-OE2 3.26Å; S348-E646 WeakPolarHBondContact CA-OE2 3.4Å
349	M	86.5	Confident	91.2	Very high	17 Å²	17	11 Å²	11	8%	0.084	5%	0.05	C	C	.	.	H	α-helix	trans	-53.7	-44	177.7	-68.5	-175.6	69.5	0	0	112.5	V353 E646 I647 E650 L652 L655	M349-V353 WeakPolarHBondContact O-CG2 3.35Å; M349-V353 PolarHBondContact O-N 3.37Å; M349-E646 HydrophobicContact CG-CB 3.84Å; M349-E646 PolarHBondContact N-OE2 2.83Å; M349-I647 HydrophobicContact CE-CG1 4.3Å; M349-I647 HydrophobicContact CG-CB 4.16Å; M349-I647 HydrophobicContact CG-CG1 4.43Å; M349-E650 HydrophobicContact SD-CB 3.57Å; M349-E650 VanDerWaalsContact SD-CB 3.57Å; M349-E650 HydrophobicContact SD-CG 4.27Å; M349-L652 HydrophobicContact CE-CD2 3.94Å; M349-L655 HydrophobicContact CE-CB 3.88Å; M349-L655 HydrophobicContact CE-CD2 3.92Å
350	Y	87.6	Confident	90.8	Very high	92 Å²	92	15.7 Å²	15.7	36%	0.361	7%	0.068	S	C	.	.	H	α-helix	trans	-71.1	-38.8	-178.2	-67.6	-67.2	0	0	0	112.3	L324 S348 D352 V353 L354 D654	L324-Y350 HydrophobicContact CD2-CD1 3.73Å; L324-Y350 HydrophobicContact CD2-CE1 3.93Å; S348-Y350 VanDerWaalsContact C-N 3.26Å; S348-Y350 PolarHBondContact O-N 3.36Å; Y350-D352 VanDerWaalsContact C-N 3.35Å; Y350-D352 PolarHBondContact O-N 3.09Å; Y350-V353 PolarHBondContact O-N 3.16Å; Y350-L354 WeakPolarHBondContact O-CB 3.38Å; Y350-L354 VanDerWaalsContact O-CG 3.29Å; Y350-L354 WeakPolarHBondContact O-CG 2.9Å; Y350-L354 PolarHBondContact O-N 2.94Å; Y350-D654 PolarHBondContact OH-OD2 3.04Å
351	S	90.1	Very high	90.6	Very high	4 Å²	4	15.7 Å²	15.7	3%	0.028	7%	0.068	C	C	.	.	H	α-helix	trans	-59.8	-43.9	176	68.4	0	0	0	0	111.8	S348 V353 L354 I355	S348-S351 PolarHBondContact N-OG 2.86Å; S348-S351 VanDerWaalsContact N-OG 3.14Å; S348-S351 PolarHBondContact O-N 3.45Å; S348-S351 PolarHBondContact O-OG 2.81Å; S348-S351 WeakPolarHBondContact OG-CB 3.41Å; S348-S351 PolarHBondContact OG-N 2.66Å; S348-S351 PolarHBondContact OG-OG 2.51Å; S351-V353 VanDerWaalsContact C-N 3.31Å; S351-V353 PolarHBondContact O-N 3.09Å; S351-L354 PolarHBondContact O-N 3.46Å; S351-I355 VanDerWaalsContact O-CG1 3.27Å; S351-I355 WeakPolarHBondContact O-CG1 3.48Å; S351-I355 PolarHBondContact O-N 2.88Å
352	D	91.3	Very high	90.5	Very high	0 Å²	0	16 Å²	16	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-62.4	-39	178.4	-88.7	20.2	0	0	0	112.2	R347 S348 Y350 G356 P673	R347-D352 IonicContact CZ-OD1 2.72Å; R347-D352 IonicContact CZ-OD2 3.24Å; R347-D352 IonicContact NE-OD1 3.52Å; R347-D352 PolarHBondContact NE-OD1 2.84Å; R347-D352 IonicContact NE-OD2 3.5Å; R347-D352 IonicContact NH2-OD1 3.14Å; R347-D352 PolarHBondContact NH2-OD1 3.04Å; R347-D352 IonicContact NH2-OD2 3.96Å; R347-D352 PolarHBondContact NH2-OD2 3.27Å; S348-D352 PolarHBondContact O-N 2.6Å; S348-D352 VanDerWaalsContact O-N 3.17Å; Y350-D352 VanDerWaalsContact C-N 3.35Å; Y350-D352 PolarHBondContact O-N 3.09Å; D352-G356 PolarHBondContact O-N 2.92Å; D352-G356 VanDerWaalsContact O-N 3.11Å; D352-P673 HydrophobicContact CB-CG 4.18Å; D352-P673 VanDerWaalsContact O-CD 3.25Å; D352-P673 WeakPolarHBondContact O-CD 3.45Å
353	V	90.5	Very high	90.3	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-71.7	-41.6	178.1	176.2	0	0	0	0	111	L324 M349 Y350 S351 I355 G356 L357 L655 F670 F672	L324-V353 HydrophobicContact CD1-CG1 4.38Å; M349-V353 WeakPolarHBondContact O-CG2 3.35Å; M349-V353 PolarHBondContact O-N 3.37Å; Y350-V353 PolarHBondContact O-N 3.16Å; S351-V353 VanDerWaalsContact C-N 3.31Å; S351-V353 PolarHBondContact O-N 3.09Å; V353-I355 VanDerWaalsContact C-N 3.34Å; V353-I355 PolarHBondContact O-N 3.22Å; V353-G356 PolarHBondContact O-N 2.92Å; V353-L357 HydrophobicContact CG1-CD1 3.97Å; V353-L357 HydrophobicContact CG1-CG 4.41Å; V353-L357 WeakPolarHBondContact O-CB 3.25Å; V353-L357 WeakPolarHBondContact O-CG 3.43Å; V353-L357 PolarHBondContact O-N 3.48Å; V353-L655 HydrophobicContact CB-CD1 4.35Å; V353-L655 HydrophobicContact CG1-CD1 4.26Å; V353-L655 HydrophobicContact CG2-CD1 3.31Å; V353-L655 HydrophobicContact CG2-CD2 4.03Å; V353-L655 HydrophobicContact CG2-CG 4.3Å; V353-F670 HydrophobicContact CG1-CZ 4.33Å; V353-F670 WeakPolarHBondContact O-CZ 3.49Å; V353-F672 HydrophobicContact CG2-CE1 4.17Å
354	L	93	Very high	90.4	Very high	0 Å²	0	20 Å²	20	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-59.9	-45.4	174.5	-74.6	174.3	0	0	0	111.2	D320 L323 L324 I327 I341 Y350 S351 G356 L357 L358	D320-L354 HydrophobicContact CB-CD1 3.68Å; L323-L354 HydrophobicContact CB-CD1 4.38Å; L323-L354 HydrophobicContact CB-CD2 4.18Å; L323-L354 HydrophobicContact CD2-CD1 4.22Å; L323-L354 HydrophobicContact CD2-CD2 4Å; L323-L354 HydrophobicContact CG-CD2 3.97Å; L324-L354 HydrophobicContact CB-CD2 4.19Å; L324-L354 HydrophobicContact CD1-CD2 4.28Å; I327-L354 HydrophobicContact CD1-CD2 3.72Å; I341-L354 HydrophobicContact CD1-CB 4.04Å; Y350-L354 WeakPolarHBondContact O-CB 3.38Å; Y350-L354 VanDerWaalsContact O-CG 3.29Å; Y350-L354 WeakPolarHBondContact O-CG 2.9Å; Y350-L354 PolarHBondContact O-N 2.94Å; S351-L354 PolarHBondContact O-N 3.46Å; L354-G356 VanDerWaalsContact C-N 3.33Å; L354-G356 PolarHBondContact O-N 3.25Å; L354-L357 PolarHBondContact O-N 3.24Å; L354-L358 VanDerWaalsContact O-CB 3.31Å; L354-L358 WeakPolarHBondContact O-CB 3.02Å; L354-L358 WeakPolarHBondContact O-CD1 3.12Å; L354-L358 WeakPolarHBondContact O-CG 2.97Å; L354-L358 PolarHBondContact O-N 3.1Å
355	I	93.5	Very high	90.6	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-59.9	-44.6	177.3	-68.4	167.4	0	0	0	110.6	I341 S351 V353 S359 I376 F386 L391 F392 P673	I341-I355 HydrophobicContact CD1-CD1 4.48Å; I341-I355 HydrophobicContact CD1-CG1 3.51Å; S351-I355 VanDerWaalsContact O-CG1 3.27Å; S351-I355 WeakPolarHBondContact O-CG1 3.48Å; S351-I355 PolarHBondContact O-N 2.88Å; V353-I355 VanDerWaalsContact C-N 3.34Å; V353-I355 PolarHBondContact O-N 3.22Å; I355-S359 PolarHBondContact O-N 3.37Å; I355-I376 HydrophobicContact CG1-CD1 4.49Å; I355-I376 HydrophobicContact CG2-CD1 4.27Å; I355-F386 HydrophobicContact CD1-CD1 4.09Å; I355-F386 HydrophobicContact CD1-CE1 3.5Å; I355-F386 VanDerWaalsContact CD1-CE1 3.5Å; I355-F386 HydrophobicContact CD1-CZ 4.16Å; I355-F386 HydrophobicContact CG2-CD1 4.46Å; I355-L391 HydrophobicContact CG2-CD1 4.08Å; I355-L391 HydrophobicContact CG2-CD2 3.69Å; I355-L391 HydrophobicContact CG2-CG 4.35Å; I355-F392 HydrophobicContact CG2-CZ 4.19Å; I355-P673 HydrophobicContact CB-CG 4.14Å; I355-P673 HydrophobicContact CG2-CG 3.95Å
356	G	92.1	Very high	90.7	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-67.2	-33.5	176.8	0	0	0	0	0	114.4	D352 V353 L354 S359 F670 P671	D352-G356 PolarHBondContact O-N 2.92Å; D352-G356 VanDerWaalsContact O-N 3.11Å; V353-G356 PolarHBondContact O-N 2.92Å; L354-G356 VanDerWaalsContact C-N 3.33Å; L354-G356 PolarHBondContact O-N 3.25Å; G356-S359 PolarHBondContact O-OG 3.06Å; G356-S359 VanDerWaalsContact O-OG 3.1Å; G356-F670 VanDerWaalsContact C-CZ 3.45Å; G356-P671 WeakPolarHBondContact CA-O 3.48Å; G356-P671 WeakPolarHBondContact O-CG 3.14Å
357	L	92.1	Very high	91.1	Very high	4 Å²	4	29.6 Å²	29.6	2%	0.021	13%	0.127	C	C	.	.	H	α-helix	trans	-70.9	-48.5	174.3	-78.6	168.7	0	0	0	110.9	L324 I327 F331 V353 L354 S359 R360 I361 M662 I664 F670	L324-L357 HydrophobicContact CD1-CD1 3.54Å; I327-L357 HydrophobicContact CD1-CB 4.33Å; I327-L357 HydrophobicContact CD1-CD1 4.09Å; I327-L357 HydrophobicContact CG2-CD1 4.32Å; F331-L357 HydrophobicContact CE2-CD2 4.29Å; V353-L357 HydrophobicContact CG1-CD1 3.97Å; V353-L357 HydrophobicContact CG1-CG 4.41Å; V353-L357 WeakPolarHBondContact O-CB 3.25Å; V353-L357 WeakPolarHBondContact O-CG 3.43Å; V353-L357 PolarHBondContact O-N 3.48Å; L354-L357 PolarHBondContact O-N 3.24Å; L357-S359 VanDerWaalsContact C-N 3.28Å; L357-S359 PolarHBondContact O-N 2.72Å; L357-R360 WeakPolarHBondContact O-CA 3.18Å; L357-R360 WeakPolarHBondContact O-CB 3.11Å; L357-R360 PolarHBondContact O-N 2.79Å; L357-I361 HydrophobicContact CB-CD1 4.42Å; L357-I361 WeakPolarHBondContact O-CG1 3.34Å; L357-I361 PolarHBondContact O-N 3.38Å; L357-M662 HydrophobicContact CD1-CE 4.03Å; L357-M662 HydrophobicContact CD1-SD 4.03Å; L357-I664 HydrophobicContact CD2-CD1 3.9Å; L357-F670 HydrophobicContact CD2-CE2 3.98Å; L357-F670 HydrophobicContact CD2-CZ 4.42Å; L357-F670 HydrophobicContact CG-CE2 4.04Å; L357-F670 HydrophobicContact CG-CZ 3.97Å
358	L	94	Very high	91.3	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-62.6	-35.8	-178.8	-71.3	164.1	0	0	0	111.5	L333 I339 I341 L354 R360 I361 I362 L372 L374	L333-L358 HydrophobicContact CD1-CD2 3.74Å; I339-L358 HydrophobicContact CG1-CD2 4.45Å; I339-L358 HydrophobicContact CG2-CD1 3.86Å; I341-L358 HydrophobicContact CD1-CD1 3.66Å; I341-L358 HydrophobicContact CG1-CD1 4.38Å; L354-L358 VanDerWaalsContact O-CB 3.31Å; L354-L358 WeakPolarHBondContact O-CB 3.02Å; L354-L358 WeakPolarHBondContact O-CD1 3.12Å; L354-L358 WeakPolarHBondContact O-CG 2.97Å; L354-L358 PolarHBondContact O-N 3.1Å; L358-R360 PolarHBondContact O-N 3.26Å; L358-R360 VanDerWaalsContact O-N 3.17Å; L358-I361 HydrophobicContact CD2-CD1 4.31Å; L358-I361 PolarHBondContact O-N 3.14Å; L358-I362 WeakPolarHBondContact O-CB 3.47Å; L358-I362 VanDerWaalsContact O-CD1 3.3Å; L358-I362 WeakPolarHBondContact O-CD1 3.2Å; L358-I362 WeakPolarHBondContact O-CG1 3.5Å; L358-I362 PolarHBondContact O-N 2.74Å; L358-L372 HydrophobicContact CD2-CD2 4.19Å; L358-L374 HydrophobicContact CB-CD2 4.04Å; L358-L374 HydrophobicContact CD1-CD1 3.81Å
359	S	92.6	Very high	91.4	Very high	4 Å²	4	45.5 Å²	45.5	3%	0.028	19%	0.194	C	C	.	.	H	α-helix	trans	-60.3	-26.7	174.5	85.5	0	0	0	0	113.3	I355 G356 L357 L363 L391 F392	I355-S359 PolarHBondContact O-N 3.37Å; G356-S359 PolarHBondContact O-OG 3.06Å; G356-S359 VanDerWaalsContact O-OG 3.1Å; L357-S359 VanDerWaalsContact C-N 3.28Å; L357-S359 PolarHBondContact O-N 2.72Å; S359-L363 WeakPolarHBondContact O-CD1 3.25Å; S359-L363 WeakPolarHBondContact O-CG 3.3Å; S359-L391 WeakPolarHBondContact CB-O 3.38Å; S359-L391 PolarHBondContact OG-O 3.27Å; S359-L391 VanDerWaalsContact OG-O 3.1Å; S359-F392 VanDerWaalsContact CB-CE1 3.46Å
360	R	90.2	Very high	91.5	Very high	100 Å²	100	47.7 Å²	47.7	38%	0.377	21%	0.205	S	C	.	.	H	α-helix	trans	-85.8	-42.9	173	-62.1	-63.5	-176.7	155	-2	112.6	L357 L358 I362 L363 I364 P671	L357-R360 WeakPolarHBondContact O-CA 3.18Å; L357-R360 WeakPolarHBondContact O-CB 3.11Å; L357-R360 PolarHBondContact O-N 2.79Å; L358-R360 PolarHBondContact O-N 3.26Å; L358-R360 VanDerWaalsContact O-N 3.17Å; R360-I362 VanDerWaalsContact C-N 3.32Å; R360-I362 PolarHBondContact O-N 3.39Å; R360-L363 PolarHBondContact O-N 3.07Å; R360-I364 WeakPolarHBondContact O-CG1 3.14Å; R360-I364 PolarHBondContact O-N 2.9Å; R360-P671 HydrophobicContact CG-CG 4.43Å
361	I	93	Very high	91.7	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-59.9	-43.9	-179.8	-66.2	165.3	0	0	0	110.6	I327 F331 L333 L357 L358 L363 I364 R365 L372	I327-I361 HydrophobicContact CD1-CD1 4.08Å; I327-I361 HydrophobicContact CG1-CD1 4.23Å; I327-I361 HydrophobicContact CG2-CD1 4.15Å; F331-I361 HydrophobicContact CD1-CG1 4.47Å; F331-I361 HydrophobicContact CE1-CG1 4.04Å; F331-I361 HydrophobicContact CE2-CG1 4.44Å; F331-I361 HydrophobicContact CZ-CG1 4.03Å; F331-I361 VanDerWaalsContact O-CD1 3.22Å; F331-I361 WeakPolarHBondContact O-CD1 3.16Å; F331-I361 WeakPolarHBondContact O-CG1 3.44Å; L333-I361 HydrophobicContact CD1-CD1 4.4Å; L357-I361 HydrophobicContact CB-CD1 4.42Å; L357-I361 WeakPolarHBondContact O-CG1 3.34Å; L357-I361 PolarHBondContact O-N 3.38Å; L358-I361 HydrophobicContact CD2-CD1 4.31Å; L358-I361 PolarHBondContact O-N 3.14Å; I361-L363 VanDerWaalsContact C-N 3.35Å; I361-L363 PolarHBondContact O-N 3.24Å; I361-I364 PolarHBondContact O-N 2.83Å; I361-I364 VanDerWaalsContact O-N 3.11Å; I361-R365 HydrophobicContact CG2-CG 4.35Å; I361-R365 WeakPolarHBondContact O-CB 3.29Å; I361-R365 PolarHBondContact O-N 2.97Å; I361-L372 HydrophobicContact CG2-CD2 4Å
362	I	93.5	Very high	91.9	Very high	5 Å²	5	49.1 Å²	49.1	3%	0.026	21%	0.213	C	C	.	.	H	α-helix	trans	-57.8	-46.4	179.2	-69.2	163.7	0	0	0	111	Q239 V240 L358 R360 I364 R365 E366 L372 L374	Q239-I362 HydrophobicContact CB-CG2 3.91Å; Q239-I362 HydrophobicContact CG-CG2 4.36Å; V240-I362 HydrophobicContact CG2-CD1 3.96Å; L358-I362 WeakPolarHBondContact O-CB 3.47Å; L358-I362 VanDerWaalsContact O-CD1 3.3Å; L358-I362 WeakPolarHBondContact O-CD1 3.2Å; L358-I362 WeakPolarHBondContact O-CG1 3.5Å; L358-I362 PolarHBondContact O-N 2.74Å; R360-I362 VanDerWaalsContact C-N 3.32Å; R360-I362 PolarHBondContact O-N 3.39Å; I362-I364 VanDerWaalsContact C-N 3.29Å; I362-I364 PolarHBondContact O-N 3.46Å; I362-R365 PolarHBondContact O-N 2.97Å; I362-E366 WeakPolarHBondContact O-CB 3.3Å; I362-E366 PolarHBondContact O-N 2.92Å; I362-L372 HydrophobicContact CG1-CB 4.48Å; I362-L372 HydrophobicContact CG1-CD2 4.29Å; I362-L374 HydrophobicContact CD1-CB 3.49Å; I362-L374 VanDerWaalsContact CD1-CB 3.49Å; I362-L374 HydrophobicContact CD1-CD2 3.81Å; I362-L374 HydrophobicContact CD1-CG 4.29Å
363	L	91	Very high	92.1	Very high	42 Å²	42	50.5 Å²	50.5	22%	0.22	22%	0.219	C	C	.	.	H	α-helix	trans	-62.6	-34.5	177.5	-67.2	173.2	0	0	0	112.9	S359 R360 I361 R367 K393	S359-L363 WeakPolarHBondContact O-CD1 3.25Å; S359-L363 WeakPolarHBondContact O-CG 3.3Å; R360-L363 PolarHBondContact O-N 3.07Å; I361-L363 VanDerWaalsContact C-N 3.35Å; I361-L363 PolarHBondContact O-N 3.24Å; L363-R367 WeakPolarHBondContact O-CG 3.42Å; L363-K393 HydrophobicContact CD1-CD 4.43Å; L363-K393 HydrophobicContact CD2-CD 4.04Å
364	I	91.9	Very high	92.4	Very high	58 Å²	58	50.6 Å²	50.6	30%	0.297	22%	0.22	S	C	.	.	H	α-helix	trans	-74.3	-41.5	178	-65	163.9	0	0	0	110.3	F331 L332 R360 I361 I362 R367 R368	F331-I364 HydrophobicContact CE1-CD1 3.78Å; L332-I364 HydrophobicContact CD2-CB 4.35Å; L332-I364 HydrophobicContact CD2-CG2 3.62Å; R360-I364 WeakPolarHBondContact O-CG1 3.14Å; R360-I364 PolarHBondContact O-N 2.9Å; I361-I364 PolarHBondContact O-N 2.83Å; I361-I364 VanDerWaalsContact O-N 3.11Å; I362-I364 VanDerWaalsContact C-N 3.29Å; I362-I364 PolarHBondContact O-N 3.46Å; I364-R367 WeakPolarHBondContact O-CB 3.29Å; I364-R367 PolarHBondContact O-N 2.87Å; I364-R368 PolarHBondContact O-N 3.45Å
365	R	93.9	Very high	92.6	Very high	3 Å²	3	50.6 Å²	50.6	1%	0.011	22%	0.22	C	C	.	.	H	α-helix	trans	-69	-34.8	178.9	-84.6	-156.7	58.3	-172.6	-9.8	113.4	L332 L333 Y336 I361 I362 R367 R368 Q369 D370 K371	L332-R365 HydrophobicContact CD2-CG 4.44Å; L332-R365 WeakPolarHBondContact O-CD 3.33Å; L333-R365 PolarHBondContact O-NH1 3.07Å; Y336-R365 PolarHBondContact O-NH1 2.63Å; I361-R365 HydrophobicContact CG2-CG 4.35Å; I361-R365 WeakPolarHBondContact O-CB 3.29Å; I361-R365 PolarHBondContact O-N 2.97Å; I362-R365 PolarHBondContact O-N 2.97Å; R365-R367 VanDerWaalsContact C-N 3.32Å; R365-R367 PolarHBondContact O-N 2.75Å; R365-R368 CarbonylContact O-C 2.99Å; R365-R368 PolarHBondContact O-N 2.74Å; R365-R368 VanDerWaalsContact O-N 3.14Å; R365-Q369 PolarHBondContact O-N 2.73Å; R365-D370 WeakPolarHBondContact CB-O 3.3Å; R365-D370 VanDerWaalsContact CZ-O 3.26Å; R365-D370 IonicContact CZ-OD1 3.55Å; R365-D370 IonicContact CZ-OD2 2.78Å; R365-D370 PolarHBondContact NE-O 3.1Å; R365-D370 IonicContact NE-OD2 3.58Å; R365-D370 PolarHBondContact NH2-O 3.12Å; R365-D370 IonicContact NH2-OD1 2.73Å; R365-D370 PolarHBondContact NH2-OD1 3Å; R365-D370 IonicContact NH2-OD2 3.11Å; R365-D370 PolarHBondContact NH2-OD2 2.81Å; R365-D370 VanDerWaalsContact NH2-OD2 3.14Å; R365-D370 PolarHBondContact O-N 2.9Å; R365-D370 VanDerWaalsContact O-N 3.14Å; R365-K371 PolarHBondContact NH2-O 3.44Å; R365-K371 VanDerWaalsContact NH2-O 3.09Å
366	E	90.4	Very high	92.7	Very high	90 Å²	90	50.6 Å²	50.6	42%	0.421	22%	0.22	S	C	.	.	H	α-helix	trans	-56.6	-45.5	170	179.1	170.5	-127.8	0	0	111.8	Q239 I362 R368 Q369	Q239-E366 VanDerWaalsContact NE2-CD 3.26Å; Q239-E366 PolarHBondContact NE2-OE1 2.93Å; I362-E366 WeakPolarHBondContact O-CB 3.3Å; I362-E366 PolarHBondContact O-N 2.92Å; E366-R368 VanDerWaalsContact C-N 3.25Å; E366-R368 PolarHBondContact O-N 3.46Å; E366-Q369 PolarHBondContact O-N 3.29Å; E366-Q369 VanDerWaalsContact O-N 3.08Å
367	R	91.6	Very high	92.8	Very high	185 Å²	185	50.6 Å²	50.6	70%	0.698	22%	0.22	S	C	*	.	H	α-helix	trans	-64.2	-28.6	177	-68.1	173.9	-179.4	-173.4	-3.4	113.3	L363 I364 R365 Q369	L363-R367 WeakPolarHBondContact O-CG 3.42Å; I364-R367 WeakPolarHBondContact O-CB 3.29Å; I364-R367 PolarHBondContact O-N 2.87Å; R365-R367 VanDerWaalsContact C-N 3.32Å; R365-R367 PolarHBondContact O-N 2.75Å; R367-Q369 VanDerWaalsContact C-N 3.25Å; R367-Q369 PolarHBondContact O-N 3.26Å
368	R	91.7	Very high	92.7	Very high	167 Å²	167	50.4 Å²	50.4	63%	0.63	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.3	7.7	176.5	-65.9	-172.7	179.2	-155.1	1.4	113.4	L332 I364 R365 E366 D370	L332-R368 VanDerWaalsContact CD1-CZ 3.4Å; I364-R368 PolarHBondContact O-N 3.45Å; R365-R368 CarbonylContact O-C 2.99Å; R365-R368 PolarHBondContact O-N 2.74Å; R365-R368 VanDerWaalsContact O-N 3.14Å; E366-R368 VanDerWaalsContact C-N 3.25Å; E366-R368 PolarHBondContact O-N 3.46Å; R368-D370 PolarHBondContact O-N 3.06Å; R368-D370 VanDerWaalsContact O-N 3.11Å
369	Q	88.3	Confident	92.1	Very high	185 Å²	185	50.9 Å²	50.9	86%	0.864	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	57	21.4	-176.6	-59.6	-175.1	-24	0	0	114.3	R365 E366 R367	R365-Q369 PolarHBondContact O-N 2.73Å; E366-Q369 PolarHBondContact O-N 3.29Å; E366-Q369 VanDerWaalsContact O-N 3.08Å; R367-Q369 VanDerWaalsContact C-N 3.25Å; R367-Q369 PolarHBondContact O-N 3.26Å
370	D	89.2	Confident	91.4	Very high	62 Å²	62	51.8 Å²	51.8	33%	0.332	23%	0.228	S	C	.	.			trans	-121.2	81	179.7	-179	15.3	0	0	0	109.6	K269 R365 R368	K269-D370 IonicContact NZ-OD1 2.79Å; K269-D370 PolarHBondContact NZ-OD1 3.01Å; K269-D370 IonicContact NZ-OD2 3.62Å; K269-D370 PolarHBondContact NZ-OD2 2.95Å; R365-D370 WeakPolarHBondContact CB-O 3.3Å; R365-D370 VanDerWaalsContact CZ-O 3.26Å; R365-D370 IonicContact CZ-OD1 3.55Å; R365-D370 IonicContact CZ-OD2 2.78Å; R365-D370 PolarHBondContact NE-O 3.1Å; R365-D370 IonicContact NE-OD2 3.58Å; R365-D370 PolarHBondContact NH2-O 3.12Å; R365-D370 IonicContact NH2-OD1 2.73Å; R365-D370 PolarHBondContact NH2-OD1 3Å; R365-D370 IonicContact NH2-OD2 3.11Å; R365-D370 PolarHBondContact NH2-OD2 2.81Å; R365-D370 VanDerWaalsContact NH2-OD2 3.14Å; R365-D370 PolarHBondContact O-N 2.9Å; R365-D370 VanDerWaalsContact O-N 3.14Å; R368-D370 PolarHBondContact O-N 3.06Å; R368-D370 VanDerWaalsContact O-N 3.11Å
371	K	91.4	Very high	90.6	Very high	125 Å²	125	52 Å²	52	54%	0.543	24%	0.237	S	C	.	.			trans	-62.8	137.8	-169.8	-64.7	-177.9	179.6	-177.8	0	112.7	R365	R365-K371 PolarHBondContact NH2-O 3.44Å; R365-K371 VanDerWaalsContact NH2-O 3.09Å
372	L	95.1	Very high	89.7	Confident	2 Å²	2	54.1 Å²	54.1	1%	0.01	24%	0.244	C	C	.	.			trans	-112.5	129.4	168.7	179.1	66.4	0	0	0	108.5	I339 L358 I361 I362	I339-L372 HydrophobicContact CG1-CD1 4.2Å; L358-L372 HydrophobicContact CD2-CD2 4.19Å; I361-L372 HydrophobicContact CG2-CD2 4Å; I362-L372 HydrophobicContact CG1-CB 4.48Å; I362-L372 HydrophobicContact CG1-CD2 4.29Å
373	H	95.8	Very high	89.1	Confident	28 Å²	28	54.5 Å²	54.5	13%	0.13	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	135.7	177.2	-57.2	83.9	0	0	0	110.6	I235 Q239 F264 S337 A338 I339	I235-H373 HydrophobicContact CG2-CB 4.07Å; I235-H373 PolarHBondContact O-CD2 3.46Å; Q239-H373 CarbonylContact O-C 3.56Å; Q239-H373 WeakPolarHBondContact O-CA 3.47Å; F264-H373 AromaticContact CE1-CE1 3.83Å; F264-H373 AromaticContact CE1-CG 3.92Å; F264-H373 AromaticContact CE1-ND1 3.56Å; S337-H373 PolarHBondContact O-N 3.34Å; S337-H373 VanDerWaalsContact O-N 3.08Å; S337-H373 PolarHBondContact O-ND1 3.35Å; A338-H373 CarbonylContact C-O 3.58Å; A338-H373 VanDerWaalsContact CA-O 3.27Å; A338-H373 WeakPolarHBondContact CA-O 3.27Å; A338-H373 HydrophobicContact CB-CB 4.28Å; I339-H373 PolarHBondContact N-O 2.89Å
374	L	96.7	Very high	88.8	Confident	2 Å²	2	57.8 Å²	57.8	1%	0.01	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	123.7	176.6	174.8	60.8	0	0	0	110.2	Q239 V240 V241 I339 I341 L358 I362 I376 F392	Q239-L374 PolarHBondContact O-N 2.87Å; V240-L374 WeakPolarHBondContact CA-O 3.39Å; V240-L374 HydrophobicContact CG1-CB 4.45Å; V240-L374 HydrophobicContact CG1-CD2 4.17Å; V240-L374 HydrophobicContact CG1-CG 4.34Å; V240-L374 HydrophobicContact CG2-CB 4.39Å; V241-L374 PolarHBondContact N-O 3.18Å; I339-L374 HydrophobicContact CG2-CD1 4.37Å; I339-L374 WeakPolarHBondContact O-CA 3.29Å; I341-L374 HydrophobicContact CD1-CD1 4.27Å; I341-L374 HydrophobicContact CG1-CD1 4.22Å; L358-L374 HydrophobicContact CB-CD2 4.04Å; L358-L374 HydrophobicContact CD1-CD1 3.81Å; I362-L374 HydrophobicContact CD1-CB 3.49Å; I362-L374 VanDerWaalsContact CD1-CB 3.49Å; I362-L374 HydrophobicContact CD1-CD2 3.81Å; I362-L374 HydrophobicContact CD1-CG 4.29Å; L374-I376 HydrophobicContact CD1-CG1 4.45Å; L374-I376 HydrophobicContact CD2-CD1 4.4Å; L374-I376 HydrophobicContact CD2-CG1 4.38Å; L374-I376 HydrophobicContact CG-CG1 4.17Å; L374-F392 HydrophobicContact CD2-CE1 4.05Å; L374-F392 HydrophobicContact CD2-CZ 3.98Å
375	V	96.9	Very high	88.4	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	117.1	174	-170.8	0	0	0	0	109.3	I235 V241 V243 V255 I339 L340 I341 M377	I235-V375 HydrophobicContact CD1-CG2 3.69Å; I235-V375 HydrophobicContact CG1-CG2 4.07Å; V241-V375 CarbonylContact O-C 3.58Å; V241-V375 VanDerWaalsContact O-CA 3.3Å; V241-V375 WeakPolarHBondContact O-CA 3.38Å; V243-V375 HydrophobicContact CG2-CG1 3.77Å; V255-V375 HydrophobicContact CG1-CG1 4.45Å; I339-V375 PolarHBondContact O-N 2.86Å; L340-V375 CarbonylContact C-O 3.54Å; L340-V375 VanDerWaalsContact CA-O 3.27Å; L340-V375 WeakPolarHBondContact CA-O 3.19Å; L340-V375 HydrophobicContact CG-CB 4.02Å; L340-V375 HydrophobicContact CG-CG2 4.36Å; I341-V375 PolarHBondContact N-O 3.39Å; V375-M377 HydrophobicContact CG1-CG 4.06Å
376	I	95.4	Very high	88	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	114.4	176.3	-56.5	176.9	0	0	0	107.8	V241 I242 V243 A344 I355 L374 F386 F392	V241-I376 PolarHBondContact O-N 2.98Å; I242-I376 CarbonylContact C-O 3.57Å; I242-I376 VanDerWaalsContact CA-O 3.3Å; I242-I376 WeakPolarHBondContact CA-O 3.44Å; I242-I376 HydrophobicContact CG1-CB 4.26Å; I242-I376 HydrophobicContact CG2-CB 4.4Å; V243-I376 PolarHBondContact N-O 2.82Å; A344-I376 HydrophobicContact CB-CG2 3.53Å; I355-I376 HydrophobicContact CG1-CD1 4.49Å; I355-I376 HydrophobicContact CG2-CD1 4.27Å; L374-I376 HydrophobicContact CD1-CG1 4.45Å; L374-I376 HydrophobicContact CD2-CD1 4.4Å; L374-I376 HydrophobicContact CD2-CG1 4.38Å; L374-I376 HydrophobicContact CG-CG1 4.17Å; I376-F386 HydrophobicContact CG2-CD2 4.45Å; I376-F386 HydrophobicContact CG2-CE2 4.46Å; I376-F392 HydrophobicContact CD1-CE2 4.21Å; I376-F392 HydrophobicContact CD1-CZ 4.1Å
377	M	94	Very high	87.7	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	130.5	-179.7	-56.9	-174.4	-65.5	0	0	110.4	V243 K251 V255 V273 L340 I341 D342 E343 A344 V375	V243-M377 HydrophobicContact CB-CG 4.35Å; V243-M377 WeakPolarHBondContact O-CA 3.46Å; K251-M377 HydrophobicContact CB-SD 4.25Å; V255-M377 HydrophobicContact CB-SD 3.98Å; V255-M377 HydrophobicContact CG1-SD 4.22Å; V255-M377 HydrophobicContact CG2-SD 4.09Å; V273-M377 HydrophobicContact CG1-CE 4.41Å; L340-M377 HydrophobicContact CB-CE 3.97Å; L340-M377 HydrophobicContact CD2-CE 3.91Å; L340-M377 HydrophobicContact CD2-SD 4.07Å; I341-M377 PolarHBondContact O-N 2.74Å; D342-M377 HydrophobicContact CB-CE 3.6Å; D342-M377 VanDerWaalsContact CG-CE 3.48Å; D342-M377 WeakPolarHBondContact OD1-CB 3.18Å; E343-M377 PolarHBondContact N-O 3.12Å; A344-M377 WeakPolarHBondContact CB-O 3.31Å; A344-M377 PolarHBondContact N-O 3Å; V375-M377 HydrophobicContact CG1-CG 4.06Å
378	S	90.1	Very high	87	Confident	0 Å²	0	49 Å²	49	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	137.8	-176.8	174	0	0	0	0	111.4	V243 C244 G245 T380	V243-S378 PolarHBondContact O-N 3.04Å; C244-S378 WeakPolarHBondContact CA-O 3.29Å; G245-S378 PolarHBondContact N-O 3.22Å; S378-T380 PolarHBondContact OG-N 2.83Å; S378-T380 VanDerWaalsContact OG-N 3.09Å; S378-T380 PolarHBondContact OG-O 2.93Å
379	A	82.6	Confident	86.3	Confident	10 Å²	10	46.1 Å²	46.1	8%	0.083	23%	0.233	C	C	.	.	S	Bend	trans	-77.3	-12.5	172.3	0	0	0	0	0	113.4	G245 T247 H345	G245-A379 VanDerWaalsContact O-CA 3.26Å; G245-A379 WeakPolarHBondContact O-CA 3.48Å; T247-A379 HydrophobicContact CG2-CB 3.8Å; H345-A379 WeakPolarHBondContact CE1-CB 3.5Å; H345-A379 PolarHBondContact ND1-N 3.1Å; H345-A379 VanDerWaalsContact ND1-N 3.16Å
380	T	77.6	Confident	86	Confident	23 Å²	23	43.5 Å²	43.5	14%	0.141	22%	0.219	C	C	.	.	S	Bend	trans	-123.9	155.9	-175.7	75	0	0	0	0	110.9	H345 S378 R382	H345-T380 HydrophobicContact CB-CG2 4.02Å; H345-T380 WeakPolarHBondContact CB-OG1 3.5Å; S378-T380 PolarHBondContact OG-N 2.83Å; S378-T380 VanDerWaalsContact OG-N 3.09Å; S378-T380 PolarHBondContact OG-O 2.93Å; T380-R382 PolarHBondContact O-N 3.43Å; T380-R382 VanDerWaalsContact O-N 3.17Å; T380-R382 PolarHBondContact OG1-N 3.06Å
381	L	72.3	Confident	85.8	Confident	106 Å²	106	41 Å²	41	56%	0.555	21%	0.205	S	C	*	.	S	Bend	trans	-74.4	5.3	174.2	-64.5	170	0	0	0	113.2	C244 V383 K400	C244-L381 HydrophobicContact CB-CD2 4.16Å; L381-V383 VanDerWaalsContact C-N 3.3Å; L381-V383 PolarHBondContact O-N 3Å; L381-K400 HydrophobicContact CD2-CD 4.01Å; L381-K400 HydrophobicContact CD2-CG 4.04Å
382	R	73.9	Confident	85.6	Confident	43 Å²	43	35.6 Å²	35.6	16%	0.162	18%	0.182	C	C	.	.			trans	-77.2	83.1	176.7	-169	-163.6	176.6	170.6	-3.9	109.8	T380 D385 Y642 S643	T380-R382 PolarHBondContact O-N 3.43Å; T380-R382 VanDerWaalsContact O-N 3.17Å; T380-R382 PolarHBondContact OG1-N 3.06Å; R382-D385 IonicContact CZ-OD2 3.16Å; R382-D385 VanDerWaalsContact CZ-OD2 3.32Å; R382-D385 IonicContact NE-OD2 3.62Å; R382-D385 PolarHBondContact NE-OD2 3.25Å; R382-D385 VanDerWaalsContact NE-OD2 3.13Å; R382-D385 IonicContact NH2-OD2 2.84Å; R382-D385 PolarHBondContact NH2-OD2 2.84Å; R382-Y642 HydrophobicContact CB-CD1 3.94Å; R382-Y642 HydrophobicContact CB-CE1 3.48Å; R382-Y642 VanDerWaalsContact CB-CE1 3.48Å; R382-Y642 HydrophobicContact CB-CE2 4.15Å; R382-Y642 HydrophobicContact CB-CG 4.49Å; R382-Y642 VanDerWaalsContact CD-CG 3.46Å; R382-Y642 HydrophobicContact CG-CD1 4.05Å; R382-Y642 HydrophobicContact CG-CD2 3.9Å; R382-Y642 HydrophobicContact CG-CE1 3.86Å; R382-Y642 HydrophobicContact CG-CE2 3.64Å; R382-Y642 HydrophobicContact CG-CG 4.08Å; R382-S643 PolarHBondContact NH1-O 2.91Å
383	V	82	Confident	85	Confident	13 Å²	13	43.4 Å²	43.4	8%	0.079	22%	0.216	C	C	.	.			trans	-114.8	-1	176.3	-62.5	0	0	0	0	113.2	I242 C244 L381 D385 F386 L387 V398	I242-V383 HydrophobicContact CD1-CB 4.41Å; I242-V383 HydrophobicContact CG2-CB 4.32Å; I242-V383 HydrophobicContact CG2-CG1 3.63Å; C244-V383 WeakPolarHBondContact SG-CG1 3.41Å; L381-V383 VanDerWaalsContact C-N 3.3Å; L381-V383 PolarHBondContact O-N 3Å; V383-D385 PolarHBondContact O-N 3.34Å; V383-F386 HydrophobicContact CB-CD2 4.3Å; V383-F386 HydrophobicContact CG1-CD2 4.39Å; V383-F386 WeakPolarHBondContact O-CA 3.33Å; V383-F386 WeakPolarHBondContact O-CB 3.32Å; V383-F386 PolarHBondContact O-N 2.88Å; V383-L387 HydrophobicContact CG2-CD1 4Å; V383-L387 HydrophobicContact CG2-CG 4.39Å; V383-L387 WeakPolarHBondContact O-CG 3.44Å; V383-L387 PolarHBondContact O-N 3.29Å; V383-L387 VanDerWaalsContact O-N 3.14Å; V383-V398 HydrophobicContact CG2-CG1 4.3Å; V383-V398 HydrophobicContact CG2-CG2 4.24Å
384	E	83.8	Confident	84.4	Confident	111 Å²	111	48.7 Å²	48.7	52%	0.519	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	-48.7	-44.9	-179.7	-64.2	162.8	-157.8	0	0	112	F386 L387 K641	E384-F386 PolarHBondContact O-N 3.4Å; E384-L387 PolarHBondContact O-N 2.99Å; E384-L387 VanDerWaalsContact O-N 3.13Å; E384-K641 IonicContact OE1-NZ 2.75Å
385	D	83.6	Confident	84	Confident	29 Å²	29	52.7 Å²	52.7	16%	0.155	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-63.2	-27.3	178.8	-63.9	-30.7	0	0	0	112.7	R347 R382 V383 M388	R347-D385 IonicContact CZ-OD2 3.32Å; R347-D385 IonicContact NH1-OD2 3.45Å; R347-D385 PolarHBondContact NH1-OD2 2.69Å; R382-D385 IonicContact CZ-OD2 3.16Å; R382-D385 VanDerWaalsContact CZ-OD2 3.32Å; R382-D385 IonicContact NE-OD2 3.62Å; R382-D385 PolarHBondContact NE-OD2 3.25Å; R382-D385 VanDerWaalsContact NE-OD2 3.13Å; R382-D385 IonicContact NH2-OD2 2.84Å; R382-D385 PolarHBondContact NH2-OD2 2.84Å; V383-D385 PolarHBondContact O-N 3.34Å; D385-M388 WeakPolarHBondContact O-CE 3.4Å
386	F	85.3	Confident	83.8	Confident	1 Å²	1	53.1 Å²	53.1	0%	0.004	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-90.8	-13.4	178.4	-52.2	-55.1	0	0	0	113.4	I242 A344 I355 I376 V383 E384 M388 L391 F392 P673	I242-F386 HydrophobicContact CD1-CB 3.77Å; A344-F386 HydrophobicContact CB-CE2 4.26Å; A344-F386 HydrophobicContact CB-CZ 4.08Å; I355-F386 HydrophobicContact CD1-CD1 4.09Å; I355-F386 HydrophobicContact CD1-CE1 3.5Å; I355-F386 VanDerWaalsContact CD1-CE1 3.5Å; I355-F386 HydrophobicContact CD1-CZ 4.16Å; I355-F386 HydrophobicContact CG2-CD1 4.46Å; I376-F386 HydrophobicContact CG2-CD2 4.45Å; I376-F386 HydrophobicContact CG2-CE2 4.46Å; V383-F386 HydrophobicContact CB-CD2 4.3Å; V383-F386 HydrophobicContact CG1-CD2 4.39Å; V383-F386 WeakPolarHBondContact O-CA 3.33Å; V383-F386 WeakPolarHBondContact O-CB 3.32Å; V383-F386 PolarHBondContact O-N 2.88Å; E384-F386 PolarHBondContact O-N 3.4Å; F386-M388 VanDerWaalsContact C-N 3.33Å; F386-L391 HydrophobicContact CD1-CD2 4.45Å; F386-F392 WeakPolarHBondContact O-CD2 3.48Å; F386-P673 HydrophobicContact CD1-CB 4.03Å; F386-P673 HydrophobicContact CD1-CG 4.37Å; F386-P673 HydrophobicContact CE1-CB 3.9Å; F386-P673 HydrophobicContact CE1-CG 4.17Å
387	L	84.6	Confident	83.6	Confident	54 Å²	54	55.6 Å²	55.6	28%	0.283	28%	0.283	S	S	.	.	S	Bend	trans	-89.5	-0	178.2	-62.9	176.9	0	0	0	112.8	I242 V383 E384 T395 V398	I242-L387 HydrophobicContact CD1-CD2 4Å; V383-L387 HydrophobicContact CG2-CD1 4Å; V383-L387 HydrophobicContact CG2-CG 4.39Å; V383-L387 WeakPolarHBondContact O-CG 3.44Å; V383-L387 PolarHBondContact O-N 3.29Å; V383-L387 VanDerWaalsContact O-N 3.14Å; E384-L387 PolarHBondContact O-N 2.99Å; E384-L387 VanDerWaalsContact O-N 3.13Å; L387-T395 HydrophobicContact CB-CG2 4.38Å; L387-T395 HydrophobicContact CD2-CG2 3.85Å; L387-V398 HydrophobicContact CD1-CG2 4.42Å; L387-V398 HydrophobicContact CD2-CG2 3.77Å
388	M	77.9	Confident	83.6	Confident	67 Å²	67	58.6 Å²	58.6	33%	0.33	30%	0.301	S	S	.	.			trans	-67.7	133.9	-177.6	-69.3	-163.1	-65.8	0	0	112.4	D385 F386 K390 L391 F392 P673	D385-M388 WeakPolarHBondContact O-CE 3.4Å; F386-M388 VanDerWaalsContact C-N 3.33Å; M388-K390 PolarHBondContact O-N 3.48Å; M388-K390 VanDerWaalsContact O-N 3.08Å; M388-L391 PolarHBondContact O-N 3.23Å; M388-F392 PolarHBondContact O-N 3.31Å; M388-P673 WeakPolarHBondContact CE-O 3.46Å
389	P	75.9	Confident	83.7	Confident	107 Å²	107	59.4 Å²	59.4	70%	0.695	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-23	179.3	-24.8	32.8	0	0	0	114.9	L391 F392	P389-L391 PolarHBondContact O-N 3.01Å; P389-F392 CarbonylContact C-O 3.59Å; P389-F392 WeakPolarHBondContact CA-O 3.36Å; P389-F392 VanDerWaalsContact O-O 3.1Å
390	K	81.1	Confident	84	Confident	130 Å²	130	65 Å²	65	57%	0.565	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-28.8	177.3	-171.6	179.9	177.9	-173.6	0	111.9	M388	M388-K390 PolarHBondContact O-N 3.48Å; M388-K390 VanDerWaalsContact O-N 3.08Å
391	L	86.1	Confident	84.4	Confident	9 Å²	9	64.1 Å²	64.1	5%	0.047	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-51.8	-176.8	-177	63.6	0	0	0	111.3	I355 S359 F386 M388 P389 P671 P673	I355-L391 HydrophobicContact CG2-CD1 4.08Å; I355-L391 HydrophobicContact CG2-CD2 3.69Å; I355-L391 HydrophobicContact CG2-CG 4.35Å; S359-L391 WeakPolarHBondContact CB-O 3.38Å; S359-L391 PolarHBondContact OG-O 3.27Å; S359-L391 VanDerWaalsContact OG-O 3.1Å; F386-L391 HydrophobicContact CD1-CD2 4.45Å; M388-L391 PolarHBondContact O-N 3.23Å; P389-L391 PolarHBondContact O-N 3.01Å; L391-P671 HydrophobicContact CD1-CB 4.17Å; L391-P671 WeakPolarHBondContact CD1-O 3.26Å; L391-P673 HydrophobicContact CD2-CG 4.36Å
392	F	87.2	Confident	84.5	Confident	12 Å²	12	64.2 Å²	64.2	5%	0.053	32%	0.324	C	S	.	.			trans	-123.5	135.3	178.3	-57.1	-69.8	0	0	0	110.4	V240 I355 S359 L374 I376 F386 M388 P389 Q394 P396	V240-F392 HydrophobicContact CB-CE1 4.47Å; V240-F392 HydrophobicContact CG1-CD1 4.33Å; V240-F392 HydrophobicContact CG1-CE1 3.91Å; V240-F392 HydrophobicContact CG1-CE2 4.11Å; V240-F392 HydrophobicContact CG1-CZ 3.8Å; V240-F392 HydrophobicContact CG2-CD1 3.89Å; V240-F392 HydrophobicContact CG2-CE1 3.83Å; I355-F392 HydrophobicContact CG2-CZ 4.19Å; S359-F392 VanDerWaalsContact CB-CE1 3.46Å; L374-F392 HydrophobicContact CD2-CE1 4.05Å; L374-F392 HydrophobicContact CD2-CZ 3.98Å; I376-F392 HydrophobicContact CD1-CE2 4.21Å; I376-F392 HydrophobicContact CD1-CZ 4.1Å; F386-F392 WeakPolarHBondContact O-CD2 3.48Å; M388-F392 PolarHBondContact O-N 3.31Å; P389-F392 CarbonylContact C-O 3.59Å; P389-F392 WeakPolarHBondContact CA-O 3.36Å; P389-F392 VanDerWaalsContact O-O 3.1Å; F392-Q394 VanDerWaalsContact C-N 3.34Å; F392-Q394 VanDerWaalsContact CB-O 3.29Å; F392-Q394 WeakPolarHBondContact CB-O 3.26Å; F392-P396 HydrophobicContact CB-CG 4.25Å; F392-P396 HydrophobicContact CD2-CG 3.42Å; F392-P396 VanDerWaalsContact CD2-CG 3.42Å; F392-P396 HydrophobicContact CE2-CG 3.92Å; F392-P396 HydrophobicContact CG-CG 3.94Å
393	K	81.9	Confident	84.1	Confident	166 Å²	166	65.8 Å²	65.8	72%	0.722	34%	0.341	S	S	*	.	S	Bend	trans	-64	-41.4	177.6	-69.2	-174.6	178.8	-178.1	0	112.1	L363	L363-K393 HydrophobicContact CD1-CD 4.43Å; L363-K393 HydrophobicContact CD2-CD 4.04Å
394	Q	83.9	Confident	83.1	Confident	139 Å²	139	68.3 Å²	68.3	65%	0.65	35%	0.349	S	S	*	.	S	Bend	trans	-102	131.4	172.6	-176.5	177.7	5.1	0	0	108	F392 P396	F392-Q394 VanDerWaalsContact C-N 3.34Å; F392-Q394 VanDerWaalsContact CB-O 3.29Å; F392-Q394 WeakPolarHBondContact CB-O 3.26Å; Q394-P396 WeakPolarHBondContact O-CD 3.4Å
395	T	88.7	Confident	81.9	Confident	86 Å²	86	66.5 Å²	66.5	53%	0.528	34%	0.341	S	S	.	.	P	Polyproline II helix	trans	-61.2	122.7	176.3	-53	0	0	0	0	109.5	L387	L387-T395 HydrophobicContact CB-CG2 4.38Å; L387-T395 HydrophobicContact CD2-CG2 3.85Å
396	P	90.8	Very high	81.5	Confident	9 Å²	9	69.5 Å²	69.5	6%	0.058	35%	0.351	C	S	.	.	P	Polyproline II helix	trans	-61.4	144.6	-180	-25.8	35.3	0	0	0	113.2	V240 I242 F392 Q394	V240-P396 HydrophobicContact CB-CB 4.24Å; V240-P396 HydrophobicContact CB-CG 4.21Å; V240-P396 HydrophobicContact CG1-CB 3.9Å; V240-P396 HydrophobicContact CG1-CG 3.77Å; I242-P396 HydrophobicContact CD1-CB 3.89Å; I242-P396 HydrophobicContact CD1-CG 4.28Å; I242-P396 HydrophobicContact CG1-CB 3.85Å; F392-P396 HydrophobicContact CB-CG 4.25Å; F392-P396 HydrophobicContact CD2-CG 3.42Å; F392-P396 VanDerWaalsContact CD2-CG 3.42Å; F392-P396 HydrophobicContact CE2-CG 3.92Å; F392-P396 HydrophobicContact CG-CG 3.94Å; Q394-P396 WeakPolarHBondContact O-CD 3.4Å
397	T	92.8	Very high	81.5	Confident	53 Å²	53	73.9 Å²	73.9	33%	0.325	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	129.2	172.7	-57.3	0	0	0	0	110	A234 N238 I242	A234-T397 HydrophobicContact CB-CG2 4.44Å; N238-T397 PolarHBondContact ND2-OG1 3.5Å; N238-T397 PolarHBondContact OD1-OG1 3Å; I242-T397 PolarHBondContact N-O 3Å
398	V	92.6	Very high	81.6	Confident	62 Å²	62	72.5 Å²	72.5	38%	0.376	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	117.1	179.4	-174.5	0	0	0	0	109.8	I242 V383 L387	I242-V398 HydrophobicContact CB-CG2 4.3Å; I242-V398 HydrophobicContact CD1-CG2 4.4Å; I242-V398 CarbonylContact O-C 3.56Å; I242-V398 WeakPolarHBondContact O-CA 3.38Å; V383-V398 HydrophobicContact CG2-CG1 4.3Å; V383-V398 HydrophobicContact CG2-CG2 4.24Å; L387-V398 HydrophobicContact CD1-CG2 4.42Å; L387-V398 HydrophobicContact CD2-CG2 3.77Å
399	I	92.6	Very high	82.3	Confident	18 Å²	18	72.6 Å²	72.6	9%	0.092	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	125.5	171.8	-62.9	178.7	0	0	0	108.5	I231 A234 V241 I242 C244 V401	I231-I399 HydrophobicContact CB-CD1 4.25Å; I231-I399 HydrophobicContact CG1-CD1 3.84Å; I231-I399 HydrophobicContact CG1-CG2 4.13Å; A234-I399 HydrophobicContact CB-CD1 3.6Å; A234-I399 HydrophobicContact CB-CG1 4.4Å; V241-I399 HydrophobicContact CG1-CD1 4.14Å; V241-I399 HydrophobicContact CG1-CG1 4.42Å; I242-I399 PolarHBondContact O-N 2.88Å; C244-I399 PolarHBondContact N-O 3.4Å; I399-V401 HydrophobicContact CG2-CG2 4.45Å
400	K	90.3	Very high	83.1	Confident	128 Å²	128	69.6 Å²	69.6	56%	0.557	36%	0.362	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.1	108.2	175.1	-175.7	-176.7	173.4	-163.2	0	108.9	L381	L381-K400 HydrophobicContact CD2-CD 4.01Å; L381-K400 HydrophobicContact CD2-CG 4.04Å
401	V	85.9	Confident	83.8	Confident	3 Å²	3	68 Å²	68	2%	0.018	35%	0.353	C	S	.	.	P	Polyproline II helix	trans	-80.6	126.6	171.1	-177.2	0	0	0	0	108.3	P223 V224 V243 C244 I399	P223-V401 HydrophobicContact CB-CG1 4.21Å; V224-V401 HydrophobicContact CB-CG1 4.01Å; V224-V401 HydrophobicContact CG2-CG1 4.32Å; V224-V401 HydrophobicContact CG2-CG2 4.09Å; V243-V401 HydrophobicContact CG1-CG2 3.9Å; C244-V401 WeakPolarHBondContact O-CB 3.32Å; C244-V401 PolarHBondContact O-N 3.41Å; I399-V401 HydrophobicContact CG2-CG2 4.45Å
402	D	72.9	Confident	84.2	Confident	108 Å²	108	71.2 Å²	71.2	58%	0.578	37%	0.367	S	S	*	.	P	Polyproline II helix	trans	-58.1	147.8	-177.3	-89.7	-20.7	0	0	0	113.6
403	S	66	Low	84.4	Confident	76 Å²	76	72.1 Å²	72.1	53%	0.531	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-83	141.6	-168.8	59.3	0	0	0	0	113.2
404	R	60.5	Low	84.8	Confident	66 Å²	66	75.2 Å²	75.2	25%	0.249	38%	0.381	C	S	.	.			trans	47.7	132.7	167.5	-53.9	-172.9	-174.9	170.3	7.6	117.8	E246 Y406 V408	E246-R404 IonicContact OE1-NE 3.57Å; E246-R404 IonicContact OE1-NH2 3.32Å; E246-R404 WeakPolarHBondContact OE2-CD 3.22Å; E246-R404 WeakPolarHBondContact OE2-CG 3.33Å; E246-R404 IonicContact OE2-CZ 3.96Å; E246-R404 IonicContact OE2-NE 3.93Å; E246-R404 PolarHBondContact OE2-NE 2.9Å; E246-R404 IonicContact OE2-NH2 3.37Å; E246-R404 PolarHBondContact OE2-NH2 3.28Å; R404-Y406 VanDerWaalsContact CB-O 3.28Å; R404-Y406 WeakPolarHBondContact CB-O 3.49Å; R404-Y406 WeakPolarHBondContact CD-O 3.46Å; R404-Y406 PolarHBondContact O-N 2.89Å; R404-V408 VanDerWaalsContact NH1-CB 3.3Å
405	Q	58.7	Low	85	Confident	74 Å²	74	76 Å²	76	35%	0.346	39%	0.385	S	S	.	.	S	Bend	trans	-61	-29.1	161.6	-74.5	179.8	-15.7	0	0	112.4	K221 P223	K221-Q405 PolarHBondContact O-NE2 3.49Å; P223-Q405 HydrophobicContact CG-CG 4.42Å
406	Y	76.7	Confident	85.2	Confident	91 Å²	91	74 Å²	74	36%	0.357	37%	0.373	S	S	.	.	S	Bend	trans	-142.6	145.9	-176.9	-58.9	-82.7	0	0	0	114.6	R404 L622 G623 P624	R404-Y406 VanDerWaalsContact CB-O 3.28Å; R404-Y406 WeakPolarHBondContact CB-O 3.49Å; R404-Y406 WeakPolarHBondContact CD-O 3.46Å; R404-Y406 PolarHBondContact O-N 2.89Å; Y406-L622 VanDerWaalsContact CE2-O 3.26Å; Y406-L622 WeakPolarHBondContact CE2-O 3.03Å; Y406-G623 WeakPolarHBondContact CB-O 3.33Å; Y406-G623 VanDerWaalsContact CD2-N 3.32Å; Y406-G623 VanDerWaalsContact CG-C 3.48Å; Y406-G623 VanDerWaalsContact CG-CA 3.41Å; Y406-P624 HydrophobicContact CD1-CG 4.25Å
407	P	84.1	Confident	84.9	Confident	93 Å²	93	77 Å²	77	60%	0.604	39%	0.387	S	S	*	.			trans	-72.5	154.6	180	30	-35.5	0	0	0	113	P624 G625	P407-P624 WeakPolarHBondContact O-CA 3.47Å; P407-G625 PolarHBondContact O-N 2.89Å
408	V	86.8	Confident	84.6	Confident	26 Å²	26	84 Å²	84	16%	0.158	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	124.1	172.2	-178.8	0	0	0	0	110.6	R404 A616 A619 G620 G625 C627	R404-V408 VanDerWaalsContact NH1-CB 3.3Å; V408-A616 HydrophobicContact CG1-CB 4.47Å; V408-A616 WeakPolarHBondContact CG1-O 3.48Å; V408-A619 HydrophobicContact CG1-CB 4.14Å; V408-A619 HydrophobicContact CG2-CB 4.28Å; V408-G620 VanDerWaalsContact CG2-CA 3.42Å; V408-G625 WeakPolarHBondContact CA-O 3.5Å; V408-C627 HydrophobicContact CG1-CB 4.01Å
409	T	92.6	Very high	84.4	Confident	68 Å²	68	83.9 Å²	83.9	42%	0.417	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	121.7	173.7	-44.5	0	0	0	0	110.4	Y411 G625 H626 C627	T409-Y411 HydrophobicContact CG2-CE1 3.89Å; T409-Y411 HydrophobicContact CG2-CE2 4.02Å; T409-G625 PolarHBondContact N-O 2.91Å; T409-H626 WeakPolarHBondContact O-CA 3.47Å; T409-C627 PolarHBondContact O-N 3.5Å
410	A	92.2	Very high	84.4	Confident	44 Å²	44	85 Å²	85	36%	0.364	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	127.2	177.5	0	0	0	0	0	111.6	C627	A410-C627 CarbonylContact C-O 3.47Å; A410-C627 WeakPolarHBondContact CA-O 3.44Å; A410-C627 HydrophobicContact CB-CB 4.5Å
411	Y	95.7	Very high	84.5	Confident	97 Å²	97	80 Å²	80	38%	0.38	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	130.4	178.7	-55.9	-81.2	0	0	0	110.3	T409 H626 C627 Y628 R629	T409-Y411 HydrophobicContact CG2-CE1 3.89Å; T409-Y411 HydrophobicContact CG2-CE2 4.02Å; Y411-H626 HydrophobicContact CE2-CB 4.01Å; Y411-H626 AromaticContact CE2-ND1 3.55Å; Y411-H626 AromaticContact CZ-ND1 3.92Å; Y411-H626 PolarHBondContact OH-ND1 2.85Å; Y411-C627 PolarHBondContact N-O 3.34Å; Y411-Y628 AromaticContact CD2-CD1 3.74Å; Y411-Y628 HydrophobicContact CD2-CD1 3.74Å; Y411-Y628 AromaticContact CD2-CE1 3.41Å; Y411-Y628 HydrophobicContact CD2-CE1 3.41Å; Y411-Y628 VanDerWaalsContact CD2-CE1 3.41Å; Y411-Y628 AromaticContact CD2-CZ 3.98Å; Y411-Y628 AromaticContact CE2-CE1 3.91Å; Y411-Y628 HydrophobicContact CE2-CE1 3.91Å; Y411-Y628 HydrophobicContact CG-CD1 4.12Å; Y411-Y628 AromaticContact CG-CE1 3.96Å; Y411-Y628 HydrophobicContact CG-CE1 3.96Å; Y411-R629 WeakPolarHBondContact O-CB 3.17Å; Y411-R629 PolarHBondContact O-N 2.86Å
412	F	94.9	Very high	84.8	Confident	77 Å²	77	82.5 Å²	82.5	34%	0.338	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	143.4	174.6	-66.1	-87.9	0	0	0	111.5	R629 Y631 Y636	F412-R629 HydrophobicContact CD1-CB 4.08Å; F412-Y631 HydrophobicContact CD1-CD2 4.44Å; F412-Y631 HydrophobicContact CD1-CE2 4.45Å; F412-Y631 HydrophobicContact CE1-CE2 4.19Å; F412-Y636 AromaticContact CE1-CD1 3.86Å; F412-Y636 HydrophobicContact CE1-CD1 3.86Å; F412-Y636 HydrophobicContact CE1-CD2 4.23Å; F412-Y636 AromaticContact CE1-CG 3.6Å; F412-Y636 HydrophobicContact CE1-CG 3.6Å; F412-Y636 AromaticContact CZ-CD1 3.7Å; F412-Y636 HydrophobicContact CZ-CD1 3.7Å; F412-Y636 HydrophobicContact CZ-CE1 4.19Å; F412-Y636 AromaticContact CZ-CG 3.94Å; F412-Y636 HydrophobicContact CZ-CG 3.94Å
413	S	91.6	Very high	85.8	Confident	30 Å²	30	77.9 Å²	77.9	21%	0.21	38%	0.383	C	S	.	.			trans	-75.6	137.3	172.1	-65.7	0	0	0	0	110.2	H415 R629 L630 Y631 S632	S413-H415 PolarHBondContact O-N 3.4Å; S413-R629 WeakPolarHBondContact CB-O 3.44Å; S413-R629 PolarHBondContact N-O 2.91Å; S413-R629 PolarHBondContact OG-O 3Å; S413-L630 WeakPolarHBondContact OG-CA 3.49Å; S413-Y631 PolarHBondContact N-O 3.17Å; S413-S632 WeakPolarHBondContact O-CA 3.31Å; S413-S632 WeakPolarHBondContact O-CB 3.5Å
414	R	90.7	Very high	87.2	Confident	231 Å²	231	74.2 Å²	74.2	87%	0.872	36%	0.358	S	S	*	.	S	Bend	trans	-59.1	-34.3	179	-67.7	-176.4	-179.6	176.6	-0.7	112.9
415	H	88.8	Confident	88.8	Confident	156 Å²	156	71.2 Å²	71.2	72%	0.722	35%	0.347	S	S	*	.	S	Bend	trans	-131.6	139	177.9	-56.4	-54.2	0	0	0	110.4	S413	S413-H415 PolarHBondContact O-N 3.4Å
416	T	90.9	Very high	90.5	Very high	45 Å²	45	72.9 Å²	72.9	28%	0.276	35%	0.35	S	S	.	.			trans	-85.1	113.3	174.7	-53.3	0	0	0	0	109.2	W606 Y631 S632	T416-W606 HydrophobicContact CG2-CH2 3.56Å; T416-W606 HydrophobicContact CG2-CZ2 4.08Å; T416-Y631 WeakPolarHBondContact OG1-CA 3.46Å; T416-S632 PolarHBondContact OG1-N 3.16Å; T416-S632 PolarHBondContact OG1-OG 3.03Å
417	M	86.6	Confident	91.4	Very high	72 Å²	72	70.7 Å²	70.7	36%	0.355	34%	0.342	S	S	.	.			trans	-75.6	144.2	176.9	-62.1	-145.1	-61.5	0	0	111.1	A423	M417-A423 HydrophobicContact CB-CB 4.36Å; M417-A423 HydrophobicContact CE-CB 3.37Å
418	H	84.7	Confident	91.9	Very high	198 Å²	198	66.2 Å²	66.2	92%	0.917	31%	0.313	S	S	*	.	S	Bend	trans	-66.1	-39.8	175.5	-73.7	-61.1	0	0	0	112.2
419	D	89.5	Confident	92.2	Very high	61 Å²	61	65.1 Å²	65.1	33%	0.326	31%	0.307	S	S	.	.			trans	-93.3	97.1	171.8	-175.8	-10.2	0	0	0	109.3	L421 Q422 A423	D419-L421 VanDerWaalsContact C-N 3.3Å; D419-L421 WeakPolarHBondContact OD1-CB 3.33Å; D419-L421 PolarHBondContact OD1-N 3.21Å; D419-Q422 HydrophobicContact CB-CB 4.36Å; D419-Q422 PolarHBondContact OD1-N 3.12Å; D419-Q422 VanDerWaalsContact OD1-N 3.08Å; D419-A423 PolarHBondContact O-N 3.38Å
420	Y	92.4	Very high	92.2	Very high	40 Å²	40	66.3 Å²	66.3	16%	0.157	31%	0.307	C	S	.	.	H	α-helix	trans	-75.5	-17.7	178.2	56.3	-95.3	0	0	0	112.8	A423 A424 E449 T585 K587	Y420-A423 PolarHBondContact O-N 3.48Å; Y420-A424 VanDerWaalsContact O-CB 3.3Å; Y420-A424 WeakPolarHBondContact O-CB 3.48Å; Y420-A424 PolarHBondContact O-N 3.42Å; Y420-E449 VanDerWaalsContact CE2-OE2 3.31Å; Y420-E449 WeakPolarHBondContact CE2-OE2 3.35Å; Y420-E449 VanDerWaalsContact OH-CD 3.26Å; Y420-E449 PolarHBondContact OH-OE1 3.39Å; Y420-E449 PolarHBondContact OH-OE2 2.96Å; Y420-T585 HydrophobicContact CD2-CG2 3.71Å; Y420-T585 HydrophobicContact CG-CG2 4.34Å; Y420-K587 HydrophobicContact CD1-CG 3.98Å; Y420-K587 HydrophobicContact CE1-CG 3.95Å; Y420-K587 HydrophobicContact CG-CG 4.4Å
421	L	93.2	Very high	92.2	Very high	24 Å²	24	64.3 Å²	64.3	13%	0.126	29%	0.291	C	S	.	.	H	α-helix	trans	-71.9	-44.9	175.8	-61.2	178.3	0	0	0	110.4	D419 A423 A424 Y425 V444 E449 W456	D419-L421 VanDerWaalsContact C-N 3.3Å; D419-L421 WeakPolarHBondContact OD1-CB 3.33Å; D419-L421 PolarHBondContact OD1-N 3.21Å; L421-A423 VanDerWaalsContact C-N 3.27Å; L421-A423 PolarHBondContact O-N 3.25Å; L421-A424 PolarHBondContact O-N 3.27Å; L421-Y425 WeakPolarHBondContact O-CB 3.21Å; L421-Y425 PolarHBondContact O-N 2.88Å; L421-V444 HydrophobicContact CD2-CG1 4.06Å; L421-E449 HydrophobicContact CD1-CB 4.26Å; L421-E449 HydrophobicContact CD1-CG 4.01Å; L421-E449 HydrophobicContact CD2-CB 3.66Å; L421-E449 HydrophobicContact CD2-CG 3.98Å; L421-W456 HydrophobicContact CB-CH2 4.12Å; L421-W456 HydrophobicContact CB-CZ3 3.84Å
422	Q	92.1	Very high	92	Very high	56 Å²	56	59.9 Å²	59.9	26%	0.262	27%	0.273	S	S	.	.	H	α-helix	trans	-63.2	-37.1	173.8	-165.9	178.6	44	0	0	111.3	D419 R426 P522	D419-Q422 HydrophobicContact CB-CB 4.36Å; D419-Q422 PolarHBondContact OD1-N 3.12Å; D419-Q422 VanDerWaalsContact OD1-N 3.08Å; Q422-R426 WeakPolarHBondContact O-CG 3.33Å; Q422-R426 PolarHBondContact O-N 2.84Å; Q422-R426 VanDerWaalsContact O-N 3.09Å; Q422-P522 HydrophobicContact CG-CB 4.38Å; Q422-P522 HydrophobicContact CG-CG 3.81Å
423	A	93	Very high	91.7	Very high	10 Å²	10	60.3 Å²	60.3	8%	0.083	27%	0.273	C	S	.	.	H	α-helix	trans	-62.1	-45.5	173.2	0	0	0	0	0	112.1	M417 D419 Y420 L421 R426 K427 L630	M417-A423 HydrophobicContact CB-CB 4.36Å; M417-A423 HydrophobicContact CE-CB 3.37Å; D419-A423 PolarHBondContact O-N 3.38Å; Y420-A423 PolarHBondContact O-N 3.48Å; L421-A423 VanDerWaalsContact C-N 3.27Å; L421-A423 PolarHBondContact O-N 3.25Å; A423-R426 PolarHBondContact O-N 2.96Å; A423-K427 WeakPolarHBondContact O-CB 3.36Å; A423-K427 PolarHBondContact O-N 3.43Å; A423-L630 HydrophobicContact CB-CB 4.46Å; A423-L630 HydrophobicContact CB-CD1 3.97Å
424	A	95.2	Very high	91.6	Very high	0 Å²	0	64.7 Å²	64.7	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-63.2	-47.9	178.6	0	0	0	0	0	111	Y420 L421 R426 K427 V428 V442 L453 T585 L630	Y420-A424 VanDerWaalsContact O-CB 3.3Å; Y420-A424 WeakPolarHBondContact O-CB 3.48Å; Y420-A424 PolarHBondContact O-N 3.42Å; L421-A424 PolarHBondContact O-N 3.27Å; A424-R426 PolarHBondContact O-N 2.96Å; A424-K427 PolarHBondContact O-N 3.32Å; A424-K427 VanDerWaalsContact O-N 3.15Å; A424-V428 VanDerWaalsContact O-CG2 3.27Å; A424-V428 WeakPolarHBondContact O-CG2 3.3Å; A424-V428 PolarHBondContact O-N 2.99Å; A424-V442 HydrophobicContact CB-CG1 4.08Å; A424-L453 HydrophobicContact CB-CD2 4.17Å; A424-T585 HydrophobicContact CB-CG2 4.18Å; A424-L630 HydrophobicContact CB-CD1 3.78Å
425	Y	95.3	Very high	91.6	Very high	3 Å²	3	55.9 Å²	55.9	1%	0.012	26%	0.263	C	S	.	.	H	α-helix	trans	-53.8	-52.7	175.7	177.2	-101.6	0	0	0	112.2	L421 K427 V428 C429 L453 W456 L457 R460 P522 I524	L421-Y425 WeakPolarHBondContact O-CB 3.21Å; L421-Y425 PolarHBondContact O-N 2.88Å; Y425-K427 VanDerWaalsContact C-N 3.29Å; Y425-K427 PolarHBondContact O-N 3.43Å; Y425-V428 PolarHBondContact O-N 3.34Å; Y425-C429 PolarHBondContact O-N 3.22Å; Y425-C429 PolarHBondContact O-SG 2.83Å; Y425-C429 VanDerWaalsContact O-SG 3.4Å; Y425-L453 HydrophobicContact CD2-CD1 4.1Å; Y425-L453 HydrophobicContact CG-CD1 4.39Å; Y425-W456 HydrophobicContact CD2-CB 3.81Å; Y425-W456 HydrophobicContact CD2-CE3 4.4Å; Y425-W456 HydrophobicContact CE2-CB 3.78Å; Y425-W456 HydrophobicContact CG-CE3 4.36Å; Y425-L457 HydrophobicContact CD2-CD2 3.92Å; Y425-L457 HydrophobicContact CD2-CG 4.22Å; Y425-L457 HydrophobicContact CE2-CD2 3.96Å; Y425-L457 HydrophobicContact CE2-CG 4.4Å; Y425-R460 WeakPolarHBondContact OH-CB 3.28Å; Y425-P522 HydrophobicContact CD1-CB 4.38Å; Y425-P522 HydrophobicContact CD1-CG 3.8Å; Y425-P522 HydrophobicContact CE1-CB 4.32Å; Y425-P522 HydrophobicContact CE1-CG 4Å; Y425-I524 HydrophobicContact CE1-CD1 4.24Å
426	R	93.8	Very high	91.7	Very high	109 Å²	109	52.1 Å²	52.1	41%	0.411	25%	0.253	S	S	.	.	H	α-helix	trans	-59.6	-40.7	178.4	-71.8	176.7	-177.8	169.5	4.5	111.9	Q422 A423 A424 Q430	Q422-R426 WeakPolarHBondContact O-CG 3.33Å; Q422-R426 PolarHBondContact O-N 2.84Å; Q422-R426 VanDerWaalsContact O-N 3.09Å; A423-R426 PolarHBondContact O-N 2.96Å; A424-R426 PolarHBondContact O-N 2.96Å; R426-Q430 WeakPolarHBondContact O-CB 3.27Å; R426-Q430 PolarHBondContact O-N 2.84Å
427	K	94.3	Very high	91.5	Very high	44 Å²	44	56.1 Å²	56.1	19%	0.191	26%	0.263	C	S	.	.	H	α-helix	trans	-69.5	-40	179.7	-168.8	59.1	57	-177.8	0	112.1	A423 A424 Y425 Q430 V431 I583 Y628 L630	A423-K427 WeakPolarHBondContact O-CB 3.36Å; A423-K427 PolarHBondContact O-N 3.43Å; A424-K427 PolarHBondContact O-N 3.32Å; A424-K427 VanDerWaalsContact O-N 3.15Å; Y425-K427 VanDerWaalsContact C-N 3.29Å; Y425-K427 PolarHBondContact O-N 3.43Å; K427-Q430 PolarHBondContact O-N 2.95Å; K427-V431 HydrophobicContact CD-CG2 4.36Å; K427-V431 HydrophobicContact CG-CG2 4.4Å; K427-V431 WeakPolarHBondContact O-CB 3.36Å; K427-V431 VanDerWaalsContact O-CG2 3.32Å; K427-V431 WeakPolarHBondContact O-CG2 3.4Å; K427-V431 PolarHBondContact O-N 3.46Å; K427-I583 HydrophobicContact CB-CD1 4.12Å; K427-I583 HydrophobicContact CB-CG2 4.28Å; K427-I583 HydrophobicContact CG-CD1 3.85Å; K427-I583 HydrophobicContact CG-CG1 3.99Å; K427-I583 HydrophobicContact CG-CG2 4.2Å; K427-Y628 HydrophobicContact CD-CD1 4.28Å; K427-Y628 HydrophobicContact CD-CG 4.13Å; K427-Y628 HydrophobicContact CG-CG 4.38Å; K427-L630 HydrophobicContact CB-CD2 3.99Å; K427-L630 HydrophobicContact CG-CD2 4.09Å
428	V	95.1	Very high	91.6	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-59.2	-50.4	174.1	173.3	0	0	0	0	109.9	A424 Y425 Q430 V431 H432 I440 V442 L457 L535 I583	A424-V428 VanDerWaalsContact O-CG2 3.27Å; A424-V428 WeakPolarHBondContact O-CG2 3.3Å; A424-V428 PolarHBondContact O-N 2.99Å; Y425-V428 PolarHBondContact O-N 3.34Å; V428-Q430 VanDerWaalsContact C-N 3.3Å; V428-Q430 PolarHBondContact O-N 3.06Å; V428-V431 PolarHBondContact O-N 2.8Å; V428-H432 VanDerWaalsContact O-CB 3.25Å; V428-H432 WeakPolarHBondContact O-CB 3.37Å; V428-H432 PolarHBondContact O-N 2.85Å; V428-I440 HydrophobicContact CG1-CD1 4.41Å; V428-V442 HydrophobicContact CG2-CG2 3.48Å; V428-V442 VanDerWaalsContact CG2-CG2 3.48Å; V428-L457 HydrophobicContact CB-CD2 4.21Å; V428-L457 HydrophobicContact CG1-CD1 3.99Å; V428-L457 HydrophobicContact CG1-CD2 3.62Å; V428-L457 HydrophobicContact CG1-CG 4.49Å; V428-L535 HydrophobicContact CG1-CD2 4.29Å; V428-I583 HydrophobicContact CB-CD1 4.2Å; V428-I583 HydrophobicContact CG2-CD1 3.49Å; V428-I583 VanDerWaalsContact CG2-CD1 3.49Å
429	C	93.4	Very high	91.9	Very high	3 Å²	3	44.6 Å²	44.6	2%	0.02	22%	0.215	C	C	.	.	H	α-helix	trans	-59.5	-40.4	177.2	-66.5	0	0	0	0	112.3	Y425 R433 I524	Y425-C429 PolarHBondContact O-N 3.22Å; Y425-C429 PolarHBondContact O-SG 2.83Å; Y425-C429 VanDerWaalsContact O-SG 3.4Å; C429-R433 WeakPolarHBondContact O-CB 3.33Å; C429-R433 WeakPolarHBondContact O-CG 3.48Å; C429-R433 PolarHBondContact O-N 3.33Å; C429-R433 VanDerWaalsContact O-N 3.13Å; C429-I524 HydrophobicContact CB-CD1 4.36Å
430	Q	92	Very high	92.2	Very high	92 Å²	92	41.7 Å²	41.7	43%	0.43	20%	0.199	S	C	.	.	H	α-helix	trans	-65.1	-47.3	177.6	-173.2	-178.6	14	0	0	112.2	R426 K427 V428 H432 R433 L434	R426-Q430 WeakPolarHBondContact O-CB 3.27Å; R426-Q430 PolarHBondContact O-N 2.84Å; K427-Q430 PolarHBondContact O-N 2.95Å; V428-Q430 VanDerWaalsContact C-N 3.3Å; V428-Q430 PolarHBondContact O-N 3.06Å; Q430-H432 VanDerWaalsContact C-N 3.34Å; Q430-R433 PolarHBondContact O-N 3.36Å; Q430-L434 HydrophobicContact CG-CD1 3.65Å; Q430-L434 HydrophobicContact CG-CG 4.44Å; Q430-L434 WeakPolarHBondContact O-CB 3.19Å; Q430-L434 WeakPolarHBondContact O-CG 3.47Å; Q430-L434 PolarHBondContact O-N 3.17Å
431	V	92.5	Very high	92.3	Very high	3 Å²	3	39.9 Å²	39.9	2%	0.018	19%	0.192	C	C	.	.	H	α-helix	trans	-63.4	-42.5	178.7	164.7	0	0	0	0	110.8	K427 V428 R433 L435 I440 R561 Y581 I583 Y628	K427-V431 HydrophobicContact CD-CG2 4.36Å; K427-V431 HydrophobicContact CG-CG2 4.4Å; K427-V431 WeakPolarHBondContact O-CB 3.36Å; K427-V431 VanDerWaalsContact O-CG2 3.32Å; K427-V431 WeakPolarHBondContact O-CG2 3.4Å; K427-V431 PolarHBondContact O-N 3.46Å; V428-V431 PolarHBondContact O-N 2.8Å; V431-R433 PolarHBondContact O-N 3.27Å; V431-L435 HydrophobicContact CB-CD1 4.24Å; V431-L435 HydrophobicContact CG1-CD1 4.07Å; V431-L435 HydrophobicContact CG2-CD1 3.95Å; V431-L435 WeakPolarHBondContact O-CB 3.42Å; V431-L435 PolarHBondContact O-N 3.18Å; V431-I440 HydrophobicContact CB-CD1 4.32Å; V431-I440 HydrophobicContact CG1-CD1 3.67Å; V431-I440 HydrophobicContact CG1-CG1 3.87Å; V431-R561 PolarHBondContact O-NH1 3Å; V431-Y581 HydrophobicContact CG1-CD1 4.1Å; V431-Y581 HydrophobicContact CG1-CD2 3.89Å; V431-Y581 HydrophobicContact CG1-CE2 4.47Å; V431-Y581 HydrophobicContact CG1-CG 3.68Å; V431-I583 HydrophobicContact CG2-CD1 4.37Å; V431-Y628 HydrophobicContact CG2-CD2 3.87Å; V431-Y628 HydrophobicContact CG2-CE2 3.64Å
432	H	92.1	Very high	92.5	Very high	4 Å²	4	38.8 Å²	38.8	2%	0.019	19%	0.186	C	C	.	.	H	α-helix	trans	-62.4	-42.1	179.8	-173.4	53.1	0	0	0	112.5	V428 Q430 I440 F461 E533 R561	V428-H432 VanDerWaalsContact O-CB 3.25Å; V428-H432 WeakPolarHBondContact O-CB 3.37Å; V428-H432 PolarHBondContact O-N 2.85Å; Q430-H432 VanDerWaalsContact C-N 3.34Å; H432-I440 HydrophobicContact CB-CD1 4.26Å; H432-F461 AromaticContact CD2-CE1 3.76Å; H432-F461 AromaticContact CD2-CZ 3.76Å; H432-E533 PolarHBondContact CE1-O 3.36Å; H432-E533 PolarHBondContact NE2-O 3.09Å; H432-R561 WeakPolarHBondContact ND1-CD 3.37Å; H432-R561 PolarHBondContact O-NH1 2.71Å
433	R	89.3	Confident	92.7	Very high	85 Å²	85	36.1 Å²	36.1	32%	0.321	17%	0.174	S	C	.	.	H	α-helix	trans	-78.4	-42.9	-178.9	-73	178.3	174.7	160.9	4.6	114.8	C429 Q430 V431 D532	C429-R433 WeakPolarHBondContact O-CB 3.33Å; C429-R433 WeakPolarHBondContact O-CG 3.48Å; C429-R433 PolarHBondContact O-N 3.33Å; C429-R433 VanDerWaalsContact O-N 3.13Å; Q430-R433 PolarHBondContact O-N 3.36Å; V431-R433 PolarHBondContact O-N 3.27Å; R433-D532 WeakPolarHBondContact CG-OD1 3.32Å; R433-D532 IonicContact CZ-OD1 3.68Å; R433-D532 IonicContact CZ-OD2 3.81Å; R433-D532 IonicContact NE-OD1 3.34Å; R433-D532 PolarHBondContact NE-OD1 3.4Å; R433-D532 IonicContact NE-OD2 3.68Å; R433-D532 IonicContact NH2-OD1 2.72Å; R433-D532 IonicContact NH2-OD2 3.6Å; R433-D532 PolarHBondContact NH2-OD2 3.17Å
434	L	89.9	Confident	92.8	Very high	122 Å²	122	35.6 Å²	35.6	64%	0.639	17%	0.17	S	C	*	.	H	α-helix	trans	-98.5	-22	-165.7	-60.7	179.2	0	0	0	113.8	Q430	Q430-L434 HydrophobicContact CG-CD1 3.65Å; Q430-L434 HydrophobicContact CG-CG 4.44Å; Q430-L434 WeakPolarHBondContact O-CB 3.19Å; Q430-L434 WeakPolarHBondContact O-CG 3.47Å; Q430-L434 PolarHBondContact O-N 3.17Å
435	L	90.8	Very high	92.7	Very high	46 Å²	46	36 Å²	36	24%	0.241	17%	0.173	C	C	.	.	S	Bend	trans	-106.4	151.2	-171.3	-55.4	-177.7	0	0	0	112.3	V431 R561 Y581 Y628	V431-L435 HydrophobicContact CB-CD1 4.24Å; V431-L435 HydrophobicContact CG1-CD1 4.07Å; V431-L435 HydrophobicContact CG2-CD1 3.95Å; V431-L435 WeakPolarHBondContact O-CB 3.42Å; V431-L435 PolarHBondContact O-N 3.18Å; L435-R561 PolarHBondContact O-NH1 3.23Å; L435-R561 PolarHBondContact O-NH2 2.87Å; L435-R561 VanDerWaalsContact O-NH2 3.09Å; L435-Y581 HydrophobicContact CB-CE1 3.9Å; L435-Y581 HydrophobicContact CD1-CD1 3.88Å; L435-Y581 HydrophobicContact CD1-CE1 3.58Å; L435-Y581 HydrophobicContact CG-CE1 4.37Å; L435-Y628 HydrophobicContact CD1-CE2 3.95Å; L435-Y628 WeakPolarHBondContact CD1-OH 3.44Å
436	P	89.3	Confident	92.2	Very high	78 Å²	78	36.6 Å²	36.6	51%	0.506	18%	0.179	S	C	.	.			trans	-55.7	164.7	177.8	-25.5	33.9	0	0	0	113.8	R561 Y581	P436-R561 PolarHBondContact O-NH1 2.99Å; P436-Y581 WeakPolarHBondContact CD-OH 3.08Å; P436-Y581 VanDerWaalsContact O-CE2 3.24Å; P436-Y581 WeakPolarHBondContact O-CE2 3.47Å; P436-Y581 PolarHBondContact O-OH 3.44Å
437	R	86.8	Confident	91.7	Very high	128 Å²	128	32.2 Å²	32.2	48%	0.483	16%	0.163	S	C	.	.	S	Bend	trans	-54.9	142.2	178.6	-60.3	-175.3	88.2	108.1	-3.2	112	E533 G559 R580	R437-E533 IonicContact CZ-OE1 3.79Å; R437-E533 IonicContact NH1-OE1 3.44Å; R437-E533 PolarHBondContact NH1-OE1 3.47Å; R437-G559 VanDerWaalsContact NH2-C 3.3Å; R437-G559 PolarHBondContact NH2-O 3.1Å; R437-R580 PolarHBondContact O-NH1 3.36Å
438	G	88.3	Confident	91.1	Very high	18 Å²	18	33 Å²	33	19%	0.186	17%	0.167	C	C	.	.			trans	161.1	145.7	-179.9	0	0	0	0	0	110.1	R561	G438-R561 WeakPolarHBondContact O-CD 3.41Å; G438-R561 WeakPolarHBondContact O-CG 3.48Å
439	S	92.4	Very high	90.9	Very high	11 Å²	11	34.3 Å²	34.3	8%	0.077	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71	143.4	-177.8	-53.9	0	0	0	0	110.9	C562 N578 R580 Y581	S439-C562 CarbonylContact C-O 3.53Å; S439-C562 VanDerWaalsContact CA-O 3.3Å; S439-C562 WeakPolarHBondContact CA-O 3.35Å; S439-N578 WeakPolarHBondContact CB-O 3.5Å; S439-N578 PolarHBondContact N-O 3.24Å; S439-N578 PolarHBondContact OG-O 2.84Å; S439-R580 PolarHBondContact O-N 3.4Å; S439-Y581 PolarHBondContact O-N 3.12Å; S439-Y581 VanDerWaalsContact O-N 3.14Å
440	I	95.2	Very high	90.8	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	131.4	178.7	-53.3	173.4	0	0	0	108.4	V428 V431 H432 V442 C562 C563 V564 Y581 I583	V428-I440 HydrophobicContact CG1-CD1 4.41Å; V431-I440 HydrophobicContact CB-CD1 4.32Å; V431-I440 HydrophobicContact CG1-CD1 3.67Å; V431-I440 HydrophobicContact CG1-CG1 3.87Å; H432-I440 HydrophobicContact CB-CD1 4.26Å; I440-V442 HydrophobicContact CG2-CG2 4.02Å; I440-C562 PolarHBondContact N-O 2.87Å; I440-C563 HydrophobicContact CB-CB 4.23Å; I440-C563 CarbonylContact O-C 3.54Å; I440-C563 VanDerWaalsContact O-CA 3.31Å; I440-C563 WeakPolarHBondContact O-CA 3.49Å; I440-V564 PolarHBondContact O-N 2.61Å; I440-Y581 CarbonylContact C-O 3.59Å; I440-Y581 WeakPolarHBondContact CA-O 3.46Å; I440-Y581 HydrophobicContact CG1-CD2 4.26Å; I440-I583 HydrophobicContact CG2-CD1 3.84Å; I440-I583 HydrophobicContact CG2-CG1 4.38Å
441	L	95.6	Very high	90.6	Very high	2 Å²	2	31.7 Å²	31.7	1%	0.01	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	122.7	171.4	176.7	60	0	0	0	109.2	F443 V564 A566 A570 I576 V579 Y581 V582 I583 R618	L441-F443 HydrophobicContact CD2-CE2 3.7Å; L441-F443 HydrophobicContact CD2-CZ 3.76Å; L441-F443 HydrophobicContact CG-CD2 4.46Å; L441-F443 HydrophobicContact CG-CE2 3.95Å; L441-F443 HydrophobicContact CG-CZ 4.28Å; L441-V564 CarbonylContact C-O 3.46Å; L441-V564 WeakPolarHBondContact CA-O 3.47Å; L441-V564 HydrophobicContact CD1-CB 4.06Å; L441-V564 HydrophobicContact CD1-CG1 4.16Å; L441-A566 HydrophobicContact CD1-CB 3.81Å; L441-A570 HydrophobicContact CD1-CB 4.03Å; L441-A570 HydrophobicContact CD2-CB 4.16Å; L441-I576 HydrophobicContact CD1-CD1 3.71Å; L441-I576 HydrophobicContact CD2-CD1 4.35Å; L441-V579 HydrophobicContact CB-CG1 3.66Å; L441-V579 HydrophobicContact CB-CG2 4.31Å; L441-V579 HydrophobicContact CD2-CG1 4.36Å; L441-Y581 PolarHBondContact N-O 2.87Å; L441-V582 HydrophobicContact CB-CG2 4.25Å; L441-V582 HydrophobicContact CD2-CG2 4.36Å; L441-V582 CarbonylContact O-C 3.57Å; L441-V582 VanDerWaalsContact O-CA 3.31Å; L441-V582 WeakPolarHBondContact O-CA 3.4Å; L441-I583 PolarHBondContact O-N 2.91Å; L441-R618 HydrophobicContact CD2-CB 3.9Å; L441-R618 HydrophobicContact CD2-CG 4.29Å
442	V	97	Very high	90.5	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	124.7	-179.5	-170	0	0	0	0	109.4	A424 V428 I440 V444 L453 V564 A566 I583	A424-V442 HydrophobicContact CB-CG1 4.08Å; V428-V442 HydrophobicContact CG2-CG2 3.48Å; V428-V442 VanDerWaalsContact CG2-CG2 3.48Å; I440-V442 HydrophobicContact CG2-CG2 4.02Å; V442-V444 HydrophobicContact CG1-CG1 4.32Å; V442-L453 HydrophobicContact CG1-CD2 3.87Å; V442-V564 PolarHBondContact N-O 3.18Å; V442-A566 PolarHBondContact O-N 2.78Å; V442-I583 WeakPolarHBondContact CA-O 3.26Å; V442-I583 HydrophobicContact CG1-CB 4.24Å; V442-I583 HydrophobicContact CG1-CG2 4.19Å; V442-I583 HydrophobicContact CG2-CB 4.29Å; V442-I583 HydrophobicContact CG2-CD1 4.29Å
443	F	96.8	Very high	90.6	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	123.5	174.3	-74.6	-82.2	0	0	0	111.3	L441 A566 A570 E571 V582 I583 T585 R615 R618	L441-F443 HydrophobicContact CD2-CE2 3.7Å; L441-F443 HydrophobicContact CD2-CZ 3.76Å; L441-F443 HydrophobicContact CG-CD2 4.46Å; L441-F443 HydrophobicContact CG-CE2 3.95Å; L441-F443 HydrophobicContact CG-CZ 4.28Å; F443-A566 CarbonylContact C-O 3.54Å; F443-A566 WeakPolarHBondContact CA-O 3.4Å; F443-A570 HydrophobicContact CE1-CB 3.77Å; F443-A570 HydrophobicContact CZ-CB 3.96Å; F443-E571 HydrophobicContact CE1-CB 4.12Å; F443-V582 HydrophobicContact CD2-CG1 3.92Å; F443-V582 HydrophobicContact CE2-CG1 3.9Å; F443-I583 PolarHBondContact N-O 3.17Å; F443-T585 WeakPolarHBondContact O-CB 3.49Å; F443-T585 WeakPolarHBondContact O-CG2 3.47Å; F443-T585 PolarHBondContact O-OG1 3.04Å; F443-R615 HydrophobicContact CD1-CG 4.15Å; F443-R615 HydrophobicContact CD2-CB 3.98Å; F443-R615 HydrophobicContact CD2-CG 3.9Å; F443-R615 HydrophobicContact CE1-CG 3.98Å; F443-R615 HydrophobicContact CE2-CB 3.68Å; F443-R615 HydrophobicContact CE2-CG 3.71Å; F443-R615 HydrophobicContact CG-CG 4.11Å; F443-R615 HydrophobicContact CZ-CB 4.13Å; F443-R615 HydrophobicContact CZ-CG 3.76Å; F443-R618 HydrophobicContact CZ-CG 4.31Å
444	V	95.1	Very high	90.7	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.16	C	C	.	.			trans	-126.5	167.1	173.7	-63.2	0	0	0	0	110.4	L421 V442 E449 V450 L453 I565 A566 T567 T585	L421-V444 HydrophobicContact CD2-CG1 4.06Å; V442-V444 HydrophobicContact CG1-CG1 4.32Å; V444-E449 HydrophobicContact CB-CB 4.03Å; V444-E449 HydrophobicContact CG2-CB 4.14Å; V444-V450 HydrophobicContact CG2-CB 4.28Å; V444-V450 HydrophobicContact CG2-CG2 3.33Å; V444-L453 HydrophobicContact CG1-CD2 4.26Å; V444-I565 HydrophobicContact CG1-CG2 4.3Å; V444-I565 HydrophobicContact CG2-CG2 4.02Å; V444-A566 PolarHBondContact N-O 3Å; V444-T567 WeakPolarHBondContact O-CA 3.24Å; V444-T585 HydrophobicContact CG1-CG2 4.36Å
445	S	91.7	Very high	90.7	Very high	9 Å²	9	27.9 Å²	27.9	6%	0.063	15%	0.154	C	C	.	.	S	Bend	trans	-80.3	-29.9	-169.4	89.4	0	0	0	0	113.7	E449 K589	S445-E449 WeakPolarHBondContact CA-OE2 3.29Å; S445-E449 WeakPolarHBondContact CB-OE2 3.38Å; S445-E449 PolarHBondContact N-OE2 2.87Å; S445-E449 PolarHBondContact OG-OE1 2.99Å; S445-E449 PolarHBondContact OG-OE2 2.66Å; S445-K589 VanDerWaalsContact O-CB 3.32Å; S445-K589 WeakPolarHBondContact O-CB 3.27Å
446	G	85.8	Confident	90.7	Very high	14 Å²	14	26.8 Å²	26.8	14%	0.144	15%	0.147	C	C	.	.	S	Bend	trans	-158.8	172.7	-172.1	0	0	0	0	0	115.5	K448 E449 V450	G446-K448 PolarHBondContact O-N 3.46Å; G446-E449 WeakPolarHBondContact O-CB 3.15Å; G446-E449 PolarHBondContact O-N 3.44Å; G446-V450 WeakPolarHBondContact O-CG2 3.4Å; G446-V450 PolarHBondContact O-N 3.19Å; G446-V450 VanDerWaalsContact O-N 3.11Å
447	Q	82.5	Confident	90.8	Very high	18 Å²	18	23 Å²	23	8%	0.084	12%	0.123	C	C	.	.	H	α-helix	trans	-61.5	-41.3	-174.5	179	176.4	-27.6	0	0	113.8	E449 V450 H451 D505 Y541	Q447-E449 PolarHBondContact O-N 3.12Å; Q447-V450 WeakPolarHBondContact O-CB 3.44Å; Q447-V450 PolarHBondContact O-N 3.22Å; Q447-H451 VanDerWaalsContact CG-CE1 3.45Å; Q447-H451 WeakPolarHBondContact CG-CE1 3.38Å; Q447-H451 PolarHBondContact O-N 3.37Å; Q447-H451 VanDerWaalsContact O-N 3.11Å; Q447-H451 PolarHBondContact O-ND1 3.12Å; Q447-D505 VanDerWaalsContact NE2-CB 3.26Å; Q447-Y541 HydrophobicContact CB-CD2 4.46Å; Q447-Y541 HydrophobicContact CB-CG 4.45Å; Q447-Y541 VanDerWaalsContact CD-CE2 3.46Å; Q447-Y541 HydrophobicContact CG-CD1 4.2Å; Q447-Y541 HydrophobicContact CG-CD2 4.17Å; Q447-Y541 HydrophobicContact CG-CE1 3.92Å; Q447-Y541 HydrophobicContact CG-CE2 3.91Å; Q447-Y541 HydrophobicContact CG-CG 4.33Å; Q447-Y541 VanDerWaalsContact OE1-CE2 3.3Å
448	K	82.6	Confident	90.9	Very high	61 Å²	61	22.1 Å²	22.1	27%	0.265	12%	0.122	S	C	.	.	H	α-helix	trans	-56.3	-43.4	177.5	-63.7	-170.6	-162.4	-168.4	0	110.9	G446 H451 T452 Q506 A508	G446-K448 PolarHBondContact O-N 3.46Å; K448-H451 PolarHBondContact O-N 3.17Å; K448-T452 WeakPolarHBondContact O-CB 3Å; K448-T452 PolarHBondContact O-N 2.94Å; K448-T452 PolarHBondContact O-OG1 3.42Å; K448-Q506 HydrophobicContact CD-CB 4.17Å; K448-Q506 HydrophobicContact CD-CG 3.86Å; K448-Q506 VanDerWaalsContact CE-CG 3.48Å; K448-Q506 WeakPolarHBondContact CE-O 3.4Å; K448-Q506 HydrophobicContact CG-CB 4.45Å; K448-Q506 HydrophobicContact CG-CG 4.09Å; K448-A508 PolarHBondContact NZ-O 2.98Å
449	E	91	Very high	90.9	Very high	26 Å²	26	28.8 Å²	28.8	12%	0.121	15%	0.146	C	C	.	.	H	α-helix	trans	-67.4	-41.2	-179.7	-60.7	-179.1	-175.3	0	0	112.1	Y420 L421 V444 S445 G446 Q447 H451 T452 L453	Y420-E449 VanDerWaalsContact CE2-OE2 3.31Å; Y420-E449 WeakPolarHBondContact CE2-OE2 3.35Å; Y420-E449 VanDerWaalsContact OH-CD 3.26Å; Y420-E449 PolarHBondContact OH-OE1 3.39Å; Y420-E449 PolarHBondContact OH-OE2 2.96Å; L421-E449 HydrophobicContact CD1-CB 4.26Å; L421-E449 HydrophobicContact CD1-CG 4.01Å; L421-E449 HydrophobicContact CD2-CB 3.66Å; L421-E449 HydrophobicContact CD2-CG 3.98Å; V444-E449 HydrophobicContact CB-CB 4.03Å; V444-E449 HydrophobicContact CG2-CB 4.14Å; S445-E449 WeakPolarHBondContact CA-OE2 3.29Å; S445-E449 WeakPolarHBondContact CB-OE2 3.38Å; S445-E449 PolarHBondContact N-OE2 2.87Å; S445-E449 PolarHBondContact OG-OE1 2.99Å; S445-E449 PolarHBondContact OG-OE2 2.66Å; G446-E449 WeakPolarHBondContact O-CB 3.15Å; G446-E449 PolarHBondContact O-N 3.44Å; Q447-E449 PolarHBondContact O-N 3.12Å; E449-H451 VanDerWaalsContact C-N 3.33Å; E449-H451 PolarHBondContact O-N 3.37Å; E449-T452 PolarHBondContact O-N 3.05Å; E449-L453 WeakPolarHBondContact O-CB 3.22Å; E449-L453 PolarHBondContact O-N 2.74Å
450	V	90.6	Very high	90.6	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-54.3	-51.3	173.5	172.5	0	0	0	0	110.1	V444 G446 Q447 L454 P539 Y541 I565 T567	V444-V450 HydrophobicContact CG2-CB 4.28Å; V444-V450 HydrophobicContact CG2-CG2 3.33Å; G446-V450 WeakPolarHBondContact O-CG2 3.4Å; G446-V450 PolarHBondContact O-N 3.19Å; G446-V450 VanDerWaalsContact O-N 3.11Å; Q447-V450 WeakPolarHBondContact O-CB 3.44Å; Q447-V450 PolarHBondContact O-N 3.22Å; V450-L454 WeakPolarHBondContact O-CB 3.47Å; V450-L454 PolarHBondContact O-N 3.17Å; V450-P539 HydrophobicContact CG1-CB 3.43Å; V450-P539 VanDerWaalsContact CG1-CB 3.43Å; V450-Y541 HydrophobicContact CB-CD1 4.38Å; V450-Y541 HydrophobicContact CG1-CD1 4.11Å; V450-Y541 HydrophobicContact CG1-CE1 4.34Å; V450-Y541 HydrophobicContact CG2-CD1 4.36Å; V450-I565 HydrophobicContact CB-CG2 4.24Å; V450-I565 HydrophobicContact CG1-CB 4.18Å; V450-I565 HydrophobicContact CG1-CG2 4.08Å; V450-I565 WeakPolarHBondContact CG1-O 3.48Å; V450-I565 HydrophobicContact CG2-CG2 4.22Å; V450-T567 HydrophobicContact CG2-CG2 4.12Å
451	H	88.6	Confident	90.3	Very high	40 Å²	40	32.5 Å²	32.5	19%	0.185	16%	0.159	C	C	.	.	H	α-helix	trans	-71.8	-35.9	-177.7	-67.4	87	0	0	0	112.9	Q447 K448 E449 L454 S455 Y541	Q447-H451 VanDerWaalsContact CG-CE1 3.45Å; Q447-H451 WeakPolarHBondContact CG-CE1 3.38Å; Q447-H451 PolarHBondContact O-N 3.37Å; Q447-H451 VanDerWaalsContact O-N 3.11Å; Q447-H451 PolarHBondContact O-ND1 3.12Å; K448-H451 PolarHBondContact O-N 3.17Å; E449-H451 VanDerWaalsContact C-N 3.33Å; E449-H451 PolarHBondContact O-N 3.37Å; H451-L454 PolarHBondContact O-N 3.2Å; H451-S455 WeakPolarHBondContact O-CB 3.35Å; H451-S455 PolarHBondContact O-N 3.37Å; H451-Y541 AromaticContact CE1-CE1 3.33Å; H451-Y541 WeakPolarHBondContact CE1-CE1 3.37Å; H451-Y541 AromaticContact CE1-CZ 3.51Å; H451-Y541 PolarHBondContact CE1-OH 3.2Å; H451-Y541 AromaticContact NE2-CE1 3.98Å; H451-Y541 PolarHBondContact NE2-OH 3.27Å
452	T	90	Very high	89.5	Confident	48 Å²	48	36.9 Å²	36.9	29%	0.294	19%	0.187	S	C	.	.	H	α-helix	trans	-60.8	-51	176.2	-58.4	0	0	0	0	110.3	K448 E449 L454 S455 W456	K448-T452 WeakPolarHBondContact O-CB 3Å; K448-T452 PolarHBondContact O-N 2.94Å; K448-T452 PolarHBondContact O-OG1 3.42Å; E449-T452 PolarHBondContact O-N 3.05Å; T452-L454 VanDerWaalsContact C-N 3.35Å; T452-L454 PolarHBondContact O-N 3.39Å; T452-S455 PolarHBondContact O-N 3.02Å; T452-W456 HydrophobicContact CG2-CD2 4.17Å; T452-W456 HydrophobicContact CG2-CH2 3.87Å; T452-W456 HydrophobicContact CG2-CZ2 3.42Å; T452-W456 VanDerWaalsContact CG2-CZ2 3.42Å; T452-W456 HydrophobicContact CG2-CZ3 4.4Å; T452-W456 VanDerWaalsContact O-CG 3.31Å; T452-W456 PolarHBondContact O-N 3.33Å
453	L	92.5	Very high	88.3	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-66.1	-37.9	177.7	-175.7	61.6	0	0	0	111.8	A424 Y425 V442 V444 E449 W456 L457 I565	A424-L453 HydrophobicContact CB-CD2 4.17Å; Y425-L453 HydrophobicContact CD2-CD1 4.1Å; Y425-L453 HydrophobicContact CG-CD1 4.39Å; V442-L453 HydrophobicContact CG1-CD2 3.87Å; V444-L453 HydrophobicContact CG1-CD2 4.26Å; E449-L453 WeakPolarHBondContact O-CB 3.22Å; E449-L453 PolarHBondContact O-N 2.74Å; L453-W456 HydrophobicContact CD1-CE3 4.1Å; L453-W456 PolarHBondContact O-N 3.08Å; L453-L457 HydrophobicContact CD1-CD1 4.37Å; L453-L457 HydrophobicContact CD1-CG 4.47Å; L453-L457 HydrophobicContact CG-CD1 4.1Å; L453-L457 WeakPolarHBondContact O-CB 3.41Å; L453-L457 WeakPolarHBondContact O-CG 3.36Å; L453-L457 PolarHBondContact O-N 3.37Å; L453-I565 HydrophobicContact CB-CD1 4.21Å; L453-I565 HydrophobicContact CB-CG2 4.47Å; L453-I565 HydrophobicContact CD2-CD1 4.27Å; L453-I565 HydrophobicContact CD2-CG1 4.34Å; L453-I565 HydrophobicContact CD2-CG2 3.91Å; L453-I565 HydrophobicContact CG-CD1 4Å
454	L	92.3	Very high	86.7	Confident	13 Å²	13	46.9 Å²	46.9	7%	0.068	24%	0.24	C	C	.	.	H	α-helix	trans	-60.3	-44.8	174.6	-176.6	64.5	0	0	0	111.5	V450 H451 T452 L457 K458 C537 P539 I565	V450-L454 WeakPolarHBondContact O-CB 3.47Å; V450-L454 PolarHBondContact O-N 3.17Å; H451-L454 PolarHBondContact O-N 3.2Å; T452-L454 VanDerWaalsContact C-N 3.35Å; T452-L454 PolarHBondContact O-N 3.39Å; L454-L457 PolarHBondContact O-N 3.48Å; L454-K458 HydrophobicContact CD1-CD 4.47Å; L454-K458 HydrophobicContact CD1-CG 4.41Å; L454-K458 HydrophobicContact CG-CD 4.24Å; L454-K458 WeakPolarHBondContact O-CB 3.12Å; L454-K458 WeakPolarHBondContact O-CG 3.5Å; L454-K458 PolarHBondContact O-N 3.01Å; L454-C537 HydrophobicContact CD1-CB 3.34Å; L454-P539 HydrophobicContact CD2-CB 4.22Å; L454-P539 HydrophobicContact CD2-CG 4.07Å; L454-I565 HydrophobicContact CB-CD1 3.86Å; L454-I565 HydrophobicContact CD1-CD1 4.11Å
455	S	90	Very high	84.7	Confident	73 Å²	73	51.3 Å²	51.3	51%	0.51	28%	0.277	S	S	.	.	H	α-helix	trans	-62.1	-46.3	177.7	-177.1	0	0	0	0	111.2	H451 T452 L457 K458 K459	H451-S455 WeakPolarHBondContact O-CB 3.35Å; H451-S455 PolarHBondContact O-N 3.37Å; T452-S455 PolarHBondContact O-N 3.02Å; S455-L457 VanDerWaalsContact C-N 3.34Å; S455-L457 PolarHBondContact O-N 3.47Å; S455-K458 PolarHBondContact O-N 3.14Å; S455-K459 WeakPolarHBondContact O-CB 3.24Å; S455-K459 PolarHBondContact O-N 2.91Å
456	W	91.6	Very high	82.5	Confident	23 Å²	23	61 Å²	61	9%	0.087	32%	0.318	C	S	.	.	H	α-helix	trans	-60.8	-40.4	176.2	-63.9	-16.9	0	0	0	113	L421 Y425 T452 L453 R460 L519	L421-W456 HydrophobicContact CB-CH2 4.12Å; L421-W456 HydrophobicContact CB-CZ3 3.84Å; Y425-W456 HydrophobicContact CD2-CB 3.81Å; Y425-W456 HydrophobicContact CD2-CE3 4.4Å; Y425-W456 HydrophobicContact CE2-CB 3.78Å; Y425-W456 HydrophobicContact CG-CE3 4.36Å; T452-W456 HydrophobicContact CG2-CD2 4.17Å; T452-W456 HydrophobicContact CG2-CH2 3.87Å; T452-W456 HydrophobicContact CG2-CZ2 3.42Å; T452-W456 VanDerWaalsContact CG2-CZ2 3.42Å; T452-W456 HydrophobicContact CG2-CZ3 4.4Å; T452-W456 VanDerWaalsContact O-CG 3.31Å; T452-W456 PolarHBondContact O-N 3.33Å; L453-W456 HydrophobicContact CD1-CE3 4.1Å; L453-W456 PolarHBondContact O-N 3.08Å; W456-R460 WeakPolarHBondContact O-CB 3.15Å; W456-R460 PolarHBondContact O-N 3.02Å; W456-L519 HydrophobicContact CZ2-CB 3.85Å; W456-L519 HydrophobicContact CZ2-CD1 4.02Å; W456-L519 HydrophobicContact CZ2-CG 4.4Å
457	L	91.5	Very high	80.6	Confident	0 Å²	0	63 Å²	63	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-72.1	-41.3	178.6	-71.8	170	0	0	0	112.2	Y425 V428 L453 L454 S455 K459 R460 F461 L535 I565	Y425-L457 HydrophobicContact CD2-CD2 3.92Å; Y425-L457 HydrophobicContact CD2-CG 4.22Å; Y425-L457 HydrophobicContact CE2-CD2 3.96Å; Y425-L457 HydrophobicContact CE2-CG 4.4Å; V428-L457 HydrophobicContact CB-CD2 4.21Å; V428-L457 HydrophobicContact CG1-CD1 3.99Å; V428-L457 HydrophobicContact CG1-CD2 3.62Å; V428-L457 HydrophobicContact CG1-CG 4.49Å; L453-L457 HydrophobicContact CD1-CD1 4.37Å; L453-L457 HydrophobicContact CD1-CG 4.47Å; L453-L457 HydrophobicContact CG-CD1 4.1Å; L453-L457 WeakPolarHBondContact O-CB 3.41Å; L453-L457 WeakPolarHBondContact O-CG 3.36Å; L453-L457 PolarHBondContact O-N 3.37Å; L454-L457 PolarHBondContact O-N 3.48Å; S455-L457 VanDerWaalsContact C-N 3.34Å; S455-L457 PolarHBondContact O-N 3.47Å; L457-K459 VanDerWaalsContact C-N 3.34Å; L457-K459 PolarHBondContact O-N 2.94Å; L457-R460 PolarHBondContact O-N 3.37Å; L457-F461 HydrophobicContact CD2-CD2 4.47Å; L457-F461 HydrophobicContact CD2-CE2 4.29Å; L457-F461 PolarHBondContact O-N 2.88Å; L457-L535 HydrophobicContact CD2-CD2 4.18Å; L457-I565 HydrophobicContact CD1-CD1 3.86Å; L457-I565 HydrophobicContact CD1-CG1 4.46Å
458	K	88.3	Confident	78.4	Confident	109 Å²	109	66.8 Å²	66.8	47%	0.474	36%	0.362	S	S	.	.	H	α-helix	trans	-63.1	-38.8	174.7	-76.7	-177	174.6	-170	0	112.4	L454 S455 R460 F461	L454-K458 HydrophobicContact CD1-CD 4.47Å; L454-K458 HydrophobicContact CD1-CG 4.41Å; L454-K458 HydrophobicContact CG-CD 4.24Å; L454-K458 WeakPolarHBondContact O-CB 3.12Å; L454-K458 WeakPolarHBondContact O-CG 3.5Å; L454-K458 PolarHBondContact O-N 3.01Å; S455-K458 PolarHBondContact O-N 3.14Å; K458-R460 VanDerWaalsContact C-N 3.29Å; K458-R460 PolarHBondContact O-N 3.39Å; K458-F461 CarbonylContact O-C 3.45Å
459	K	87.5	Confident	75.8	Confident	158 Å²	158	72.5 Å²	72.5	69%	0.687	39%	0.389	S	S	*	.	H	α-helix	trans	-65.9	-32.6	175.3	-175.1	169.4	171.9	-175.9	0	112	S455 L457	S455-K459 WeakPolarHBondContact O-CB 3.24Å; S455-K459 PolarHBondContact O-N 2.91Å; L457-K459 VanDerWaalsContact C-N 3.34Å; L457-K459 PolarHBondContact O-N 2.94Å
460	R	86.7	Confident	73.2	Confident	77 Å²	77	77 Å²	77	29%	0.291	42%	0.421	S	S	.	.	H	α-helix	trans	-80.8	-38.9	178.3	-176.1	66.9	-162.9	-177.7	10.9	113.3	Y425 W456 L457 K458 D532	Y425-R460 WeakPolarHBondContact OH-CB 3.28Å; W456-R460 WeakPolarHBondContact O-CB 3.15Å; W456-R460 PolarHBondContact O-N 3.02Å; L457-R460 PolarHBondContact O-N 3.37Å; K458-R460 VanDerWaalsContact C-N 3.29Å; K458-R460 PolarHBondContact O-N 3.39Å; R460-D532 IonicContact NH2-OD2 3.03Å
461	F	87.6	Confident	70.3	Confident	12 Å²	12	85.9 Å²	85.9	5%	0.053	46%	0.459	C	S	.	.	S	Bend	trans	-124.9	76.8	-177.3	-54.3	-75.4	0	0	0	109.6	H432 L457 K458 D532 L535	H432-F461 AromaticContact CD2-CE1 3.76Å; H432-F461 AromaticContact CD2-CZ 3.76Å; L457-F461 HydrophobicContact CD2-CD2 4.47Å; L457-F461 HydrophobicContact CD2-CE2 4.29Å; L457-F461 PolarHBondContact O-N 2.88Å; K458-F461 CarbonylContact O-C 3.45Å; F461-D532 HydrophobicContact CD1-CB 4.15Å; F461-D532 HydrophobicContact CE1-CB 3.83Å; F461-L535 HydrophobicContact CB-CB 3.87Å; F461-L535 HydrophobicContact CD2-CB 4.09Å; F461-L535 HydrophobicContact CD2-CD2 3.67Å; F461-L535 HydrophobicContact CE2-CD2 3.99Å; F461-L535 HydrophobicContact CG-CB 3.97Å; F461-L535 HydrophobicContact CG-CD2 4.4Å
462	P	80.3	Confident	67.6	Low	93 Å²	93	89.3 Å²	89.3	60%	0.604	49%	0.485	S	S	*	.	P	Polyproline II helix	trans	-65	145.6	179.3	26.4	-33.4	0	0	0	111.5
463	L	72.3	Confident	65	Low	90 Å²	90	95 Å²	95	47%	0.471	51%	0.514	S	S	.	.	P	Polyproline II helix	trans	-74.3	132.8	174.6	-64.1	175.9	0	0	0	109.5	A465 F536 Y560	L463-A465 PolarHBondContact O-N 3.14Å; L463-F536 HydrophobicContact CD2-CD2 4.21Å; L463-Y560 HydrophobicContact CD2-CD1 3.94Å; L463-Y560 HydrophobicContact CD2-CE1 3.34Å
464	N	63.1	Low	62.1	Low	121 Å²	121	104.3 Å²	104.3	65%	0.647	55%	0.554	S	S	*	*	P	Polyproline II helix	trans	-71.9	116.7	171.2	-79.8	-22	0	0	0	108.9	K466 A467 Y560	N464-K466 PolarHBondContact O-N 3.01Å; N464-A467 PolarHBondContact O-N 3.32Å; N464-Y560 PolarHBondContact N-OH 2.95Å
465	A	52.8	Low	59.5	Low	93 Å²	93	113.2 Å²	113.2	77%	0.769	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.9	-9.4	-176.3	0	0	0	0	0	115.8	L463	L463-A465 PolarHBondContact O-N 3.14Å
466	K	45.2	Very low	56.8	Low	211 Å²	211	115.5 Å²	115.5	92%	0.917	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.7	-3.9	179.9	-67.9	-174.1	177.5	-179.3	0	114.9	N464	N464-K466 PolarHBondContact O-N 3.01Å
467	A	45.9	Very low	53.9	Low	56 Å²	56	123.4 Å²	123.4	46%	0.463	65%	0.652	S	S	.	*	S	Bend	trans	-107	4	-172.1	0	0	0	0	0	115.5	N464 Y560	N464-A467 PolarHBondContact O-N 3.32Å; A467-Y560 HydrophobicContact CB-CE2 4.15Å
468	S	35.8	Very low	51.2	Low	98 Å²	98	127 Å²	127	69%	0.685	69%	0.688	S	S	*	*	S	Bend	trans	-112.6	16.1	-167.2	59.1	0	0	0	0	116.8
469	E	29	Very low	48.5	Very low	181 Å²	181	131.6 Å²	131.6	85%	0.846	71%	0.709	S	S	*	*			trans	-119.7	114.4	171.5	-72.4	-168.1	170.3	0	0	111.8	K471	E469-K471 PolarHBondContact O-N 3.21Å
470	P	34.8	Very low	46	Very low	120 Å²	120	136 Å²	136	78%	0.779	72%	0.721	S	S	*	*			trans	-70.1	121.3	160.4	28.3	-27.2	0	0	0	108.2
471	K	30.7	Very low	43.3	Very low	187 Å²	187	142.3 Å²	142.3	81%	0.813	75%	0.75	S	S	*	*			trans	-58.4	132.3	171.6	-72.9	179.1	178.3	175.7	0	109	E469 D473	E469-K471 PolarHBondContact O-N 3.21Å; K471-D473 PolarHBondContact O-N 3.41Å
472	P	32.4	Very low	40.8	Very low	112 Å²	112	151.9 Å²	151.9	73%	0.727	79%	0.792	S	S	*	*			trans	-73.8	111.8	175.2	29	-30.6	0	0	0	108.9	K474	P472-K474 PolarHBondContact O-N 3.21Å
473	D	35.4	Very low	38.2	Very low	169 Å²	169	157.1 Å²	157.1	90%	0.904	81%	0.805	S	S	*	*			trans	-66.7	100.9	171.5	-87.7	-29.5	0	0	0	109.9	K471 K475	K471-D473 PolarHBondContact O-N 3.41Å; D473-K475 PolarHBondContact O-N 3.14Å
474	K	30.8	Very low	36.2	Very low	194 Å²	194	161 Å²	161	84%	0.843	83%	0.825	S	S	*	*			trans	-75.4	103.5	165.4	-73	178.6	177.1	176.6	0	108.5	P472	P472-K474 PolarHBondContact O-N 3.21Å
475	K	37.4	Very low	34.4	Very low	200 Å²	200	161.8 Å²	161.8	87%	0.87	83%	0.834	S	S	*	*			trans	-158.8	121.8	154.6	-106.3	160.5	-168.8	-175.3	0	113	D473	D473-K475 PolarHBondContact O-N 3.14Å
476	S	34.1	Very low	33.3	Very low	122 Å²	122	163.1 Å²	163.1	85%	0.853	83%	0.829	S	S	*	*			trans	63.3	92	160.6	60.5	0	0	0	0	120.6	G478	S476-G478 PolarHBondContact O-N 2.95Å
477	L	31	Very low	32.7	Very low	189 Å²	189	161 Å²	161	99%	0.99	83%	0.826	S	S	*	*			trans	-73.8	109.2	154.2	-89.7	118.8	0	0	0	110.6
478	G	35	Very low	32	Very low	75 Å²	75	164.1 Å²	164.1	77%	0.773	84%	0.835	S	S	*	*			trans	-117.1	111	166.3	0	0	0	0	0	110.6	S476	S476-G478 PolarHBondContact O-N 2.95Å
479	K	31.3	Very low	31.9	Very low	206 Å²	206	166.2 Å²	166.2	90%	0.896	84%	0.839	S	S	*	*			trans	-62.2	130.5	-178.8	-71.3	167.4	175.5	170.1	0	112.4
480	R	35.4	Very low	32.1	Very low	251 Å²	251	167.9 Å²	167.9	95%	0.947	84%	0.839	S	S	*	*			trans	-160.2	113.5	140.8	-113.1	169.8	173.9	-178.7	-1.9	112.2
481	K	28.6	Very low	31.9	Very low	209 Å²	209	170 Å²	170	91%	0.909	84%	0.836	S	S	*	*			trans	-73.5	129.6	174.4	-70.8	175	173	177.9	0	110.3
482	K	34.9	Very low	31.8	Very low	212 Å²	212	169.9 Å²	169.9	92%	0.922	84%	0.838	S	S	*	*			trans	-140.4	128.5	146.1	-89.1	-172.4	178	178.8	0	109
483	K	26.5	Very low	31.6	Very low	204 Å²	204	170.6 Å²	170.6	89%	0.887	84%	0.836	S	S	*	*			trans	-73	126.6	-178.6	-67.4	173.7	173.3	-179.1	0	109.4
484	L	29.9	Very low	31.2	Very low	171 Å²	171	168 Å²	168	90%	0.895	83%	0.831	S	S	*	*			trans	-141.1	120.3	150.4	-145.9	78.4	0	0	0	106.6	N486	L484-N486 PolarHBondContact O-N 3.46Å
485	V	26.1	Very low	31	Very low	138 Å²	138	165.3 Å²	165.3	84%	0.836	83%	0.825	S	S	*	*			trans	-72.3	111.6	-176	175.1	0	0	0	0	107.3
486	N	28.8	Very low	30.4	Very low	121 Å²	121	164.6 Å²	164.6	65%	0.647	82%	0.824	S	S	*	*			trans	-119.2	128.9	168.8	-157.7	10.4	0	0	0	107.9	L484 D488	L484-N486 PolarHBondContact O-N 3.46Å; N486-D488 PolarHBondContact O-N 2.64Å; N486-D488 VanDerWaalsContact O-N 3.08Å
487	L	32.3	Very low	30	Very low	165 Å²	165	165.2 Å²	165.2	86%	0.864	82%	0.817	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.3	42	-167.1	-148.8	81.1	0	0	0	111.5
488	D	32.9	Very low	29.8	Very low	123 Å²	123	165.3 Å²	165.3	66%	0.658	81%	0.809	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.5	4.3	-172.1	-76.5	-26	0	0	0	114.2	N486 Y490	N486-D488 PolarHBondContact O-N 2.64Å; N486-D488 VanDerWaalsContact O-N 3.08Å; D488-Y490 VanDerWaalsContact C-N 3.33Å; D488-Y490 PolarHBondContact O-N 3.42Å
489	D	31.8	Very low	29.4	Very low	141 Å²	141	170.6 Å²	170.6	75%	0.754	81%	0.814	S	S	*	*			trans	-83.2	72.8	180	-79.6	-10.8	0	0	0	112.1	K491	D489-K491 VanDerWaalsContact C-N 3.27Å; D489-K491 PolarHBondContact O-N 3.17Å
490	Y	34.5	Very low	29.2	Very low	216 Å²	216	169.8 Å²	169.8	85%	0.847	81%	0.813	S	S	*	*			trans	-74.4	94.3	142.8	-81.9	-83.4	0	0	0	107	D488 E492	D488-Y490 VanDerWaalsContact C-N 3.33Å; D488-Y490 PolarHBondContact O-N 3.42Å; Y490-E492 PolarHBondContact O-N 3.26Å
491	K	29.5	Very low	28.9	Very low	166 Å²	166	162.7 Å²	162.7	72%	0.722	80%	0.798	S	S	*	*			trans	-56.9	101.7	163.1	-73.2	-179.9	176.9	178	0	108.1	D489 D493	D489-K491 VanDerWaalsContact C-N 3.27Å; D489-K491 PolarHBondContact O-N 3.17Å; K491-D493 PolarHBondContact O-N 2.92Å
492	E	28.8	Very low	28.9	Very low	184 Å²	184	157.7 Å²	157.7	86%	0.86	78%	0.781	S	S	*	*			trans	-63.9	95.2	152.7	-80.6	-174.3	158.2	0	0	106	Y490 S494	Y490-E492 PolarHBondContact O-N 3.26Å; E492-S494 PolarHBondContact O-N 2.77Å
493	D	29.5	Very low	28.7	Very low	127 Å²	127	151.5 Å²	151.5	68%	0.679	76%	0.758	S	S	*	*			trans	-58.1	108	167.8	-84.2	-28.3	0	0	0	108.1	K491 L495	K491-D493 PolarHBondContact O-N 2.92Å; D493-L495 PolarHBondContact O-N 2.79Å
494	S	25.2	Very low	28.9	Very low	113 Å²	113	143.5 Å²	143.5	79%	0.79	72%	0.724	S	S	*	*			trans	-12.7	86.2	152.1	-47.5	0	0	0	0	113.7	E492	E492-S494 PolarHBondContact O-N 2.77Å
495	L	27.7	Very low	29	Very low	138 Å²	138	136.2 Å²	136.2	72%	0.723	69%	0.686	S	S	*	*			trans	-114.6	94.9	169.6	-78.6	174.5	0	0	0	108.7	D493 I497	D493-L495 PolarHBondContact O-N 2.79Å; L495-I497 HydrophobicContact CB-CD1 3.86Å; L495-I497 HydrophobicContact CB-CG1 4.02Å; L495-I497 HydrophobicContact CD1-CD1 4.16Å; L495-I497 HydrophobicContact CG-CD1 4.41Å; L495-I497 PolarHBondContact O-N 2.94Å
496	H	24	Very low	29.3	Very low	185 Å²	185	133 Å²	133	86%	0.856	66%	0.662	S	S	*	*			trans	-55.1	99	155.9	-77.8	-87.7	0	0	0	108.1
497	I	27	Very low	29.5	Very low	135 Å²	135	129.4 Å²	129.4	69%	0.692	64%	0.643	S	S	*	*			trans	-127	114.1	173.7	-61.6	174.7	0	0	0	108.6	L495	L495-I497 HydrophobicContact CB-CD1 3.86Å; L495-I497 HydrophobicContact CB-CG1 4.02Å; L495-I497 HydrophobicContact CD1-CD1 4.16Å; L495-I497 HydrophobicContact CG-CD1 4.41Å; L495-I497 PolarHBondContact O-N 2.94Å
498	F	27.2	Very low	29.4	Very low	191 Å²	191	123.2 Å²	123.2	84%	0.838	62%	0.615	S	S	*	*			trans	-50.4	155.7	169.5	-78.1	-98.8	0	0	0	112.2	E500	F498-E500 PolarHBondContact O-N 3.21Å; F498-E500 VanDerWaalsContact O-N 3.12Å
499	E	25.2	Very low	29.2	Very low	187 Å²	187	119.3 Å²	119.3	87%	0.874	60%	0.597	S	S	*	*	S	Bend	trans	-49	108.5	177.2	-62.3	175.9	131.4	0	0	113.4
500	E	26.8	Very low	29.2	Very low	188 Å²	188	116 Å²	116	88%	0.879	58%	0.579	S	S	*	*			trans	-155.9	111	146.5	-108.6	173.4	-167.6	0	0	107.7	F498	F498-E500 PolarHBondContact O-N 3.21Å; F498-E500 VanDerWaalsContact O-N 3.12Å
501	V	29.3	Very low	29	Very low	102 Å²	102	113.3 Å²	113.3	62%	0.618	58%	0.579	S	S	*	*			trans	-94.1	105.5	-179.1	178.8	0	0	0	0	107.5	L503	V501-L503 PolarHBondContact O-N 2.88Å
502	D	28.8	Very low	28.9	Very low	104 Å²	104	108.1 Å²	108.1	56%	0.556	56%	0.559	S	S	*	*			trans	-60.6	118.2	173.4	-90.9	-32.4	0	0	0	111.7	V809	D502-V809 WeakPolarHBondContact OD2-CG1 3.44Å
503	L	30.4	Very low	28.8	Very low	83 Å²	83	106.3 Å²	106.3	44%	0.435	55%	0.554	S	S	.	*			trans	-91.4	94.9	178.5	-71.6	154.2	0	0	0	108.2	V501 E760	V501-L503 PolarHBondContact O-N 2.88Å; L503-E760 WeakPolarHBondContact CD1-OE2 3.5Å
504	N	30.3	Very low	28.7	Very low	35 Å²	35	107.9 Å²	107.9	19%	0.187	56%	0.555	C	S	.	*			trans	-163.1	86.7	162.5	-95.3	-39.4	0	0	0	109.8	L754 T758	N504-L754 HydrophobicContact CB-CD1 3.98Å; N504-L754 HydrophobicContact CB-CD2 3.93Å; N504-T758 PolarHBondContact OD1-O 3.33Å; N504-T758 VanDerWaalsContact OD1-O 3.13Å; N504-T758 PolarHBondContact OD1-OG1 2.68Å
505	D	33.1	Very low	28.8	Very low	18 Å²	18	108.3 Å²	108.3	10%	0.096	55%	0.548	C	S	.	.			trans	-156.2	97.8	153.4	-99.1	-22.5	0	0	0	110.1	Q447 R818	Q447-D505 VanDerWaalsContact NE2-CB 3.26Å; D505-R818 WeakPolarHBondContact OD1-CD 3.41Å; D505-R818 WeakPolarHBondContact OD1-CG 3.49Å; D505-R818 IonicContact OD1-CZ 3.29Å; D505-R818 IonicContact OD1-NE 2.9Å; D505-R818 PolarHBondContact OD1-NE 3.38Å; D505-R818 IonicContact OD1-NH1 2.6Å; D505-R818 PolarHBondContact OD1-NH1 3.42Å; D505-R818 IonicContact OD1-NH2 2.82Å; D505-R818 VanDerWaalsContact OD2-CD 3.24Å; D505-R818 WeakPolarHBondContact OD2-CD 3.4Å; D505-R818 WeakPolarHBondContact OD2-CG 3.31Å; D505-R818 IonicContact OD2-NE 2.73Å
506	Q	32.9	Very low	28.8	Very low	71 Å²	71	108.5 Å²	108.5	33%	0.332	56%	0.555	S	S	.	*			trans	-108.5	71	-170.1	-88	-147.1	22.1	0	0	110.7	K448 A508 T758	K448-Q506 HydrophobicContact CD-CB 4.17Å; K448-Q506 HydrophobicContact CD-CG 3.86Å; K448-Q506 VanDerWaalsContact CE-CG 3.48Å; K448-Q506 WeakPolarHBondContact CE-O 3.4Å; K448-Q506 HydrophobicContact CG-CB 4.45Å; K448-Q506 HydrophobicContact CG-CG 4.09Å; Q506-A508 VanDerWaalsContact C-N 3.32Å; Q506-A508 PolarHBondContact O-N 2.94Å; Q506-T758 HydrophobicContact CB-CG2 3.6Å; Q506-T758 HydrophobicContact CG-CG2 3.9Å
507	D	31.5	Very low	29	Very low	45 Å²	45	107 Å²	107	24%	0.241	55%	0.548	C	S	.	.			trans	-68	87.7	171.4	-62.1	-30.2	0	0	0	110.3	K589 R818	D507-K589 PolarHBondContact O-NZ 3.42Å; D507-R818 IonicContact OD1-NH1 3.86Å; D507-R818 PolarHBondContact OD1-NH1 2.77Å; D507-R818 IonicContact OD1-NH2 2.6Å
508	A	31.6	Very low	29	Very low	35 Å²	35	108.4 Å²	108.4	29%	0.289	55%	0.552	S	S	.	*			trans	168	110.8	153.8	0	0	0	0	0	107.1	K448 Q506 D510	K448-A508 PolarHBondContact NZ-O 2.98Å; Q506-A508 VanDerWaalsContact C-N 3.32Å; Q506-A508 PolarHBondContact O-N 2.94Å; A508-D510 VanDerWaalsContact C-N 3.31Å; A508-D510 PolarHBondContact O-N 3.07Å
509	P	28.1	Very low	29.5	Very low	42 Å²	42	104.8 Å²	104.8	27%	0.273	54%	0.54	S	S	.	.			trans	-84.3	87.4	153.4	21.5	-3.9	0	0	0	106.2	V925 D926	P509-V925 HydrophobicContact CB-CG1 3.39Å; P509-V925 HydrophobicContact CG-CB 4.35Å; P509-V925 HydrophobicContact CG-CG1 3.31Å; P509-V925 HydrophobicContact CG-CG2 4.1Å; P509-D926 VanDerWaalsContact O-O 3.14Å
510	D	31.2	Very low	29.9	Very low	71 Å²	71	103.4 Å²	103.4	38%	0.38	53%	0.534	S	S	.	.			trans	-157.2	122.2	158.1	-104.3	-26.5	0	0	0	105.3	A508 K601	A508-D510 VanDerWaalsContact C-N 3.31Å; A508-D510 PolarHBondContact O-N 3.07Å; D510-K601 WeakPolarHBondContact OD2-CE 3.48Å; D510-K601 IonicContact OD2-NZ 3.53Å; D510-K601 PolarHBondContact OD2-NZ 3.2Å
511	L	30.3	Very low	30.2	Very low	160 Å²	160	95.8 Å²	95.8	84%	0.838	50%	0.501	S	S	*	.			trans	96.1	80.4	175.9	-52.6	169	0	0	0	116.8
512	D	28.5	Very low	31.2	Very low	56 Å²	56	91.8 Å²	91.8	30%	0.299	48%	0.478	S	S	.	.			trans	-56	147.1	147.3	-62.9	-93.3	0	0	0	114.1	F514 N928	D512-F514 PolarHBondContact O-N 2.98Å; D512-N928 WeakPolarHBondContact CB-ND2 3.37Å; D512-N928 WeakPolarHBondContact CB-OD1 3.49Å; D512-N928 PolarHBondContact OD1-ND2 3.22Å; D512-N928 VanDerWaalsContact OD1-ND2 3.12Å; D512-N928 WeakPolarHBondContact OD2-CA 3.37Å; D512-N928 WeakPolarHBondContact OD2-CB 3.3Å; D512-N928 PolarHBondContact OD2-N 2.9Å; D512-N928 PolarHBondContact OD2-ND2 2.68Å; D512-N928 PolarHBondContact OD2-OD1 2.51Å; D512-N928 VanDerWaalsContact OD2-OD1 3.12Å
513	I	26.7	Very low	31.9	Very low	147 Å²	147	94.2 Å²	94.2	75%	0.754	49%	0.49	S	S	*	.			trans	45.3	71.1	146.1	-47.4	164	0	0	0	114.7
514	F	27.4	Very low	32.6	Very low	159 Å²	159	92.5 Å²	92.5	70%	0.697	48%	0.481	S	S	*	.	S	Bend	trans	-120	140	132.4	-71.8	-80.9	0	0	0	106.8	D512 V516	D512-F514 PolarHBondContact O-N 2.98Å; F514-V516 PolarHBondContact O-N 3.13Å
515	D	26.2	Very low	33.2	Very low	122 Å²	122	96.5 Å²	96.5	65%	0.652	51%	0.509	S	S	*	.			trans	-22.9	123.2	179.4	-61.8	-59.2	0	0	0	112.2	E517	D515-E517 HydrophobicContact CB-CG 4.04Å; D515-E517 PolarHBondContact O-N 2.98Å
516	V	29.1	Very low	33.5	Very low	142 Å²	142	100.4 Å²	100.4	86%	0.861	53%	0.534	S	S	*	.			trans	-68	68.5	146.6	-169.6	0	0	0	0	104.7	F514 E518	F514-V516 PolarHBondContact O-N 3.13Å; V516-E518 PolarHBondContact O-N 2.83Å; V516-E518 VanDerWaalsContact O-N 3.1Å
517	E	27.1	Very low	33.7	Very low	154 Å²	154	101.2 Å²	101.2	72%	0.72	55%	0.553	S	S	*	*			trans	-53.3	110.3	137	-78.7	178.2	174.7	0	0	101.1	D515 L519	D515-E517 HydrophobicContact CB-CG 4.04Å; D515-E517 PolarHBondContact O-N 2.98Å; E517-L519 VanDerWaalsContact C-N 3.3Å; E517-L519 PolarHBondContact O-N 3.01Å
518	E	28.5	Very low	33.7	Very low	164 Å²	164	104 Å²	104	77%	0.766	58%	0.575	S	S	*	*			trans	-37.1	110.7	159.8	-75.9	-177.4	138.4	0	0	104.3	V516 E520	V516-E518 PolarHBondContact O-N 2.83Å; V516-E518 VanDerWaalsContact O-N 3.1Å; E518-E520 PolarHBondContact O-N 3.03Å
519	L	37.6	Very low	34	Very low	115 Å²	115	110.2 Å²	110.2	60%	0.602	60%	0.603	S	S	*	*			trans	-61	94.8	-179.6	-96.5	157.9	0	0	0	103.8	W456 E517 C521	W456-L519 HydrophobicContact CZ2-CB 3.85Å; W456-L519 HydrophobicContact CZ2-CD1 4.02Å; W456-L519 HydrophobicContact CZ2-CG 4.4Å; E517-L519 VanDerWaalsContact C-N 3.3Å; E517-L519 PolarHBondContact O-N 3.01Å; L519-C521 PolarHBondContact O-N 2.84Å
520	E	33.4	Very low	34.9	Very low	158 Å²	158	116.7 Å²	116.7	74%	0.738	63%	0.629	S	S	*	*			trans	-54.9	133.2	-173.9	-77.4	178.9	159	0	0	104.8	E518 P522	E518-E520 PolarHBondContact O-N 3.03Å; E520-P522 WeakPolarHBondContact O-CD 3.36Å
521	C	33.5	Very low	36	Very low	29 Å²	29	119.1 Å²	119.1	20%	0.196	65%	0.649	C	S	.	*			trans	-46.6	124.7	171.6	-84.9	0	0	0	0	106.4	L519 D523	L519-C521 PolarHBondContact O-N 2.84Å; C521-D523 PolarHBondContact O-N 2.84Å
522	P	48.5	Very low	37.5	Very low	18 Å²	18	114.6 Å²	114.6	12%	0.117	63%	0.626	C	S	.	*			trans	-55.3	111.8	-179.1	-22.8	30.7	0	0	0	107.8	Q422 Y425 E520 I524	Q422-P522 HydrophobicContact CG-CB 4.38Å; Q422-P522 HydrophobicContact CG-CG 3.81Å; Y425-P522 HydrophobicContact CD1-CB 4.38Å; Y425-P522 HydrophobicContact CD1-CG 3.8Å; Y425-P522 HydrophobicContact CE1-CB 4.32Å; Y425-P522 HydrophobicContact CE1-CG 4Å; E520-P522 WeakPolarHBondContact O-CD 3.36Å; P522-I524 PolarHBondContact O-N 2.72Å
523	D	43.4	Very low	39.7	Very low	154 Å²	154	115.2 Å²	115.2	82%	0.824	63%	0.627	S	S	*	*			trans	-62.6	104.3	176.4	-78.9	-30.3	0	0	0	107.4	C521	C521-D523 PolarHBondContact O-N 2.84Å
524	I	45	Very low	42.5	Very low	48 Å²	48	110.4 Å²	110.4	25%	0.246	61%	0.605	C	S	.	*			trans	-92.6	116.3	167.3	-56.8	170.3	0	0	0	104.7	Y425 C429 P522 T526	Y425-I524 HydrophobicContact CE1-CD1 4.24Å; C429-I524 HydrophobicContact CB-CD1 4.36Å; P522-I524 PolarHBondContact O-N 2.72Å; I524-T526 PolarHBondContact O-N 3.27Å
525	P	43.6	Very low	45.4	Very low	119 Å²	119	103 Å²	103	77%	0.773	57%	0.573	S	S	*	*			trans	-55.5	111.8	175	-21.5	31.4	0	0	0	109.4	A527	P525-A527 VanDerWaalsContact C-N 3.32Å; P525-A527 PolarHBondContact O-N 2.71Å
526	T	39.1	Very low	48.5	Very low	100 Å²	100	98.7 Å²	98.7	61%	0.613	55%	0.548	S	S	*	.			trans	-73.9	86.8	172.9	16.9	0	0	0	0	108.9	I524 S528	I524-T526 PolarHBondContact O-N 3.27Å; T526-S528 PolarHBondContact O-N 3.05Å
527	A	37.8	Very low	51.5	Low	88 Å²	88	92.5 Å²	92.5	73%	0.727	51%	0.512	S	S	*	.			trans	-82.6	100.6	160.2	0	0	0	0	0	108.1	P525	P525-A527 VanDerWaalsContact C-N 3.32Å; P525-A527 PolarHBondContact O-N 2.71Å
528	S	32.2	Very low	54.6	Low	102 Å²	102	85.7 Å²	85.7	71%	0.713	48%	0.48	S	S	*	.	S	Bend	trans	30.7	111.1	148.5	53.8	0	0	0	0	119.1	T526	T526-S528 PolarHBondContact O-N 3.05Å
529	L	37.2	Very low	57.6	Low	167 Å²	167	79.2 Å²	79.2	87%	0.874	45%	0.452	S	S	*	.			trans	159.4	127.1	130.7	-82.1	149.9	0	0	0	110.9
530	E	47.2	Very low	60.1	Low	177 Å²	177	73.8 Å²	73.8	83%	0.827	42%	0.424	S	S	*	.	S	Bend	trans	65.9	142.7	174.7	-60.1	-164.8	178	0	0	119.5	D532	E530-D532 PolarHBondContact O-N 3.18Å
531	P	52.9	Low	62.6	Low	123 Å²	123	67.1 Å²	67.1	80%	0.799	39%	0.392	S	S	*	.	P	Polyproline II helix	trans	-62.5	121.4	176.6	25.3	-31.9	0	0	0	109.9	E533	P531-E533 PolarHBondContact O-N 3.28Å
532	D	62.5	Low	64.5	Low	65 Å²	65	69.6 Å²	69.6	35%	0.348	41%	0.41	S	S	.	.	P	Polyproline II helix	trans	-49.9	122.3	178.1	-82.4	-38	0	0	0	109.4	R433 R460 F461 E530	R433-D532 WeakPolarHBondContact CG-OD1 3.32Å; R433-D532 IonicContact CZ-OD1 3.68Å; R433-D532 IonicContact CZ-OD2 3.81Å; R433-D532 IonicContact NE-OD1 3.34Å; R433-D532 PolarHBondContact NE-OD1 3.4Å; R433-D532 IonicContact NE-OD2 3.68Å; R433-D532 IonicContact NH2-OD1 2.72Å; R433-D532 IonicContact NH2-OD2 3.6Å; R433-D532 PolarHBondContact NH2-OD2 3.17Å; R460-D532 IonicContact NH2-OD2 3.03Å; F461-D532 HydrophobicContact CD1-CB 4.15Å; F461-D532 HydrophobicContact CE1-CB 3.83Å; E530-D532 PolarHBondContact O-N 3.18Å
533	E	74	Confident	65.5	Low	69 Å²	69	71.6 Å²	71.6	32%	0.322	42%	0.419	S	S	.	.	P	Polyproline II helix	trans	-51	144.5	172	-76.9	-169.1	143.8	0	0	109.4	H432 R437 P531 R561	H432-E533 PolarHBondContact CE1-O 3.36Å; H432-E533 PolarHBondContact NE2-O 3.09Å; R437-E533 IonicContact CZ-OE1 3.79Å; R437-E533 IonicContact NH1-OE1 3.44Å; R437-E533 PolarHBondContact NH1-OE1 3.47Å; P531-E533 PolarHBondContact O-N 3.28Å; E533-R561 IonicContact OE2-CZ 2.66Å; E533-R561 IonicContact OE2-NE 3.43Å; E533-R561 IonicContact OE2-NH2 3.33Å; E533-R561 PolarHBondContact OE2-NH2 3.45Å
534	P	85.6	Confident	66.8	Low	46 Å²	46	64.8 Å²	64.8	30%	0.299	38%	0.382	S	S	.	.	P	Polyproline II helix	trans	-74.2	141.6	-177.7	31.8	-35.6	0	0	0	111.6	Y560 R561	P534-Y560 HydrophobicContact CB-CD1 3.58Å; P534-Y560 HydrophobicContact CB-CE1 3.46Å; P534-Y560 VanDerWaalsContact CB-CE1 3.46Å; P534-Y560 HydrophobicContact CB-CG 4.21Å; P534-Y560 HydrophobicContact CG-CD1 3.98Å; P534-Y560 HydrophobicContact CG-CD2 4.3Å; P534-Y560 HydrophobicContact CG-CE1 4.08Å; P534-Y560 HydrophobicContact CG-CE2 4.4Å; P534-Y560 HydrophobicContact CG-CG 4.09Å; P534-Y560 WeakPolarHBondContact O-CA 3.48Å; P534-R561 PolarHBondContact O-N 3.36Å
535	L	89.4	Confident	67.8	Low	4 Å²	4	65.2 Å²	65.2	2%	0.021	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	117	-174.8	-172.4	67.7	0	0	0	111	V428 L457 F461 C537 R561 C563	V428-L535 HydrophobicContact CG1-CD2 4.29Å; L457-L535 HydrophobicContact CD2-CD2 4.18Å; F461-L535 HydrophobicContact CB-CB 3.87Å; F461-L535 HydrophobicContact CD2-CB 4.09Å; F461-L535 HydrophobicContact CD2-CD2 3.67Å; F461-L535 HydrophobicContact CE2-CD2 3.99Å; F461-L535 HydrophobicContact CG-CB 3.97Å; F461-L535 HydrophobicContact CG-CD2 4.4Å; L535-C537 VanDerWaalsContact CD2-SG 3.55Å; L535-R561 HydrophobicContact CD1-CB 4.17Å; L535-C563 HydrophobicContact CD1-CB 3.75Å; L535-C563 HydrophobicContact CD2-CB 4.31Å; L535-C563 HydrophobicContact CG-CB 4.12Å
536	F	91.2	Very high	68.8	Low	30 Å²	30	63.9 Å²	63.9	13%	0.132	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	104.8	175.7	-173.5	-114	0	0	0	110.4	L463 L538 P556 P557 Y560 R561 C562 C563	L463-F536 HydrophobicContact CD2-CD2 4.21Å; F536-L538 HydrophobicContact CD1-CD1 4.34Å; F536-L538 HydrophobicContact CD1-CG 4.15Å; F536-L538 HydrophobicContact CE1-CD1 3.76Å; F536-L538 HydrophobicContact CE1-CD2 3.75Å; F536-L538 HydrophobicContact CE1-CG 3.71Å; F536-L538 HydrophobicContact CZ-CD2 3.83Å; F536-L538 HydrophobicContact CZ-CG 4.3Å; F536-P556 HydrophobicContact CD1-CB 4.17Å; F536-P557 HydrophobicContact CD2-CG 4.42Å; F536-P557 HydrophobicContact CE2-CG 4.41Å; F536-Y560 HydrophobicContact CB-CD1 4.05Å; F536-Y560 HydrophobicContact CB-CG 4.26Å; F536-R561 PolarHBondContact N-O 3.43Å; F536-C562 CarbonylContact O-C 3.46Å; F536-C562 WeakPolarHBondContact O-CA 3.32Å; F536-C563 PolarHBondContact O-N 2.99Å
537	C	92.4	Very high	70.3	Confident	13 Å²	13	61.8 Å²	61.8	9%	0.088	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	129.4	-175.8	-60.1	0	0	0	0	112.6	L454 L535 C563	L454-C537 HydrophobicContact CD1-CB 3.34Å; L535-C537 VanDerWaalsContact CD2-SG 3.55Å; C537-C563 CarbonylContact C-O 3.35Å; C537-C563 VanDerWaalsContact CA-O 3.24Å; C537-C563 WeakPolarHBondContact CA-O 3.44Å
538	L	91.8	Very high	72.1	Confident	10 Å²	10	63.2 Å²	63.2	5%	0.052	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	137.9	176.6	-67.1	177.2	0	0	0	111.6	F536 R551 V552 C563 V564 I565	F536-L538 HydrophobicContact CD1-CD1 4.34Å; F536-L538 HydrophobicContact CD1-CG 4.15Å; F536-L538 HydrophobicContact CE1-CD1 3.76Å; F536-L538 HydrophobicContact CE1-CD2 3.75Å; F536-L538 HydrophobicContact CE1-CG 3.71Å; F536-L538 HydrophobicContact CZ-CD2 3.83Å; F536-L538 HydrophobicContact CZ-CG 4.3Å; L538-R551 HydrophobicContact CD1-CB 4.45Å; L538-R551 WeakPolarHBondContact CD1-O 3.2Å; L538-V552 HydrophobicContact CB-CG1 4.35Å; L538-V552 HydrophobicContact CD1-CG1 4.28Å; L538-C563 PolarHBondContact N-O 2.93Å; L538-V564 CarbonylContact O-C 3.54Å; L538-V564 WeakPolarHBondContact O-CA 3.41Å; L538-I565 PolarHBondContact O-N 2.88Å
539	P	92.1	Very high	74.3	Confident	29 Å²	29	59.8 Å²	59.8	19%	0.188	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	153.7	170	32.9	-32.2	0	0	0	111.4	V450 L454 Y541 M544 I565	V450-P539 HydrophobicContact CG1-CB 3.43Å; V450-P539 VanDerWaalsContact CG1-CB 3.43Å; L454-P539 HydrophobicContact CD2-CB 4.22Å; L454-P539 HydrophobicContact CD2-CG 4.07Å; P539-Y541 HydrophobicContact CB-CD1 4.49Å; P539-Y541 HydrophobicContact CB-CE1 4.09Å; P539-M544 VanDerWaalsContact C-CE 3.48Å; P539-M544 HydrophobicContact CB-CE 3.78Å; P539-M544 HydrophobicContact CG-CE 3.8Å; P539-M544 VanDerWaalsContact O-CE 3.25Å; P539-M544 WeakPolarHBondContact O-CE 3.39Å; P539-I565 CarbonylContact C-O 3.43Å; P539-I565 WeakPolarHBondContact CA-O 3.43Å
540	L	89.6	Confident	76.3	Confident	1 Å²	1	53.8 Å²	53.8	1%	0.005	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	119.6	170	-175.8	61.9	0	0	0	112	Q549 V552 V564 I565 A566 T567 A570 V574 I576	L540-Q549 HydrophobicContact CD1-CB 4.24Å; L540-Q549 HydrophobicContact CD1-CG 4.14Å; L540-V552 HydrophobicContact CB-CG1 4.29Å; L540-V552 HydrophobicContact CD1-CG1 4.15Å; L540-V552 HydrophobicContact CD1-CG2 4.32Å; L540-V552 HydrophobicContact CD2-CG1 4.49Å; L540-V552 HydrophobicContact CD2-CG2 4.3Å; L540-V564 HydrophobicContact CB-CG1 3.82Å; L540-V564 HydrophobicContact CD2-CG1 4.26Å; L540-I565 PolarHBondContact N-O 3.26Å; L540-A566 HydrophobicContact CB-CB 3.93Å; L540-A566 HydrophobicContact CD2-CB 4.25Å; L540-A566 HydrophobicContact CG-CB 4.39Å; L540-A566 WeakPolarHBondContact O-CA 3.42Å; L540-T567 PolarHBondContact O-N 2.98Å; L540-T567 VanDerWaalsContact O-N 3.11Å; L540-A570 HydrophobicContact CD2-CB 4.11Å; L540-V574 HydrophobicContact CD2-CG1 4.29Å; L540-I576 HydrophobicContact CD2-CD1 3.9Å; L540-I576 HydrophobicContact CD2-CG1 4.46Å
541	Y	84.5	Confident	78.1	Confident	17 Å²	17	50.7 Å²	50.7	7%	0.067	30%	0.298	C	S	.	.			trans	-159.5	161.4	176.4	51.8	-95.5	0	0	0	109.7	Q447 V450 H451 P539 L543 M544 Q549	Q447-Y541 HydrophobicContact CB-CD2 4.46Å; Q447-Y541 HydrophobicContact CB-CG 4.45Å; Q447-Y541 VanDerWaalsContact CD-CE2 3.46Å; Q447-Y541 HydrophobicContact CG-CD1 4.2Å; Q447-Y541 HydrophobicContact CG-CD2 4.17Å; Q447-Y541 HydrophobicContact CG-CE1 3.92Å; Q447-Y541 HydrophobicContact CG-CE2 3.91Å; Q447-Y541 HydrophobicContact CG-CG 4.33Å; Q447-Y541 VanDerWaalsContact OE1-CE2 3.3Å; V450-Y541 HydrophobicContact CB-CD1 4.38Å; V450-Y541 HydrophobicContact CG1-CD1 4.11Å; V450-Y541 HydrophobicContact CG1-CE1 4.34Å; V450-Y541 HydrophobicContact CG2-CD1 4.36Å; H451-Y541 AromaticContact CE1-CE1 3.33Å; H451-Y541 WeakPolarHBondContact CE1-CE1 3.37Å; H451-Y541 AromaticContact CE1-CZ 3.51Å; H451-Y541 PolarHBondContact CE1-OH 3.2Å; H451-Y541 AromaticContact NE2-CE1 3.98Å; H451-Y541 PolarHBondContact NE2-OH 3.27Å; P539-Y541 HydrophobicContact CB-CD1 4.49Å; P539-Y541 HydrophobicContact CB-CE1 4.09Å; Y541-L543 HydrophobicContact CD2-CB 4.19Å; Y541-L543 HydrophobicContact CE2-CB 4.34Å; Y541-L543 PolarHBondContact O-N 3.38Å; Y541-M544 HydrophobicContact CD1-CE 3.54Å; Y541-M544 HydrophobicContact CD2-CB 4.09Å; Y541-M544 HydrophobicContact CD2-CE 4.42Å; Y541-M544 HydrophobicContact CE1-CE 3.25Å; Y541-M544 HydrophobicContact CE2-CB 3.87Å; Y541-M544 HydrophobicContact CE2-CE 4.18Å; Y541-M544 HydrophobicContact CG-CE 4.11Å; Y541-M544 WeakPolarHBondContact O-CB 3.34Å; Y541-M544 PolarHBondContact O-N 3.43Å; Y541-M544 VanDerWaalsContact O-N 3.12Å; Y541-Q549 PolarHBondContact O-NE2 2.81Å
542	S	73.6	Confident	79.6	Confident	81 Å²	81	45.1 Å²	45.1	57%	0.566	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-40	-165.6	48.1	0	0	0	0	113.6	M544 Q549	S542-M544 PolarHBondContact O-N 3.11Å; S542-M544 VanDerWaalsContact O-N 3.17Å; S542-Q549 PolarHBondContact O-NE2 2.95Å; S542-Q549 VanDerWaalsContact O-NE2 3.17Å
543	L	69.9	Low	80.6	Confident	61 Å²	61	46.1 Å²	46.1	32%	0.319	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	5.3	-180	-63.2	174.2	0	0	0	114	Y541 K820	Y541-L543 HydrophobicContact CD2-CB 4.19Å; Y541-L543 HydrophobicContact CE2-CB 4.34Å; Y541-L543 PolarHBondContact O-N 3.38Å; L543-K820 PolarHBondContact O-NZ 2.85Å
544	M	70.3	Confident	81.1	Confident	10 Å²	10	48.7 Å²	48.7	5%	0.049	28%	0.275	C	S	.	.	S	Bend	trans	-79.2	140.9	177.6	-171.5	176.5	-51.2	0	0	111	P539 Y541 S542 K548 Q549	P539-M544 VanDerWaalsContact C-CE 3.48Å; P539-M544 HydrophobicContact CB-CE 3.78Å; P539-M544 HydrophobicContact CG-CE 3.8Å; P539-M544 VanDerWaalsContact O-CE 3.25Å; P539-M544 WeakPolarHBondContact O-CE 3.39Å; Y541-M544 HydrophobicContact CD1-CE 3.54Å; Y541-M544 HydrophobicContact CD2-CB 4.09Å; Y541-M544 HydrophobicContact CD2-CE 4.42Å; Y541-M544 HydrophobicContact CE1-CE 3.25Å; Y541-M544 HydrophobicContact CE2-CB 3.87Å; Y541-M544 HydrophobicContact CE2-CE 4.18Å; Y541-M544 HydrophobicContact CG-CE 4.11Å; Y541-M544 WeakPolarHBondContact O-CB 3.34Å; Y541-M544 PolarHBondContact O-N 3.43Å; Y541-M544 VanDerWaalsContact O-N 3.12Å; S542-M544 PolarHBondContact O-N 3.11Å; S542-M544 VanDerWaalsContact O-N 3.17Å; M544-K548 HydrophobicContact CG-CB 3.65Å; M544-K548 HydrophobicContact SD-CB 3.76Å; M544-Q549 HydrophobicContact CB-CG 3.72Å; M544-Q549 HydrophobicContact CG-CG 3.95Å; M544-Q549 PolarHBondContact O-NE2 3.48Å; M544-Q549 HydrophobicContact SD-CG 4.18Å
545	P	66.3	Low	80.9	Confident	58 Å²	58	54.8 Å²	54.8	38%	0.377	30%	0.299	S	S	.	.			trans	-57.7	141.8	175.3	-23.8	33.9	0	0	0	112	G547 K548 Q549	P545-G547 VanDerWaalsContact C-N 3.27Å; P545-G547 PolarHBondContact O-N 3.42Å; P545-K548 HydrophobicContact CG-CD 4.39Å; P545-K548 WeakPolarHBondContact O-CA 3.02Å; P545-K548 PolarHBondContact O-N 2.84Å; P545-Q549 PolarHBondContact O-N 3.25Å
546	S	65.1	Low	80.7	Confident	91 Å²	91	56.7 Å²	56.7	64%	0.636	31%	0.311	S	S	*	.	H	α-helix	trans	-53.8	-40.2	-175.9	-50.2	0	0	0	0	113.2	K548 Q549 A550	S546-K548 VanDerWaalsContact C-N 3.35Å; S546-K548 PolarHBondContact O-N 2.95Å; S546-Q549 PolarHBondContact O-N 3.19Å; S546-A550 WeakPolarHBondContact O-CB 3.29Å; S546-A550 PolarHBondContact O-N 3.12Å
547	G	70.8	Confident	80.5	Confident	55 Å²	55	57.6 Å²	57.6	57%	0.567	32%	0.321	S	S	*	.	H	α-helix	trans	-63.5	-35.7	175.8	0	0	0	0	0	113.7	P545 A550	P545-G547 VanDerWaalsContact C-N 3.27Å; P545-G547 PolarHBondContact O-N 3.42Å; G547-A550 PolarHBondContact O-N 3.27Å
548	K	76.3	Confident	80	Confident	119 Å²	119	61.9 Å²	61.9	52%	0.517	36%	0.357	S	S	.	.	H	α-helix	trans	-74.4	-37.8	174.3	-70.6	-171.4	-178.5	-178.4	0	111.7	M544 P545 S546 A550 R551	M544-K548 HydrophobicContact CG-CB 3.65Å; M544-K548 HydrophobicContact SD-CB 3.76Å; P545-K548 HydrophobicContact CG-CD 4.39Å; P545-K548 WeakPolarHBondContact O-CA 3.02Å; P545-K548 PolarHBondContact O-N 2.84Å; S546-K548 VanDerWaalsContact C-N 3.35Å; S546-K548 PolarHBondContact O-N 2.95Å; K548-A550 VanDerWaalsContact C-N 3.27Å; K548-A550 PolarHBondContact O-N 3.48Å; K548-R551 WeakPolarHBondContact O-CB 3.36Å; K548-R551 PolarHBondContact O-N 3.24Å
549	Q	78	Confident	79.6	Confident	30 Å²	30	63.4 Å²	63.4	14%	0.14	38%	0.375	C	S	.	.	H	α-helix	trans	-60.8	-40.6	171.8	-64.8	-171.6	21.5	0	0	110.4	L540 Y541 S542 M544 P545 S546 R551 V552	L540-Q549 HydrophobicContact CD1-CB 4.24Å; L540-Q549 HydrophobicContact CD1-CG 4.14Å; Y541-Q549 PolarHBondContact O-NE2 2.81Å; S542-Q549 PolarHBondContact O-NE2 2.95Å; S542-Q549 VanDerWaalsContact O-NE2 3.17Å; M544-Q549 HydrophobicContact CB-CG 3.72Å; M544-Q549 HydrophobicContact CG-CG 3.95Å; M544-Q549 PolarHBondContact O-NE2 3.48Å; M544-Q549 HydrophobicContact SD-CG 4.18Å; P545-Q549 PolarHBondContact O-N 3.25Å; S546-Q549 PolarHBondContact O-N 3.19Å; Q549-R551 PolarHBondContact O-N 3.25Å; Q549-R551 VanDerWaalsContact O-N 3.1Å; Q549-V552 WeakPolarHBondContact O-CG2 3.28Å; Q549-V552 PolarHBondContact O-N 3.32Å
550	A	79.3	Confident	79.3	Confident	40 Å²	40	63.1 Å²	63.1	33%	0.331	37%	0.37	S	S	.	.	H	α-helix	trans	-59.3	-26.3	-178.9	0	0	0	0	0	113.5	S546 G547 K548 V552 F553	S546-A550 WeakPolarHBondContact O-CB 3.29Å; S546-A550 PolarHBondContact O-N 3.12Å; G547-A550 PolarHBondContact O-N 3.27Å; K548-A550 VanDerWaalsContact C-N 3.27Å; K548-A550 PolarHBondContact O-N 3.48Å; A550-V552 PolarHBondContact O-N 3.18Å; A550-F553 WeakPolarHBondContact O-CB 3.46Å; A550-F553 WeakPolarHBondContact O-CD2 3.28Å; A550-F553 PolarHBondContact O-N 3.05Å
551	R	83.8	Confident	79.4	Confident	113 Å²	113	63.7 Å²	63.7	43%	0.426	37%	0.372	S	S	.	.	G	3₁₀ helix	trans	-60.1	-25.5	176.3	-64.1	-178.8	63.8	-172.2	0.3	113.6	L538 K548 Q549 F553 Q554	L538-R551 HydrophobicContact CD1-CB 4.45Å; L538-R551 WeakPolarHBondContact CD1-O 3.2Å; K548-R551 WeakPolarHBondContact O-CB 3.36Å; K548-R551 PolarHBondContact O-N 3.24Å; Q549-R551 PolarHBondContact O-N 3.25Å; Q549-R551 VanDerWaalsContact O-N 3.1Å; R551-F553 PolarHBondContact O-N 3.46Å; R551-Q554 PolarHBondContact O-N 3.36Å
552	V	85.2	Confident	79.8	Confident	5 Å²	5	63.3 Å²	63.3	3%	0.03	37%	0.372	C	S	.	.	G	3₁₀ helix	trans	-70.3	-15.9	177.2	-53	0	0	0	0	112.8	L538 L540 Q549 A550 V564 I576	L538-V552 HydrophobicContact CB-CG1 4.35Å; L538-V552 HydrophobicContact CD1-CG1 4.28Å; L540-V552 HydrophobicContact CB-CG1 4.29Å; L540-V552 HydrophobicContact CD1-CG1 4.15Å; L540-V552 HydrophobicContact CD1-CG2 4.32Å; L540-V552 HydrophobicContact CD2-CG1 4.49Å; L540-V552 HydrophobicContact CD2-CG2 4.3Å; Q549-V552 WeakPolarHBondContact O-CG2 3.28Å; Q549-V552 PolarHBondContact O-N 3.32Å; A550-V552 PolarHBondContact O-N 3.18Å; V552-V564 HydrophobicContact CG1-CG1 4.19Å; V552-I576 HydrophobicContact CG2-CG1 4.31Å
553	F	83.5	Confident	80.8	Confident	87 Å²	87	59.5 Å²	59.5	38%	0.382	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	-94.5	-12.9	175.8	-50.3	-66.1	0	0	0	113	A550 R551 V574 T575	A550-F553 WeakPolarHBondContact O-CB 3.46Å; A550-F553 WeakPolarHBondContact O-CD2 3.28Å; A550-F553 PolarHBondContact O-N 3.05Å; R551-F553 PolarHBondContact O-N 3.46Å; F553-V574 HydrophobicContact CE1-CG1 3.62Å; F553-V574 HydrophobicContact CZ-CG1 3.58Å; F553-T575 WeakPolarHBondContact CD1-O 3.44Å; F553-T575 WeakPolarHBondContact CE1-O 3.34Å
554	Q	83.8	Confident	81.9	Confident	123 Å²	123	56.6 Å²	56.6	58%	0.575	33%	0.33	S	S	*	.	S	Bend	trans	-75.5	147.3	176.8	-64.8	174.2	-5.4	0	0	110	R551	R551-Q554 PolarHBondContact O-N 3.36Å
555	E	82.7	Confident	83.1	Confident	174 Å²	174	56.1 Å²	56.1	81%	0.813	33%	0.328	S	S	*	.	P	Polyproline II helix	trans	-64.1	137.4	174.3	-65.6	-168.8	161.8	0	0	110.6
556	P	84.6	Confident	84.4	Confident	43 Å²	43	53.3 Å²	53.3	28%	0.279	31%	0.31	S	S	.	.	P	Polyproline II helix	trans	-64.9	153.3	175.8	29.2	-35.3	0	0	0	110.5	F536 C562	F536-P556 HydrophobicContact CD1-CB 4.17Å; P556-C562 HydrophobicContact CB-CB 4.04Å; P556-C562 HydrophobicContact CG-CB 4.05Å
557	P	86.1	Confident	85.7	Confident	50 Å²	50	49.8 Å²	49.8	33%	0.325	28%	0.284	S	S	.	.	P	Polyproline II helix	trans	-53.5	144.7	175.3	-24.3	33.3	0	0	0	112.1	F536 G559 Y560	F536-P557 HydrophobicContact CD2-CG 4.42Å; F536-P557 HydrophobicContact CE2-CG 4.41Å; P557-G559 PolarHBondContact O-N 3.22Å; P557-Y560 HydrophobicContact CB-CD2 3.78Å; P557-Y560 HydrophobicContact CB-CE2 4.21Å; P557-Y560 HydrophobicContact CB-CG 4.45Å; P557-Y560 WeakPolarHBondContact O-CB 3.2Å; P557-Y560 WeakPolarHBondContact O-CD2 3.39Å; P557-Y560 PolarHBondContact O-N 3.31Å
558	A	82.5	Confident	86.6	Confident	102 Å²	102	49.1 Å²	49.1	84%	0.843	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.5	132.6	-177.9	0	0	0	0	0	111.5	Y560	A558-Y560 VanDerWaalsContact C-N 3.35Å
559	G	83.2	Confident	86.9	Confident	42 Å²	42	44.5 Å²	44.5	43%	0.433	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	90.7	-18.9	-177.2	0	0	0	0	0	114.9	R437 P557	R437-G559 VanDerWaalsContact NH2-C 3.3Å; R437-G559 PolarHBondContact NH2-O 3.1Å; P557-G559 PolarHBondContact O-N 3.22Å
560	Y	87.4	Confident	87.4	Confident	24 Å²	24	43 Å²	43	9%	0.094	24%	0.243	C	C	.	.	P	Polyproline II helix	trans	-88.1	143.9	-178.7	-68.3	-105.7	0	0	0	112.6	L463 N464 A467 P534 F536 P557 A558	L463-Y560 HydrophobicContact CD2-CD1 3.94Å; L463-Y560 HydrophobicContact CD2-CE1 3.34Å; N464-Y560 PolarHBondContact N-OH 2.95Å; A467-Y560 HydrophobicContact CB-CE2 4.15Å; P534-Y560 HydrophobicContact CB-CD1 3.58Å; P534-Y560 HydrophobicContact CB-CE1 3.46Å; P534-Y560 VanDerWaalsContact CB-CE1 3.46Å; P534-Y560 HydrophobicContact CB-CG 4.21Å; P534-Y560 HydrophobicContact CG-CD1 3.98Å; P534-Y560 HydrophobicContact CG-CD2 4.3Å; P534-Y560 HydrophobicContact CG-CE1 4.08Å; P534-Y560 HydrophobicContact CG-CE2 4.4Å; P534-Y560 HydrophobicContact CG-CG 4.09Å; P534-Y560 WeakPolarHBondContact O-CA 3.48Å; F536-Y560 HydrophobicContact CB-CD1 4.05Å; F536-Y560 HydrophobicContact CB-CG 4.26Å; P557-Y560 HydrophobicContact CB-CD2 3.78Å; P557-Y560 HydrophobicContact CB-CE2 4.21Å; P557-Y560 HydrophobicContact CB-CG 4.45Å; P557-Y560 WeakPolarHBondContact O-CB 3.2Å; P557-Y560 WeakPolarHBondContact O-CD2 3.39Å; P557-Y560 PolarHBondContact O-N 3.31Å; A558-Y560 VanDerWaalsContact C-N 3.35Å
561	R	90.4	Very high	87.5	Confident	12 Å²	12	41.8 Å²	41.8	5%	0.045	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	135.8	163.5	-168	175.2	-58.4	-164.6	1.6	109	V431 H432 L435 P436 G438 E533 P534 L535 F536	V431-R561 PolarHBondContact O-NH1 3Å; H432-R561 WeakPolarHBondContact ND1-CD 3.37Å; H432-R561 PolarHBondContact O-NH1 2.71Å; L435-R561 PolarHBondContact O-NH1 3.23Å; L435-R561 PolarHBondContact O-NH2 2.87Å; L435-R561 VanDerWaalsContact O-NH2 3.09Å; P436-R561 PolarHBondContact O-NH1 2.99Å; G438-R561 WeakPolarHBondContact O-CD 3.41Å; G438-R561 WeakPolarHBondContact O-CG 3.48Å; E533-R561 IonicContact OE2-CZ 2.66Å; E533-R561 IonicContact OE2-NE 3.43Å; E533-R561 IonicContact OE2-NH2 3.33Å; E533-R561 PolarHBondContact OE2-NH2 3.45Å; P534-R561 PolarHBondContact O-N 3.36Å; L535-R561 HydrophobicContact CD1-CB 4.17Å; F536-R561 PolarHBondContact N-O 3.43Å
562	C	92.3	Very high	86.9	Confident	10 Å²	10	36.8 Å²	36.8	7%	0.068	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	136.3	177.4	-172.7	0	0	0	0	111.2	S439 I440 F536 P556	S439-C562 CarbonylContact C-O 3.53Å; S439-C562 VanDerWaalsContact CA-O 3.3Å; S439-C562 WeakPolarHBondContact CA-O 3.35Å; I440-C562 PolarHBondContact N-O 2.87Å; F536-C562 CarbonylContact O-C 3.46Å; F536-C562 WeakPolarHBondContact O-CA 3.32Å; P556-C562 HydrophobicContact CB-CB 4.04Å; P556-C562 HydrophobicContact CG-CB 4.05Å
563	C	94.6	Very high	85.9	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	112.7	170.7	177.7	0	0	0	0	110.2	I440 L535 F536 C537 L538	I440-C563 HydrophobicContact CB-CB 4.23Å; I440-C563 CarbonylContact O-C 3.54Å; I440-C563 VanDerWaalsContact O-CA 3.31Å; I440-C563 WeakPolarHBondContact O-CA 3.49Å; L535-C563 HydrophobicContact CD1-CB 3.75Å; L535-C563 HydrophobicContact CD2-CB 4.31Å; L535-C563 HydrophobicContact CG-CB 4.12Å; F536-C563 PolarHBondContact O-N 2.99Å; C537-C563 CarbonylContact C-O 3.35Å; C537-C563 VanDerWaalsContact CA-O 3.24Å; C537-C563 WeakPolarHBondContact CA-O 3.44Å; L538-C563 PolarHBondContact N-O 2.93Å
564	V	94.3	Very high	85.1	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	125	176.6	-174.6	0	0	0	0	109.4	I440 L441 V442 L538 L540 V552 A566 I576	I440-V564 PolarHBondContact O-N 2.61Å; L441-V564 CarbonylContact C-O 3.46Å; L441-V564 WeakPolarHBondContact CA-O 3.47Å; L441-V564 HydrophobicContact CD1-CB 4.06Å; L441-V564 HydrophobicContact CD1-CG1 4.16Å; V442-V564 PolarHBondContact N-O 3.18Å; L538-V564 CarbonylContact O-C 3.54Å; L538-V564 WeakPolarHBondContact O-CA 3.41Å; L540-V564 HydrophobicContact CB-CG1 3.82Å; L540-V564 HydrophobicContact CD2-CG1 4.26Å; V552-V564 HydrophobicContact CG1-CG1 4.19Å; V564-A566 HydrophobicContact CG1-CB 4.47Å; V564-I576 HydrophobicContact CB-CD1 4.14Å; V564-I576 HydrophobicContact CG1-CD1 3.85Å; V564-I576 HydrophobicContact CG2-CD1 4.31Å; V564-I576 HydrophobicContact CG2-CG2 4.15Å
565	I	95.6	Very high	84.6	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	110.8	176	-50.9	165.1	0	0	0	107.4	V444 V450 L453 L454 L457 L538 P539 L540	V444-I565 HydrophobicContact CG1-CG2 4.3Å; V444-I565 HydrophobicContact CG2-CG2 4.02Å; V450-I565 HydrophobicContact CB-CG2 4.24Å; V450-I565 HydrophobicContact CG1-CB 4.18Å; V450-I565 HydrophobicContact CG1-CG2 4.08Å; V450-I565 WeakPolarHBondContact CG1-O 3.48Å; V450-I565 HydrophobicContact CG2-CG2 4.22Å; L453-I565 HydrophobicContact CB-CD1 4.21Å; L453-I565 HydrophobicContact CB-CG2 4.47Å; L453-I565 HydrophobicContact CD2-CD1 4.27Å; L453-I565 HydrophobicContact CD2-CG1 4.34Å; L453-I565 HydrophobicContact CD2-CG2 3.91Å; L453-I565 HydrophobicContact CG-CD1 4Å; L454-I565 HydrophobicContact CB-CD1 3.86Å; L454-I565 HydrophobicContact CD1-CD1 4.11Å; L457-I565 HydrophobicContact CD1-CD1 3.86Å; L457-I565 HydrophobicContact CD1-CG1 4.46Å; L538-I565 PolarHBondContact O-N 2.88Å; P539-I565 CarbonylContact C-O 3.43Å; P539-I565 WeakPolarHBondContact CA-O 3.43Å; L540-I565 PolarHBondContact N-O 3.26Å
566	A	93.9	Very high	84.5	Confident	0 Å²	0	25.1 Å²	25.1	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	153	-167.5	0	0	0	0	0	113.6	L441 V442 F443 V444 L540 V564 A570	L441-A566 HydrophobicContact CD1-CB 3.81Å; V442-A566 PolarHBondContact O-N 2.78Å; F443-A566 CarbonylContact C-O 3.54Å; F443-A566 WeakPolarHBondContact CA-O 3.4Å; V444-A566 PolarHBondContact N-O 3Å; L540-A566 HydrophobicContact CB-CB 3.93Å; L540-A566 HydrophobicContact CD2-CB 4.25Å; L540-A566 HydrophobicContact CG-CB 4.39Å; L540-A566 WeakPolarHBondContact O-CA 3.42Å; V564-A566 HydrophobicContact CG1-CB 4.47Å; A566-A570 HydrophobicContact CB-CB 3.54Å
567	T	91.9	Very high	84.2	Confident	16 Å²	16	25.3 Å²	25.3	10%	0.098	17%	0.171	C	C	.	.			trans	-85.2	-170	160	63.2	0	0	0	0	110.6	V444 V450 L540 V569 A570	V444-T567 WeakPolarHBondContact O-CA 3.24Å; V450-T567 HydrophobicContact CG2-CG2 4.12Å; L540-T567 PolarHBondContact O-N 2.98Å; L540-T567 VanDerWaalsContact O-N 3.11Å; T567-V569 PolarHBondContact O-N 3.32Å; T567-A570 PolarHBondContact O-N 3.33Å; T567-A570 VanDerWaalsContact O-N 3.17Å
568	N	88.8	Confident	84.1	Confident	41 Å²	41	27.3 Å²	27.3	22%	0.219	18%	0.178	C	C	.	.	G	3₁₀ helix	trans	-54	-11.1	174.9	-61.7	23.5	0	0	0	114	A570 E571 E588 R615	N568-A570 PolarHBondContact O-N 3.37Å; N568-E571 WeakPolarHBondContact O-CA 3.29Å; N568-E571 WeakPolarHBondContact O-CB 3.36Å; N568-E571 PolarHBondContact O-N 3.29Å; N568-E588 WeakPolarHBondContact ND2-CB 3.29Å; N568-E588 PolarHBondContact ND2-OE2 3.47Å; N568-R615 PolarHBondContact ND2-NH2 3.18Å; N568-R615 PolarHBondContact OD1-NH2 3.04Å
569	V	83.8	Confident	84.4	Confident	22 Å²	22	23 Å²	23	13%	0.133	14%	0.142	C	C	.	.	G	3₁₀ helix	trans	-57.7	-32.3	173.5	176.5	0	0	0	0	112.9	T567 E571 T572 V574	T567-V569 PolarHBondContact O-N 3.32Å; V569-E571 VanDerWaalsContact C-N 3.26Å; V569-E571 PolarHBondContact O-N 3.02Å; V569-T572 VanDerWaalsContact O-O 3.09Å; V569-V574 HydrophobicContact CG1-CG2 4.39Å
570	A	86.9	Confident	84.8	Confident	0 Å²	0	25.1 Å²	25.1	0%	0	14%	0.137	C	C	.	.	G	3₁₀ helix	trans	-79.4	-8.4	174.9	0	0	0	0	0	113.5	L441 F443 L540 A566 T567 N568 I576 R618	L441-A570 HydrophobicContact CD1-CB 4.03Å; L441-A570 HydrophobicContact CD2-CB 4.16Å; F443-A570 HydrophobicContact CE1-CB 3.77Å; F443-A570 HydrophobicContact CZ-CB 3.96Å; L540-A570 HydrophobicContact CD2-CB 4.11Å; A566-A570 HydrophobicContact CB-CB 3.54Å; T567-A570 PolarHBondContact O-N 3.33Å; T567-A570 VanDerWaalsContact O-N 3.17Å; N568-A570 PolarHBondContact O-N 3.37Å; A570-I576 HydrophobicContact CB-CD1 4.27Å; A570-R618 WeakPolarHBondContact O-CD 3.32Å; A570-R618 PolarHBondContact O-NE 2.93Å
571	E	83.4	Confident	85.2	Confident	13 Å²	13	24 Å²	24	6%	0.061	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-32.5	-176.4	-173.8	174.8	143.1	0	0	112.9	F443 N568 V569 S611 Q614 R615 R618	F443-E571 HydrophobicContact CE1-CB 4.12Å; N568-E571 WeakPolarHBondContact O-CA 3.29Å; N568-E571 WeakPolarHBondContact O-CB 3.36Å; N568-E571 PolarHBondContact O-N 3.29Å; V569-E571 VanDerWaalsContact C-N 3.26Å; V569-E571 PolarHBondContact O-N 3.02Å; E571-S611 VanDerWaalsContact OE1-CA 3.25Å; E571-S611 WeakPolarHBondContact OE1-CA 3.41Å; E571-S611 WeakPolarHBondContact OE1-CB 3.45Å; E571-S611 PolarHBondContact OE1-OG 3.43Å; E571-Q614 HydrophobicContact CG-CB 4.12Å; E571-R615 HydrophobicContact CB-CG 4.43Å; E571-R615 HydrophobicContact CG-CG 3.96Å; E571-R615 IonicContact OE2-CZ 3.23Å; E571-R615 IonicContact OE2-NE 3.54Å; E571-R615 PolarHBondContact OE2-NE 3.38Å; E571-R615 IonicContact OE2-NH2 2.95Å; E571-R615 PolarHBondContact OE2-NH2 3.29Å; E571-R615 VanDerWaalsContact OE2-NH2 3.1Å; E571-R618 VanDerWaalsContact C-NH2 3.3Å; E571-R618 PolarHBondContact O-NE 3.18Å; E571-R618 PolarHBondContact O-NH2 3.44Å
572	T	71.2	Confident	85.5	Confident	9 Å²	9	23.5 Å²	23.5	6%	0.055	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-136	155	-179.6	59.9	0	0	0	0	111.4	R277 E346 V569 V574 Q614 R618	R277-T572 VanDerWaalsContact NH1-C 3.32Å; R277-T572 PolarHBondContact NH1-O 3.47Å; R277-T572 PolarHBondContact NH1-OG1 3.28Å; R277-T572 PolarHBondContact NH2-OG1 2.91Å; E346-T572 WeakPolarHBondContact OE1-CB 3.44Å; E346-T572 PolarHBondContact OE1-OG1 3.42Å; V569-T572 VanDerWaalsContact O-O 3.09Å; T572-V574 PolarHBondContact O-N 2.89Å; T572-Q614 VanDerWaalsContact CG2-OE1 3.29Å; T572-R618 VanDerWaalsContact CA-NH2 3.28Å
573	S	63.4	Low	85.7	Confident	40 Å²	40	23 Å²	23	28%	0.28	13%	0.127	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.7	-29	176.6	-21.7	0	0	0	0	119.8	R277	R277-S573 WeakPolarHBondContact CD-OG 3.39Å; R277-S573 PolarHBondContact NH1-OG 2.82Å
574	V	67.4	Low	85.8	Confident	20 Å²	20	23 Å²	23	12%	0.121	13%	0.127	C	C	.	.			trans	-96.1	119.9	-178.9	173.9	0	0	0	0	110.8	L540 F553 V569 T572 I576 R618	L540-V574 HydrophobicContact CD2-CG1 4.29Å; F553-V574 HydrophobicContact CE1-CG1 3.62Å; F553-V574 HydrophobicContact CZ-CG1 3.58Å; V569-V574 HydrophobicContact CG1-CG2 4.39Å; T572-V574 PolarHBondContact O-N 2.89Å; V574-I576 HydrophobicContact CG1-CG1 4.22Å; V574-R618 PolarHBondContact O-NH1 3.18Å
575	T	72.7	Confident	85.9	Confident	71 Å²	71	23.1 Å²	23.1	44%	0.436	13%	0.128	S	C	.	.			trans	-103.7	95.4	180	-45.3	0	0	0	0	109.9	F553 R621	F553-T575 WeakPolarHBondContact CD1-O 3.44Å; F553-T575 WeakPolarHBondContact CE1-O 3.34Å; T575-R621 PolarHBondContact OG1-NH1 3.36Å
576	I	80.2	Confident	85.9	Confident	12 Å²	12	23.1 Å²	23.1	6%	0.062	13%	0.128	C	C	.	.			trans	-75	124.8	175	-57.8	166.7	0	0	0	108.1	L441 L540 V552 V564 A570 V574 V579	L441-I576 HydrophobicContact CD1-CD1 3.71Å; L441-I576 HydrophobicContact CD2-CD1 4.35Å; L540-I576 HydrophobicContact CD2-CD1 3.9Å; L540-I576 HydrophobicContact CD2-CG1 4.46Å; V552-I576 HydrophobicContact CG2-CG1 4.31Å; V564-I576 HydrophobicContact CB-CD1 4.14Å; V564-I576 HydrophobicContact CG1-CD1 3.85Å; V564-I576 HydrophobicContact CG2-CD1 4.31Å; V564-I576 HydrophobicContact CG2-CG2 4.15Å; A570-I576 HydrophobicContact CB-CD1 4.27Å; V574-I576 HydrophobicContact CG1-CG1 4.22Å; I576-V579 HydrophobicContact CB-CG2 3.64Å; I576-V579 HydrophobicContact CG2-CG2 3.55Å
577	P	78.5	Confident	85.9	Confident	48 Å²	48	24.6 Å²	24.6	31%	0.312	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	150.8	-179.8	27.6	-33.8	0	0	0	111.6	V579	P577-V579 PolarHBondContact O-N 2.71Å; P577-V579 VanDerWaalsContact O-N 3.09Å
578	N	83.3	Confident	85.9	Confident	91 Å²	91	24.4 Å²	24.4	49%	0.487	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.1	20	173.5	-64.5	-24.7	0	0	0	116.6	S439 R580 L622	S439-N578 WeakPolarHBondContact CB-O 3.5Å; S439-N578 PolarHBondContact N-O 3.24Å; S439-N578 PolarHBondContact OG-O 2.84Å; N578-R580 PolarHBondContact O-N 3.06Å; N578-L622 WeakPolarHBondContact OD1-CD1 3.29Å
579	V	89.4	Confident	85.8	Confident	12 Å²	12	25 Å²	25	7%	0.073	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	119	171.2	179.7	0	0	0	0	109.7	L441 I576 P577 V582 A619	L441-V579 HydrophobicContact CB-CG1 3.66Å; L441-V579 HydrophobicContact CB-CG2 4.31Å; L441-V579 HydrophobicContact CD2-CG1 4.36Å; I576-V579 HydrophobicContact CB-CG2 3.64Å; I576-V579 HydrophobicContact CG2-CG2 3.55Å; P577-V579 PolarHBondContact O-N 2.71Å; P577-V579 VanDerWaalsContact O-N 3.09Å; V579-V582 HydrophobicContact CG1-CG2 4.07Å; V579-A619 CarbonylContact O-C 3.59Å; V579-A619 VanDerWaalsContact O-O 3.07Å
580	R	92	Very high	85.8	Confident	87 Å²	87	25.6 Å²	25.6	33%	0.328	14%	0.136	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	-28	177.1	-172.6	176	-177.8	-179.8	0.2	112.4	R437 S439 N578 G625 H626	R437-R580 PolarHBondContact O-NH1 3.36Å; S439-R580 PolarHBondContact O-N 3.4Å; N578-R580 PolarHBondContact O-N 3.06Å; R580-G625 CarbonylContact O-C 3.56Å; R580-G625 WeakPolarHBondContact O-CA 3.47Å; R580-H626 PolarHBondContact O-N 2.99Å
581	Y	95.6	Very high	85.5	Confident	1 Å²	1	28.9 Å²	28.9	0%	0.004	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	121.6	-177.9	-52.4	-74.4	0	0	0	109.8	V431 L435 P436 S439 I440 L441 H626 Y628	V431-Y581 HydrophobicContact CG1-CD1 4.1Å; V431-Y581 HydrophobicContact CG1-CD2 3.89Å; V431-Y581 HydrophobicContact CG1-CE2 4.47Å; V431-Y581 HydrophobicContact CG1-CG 3.68Å; L435-Y581 HydrophobicContact CB-CE1 3.9Å; L435-Y581 HydrophobicContact CD1-CD1 3.88Å; L435-Y581 HydrophobicContact CD1-CE1 3.58Å; L435-Y581 HydrophobicContact CG-CE1 4.37Å; P436-Y581 WeakPolarHBondContact CD-OH 3.08Å; P436-Y581 VanDerWaalsContact O-CE2 3.24Å; P436-Y581 WeakPolarHBondContact O-CE2 3.47Å; P436-Y581 PolarHBondContact O-OH 3.44Å; S439-Y581 PolarHBondContact O-N 3.12Å; S439-Y581 VanDerWaalsContact O-N 3.14Å; I440-Y581 CarbonylContact C-O 3.59Å; I440-Y581 WeakPolarHBondContact CA-O 3.46Å; I440-Y581 HydrophobicContact CG1-CD2 4.26Å; L441-Y581 PolarHBondContact N-O 2.87Å; Y581-H626 CarbonylContact C-O 3.52Å; Y581-H626 WeakPolarHBondContact CA-O 3.44Å; Y581-H626 HydrophobicContact CD1-CB 4.04Å; Y581-H626 HydrophobicContact CE1-CB 4.49Å; Y581-H626 AromaticContact CE1-CD2 3.7Å; Y581-Y628 HydrophobicContact CD1-CE2 4.22Å
582	V	95.7	Very high	85.2	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	133.7	170.8	168.9	0	0	0	0	108.9	L441 F443 V579 R618 A619 H626 C627 Y628	L441-V582 HydrophobicContact CB-CG2 4.25Å; L441-V582 HydrophobicContact CD2-CG2 4.36Å; L441-V582 CarbonylContact O-C 3.57Å; L441-V582 VanDerWaalsContact O-CA 3.31Å; L441-V582 WeakPolarHBondContact O-CA 3.4Å; F443-V582 HydrophobicContact CD2-CG1 3.92Å; F443-V582 HydrophobicContact CE2-CG1 3.9Å; V579-V582 HydrophobicContact CG1-CG2 4.07Å; V582-R618 HydrophobicContact CG2-CB 4.1Å; V582-A619 HydrophobicContact CB-CB 4.39Å; V582-A619 HydrophobicContact CG2-CB 3.78Å; V582-H626 PolarHBondContact N-O 3.28Å; V582-C627 HydrophobicContact CB-CB 4.36Å; V582-C627 CarbonylContact O-C 3.55Å; V582-C627 WeakPolarHBondContact O-CA 3.48Å; V582-Y628 PolarHBondContact O-N 3.49Å
583	I	97.2	Very high	85.5	Confident	0 Å²	0	33 Å²	33	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	112.3	171.4	-63.3	172	0	0	0	106.9	K427 V428 V431 I440 L441 V442 F443 Y628 L630	K427-I583 HydrophobicContact CB-CD1 4.12Å; K427-I583 HydrophobicContact CB-CG2 4.28Å; K427-I583 HydrophobicContact CG-CD1 3.85Å; K427-I583 HydrophobicContact CG-CG1 3.99Å; K427-I583 HydrophobicContact CG-CG2 4.2Å; V428-I583 HydrophobicContact CB-CD1 4.2Å; V428-I583 HydrophobicContact CG2-CD1 3.49Å; V428-I583 VanDerWaalsContact CG2-CD1 3.49Å; V431-I583 HydrophobicContact CG2-CD1 4.37Å; I440-I583 HydrophobicContact CG2-CD1 3.84Å; I440-I583 HydrophobicContact CG2-CG1 4.38Å; L441-I583 PolarHBondContact O-N 2.91Å; V442-I583 WeakPolarHBondContact CA-O 3.26Å; V442-I583 HydrophobicContact CG1-CB 4.24Å; V442-I583 HydrophobicContact CG1-CG2 4.19Å; V442-I583 HydrophobicContact CG2-CB 4.29Å; V442-I583 HydrophobicContact CG2-CD1 4.29Å; F443-I583 PolarHBondContact N-O 3.17Å; I583-Y628 HydrophobicContact CG1-CD2 4.49Å; I583-L630 HydrophobicContact CG2-CD1 3.82Å; I583-L630 HydrophobicContact CG2-CD2 4.13Å; I583-L630 HydrophobicContact CG2-CG 4.06Å
584	D	97	Very high	85.9	Confident	0 Å²	0	34 Å²	34	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	113.8	-175.7	-178.7	25.3	0	0	0	110.7	G586 I607 R615 Y628 L630 Y631	D584-G586 PolarHBondContact O-N 2.84Å; D584-G586 PolarHBondContact OD1-N 2.91Å; D584-I607 WeakPolarHBondContact OD2-CD1 3.39Å; D584-R615 WeakPolarHBondContact OD1-CD 3.46Å; D584-R615 IonicContact OD1-CZ 2.88Å; D584-R615 IonicContact OD1-NH1 3.66Å; D584-R615 PolarHBondContact OD1-NH1 3.46Å; D584-R615 VanDerWaalsContact OD1-NH1 3.08Å; D584-Y628 PolarHBondContact N-O 3.38Å; D584-L630 WeakPolarHBondContact O-CG 3.34Å; D584-L630 PolarHBondContact O-N 3.08Å; D584-Y631 HydrophobicContact CB-CE1 4.44Å; D584-Y631 WeakPolarHBondContact OD2-CE1 3.3Å; D584-Y631 PolarHBondContact OD2-OH 3.21Å
585	T	96.2	Very high	86	Confident	2 Å²	2	35.3 Å²	35.3	1%	0.012	18%	0.179	C	C	.	.			trans	-69.4	-18.8	174.2	55.9	0	0	0	0	112.6	Y420 A424 F443 V444 K587 L630	Y420-T585 HydrophobicContact CD2-CG2 3.71Å; Y420-T585 HydrophobicContact CG-CG2 4.34Å; A424-T585 HydrophobicContact CB-CG2 4.18Å; F443-T585 WeakPolarHBondContact O-CB 3.49Å; F443-T585 WeakPolarHBondContact O-CG2 3.47Å; F443-T585 PolarHBondContact O-OG1 3.04Å; V444-T585 HydrophobicContact CG1-CG2 4.36Å; T585-K587 PolarHBondContact O-N 3.3Å; T585-L630 HydrophobicContact CG2-CD1 3.91Å
586	G	95.1	Very high	85.8	Confident	0 Å²	0	38 Å²	38	0%	0	20%	0.195	C	C	.	.			trans	75.6	6	-176	0	0	0	0	0	113.7	D584 W606 I607	D584-G586 PolarHBondContact O-N 2.84Å; D584-G586 PolarHBondContact OD1-N 2.91Å; G586-W606 WeakPolarHBondContact O-CA 3.3Å; G586-I607 PolarHBondContact O-N 3.34Å
587	K	94.3	Very high	85.1	Confident	32 Å²	32	39.4 Å²	39.4	14%	0.139	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	149.5	-177.3	-63.6	-60.5	-171.9	175.9	0	111.5	Y420 T585 V604 Q605 W606 R615	Y420-K587 HydrophobicContact CD1-CG 3.98Å; Y420-K587 HydrophobicContact CE1-CG 3.95Å; Y420-K587 HydrophobicContact CG-CG 4.4Å; T585-K587 PolarHBondContact O-N 3.3Å; K587-V604 HydrophobicContact CB-CG1 3.98Å; K587-V604 HydrophobicContact CD-CG1 4.28Å; K587-V604 HydrophobicContact CG-CG1 4.36Å; K587-Q605 WeakPolarHBondContact CA-O 3.47Å; K587-Q605 WeakPolarHBondContact CD-O 3.03Å; K587-W606 HydrophobicContact CD-CD2 4.15Å; K587-W606 HydrophobicContact CD-CE3 3.82Å; K587-W606 HydrophobicContact CD-CH2 4.47Å; K587-W606 HydrophobicContact CD-CZ3 4Å; K587-W606 HydrophobicContact CG-CZ3 4.46Å; K587-R615 PolarHBondContact O-NH1 3.48Å; K587-R615 VanDerWaalsContact O-NH1 3.16Å
588	E	91.9	Very high	84.4	Confident	12 Å²	12	39 Å²	39	6%	0.056	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	156.4	170.8	60.5	178.5	-173.7	0	0	110	N568 V590 V604 Q605 I607	N568-E588 WeakPolarHBondContact ND2-CB 3.29Å; N568-E588 PolarHBondContact ND2-OE2 3.47Å; E588-V590 HydrophobicContact CG-CG1 3.96Å; E588-V604 CarbonylContact O-C 3.48Å; E588-V604 VanDerWaalsContact O-CA 3.29Å; E588-V604 WeakPolarHBondContact O-CA 3.27Å; E588-Q605 HydrophobicContact CG-CG 4.13Å; E588-Q605 PolarHBondContact N-O 3.15Å; E588-Q605 VanDerWaalsContact N-O 3.16Å; E588-Q605 PolarHBondContact O-N 2.98Å; E588-Q605 PolarHBondContact OE1-NE2 3.48Å; E588-I607 HydrophobicContact CB-CG2 3.73Å; E588-I607 HydrophobicContact CG-CG2 3.63Å
589	K	87.1	Confident	83.6	Confident	54 Å²	54	36.2 Å²	36.2	24%	0.235	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	115	174.1	-172.3	179.9	179.1	-170.6	0	108.7	S445 D507 F602 V604	S445-K589 VanDerWaalsContact O-CB 3.32Å; S445-K589 WeakPolarHBondContact O-CB 3.27Å; D507-K589 PolarHBondContact O-NZ 3.42Å; K589-F602 HydrophobicContact CG-CB 4.47Å; K589-F602 HydrophobicContact CG-CD1 4.42Å; K589-V604 HydrophobicContact CB-CG2 4.36Å; K589-V604 HydrophobicContact CG-CG2 4.37Å
590	V	84.2	Confident	82.5	Confident	33 Å²	33	36.9 Å²	36.9	20%	0.2	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	157.3	178.3	-60.3	0	0	0	0	110.7	E588 L592 F602 V603 Q605	E588-V590 HydrophobicContact CG-CG1 3.96Å; V590-L592 HydrophobicContact CG2-CD2 3.96Å; V590-L592 HydrophobicContact CG2-CG 4.31Å; V590-F602 WeakPolarHBondContact O-CA 3.44Å; V590-V603 PolarHBondContact N-O 3.04Å; V590-V603 PolarHBondContact O-N 2.8Å; V590-Q605 HydrophobicContact CG1-CG 4.3Å; V590-Q605 HydrophobicContact CG2-CG 3.81Å
591	R	78.9	Confident	81.5	Confident	70 Å²	70	36.6 Å²	36.6	26%	0.264	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	121.2	169.6	-168.7	-178.5	-170.3	-176.5	2.2	107.9	S600 F602	R591-S600 PolarHBondContact NE-OG 3.49Å; R591-S600 PolarHBondContact NH2-OG 2.92Å; R591-F602 HydrophobicContact CB-CD1 4.09Å; R591-F602 HydrophobicContact CB-CE1 3.84Å; R591-F602 HydrophobicContact CB-CZ 4.42Å; R591-F602 HydrophobicContact CG-CD1 4.48Å; R591-F602 HydrophobicContact CG-CE1 4.14Å; R591-F602 HydrophobicContact CG-CZ 4.25Å
592	L	79	Confident	80.5	Confident	72 Å²	72	40.1 Å²	40.1	38%	0.377	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	124	171.8	-59	-179.3	0	0	0	107.8	V590 S600 K601 V603	V590-L592 HydrophobicContact CG2-CD2 3.96Å; V590-L592 HydrophobicContact CG2-CG 4.31Å; L592-S600 CarbonylContact O-C 3.52Å; L592-S600 WeakPolarHBondContact O-CA 3.43Å; L592-K601 PolarHBondContact N-O 2.93Å; L592-K601 PolarHBondContact O-N 2.98Å; L592-V603 HydrophobicContact CD1-CB 4.06Å; L592-V603 HydrophobicContact CD1-CG2 3.77Å; L592-V603 HydrophobicContact CG-CG2 4.37Å
593	Y	76.4	Confident	79.9	Confident	35 Å²	35	42.3 Å²	42.3	14%	0.137	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	130.8	169.7	179.5	-112	0	0	0	109.1	P595 G598 T649 P651	Y593-P595 HydrophobicContact CE1-CB 4.24Å; Y593-G598 VanDerWaalsContact CE2-C 3.47Å; Y593-G598 WeakPolarHBondContact CE2-O 3.45Å; Y593-T649 WeakPolarHBondContact CB-O 3.37Å; Y593-T649 PolarHBondContact N-O 3.46Å; Y593-P651 HydrophobicContact CD1-CG 4.43Å; Y593-P651 HydrophobicContact CD2-CG 3.86Å; Y593-P651 HydrophobicContact CE1-CB 4.11Å; Y593-P651 HydrophobicContact CE1-CG 4.24Å; Y593-P651 HydrophobicContact CE2-CB 4.16Å; Y593-P651 HydrophobicContact CE2-CG 3.63Å; Y593-P651 HydrophobicContact CG-CG 4.25Å
594	D	72.6	Confident	79.5	Confident	63 Å²	63	45.3 Å²	45.3	34%	0.337	25%	0.247	S	C	.	.			trans	-93.9	113.2	169.3	176.9	-0.1	0	0	0	108.7	V596 T597 G598 I599	D594-V596 PolarHBondContact O-N 3.09Å; D594-V596 PolarHBondContact OD1-N 2.91Å; D594-T597 WeakPolarHBondContact CB-OG1 3.43Å; D594-T597 WeakPolarHBondContact OD2-CB 3.49Å; D594-T597 WeakPolarHBondContact OD2-CG2 3.12Å; D594-T597 PolarHBondContact OD2-OG1 3.43Å; D594-G598 VanDerWaalsContact O-CA 3.27Å; D594-G598 WeakPolarHBondContact O-CA 3.27Å; D594-G598 PolarHBondContact O-N 3Å; D594-I599 PolarHBondContact N-O 3.33Å
595	P	68.9	Low	79.2	Confident	46 Å²	46	48.5 Å²	48.5	30%	0.299	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-22.6	-176.9	27.6	-34.7	0	0	0	113.6	Y593	Y593-P595 HydrophobicContact CE1-CB 4.24Å
596	V	67.3	Low	79.1	Confident	129 Å²	129	52.9 Å²	52.9	78%	0.782	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.9	-53.5	-179.1	-178.6	0	0	0	0	110.3	D594	D594-V596 PolarHBondContact O-N 3.09Å; D594-V596 PolarHBondContact OD1-N 2.91Å
597	T	65.7	Low	79.1	Confident	41 Å²	41	53 Å²	53	25%	0.252	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-15.4	-178.5	62.8	0	0	0	0	113.2	D594 I599	D594-T597 WeakPolarHBondContact CB-OG1 3.43Å; D594-T597 WeakPolarHBondContact OD2-CB 3.49Å; D594-T597 WeakPolarHBondContact OD2-CG2 3.12Å; D594-T597 PolarHBondContact OD2-OG1 3.43Å; T597-I599 PolarHBondContact O-N 3.41Å
598	G	65	Low	79	Confident	40 Å²	40	51.7 Å²	51.7	41%	0.412	27%	0.274	S	S	.	.			trans	68.3	11.2	-174.5	0	0	0	0	0	113.8	Y593 D594	Y593-G598 VanDerWaalsContact CE2-C 3.47Å; Y593-G598 WeakPolarHBondContact CE2-O 3.45Å; D594-G598 VanDerWaalsContact O-CA 3.27Å; D594-G598 WeakPolarHBondContact O-CA 3.27Å; D594-G598 PolarHBondContact O-N 3Å
599	I	66.1	Low	79	Confident	32 Å²	32	53.9 Å²	53.9	16%	0.164	28%	0.283	C	S	.	.			trans	-89.7	133.7	-177.5	-56.7	174.4	0	0	0	109.3	D594 T597 V899 I924	D594-I599 PolarHBondContact N-O 3.33Å; T597-I599 PolarHBondContact O-N 3.41Å; I599-V899 HydrophobicContact CD1-CG1 4.04Å; I599-V899 HydrophobicContact CD1-CG2 3.69Å; I599-V899 HydrophobicContact CG1-CG2 4.04Å; I599-I924 HydrophobicContact CD1-CD1 4.25Å; I599-I924 HydrophobicContact CG1-CD1 4.37Å
600	S	67.2	Low	79	Confident	26 Å²	26	52.2 Å²	52.2	18%	0.182	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	127.5	168	72.3	0	0	0	0	111.7	R591 L592	R591-S600 PolarHBondContact NE-OG 3.49Å; R591-S600 PolarHBondContact NH2-OG 2.92Å; L592-S600 CarbonylContact O-C 3.52Å; L592-S600 WeakPolarHBondContact O-CA 3.43Å
601	K	70.4	Confident	79.3	Confident	80 Å²	80	51 Å²	51	35%	0.348	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	137.8	175.8	-178.6	169.2	-178.2	161.1	0	110.8	D510 L592 V603 D926	D510-K601 WeakPolarHBondContact OD2-CE 3.48Å; D510-K601 IonicContact OD2-NZ 3.53Å; D510-K601 PolarHBondContact OD2-NZ 3.2Å; L592-K601 PolarHBondContact N-O 2.93Å; L592-K601 PolarHBondContact O-N 2.98Å; K601-V603 HydrophobicContact CD-CG2 4.25Å; K601-V603 HydrophobicContact CG-CG2 3.99Å; K601-D926 IonicContact NZ-OD2 2.57Å; K601-D926 PolarHBondContact NZ-OD2 2.68Å; K601-D926 VanDerWaalsContact NZ-OD2 3.1Å
602	F	74.4	Confident	80	Confident	75 Å²	75	47.7 Å²	47.7	33%	0.329	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	129.4	168.8	-71.7	-81.2	0	0	0	110.7	K589 V590 R591	K589-F602 HydrophobicContact CG-CB 4.47Å; K589-F602 HydrophobicContact CG-CD1 4.42Å; V590-F602 WeakPolarHBondContact O-CA 3.44Å; R591-F602 HydrophobicContact CB-CD1 4.09Å; R591-F602 HydrophobicContact CB-CE1 3.84Å; R591-F602 HydrophobicContact CB-CZ 4.42Å; R591-F602 HydrophobicContact CG-CD1 4.48Å; R591-F602 HydrophobicContact CG-CE1 4.14Å; R591-F602 HydrophobicContact CG-CZ 4.25Å
603	V	82.5	Confident	80.4	Confident	47 Å²	47	46.7 Å²	46.7	29%	0.285	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	137	179.2	-178.6	0	0	0	0	109.6	V590 L592 K601	V590-V603 PolarHBondContact N-O 3.04Å; V590-V603 PolarHBondContact O-N 2.8Å; L592-V603 HydrophobicContact CD1-CB 4.06Å; L592-V603 HydrophobicContact CD1-CG2 3.77Å; L592-V603 HydrophobicContact CG-CG2 4.37Å; K601-V603 HydrophobicContact CD-CG2 4.25Å; K601-V603 HydrophobicContact CG-CG2 3.99Å
604	V	88.3	Confident	80.9	Confident	62 Å²	62	46 Å²	46	38%	0.376	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	116	168.7	179.9	0	0	0	0	108.6	K587 E588 K589	K587-V604 HydrophobicContact CB-CG1 3.98Å; K587-V604 HydrophobicContact CD-CG1 4.28Å; K587-V604 HydrophobicContact CG-CG1 4.36Å; E588-V604 CarbonylContact O-C 3.48Å; E588-V604 VanDerWaalsContact O-CA 3.29Å; E588-V604 WeakPolarHBondContact O-CA 3.27Å; K589-V604 HydrophobicContact CB-CG2 4.36Å; K589-V604 HydrophobicContact CG-CG2 4.37Å
605	Q	90.7	Very high	81.8	Confident	68 Å²	68	43 Å²	43	32%	0.318	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	176.6	-176.7	69.2	176.2	29.5	0	0	112	K587 E588 V590	K587-Q605 WeakPolarHBondContact CA-O 3.47Å; K587-Q605 WeakPolarHBondContact CD-O 3.03Å; E588-Q605 HydrophobicContact CG-CG 4.13Å; E588-Q605 PolarHBondContact N-O 3.15Å; E588-Q605 VanDerWaalsContact N-O 3.16Å; E588-Q605 PolarHBondContact O-N 2.98Å; E588-Q605 PolarHBondContact OE1-NE2 3.48Å; V590-Q605 HydrophobicContact CG1-CG 4.3Å; V590-Q605 HydrophobicContact CG2-CG 3.81Å
606	W	95.3	Very high	82.8	Confident	93 Å²	93	41.1 Å²	41.1	35%	0.352	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	140.8	169.2	-69.2	116.6	0	0	0	110.3	T416 G586 K587 Y631 V635 F639	T416-W606 HydrophobicContact CG2-CH2 3.56Å; T416-W606 HydrophobicContact CG2-CZ2 4.08Å; G586-W606 WeakPolarHBondContact O-CA 3.3Å; K587-W606 HydrophobicContact CD-CD2 4.15Å; K587-W606 HydrophobicContact CD-CE3 3.82Å; K587-W606 HydrophobicContact CD-CH2 4.47Å; K587-W606 HydrophobicContact CD-CZ3 4Å; K587-W606 HydrophobicContact CG-CZ3 4.46Å; W606-Y631 HydrophobicContact CZ3-CD1 4.3Å; W606-Y631 HydrophobicContact CZ3-CG 4.29Å; W606-V635 HydrophobicContact CD2-CG1 4.2Å; W606-V635 HydrophobicContact CE3-CG1 4.32Å; W606-V635 HydrophobicContact CH2-CG1 3.87Å; W606-V635 HydrophobicContact CZ2-CG1 3.68Å; W606-V635 HydrophobicContact CZ3-CG1 4.17Å; W606-F639 HydrophobicContact CB-CD1 3.86Å; W606-F639 HydrophobicContact CB-CE1 3.61Å; W606-F639 HydrophobicContact CB-CZ 4.15Å; W606-F639 HydrophobicContact CD2-CD1 4.39Å; W606-F639 AromaticContact CD2-CE1 3.39Å; W606-F639 HydrophobicContact CD2-CE1 3.39Å; W606-F639 AromaticContact CD2-CZ 3.82Å; W606-F639 HydrophobicContact CD2-CZ 3.82Å; W606-F639 AromaticContact CE3-CE1 3.36Å; W606-F639 HydrophobicContact CE3-CE1 3.36Å; W606-F639 HydrophobicContact CE3-CE2 4.42Å; W606-F639 AromaticContact CE3-CZ 3.25Å; W606-F639 HydrophobicContact CE3-CZ 3.25Å; W606-F639 HydrophobicContact CG-CD1 4.11Å; W606-F639 AromaticContact CG-CE1 3.53Å; W606-F639 HydrophobicContact CG-CE1 3.53Å; W606-F639 HydrophobicContact CG-CZ 4.22Å; W606-F639 HydrophobicContact CZ3-CE1 4.2Å; W606-F639 AromaticContact CZ3-CZ 3.92Å; W606-F639 HydrophobicContact CZ3-CZ 3.92Å
607	I	94.8	Very high	83.7	Confident	3 Å²	3	35.3 Å²	35.3	2%	0.015	20%	0.196	C	C	.	.	P	Polyproline II helix	trans	-70.1	163.5	173.2	63.3	179	0	0	0	111.3	D584 G586 E588 A612 F639	D584-I607 WeakPolarHBondContact OD2-CD1 3.39Å; G586-I607 PolarHBondContact O-N 3.34Å; E588-I607 HydrophobicContact CB-CG2 3.73Å; E588-I607 HydrophobicContact CG-CG2 3.63Å; I607-A612 HydrophobicContact CD1-CB 3.69Å; I607-A612 HydrophobicContact CG1-CB 4.27Å; I607-F639 HydrophobicContact CG1-CD2 4.15Å; I607-F639 HydrophobicContact CG1-CE2 3.73Å; I607-F639 WeakPolarHBondContact O-CD2 3.26Å; I607-F639 VanDerWaalsContact O-CG 3.31Å; I607-F639 WeakPolarHBondContact O-CG 3.22Å
608	S	92.7	Very high	84.7	Confident	5 Å²	5	33.8 Å²	33.8	4%	0.035	19%	0.185	C	C	.	.	P	Polyproline II helix	trans	-74.2	161.3	170.7	72.1	0	0	0	0	112.4	A610 S611 A612 E640 S643	S608-A610 PolarHBondContact O-N 3.04Å; S608-S611 PolarHBondContact O-N 3.49Å; S608-S611 PolarHBondContact OG-N 3.39Å; S608-S611 VanDerWaalsContact OG-N 3.1Å; S608-S611 PolarHBondContact OG-OG 3.08Å; S608-A612 PolarHBondContact O-N 3.11Å; S608-E640 CarbonylContact C-O 3.53Å; S608-E640 VanDerWaalsContact CA-O 3.31Å; S608-E640 WeakPolarHBondContact CA-O 3.11Å; S608-E640 WeakPolarHBondContact CB-O 3.46Å; S608-S643 VanDerWaalsContact CB-N 3.35Å; S608-S643 WeakPolarHBondContact CB-OG 3.44Å; S608-S643 PolarHBondContact OG-N 3.35Å; S608-S643 PolarHBondContact OG-OG 3.1Å
609	K	92.3	Very high	85.8	Confident	58 Å²	58	31.9 Å²	31.9	25%	0.252	17%	0.166	S	C	.	.	H	α-helix	trans	-59.2	-37	172.3	-67.8	-178.6	176.4	163	0	111.6	A612 S613 Y636 N637 F639 E640	K609-A612 PolarHBondContact O-N 3.07Å; K609-S613 PolarHBondContact O-N 2.96Å; K609-S613 PolarHBondContact O-OG 3.5Å; K609-Y636 HydrophobicContact CB-CE2 4.17Å; K609-Y636 WeakPolarHBondContact CE-O 3.49Å; K609-Y636 HydrophobicContact CG-CD2 4.46Å; K609-Y636 HydrophobicContact CG-CE2 3.88Å; K609-N637 WeakPolarHBondContact CE-O 3.48Å; K609-N637 PolarHBondContact NZ-O 3.25Å; K609-F639 VanDerWaalsContact CE-O 3.27Å; K609-F639 WeakPolarHBondContact CE-O 3.25Å; K609-F639 HydrophobicContact CG-CB 3.78Å; K609-E640 PolarHBondContact N-O 2.89Å
610	A	87.2	Confident	86.3	Confident	19 Å²	19	30.6 Å²	30.6	16%	0.157	16%	0.16	C	C	.	.	H	α-helix	trans	-62.8	-49.3	175.5	0	0	0	0	0	112	S608 A612 S613 Q614 K641 Y642	S608-A610 PolarHBondContact O-N 3.04Å; A610-A612 VanDerWaalsContact C-N 3.33Å; A610-A612 PolarHBondContact O-N 3.37Å; A610-S613 WeakPolarHBondContact O-CB 3.17Å; A610-S613 PolarHBondContact O-N 3.28Å; A610-S613 VanDerWaalsContact O-N 3.08Å; A610-Q614 WeakPolarHBondContact O-CG 3.47Å; A610-Q614 PolarHBondContact O-N 3.21Å; A610-K641 PolarHBondContact N-O 2.92Å; A610-K641 VanDerWaalsContact N-O 3.13Å; A610-Y642 HydrophobicContact CB-CD1 3.81Å; A610-Y642 HydrophobicContact CB-CE1 4.36Å
611	S	90.1	Very high	86.6	Confident	8 Å²	8	31 Å²	31	6%	0.056	16%	0.158	C	C	.	.	H	α-helix	trans	-57.9	-44.2	174.8	-71.3	0	0	0	0	112	E571 S608 S613 Q614 R615	E571-S611 VanDerWaalsContact OE1-CA 3.25Å; E571-S611 WeakPolarHBondContact OE1-CA 3.41Å; E571-S611 WeakPolarHBondContact OE1-CB 3.45Å; E571-S611 PolarHBondContact OE1-OG 3.43Å; S608-S611 PolarHBondContact O-N 3.49Å; S608-S611 PolarHBondContact OG-N 3.39Å; S608-S611 VanDerWaalsContact OG-N 3.1Å; S608-S611 PolarHBondContact OG-OG 3.08Å; S611-S613 VanDerWaalsContact C-N 3.27Å; S611-S613 PolarHBondContact O-N 2.94Å; S611-Q614 PolarHBondContact O-N 3.27Å; S611-R615 WeakPolarHBondContact O-CB 3.45Å; S611-R615 VanDerWaalsContact O-CG 3.3Å; S611-R615 WeakPolarHBondContact O-CG 3.43Å; S611-R615 PolarHBondContact O-N 3.47Å
612	A	92.4	Very high	86.8	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-60.7	-34.3	175.9	0	0	0	0	0	113.3	I607 S608 K609 A610 A616 R629 Y636	I607-A612 HydrophobicContact CD1-CB 3.69Å; I607-A612 HydrophobicContact CG1-CB 4.27Å; S608-A612 PolarHBondContact O-N 3.11Å; K609-A612 PolarHBondContact O-N 3.07Å; A610-A612 VanDerWaalsContact C-N 3.33Å; A610-A612 PolarHBondContact O-N 3.37Å; A612-A616 WeakPolarHBondContact O-CB 3.22Å; A612-A616 PolarHBondContact O-N 3.49Å; A612-R629 PolarHBondContact O-NH2 3.19Å; A612-Y636 HydrophobicContact CB-CD2 4.49Å; A612-Y636 HydrophobicContact CB-CE2 3.83Å
613	S	88.8	Confident	87.1	Confident	50 Å²	50	29.7 Å²	29.7	35%	0.35	16%	0.163	S	C	.	.	H	α-helix	trans	-74.5	-38.9	175.9	-68.3	0	0	0	0	112.1	K609 A610 S611 A616 G617	K609-S613 PolarHBondContact O-N 2.96Å; K609-S613 PolarHBondContact O-OG 3.5Å; A610-S613 WeakPolarHBondContact O-CB 3.17Å; A610-S613 PolarHBondContact O-N 3.28Å; A610-S613 VanDerWaalsContact O-N 3.08Å; S611-S613 VanDerWaalsContact C-N 3.27Å; S611-S613 PolarHBondContact O-N 2.94Å; S613-A616 PolarHBondContact O-N 2.9Å; S613-G617 PolarHBondContact O-N 3.08Å
614	Q	86.7	Confident	87.4	Confident	21 Å²	21	31 Å²	31	10%	0.098	17%	0.172	C	C	.	.	H	α-helix	trans	-65.2	-45.5	174.8	-70.7	-169.9	3.5	0	0	112.1	H345 E571 T572 A610 S611 A616 G617 R618	H345-Q614 PolarHBondContact CD2-NE2 3.23Å; H345-Q614 PolarHBondContact NE2-NE2 3.38Å; E571-Q614 HydrophobicContact CG-CB 4.12Å; T572-Q614 VanDerWaalsContact CG2-OE1 3.29Å; A610-Q614 WeakPolarHBondContact O-CG 3.47Å; A610-Q614 PolarHBondContact O-N 3.21Å; S611-Q614 PolarHBondContact O-N 3.27Å; Q614-A616 VanDerWaalsContact C-N 3.31Å; Q614-A616 PolarHBondContact O-N 3.08Å; Q614-G617 PolarHBondContact O-N 3.37Å; Q614-G617 VanDerWaalsContact O-N 3.09Å; Q614-R618 PolarHBondContact O-N 3.2Å
615	R	91.3	Very high	87.5	Confident	0 Å²	0	28.1 Å²	28.1	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-56	-46.7	173.7	-71.1	179.7	-173.1	-159.3	-3.6	111.4	F443 N568 E571 D584 K587 S611 G617 R618	F443-R615 HydrophobicContact CD1-CG 4.15Å; F443-R615 HydrophobicContact CD2-CB 3.98Å; F443-R615 HydrophobicContact CD2-CG 3.9Å; F443-R615 HydrophobicContact CE1-CG 3.98Å; F443-R615 HydrophobicContact CE2-CB 3.68Å; F443-R615 HydrophobicContact CE2-CG 3.71Å; F443-R615 HydrophobicContact CG-CG 4.11Å; F443-R615 HydrophobicContact CZ-CB 4.13Å; F443-R615 HydrophobicContact CZ-CG 3.76Å; N568-R615 PolarHBondContact ND2-NH2 3.18Å; N568-R615 PolarHBondContact OD1-NH2 3.04Å; E571-R615 HydrophobicContact CB-CG 4.43Å; E571-R615 HydrophobicContact CG-CG 3.96Å; E571-R615 IonicContact OE2-CZ 3.23Å; E571-R615 IonicContact OE2-NE 3.54Å; E571-R615 PolarHBondContact OE2-NE 3.38Å; E571-R615 IonicContact OE2-NH2 2.95Å; E571-R615 PolarHBondContact OE2-NH2 3.29Å; E571-R615 VanDerWaalsContact OE2-NH2 3.1Å; D584-R615 WeakPolarHBondContact OD1-CD 3.46Å; D584-R615 IonicContact OD1-CZ 2.88Å; D584-R615 IonicContact OD1-NH1 3.66Å; D584-R615 PolarHBondContact OD1-NH1 3.46Å; D584-R615 VanDerWaalsContact OD1-NH1 3.08Å; K587-R615 PolarHBondContact O-NH1 3.48Å; K587-R615 VanDerWaalsContact O-NH1 3.16Å; S611-R615 WeakPolarHBondContact O-CB 3.45Å; S611-R615 VanDerWaalsContact O-CG 3.3Å; S611-R615 WeakPolarHBondContact O-CG 3.43Å; S611-R615 PolarHBondContact O-N 3.47Å; R615-G617 VanDerWaalsContact C-N 3.32Å; R615-G617 PolarHBondContact O-N 3.34Å; R615-R618 WeakPolarHBondContact O-CB 3.32Å; R615-R618 PolarHBondContact O-N 3.12Å
616	A	90.3	Very high	87.7	Confident	6 Å²	6	26.9 Å²	26.9	5%	0.05	15%	0.149	C	C	.	.	H	α-helix	trans	-60.5	-41.8	175.7	0	0	0	0	0	112	V408 A612 S613 Q614 R618 A619 C627	V408-A616 HydrophobicContact CG1-CB 4.47Å; V408-A616 WeakPolarHBondContact CG1-O 3.48Å; A612-A616 WeakPolarHBondContact O-CB 3.22Å; A612-A616 PolarHBondContact O-N 3.49Å; S613-A616 PolarHBondContact O-N 2.9Å; Q614-A616 VanDerWaalsContact C-N 3.31Å; Q614-A616 PolarHBondContact O-N 3.08Å; A616-R618 PolarHBondContact O-N 3.08Å; A616-R618 VanDerWaalsContact O-N 3.11Å; A616-A619 WeakPolarHBondContact O-CB 3.4Å; A616-A619 PolarHBondContact O-N 3.19Å; A616-A619 VanDerWaalsContact O-N 3.11Å; A616-C627 HydrophobicContact CB-CB 3.75Å
617	G	85.5	Confident	87.7	Confident	8 Å²	8	22.4 Å²	22.4	8%	0.082	13%	0.132	C	C	.	.	H	α-helix	trans	-59.3	-20.8	178.3	0	0	0	0	0	114.7	S613 Q614 R615 A619 G620	S613-G617 PolarHBondContact O-N 3.08Å; Q614-G617 PolarHBondContact O-N 3.37Å; Q614-G617 VanDerWaalsContact O-N 3.09Å; R615-G617 VanDerWaalsContact C-N 3.32Å; R615-G617 PolarHBondContact O-N 3.34Å; G617-A619 PolarHBondContact O-N 3.42Å; G617-G620 PolarHBondContact O-N 2.83Å; G617-G620 VanDerWaalsContact O-N 3.15Å
618	R	87.3	Confident	87.8	Confident	8 Å²	8	23.9 Å²	23.9	3%	0.03	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63	-23.9	175.2	-58.6	-69.3	156.7	172.3	-18.4	113.3	L441 F443 A570 E571 T572 V574 V582 Q614 R615 A616 R621	L441-R618 HydrophobicContact CD2-CB 3.9Å; L441-R618 HydrophobicContact CD2-CG 4.29Å; F443-R618 HydrophobicContact CZ-CG 4.31Å; A570-R618 WeakPolarHBondContact O-CD 3.32Å; A570-R618 PolarHBondContact O-NE 2.93Å; E571-R618 VanDerWaalsContact C-NH2 3.3Å; E571-R618 PolarHBondContact O-NE 3.18Å; E571-R618 PolarHBondContact O-NH2 3.44Å; T572-R618 VanDerWaalsContact CA-NH2 3.28Å; V574-R618 PolarHBondContact O-NH1 3.18Å; V582-R618 HydrophobicContact CG2-CB 4.1Å; Q614-R618 PolarHBondContact O-N 3.2Å; R615-R618 WeakPolarHBondContact O-CB 3.32Å; R615-R618 PolarHBondContact O-N 3.12Å; A616-R618 PolarHBondContact O-N 3.08Å; A616-R618 VanDerWaalsContact O-N 3.11Å; R618-R621 VanDerWaalsContact NH2-NH2 3.2Å
619	A	87.5	Confident	88	Confident	1 Å²	1	24.3 Å²	24.3	1%	0.008	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-21	176.5	0	0	0	0	0	114.2	V408 V579 V582 A616 G617 G625	V408-A619 HydrophobicContact CG1-CB 4.14Å; V408-A619 HydrophobicContact CG2-CB 4.28Å; V579-A619 CarbonylContact O-C 3.59Å; V579-A619 VanDerWaalsContact O-O 3.07Å; V582-A619 HydrophobicContact CB-CB 4.39Å; V582-A619 HydrophobicContact CG2-CB 3.78Å; A616-A619 WeakPolarHBondContact O-CB 3.4Å; A616-A619 PolarHBondContact O-N 3.19Å; A616-A619 VanDerWaalsContact O-N 3.11Å; G617-A619 PolarHBondContact O-N 3.42Å; A619-G625 WeakPolarHBondContact O-CA 3.42Å
620	G	77.2	Confident	88.2	Confident	4 Å²	4	22 Å²	22	4%	0.041	13%	0.128	C	C	.	.	S	Bend	trans	-103.6	29.2	-168.4	0	0	0	0	0	114.5	V408 G617 G623	V408-G620 VanDerWaalsContact CG2-CA 3.42Å; G617-G620 PolarHBondContact O-N 2.83Å; G617-G620 VanDerWaalsContact O-N 3.15Å; G620-G623 WeakPolarHBondContact CA-O 3.35Å
621	R	73.6	Confident	88.6	Confident	35 Å²	35	21 Å²	21	13%	0.132	12%	0.121	C	C	.	.	S	Bend	trans	-87.6	-52.6	-171.3	-68	-169.6	167.8	-154.2	-7.6	113.5	T247 T575 R618	T247-R621 PolarHBondContact OG1-NH2 2.91Å; T575-R621 PolarHBondContact OG1-NH1 3.36Å; R618-R621 VanDerWaalsContact NH2-NH2 3.2Å
622	L	74.5	Confident	88.9	Confident	107 Å²	107	21.5 Å²	21.5	56%	0.56	12%	0.124	S	C	*	.	S	Bend	trans	-102.8	-12.5	-177.5	-62.6	176.7	0	0	0	113.3	Y406 N578	Y406-L622 VanDerWaalsContact CE2-O 3.26Å; Y406-L622 WeakPolarHBondContact CE2-O 3.03Å; N578-L622 WeakPolarHBondContact OD1-CD1 3.29Å
623	G	81.3	Confident	89	Confident	21 Å²	21	24.6 Å²	24.6	22%	0.216	15%	0.146	C	C	.	.	S	Bend	trans	-171.9	177.5	-179.1	0	0	0	0	0	111.1	Y406 G620 G625	Y406-G623 WeakPolarHBondContact CB-O 3.33Å; Y406-G623 VanDerWaalsContact CD2-N 3.32Å; Y406-G623 VanDerWaalsContact CG-C 3.48Å; Y406-G623 VanDerWaalsContact CG-CA 3.41Å; G620-G623 WeakPolarHBondContact CA-O 3.35Å; G623-G625 PolarHBondContact O-N 3.29Å
624	P	87.8	Confident	89.3	Confident	74 Å²	74	25 Å²	25	48%	0.481	15%	0.152	S	C	.	.			trans	-59.4	130.3	177	-24	34.5	0	0	0	112.2	Y406 P407	Y406-P624 HydrophobicContact CD1-CG 4.25Å; P407-P624 WeakPolarHBondContact O-CA 3.47Å
625	G	90.6	Very high	89.6	Confident	1 Å²	1	25.5 Å²	25.5	1%	0.01	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	165.3	-172.6	0	0	0	0	0	114.3	P407 V408 T409 R580 A619 G623	P407-G625 PolarHBondContact O-N 2.89Å; V408-G625 WeakPolarHBondContact CA-O 3.5Å; T409-G625 PolarHBondContact N-O 2.91Å; R580-G625 CarbonylContact O-C 3.56Å; R580-G625 WeakPolarHBondContact O-CA 3.47Å; A619-G625 WeakPolarHBondContact O-CA 3.42Å; G623-G625 PolarHBondContact O-N 3.29Å
626	H	94.2	Very high	89.8	Confident	42 Å²	42	27.3 Å²	27.3	19%	0.194	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	135.1	173.6	-61.6	-69.6	0	0	0	110.7	T409 Y411 R580 Y581 V582 Y628	T409-H626 WeakPolarHBondContact O-CA 3.47Å; Y411-H626 HydrophobicContact CE2-CB 4.01Å; Y411-H626 AromaticContact CE2-ND1 3.55Å; Y411-H626 AromaticContact CZ-ND1 3.92Å; Y411-H626 PolarHBondContact OH-ND1 2.85Å; R580-H626 PolarHBondContact O-N 2.99Å; Y581-H626 CarbonylContact C-O 3.52Å; Y581-H626 WeakPolarHBondContact CA-O 3.44Å; Y581-H626 HydrophobicContact CD1-CB 4.04Å; Y581-H626 HydrophobicContact CE1-CB 4.49Å; Y581-H626 AromaticContact CE1-CD2 3.7Å; V582-H626 PolarHBondContact N-O 3.28Å; H626-Y628 HydrophobicContact CB-CE2 4.08Å
627	C	95.6	Very high	90	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	122.7	175.1	179.8	0	0	0	0	110.2	V408 T409 A410 Y411 V582 A616	V408-C627 HydrophobicContact CG1-CB 4.01Å; T409-C627 PolarHBondContact O-N 3.5Å; A410-C627 CarbonylContact C-O 3.47Å; A410-C627 WeakPolarHBondContact CA-O 3.44Å; A410-C627 HydrophobicContact CB-CB 4.5Å; Y411-C627 PolarHBondContact N-O 3.34Å; V582-C627 HydrophobicContact CB-CB 4.36Å; V582-C627 CarbonylContact O-C 3.55Å; V582-C627 WeakPolarHBondContact O-CA 3.48Å; A616-C627 HydrophobicContact CB-CB 3.75Å
628	Y	97	Very high	90.4	Very high	34 Å²	34	38.2 Å²	38.2	13%	0.133	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	105.1	177.2	-63.2	-76.4	0	0	0	110	Y411 K427 V431 L435 Y581 V582 I583 D584 H626	Y411-Y628 AromaticContact CD2-CD1 3.74Å; Y411-Y628 HydrophobicContact CD2-CD1 3.74Å; Y411-Y628 AromaticContact CD2-CE1 3.41Å; Y411-Y628 HydrophobicContact CD2-CE1 3.41Å; Y411-Y628 VanDerWaalsContact CD2-CE1 3.41Å; Y411-Y628 AromaticContact CD2-CZ 3.98Å; Y411-Y628 AromaticContact CE2-CE1 3.91Å; Y411-Y628 HydrophobicContact CE2-CE1 3.91Å; Y411-Y628 HydrophobicContact CG-CD1 4.12Å; Y411-Y628 AromaticContact CG-CE1 3.96Å; Y411-Y628 HydrophobicContact CG-CE1 3.96Å; K427-Y628 HydrophobicContact CD-CD1 4.28Å; K427-Y628 HydrophobicContact CD-CG 4.13Å; K427-Y628 HydrophobicContact CG-CG 4.38Å; V431-Y628 HydrophobicContact CG2-CD2 3.87Å; V431-Y628 HydrophobicContact CG2-CE2 3.64Å; L435-Y628 HydrophobicContact CD1-CE2 3.95Å; L435-Y628 WeakPolarHBondContact CD1-OH 3.44Å; Y581-Y628 HydrophobicContact CD1-CE2 4.22Å; V582-Y628 PolarHBondContact O-N 3.49Å; I583-Y628 HydrophobicContact CG1-CD2 4.49Å; D584-Y628 PolarHBondContact N-O 3.38Å; H626-Y628 HydrophobicContact CB-CE2 4.08Å
629	R	97	Very high	90.7	Very high	13 Å²	13	38.3 Å²	38.3	5%	0.049	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	122.2	176	-64.7	177.8	170.4	178.8	-1.8	109.6	Y411 F412 S413 A612 Y631 Y636	Y411-R629 WeakPolarHBondContact O-CB 3.17Å; Y411-R629 PolarHBondContact O-N 2.86Å; F412-R629 HydrophobicContact CD1-CB 4.08Å; S413-R629 WeakPolarHBondContact CB-O 3.44Å; S413-R629 PolarHBondContact N-O 2.91Å; S413-R629 PolarHBondContact OG-O 3Å; A612-R629 PolarHBondContact O-NH2 3.19Å; R629-Y631 HydrophobicContact CB-CD1 4.21Å; R629-Y631 HydrophobicContact CB-CD2 4.24Å; R629-Y631 HydrophobicContact CB-CE1 3.81Å; R629-Y631 HydrophobicContact CB-CE2 3.87Å; R629-Y631 HydrophobicContact CB-CG 4.42Å; R629-Y631 WeakPolarHBondContact CD-OH 3.48Å; R629-Y631 HydrophobicContact CG-CE1 4.12Å; R629-Y631 HydrophobicContact CG-CE2 4.05Å; R629-Y631 WeakPolarHBondContact CG-OH 3.43Å; R629-Y631 PolarHBondContact NE-OH 3.25Å; R629-Y631 PolarHBondContact O-N 3.46Å; R629-Y636 VanDerWaalsContact NH1-CE2 3.27Å
630	L	96.3	Very high	91	Very high	9 Å²	9	43 Å²	43	5%	0.047	24%	0.242	C	C	.	.	S	Bend	trans	-81.3	12.5	-178.7	-55.8	-177.1	0	0	0	113.3	S413 A423 A424 K427 I583 D584 T585	S413-L630 WeakPolarHBondContact OG-CA 3.49Å; A423-L630 HydrophobicContact CB-CB 4.46Å; A423-L630 HydrophobicContact CB-CD1 3.97Å; A424-L630 HydrophobicContact CB-CD1 3.78Å; K427-L630 HydrophobicContact CB-CD2 3.99Å; K427-L630 HydrophobicContact CG-CD2 4.09Å; I583-L630 HydrophobicContact CG2-CD1 3.82Å; I583-L630 HydrophobicContact CG2-CD2 4.13Å; I583-L630 HydrophobicContact CG2-CG 4.06Å; D584-L630 WeakPolarHBondContact O-CG 3.34Å; D584-L630 PolarHBondContact O-N 3.08Å; T585-L630 HydrophobicContact CG2-CD1 3.91Å
631	Y	96.5	Very high	91.6	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.264	C	S	.	.	S	Bend	trans	-125	155.6	177.5	47.5	-87.3	0	0	0	110.1	F412 S413 T416 D584 W606 R629 Y636 F639	F412-Y631 HydrophobicContact CD1-CD2 4.44Å; F412-Y631 HydrophobicContact CD1-CE2 4.45Å; F412-Y631 HydrophobicContact CE1-CE2 4.19Å; S413-Y631 PolarHBondContact N-O 3.17Å; T416-Y631 WeakPolarHBondContact OG1-CA 3.46Å; D584-Y631 HydrophobicContact CB-CE1 4.44Å; D584-Y631 WeakPolarHBondContact OD2-CE1 3.3Å; D584-Y631 PolarHBondContact OD2-OH 3.21Å; W606-Y631 HydrophobicContact CZ3-CD1 4.3Å; W606-Y631 HydrophobicContact CZ3-CG 4.29Å; R629-Y631 HydrophobicContact CB-CD1 4.21Å; R629-Y631 HydrophobicContact CB-CD2 4.24Å; R629-Y631 HydrophobicContact CB-CE1 3.81Å; R629-Y631 HydrophobicContact CB-CE2 3.87Å; R629-Y631 HydrophobicContact CB-CG 4.42Å; R629-Y631 WeakPolarHBondContact CD-OH 3.48Å; R629-Y631 HydrophobicContact CG-CE1 4.12Å; R629-Y631 HydrophobicContact CG-CE2 4.05Å; R629-Y631 WeakPolarHBondContact CG-OH 3.43Å; R629-Y631 PolarHBondContact NE-OH 3.25Å; R629-Y631 PolarHBondContact O-N 3.46Å; Y631-Y636 AromaticContact CE2-CD2 3.84Å; Y631-Y636 HydrophobicContact CE2-CD2 3.84Å; Y631-Y636 HydrophobicContact CE2-CG 4.31Å; Y631-F639 HydrophobicContact CD1-CZ 4.48Å; Y631-F639 HydrophobicContact CD2-CE2 4.16Å; Y631-F639 AromaticContact CD2-CZ 3.86Å; Y631-F639 HydrophobicContact CD2-CZ 3.86Å; Y631-F639 HydrophobicContact CE1-CE2 4.5Å; Y631-F639 AromaticContact CE2-CE2 3.7Å; Y631-F639 HydrophobicContact CE2-CE2 3.7Å; Y631-F639 AromaticContact CE2-CZ 3.89Å; Y631-F639 HydrophobicContact CE2-CZ 3.89Å; Y631-F639 HydrophobicContact CG-CZ 4.15Å; Y631-F639 AromaticContact CZ-CE2 3.88Å
632	S	95.6	Very high	92.2	Very high	18 Å²	18	49 Å²	49	13%	0.126	27%	0.267	C	S	.	.			trans	-74.2	159.6	178.3	65.3	0	0	0	0	113	S413 T416 A634 V635 Y636	S413-S632 WeakPolarHBondContact O-CA 3.31Å; S413-S632 WeakPolarHBondContact O-CB 3.5Å; T416-S632 PolarHBondContact OG1-N 3.16Å; T416-S632 PolarHBondContact OG1-OG 3.03Å; S632-A634 PolarHBondContact O-N 3.08Å; S632-V635 PolarHBondContact O-N 3.1Å; S632-V635 WeakPolarHBondContact OG-CG2 3.5Å; S632-V635 PolarHBondContact OG-N 3.07Å; S632-Y636 PolarHBondContact O-N 2.93Å
633	S	94.4	Very high	92.8	Very high	65 Å²	65	46.2 Å²	46.2	46%	0.455	26%	0.256	S	S	.	.	H	α-helix	trans	-60.3	-34	173.5	52.1	0	0	0	0	112.3	Y636 N637	S633-Y636 WeakPolarHBondContact O-CB 3.43Å; S633-Y636 PolarHBondContact O-N 3.11Å; S633-N637 VanDerWaalsContact O-CG 3.28Å; S633-N637 PolarHBondContact O-N 3.41Å
634	A	94.3	Very high	93.1	Very high	58 Å²	58	53.1 Å²	53.1	48%	0.479	28%	0.275	S	S	.	.	H	α-helix	trans	-61.2	-48.9	173.9	0	0	0	0	0	111.4	S632 Y636 N637 D638	S632-A634 PolarHBondContact O-N 3.08Å; A634-Y636 VanDerWaalsContact C-N 3.29Å; A634-Y636 PolarHBondContact O-N 3.08Å; A634-N637 WeakPolarHBondContact O-CB 3.37Å; A634-N637 PolarHBondContact O-N 3.46Å; A634-N637 VanDerWaalsContact O-N 3.12Å; A634-D638 PolarHBondContact O-N 3.33Å
635	V	94.6	Very high	93.2	Very high	31 Å²	31	49.9 Å²	49.9	19%	0.188	25%	0.254	C	S	.	.	H	α-helix	trans	-62.8	-37.2	176.5	169.1	0	0	0	0	111.5	W606 S632 N637 D638 F639	W606-V635 HydrophobicContact CD2-CG1 4.2Å; W606-V635 HydrophobicContact CE3-CG1 4.32Å; W606-V635 HydrophobicContact CH2-CG1 3.87Å; W606-V635 HydrophobicContact CZ2-CG1 3.68Å; W606-V635 HydrophobicContact CZ3-CG1 4.17Å; S632-V635 PolarHBondContact O-N 3.1Å; S632-V635 WeakPolarHBondContact OG-CG2 3.5Å; S632-V635 PolarHBondContact OG-N 3.07Å; V635-N637 VanDerWaalsContact C-N 3.33Å; V635-N637 PolarHBondContact O-N 2.96Å; V635-D638 PolarHBondContact O-N 3.41Å; V635-F639 HydrophobicContact CG1-CD1 4.42Å; V635-F639 HydrophobicContact CG1-CE1 3.53Å; V635-F639 HydrophobicContact CG1-CZ 4.16Å; V635-F639 WeakPolarHBondContact O-CD1 3.27Å; V635-F639 VanDerWaalsContact O-CE1 3.29Å; V635-F639 WeakPolarHBondContact O-CE1 3.46Å; V635-F639 PolarHBondContact O-N 3.36Å
636	Y	95	Very high	93	Very high	39 Å²	39	53.6 Å²	53.6	15%	0.153	27%	0.271	C	S	.	.	H	α-helix	trans	-64.6	-35.6	174.7	178.7	-109	0	0	0	113	F412 K609 A612 R629 Y631 S632 S633 A634 D638 F639	F412-Y636 AromaticContact CE1-CD1 3.86Å; F412-Y636 HydrophobicContact CE1-CD1 3.86Å; F412-Y636 HydrophobicContact CE1-CD2 4.23Å; F412-Y636 AromaticContact CE1-CG 3.6Å; F412-Y636 HydrophobicContact CE1-CG 3.6Å; F412-Y636 AromaticContact CZ-CD1 3.7Å; F412-Y636 HydrophobicContact CZ-CD1 3.7Å; F412-Y636 HydrophobicContact CZ-CE1 4.19Å; F412-Y636 AromaticContact CZ-CG 3.94Å; F412-Y636 HydrophobicContact CZ-CG 3.94Å; K609-Y636 HydrophobicContact CB-CE2 4.17Å; K609-Y636 WeakPolarHBondContact CE-O 3.49Å; K609-Y636 HydrophobicContact CG-CD2 4.46Å; K609-Y636 HydrophobicContact CG-CE2 3.88Å; A612-Y636 HydrophobicContact CB-CD2 4.49Å; A612-Y636 HydrophobicContact CB-CE2 3.83Å; R629-Y636 VanDerWaalsContact NH1-CE2 3.27Å; Y631-Y636 AromaticContact CE2-CD2 3.84Å; Y631-Y636 HydrophobicContact CE2-CD2 3.84Å; Y631-Y636 HydrophobicContact CE2-CG 4.31Å; S632-Y636 PolarHBondContact O-N 2.93Å; S633-Y636 WeakPolarHBondContact O-CB 3.43Å; S633-Y636 PolarHBondContact O-N 3.11Å; A634-Y636 VanDerWaalsContact C-N 3.29Å; A634-Y636 PolarHBondContact O-N 3.08Å; Y636-D638 PolarHBondContact O-N 2.93Å; Y636-F639 AromaticContact CD2-CD2 3.83Å; Y636-F639 HydrophobicContact CD2-CD2 3.83Å; Y636-F639 HydrophobicContact CD2-CE2 4.13Å; Y636-F639 HydrophobicContact CD2-CG 4.5Å; Y636-F639 HydrophobicContact CE2-CD2 4.39Å; Y636-F639 WeakPolarHBondContact O-CB 3.4Å; Y636-F639 PolarHBondContact O-N 2.98Å
637	N	94	Very high	92.6	Very high	102 Å²	102	51.7 Å²	51.7	55%	0.545	26%	0.263	S	S	.	.	H	α-helix	trans	-64.6	-31.6	177.4	-72.8	-17.3	0	0	0	112	K609 S633 A634 V635 F639	K609-N637 WeakPolarHBondContact CE-O 3.48Å; K609-N637 PolarHBondContact NZ-O 3.25Å; S633-N637 VanDerWaalsContact O-CG 3.28Å; S633-N637 PolarHBondContact O-N 3.41Å; A634-N637 WeakPolarHBondContact O-CB 3.37Å; A634-N637 PolarHBondContact O-N 3.46Å; A634-N637 VanDerWaalsContact O-N 3.12Å; V635-N637 VanDerWaalsContact C-N 3.33Å; V635-N637 PolarHBondContact O-N 2.96Å; N637-F639 VanDerWaalsContact C-N 3.32Å
638	D	94.6	Very high	92.2	Very high	140 Å²	140	55.7 Å²	55.7	75%	0.749	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77	-11.5	176.3	-62.5	-19.3	0	0	0	113.8	A634 V635 Y636	A634-D638 PolarHBondContact O-N 3.33Å; V635-D638 PolarHBondContact O-N 3.41Å; Y636-D638 PolarHBondContact O-N 2.93Å
639	F	93.8	Very high	91.6	Very high	11 Å²	11	55.5 Å²	55.5	5%	0.048	29%	0.286	C	S	.	.	S	Bend	trans	-65.1	141.1	177.3	-71.7	6.3	0	0	0	111.1	W606 I607 K609 Y631 V635 Y636 N637	W606-F639 HydrophobicContact CB-CD1 3.86Å; W606-F639 HydrophobicContact CB-CE1 3.61Å; W606-F639 HydrophobicContact CB-CZ 4.15Å; W606-F639 HydrophobicContact CD2-CD1 4.39Å; W606-F639 AromaticContact CD2-CE1 3.39Å; W606-F639 HydrophobicContact CD2-CE1 3.39Å; W606-F639 AromaticContact CD2-CZ 3.82Å; W606-F639 HydrophobicContact CD2-CZ 3.82Å; W606-F639 AromaticContact CE3-CE1 3.36Å; W606-F639 HydrophobicContact CE3-CE1 3.36Å; W606-F639 HydrophobicContact CE3-CE2 4.42Å; W606-F639 AromaticContact CE3-CZ 3.25Å; W606-F639 HydrophobicContact CE3-CZ 3.25Å; W606-F639 HydrophobicContact CG-CD1 4.11Å; W606-F639 AromaticContact CG-CE1 3.53Å; W606-F639 HydrophobicContact CG-CE1 3.53Å; W606-F639 HydrophobicContact CG-CZ 4.22Å; W606-F639 HydrophobicContact CZ3-CE1 4.2Å; W606-F639 AromaticContact CZ3-CZ 3.92Å; W606-F639 HydrophobicContact CZ3-CZ 3.92Å; I607-F639 HydrophobicContact CG1-CD2 4.15Å; I607-F639 HydrophobicContact CG1-CE2 3.73Å; I607-F639 WeakPolarHBondContact O-CD2 3.26Å; I607-F639 VanDerWaalsContact O-CG 3.31Å; I607-F639 WeakPolarHBondContact O-CG 3.22Å; K609-F639 VanDerWaalsContact CE-O 3.27Å; K609-F639 WeakPolarHBondContact CE-O 3.25Å; K609-F639 HydrophobicContact CG-CB 3.78Å; Y631-F639 HydrophobicContact CD1-CZ 4.48Å; Y631-F639 HydrophobicContact CD2-CE2 4.16Å; Y631-F639 AromaticContact CD2-CZ 3.86Å; Y631-F639 HydrophobicContact CD2-CZ 3.86Å; Y631-F639 HydrophobicContact CE1-CE2 4.5Å; Y631-F639 AromaticContact CE2-CE2 3.7Å; Y631-F639 HydrophobicContact CE2-CE2 3.7Å; Y631-F639 AromaticContact CE2-CZ 3.89Å; Y631-F639 HydrophobicContact CE2-CZ 3.89Å; Y631-F639 HydrophobicContact CG-CZ 4.15Å; Y631-F639 AromaticContact CZ-CE2 3.88Å; V635-F639 HydrophobicContact CG1-CD1 4.42Å; V635-F639 HydrophobicContact CG1-CE1 3.53Å; V635-F639 HydrophobicContact CG1-CZ 4.16Å; V635-F639 WeakPolarHBondContact O-CD1 3.27Å; V635-F639 VanDerWaalsContact O-CE1 3.29Å; V635-F639 WeakPolarHBondContact O-CE1 3.46Å; V635-F639 PolarHBondContact O-N 3.36Å; Y636-F639 AromaticContact CD2-CD2 3.83Å; Y636-F639 HydrophobicContact CD2-CD2 3.83Å; Y636-F639 HydrophobicContact CD2-CE2 4.13Å; Y636-F639 HydrophobicContact CD2-CG 4.5Å; Y636-F639 HydrophobicContact CE2-CD2 4.39Å; Y636-F639 WeakPolarHBondContact O-CB 3.4Å; Y636-F639 PolarHBondContact O-N 2.98Å; N637-F639 VanDerWaalsContact C-N 3.32Å
640	E	92.5	Very high	90.8	Very high	100 Å²	100	58 Å²	58	47%	0.467	30%	0.298	S	S	.	.			trans	-56.9	141.4	168.4	-65.9	-172.2	173.9	0	0	109.4	S608 K609 Y642 R644	S608-E640 CarbonylContact C-O 3.53Å; S608-E640 VanDerWaalsContact CA-O 3.31Å; S608-E640 WeakPolarHBondContact CA-O 3.11Å; S608-E640 WeakPolarHBondContact CB-O 3.46Å; K609-E640 PolarHBondContact N-O 2.89Å; E640-Y642 VanDerWaalsContact C-N 3.25Å; E640-Y642 PolarHBondContact O-N 3.42Å; E640-R644 IonicContact OE1-CZ 3.14Å; E640-R644 IonicContact OE1-NE 3.64Å; E640-R644 IonicContact OE1-NH2 2.56Å; E640-R644 PolarHBondContact OE1-NH2 2.76Å; E640-R644 IonicContact OE2-NE 3.45Å
641	K	89.5	Confident	90.3	Very high	117 Å²	117	59.8 Å²	59.8	51%	0.509	31%	0.311	S	S	.	.	S	Bend	trans	-61	-38.2	-176.8	-169	-178.8	177.1	-157.6	0	111.3	E384 A610	E384-K641 IonicContact OE1-NZ 2.75Å; A610-K641 PolarHBondContact N-O 2.92Å; A610-K641 VanDerWaalsContact N-O 3.13Å
642	Y	88	Confident	89.9	Confident	48 Å²	48	60.3 Å²	60.3	19%	0.188	31%	0.313	C	S	.	.	S	Bend	trans	-139.5	154.6	-176.2	-53.6	-67.8	0	0	0	111.2	R382 A610 E640	R382-Y642 HydrophobicContact CB-CD1 3.94Å; R382-Y642 HydrophobicContact CB-CE1 3.48Å; R382-Y642 VanDerWaalsContact CB-CE1 3.48Å; R382-Y642 HydrophobicContact CB-CE2 4.15Å; R382-Y642 HydrophobicContact CB-CG 4.49Å; R382-Y642 VanDerWaalsContact CD-CG 3.46Å; R382-Y642 HydrophobicContact CG-CD1 4.05Å; R382-Y642 HydrophobicContact CG-CD2 3.9Å; R382-Y642 HydrophobicContact CG-CE1 3.86Å; R382-Y642 HydrophobicContact CG-CE2 3.64Å; R382-Y642 HydrophobicContact CG-CG 4.08Å; A610-Y642 HydrophobicContact CB-CD1 3.81Å; A610-Y642 HydrophobicContact CB-CE1 4.36Å; E640-Y642 VanDerWaalsContact C-N 3.25Å; E640-Y642 PolarHBondContact O-N 3.42Å
643	S	87.1	Confident	89.7	Confident	48 Å²	48	60.1 Å²	60.1	34%	0.336	31%	0.311	S	S	.	.	P	Polyproline II helix	trans	-69.3	150.6	171.9	-52.4	0	0	0	0	110.4	R382 S608	R382-S643 PolarHBondContact NH1-O 2.91Å; S608-S643 VanDerWaalsContact CB-N 3.35Å; S608-S643 WeakPolarHBondContact CB-OG 3.44Å; S608-S643 PolarHBondContact OG-N 3.35Å; S608-S643 PolarHBondContact OG-OG 3.1Å
644	R	87.4	Confident	89.4	Confident	166 Å²	166	58.9 Å²	58.9	63%	0.626	30%	0.299	S	S	*	.	P	Polyproline II helix	trans	-71.9	137.2	177.2	-62.6	-175.1	-175.8	-165.1	-0.4	109.9	E640 T649	E640-R644 IonicContact OE1-CZ 3.14Å; E640-R644 IonicContact OE1-NE 3.64Å; E640-R644 IonicContact OE1-NH2 2.56Å; E640-R644 PolarHBondContact OE1-NH2 2.76Å; E640-R644 IonicContact OE2-NE 3.45Å; R644-T649 HydrophobicContact CB-CG2 4.39Å
645	P	88.3	Confident	89.2	Confident	6 Å²	6	56.5 Å²	56.5	4%	0.039	28%	0.278	C	S	.	.	P	Polyproline II helix	trans	-57.3	143.8	174.5	-27	36.4	0	0	0	112.9	R347 I647 L648	R347-P645 HydrophobicContact CB-CB 3.95Å; R347-P645 HydrophobicContact CB-CG 4.3Å; P645-I647 HydrophobicContact CB-CG2 4.12Å; P645-I647 PolarHBondContact O-N 3.48Å; P645-L648 PolarHBondContact O-N 3.5Å; P645-L648 VanDerWaalsContact O-N 3.08Å
646	E	86.7	Confident	89.1	Confident	79 Å²	79	55 Å²	55	37%	0.369	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-59.9	-32.4	-176.9	-70.6	-174.3	163.8	0	0	112.6	R347 S348 M349 L648 T649 E650	R347-E646 PolarHBondContact O-N 2.97Å; R347-E646 VanDerWaalsContact O-N 3.09Å; S348-E646 VanDerWaalsContact CA-OE2 3.26Å; S348-E646 WeakPolarHBondContact CA-OE2 3.4Å; M349-E646 HydrophobicContact CG-CB 3.84Å; M349-E646 PolarHBondContact N-OE2 2.83Å; E646-L648 PolarHBondContact O-N 3.22Å; E646-L648 VanDerWaalsContact O-N 3.08Å; E646-T649 WeakPolarHBondContact CA-OG1 3.31Å; E646-T649 PolarHBondContact O-N 3.18Å; E646-T649 PolarHBondContact O-OG1 2.89Å; E646-T649 VanDerWaalsContact O-OG1 3.11Å; E646-E650 PolarHBondContact O-N 3.17Å; E646-E650 VanDerWaalsContact O-N 3.08Å
647	I	87.4	Confident	89	Confident	2 Å²	2	53.2 Å²	53.2	1%	0.01	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-60.8	-18.5	178.9	-152.5	179.2	0	0	0	113.6	M349 P645 L652 L655 F672 L676	M349-I647 HydrophobicContact CE-CG1 4.3Å; M349-I647 HydrophobicContact CG-CB 4.16Å; M349-I647 HydrophobicContact CG-CG1 4.43Å; P645-I647 HydrophobicContact CB-CG2 4.12Å; P645-I647 PolarHBondContact O-N 3.48Å; I647-L652 HydrophobicContact CG1-CD2 3.89Å; I647-L652 WeakPolarHBondContact O-CD2 3.48Å; I647-L655 HydrophobicContact CD1-CD2 3.76Å; I647-L655 HydrophobicContact CG1-CD2 3.94Å; I647-F672 HydrophobicContact CD1-CD1 3.63Å; I647-F672 HydrophobicContact CD1-CE1 3.76Å; I647-F672 HydrophobicContact CD1-CG 4.45Å; I647-L676 HydrophobicContact CB-CD2 4.34Å; I647-L676 HydrophobicContact CD1-CD1 3.83Å; I647-L676 HydrophobicContact CD1-CD2 3.91Å; I647-L676 HydrophobicContact CD1-CG 4.17Å; I647-L676 HydrophobicContact CG1-CD1 4.27Å; I647-L676 HydrophobicContact CG1-CD2 3.82Å; I647-L676 HydrophobicContact CG2-CD2 3.85Å
648	L	86.5	Confident	88.7	Confident	84 Å²	84	49.3 Å²	49.3	44%	0.44	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	-94.8	-9.9	175	-60.8	-178.7	0	0	0	113.3	P645 E646 T674 L676	P645-L648 PolarHBondContact O-N 3.5Å; P645-L648 VanDerWaalsContact O-N 3.08Å; E646-L648 PolarHBondContact O-N 3.22Å; E646-L648 VanDerWaalsContact O-N 3.08Å; L648-T674 HydrophobicContact CD1-CG2 4.04Å; L648-T674 HydrophobicContact CD2-CG2 4.49Å; L648-T674 HydrophobicContact CG-CG2 4.45Å; L648-L676 HydrophobicContact CD2-CD2 3.8Å
649	T	83.3	Confident	88.4	Confident	29 Å²	29	42.6 Å²	42.6	18%	0.178	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-121.5	-0.4	-171.4	56.2	0	0	0	0	114	Y593 R644 E646	Y593-T649 WeakPolarHBondContact CB-O 3.37Å; Y593-T649 PolarHBondContact N-O 3.46Å; R644-T649 HydrophobicContact CB-CG2 4.39Å; E646-T649 WeakPolarHBondContact CA-OG1 3.31Å; E646-T649 PolarHBondContact O-N 3.18Å; E646-T649 PolarHBondContact O-OG1 2.89Å; E646-T649 VanDerWaalsContact O-OG1 3.11Å
650	E	81.9	Confident	88.3	Confident	65 Å²	65	42.2 Å²	42.2	30%	0.304	20%	0.203	S	C	.	.	S	Bend	trans	-124.2	156.7	179.3	-65.3	-149.4	146	0	0	112.1	M349 E646 L652	M349-E650 HydrophobicContact SD-CB 3.57Å; M349-E650 VanDerWaalsContact SD-CB 3.57Å; M349-E650 HydrophobicContact SD-CG 4.27Å; E646-E650 PolarHBondContact O-N 3.17Å; E646-E650 VanDerWaalsContact O-N 3.08Å; E650-L652 PolarHBondContact O-N 2.61Å
651	P	84.5	Confident	88.1	Confident	48 Å²	48	39.1 Å²	39.1	31%	0.312	19%	0.194	S	C	.	.			trans	-62	128.8	175.7	-15.4	26.5	0	0	0	111.8	Y593 D653	Y593-P651 HydrophobicContact CD1-CG 4.43Å; Y593-P651 HydrophobicContact CD2-CG 3.86Å; Y593-P651 HydrophobicContact CE1-CB 4.11Å; Y593-P651 HydrophobicContact CE1-CG 4.24Å; Y593-P651 HydrophobicContact CE2-CB 4.16Å; Y593-P651 HydrophobicContact CE2-CG 3.63Å; Y593-P651 HydrophobicContact CG-CG 4.25Å; P651-D653 VanDerWaalsContact C-N 3.26Å; P651-D653 WeakPolarHBondContact CB-OD2 3.48Å; P651-D653 PolarHBondContact O-N 2.85Å
652	L	89.4	Confident	87.9	Confident	10 Å²	10	34.8 Å²	34.8	5%	0.052	18%	0.176	C	C	.	.	S	Bend	trans	-79.9	-2.9	-177.7	-60	178.5	0	0	0	113.9	M349 I647 E650 D654 L655 V656 L676 L681 A684	M349-L652 HydrophobicContact CE-CD2 3.94Å; I647-L652 HydrophobicContact CG1-CD2 3.89Å; I647-L652 WeakPolarHBondContact O-CD2 3.48Å; E650-L652 PolarHBondContact O-N 2.61Å; L652-D654 PolarHBondContact O-N 2.84Å; L652-L655 HydrophobicContact CD2-CD2 4.27Å; L652-L655 WeakPolarHBondContact O-CB 3.35Å; L652-L655 PolarHBondContact O-N 2.78Å; L652-V656 HydrophobicContact CB-CG2 4.27Å; L652-V656 WeakPolarHBondContact O-CG2 3.48Å; L652-V656 PolarHBondContact O-N 3.13Å; L652-L676 HydrophobicContact CD1-CD1 4.28Å; L652-L681 HydrophobicContact CD1-CD2 4Å; L652-L681 HydrophobicContact CD1-CG 4.42Å; L652-A684 HydrophobicContact CB-CB 3.96Å
653	D	90.2	Very high	87.7	Confident	15 Å²	15	36.1 Å²	36.1	8%	0.08	19%	0.192	C	C	.	.	H	α-helix	trans	-59.5	-47.4	-170.1	-55	-104.2	0	0	0	113.1	P651 L657 R687 L688 P722	P651-D653 VanDerWaalsContact C-N 3.26Å; P651-D653 WeakPolarHBondContact CB-OD2 3.48Å; P651-D653 PolarHBondContact O-N 2.85Å; D653-L657 WeakPolarHBondContact O-CB 3.39Å; D653-L657 PolarHBondContact O-N 3.25Å; D653-L657 VanDerWaalsContact O-N 3.07Å; D653-R687 WeakPolarHBondContact OD1-CB 3.49Å; D653-R687 IonicContact OD1-CZ 3.2Å; D653-R687 IonicContact OD1-NE 3.05Å; D653-R687 PolarHBondContact OD1-NE 3.34Å; D653-R687 IonicContact OD1-NH2 3.7Å; D653-R687 PolarHBondContact OD1-NH2 2.94Å; D653-R687 IonicContact OD2-CZ 3.65Å; D653-R687 IonicContact OD2-NE 3.64Å; D653-R687 IonicContact OD2-NH2 3.2Å; D653-R687 PolarHBondContact OD2-NH2 3.31Å; D653-L688 HydrophobicContact CB-CD2 4.41Å; D653-P722 HydrophobicContact CB-CG 4.21Å
654	D	89.6	Confident	87.6	Confident	38 Å²	38	35.4 Å²	35.4	20%	0.203	18%	0.184	C	C	.	.	H	α-helix	trans	-64.3	-44.7	176	-176	53	0	0	0	110.7	Y350 L652 V656 L657 Q658 P722	Y350-D654 PolarHBondContact OH-OD2 3.04Å; L652-D654 PolarHBondContact O-N 2.84Å; D654-V656 PolarHBondContact O-N 2.72Å; D654-L657 PolarHBondContact O-N 2.83Å; D654-Q658 VanDerWaalsContact O-CG 3.26Å; D654-Q658 WeakPolarHBondContact O-CG 3.2Å; D654-Q658 PolarHBondContact O-N 2.7Å; D654-P722 HydrophobicContact CB-CG 4.37Å
655	L	88.9	Confident	87.4	Confident	8 Å²	8	29.8 Å²	29.8	4%	0.042	17%	0.166	C	C	.	.	H	α-helix	trans	-59.4	-50.8	179.8	174.1	57.9	0	0	0	112.1	M349 V353 I647 L652 L657 Q658 M659 F672	M349-L655 HydrophobicContact CE-CB 3.88Å; M349-L655 HydrophobicContact CE-CD2 3.92Å; V353-L655 HydrophobicContact CB-CD1 4.35Å; V353-L655 HydrophobicContact CG1-CD1 4.26Å; V353-L655 HydrophobicContact CG2-CD1 3.31Å; V353-L655 HydrophobicContact CG2-CD2 4.03Å; V353-L655 HydrophobicContact CG2-CG 4.3Å; I647-L655 HydrophobicContact CD1-CD2 3.76Å; I647-L655 HydrophobicContact CG1-CD2 3.94Å; L652-L655 HydrophobicContact CD2-CD2 4.27Å; L652-L655 WeakPolarHBondContact O-CB 3.35Å; L652-L655 PolarHBondContact O-N 2.78Å; L655-L657 VanDerWaalsContact C-N 3.3Å; L655-L657 PolarHBondContact O-N 3.4Å; L655-Q658 PolarHBondContact O-N 3.37Å; L655-M659 HydrophobicContact CD1-CG 3.9Å; L655-M659 HydrophobicContact CD1-SD 3.77Å; L655-M659 HydrophobicContact CD2-SD 4.48Å; L655-M659 HydrophobicContact CG-CG 4.44Å; L655-M659 HydrophobicContact CG-SD 3.9Å; L655-M659 WeakPolarHBondContact O-CB 3.45Å; L655-M659 VanDerWaalsContact O-CG 3.27Å; L655-M659 WeakPolarHBondContact O-CG 3.14Å; L655-M659 PolarHBondContact O-N 2.93Å; L655-F672 HydrophobicContact CD2-CE1 4.27Å
656	V	92.1	Very high	87.2	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-60.7	-42.8	179.2	172	0	0	0	0	110.1	L652 D654 M659 K660 V667 L681 A684 E685 L688 L694	L652-V656 HydrophobicContact CB-CG2 4.27Å; L652-V656 WeakPolarHBondContact O-CG2 3.48Å; L652-V656 PolarHBondContact O-N 3.13Å; D654-V656 PolarHBondContact O-N 2.72Å; V656-M659 PolarHBondContact O-N 2.92Å; V656-K660 HydrophobicContact CG1-CG 4.23Å; V656-K660 WeakPolarHBondContact O-CB 3.45Å; V656-K660 WeakPolarHBondContact O-CG 3.4Å; V656-K660 PolarHBondContact O-N 3.11Å; V656-V667 HydrophobicContact CG1-CG2 4.45Å; V656-L681 HydrophobicContact CG2-CD2 4Å; V656-A684 HydrophobicContact CG2-CB 4.01Å; V656-E685 HydrophobicContact CG1-CG 3.89Å; V656-L688 HydrophobicContact CB-CD1 3.91Å; V656-L688 HydrophobicContact CG1-CD1 3.66Å; V656-L694 HydrophobicContact CG1-CD1 4.49Å
657	L	92.9	Very high	87.1	Confident	1 Å²	1	29.4 Å²	29.4	1%	0.005	16%	0.163	C	C	.	.	H	α-helix	trans	-62	-46.3	177.4	-175.8	64.3	0	0	0	112	D653 D654 L655 M659 K660 A661 L688 L693 L694 I708 V715 A716 P722	D653-L657 WeakPolarHBondContact O-CB 3.39Å; D653-L657 PolarHBondContact O-N 3.25Å; D653-L657 VanDerWaalsContact O-N 3.07Å; D654-L657 PolarHBondContact O-N 2.83Å; L655-L657 VanDerWaalsContact C-N 3.3Å; L655-L657 PolarHBondContact O-N 3.4Å; L657-M659 PolarHBondContact O-N 2.96Å; L657-K660 PolarHBondContact O-N 2.7Å; L657-A661 WeakPolarHBondContact O-CB 3.07Å; L657-A661 PolarHBondContact O-N 3.24Å; L657-L688 HydrophobicContact CB-CD1 4.08Å; L657-L688 HydrophobicContact CB-CD2 4.26Å; L657-L693 HydrophobicContact CD1-CB 4.14Å; L657-L693 HydrophobicContact CD2-CD1 4.13Å; L657-L694 HydrophobicContact CD1-CD2 4.46Å; L657-I708 HydrophobicContact CD1-CD1 3.93Å; L657-I708 HydrophobicContact CD1-CG1 4.27Å; L657-V715 HydrophobicContact CD2-CB 4.36Å; L657-V715 HydrophobicContact CD2-CG1 3.77Å; L657-A716 HydrophobicContact CD2-CB 4.48Å; L657-A716 HydrophobicContact CG-CB 4.25Å; L657-P722 HydrophobicContact CB-CG 4.43Å; L657-P722 HydrophobicContact CD2-CB 4.03Å; L657-P722 HydrophobicContact CD2-CG 3.91Å
658	Q	88.1	Confident	87	Confident	20 Å²	20	32.5 Å²	32.5	9%	0.093	18%	0.184	C	C	.	.	H	α-helix	trans	-62.2	-42	177	-67.4	-61.7	-31.9	0	0	111.8	D654 L655 A661 M662 A716	D654-Q658 VanDerWaalsContact O-CG 3.26Å; D654-Q658 WeakPolarHBondContact O-CG 3.2Å; D654-Q658 PolarHBondContact O-N 2.7Å; L655-Q658 PolarHBondContact O-N 3.37Å; Q658-A661 WeakPolarHBondContact O-CB 3.39Å; Q658-A661 PolarHBondContact O-N 3.39Å; Q658-M662 WeakPolarHBondContact O-CG 3.31Å; Q658-M662 PolarHBondContact O-N 3.05Å; Q658-A716 PolarHBondContact NE2-O 2.84Å
659	M	89.5	Confident	87	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-64.5	-41.8	177	-71.2	-180	76.6	0	0	112.2	L655 V656 L657 A661 M662 I664 V667 F670 F672	L655-M659 HydrophobicContact CD1-CG 3.9Å; L655-M659 HydrophobicContact CD1-SD 3.77Å; L655-M659 HydrophobicContact CD2-SD 4.48Å; L655-M659 HydrophobicContact CG-CG 4.44Å; L655-M659 HydrophobicContact CG-SD 3.9Å; L655-M659 WeakPolarHBondContact O-CB 3.45Å; L655-M659 VanDerWaalsContact O-CG 3.27Å; L655-M659 WeakPolarHBondContact O-CG 3.14Å; L655-M659 PolarHBondContact O-N 2.93Å; V656-M659 PolarHBondContact O-N 2.92Å; L657-M659 PolarHBondContact O-N 2.96Å; M659-A661 VanDerWaalsContact C-N 3.32Å; M659-A661 PolarHBondContact O-N 2.83Å; M659-M662 HydrophobicContact CG-CE 4.17Å; M659-M662 CarbonylContact O-C 3.54Å; M659-M662 PolarHBondContact O-N 3.34Å; M659-I664 HydrophobicContact CB-CB 4.33Å; M659-I664 HydrophobicContact CB-CD1 4.32Å; M659-I664 HydrophobicContact CE-CD1 4.02Å; M659-I664 HydrophobicContact CE-CG2 4.14Å; M659-I664 HydrophobicContact CG-CD1 4.43Å; M659-I664 VanDerWaalsContact O-CB 3.3Å; M659-I664 WeakPolarHBondContact O-CB 3.31Å; M659-I664 PolarHBondContact O-N 3.34Å; M659-V667 HydrophobicContact CB-CG2 4.29Å; M659-V667 HydrophobicContact CE-CG1 3.86Å; M659-V667 HydrophobicContact SD-CG1 3.81Å; M659-F670 HydrophobicContact CE-CB 3.6Å; M659-F670 HydrophobicContact CE-CD1 3.63Å; M659-F670 HydrophobicContact CE-CD2 3.42Å; M659-F670 VanDerWaalsContact CE-CD2 3.42Å; M659-F670 HydrophobicContact CE-CE1 4.11Å; M659-F670 HydrophobicContact CE-CE2 3.93Å; M659-F670 HydrophobicContact CE-CG 3.24Å; M659-F670 HydrophobicContact CE-CZ 4.24Å; M659-F672 HydrophobicContact CE-CE1 4.17Å; M659-F672 HydrophobicContact CE-CE2 4.48Å; M659-F672 HydrophobicContact CE-CZ 3.66Å; M659-F672 HydrophobicContact SD-CE1 4.05Å; M659-F672 HydrophobicContact SD-CZ 3.7Å
660	K	91.1	Very high	87.3	Confident	3 Å²	3	32.5 Å²	32.5	1%	0.013	18%	0.182	C	C	.	.	H	α-helix	trans	-65.9	-35.5	175	-65.6	-80.3	-174.8	170.7	0	111.7	V656 L657 M662 C663 L665 V667 E685 L694 A706 I708	V656-K660 HydrophobicContact CG1-CG 4.23Å; V656-K660 WeakPolarHBondContact O-CB 3.45Å; V656-K660 WeakPolarHBondContact O-CG 3.4Å; V656-K660 PolarHBondContact O-N 3.11Å; L657-K660 PolarHBondContact O-N 2.7Å; K660-M662 VanDerWaalsContact C-N 3.28Å; K660-M662 PolarHBondContact O-N 2.87Å; K660-C663 PolarHBondContact O-N 3.22Å; K660-C663 VanDerWaalsContact O-N 3.08Å; K660-L665 PolarHBondContact NZ-O 3.24Å; K660-V667 HydrophobicContact CD-CG2 4.45Å; K660-E685 WeakPolarHBondContact CE-OE1 3.2Å; K660-E685 IonicContact NZ-OE1 2.67Å; K660-E685 PolarHBondContact NZ-OE1 3.3Å; K660-L694 HydrophobicContact CB-CD2 4.06Å; K660-L694 HydrophobicContact CG-CD1 4.41Å; K660-L694 HydrophobicContact CG-CD2 4.03Å; K660-A706 WeakPolarHBondContact CD-O 3.42Å; K660-A706 PolarHBondContact NZ-O 3.04Å; K660-I708 HydrophobicContact CB-CB 4.25Å
661	A	88.9	Confident	87.6	Confident	34 Å²	34	29.5 Å²	29.5	28%	0.281	17%	0.169	S	C	.	.	H	α-helix	trans	-65	-31.2	173.1	0	0	0	0	0	112.5	L657 Q658 M659 C663 I708 A716	L657-A661 WeakPolarHBondContact O-CB 3.07Å; L657-A661 PolarHBondContact O-N 3.24Å; Q658-A661 WeakPolarHBondContact O-CB 3.39Å; Q658-A661 PolarHBondContact O-N 3.39Å; M659-A661 VanDerWaalsContact C-N 3.32Å; M659-A661 PolarHBondContact O-N 2.83Å; A661-C663 PolarHBondContact O-N 3.05Å; A661-I708 HydrophobicContact CB-CD1 3.68Å; A661-A716 HydrophobicContact CB-CB 3.71Å
662	M	84.9	Confident	87.8	Confident	26 Å²	26	27.8 Å²	27.8	13%	0.128	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.6	17.6	170.8	-67.2	-177.4	-62.6	0	0	113.7	L324 Q328 L357 Q658 M659 K660 I664	L324-M662 HydrophobicContact CD1-CE 3.92Å; L324-M662 HydrophobicContact CD1-SD 3.77Å; L324-M662 HydrophobicContact CG-SD 4.5Å; Q328-M662 HydrophobicContact CG-CG 3.59Å; Q328-M662 HydrophobicContact CG-SD 3.94Å; L357-M662 HydrophobicContact CD1-CE 4.03Å; L357-M662 HydrophobicContact CD1-SD 4.03Å; Q658-M662 WeakPolarHBondContact O-CG 3.31Å; Q658-M662 PolarHBondContact O-N 3.05Å; M659-M662 HydrophobicContact CG-CE 4.17Å; M659-M662 CarbonylContact O-C 3.54Å; M659-M662 PolarHBondContact O-N 3.34Å; K660-M662 VanDerWaalsContact C-N 3.28Å; K660-M662 PolarHBondContact O-N 2.87Å; M662-I664 HydrophobicContact CB-CD1 4.48Å; M662-I664 HydrophobicContact CB-CG1 4.44Å; M662-I664 HydrophobicContact CE-CD1 4.32Å; M662-I664 PolarHBondContact O-N 3.33Å
663	C	83.5	Confident	87.6	Confident	77 Å²	77	27.3 Å²	27.3	52%	0.52	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.6	20.6	-178.2	-60.8	0	0	0	0	115.1	K660 A661 L665	K660-C663 PolarHBondContact O-N 3.22Å; K660-C663 VanDerWaalsContact O-N 3.08Å; A661-C663 PolarHBondContact O-N 3.05Å; C663-L665 PolarHBondContact O-N 2.82Å; C663-L665 VanDerWaalsContact O-N 3.07Å
664	I	85.8	Confident	87.4	Confident	32 Å²	32	27.7 Å²	27.7	16%	0.164	16%	0.157	C	C	.	.			trans	-82.1	88.4	172	-54.9	171.3	0	0	0	108.4	L357 M659 M662 F670	L357-I664 HydrophobicContact CD2-CD1 3.9Å; M659-I664 HydrophobicContact CB-CB 4.33Å; M659-I664 HydrophobicContact CB-CD1 4.32Å; M659-I664 HydrophobicContact CE-CD1 4.02Å; M659-I664 HydrophobicContact CE-CG2 4.14Å; M659-I664 HydrophobicContact CG-CD1 4.43Å; M659-I664 VanDerWaalsContact O-CB 3.3Å; M659-I664 WeakPolarHBondContact O-CB 3.31Å; M659-I664 PolarHBondContact O-N 3.34Å; M662-I664 HydrophobicContact CB-CD1 4.48Å; M662-I664 HydrophobicContact CB-CG1 4.44Å; M662-I664 HydrophobicContact CE-CD1 4.32Å; M662-I664 PolarHBondContact O-N 3.33Å; I664-F670 HydrophobicContact CD1-CD2 3.85Å; I664-F670 HydrophobicContact CD1-CE2 3.78Å; I664-F670 HydrophobicContact CG2-CD2 4.26Å
665	L	81.3	Confident	86.9	Confident	49 Å²	49	29.6 Å²	29.6	26%	0.257	18%	0.178	S	C	.	.			trans	-67.2	-43.5	-174.9	-61.2	-179.4	0	0	0	113	K660 C663 V705	K660-L665 PolarHBondContact NZ-O 3.24Å; C663-L665 PolarHBondContact O-N 2.82Å; C663-L665 VanDerWaalsContact O-N 3.07Å; L665-V705 HydrophobicContact CB-CG1 4.2Å
666	K	84.8	Confident	86.6	Confident	76 Å²	76	30.3 Å²	30.3	33%	0.33	18%	0.181	S	C	.	.			trans	-106	85.9	-178.5	-71.5	177.3	179	161.6	0	110	C668 N669 D699	K666-C668 PolarHBondContact O-N 3.04Å; K666-N669 HydrophobicContact CB-CB 4.32Å; K666-N669 PolarHBondContact O-N 3.46Å; K666-D699 IonicContact NZ-OD2 2.68Å; K666-D699 PolarHBondContact NZ-OD2 3.22Å
667	V	85.5	Confident	86.3	Confident	1 Å²	1	34.2 Å²	34.2	1%	0.006	20%	0.202	C	C	.	.	G	3₁₀ helix	trans	-60.3	-33.8	-177.5	-179.2	0	0	0	0	111.7	V656 M659 K660 N669 F670 F672 L681	V656-V667 HydrophobicContact CG1-CG2 4.45Å; M659-V667 HydrophobicContact CB-CG2 4.29Å; M659-V667 HydrophobicContact CE-CG1 3.86Å; M659-V667 HydrophobicContact SD-CG1 3.81Å; K660-V667 HydrophobicContact CD-CG2 4.45Å; V667-N669 PolarHBondContact O-N 3.01Å; V667-F670 WeakPolarHBondContact O-CB 3.48Å; V667-F670 PolarHBondContact O-N 3.23Å; V667-F672 HydrophobicContact CG1-CE2 4.19Å; V667-F672 HydrophobicContact CG1-CZ 3.99Å; V667-L681 HydrophobicContact CG1-CD1 4.35Å; V667-L681 HydrophobicContact CG1-CD2 3.67Å
668	C	85.5	Confident	85.9	Confident	66 Å²	66	38 Å²	38	45%	0.446	23%	0.225	S	C	.	.	G	3₁₀ helix	trans	-59.6	-26	175.4	57.7	0	0	0	0	114.5	K666 L681	K666-C668 PolarHBondContact O-N 3.04Å; C668-L681 HydrophobicContact CB-CD1 4.33Å
669	N	85.9	Confident	85.7	Confident	101 Å²	101	40.9 Å²	40.9	54%	0.54	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	-87.3	-8.3	178.6	-70.2	-10.9	0	0	0	113	K666 V667	K666-N669 HydrophobicContact CB-CB 4.32Å; K666-N669 PolarHBondContact O-N 3.46Å; V667-N669 PolarHBondContact O-N 3.01Å
670	F	88.6	Confident	85.6	Confident	12 Å²	12	42 Å²	42	5%	0.053	25%	0.249	C	C	.	.	S	Bend	trans	-64.6	137.6	-178.8	-173.8	-94.5	0	0	0	110.8	V353 G356 L357 M659 I664 V667 F672	V353-F670 HydrophobicContact CG1-CZ 4.33Å; V353-F670 WeakPolarHBondContact O-CZ 3.49Å; G356-F670 VanDerWaalsContact C-CZ 3.45Å; L357-F670 HydrophobicContact CD2-CE2 3.98Å; L357-F670 HydrophobicContact CD2-CZ 4.42Å; L357-F670 HydrophobicContact CG-CE2 4.04Å; L357-F670 HydrophobicContact CG-CZ 3.97Å; M659-F670 HydrophobicContact CE-CB 3.6Å; M659-F670 HydrophobicContact CE-CD1 3.63Å; M659-F670 HydrophobicContact CE-CD2 3.42Å; M659-F670 VanDerWaalsContact CE-CD2 3.42Å; M659-F670 HydrophobicContact CE-CE1 4.11Å; M659-F670 HydrophobicContact CE-CE2 3.93Å; M659-F670 HydrophobicContact CE-CG 3.24Å; M659-F670 HydrophobicContact CE-CZ 4.24Å; I664-F670 HydrophobicContact CD1-CD2 3.85Å; I664-F670 HydrophobicContact CD1-CE2 3.78Å; I664-F670 HydrophobicContact CG2-CD2 4.26Å; V667-F670 WeakPolarHBondContact O-CB 3.48Å; V667-F670 PolarHBondContact O-N 3.23Å; F670-F672 VanDerWaalsContact C-N 3.27Å; F670-F672 HydrophobicContact CB-CD2 4.19Å; F670-F672 HydrophobicContact CB-CE2 3.74Å; F670-F672 HydrophobicContact CB-CZ 4.1Å; F670-F672 AromaticContact CD1-CD1 3.56Å; F670-F672 HydrophobicContact CD1-CD1 3.56Å; F670-F672 AromaticContact CD1-CD2 3.81Å; F670-F672 HydrophobicContact CD1-CD2 3.81Å; F670-F672 AromaticContact CD1-CE1 3.47Å; F670-F672 HydrophobicContact CD1-CE1 3.47Å; F670-F672 VanDerWaalsContact CD1-CE1 3.47Å; F670-F672 AromaticContact CD1-CE2 3.73Å; F670-F672 HydrophobicContact CD1-CE2 3.73Å; F670-F672 AromaticContact CD1-CG 3.73Å; F670-F672 HydrophobicContact CD1-CG 3.73Å; F670-F672 AromaticContact CD1-CZ 3.57Å; F670-F672 HydrophobicContact CD1-CZ 3.57Å; F670-F672 AromaticContact CE1-CD1 3.84Å; F670-F672 HydrophobicContact CE1-CD1 3.84Å; F670-F672 AromaticContact CE1-CE1 3.84Å; F670-F672 HydrophobicContact CE1-CE1 3.84Å; F670-F672 HydrophobicContact CE1-CG 4.35Å; F670-F672 HydrophobicContact CE1-CZ 4.36Å; F670-F672 HydrophobicContact CG-CE1 4.44Å; F670-F672 HydrophobicContact CG-CE2 4.18Å; F670-F672 HydrophobicContact CG-CZ 4.15Å; F670-F672 WeakPolarHBondContact O-CD2 3.18Å; F670-F672 PolarHBondContact O-N 3.29Å
671	P	88.8	Confident	85.4	Confident	3 Å²	3	42.3 Å²	42.3	2%	0.019	25%	0.251	C	S	.	.			trans	-80.4	72.8	-177.2	34.9	-36.4	0	0	0	110.8	G356 R360 L391	G356-P671 WeakPolarHBondContact CA-O 3.48Å; G356-P671 WeakPolarHBondContact O-CG 3.14Å; R360-P671 HydrophobicContact CG-CG 4.43Å; L391-P671 HydrophobicContact CD1-CB 4.17Å; L391-P671 WeakPolarHBondContact CD1-O 3.26Å
672	F	87.7	Confident	85.3	Confident	12 Å²	12	46.4 Å²	46.4	5%	0.053	26%	0.259	C	S	.	.			trans	-66.9	140.4	171.4	-63.3	-76.9	0	0	0	110.9	V353 I647 L655 M659 V667 F670 T674 L676	V353-F672 HydrophobicContact CG2-CE1 4.17Å; I647-F672 HydrophobicContact CD1-CD1 3.63Å; I647-F672 HydrophobicContact CD1-CE1 3.76Å; I647-F672 HydrophobicContact CD1-CG 4.45Å; L655-F672 HydrophobicContact CD2-CE1 4.27Å; M659-F672 HydrophobicContact CE-CE1 4.17Å; M659-F672 HydrophobicContact CE-CE2 4.48Å; M659-F672 HydrophobicContact CE-CZ 3.66Å; M659-F672 HydrophobicContact SD-CE1 4.05Å; M659-F672 HydrophobicContact SD-CZ 3.7Å; V667-F672 HydrophobicContact CG1-CE2 4.19Å; V667-F672 HydrophobicContact CG1-CZ 3.99Å; F670-F672 VanDerWaalsContact C-N 3.27Å; F670-F672 HydrophobicContact CB-CD2 4.19Å; F670-F672 HydrophobicContact CB-CE2 3.74Å; F670-F672 HydrophobicContact CB-CZ 4.1Å; F670-F672 AromaticContact CD1-CD1 3.56Å; F670-F672 HydrophobicContact CD1-CD1 3.56Å; F670-F672 AromaticContact CD1-CD2 3.81Å; F670-F672 HydrophobicContact CD1-CD2 3.81Å; F670-F672 AromaticContact CD1-CE1 3.47Å; F670-F672 HydrophobicContact CD1-CE1 3.47Å; F670-F672 VanDerWaalsContact CD1-CE1 3.47Å; F670-F672 AromaticContact CD1-CE2 3.73Å; F670-F672 HydrophobicContact CD1-CE2 3.73Å; F670-F672 AromaticContact CD1-CG 3.73Å; F670-F672 HydrophobicContact CD1-CG 3.73Å; F670-F672 AromaticContact CD1-CZ 3.57Å; F670-F672 HydrophobicContact CD1-CZ 3.57Å; F670-F672 AromaticContact CE1-CD1 3.84Å; F670-F672 HydrophobicContact CE1-CD1 3.84Å; F670-F672 AromaticContact CE1-CE1 3.84Å; F670-F672 HydrophobicContact CE1-CE1 3.84Å; F670-F672 HydrophobicContact CE1-CG 4.35Å; F670-F672 HydrophobicContact CE1-CZ 4.36Å; F670-F672 HydrophobicContact CG-CE1 4.44Å; F670-F672 HydrophobicContact CG-CE2 4.18Å; F670-F672 HydrophobicContact CG-CZ 4.15Å; F670-F672 WeakPolarHBondContact O-CD2 3.18Å; F670-F672 PolarHBondContact O-N 3.29Å; F672-T674 WeakPolarHBondContact CB-O 2.92Å; F672-T674 PolarHBondContact O-N 2.94Å; F672-L676 HydrophobicContact CD1-CD1 4.38Å; F672-L676 HydrophobicContact CD2-CD1 3.96Å; F672-L676 HydrophobicContact CD2-CG 4.17Å; F672-L676 HydrophobicContact CE1-CD1 4.12Å; F672-L676 HydrophobicContact CE2-CD1 3.67Å; F672-L676 HydrophobicContact CE2-CG 4.36Å; F672-L676 HydrophobicContact CG-CD1 4.31Å; F672-L676 HydrophobicContact CG-CG 4.39Å; F672-L676 HydrophobicContact CZ-CD1 3.74Å
673	P	86.9	Confident	85.3	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	27%	0.267	C	S	.	.	S	Bend	trans	-58.8	-27.9	170.9	-25.3	35	0	0	0	113.2	D352 I355 F386 M388 L391	D352-P673 HydrophobicContact CB-CG 4.18Å; D352-P673 VanDerWaalsContact O-CD 3.25Å; D352-P673 WeakPolarHBondContact O-CD 3.45Å; I355-P673 HydrophobicContact CB-CG 4.14Å; I355-P673 HydrophobicContact CG2-CG 3.95Å; F386-P673 HydrophobicContact CD1-CB 4.03Å; F386-P673 HydrophobicContact CD1-CG 4.37Å; F386-P673 HydrophobicContact CE1-CB 3.9Å; F386-P673 HydrophobicContact CE1-CG 4.17Å; M388-P673 WeakPolarHBondContact CE-O 3.46Å; L391-P673 HydrophobicContact CD2-CG 4.36Å
674	T	84.6	Confident	85.6	Confident	23 Å²	23	43.6 Å²	43.6	14%	0.141	24%	0.243	C	C	.	.	S	Bend	trans	-120.1	127.8	167.1	-69.8	0	0	0	0	109.6	R347 L648 F672 L676	R347-T674 PolarHBondContact NH2-OG1 3.31Å; L648-T674 HydrophobicContact CD1-CG2 4.04Å; L648-T674 HydrophobicContact CD2-CG2 4.49Å; L648-T674 HydrophobicContact CG-CG2 4.45Å; F672-T674 WeakPolarHBondContact CB-O 2.92Å; F672-T674 PolarHBondContact O-N 2.94Å; T674-L676 PolarHBondContact O-N 3.08Å
675	A	79.3	Confident	85.8	Confident	77 Å²	77	44.3 Å²	44.3	64%	0.636	25%	0.245	S	C	*	.	P	Polyproline II helix	trans	-61.4	124.8	177.6	0	0	0	0	0	110.2
676	L	83.7	Confident	86.2	Confident	23 Å²	23	46.5 Å²	46.5	12%	0.12	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-80.9	147.9	173.2	-66.3	179.2	0	0	0	110.7	I647 L648 L652 F672 T674 L681	I647-L676 HydrophobicContact CB-CD2 4.34Å; I647-L676 HydrophobicContact CD1-CD1 3.83Å; I647-L676 HydrophobicContact CD1-CD2 3.91Å; I647-L676 HydrophobicContact CD1-CG 4.17Å; I647-L676 HydrophobicContact CG1-CD1 4.27Å; I647-L676 HydrophobicContact CG1-CD2 3.82Å; I647-L676 HydrophobicContact CG2-CD2 3.85Å; L648-L676 HydrophobicContact CD2-CD2 3.8Å; L652-L676 HydrophobicContact CD1-CD1 4.28Å; F672-L676 HydrophobicContact CD1-CD1 4.38Å; F672-L676 HydrophobicContact CD2-CD1 3.96Å; F672-L676 HydrophobicContact CD2-CG 4.17Å; F672-L676 HydrophobicContact CE1-CD1 4.12Å; F672-L676 HydrophobicContact CE2-CD1 3.67Å; F672-L676 HydrophobicContact CE2-CG 4.36Å; F672-L676 HydrophobicContact CG-CD1 4.31Å; F672-L676 HydrophobicContact CG-CG 4.39Å; F672-L676 HydrophobicContact CZ-CD1 3.74Å; T674-L676 PolarHBondContact O-N 3.08Å; L676-L681 HydrophobicContact CB-CD1 4.05Å; L676-L681 HydrophobicContact CB-CG 4.23Å; L676-L681 HydrophobicContact CD1-CD1 4.25Å; L676-L681 HydrophobicContact CD1-CD2 3.82Å; L676-L681 HydrophobicContact CD1-CG 4.13Å
677	D	84.1	Confident	86.4	Confident	82 Å²	82	43.9 Å²	43.9	44%	0.439	24%	0.242	S	C	.	.	P	Polyproline II helix	trans	-64.4	132.3	167	169.9	50.3	0	0	0	110.3	D679 S680 L681	D677-D679 VanDerWaalsContact C-N 3.3Å; D677-D679 PolarHBondContact O-N 3.37Å; D677-D679 WeakPolarHBondContact OD2-CB 2.91Å; D677-D679 PolarHBondContact OD2-N 2.7Å; D677-S680 PolarHBondContact O-N 3.48Å; D677-S680 PolarHBondContact OD2-N 3.32Å; D677-S680 PolarHBondContact OD2-OG 3.47Å; D677-L681 PolarHBondContact O-N 2.91Å
678	V	85.3	Confident	86.7	Confident	80 Å²	80	43.9 Å²	43.9	49%	0.485	24%	0.242	S	C	.	.	H	α-helix	trans	-69.2	-33.4	-174.9	-179.9	0	0	0	0	110.6	L681 R682	V678-L681 PolarHBondContact O-N 3.4Å; V678-R682 WeakPolarHBondContact O-CB 3.25Å; V678-R682 PolarHBondContact O-N 3.42Å
679	D	84.9	Confident	87.1	Confident	81 Å²	81	42.5 Å²	42.5	43%	0.433	23%	0.231	S	C	.	.	H	α-helix	trans	-70.3	-38.5	179.3	-63.9	-35.2	0	0	0	110.9	D677 L681 R682 C683	D677-D679 VanDerWaalsContact C-N 3.3Å; D677-D679 PolarHBondContact O-N 3.37Å; D677-D679 WeakPolarHBondContact OD2-CB 2.91Å; D677-D679 PolarHBondContact OD2-N 2.7Å; D679-L681 VanDerWaalsContact C-N 3.35Å; D679-L681 PolarHBondContact O-N 2.86Å; D679-R682 PolarHBondContact O-N 2.92Å; D679-R682 IonicContact OD1-CZ 3.79Å; D679-R682 IonicContact OD1-NH1 3.11Å; D679-R682 PolarHBondContact OD1-NH1 2.81Å; D679-R682 IonicContact OD1-NH2 3.53Å; D679-R682 PolarHBondContact OD1-NH2 2.9Å; D679-C683 WeakPolarHBondContact O-CB 3.4Å; D679-C683 PolarHBondContact O-N 2.83Å; D679-C683 PolarHBondContact O-SG 2.76Å
680	S	85.6	Confident	87.3	Confident	24 Å²	24	41 Å²	41	17%	0.168	22%	0.22	C	C	.	.	H	α-helix	trans	-60.1	-40.8	173.4	-61	0	0	0	0	112.9	D677 A684	D677-S680 PolarHBondContact O-N 3.48Å; D677-S680 PolarHBondContact OD2-N 3.32Å; D677-S680 PolarHBondContact OD2-OG 3.47Å; S680-A684 PolarHBondContact O-N 3.03Å; S680-A684 VanDerWaalsContact O-N 3.16Å
681	L	87.8	Confident	87.4	Confident	9 Å²	9	40.6 Å²	40.6	5%	0.047	22%	0.218	C	C	.	.	H	α-helix	trans	-67.4	-44.5	173.8	-77.1	174.2	0	0	0	112.1	L652 V656 V667 C668 L676 D677 V678 D679 C683 A684 E685	L652-L681 HydrophobicContact CD1-CD2 4Å; L652-L681 HydrophobicContact CD1-CG 4.42Å; V656-L681 HydrophobicContact CG2-CD2 4Å; V667-L681 HydrophobicContact CG1-CD1 4.35Å; V667-L681 HydrophobicContact CG1-CD2 3.67Å; C668-L681 HydrophobicContact CB-CD1 4.33Å; L676-L681 HydrophobicContact CB-CD1 4.05Å; L676-L681 HydrophobicContact CB-CG 4.23Å; L676-L681 HydrophobicContact CD1-CD1 4.25Å; L676-L681 HydrophobicContact CD1-CD2 3.82Å; L676-L681 HydrophobicContact CD1-CG 4.13Å; D677-L681 PolarHBondContact O-N 2.91Å; V678-L681 PolarHBondContact O-N 3.4Å; D679-L681 VanDerWaalsContact C-N 3.35Å; D679-L681 PolarHBondContact O-N 2.86Å; L681-C683 VanDerWaalsContact C-N 3.34Å; L681-C683 PolarHBondContact O-N 3.34Å; L681-A684 PolarHBondContact O-N 2.52Å; L681-E685 PolarHBondContact O-N 3.11Å
682	R	86.6	Confident	87.6	Confident	120 Å²	120	42 Å²	42	45%	0.453	23%	0.234	S	C	.	.	H	α-helix	trans	-60.1	-45.3	177.2	-169.2	-172.2	-56.6	124.6	13.2	111.1	V678 D679 A684 E685 E686	V678-R682 WeakPolarHBondContact O-CB 3.25Å; V678-R682 PolarHBondContact O-N 3.42Å; D679-R682 PolarHBondContact O-N 2.92Å; D679-R682 IonicContact OD1-CZ 3.79Å; D679-R682 IonicContact OD1-NH1 3.11Å; D679-R682 PolarHBondContact OD1-NH1 2.81Å; D679-R682 IonicContact OD1-NH2 3.53Å; D679-R682 PolarHBondContact OD1-NH2 2.9Å; R682-A684 VanDerWaalsContact C-N 3.31Å; R682-A684 PolarHBondContact O-N 2.67Å; R682-E685 PolarHBondContact O-N 2.72Å; R682-E686 WeakPolarHBondContact O-CB 3.49Å; R682-E686 WeakPolarHBondContact O-CG 3.17Å; R682-E686 PolarHBondContact O-N 2.93Å
683	C	85.9	Confident	87.9	Confident	45 Å²	45	41.4 Å²	41.4	30%	0.304	23%	0.231	S	C	.	.	H	α-helix	trans	-59.5	-41	176.5	-68.3	0	0	0	0	111.6	D679 L681 E686 R687	D679-C683 WeakPolarHBondContact O-CB 3.4Å; D679-C683 PolarHBondContact O-N 2.83Å; D679-C683 PolarHBondContact O-SG 2.76Å; L681-C683 VanDerWaalsContact C-N 3.34Å; L681-C683 PolarHBondContact O-N 3.34Å; C683-E686 PolarHBondContact O-N 3.44Å; C683-R687 VanDerWaalsContact O-CG 3.29Å; C683-R687 WeakPolarHBondContact O-CG 3.31Å; C683-R687 PolarHBondContact O-N 3.16Å
684	A	89.3	Confident	88.3	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-66.7	-41.7	176.3	0	0	0	0	0	112.5	L652 V656 S680 L681 R682 R687 L688	L652-A684 HydrophobicContact CB-CB 3.96Å; V656-A684 HydrophobicContact CG2-CB 4.01Å; S680-A684 PolarHBondContact O-N 3.03Å; S680-A684 VanDerWaalsContact O-N 3.16Å; L681-A684 PolarHBondContact O-N 2.52Å; R682-A684 VanDerWaalsContact C-N 3.31Å; R682-A684 PolarHBondContact O-N 2.67Å; A684-R687 PolarHBondContact O-N 2.9Å; A684-L688 WeakPolarHBondContact O-CG 3.43Å; A684-L688 PolarHBondContact O-N 3.49Å
685	E	90.5	Very high	88.6	Confident	46 Å²	46	45.4 Å²	45.4	22%	0.215	25%	0.248	C	C	.	.	H	α-helix	trans	-61.2	-46.8	173.8	-71.8	-172.4	154.4	0	0	111.4	V656 K660 L681 R682 R687 L688 V689	V656-E685 HydrophobicContact CG1-CG 3.89Å; K660-E685 WeakPolarHBondContact CE-OE1 3.2Å; K660-E685 IonicContact NZ-OE1 2.67Å; K660-E685 PolarHBondContact NZ-OE1 3.3Å; L681-E685 PolarHBondContact O-N 3.11Å; R682-E685 PolarHBondContact O-N 2.72Å; E685-R687 VanDerWaalsContact C-N 3.34Å; E685-R687 PolarHBondContact O-N 3.05Å; E685-L688 PolarHBondContact O-N 3.26Å; E685-V689 WeakPolarHBondContact O-CG2 3.32Å; E685-V689 PolarHBondContact O-N 3.19Å
686	E	88.3	Confident	89	Confident	95 Å²	95	46.7 Å²	46.7	44%	0.444	24%	0.244	S	C	.	.	H	α-helix	trans	-58.6	-43.2	176.9	-74.3	174.3	-168.4	0	0	112.1	R682 C683 V689 K690	R682-E686 WeakPolarHBondContact O-CB 3.49Å; R682-E686 WeakPolarHBondContact O-CG 3.17Å; R682-E686 PolarHBondContact O-N 2.93Å; C683-E686 PolarHBondContact O-N 3.44Å; E686-V689 PolarHBondContact O-N 3.41Å; E686-K690 VanDerWaalsContact O-CG 3.31Å; E686-K690 WeakPolarHBondContact O-CG 3.35Å; E686-K690 PolarHBondContact O-N 3.16Å
687	R	88.6	Confident	88.9	Confident	22 Å²	22	46.6 Å²	46.6	8%	0.083	25%	0.247	C	C	.	.	H	α-helix	trans	-61.8	-43.2	175.7	-72.9	-166	-63.2	-95.9	2	112.2	D653 C683 A684 E685 V689 K690 L691 E872	D653-R687 WeakPolarHBondContact OD1-CB 3.49Å; D653-R687 IonicContact OD1-CZ 3.2Å; D653-R687 IonicContact OD1-NE 3.05Å; D653-R687 PolarHBondContact OD1-NE 3.34Å; D653-R687 IonicContact OD1-NH2 3.7Å; D653-R687 PolarHBondContact OD1-NH2 2.94Å; D653-R687 IonicContact OD2-CZ 3.65Å; D653-R687 IonicContact OD2-NE 3.64Å; D653-R687 IonicContact OD2-NH2 3.2Å; D653-R687 PolarHBondContact OD2-NH2 3.31Å; C683-R687 VanDerWaalsContact O-CG 3.29Å; C683-R687 WeakPolarHBondContact O-CG 3.31Å; C683-R687 PolarHBondContact O-N 3.16Å; A684-R687 PolarHBondContact O-N 2.9Å; E685-R687 VanDerWaalsContact C-N 3.34Å; E685-R687 PolarHBondContact O-N 3.05Å; R687-V689 VanDerWaalsContact C-N 3.34Å; R687-V689 PolarHBondContact O-N 3.22Å; R687-K690 PolarHBondContact O-N 3.46Å; R687-L691 WeakPolarHBondContact O-CG 3.19Å; R687-L691 PolarHBondContact O-N 2.83Å; R687-E872 WeakPolarHBondContact CD-OE2 3.47Å; R687-E872 WeakPolarHBondContact CG-OE1 3.35Å; R687-E872 WeakPolarHBondContact CG-OE2 3.19Å
688	L	93.1	Very high	88.7	Confident	0 Å²	0	48 Å²	48	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-68.4	-32	177	-67.3	170.8	0	0	0	112.7	D653 V656 L657 A684 E685 L691 G692 L693 L694 P722	D653-L688 HydrophobicContact CB-CD2 4.41Å; V656-L688 HydrophobicContact CB-CD1 3.91Å; V656-L688 HydrophobicContact CG1-CD1 3.66Å; L657-L688 HydrophobicContact CB-CD1 4.08Å; L657-L688 HydrophobicContact CB-CD2 4.26Å; A684-L688 WeakPolarHBondContact O-CG 3.43Å; A684-L688 PolarHBondContact O-N 3.49Å; E685-L688 PolarHBondContact O-N 3.26Å; L688-L691 HydrophobicContact CD2-CD1 4.45Å; L688-L691 PolarHBondContact O-N 3.02Å; L688-G692 PolarHBondContact O-N 3.31Å; L688-L693 HydrophobicContact CD2-CD1 4.01Å; L688-L693 PolarHBondContact O-N 3.24Å; L688-L694 HydrophobicContact CB-CB 4.37Å; L688-L694 HydrophobicContact CB-CD1 3.66Å; L688-L694 HydrophobicContact CB-CG 3.71Å; L688-L694 HydrophobicContact CD1-CD1 3.8Å; L688-L694 HydrophobicContact CD1-CG 4.28Å; L688-L694 HydrophobicContact CG-CD1 4.42Å; L688-L694 PolarHBondContact O-N 3.21Å; L688-P722 HydrophobicContact CD2-CB 3.76Å; L688-P722 HydrophobicContact CD2-CG 3.97Å
689	V	92.9	Very high	88.1	Confident	37 Å²	37	45 Å²	45	22%	0.224	24%	0.235	C	C	.	.	H	α-helix	trans	-66	-45.3	171	172.1	0	0	0	0	110.7	E685 E686 R687 L691 G692 L694 A706	E685-V689 WeakPolarHBondContact O-CG2 3.32Å; E685-V689 PolarHBondContact O-N 3.19Å; E686-V689 PolarHBondContact O-N 3.41Å; R687-V689 VanDerWaalsContact C-N 3.34Å; R687-V689 PolarHBondContact O-N 3.22Å; V689-L691 PolarHBondContact O-N 3.48Å; V689-G692 WeakPolarHBondContact O-CA 3.41Å; V689-G692 PolarHBondContact O-N 2.95Å; V689-L694 WeakPolarHBondContact CA-O 3.49Å; V689-L694 HydrophobicContact CG2-CB 3.75Å; V689-A706 HydrophobicContact CG2-CB 4.4Å
690	K	89.9	Confident	87.7	Confident	71 Å²	71	44.7 Å²	44.7	31%	0.309	24%	0.239	S	C	.	.	H	α-helix	trans	-60.4	-33	174.6	-69.5	171.9	-173	174.8	0	112.6	E686 R687 G692 E872	E686-K690 VanDerWaalsContact O-CG 3.31Å; E686-K690 WeakPolarHBondContact O-CG 3.35Å; E686-K690 PolarHBondContact O-N 3.16Å; R687-K690 PolarHBondContact O-N 3.46Å; K690-G692 VanDerWaalsContact C-N 3.26Å; K690-G692 PolarHBondContact O-N 3.01Å; K690-E872 WeakPolarHBondContact CD-OE1 3.22Å; K690-E872 IonicContact NZ-OE1 3.36Å; K690-E872 PolarHBondContact NZ-OE1 2.82Å; K690-E872 VanDerWaalsContact NZ-OE1 3.16Å
691	L	91.7	Very high	87.1	Confident	2 Å²	2	48 Å²	48	1%	0.01	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-12.3	173	-71.2	170.5	0	0	0	113.2	R687 L688 V689 L693 P722 R723 K726	R687-L691 WeakPolarHBondContact O-CG 3.19Å; R687-L691 PolarHBondContact O-N 2.83Å; L688-L691 HydrophobicContact CD2-CD1 4.45Å; L688-L691 PolarHBondContact O-N 3.02Å; V689-L691 PolarHBondContact O-N 3.48Å; L691-L693 VanDerWaalsContact C-N 3.27Å; L691-L693 HydrophobicContact CB-CD1 4.15Å; L691-L693 HydrophobicContact CB-CG 3.93Å; L691-L693 HydrophobicContact CD1-CD1 4.26Å; L691-P722 HydrophobicContact CD1-CB 4.41Å; L691-R723 HydrophobicContact CD1-CG 4Å; L691-R723 HydrophobicContact CD2-CG 4.4Å; L691-K726 HydrophobicContact CB-CD 4.46Å; L691-K726 HydrophobicContact CD2-CD 4.31Å; L691-K726 VanDerWaalsContact O-CD 3.29Å; L691-K726 WeakPolarHBondContact O-CD 3.45Å; L691-K726 WeakPolarHBondContact O-CE 3.45Å; L691-K726 PolarHBondContact O-NZ 3Å
692	G	92.3	Very high	86.5	Confident	33 Å²	33	50 Å²	50	34%	0.34	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	75	14.9	-176.1	0	0	0	0	0	113.9	L688 V689 K690 T709	L688-G692 PolarHBondContact O-N 3.31Å; V689-G692 WeakPolarHBondContact O-CA 3.41Å; V689-G692 PolarHBondContact O-N 2.95Å; K690-G692 VanDerWaalsContact C-N 3.26Å; K690-G692 PolarHBondContact O-N 3.01Å; G692-T709 PolarHBondContact O-OG1 3.43Å
693	L	94.6	Very high	86	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	29%	0.285	C	S	.	.	S	Bend	trans	-87.1	-25.1	177	-55.7	-178.7	0	0	0	111.5	L657 L688 L691 T709 L711 G712 V715 P722 K726	L657-L693 HydrophobicContact CD1-CB 4.14Å; L657-L693 HydrophobicContact CD2-CD1 4.13Å; L688-L693 HydrophobicContact CD2-CD1 4.01Å; L688-L693 PolarHBondContact O-N 3.24Å; L691-L693 VanDerWaalsContact C-N 3.27Å; L691-L693 HydrophobicContact CB-CD1 4.15Å; L691-L693 HydrophobicContact CB-CG 3.93Å; L691-L693 HydrophobicContact CD1-CD1 4.26Å; L693-T709 PolarHBondContact O-N 3.3Å; L693-T709 PolarHBondContact O-OG1 2.79Å; L693-T709 VanDerWaalsContact O-OG1 3.13Å; L693-L711 HydrophobicContact CD2-CD2 4.07Å; L693-L711 HydrophobicContact CD2-CG 3.88Å; L693-G712 WeakPolarHBondContact O-CA 3.38Å; L693-V715 HydrophobicContact CD1-CG1 4.08Å; L693-V715 HydrophobicContact CD2-CB 4.12Å; L693-V715 HydrophobicContact CD2-CG1 4.42Å; L693-V715 HydrophobicContact CD2-CG2 3.72Å; L693-P722 HydrophobicContact CD1-CB 3.6Å; L693-K726 HydrophobicContact CD2-CB 4.43Å
694	L	94.3	Very high	85.5	Confident	3 Å²	3	56.6 Å²	56.6	2%	0.016	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	156.5	167.5	-57.3	-178.9	0	0	0	110.1	V656 L657 K660 L688 V689 A706 R707 I708	V656-L694 HydrophobicContact CG1-CD1 4.49Å; L657-L694 HydrophobicContact CD1-CD2 4.46Å; K660-L694 HydrophobicContact CB-CD2 4.06Å; K660-L694 HydrophobicContact CG-CD1 4.41Å; K660-L694 HydrophobicContact CG-CD2 4.03Å; L688-L694 HydrophobicContact CB-CB 4.37Å; L688-L694 HydrophobicContact CB-CD1 3.66Å; L688-L694 HydrophobicContact CB-CG 3.71Å; L688-L694 HydrophobicContact CD1-CD1 3.8Å; L688-L694 HydrophobicContact CD1-CG 4.28Å; L688-L694 HydrophobicContact CG-CD1 4.42Å; L688-L694 PolarHBondContact O-N 3.21Å; V689-L694 WeakPolarHBondContact CA-O 3.49Å; V689-L694 HydrophobicContact CG2-CB 3.75Å; L694-A706 HydrophobicContact CB-CB 4.29Å; L694-A706 HydrophobicContact CD1-CB 3.99Å; L694-R707 CarbonylContact C-O 3.49Å; L694-R707 WeakPolarHBondContact CA-O 3.2Å; L694-I708 HydrophobicContact CD2-CB 3.99Å; L694-I708 HydrophobicContact CD2-CG1 4.25Å
695	E	91.5	Very high	85.3	Confident	103 Å²	103	57.2 Å²	57.2	48%	0.481	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	142.9	172.2	64.1	-174	-176.6	0	0	110.1	A697 A706 R707 T709	E695-A697 PolarHBondContact O-N 2.99Å; E695-A706 CarbonylContact O-C 3.59Å; E695-A706 WeakPolarHBondContact O-CA 3.39Å; E695-R707 HydrophobicContact CG-CB 4.3Å; E695-R707 PolarHBondContact N-O 2.74Å; E695-R707 PolarHBondContact O-N 2.85Å; E695-T709 HydrophobicContact CB-CG2 3.89Å; E695-T709 HydrophobicContact CG-CG2 4.06Å
696	N	87.4	Confident	85.1	Confident	105 Å²	105	55.2 Å²	55.2	56%	0.561	30%	0.297	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.4	111.7	173.9	-70.4	-26.1	0	0	0	108.7
697	A	82.4	Confident	85.2	Confident	21 Å²	21	53.5 Å²	53.5	17%	0.174	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	163.8	174.4	0	0	0	0	0	110.1	E695 Q704 V705 R707	E695-A697 PolarHBondContact O-N 2.99Å; A697-Q704 CarbonylContact O-C 3.58Å; A697-Q704 WeakPolarHBondContact O-CA 3.08Å; A697-V705 PolarHBondContact N-O 3.32Å; A697-V705 PolarHBondContact O-N 3.31Å; A697-V705 VanDerWaalsContact O-O 3.13Å; A697-R707 HydrophobicContact CB-CG 4.04Å
698	L	80	Confident	85.5	Confident	110 Å²	110	53.5 Å²	53.5	58%	0.576	29%	0.288	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.3	133.8	168.5	-60.4	176.1	0	0	0	109	R703 Q704	L698-R703 CarbonylContact C-O 3.5Å; L698-R703 WeakPolarHBondContact CA-O 3.43Å; L698-Q704 HydrophobicContact CD2-CG 3.91Å
699	D	73.1	Confident	85.5	Confident	19 Å²	19	54.4 Å²	54.4	10%	0.102	29%	0.294	C	S	.	.			trans	-71.1	170	166.4	71.1	9.5	0	0	0	110.9	K666 N701 G702 R703 V705	K666-D699 IonicContact NZ-OD2 2.68Å; K666-D699 PolarHBondContact NZ-OD2 3.22Å; D699-N701 PolarHBondContact O-N 2.97Å; D699-N701 VanDerWaalsContact OD1-C 3.29Å; D699-N701 WeakPolarHBondContact OD1-CA 3.37Å; D699-N701 WeakPolarHBondContact OD1-CB 3.25Å; D699-N701 PolarHBondContact OD1-N 3.28Å; D699-G702 PolarHBondContact O-N 3.35Å; D699-G702 PolarHBondContact OD1-N 3.01Å; D699-R703 PolarHBondContact N-O 3.4Å; D699-R703 WeakPolarHBondContact OD1-CA 3.24Å; D699-R703 WeakPolarHBondContact OD1-CB 2.87Å; D699-R703 PolarHBondContact OD1-N 3.42Å; D699-V705 HydrophobicContact CB-CG2 3.84Å
700	S	75.6	Confident	85.5	Confident	74 Å²	74	61.7 Å²	61.7	52%	0.517	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.5	-22.4	175.2	41.7	0	0	0	0	113.8	D134	D134-S700 VanDerWaalsContact OD2-CB 3.26Å; D134-S700 WeakPolarHBondContact OD2-CB 3.41Å; D134-S700 PolarHBondContact OD2-OG 3.1Å
701	N	73.6	Confident	85.7	Confident	94 Å²	94	60.6 Å²	60.6	50%	0.503	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.7	9.8	177.9	-64.2	-54.3	0	0	0	113.4	D699 R703	D699-N701 PolarHBondContact O-N 2.97Å; D699-N701 VanDerWaalsContact OD1-C 3.29Å; D699-N701 WeakPolarHBondContact OD1-CA 3.37Å; D699-N701 WeakPolarHBondContact OD1-CB 3.25Å; D699-N701 PolarHBondContact OD1-N 3.28Å; N701-R703 VanDerWaalsContact C-N 3.29Å; N701-R703 HydrophobicContact CB-CG 4.44Å; N701-R703 PolarHBondContact O-N 3.09Å
702	G	74.2	Confident	85.8	Confident	50 Å²	50	60.5 Å²	60.5	52%	0.515	32%	0.319	S	S	.	.	S	Bend	trans	72.2	14.6	179.4	0	0	0	0	0	114.8	D699	D699-G702 PolarHBondContact O-N 3.35Å; D699-G702 PolarHBondContact OD1-N 3.01Å
703	R	76.1	Confident	85.8	Confident	160 Å²	160	66.4 Å²	66.4	60%	0.604	33%	0.331	S	S	*	.			trans	-90.8	141.4	177.9	-53.1	-179.8	-177.1	-179	4.6	110	L698 D699 N701 V705	L698-R703 CarbonylContact C-O 3.5Å; L698-R703 WeakPolarHBondContact CA-O 3.43Å; D699-R703 PolarHBondContact N-O 3.4Å; D699-R703 WeakPolarHBondContact OD1-CA 3.24Å; D699-R703 WeakPolarHBondContact OD1-CB 2.87Å; D699-R703 PolarHBondContact OD1-N 3.42Å; N701-R703 VanDerWaalsContact C-N 3.29Å; N701-R703 HydrophobicContact CB-CG 4.44Å; N701-R703 PolarHBondContact O-N 3.09Å; R703-V705 PolarHBondContact O-N 3.04Å
704	Q	76.5	Confident	85.6	Confident	144 Å²	144	69.7 Å²	69.7	67%	0.673	35%	0.351	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.9	125.6	174.7	-67.2	-173.2	15.9	0	0	110.5	A697 L698	A697-Q704 CarbonylContact O-C 3.58Å; A697-Q704 WeakPolarHBondContact O-CA 3.08Å; L698-Q704 HydrophobicContact CD2-CG 3.91Å
705	V	84.1	Confident	85.6	Confident	12 Å²	12	69.7 Å²	69.7	7%	0.073	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	128.7	176.6	-179.9	0	0	0	0	108.5	L665 A697 D699 R703 R707	L665-V705 HydrophobicContact CB-CG1 4.2Å; A697-V705 PolarHBondContact N-O 3.32Å; A697-V705 PolarHBondContact O-N 3.31Å; A697-V705 VanDerWaalsContact O-O 3.13Å; D699-V705 HydrophobicContact CB-CG2 3.84Å; R703-V705 PolarHBondContact O-N 3.04Å; V705-R707 PolarHBondContact O-N 3.13Å
706	A	87.9	Confident	85.6	Confident	4 Å²	4	65.1 Å²	65.1	3%	0.033	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	116.6	173.6	0	0	0	0	0	110.3	K660 V689 L694 E695	K660-A706 WeakPolarHBondContact CD-O 3.42Å; K660-A706 PolarHBondContact NZ-O 3.04Å; V689-A706 HydrophobicContact CG2-CB 4.4Å; L694-A706 HydrophobicContact CB-CB 4.29Å; L694-A706 HydrophobicContact CD1-CB 3.99Å; E695-A706 CarbonylContact O-C 3.59Å; E695-A706 WeakPolarHBondContact O-CA 3.39Å
707	R	90.2	Very high	85.6	Confident	60 Å²	60	64.4 Å²	64.4	23%	0.226	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	151	176.2	-70	-173.9	176.3	-178	-2.9	110.6	L694 E695 A697 V705	L694-R707 CarbonylContact C-O 3.49Å; L694-R707 WeakPolarHBondContact CA-O 3.2Å; E695-R707 HydrophobicContact CG-CB 4.3Å; E695-R707 PolarHBondContact N-O 2.74Å; E695-R707 PolarHBondContact O-N 2.85Å; A697-R707 HydrophobicContact CB-CG 4.04Å; V705-R707 PolarHBondContact O-N 3.13Å
708	I	93.5	Very high	85.9	Confident	21 Å²	21	63.7 Å²	63.7	11%	0.108	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	129.7	178.9	-167.9	169	0	0	0	111.3	L657 K660 A661 L694 R713	L657-I708 HydrophobicContact CD1-CD1 3.93Å; L657-I708 HydrophobicContact CD1-CG1 4.27Å; K660-I708 HydrophobicContact CB-CB 4.25Å; A661-I708 HydrophobicContact CB-CD1 3.68Å; L694-I708 HydrophobicContact CD2-CB 3.99Å; L694-I708 HydrophobicContact CD2-CG1 4.25Å; I708-R713 HydrophobicContact CD1-CG 3.91Å; I708-R713 HydrophobicContact CG1-CG 4Å; I708-R713 HydrophobicContact CG2-CG 3.98Å
709	T	94.4	Very high	86.1	Confident	20 Å²	20	59.6 Å²	59.6	12%	0.123	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-78.3	166.5	177.8	66.5	0	0	0	0	111	G692 L693 E695 L711 G712 R713	G692-T709 PolarHBondContact O-OG1 3.43Å; L693-T709 PolarHBondContact O-N 3.3Å; L693-T709 PolarHBondContact O-OG1 2.79Å; L693-T709 VanDerWaalsContact O-OG1 3.13Å; E695-T709 HydrophobicContact CB-CG2 3.89Å; E695-T709 HydrophobicContact CG-CG2 4.06Å; T709-L711 VanDerWaalsContact C-N 3.26Å; T709-L711 PolarHBondContact O-N 2.73Å; T709-G712 WeakPolarHBondContact O-CA 3.48Å; T709-G712 PolarHBondContact O-N 2.85Å; T709-G712 VanDerWaalsContact O-N 3.08Å; T709-G712 PolarHBondContact OG1-N 3.28Å; T709-R713 PolarHBondContact O-N 3.1Å
710	K	93.2	Very high	86.9	Confident	190 Å²	190	59.3 Å²	59.3	83%	0.826	30%	0.298	S	S	*	.	H	α-helix	trans	-54.9	-44.9	172.1	-68.4	-173.6	179.6	-174.7	0	111.1	G712 R713 T714	K710-G712 PolarHBondContact O-N 3.13Å; K710-R713 PolarHBondContact O-N 3.11Å; K710-T714 PolarHBondContact O-N 3.38Å; K710-T714 PolarHBondContact O-OG1 2.83Å
711	L	93	Very high	87.6	Confident	48 Å²	48	57.9 Å²	57.9	25%	0.251	29%	0.291	S	S	.	.	H	α-helix	trans	-60	-45.1	173.7	179.5	64.2	0	0	0	111.7	L693 T709 R713 T714 V715 K726 A729 L730	L693-L711 HydrophobicContact CD2-CD2 4.07Å; L693-L711 HydrophobicContact CD2-CG 3.88Å; T709-L711 VanDerWaalsContact C-N 3.26Å; T709-L711 PolarHBondContact O-N 2.73Å; L711-R713 VanDerWaalsContact C-N 3.31Å; L711-R713 PolarHBondContact O-N 3.13Å; L711-T714 PolarHBondContact O-N 3.28Å; L711-V715 HydrophobicContact CD1-CG2 4.36Å; L711-V715 HydrophobicContact CG-CG2 4.48Å; L711-V715 WeakPolarHBondContact O-CG2 3.48Å; L711-V715 PolarHBondContact O-N 3.17Å; L711-K726 HydrophobicContact CD2-CG 4.47Å; L711-A729 HydrophobicContact CD1-CB 3.76Å; L711-L730 HydrophobicContact CD1-CD2 4.43Å
712	G	93.8	Very high	88.5	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-56.1	-42	176.1	0	0	0	0	0	113.2	L693 T709 K710 V715 A716	L693-G712 WeakPolarHBondContact O-CA 3.38Å; T709-G712 WeakPolarHBondContact O-CA 3.48Å; T709-G712 PolarHBondContact O-N 2.85Å; T709-G712 VanDerWaalsContact O-N 3.08Å; T709-G712 PolarHBondContact OG1-N 3.28Å; K710-G712 PolarHBondContact O-N 3.13Å; G712-V715 PolarHBondContact O-N 3.43Å; G712-A716 WeakPolarHBondContact O-CB 3.35Å; G712-A716 PolarHBondContact O-N 2.73Å
713	R	91.9	Very high	89.4	Confident	156 Å²	156	54 Å²	54	59%	0.589	26%	0.255	S	S	*	.	H	α-helix	trans	-63.6	-44.5	176.4	-67.1	-174.7	-165.5	-157.9	3.7	111.8	I708 T709 K710 L711 V715 A716 L717	I708-R713 HydrophobicContact CD1-CG 3.91Å; I708-R713 HydrophobicContact CG1-CG 4Å; I708-R713 HydrophobicContact CG2-CG 3.98Å; T709-R713 PolarHBondContact O-N 3.1Å; K710-R713 PolarHBondContact O-N 3.11Å; L711-R713 VanDerWaalsContact C-N 3.31Å; L711-R713 PolarHBondContact O-N 3.13Å; R713-V715 VanDerWaalsContact C-N 3.32Å; R713-V715 PolarHBondContact O-N 3Å; R713-A716 PolarHBondContact O-N 2.97Å; R713-L717 PolarHBondContact O-N 3Å
714	T	91.6	Very high	90.3	Very high	70 Å²	70	47.8 Å²	47.8	43%	0.429	23%	0.232	S	C	.	.	H	α-helix	trans	-61	-43.1	175.8	-52.4	0	0	0	0	111.4	K710 L711 A716 L717 A729	K710-T714 PolarHBondContact O-N 3.38Å; K710-T714 PolarHBondContact O-OG1 2.83Å; L711-T714 PolarHBondContact O-N 3.28Å; T714-A716 PolarHBondContact O-N 3.14Å; T714-L717 PolarHBondContact O-N 3.26Å; T714-A729 HydrophobicContact CG2-CB 4.49Å
715	V	93.3	Very high	91.1	Very high	2 Å²	2	41 Å²	41	1%	0.012	20%	0.2	C	C	.	.	H	α-helix	trans	-65	-38.4	178.5	172.1	0	0	0	0	111.9	L657 L693 L711 G712 R713 L717 L718 K726 A729	L657-V715 HydrophobicContact CD2-CB 4.36Å; L657-V715 HydrophobicContact CD2-CG1 3.77Å; L693-V715 HydrophobicContact CD1-CG1 4.08Å; L693-V715 HydrophobicContact CD2-CB 4.12Å; L693-V715 HydrophobicContact CD2-CG1 4.42Å; L693-V715 HydrophobicContact CD2-CG2 3.72Å; L711-V715 HydrophobicContact CD1-CG2 4.36Å; L711-V715 HydrophobicContact CG-CG2 4.48Å; L711-V715 WeakPolarHBondContact O-CG2 3.48Å; L711-V715 PolarHBondContact O-N 3.17Å; G712-V715 PolarHBondContact O-N 3.43Å; R713-V715 VanDerWaalsContact C-N 3.32Å; R713-V715 PolarHBondContact O-N 3Å; V715-L717 PolarHBondContact O-N 3.1Å; V715-L718 WeakPolarHBondContact O-CB 3.37Å; V715-L718 PolarHBondContact O-N 3.47Å; V715-K726 HydrophobicContact CG2-CB 4.49Å; V715-A729 HydrophobicContact CG2-CB 4.04Å
716	A	91.1	Very high	91.7	Very high	7 Å²	7	41.2 Å²	41.2	6%	0.058	20%	0.2	C	C	.	.	H	α-helix	trans	-62.3	-25.1	178.5	0	0	0	0	0	113.7	L657 Q658 A661 G712 R713 T714 L718	L657-A716 HydrophobicContact CD2-CB 4.48Å; L657-A716 HydrophobicContact CG-CB 4.25Å; Q658-A716 PolarHBondContact NE2-O 2.84Å; A661-A716 HydrophobicContact CB-CB 3.71Å; G712-A716 WeakPolarHBondContact O-CB 3.35Å; G712-A716 PolarHBondContact O-N 2.73Å; R713-A716 PolarHBondContact O-N 2.97Å; T714-A716 PolarHBondContact O-N 3.14Å; A716-L718 VanDerWaalsContact C-N 3.32Å
717	L	87.5	Confident	92	Very high	90 Å²	90	41 Å²	41	47%	0.471	20%	0.198	S	C	.	.	H	α-helix	trans	-74.3	-25.3	176	-62	172.9	0	0	0	112.6	R713 T714 V715 L839	R713-L717 PolarHBondContact O-N 3Å; T714-L717 PolarHBondContact O-N 3.26Å; V715-L717 PolarHBondContact O-N 3.1Å; L717-L839 HydrophobicContact CB-CD1 4.06Å; L717-L839 HydrophobicContact CB-CD2 4.34Å; L717-L839 HydrophobicContact CD1-CD2 3.87Å
718	L	88.3	Confident	92.2	Very high	7 Å²	7	38.4 Å²	38.4	4%	0.037	19%	0.189	C	C	.	.	S	Bend	trans	-80.9	132.1	-179.8	-60.8	176.5	0	0	0	109.9	V715 A716 L720 V728 I835 V836 L839	V715-L718 WeakPolarHBondContact O-CB 3.37Å; V715-L718 PolarHBondContact O-N 3.47Å; A716-L718 VanDerWaalsContact C-N 3.32Å; L718-L720 HydrophobicContact CB-CD1 4.35Å; L718-L720 PolarHBondContact O-N 3.4Å; L718-V728 HydrophobicContact CD1-CB 4.01Å; L718-V728 HydrophobicContact CD1-CG1 4.09Å; L718-I835 HydrophobicContact CD2-CG2 4.27Å; L718-V836 HydrophobicContact CD2-CG2 4.36Å; L718-L839 HydrophobicContact CD2-CD1 3.85Å
719	P	85.1	Confident	92.1	Very high	24 Å²	24	38.5 Å²	38.5	16%	0.156	19%	0.193	C	C	.	.	S	Bend	trans	-89.3	59.4	-175.9	41.6	-42.2	0	0	0	110.9	R304 F305 L832 I835	R304-P719 PolarHBondContact NH2-O 3.48Å; F305-P719 HydrophobicContact CZ-CG 4.43Å; P719-L832 HydrophobicContact CG-CD2 4.44Å; P719-I835 HydrophobicContact CG-CD1 3.59Å
720	L	90	Very high	92	Very high	12 Å²	12	40.6 Å²	40.6	6%	0.063	20%	0.203	C	C	.	.	S	Bend	trans	-134.9	156	-173.6	-69.2	171.8	0	0	0	109.4	L718 V728 V744 M828 L832	L718-L720 HydrophobicContact CB-CD1 4.35Å; L718-L720 PolarHBondContact O-N 3.4Å; L720-V728 HydrophobicContact CD1-CG2 3.87Å; L720-V744 HydrophobicContact CD1-CG1 3.68Å; L720-V744 HydrophobicContact CD2-CG1 3.76Å; L720-V744 HydrophobicContact CG-CG1 4.35Å; L720-M828 HydrophobicContact CD2-CE 4.04Å; L720-L832 HydrophobicContact CD1-CD1 4.24Å; L720-L832 HydrophobicContact CD1-CD2 3.91Å; L720-L832 HydrophobicContact CD2-CD1 4.05Å; L720-L832 HydrophobicContact CD2-CD2 4.11Å; L720-L832 HydrophobicContact CG-CD2 3.94Å
721	A	89.9	Confident	91.9	Very high	45 Å²	45	31.6 Å²	31.6	37%	0.372	16%	0.164	S	C	.	.			trans	-58.3	144.9	169.2	0	0	0	0	0	110.5	R723 Y724 G725	A721-R723 PolarHBondContact O-N 3.38Å; A721-Y724 HydrophobicContact CB-CD2 4.07Å; A721-Y724 HydrophobicContact CB-CE2 4.46Å; A721-Y724 PolarHBondContact O-N 2.9Å; A721-G725 PolarHBondContact O-N 3.12Å
722	P	93.7	Very high	91.5	Very high	5 Å²	5	33 Å²	33	3%	0.032	18%	0.177	C	C	.	.	H	α-helix	trans	-50.3	-38.4	-175.6	-31.5	35	0	0	0	114.6	D653 D654 L657 L688 L691 L693 Y724 G725 K726	D653-P722 HydrophobicContact CB-CG 4.21Å; D654-P722 HydrophobicContact CB-CG 4.37Å; L657-P722 HydrophobicContact CB-CG 4.43Å; L657-P722 HydrophobicContact CD2-CB 4.03Å; L657-P722 HydrophobicContact CD2-CG 3.91Å; L688-P722 HydrophobicContact CD2-CB 3.76Å; L688-P722 HydrophobicContact CD2-CG 3.97Å; L691-P722 HydrophobicContact CD1-CB 4.41Å; L693-P722 HydrophobicContact CD1-CB 3.6Å; P722-Y724 PolarHBondContact O-N 3.48Å; P722-G725 PolarHBondContact O-N 2.76Å; P722-K726 WeakPolarHBondContact O-CB 3.38Å; P722-K726 PolarHBondContact O-N 2.89Å
723	R	93	Very high	90.9	Very high	57 Å²	57	39.5 Å²	39.5	22%	0.215	21%	0.207	C	C	.	.	H	α-helix	trans	-57.7	-46.9	176	-65.4	-175.7	179.7	-159.8	-4.9	112.6	L691 A721 M727 G869 E872 N873	L691-R723 HydrophobicContact CD1-CG 4Å; L691-R723 HydrophobicContact CD2-CG 4.4Å; A721-R723 PolarHBondContact O-N 3.38Å; R723-M727 WeakPolarHBondContact O-CG 3.23Å; R723-G869 VanDerWaalsContact CB-O 3.24Å; R723-G869 WeakPolarHBondContact CB-O 3.37Å; R723-G869 VanDerWaalsContact CG-O 3.27Å; R723-G869 WeakPolarHBondContact CG-O 3.31Å; R723-G869 WeakPolarHBondContact O-CA 3.35Å; R723-E872 IonicContact CZ-OE2 3.45Å; R723-E872 IonicContact NH2-OE2 3.34Å; R723-E872 PolarHBondContact NH2-OE2 3.39Å; R723-N873 VanDerWaalsContact NH1-CG 3.31Å; R723-N873 PolarHBondContact NH1-ND2 3.26Å; R723-N873 PolarHBondContact NH1-OD1 3.14Å
724	Y	94.8	Very high	90.3	Very high	30 Å²	30	38.3 Å²	38.3	12%	0.118	21%	0.208	C	C	.	.	H	α-helix	trans	-80	-34.9	-179.8	-56.3	-34.6	0	0	0	112.5	A721 P722 K726 M727 V728 V744 L747 L870 Q922	A721-Y724 HydrophobicContact CB-CD2 4.07Å; A721-Y724 HydrophobicContact CB-CE2 4.46Å; A721-Y724 PolarHBondContact O-N 2.9Å; P722-Y724 PolarHBondContact O-N 3.48Å; Y724-K726 VanDerWaalsContact C-N 3.28Å; Y724-K726 PolarHBondContact O-N 3.5Å; Y724-M727 HydrophobicContact CD1-SD 4.02Å; Y724-M727 WeakPolarHBondContact O-CB 3.44Å; Y724-M727 PolarHBondContact O-N 3.48Å; Y724-M727 VanDerWaalsContact O-N 3.15Å; Y724-V728 PolarHBondContact O-N 3.45Å; Y724-V728 VanDerWaalsContact O-N 3.09Å; Y724-V744 HydrophobicContact CG-CG1 4.42Å; Y724-L747 HydrophobicContact CE1-CB 4.13Å; Y724-L747 HydrophobicContact CE1-CD1 4.24Å; Y724-L870 HydrophobicContact CE1-CD2 4.49Å; Y724-Q922 PolarHBondContact OH-NE2 2.57Å
725	G	93.8	Very high	89.9	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-61.6	-38.2	174.7	0	0	0	0	0	111.8	A721 P722 M727 V728 A729	A721-G725 PolarHBondContact O-N 3.12Å; P722-G725 PolarHBondContact O-N 2.76Å; G725-M727 PolarHBondContact O-N 2.97Å; G725-V728 PolarHBondContact O-N 2.88Å; G725-A729 WeakPolarHBondContact O-CB 3.29Å; G725-A729 PolarHBondContact O-N 3.28Å
726	K	94.7	Very high	89.7	Confident	18 Å²	18	38.2 Å²	38.2	8%	0.078	22%	0.219	C	C	.	.	H	α-helix	trans	-59.4	-42.9	171.5	-176.8	177.8	176.4	-172.4	0	112.5	L691 L693 L711 V715 P722 Y724 V728 A729 L730 T868	L691-K726 HydrophobicContact CB-CD 4.46Å; L691-K726 HydrophobicContact CD2-CD 4.31Å; L691-K726 VanDerWaalsContact O-CD 3.29Å; L691-K726 WeakPolarHBondContact O-CD 3.45Å; L691-K726 WeakPolarHBondContact O-CE 3.45Å; L691-K726 PolarHBondContact O-NZ 3Å; L693-K726 HydrophobicContact CD2-CB 4.43Å; L711-K726 HydrophobicContact CD2-CG 4.47Å; V715-K726 HydrophobicContact CG2-CB 4.49Å; P722-K726 WeakPolarHBondContact O-CB 3.38Å; P722-K726 PolarHBondContact O-N 2.89Å; Y724-K726 VanDerWaalsContact C-N 3.28Å; Y724-K726 PolarHBondContact O-N 3.5Å; K726-V728 PolarHBondContact O-N 3.41Å; K726-A729 PolarHBondContact O-N 3.39Å; K726-L730 HydrophobicContact CG-CD1 3.93Å; K726-L730 HydrophobicContact CG-CG 4.39Å; K726-L730 WeakPolarHBondContact O-CG 3.46Å; K726-L730 PolarHBondContact O-N 2.83Å; K726-T868 WeakPolarHBondContact CD-O 3.34Å; K726-T868 WeakPolarHBondContact CE-O 3.48Å; K726-T868 PolarHBondContact NZ-O 2.95Å
727	M	95.1	Very high	89.8	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-61.2	-44.4	177.1	-63.4	168.4	59.8	0	0	111.4	R723 Y724 G725 A731 L743 V744 L747 L865 V866	R723-M727 WeakPolarHBondContact O-CG 3.23Å; Y724-M727 HydrophobicContact CD1-SD 4.02Å; Y724-M727 WeakPolarHBondContact O-CB 3.44Å; Y724-M727 PolarHBondContact O-N 3.48Å; Y724-M727 VanDerWaalsContact O-N 3.15Å; G725-M727 PolarHBondContact O-N 2.97Å; M727-A731 VanDerWaalsContact O-CB 3.32Å; M727-A731 WeakPolarHBondContact O-CB 3.33Å; M727-A731 PolarHBondContact O-N 2.72Å; M727-L743 HydrophobicContact CE-CD2 4.41Å; M727-V744 HydrophobicContact CB-CG2 4.15Å; M727-V744 HydrophobicContact CE-CG2 4.04Å; M727-V744 HydrophobicContact SD-CG2 4.36Å; M727-L747 HydrophobicContact CE-CD1 4.27Å; M727-L865 HydrophobicContact CB-CD2 4.48Å; M727-L865 HydrophobicContact CB-CG 4.23Å; M727-L865 WeakPolarHBondContact O-CD1 3.25Å; M727-V866 HydrophobicContact CE-CB 4.1Å; M727-V866 HydrophobicContact CE-CG1 4.49Å; M727-V866 HydrophobicContact CE-CG2 3.49Å; M727-V866 VanDerWaalsContact CE-CG2 3.49Å
728	V	93.8	Very high	90	Very high	4 Å²	4	35 Å²	35	2%	0.024	20%	0.204	C	C	.	.	H	α-helix	trans	-66	-42.7	177.4	178.4	0	0	0	0	111.1	L718 L720 Y724 G725 K726 L730 A731 L737 I741 V744 V836	L718-V728 HydrophobicContact CD1-CB 4.01Å; L718-V728 HydrophobicContact CD1-CG1 4.09Å; L720-V728 HydrophobicContact CD1-CG2 3.87Å; Y724-V728 PolarHBondContact O-N 3.45Å; Y724-V728 VanDerWaalsContact O-N 3.09Å; G725-V728 PolarHBondContact O-N 2.88Å; K726-V728 PolarHBondContact O-N 3.41Å; V728-L730 VanDerWaalsContact C-N 3.33Å; V728-L730 PolarHBondContact O-N 2.9Å; V728-A731 PolarHBondContact O-N 2.78Å; V728-L737 HydrophobicContact CG1-CD1 4.16Å; V728-I741 HydrophobicContact CG1-CG1 4.25Å; V728-V744 HydrophobicContact CG2-CB 4.11Å; V728-V744 HydrophobicContact CG2-CG1 4.04Å; V728-V744 HydrophobicContact CG2-CG2 3.93Å; V728-V836 HydrophobicContact CG1-CG2 3.96Å
729	A	92.3	Very high	90.2	Very high	23 Å²	23	35.7 Å²	35.7	19%	0.19	21%	0.206	C	C	.	.	H	α-helix	trans	-63.8	-36.1	-179.3	0	0	0	0	0	113.1	L711 T714 V715 G725 K726	L711-A729 HydrophobicContact CD1-CB 3.76Å; T714-A729 HydrophobicContact CG2-CB 4.49Å; V715-A729 HydrophobicContact CG2-CB 4.04Å; G725-A729 WeakPolarHBondContact O-CB 3.29Å; G725-A729 PolarHBondContact O-N 3.28Å; K726-A729 PolarHBondContact O-N 3.39Å
730	L	91.7	Very high	90.6	Very high	64 Å²	64	34.5 Å²	34.5	34%	0.335	20%	0.199	S	C	.	.	H	α-helix	trans	-83.1	-12.9	177.7	-66.3	178.2	0	0	0	113.4	L711 K726 V728 C732 L865 T868	L711-L730 HydrophobicContact CD1-CD2 4.43Å; K726-L730 HydrophobicContact CG-CD1 3.93Å; K726-L730 HydrophobicContact CG-CG 4.39Å; K726-L730 WeakPolarHBondContact O-CG 3.46Å; K726-L730 PolarHBondContact O-N 2.83Å; V728-L730 VanDerWaalsContact C-N 3.33Å; V728-L730 PolarHBondContact O-N 2.9Å; L730-C732 VanDerWaalsContact C-N 3.26Å; L730-C732 PolarHBondContact O-N 3.27Å; L730-L865 HydrophobicContact CB-CD1 3.67Å; L730-T868 HydrophobicContact CD1-CG2 4.11Å
731	A	91.8	Very high	90.8	Very high	1 Å²	1	34 Å²	34	1%	0.008	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-0.4	-176.4	0	0	0	0	0	114.9	M727 V728 Q733 L737 A740 L865	M727-A731 VanDerWaalsContact O-CB 3.32Å; M727-A731 WeakPolarHBondContact O-CB 3.33Å; M727-A731 PolarHBondContact O-N 2.72Å; V728-A731 PolarHBondContact O-N 2.78Å; A731-Q733 PolarHBondContact O-N 3.36Å; A731-L737 HydrophobicContact CB-CB 4.49Å; A731-L737 HydrophobicContact CB-CD1 4.07Å; A731-L737 WeakPolarHBondContact O-CA 3.3Å; A731-L737 WeakPolarHBondContact O-CB 3.38Å; A731-L737 PolarHBondContact O-N 3.48Å; A731-A740 HydrophobicContact CB-CB 3.3Å; A731-L865 HydrophobicContact CB-CD2 3.79Å
732	C	83.3	Confident	91	Very high	77 Å²	77	31.9 Å²	31.9	52%	0.52	18%	0.178	S	C	.	.	S	Bend	trans	-67.8	19.1	180	-65.1	0	0	0	0	114.4	L730	L730-C732 VanDerWaalsContact C-N 3.26Å; L730-C732 PolarHBondContact O-N 3.27Å
733	Q	81.1	Confident	91	Very high	137 Å²	137	31.7 Å²	31.7	64%	0.64	18%	0.177	S	C	*	.	S	Bend	trans	-126.7	151.5	-176.5	-60.3	177.6	-3.4	0	0	109.8	A731 G735 L736	A731-Q733 PolarHBondContact O-N 3.36Å; Q733-G735 PolarHBondContact O-N 3.04Å; Q733-L736 WeakPolarHBondContact O-CB 3.35Å; Q733-L736 PolarHBondContact O-N 3.43Å
734	Q	80.2	Confident	91.1	Very high	131 Å²	131	29 Å²	29	61%	0.612	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.5	26.5	170.9	-58.8	176.1	-9.5	0	0	115.2	L736 L861	Q734-L736 HydrophobicContact CB-CD1 4.41Å; Q734-L736 HydrophobicContact CB-CG 4.31Å; Q734-L736 PolarHBondContact O-N 3.23Å; Q734-L861 VanDerWaalsContact OE1-CD2 3.27Å
735	G	83	Confident	91	Very high	59 Å²	59	27.5 Å²	27.5	61%	0.608	16%	0.161	S	C	*	.	T	Hydrogen-bonded Turn	trans	67.3	18.9	-179.6	0	0	0	0	0	114.4	Q733	Q733-G735 PolarHBondContact O-N 3.04Å
736	L	90.3	Very high	90.9	Very high	11 Å²	11	27.5 Å²	27.5	6%	0.058	16%	0.161	C	C	.	.			trans	-80.3	-19.7	-176.8	-63.2	172.6	0	0	0	113.4	Q733 Q734 A738 Y739 A740 Q858 L861 L862	Q733-L736 WeakPolarHBondContact O-CB 3.35Å; Q733-L736 PolarHBondContact O-N 3.43Å; Q734-L736 HydrophobicContact CB-CD1 4.41Å; Q734-L736 HydrophobicContact CB-CG 4.31Å; Q734-L736 PolarHBondContact O-N 3.23Å; L736-A738 VanDerWaalsContact C-N 3.33Å; L736-A738 PolarHBondContact O-N 3.01Å; L736-Y739 WeakPolarHBondContact O-CB 3.32Å; L736-Y739 PolarHBondContact O-N 3.23Å; L736-A740 WeakPolarHBondContact O-CB 3.4Å; L736-A740 PolarHBondContact O-N 3.13Å; L736-Q858 HydrophobicContact CD2-CB 4.11Å; L736-Q858 HydrophobicContact CD2-CG 4.08Å; L736-L861 HydrophobicContact CD1-CB 3.65Å; L736-L861 HydrophobicContact CD1-CD1 4.33Å; L736-L861 HydrophobicContact CD2-CB 4.21Å; L736-L862 HydrophobicContact CD2-CD2 4.49Å; L736-L862 HydrophobicContact CD2-CG 4.3Å
737	L	91.6	Very high	90.7	Very high	13 Å²	13	27 Å²	27	7%	0.068	16%	0.159	C	C	.	.	H	α-helix	trans	-53.5	-45.1	-171.6	-174.1	58.1	0	0	0	113.4	V728 A731 Y739 A740 I741 V836 A843 L845	V728-L737 HydrophobicContact CG1-CD1 4.16Å; A731-L737 HydrophobicContact CB-CB 4.49Å; A731-L737 HydrophobicContact CB-CD1 4.07Å; A731-L737 WeakPolarHBondContact O-CA 3.3Å; A731-L737 WeakPolarHBondContact O-CB 3.38Å; A731-L737 PolarHBondContact O-N 3.48Å; L737-Y739 PolarHBondContact O-N 3.42Å; L737-A740 PolarHBondContact O-N 2.86Å; L737-I741 HydrophobicContact CD1-CD1 4.17Å; L737-I741 HydrophobicContact CD1-CG1 4.36Å; L737-I741 HydrophobicContact CG-CD1 4.06Å; L737-I741 VanDerWaalsContact O-CG1 3.26Å; L737-I741 WeakPolarHBondContact O-CG1 3.48Å; L737-I741 PolarHBondContact O-N 3.37Å; L737-V836 HydrophobicContact CD1-CG1 4.35Å; L737-V836 HydrophobicContact CD2-CG1 3.9Å; L737-V836 HydrophobicContact CG-CG1 4.45Å; L737-A843 HydrophobicContact CD2-CB 3.83Å; L737-L845 HydrophobicContact CD2-CD1 3.77Å; L737-L845 HydrophobicContact CD2-CD2 4.4Å; L737-L845 HydrophobicContact CD2-CG 4.29Å; L737-L845 HydrophobicContact CG-CD1 3.89Å
738	A	91.7	Very high	90.5	Very high	18 Å²	18	28.7 Å²	28.7	15%	0.149	17%	0.171	C	C	.	.	H	α-helix	trans	-65.7	-38.4	-179.8	0	0	0	0	0	112.3	L736 C742 L845 L851	L736-A738 VanDerWaalsContact C-N 3.33Å; L736-A738 PolarHBondContact O-N 3.01Å; A738-C742 WeakPolarHBondContact O-CB 3.45Å; A738-C742 PolarHBondContact O-N 3.14Å; A738-C742 VanDerWaalsContact O-N 3.14Å; A738-L845 HydrophobicContact CB-CD2 4.17Å; A738-L851 HydrophobicContact CB-CD1 3.61Å; A738-L851 HydrophobicContact CB-CD2 3.87Å; A738-L851 HydrophobicContact CB-CG 4.4Å
739	Y	93.5	Very high	90.1	Very high	20 Å²	20	29.2 Å²	29.2	8%	0.078	17%	0.174	C	C	.	.	H	α-helix	trans	-70.6	-40.8	174.6	-60.8	-59.2	0	0	0	112.1	L736 L737 C742 L743 L801 L851 K852 P854	L736-Y739 WeakPolarHBondContact O-CB 3.32Å; L736-Y739 PolarHBondContact O-N 3.23Å; L737-Y739 PolarHBondContact O-N 3.42Å; Y739-C742 WeakPolarHBondContact O-CB 3.3Å; Y739-C742 PolarHBondContact O-N 2.81Å; Y739-L743 WeakPolarHBondContact O-CB 3Å; Y739-L743 PolarHBondContact O-N 3.11Å; Y739-L801 HydrophobicContact CD1-CD1 4.33Å; Y739-L801 HydrophobicContact CE1-CD1 4.18Å; Y739-L851 HydrophobicContact CD1-CD1 4.31Å; Y739-L851 HydrophobicContact CE1-CB 4.08Å; Y739-L851 HydrophobicContact CE1-CD1 4.35Å; Y739-K852 WeakPolarHBondContact CE1-O 3.3Å; Y739-K852 PolarHBondContact OH-O 3.11Å; Y739-P854 HydrophobicContact CE1-CB 4.38Å; Y739-P854 HydrophobicContact CE2-CB 4.49Å
740	A	93.8	Very high	89.2	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-62.7	-43.9	176.9	0	0	0	0	0	111.3	A731 L736 L737 C742 L743 V744 L865	A731-A740 HydrophobicContact CB-CB 3.3Å; L736-A740 WeakPolarHBondContact O-CB 3.4Å; L736-A740 PolarHBondContact O-N 3.13Å; L737-A740 PolarHBondContact O-N 2.86Å; A740-C742 VanDerWaalsContact C-N 3.33Å; A740-C742 PolarHBondContact O-N 3.46Å; A740-L743 PolarHBondContact O-N 3.23Å; A740-V744 VanDerWaalsContact O-CB 3.22Å; A740-V744 WeakPolarHBondContact O-CB 3.34Å; A740-V744 VanDerWaalsContact O-CG2 3.27Å; A740-V744 WeakPolarHBondContact O-CG2 3.35Å; A740-V744 PolarHBondContact O-N 2.94Å; A740-L865 HydrophobicContact CB-CD2 3.72Å
741	I	93.6	Very high	88.2	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-60.9	-43.5	174.4	-67.9	166.2	0	0	0	110.7	V728 L737 S745 R829 L832 V836 L845	V728-I741 HydrophobicContact CG1-CG1 4.25Å; L737-I741 HydrophobicContact CD1-CD1 4.17Å; L737-I741 HydrophobicContact CD1-CG1 4.36Å; L737-I741 HydrophobicContact CG-CD1 4.06Å; L737-I741 VanDerWaalsContact O-CG1 3.26Å; L737-I741 WeakPolarHBondContact O-CG1 3.48Å; L737-I741 PolarHBondContact O-N 3.37Å; I741-S745 VanDerWaalsContact O-CB 3.29Å; I741-S745 WeakPolarHBondContact O-CB 3.45Å; I741-S745 PolarHBondContact O-N 3.23Å; I741-S745 PolarHBondContact O-OG 3.38Å; I741-R829 HydrophobicContact CG2-CG 4.13Å; I741-L832 HydrophobicContact CG2-CB 3.67Å; I741-L832 HydrophobicContact CG2-CD1 4.3Å; I741-V836 HydrophobicContact CD1-CB 4.3Å; I741-V836 HydrophobicContact CD1-CG1 4.42Å; I741-V836 HydrophobicContact CD1-CG2 4.08Å; I741-L845 HydrophobicContact CD1-CD1 3.53Å
742	C	93.3	Very high	87.6	Confident	1 Å²	1	35.8 Å²	35.8	1%	0.007	19%	0.192	C	C	.	.	H	α-helix	trans	-62.8	-48.3	177.8	-169.6	0	0	0	0	111.8	A738 Y739 A740 S745 A746 L797 S800 L801	A738-C742 WeakPolarHBondContact O-CB 3.45Å; A738-C742 PolarHBondContact O-N 3.14Å; A738-C742 VanDerWaalsContact O-N 3.14Å; Y739-C742 WeakPolarHBondContact O-CB 3.3Å; Y739-C742 PolarHBondContact O-N 2.81Å; A740-C742 VanDerWaalsContact C-N 3.33Å; A740-C742 PolarHBondContact O-N 3.46Å; C742-S745 WeakPolarHBondContact O-CB 3.49Å; C742-S745 PolarHBondContact O-N 3.36Å; C742-A746 PolarHBondContact O-N 2.89Å; C742-L797 HydrophobicContact CB-CD1 3.77Å; C742-S800 VanDerWaalsContact SG-CB 3.54Å; C742-L801 HydrophobicContact CB-CD2 4.44Å
743	L	94	Very high	87.4	Confident	1 Å²	1	33.4 Å²	33.4	1%	0.005	17%	0.174	C	C	.	.	H	α-helix	trans	-63.5	-46.3	178.3	178.9	59.2	0	0	0	111.9	M727 Y739 A740 S745 A746 L747 L793 L797 V866	M727-L743 HydrophobicContact CE-CD2 4.41Å; Y739-L743 WeakPolarHBondContact O-CB 3Å; Y739-L743 PolarHBondContact O-N 3.11Å; A740-L743 PolarHBondContact O-N 3.23Å; L743-S745 VanDerWaalsContact C-N 3.3Å; L743-S745 PolarHBondContact O-N 3.34Å; L743-A746 WeakPolarHBondContact O-CB 3.45Å; L743-A746 PolarHBondContact O-N 2.85Å; L743-A746 VanDerWaalsContact O-N 3.11Å; L743-L747 HydrophobicContact CD1-CD1 4.23Å; L743-L747 HydrophobicContact CD1-CG 4.23Å; L743-L747 HydrophobicContact CG-CD1 4.01Å; L743-L747 HydrophobicContact CG-CG 4.43Å; L743-L747 WeakPolarHBondContact O-CG 3.37Å; L743-L747 PolarHBondContact O-N 3.11Å; L743-L793 HydrophobicContact CD1-CB 3.98Å; L743-L793 HydrophobicContact CD1-CD2 4.49Å; L743-L797 HydrophobicContact CB-CD1 4.36Å; L743-V866 HydrophobicContact CD2-CG2 3.73Å
744	V	94.6	Very high	87	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-64.6	-35.6	178.2	164.1	0	0	0	0	111.5	L720 Y724 M727 V728 A740 A746 L747 S748 L832	L720-V744 HydrophobicContact CD1-CG1 3.68Å; L720-V744 HydrophobicContact CD2-CG1 3.76Å; L720-V744 HydrophobicContact CG-CG1 4.35Å; Y724-V744 HydrophobicContact CG-CG1 4.42Å; M727-V744 HydrophobicContact CB-CG2 4.15Å; M727-V744 HydrophobicContact CE-CG2 4.04Å; M727-V744 HydrophobicContact SD-CG2 4.36Å; V728-V744 HydrophobicContact CG2-CB 4.11Å; V728-V744 HydrophobicContact CG2-CG1 4.04Å; V728-V744 HydrophobicContact CG2-CG2 3.93Å; A740-V744 VanDerWaalsContact O-CB 3.22Å; A740-V744 WeakPolarHBondContact O-CB 3.34Å; A740-V744 VanDerWaalsContact O-CG2 3.27Å; A740-V744 WeakPolarHBondContact O-CG2 3.35Å; A740-V744 PolarHBondContact O-N 2.94Å; V744-A746 VanDerWaalsContact C-N 3.33Å; V744-L747 PolarHBondContact O-N 3.22Å; V744-S748 VanDerWaalsContact O-CB 3.25Å; V744-S748 WeakPolarHBondContact O-CB 3.44Å; V744-S748 PolarHBondContact O-N 2.66Å; V744-S748 PolarHBondContact O-OG 3.44Å; V744-L832 HydrophobicContact CG1-CD1 4.36Å
745	S	93	Very high	86.5	Confident	0 Å²	0	23.7 Å²	23.7	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-61.8	-43.1	172.1	-59.1	0	0	0	0	111	I741 C742 L743 S748 V749 R829	I741-S745 VanDerWaalsContact O-CB 3.29Å; I741-S745 WeakPolarHBondContact O-CB 3.45Å; I741-S745 PolarHBondContact O-N 3.23Å; I741-S745 PolarHBondContact O-OG 3.38Å; C742-S745 WeakPolarHBondContact O-CB 3.49Å; C742-S745 PolarHBondContact O-N 3.36Å; L743-S745 VanDerWaalsContact C-N 3.3Å; L743-S745 PolarHBondContact O-N 3.34Å; S745-S748 PolarHBondContact O-N 2.88Å; S745-V749 WeakPolarHBondContact O-CG2 3.38Å; S745-V749 PolarHBondContact O-N 3.33Å; S745-R829 VanDerWaalsContact OG-CA 3.23Å; S745-R829 WeakPolarHBondContact OG-CA 3.47Å; S745-R829 PolarHBondContact OG-N 3.42Å
746	A	92.5	Very high	85.7	Confident	0 Å²	0	21.1 Å²	21.1	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-65.4	-42	176	0	0	0	0	0	113.1	C742 L743 V744 S748 L796 I825	C742-A746 PolarHBondContact O-N 2.89Å; L743-A746 WeakPolarHBondContact O-CB 3.45Å; L743-A746 PolarHBondContact O-N 2.85Å; L743-A746 VanDerWaalsContact O-N 3.11Å; V744-A746 VanDerWaalsContact C-N 3.33Å; A746-S748 VanDerWaalsContact C-N 3.33Å; A746-L796 HydrophobicContact CB-CB 4.15Å; A746-I825 HydrophobicContact CB-CD1 3.97Å; A746-I825 HydrophobicContact CB-CG1 4.46Å; A746-I825 HydrophobicContact CB-CG2 4.35Å
747	L	91.4	Very high	84.5	Confident	6 Å²	6	23.7 Å²	23.7	3%	0.031	12%	0.122	C	C	.	.	H	α-helix	trans	-69.8	-28.4	178.3	-72.1	175.1	0	0	0	113.4	Y724 M727 L743 V744 L793 L796 Q922	Y724-L747 HydrophobicContact CE1-CB 4.13Å; Y724-L747 HydrophobicContact CE1-CD1 4.24Å; M727-L747 HydrophobicContact CE-CD1 4.27Å; L743-L747 HydrophobicContact CD1-CD1 4.23Å; L743-L747 HydrophobicContact CD1-CG 4.23Å; L743-L747 HydrophobicContact CG-CD1 4.01Å; L743-L747 HydrophobicContact CG-CG 4.43Å; L743-L747 WeakPolarHBondContact O-CG 3.37Å; L743-L747 PolarHBondContact O-N 3.11Å; V744-L747 PolarHBondContact O-N 3.22Å; L747-L793 HydrophobicContact CD2-CD2 3.63Å; L747-L796 HydrophobicContact CD2-CD1 4.28Å; L747-Q922 HydrophobicContact CD2-CG 4.29Å; L747-Q922 PolarHBondContact O-NE2 3.34Å
748	S	89.6	Confident	83.1	Confident	37 Å²	37	23.5 Å²	23.5	26%	0.259	12%	0.122	S	C	.	.	H	α-helix	trans	-80.4	-24.6	-179.7	-61.2	0	0	0	0	112.8	V744 S745 A746 M828	V744-S748 VanDerWaalsContact O-CB 3.25Å; V744-S748 WeakPolarHBondContact O-CB 3.44Å; V744-S748 PolarHBondContact O-N 2.66Å; V744-S748 PolarHBondContact O-OG 3.44Å; S745-S748 PolarHBondContact O-N 2.88Å; A746-S748 VanDerWaalsContact C-N 3.33Å; S748-M828 WeakPolarHBondContact CB-SD 3.44Å
749	V	85.8	Confident	81.9	Confident	14 Å²	14	23.4 Å²	23.4	9%	0.085	12%	0.118	C	C	.	.	S	Bend	trans	-80	137.9	174.1	174.5	0	0	0	0	109.5	S745 E751 P752 A821 E824 I825 M828	S745-V749 WeakPolarHBondContact O-CG2 3.38Å; S745-V749 PolarHBondContact O-N 3.33Å; V749-E751 PolarHBondContact O-N 3.38Å; V749-P752 WeakPolarHBondContact O-CD 3.33Å; V749-A821 HydrophobicContact CG1-CB 3.68Å; V749-E824 HydrophobicContact CG1-CB 4.31Å; V749-E824 HydrophobicContact CG2-CB 4Å; V749-I825 HydrophobicContact CB-CD1 4.44Å; V749-I825 HydrophobicContact CB-CG1 3.82Å; V749-I825 HydrophobicContact CG1-CG1 4.23Å; V749-I825 HydrophobicContact CG2-CG1 3.66Å; V749-M828 HydrophobicContact CG2-SD 4.36Å
750	R	73.3	Confident	80.2	Confident	164 Å²	164	27.3 Å²	27.3	62%	0.619	14%	0.137	S	C	*	.	S	Bend	trans	-74.5	127.4	-174.4	-64.7	-176.7	-179.1	-176.7	0.4	111.1
751	E	70.6	Confident	78.6	Confident	58 Å²	58	29.1 Å²	29.1	27%	0.271	15%	0.15	S	C	.	.			trans	43.6	57.7	171.3	-64.5	-178.7	173.8	0	0	114.9	V749 L753 R818	V749-E751 PolarHBondContact O-N 3.38Å; E751-L753 PolarHBondContact O-N 2.87Å; E751-R818 PolarHBondContact O-NE 3.37Å; E751-R818 PolarHBondContact O-NH2 2.97Å; E751-R818 IonicContact OE2-NH2 2.81Å; E751-R818 PolarHBondContact OE2-NH2 2.88Å
752	P	79.2	Confident	77.2	Confident	4 Å²	4	39.7 Å²	39.7	3%	0.026	20%	0.196	C	C	.	.			trans	-63.3	-26.8	-178.6	26.2	-35.9	0	0	0	113.3	V749 L796 F817 R818 A821 I825	V749-P752 WeakPolarHBondContact O-CD 3.33Å; P752-L796 HydrophobicContact CB-CD2 4.23Å; P752-L796 HydrophobicContact CG-CD2 3.57Å; P752-F817 WeakPolarHBondContact O-CA 3.27Å; P752-R818 PolarHBondContact O-N 3.23Å; P752-A821 HydrophobicContact CB-CB 4.06Å; P752-I825 HydrophobicContact CB-CD1 3.94Å
753	L	80.3	Confident	76.3	Confident	27 Å²	27	42.7 Å²	42.7	14%	0.141	21%	0.212	C	C	.	.	B	Isolated β-bridge	trans	-86.8	120.4	176.4	-66.3	170	0	0	0	110.2	E751 V795 L796 F817	E751-L753 PolarHBondContact O-N 2.87Å; L753-V795 HydrophobicContact CD2-CG1 4.42Å; L753-L796 HydrophobicContact CD1-CD2 3.82Å; L753-L796 HydrophobicContact CD1-CG 4.36Å; L753-L796 HydrophobicContact CD2-CD2 3.98Å; L753-L796 HydrophobicContact CG-CD2 3.59Å; L753-F817 HydrophobicContact CD2-CD1 3.97Å; L753-F817 HydrophobicContact CD2-CE1 3.41Å; L753-F817 VanDerWaalsContact CD2-CE1 3.41Å; L753-F817 HydrophobicContact CD2-CE2 4.07Å; L753-F817 HydrophobicContact CD2-CZ 3.45Å; L753-F817 VanDerWaalsContact CD2-CZ 3.45Å; L753-F817 HydrophobicContact CG-CE1 4.29Å
754	L	72.2	Confident	75.4	Confident	10 Å²	10	48.5 Å²	48.5	5%	0.052	24%	0.241	C	C	.	.	P	Polyproline II helix	trans	-63	138.8	169.3	-67.7	171	0	0	0	109.6	N504 P756 R778 G816 F817 R818	N504-L754 HydrophobicContact CB-CD1 3.98Å; N504-L754 HydrophobicContact CB-CD2 3.93Å; L754-P756 VanDerWaalsContact O-CD 3.28Å; L754-P756 WeakPolarHBondContact O-CD 3.01Å; L754-R778 PolarHBondContact O-NH2 2.85Å; L754-G816 WeakPolarHBondContact CB-O 3.43Å; L754-G816 PolarHBondContact N-O 3.21Å; L754-F817 WeakPolarHBondContact CD1-O 3.18Å; L754-R818 HydrophobicContact CD2-CB 4.25Å; L754-R818 HydrophobicContact CG-CB 4.48Å
755	N	68.7	Low	74.7	Confident	55 Å²	55	55.7 Å²	55.7	29%	0.294	28%	0.275	S	S	.	.	P	Polyproline II helix	trans	-70.7	118.5	167	-175.2	-12.5	0	0	0	107.1	S757 T758	N755-S757 PolarHBondContact ND2-OG 3.09Å; N755-S757 PolarHBondContact O-N 3.41Å; N755-S757 PolarHBondContact OD1-N 3.46Å; N755-S757 PolarHBondContact OD1-OG 3.11Å; N755-S757 VanDerWaalsContact OD1-OG 3.04Å; N755-T758 HydrophobicContact CB-CG2 3.99Å; N755-T758 WeakPolarHBondContact O-CB 3.25Å; N755-T758 WeakPolarHBondContact O-CG2 3.48Å; N755-T758 PolarHBondContact O-N 2.8Å; N755-T758 PolarHBondContact O-OG1 2.88Å
756	P	67.2	Low	74	Confident	4 Å²	4	61.2 Å²	61.2	3%	0.026	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-53.9	-26.2	-175.9	-27	36.2	0	0	0	113.6	L754 T758 I759 I771 L775 T908	L754-P756 VanDerWaalsContact O-CD 3.28Å; L754-P756 WeakPolarHBondContact O-CD 3.01Å; P756-T758 PolarHBondContact O-N 3Å; P756-I759 HydrophobicContact CB-CD1 4.44Å; P756-I759 WeakPolarHBondContact O-CB 3.18Å; P756-I759 WeakPolarHBondContact O-CG1 3.47Å; P756-I759 PolarHBondContact O-N 3.49Å; P756-I771 HydrophobicContact CB-CB 4.34Å; P756-I771 HydrophobicContact CB-CG1 4.05Å; P756-I771 HydrophobicContact CB-CG2 3.83Å; P756-I771 WeakPolarHBondContact O-CD1 3.43Å; P756-I771 WeakPolarHBondContact O-CG1 3.48Å; P756-L775 HydrophobicContact CG-CD2 4.01Å; P756-L775 HydrophobicContact CG-CG 4.38Å; P756-T908 VanDerWaalsContact CD-CG2 3.43Å; P756-T908 HydrophobicContact CG-CG2 4.14Å
757	S	64.3	Low	73.3	Confident	65 Å²	65	64.1 Å²	64.1	46%	0.455	31%	0.312	S	S	.	.	G	3₁₀ helix	trans	-60.3	-23.2	174.4	63.4	0	0	0	0	114.2	N755 I759 K767	N755-S757 PolarHBondContact ND2-OG 3.09Å; N755-S757 PolarHBondContact O-N 3.41Å; N755-S757 PolarHBondContact OD1-N 3.46Å; N755-S757 PolarHBondContact OD1-OG 3.11Å; N755-S757 VanDerWaalsContact OD1-OG 3.04Å; S757-I759 VanDerWaalsContact C-N 3.34Å; S757-K767 VanDerWaalsContact O-CE 3.29Å; S757-K767 WeakPolarHBondContact O-CE 3.44Å; S757-K767 PolarHBondContact O-NZ 3.1Å
758	T	63	Low	72.7	Confident	9 Å²	9	70.6 Å²	70.6	6%	0.055	34%	0.34	C	S	.	.	G	3₁₀ helix	trans	-81	-14.2	-178.4	70.8	0	0	0	0	112.9	N504 Q506 N755 P756 E760	N504-T758 PolarHBondContact OD1-O 3.33Å; N504-T758 VanDerWaalsContact OD1-O 3.13Å; N504-T758 PolarHBondContact OD1-OG1 2.68Å; Q506-T758 HydrophobicContact CB-CG2 3.6Å; Q506-T758 HydrophobicContact CG-CG2 3.9Å; N755-T758 HydrophobicContact CB-CG2 3.99Å; N755-T758 WeakPolarHBondContact O-CB 3.25Å; N755-T758 WeakPolarHBondContact O-CG2 3.48Å; N755-T758 PolarHBondContact O-N 2.8Å; N755-T758 PolarHBondContact O-OG1 2.88Å; P756-T758 PolarHBondContact O-N 3Å; T758-E760 PolarHBondContact O-N 2.98Å
759	I	66.2	Low	72.4	Confident	16 Å²	16	74.8 Å²	74.8	8%	0.082	36%	0.355	C	S	.	.			trans	-56.7	112.4	177.4	-61.3	171.6	0	0	0	108.4	P756 S757 C761 K767 K770 I771 C774	P756-I759 HydrophobicContact CB-CD1 4.44Å; P756-I759 WeakPolarHBondContact O-CB 3.18Å; P756-I759 WeakPolarHBondContact O-CG1 3.47Å; P756-I759 PolarHBondContact O-N 3.49Å; S757-I759 VanDerWaalsContact C-N 3.34Å; I759-C761 PolarHBondContact O-N 2.71Å; I759-K767 WeakPolarHBondContact O-CD 3.38Å; I759-K767 WeakPolarHBondContact O-CE 3.14Å; I759-K767 PolarHBondContact O-NZ 3.49Å; I759-K770 HydrophobicContact CG2-CB 4.09Å; I759-K770 HydrophobicContact CG2-CD 3.91Å; I759-I771 HydrophobicContact CD1-CG1 4.22Å; I759-C774 HydrophobicContact CD1-CB 4.33Å
760	E	57.7	Low	72.1	Confident	102 Å²	102	78.6 Å²	78.6	48%	0.477	37%	0.371	S	S	.	.			trans	-79.9	120.8	178.2	-66.5	-169	-172.1	0	0	109.3	L503 T758	L503-E760 WeakPolarHBondContact CD1-OE2 3.5Å; T758-E760 PolarHBondContact O-N 2.98Å
761	C	61.3	Low	72.4	Confident	38 Å²	38	72.7 Å²	72.7	26%	0.257	35%	0.351	S	S	.	.			trans	-142.9	131.3	166.1	-162.9	0	0	0	0	106.9	I759 D763 K766 K767	I759-C761 PolarHBondContact O-N 2.71Å; C761-D763 PolarHBondContact O-N 3.02Å; C761-K766 VanDerWaalsContact SG-CB 3.53Å; C761-K767 HydrophobicContact CB-CB 3.89Å
762	K	62.4	Low	73	Confident	222 Å²	222	72 Å²	72	97%	0.965	36%	0.355	S	S	*	.	S	Bend	trans	-60	-29.9	179.2	-66	-178.6	179.4	176.4	0	111.8
763	D	74.3	Confident	73.3	Confident	64 Å²	64	76.1 Å²	76.1	34%	0.342	37%	0.374	S	S	.	.	S	Bend	trans	-98.4	123.4	-180	-174.6	-14.2	0	0	0	110.4	C761 E765 K766 K767	C761-D763 PolarHBondContact O-N 3.02Å; D763-E765 VanDerWaalsContact C-N 3.3Å; D763-E765 PolarHBondContact O-N 2.8Å; D763-E765 PolarHBondContact OD1-N 2.88Å; D763-E765 VanDerWaalsContact OD1-N 3.08Å; D763-K766 HydrophobicContact CB-CB 4.09Å; D763-K766 HydrophobicContact CB-CD 4Å; D763-K766 HydrophobicContact CB-CG 4.05Å; D763-K766 PolarHBondContact O-N 3.08Å; D763-K766 WeakPolarHBondContact OD2-CE 3.1Å; D763-K767 WeakPolarHBondContact O-CB 3.29Å; D763-K767 PolarHBondContact O-N 2.88Å
764	I	76.8	Confident	73.5	Confident	123 Å²	123	74.9 Å²	74.9	63%	0.631	37%	0.368	S	S	*	.	H	α-helix	trans	-64.2	-35.3	-176.1	-61	173.7	0	0	0	111.1	K767 K768	I764-K767 PolarHBondContact O-N 2.8Å; I764-K768 WeakPolarHBondContact O-CG 3.22Å; I764-K768 PolarHBondContact O-N 3.39Å; I764-K768 VanDerWaalsContact O-N 3.09Å
765	E	78.2	Confident	74	Confident	151 Å²	151	76.6 Å²	76.6	71%	0.706	38%	0.377	S	S	*	.	H	α-helix	trans	-71.3	-46.9	-179.3	-66.5	-168.8	164.7	0	0	110.8	D763 K767 K768 E769	D763-E765 VanDerWaalsContact C-N 3.3Å; D763-E765 PolarHBondContact O-N 2.8Å; D763-E765 PolarHBondContact OD1-N 2.88Å; D763-E765 VanDerWaalsContact OD1-N 3.08Å; E765-K767 VanDerWaalsContact C-N 3.26Å; E765-K767 PolarHBondContact O-N 3.39Å; E765-K768 WeakPolarHBondContact O-CB 3.27Å; E765-K768 PolarHBondContact O-N 2.96Å; E765-K768 VanDerWaalsContact O-N 3.1Å; E765-E769 PolarHBondContact O-N 2.61Å
766	K	79.7	Confident	74.9	Confident	117 Å²	117	81.5 Å²	81.5	51%	0.509	39%	0.391	S	S	.	.	H	α-helix	trans	-60.7	-36.1	173.6	-65.3	-176.5	-173.8	179	0	112.1	C761 D763 E769 K770	C761-K766 VanDerWaalsContact SG-CB 3.53Å; D763-K766 HydrophobicContact CB-CB 4.09Å; D763-K766 HydrophobicContact CB-CD 4Å; D763-K766 HydrophobicContact CB-CG 4.05Å; D763-K766 PolarHBondContact O-N 3.08Å; D763-K766 WeakPolarHBondContact OD2-CE 3.1Å; K766-E769 PolarHBondContact O-N 3.08Å; K766-K770 WeakPolarHBondContact O-CG 3.36Å; K766-K770 PolarHBondContact O-N 3.4Å
767	K	76.5	Confident	75.8	Confident	61 Å²	61	82.1 Å²	82.1	27%	0.265	40%	0.395	S	S	.	.	H	α-helix	trans	-60	-48.4	173.4	-174.1	165.3	173.3	150.3	0	111.3	S757 I759 C761 D763 I764 E765 E769 K770 I771	S757-K767 VanDerWaalsContact O-CE 3.29Å; S757-K767 WeakPolarHBondContact O-CE 3.44Å; S757-K767 PolarHBondContact O-NZ 3.1Å; I759-K767 WeakPolarHBondContact O-CD 3.38Å; I759-K767 WeakPolarHBondContact O-CE 3.14Å; I759-K767 PolarHBondContact O-NZ 3.49Å; C761-K767 HydrophobicContact CB-CB 3.89Å; D763-K767 WeakPolarHBondContact O-CB 3.29Å; D763-K767 PolarHBondContact O-N 2.88Å; I764-K767 PolarHBondContact O-N 2.8Å; E765-K767 VanDerWaalsContact C-N 3.26Å; E765-K767 PolarHBondContact O-N 3.39Å; K767-E769 VanDerWaalsContact C-N 3.31Å; K767-E769 PolarHBondContact O-N 3.06Å; K767-K770 PolarHBondContact O-N 3.45Å; K767-I771 HydrophobicContact CG-CD1 3.93Å; K767-I771 WeakPolarHBondContact O-CB 3.46Å; K767-I771 WeakPolarHBondContact O-CG1 3.45Å; K767-I771 PolarHBondContact O-N 2.87Å
768	K	79.6	Confident	77	Confident	142 Å²	142	79.3 Å²	79.3	62%	0.617	38%	0.375	S	S	*	.	H	α-helix	trans	-62	-39.7	177.9	-73.4	176.1	180	176	0	111.7	I764 E765 I771 A772	I764-K768 WeakPolarHBondContact O-CG 3.22Å; I764-K768 PolarHBondContact O-N 3.39Å; I764-K768 VanDerWaalsContact O-N 3.09Å; E765-K768 WeakPolarHBondContact O-CB 3.27Å; E765-K768 PolarHBondContact O-N 2.96Å; E765-K768 VanDerWaalsContact O-N 3.1Å; K768-I771 PolarHBondContact O-N 3.3Å; K768-A772 WeakPolarHBondContact O-CB 3.44Å; K768-A772 PolarHBondContact O-N 3.29Å
769	E	84.4	Confident	78.1	Confident	125 Å²	125	83.3 Å²	83.3	58%	0.584	39%	0.389	S	S	*	.	H	α-helix	trans	-64.5	-48.5	177.2	-172.2	173.4	-162	0	0	112	E765 K766 K767 I771 A772 E773	E765-E769 PolarHBondContact O-N 2.61Å; K766-E769 PolarHBondContact O-N 3.08Å; K767-E769 VanDerWaalsContact C-N 3.31Å; K767-E769 PolarHBondContact O-N 3.06Å; E769-I771 VanDerWaalsContact C-N 3.3Å; E769-I771 PolarHBondContact O-N 3.2Å; E769-A772 CarbonylContact O-C 3.57Å; E769-A772 PolarHBondContact O-N 3.45Å; E769-A772 VanDerWaalsContact O-N 3.11Å; E769-E773 WeakPolarHBondContact O-CB 3.31Å; E769-E773 PolarHBondContact O-N 3.26Å
770	K	79.2	Confident	79.3	Confident	94 Å²	94	86.3 Å²	86.3	41%	0.409	42%	0.416	S	S	.	.	H	α-helix	trans	-58.8	-40.3	174.8	-74.8	-170	174.8	-164.6	0	112.3	I759 K766 K767 E773 C774	I759-K770 HydrophobicContact CG2-CB 4.09Å; I759-K770 HydrophobicContact CG2-CD 3.91Å; K766-K770 WeakPolarHBondContact O-CG 3.36Å; K766-K770 PolarHBondContact O-N 3.4Å; K767-K770 PolarHBondContact O-N 3.45Å; K770-E773 PolarHBondContact O-N 3.07Å; K770-C774 WeakPolarHBondContact O-CB 3.22Å; K770-C774 PolarHBondContact O-N 2.99Å
771	I	79.8	Confident	80.8	Confident	40 Å²	40	82.9 Å²	82.9	21%	0.205	40%	0.401	C	S	.	.	H	α-helix	trans	-62.2	-46.7	174.6	-71.8	168.8	0	0	0	110.7	P756 I759 K767 K768 E769 E773 C774 L775	P756-I771 HydrophobicContact CB-CB 4.34Å; P756-I771 HydrophobicContact CB-CG1 4.05Å; P756-I771 HydrophobicContact CB-CG2 3.83Å; P756-I771 WeakPolarHBondContact O-CD1 3.43Å; P756-I771 WeakPolarHBondContact O-CG1 3.48Å; I759-I771 HydrophobicContact CD1-CG1 4.22Å; K767-I771 HydrophobicContact CG-CD1 3.93Å; K767-I771 WeakPolarHBondContact O-CB 3.46Å; K767-I771 WeakPolarHBondContact O-CG1 3.45Å; K767-I771 PolarHBondContact O-N 2.87Å; K768-I771 PolarHBondContact O-N 3.3Å; E769-I771 VanDerWaalsContact C-N 3.3Å; E769-I771 PolarHBondContact O-N 3.2Å; I771-E773 VanDerWaalsContact C-N 3.35Å; I771-C774 PolarHBondContact O-N 2.72Å; I771-L775 HydrophobicContact CG2-CD1 4Å; I771-L775 WeakPolarHBondContact O-CB 3.38Å; I771-L775 VanDerWaalsContact O-CG 3.32Å; I771-L775 WeakPolarHBondContact O-CG 3.32Å; I771-L775 PolarHBondContact O-N 3.02Å
772	A	82.8	Confident	82.1	Confident	44 Å²	44	81.1 Å²	81.1	36%	0.364	39%	0.389	S	S	.	.	H	α-helix	trans	-65.9	-37.6	179.3	0	0	0	0	0	112.1	K768 E769 R776	K768-A772 WeakPolarHBondContact O-CB 3.44Å; K768-A772 PolarHBondContact O-N 3.29Å; E769-A772 CarbonylContact O-C 3.57Å; E769-A772 PolarHBondContact O-N 3.45Å; E769-A772 VanDerWaalsContact O-N 3.11Å; A772-R776 WeakPolarHBondContact O-CB 3.39Å; A772-R776 VanDerWaalsContact O-CG 3.24Å; A772-R776 WeakPolarHBondContact O-CG 3.44Å; A772-R776 PolarHBondContact O-N 3.14Å; A772-R776 PolarHBondContact O-NE 2.85Å
773	E	85.6	Confident	83.5	Confident	89 Å²	89	71.8 Å²	71.8	42%	0.416	36%	0.356	S	S	.	.	H	α-helix	trans	-62.9	-50.1	173.2	-172	-179.8	-176.8	0	0	111.7	E769 K770 I771 L775 R776 S777	E769-E773 WeakPolarHBondContact O-CB 3.31Å; E769-E773 PolarHBondContact O-N 3.26Å; K770-E773 PolarHBondContact O-N 3.07Å; I771-E773 VanDerWaalsContact C-N 3.35Å; E773-L775 VanDerWaalsContact C-N 3.34Å; E773-L775 PolarHBondContact O-N 3.17Å; E773-R776 PolarHBondContact O-N 3.24Å; E773-S777 VanDerWaalsContact O-CB 3.32Å; E773-S777 WeakPolarHBondContact O-CB 3.41Å; E773-S777 PolarHBondContact O-N 2.85Å
774	C	83.7	Confident	84.2	Confident	2 Å²	2	76.7 Å²	76.7	1%	0.014	38%	0.377	C	S	.	.	H	α-helix	trans	-55	-48.9	175.8	175.3	0	0	0	0	111.6	I759 K770 I771 R776 S777 R778 G816	I759-C774 HydrophobicContact CD1-CB 4.33Å; K770-C774 WeakPolarHBondContact O-CB 3.22Å; K770-C774 PolarHBondContact O-N 2.99Å; I771-C774 PolarHBondContact O-N 2.72Å; C774-R776 PolarHBondContact O-N 3.19Å; C774-S777 WeakPolarHBondContact O-CB 3.41Å; C774-S777 PolarHBondContact O-N 3.46Å; C774-R778 WeakPolarHBondContact O-CG 3.44Å; C774-R778 PolarHBondContact O-N 2.86Å; C774-G816 VanDerWaalsContact SG-CA 3.55Å
775	L	83.7	Confident	85	Confident	46 Å²	46	73 Å²	73	24%	0.241	37%	0.37	C	S	.	.	H	α-helix	trans	-65.8	-37.6	179.3	-70.3	174.9	0	0	0	112.8	P756 I771 E773 R779	P756-L775 HydrophobicContact CG-CD2 4.01Å; P756-L775 HydrophobicContact CG-CG 4.38Å; I771-L775 HydrophobicContact CG2-CD1 4Å; I771-L775 WeakPolarHBondContact O-CB 3.38Å; I771-L775 VanDerWaalsContact O-CG 3.32Å; I771-L775 WeakPolarHBondContact O-CG 3.32Å; I771-L775 PolarHBondContact O-N 3.02Å; E773-L775 VanDerWaalsContact C-N 3.34Å; E773-L775 PolarHBondContact O-N 3.17Å; L775-R779 WeakPolarHBondContact O-CG 3.48Å; L775-R779 PolarHBondContact O-N 2.79Å; L775-R779 VanDerWaalsContact O-N 3.12Å
776	R	86.9	Confident	85.6	Confident	158 Å²	158	68.4 Å²	68.4	60%	0.596	35%	0.348	S	S	*	.	H	α-helix	trans	-63.5	-43.7	173.4	-79.3	-176.7	-68	167.7	-1.1	111	A772 E773 C774 R779 A780	A772-R776 WeakPolarHBondContact O-CB 3.39Å; A772-R776 VanDerWaalsContact O-CG 3.24Å; A772-R776 WeakPolarHBondContact O-CG 3.44Å; A772-R776 PolarHBondContact O-N 3.14Å; A772-R776 PolarHBondContact O-NE 2.85Å; E773-R776 PolarHBondContact O-N 3.24Å; C774-R776 PolarHBondContact O-N 3.19Å; R776-R779 PolarHBondContact O-N 3.46Å; R776-A780 PolarHBondContact O-N 3.47Å
777	S	86.9	Confident	86.3	Confident	16 Å²	16	63.3 Å²	63.3	11%	0.112	33%	0.327	C	S	.	.	H	α-helix	trans	-61.4	-44.5	178.7	-169.7	0	0	0	0	112.1	E773 C774 R779 A780 L781 H815	E773-S777 VanDerWaalsContact O-CB 3.32Å; E773-S777 WeakPolarHBondContact O-CB 3.41Å; E773-S777 PolarHBondContact O-N 2.85Å; C774-S777 WeakPolarHBondContact O-CB 3.41Å; C774-S777 PolarHBondContact O-N 3.46Å; S777-R779 PolarHBondContact O-N 2.93Å; S777-A780 WeakPolarHBondContact O-CB 3.41Å; S777-A780 PolarHBondContact O-N 3.34Å; S777-L781 PolarHBondContact O-N 3.11Å; S777-H815 PolarHBondContact OG-CE1 2.87Å; S777-H815 PolarHBondContact OG-ND1 3.29Å
778	R	87.6	Confident	87.1	Confident	6 Å²	6	63.1 Å²	63.1	2%	0.023	33%	0.329	C	S	.	.	H	α-helix	trans	-62.2	-42.6	174.6	-70.4	-175.4	-178.9	179	1.9	112.7	L754 C774 A780 L781 A782 V795 H815 G816 V910	L754-R778 PolarHBondContact O-NH2 2.85Å; C774-R778 WeakPolarHBondContact O-CG 3.44Å; C774-R778 PolarHBondContact O-N 2.86Å; R778-A780 VanDerWaalsContact C-N 3.32Å; R778-A780 PolarHBondContact O-N 3.43Å; R778-L781 PolarHBondContact O-N 3.17Å; R778-A782 PolarHBondContact O-N 3.29Å; R778-V795 HydrophobicContact CB-CG1 3.99Å; R778-V795 HydrophobicContact CB-CG2 4.47Å; R778-V795 HydrophobicContact CG-CG1 3.87Å; R778-V795 WeakPolarHBondContact O-CG2 3.45Å; R778-H815 PolarHBondContact NE-O 3.49Å; R778-G816 PolarHBondContact NH2-O 2.82Å; R778-V910 HydrophobicContact CB-CG2 4.36Å
779	R	87.3	Confident	87.8	Confident	94 Å²	94	59 Å²	59	36%	0.355	31%	0.313	S	S	.	.	H	α-helix	trans	-62.8	-39.4	175.7	-73.7	-179	-174.7	162	7.6	112.1	L775 R776 S777 L781 A782 G783 V910	L775-R779 WeakPolarHBondContact O-CG 3.48Å; L775-R779 PolarHBondContact O-N 2.79Å; L775-R779 VanDerWaalsContact O-N 3.12Å; R776-R779 PolarHBondContact O-N 3.46Å; S777-R779 PolarHBondContact O-N 2.93Å; R779-L781 VanDerWaalsContact C-N 3.32Å; R779-L781 PolarHBondContact O-N 3.39Å; R779-A782 PolarHBondContact O-N 3.35Å; R779-G783 PolarHBondContact O-N 3.08Å; R779-V910 HydrophobicContact CG-CG1 4.2Å; R779-V910 HydrophobicContact CG-CG2 4.42Å
780	A	90.1	Very high	88.2	Confident	79 Å²	79	53 Å²	53	65%	0.653	29%	0.285	S	S	*	.	H	α-helix	trans	-62.3	-40.1	175.4	0	0	0	0	0	111.8	R776 S777 R778 G783	R776-A780 PolarHBondContact O-N 3.47Å; S777-A780 WeakPolarHBondContact O-CB 3.41Å; S777-A780 PolarHBondContact O-N 3.34Å; R778-A780 VanDerWaalsContact C-N 3.32Å; R778-A780 PolarHBondContact O-N 3.43Å; A780-G783 PolarHBondContact O-N 3.24Å
781	L	89.7	Confident	88.9	Confident	30 Å²	30	48.6 Å²	48.6	16%	0.157	27%	0.266	C	S	.	.	H	α-helix	trans	-64.2	-44.3	174.2	-70.8	174.1	0	0	0	112.2	S777 R778 R779 G783 V795 K798 A799 H815 F817	S777-L781 PolarHBondContact O-N 3.11Å; R778-L781 PolarHBondContact O-N 3.17Å; R779-L781 VanDerWaalsContact C-N 3.32Å; R779-L781 PolarHBondContact O-N 3.39Å; L781-G783 PolarHBondContact O-N 3.43Å; L781-V795 HydrophobicContact CB-CG1 4.3Å; L781-V795 HydrophobicContact CB-CG2 4.5Å; L781-V795 HydrophobicContact CD1-CG1 4.05Å; L781-K798 HydrophobicContact CD2-CB 4.14Å; L781-K798 WeakPolarHBondContact O-CD 3.37Å; L781-K798 PolarHBondContact O-NZ 3.18Å; L781-A799 HydrophobicContact CD1-CB 4.33Å; L781-H815 WeakPolarHBondContact CD1-ND1 3.33Å; L781-F817 HydrophobicContact CD1-CE2 4.48Å
782	A	89.6	Confident	89.4	Confident	0 Å²	0	47 Å²	47	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-59.1	-32.3	177.7	0	0	0	0	0	112.5	R778 R779 S787 L788 V795 V910	R778-A782 PolarHBondContact O-N 3.29Å; R779-A782 PolarHBondContact O-N 3.35Å; A782-S787 CarbonylContact O-C 3.5Å; A782-S787 WeakPolarHBondContact O-CB 3.3Å; A782-S787 PolarHBondContact O-OG 2.82Å; A782-L788 HydrophobicContact CB-CD1 4.03Å; A782-L788 PolarHBondContact O-N 3.43Å; A782-V795 HydrophobicContact CB-CG2 3.87Å; A782-V910 HydrophobicContact CB-CB 4.35Å; A782-V910 HydrophobicContact CB-CG1 3.7Å; A782-V910 HydrophobicContact CB-CG2 4.19Å
783	G	90.3	Very high	90	Very high	27 Å²	27	45 Å²	45	28%	0.278	24%	0.241	S	C	.	.			trans	77.1	-145	175.9	0	0	0	0	0	113	R779 A780 L781	R779-G783 PolarHBondContact O-N 3.08Å; A780-G783 PolarHBondContact O-N 3.24Å; L781-G783 PolarHBondContact O-N 3.43Å
784	Q	90.6	Very high	90.4	Very high	166 Å²	166	40.8 Å²	40.8	78%	0.776	22%	0.221	S	C	*	.	S	Bend	trans	-130.1	176.1	-179	-61.5	-177.4	2.4	0	0	109.4	S787 L788	Q784-S787 WeakPolarHBondContact O-CB 3.13Å; Q784-S787 PolarHBondContact O-N 3.02Å; Q784-L788 PolarHBondContact O-N 2.93Å
785	G	92.2	Very high	90.8	Very high	47 Å²	47	40.8 Å²	40.8	49%	0.485	22%	0.221	S	C	.	.	H	α-helix	trans	62.4	-142.6	175.9	0	0	0	0	0	114	S787 L788 L789	G785-S787 PolarHBondContact O-N 3.21Å; G785-L788 WeakPolarHBondContact O-CB 3.44Å; G785-L788 PolarHBondContact O-N 3.3Å; G785-L788 VanDerWaalsContact O-N 3.12Å; G785-L789 PolarHBondContact O-N 3.34Å
786	H	92.5	Very high	91.2	Very high	53 Å²	53	38.6 Å²	38.6	25%	0.245	21%	0.21	C	C	.	.	H	α-helix	trans	-64.9	-29.1	177.6	-62.6	-65.7	0	0	0	112.5	L788 L789 L790 D856 A859 E860 R863	H786-L788 VanDerWaalsContact C-N 3.3Å; H786-L788 PolarHBondContact O-N 3.21Å; H786-L789 PolarHBondContact O-N 3.26Å; H786-L790 PolarHBondContact O-N 3.06Å; H786-D856 WeakPolarHBondContact CA-OD1 3.44Å; H786-D856 WeakPolarHBondContact CB-O 3.35Å; H786-D856 IonicContact CD2-OD2 2.68Å; H786-D856 PolarHBondContact CD2-OD2 3.35Å; H786-D856 IonicContact CG-OD2 3.9Å; H786-D856 PolarHBondContact N-OD1 3.17Å; H786-D856 PolarHBondContact N-OD2 2.99Å; H786-D856 VanDerWaalsContact N-OD2 3.12Å; H786-A859 HydrophobicContact CB-CB 4.34Å; H786-E860 HydrophobicContact CB-CB 4.22Å; H786-E860 IonicContact NE2-OE2 2.72Å; H786-R863 PolarHBondContact ND1-NH2 2.94Å
787	S	92.7	Very high	91.5	Very high	11 Å²	11	31 Å²	31	8%	0.077	18%	0.181	C	C	.	.	H	α-helix	trans	-58.2	-40.3	171.5	178.5	0	0	0	0	111.9	A782 Q784 G785 M794 K798 D856	A782-S787 CarbonylContact O-C 3.5Å; A782-S787 WeakPolarHBondContact O-CB 3.3Å; A782-S787 PolarHBondContact O-OG 2.82Å; Q784-S787 WeakPolarHBondContact O-CB 3.13Å; Q784-S787 PolarHBondContact O-N 3.02Å; G785-S787 PolarHBondContact O-N 3.21Å; S787-M794 VanDerWaalsContact O-CB 3.31Å; S787-M794 WeakPolarHBondContact O-CB 3.29Å; S787-M794 WeakPolarHBondContact O-CG 3.44Å; S787-M794 VanDerWaalsContact OG-CE 3.29Å; S787-M794 WeakPolarHBondContact OG-CE 3.2Å; S787-M794 WeakPolarHBondContact OG-CG 3.5Å; S787-K798 PolarHBondContact OG-NZ 3.4Å; S787-D856 PolarHBondContact N-OD1 3.4Å
788	L	93.3	Very high	91.7	Very high	56 Å²	56	32.2 Å²	32.2	29%	0.293	18%	0.184	S	C	.	.	H	α-helix	trans	-70.8	-38.3	175.2	178.5	63.9	0	0	0	111.8	A782 Q784 G785 H786 L790 G791 V910 L911	A782-L788 HydrophobicContact CB-CD1 4.03Å; A782-L788 PolarHBondContact O-N 3.43Å; Q784-L788 PolarHBondContact O-N 2.93Å; G785-L788 WeakPolarHBondContact O-CB 3.44Å; G785-L788 PolarHBondContact O-N 3.3Å; G785-L788 VanDerWaalsContact O-N 3.12Å; H786-L788 VanDerWaalsContact C-N 3.3Å; H786-L788 PolarHBondContact O-N 3.21Å; L788-L790 VanDerWaalsContact C-N 3.28Å; L788-L790 PolarHBondContact O-N 3.17Å; L788-G791 WeakPolarHBondContact O-CA 3.38Å; L788-G791 PolarHBondContact O-N 2.92Å; L788-V910 HydrophobicContact CD1-CG1 3.44Å; L788-V910 VanDerWaalsContact CD1-CG1 3.44Å; L788-L911 WeakPolarHBondContact O-CD2 3.21Å
789	L	94.3	Very high	91.8	Very high	56 Å²	56	32 Å²	32	29%	0.293	18%	0.183	S	C	.	.	H	α-helix	trans	-68.1	-27	179.5	-65	178.2	0	0	0	112.7	G785 H786 G791 A938	G785-L789 PolarHBondContact O-N 3.34Å; H786-L789 PolarHBondContact O-N 3.26Å; L789-G791 PolarHBondContact O-N 3.16Å; L789-A938 HydrophobicContact CB-CB 4.15Å; L789-A938 HydrophobicContact CD2-CB 3.86Å; L789-A938 PolarHBondContact O-N 3.03Å
790	L	94	Very high	91.8	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-15.4	168.3	-174.7	63	0	0	0	111.4	H786 L788 L793 M794 L862 R863 M937	H786-L790 PolarHBondContact O-N 3.06Å; L788-L790 VanDerWaalsContact C-N 3.28Å; L788-L790 PolarHBondContact O-N 3.17Å; L790-L793 HydrophobicContact CD1-CB 4.03Å; L790-L793 HydrophobicContact CD1-CD1 4.34Å; L790-L793 HydrophobicContact CG-CB 4.04Å; L790-L793 WeakPolarHBondContact O-CB 3.47Å; L790-L793 PolarHBondContact O-N 3.38Å; L790-M794 HydrophobicContact CB-CB 4.02Å; L790-M794 HydrophobicContact CB-CE 4.45Å; L790-M794 HydrophobicContact CD2-CB 4.01Å; L790-M794 HydrophobicContact CD2-CE 3.6Å; L790-M794 HydrophobicContact CD2-SD 4.19Å; L790-M794 HydrophobicContact CG-CB 4.05Å; L790-L862 HydrophobicContact CD1-CB 4.44Å; L790-L862 HydrophobicContact CD2-CB 4.25Å; L790-L862 HydrophobicContact CD2-CD1 4.36Å; L790-R863 HydrophobicContact CB-CG 3.89Å; L790-R863 HydrophobicContact CD1-CB 4.46Å; L790-R863 HydrophobicContact CD1-CG 3.56Å; L790-R863 HydrophobicContact CG-CG 4.31Å; L790-M937 HydrophobicContact CD1-CG 4.28Å; L790-M937 HydrophobicContact CD1-SD 3.71Å
791	G	92.9	Very high	91.8	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.1	-133.6	161.7	0	0	0	0	0	112.7	L788 L789 L793 M794	L788-G791 WeakPolarHBondContact O-CA 3.38Å; L788-G791 PolarHBondContact O-N 2.92Å; L789-G791 PolarHBondContact O-N 3.16Å; G791-L793 PolarHBondContact O-N 3.48Å; G791-M794 PolarHBondContact O-N 3.27Å
792	D	91.7	Very high	91.6	Very high	7 Å²	7	24.4 Å²	24.4	4%	0.037	14%	0.144	C	C	.	.	H	α-helix	trans	-65.5	-26.4	-180	-62	-38	0	0	0	111.4	M794 V795 L796 S909 V910 V936	D792-M794 VanDerWaalsContact C-N 3.33Å; D792-M794 PolarHBondContact O-N 3.37Å; D792-V795 WeakPolarHBondContact O-CB 3.49Å; D792-V795 PolarHBondContact O-N 3.31Å; D792-L796 WeakPolarHBondContact O-CG 3.37Å; D792-L796 PolarHBondContact O-N 3.16Å; D792-S909 VanDerWaalsContact CG-OG 3.26Å; D792-S909 VanDerWaalsContact OD1-CA 3.28Å; D792-S909 WeakPolarHBondContact OD1-CA 3.37Å; D792-S909 PolarHBondContact OD1-OG 3.42Å; D792-S909 WeakPolarHBondContact OD2-CB 3.44Å; D792-S909 PolarHBondContact OD2-OG 3.14Å; D792-V910 PolarHBondContact OD1-N 3.34Å; D792-V936 PolarHBondContact N-O 3.34Å; D792-V936 PolarHBondContact OD2-N 3.01Å
793	L	93.8	Very high	91.4	Very high	3 Å²	3	24.6 Å²	24.6	2%	0.016	15%	0.145	C	C	.	.	H	α-helix	trans	-67	-33.4	179	-54.6	-171.9	0	0	0	112.4	L743 L747 L790 G791 V795 L796 L797 V866 N935 M937	L743-L793 HydrophobicContact CD1-CB 3.98Å; L743-L793 HydrophobicContact CD1-CD2 4.49Å; L747-L793 HydrophobicContact CD2-CD2 3.63Å; L790-L793 HydrophobicContact CD1-CB 4.03Å; L790-L793 HydrophobicContact CD1-CD1 4.34Å; L790-L793 HydrophobicContact CG-CB 4.04Å; L790-L793 WeakPolarHBondContact O-CB 3.47Å; L790-L793 PolarHBondContact O-N 3.38Å; G791-L793 PolarHBondContact O-N 3.48Å; L793-V795 VanDerWaalsContact C-N 3.33Å; L793-L796 HydrophobicContact CD2-CD1 4.2Å; L793-L796 PolarHBondContact O-N 3.38Å; L793-L797 WeakPolarHBondContact O-CB 3.31Å; L793-L797 PolarHBondContact O-N 3.19Å; L793-V866 HydrophobicContact CD1-CB 4.4Å; L793-V866 HydrophobicContact CD1-CG1 3.77Å; L793-V866 HydrophobicContact CD1-CG2 3.91Å; L793-N935 HydrophobicContact CD2-CB 4.13Å; L793-M937 HydrophobicContact CD1-CB 4.08Å; L793-M937 HydrophobicContact CD1-SD 4.03Å
794	M	94.6	Very high	90.9	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-67.8	-37.1	173.8	-176.6	56.3	85.7	0	0	111.6	S787 L790 G791 D792 L797 K798 P854 A859	S787-M794 VanDerWaalsContact O-CB 3.31Å; S787-M794 WeakPolarHBondContact O-CB 3.29Å; S787-M794 WeakPolarHBondContact O-CG 3.44Å; S787-M794 VanDerWaalsContact OG-CE 3.29Å; S787-M794 WeakPolarHBondContact OG-CE 3.2Å; S787-M794 WeakPolarHBondContact OG-CG 3.5Å; L790-M794 HydrophobicContact CB-CB 4.02Å; L790-M794 HydrophobicContact CB-CE 4.45Å; L790-M794 HydrophobicContact CD2-CB 4.01Å; L790-M794 HydrophobicContact CD2-CE 3.6Å; L790-M794 HydrophobicContact CD2-SD 4.19Å; L790-M794 HydrophobicContact CG-CB 4.05Å; G791-M794 PolarHBondContact O-N 3.27Å; D792-M794 VanDerWaalsContact C-N 3.33Å; D792-M794 PolarHBondContact O-N 3.37Å; M794-L797 PolarHBondContact O-N 3.11Å; M794-K798 HydrophobicContact CG-CD 4.01Å; M794-K798 WeakPolarHBondContact O-CB 3.49Å; M794-K798 PolarHBondContact O-N 2.68Å; M794-K798 HydrophobicContact SD-CD 3.77Å; M794-K798 WeakPolarHBondContact SD-CE 3.18Å; M794-K798 HydrophobicContact SD-CG 3.9Å; M794-P854 HydrophobicContact CE-CG 3.79Å; M794-P854 HydrophobicContact SD-CG 3.94Å; M794-A859 HydrophobicContact CE-CB 3.47Å; M794-A859 VanDerWaalsContact CE-CB 3.47Å
795	V	92.5	Very high	90.3	Very high	1 Å²	1	23.3 Å²	23.3	1%	0.006	13%	0.132	C	C	.	.	H	α-helix	trans	-62.8	-46.7	175.5	-175.4	0	0	0	0	110	L753 R778 L781 A782 D792 L793 A799 F817 V910	L753-V795 HydrophobicContact CD2-CG1 4.42Å; R778-V795 HydrophobicContact CB-CG1 3.99Å; R778-V795 HydrophobicContact CB-CG2 4.47Å; R778-V795 HydrophobicContact CG-CG1 3.87Å; R778-V795 WeakPolarHBondContact O-CG2 3.45Å; L781-V795 HydrophobicContact CB-CG1 4.3Å; L781-V795 HydrophobicContact CB-CG2 4.5Å; L781-V795 HydrophobicContact CD1-CG1 4.05Å; A782-V795 HydrophobicContact CB-CG2 3.87Å; D792-V795 WeakPolarHBondContact O-CB 3.49Å; D792-V795 PolarHBondContact O-N 3.31Å; L793-V795 VanDerWaalsContact C-N 3.33Å; V795-A799 WeakPolarHBondContact O-CB 3.32Å; V795-A799 PolarHBondContact O-N 3.21Å; V795-F817 HydrophobicContact CG1-CE2 4.39Å; V795-F817 HydrophobicContact CG1-CZ 4Å; V795-V910 HydrophobicContact CG2-CG2 3.81Å
796	L	91.6	Very high	89.7	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-59.6	-48	175	-66.9	-179.9	0	0	0	111.9	A746 L747 P752 L753 D792 L793 S800 F817	A746-L796 HydrophobicContact CB-CB 4.15Å; L747-L796 HydrophobicContact CD2-CD1 4.28Å; P752-L796 HydrophobicContact CB-CD2 4.23Å; P752-L796 HydrophobicContact CG-CD2 3.57Å; L753-L796 HydrophobicContact CD1-CD2 3.82Å; L753-L796 HydrophobicContact CD1-CG 4.36Å; L753-L796 HydrophobicContact CD2-CD2 3.98Å; L753-L796 HydrophobicContact CG-CD2 3.59Å; D792-L796 WeakPolarHBondContact O-CG 3.37Å; D792-L796 PolarHBondContact O-N 3.16Å; L793-L796 HydrophobicContact CD2-CD1 4.2Å; L793-L796 PolarHBondContact O-N 3.38Å; L796-S800 VanDerWaalsContact O-CB 3.3Å; L796-S800 WeakPolarHBondContact O-CB 3.47Å; L796-S800 PolarHBondContact O-N 3.26Å; L796-S800 PolarHBondContact O-OG 3.3Å; L796-F817 HydrophobicContact CD2-CE1 3.85Å
797	L	92.9	Very high	89.2	Confident	0 Å²	0	27 Å²	27	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-62.2	-56.3	-177.8	179	58.8	0	0	0	111.1	C742 L743 L793 M794 A799 S800 L801 P854 L862	C742-L797 HydrophobicContact CB-CD1 3.77Å; L743-L797 HydrophobicContact CB-CD1 4.36Å; L793-L797 WeakPolarHBondContact O-CB 3.31Å; L793-L797 PolarHBondContact O-N 3.19Å; M794-L797 PolarHBondContact O-N 3.11Å; L797-A799 VanDerWaalsContact C-N 3.33Å; L797-A799 PolarHBondContact O-N 3.37Å; L797-S800 WeakPolarHBondContact O-CB 3.48Å; L797-S800 PolarHBondContact O-N 3.24Å; L797-S800 VanDerWaalsContact O-N 3.11Å; L797-L801 HydrophobicContact CD1-CD1 4.4Å; L797-L801 HydrophobicContact CD1-CG 4.34Å; L797-L801 HydrophobicContact CG-CD1 4.36Å; L797-L801 WeakPolarHBondContact O-CG 3.35Å; L797-L801 PolarHBondContact O-N 2.95Å; L797-P854 HydrophobicContact CD2-CG 3.92Å; L797-L862 HydrophobicContact CD2-CD1 3.76Å
798	K	91.6	Very high	88.8	Confident	41 Å²	41	28.6 Å²	28.6	18%	0.178	15%	0.147	C	C	.	.	H	α-helix	trans	-63.9	-36.3	-178	-77.9	172.2	177.7	169.7	0	112.8	L781 S787 M794 S800 L801 A802	L781-K798 HydrophobicContact CD2-CB 4.14Å; L781-K798 WeakPolarHBondContact O-CD 3.37Å; L781-K798 PolarHBondContact O-NZ 3.18Å; S787-K798 PolarHBondContact OG-NZ 3.4Å; M794-K798 HydrophobicContact CG-CD 4.01Å; M794-K798 WeakPolarHBondContact O-CB 3.49Å; M794-K798 PolarHBondContact O-N 2.68Å; M794-K798 HydrophobicContact SD-CD 3.77Å; M794-K798 WeakPolarHBondContact SD-CE 3.18Å; M794-K798 HydrophobicContact SD-CG 3.9Å; K798-S800 VanDerWaalsContact C-N 3.35Å; K798-L801 PolarHBondContact O-N 2.95Å; K798-A802 WeakPolarHBondContact O-CB 3.45Å; K798-A802 PolarHBondContact O-N 3.05Å
799	A	88.8	Confident	88.3	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-66.2	-38.1	174.2	0	0	0	0	0	112.4	L781 V795 L797 L801 A802 A803 F817 M822	L781-A799 HydrophobicContact CD1-CB 4.33Å; V795-A799 WeakPolarHBondContact O-CB 3.32Å; V795-A799 PolarHBondContact O-N 3.21Å; L797-A799 VanDerWaalsContact C-N 3.33Å; L797-A799 PolarHBondContact O-N 3.37Å; A799-L801 VanDerWaalsContact C-N 3.35Å; A799-A802 PolarHBondContact O-N 3.39Å; A799-A803 VanDerWaalsContact O-CB 3.25Å; A799-A803 WeakPolarHBondContact O-CB 3.33Å; A799-A803 PolarHBondContact O-N 2.98Å; A799-F817 HydrophobicContact CB-CD1 4.36Å; A799-F817 HydrophobicContact CB-CD2 4.02Å; A799-F817 HydrophobicContact CB-CE1 3.65Å; A799-F817 HydrophobicContact CB-CE2 3.26Å; A799-F817 HydrophobicContact CB-CZ 3.03Å; A799-M822 HydrophobicContact CB-CE 4.43Å; A799-M822 WeakPolarHBondContact O-CE 3.48Å
800	S	88.9	Confident	87.7	Confident	1 Å²	1	29.7 Å²	29.7	1%	0.007	16%	0.162	C	C	.	.	H	α-helix	trans	-67.3	-35.9	175.6	-56.8	0	0	0	0	112.2	C742 L796 L797 K798	C742-S800 VanDerWaalsContact SG-CB 3.54Å; L796-S800 VanDerWaalsContact O-CB 3.3Å; L796-S800 WeakPolarHBondContact O-CB 3.47Å; L796-S800 PolarHBondContact O-N 3.26Å; L796-S800 PolarHBondContact O-OG 3.3Å; L797-S800 WeakPolarHBondContact O-CB 3.48Å; L797-S800 PolarHBondContact O-N 3.24Å; L797-S800 VanDerWaalsContact O-N 3.11Å; K798-S800 VanDerWaalsContact C-N 3.35Å
801	L	88.9	Confident	87.3	Confident	13 Å²	13	31.4 Å²	31.4	7%	0.068	17%	0.169	C	C	.	.	H	α-helix	trans	-67.9	-44.9	172.6	-65	-178.5	0	0	0	111.9	Y739 C742 L797 K798 A799 E804 R829 L851	Y739-L801 HydrophobicContact CD1-CD1 4.33Å; Y739-L801 HydrophobicContact CE1-CD1 4.18Å; C742-L801 HydrophobicContact CB-CD2 4.44Å; L797-L801 HydrophobicContact CD1-CD1 4.4Å; L797-L801 HydrophobicContact CD1-CG 4.34Å; L797-L801 HydrophobicContact CG-CD1 4.36Å; L797-L801 WeakPolarHBondContact O-CG 3.35Å; L797-L801 PolarHBondContact O-N 2.95Å; K798-L801 PolarHBondContact O-N 2.95Å; A799-L801 VanDerWaalsContact C-N 3.35Å; L801-E804 PolarHBondContact O-N 3.3Å; L801-R829 VanDerWaalsContact CD2-NH1 3.33Å; L801-L851 HydrophobicContact CD2-CB 3.91Å; L801-L851 HydrophobicContact CD2-CD1 3.95Å; L801-L851 HydrophobicContact CD2-CG 4.47Å
802	A	86.8	Confident	86.9	Confident	31 Å²	31	31.5 Å²	31.5	26%	0.256	17%	0.17	S	C	.	.	H	α-helix	trans	-67.5	-36.6	179.3	0	0	0	0	0	112.6	K798 A799 E804 Q805 E806 F811	K798-A802 WeakPolarHBondContact O-CB 3.45Å; K798-A802 PolarHBondContact O-N 3.05Å; A799-A802 PolarHBondContact O-N 3.39Å; A802-E804 PolarHBondContact O-N 2.93Å; A802-Q805 WeakPolarHBondContact O-CB 3.4Å; A802-Q805 PolarHBondContact O-N 3.43Å; A802-E806 PolarHBondContact O-N 3.38Å; A802-F811 HydrophobicContact CB-CE2 4.08Å; A802-F811 HydrophobicContact CB-CZ 3.7Å
803	A	84.5	Confident	86.2	Confident	3 Å²	3	35 Å²	35	3%	0.025	19%	0.186	C	C	.	.	H	α-helix	trans	-61.4	-23	176.1	0	0	0	0	0	113.3	A799 Q805 L807 F811 M822	A799-A803 VanDerWaalsContact O-CB 3.25Å; A799-A803 WeakPolarHBondContact O-CB 3.33Å; A799-A803 PolarHBondContact O-N 2.98Å; A803-Q805 VanDerWaalsContact C-N 3.28Å; A803-Q805 PolarHBondContact O-N 2.93Å; A803-L807 HydrophobicContact CB-CD1 4.11Å; A803-L807 VanDerWaalsContact O-CB 3.31Å; A803-L807 WeakPolarHBondContact O-CB 3.35Å; A803-L807 PolarHBondContact O-N 3.47Å; A803-F811 HydrophobicContact CB-CE1 4.38Å; A803-M822 HydrophobicContact CB-CE 3.43Å; A803-M822 VanDerWaalsContact CB-CE 3.43Å
804	E	79.3	Confident	85.5	Confident	38 Å²	38	40.3 Å²	40.3	18%	0.178	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-21.8	174.3	-72.2	-172.2	159.9	0	0	113.7	L801 A802 R829	L801-E804 PolarHBondContact O-N 3.3Å; A802-E804 PolarHBondContact O-N 2.93Å; E804-R829 WeakPolarHBondContact OE1-CD 3.48Å; E804-R829 IonicContact OE1-CZ 3.65Å; E804-R829 IonicContact OE1-NE 3.95Å; E804-R829 PolarHBondContact OE1-NE 3.14Å; E804-R829 IonicContact OE1-NH1 3.1Å; E804-R829 PolarHBondContact OE1-NH1 2.93Å; E804-R829 IonicContact OE1-NH2 3.42Å; E804-R829 IonicContact OE2-CZ 2.85Å; E804-R829 IonicContact OE2-NH1 3.72Å; E804-R829 PolarHBondContact OE2-NH1 2.83Å; E804-R829 IonicContact OE2-NH2 3.62Å; E804-R829 PolarHBondContact OE2-NH2 3.35Å
805	Q	78.6	Confident	84.8	Confident	128 Å²	128	41.4 Å²	41.4	60%	0.598	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-51	176	-63.7	-179.9	-19.3	0	0	110.6	A802 A803 Q850	A802-Q805 WeakPolarHBondContact O-CB 3.4Å; A802-Q805 PolarHBondContact O-N 3.43Å; A803-Q805 VanDerWaalsContact C-N 3.28Å; A803-Q805 PolarHBondContact O-N 2.93Å; Q805-Q850 HydrophobicContact CG-CG 4.25Å
806	E	79.5	Confident	84.1	Confident	134 Å²	134	41.4 Å²	41.4	63%	0.626	21%	0.214	S	C	*	.			trans	-148.9	87.7	-176.3	-168.3	178.6	178.4	0	0	110.7	A802 T808	A802-E806 PolarHBondContact O-N 3.38Å; E806-T808 HydrophobicContact CG-CG2 3.84Å; E806-T808 PolarHBondContact O-N 3.23Å; E806-T808 VanDerWaalsContact O-N 3.16Å
807	L	82.4	Confident	83.7	Confident	45 Å²	45	41.5 Å²	41.5	24%	0.236	21%	0.214	C	C	.	.			trans	-81.4	91.5	173.8	-177.4	52.6	0	0	0	110.4	A803 Y819 M822 V823	A803-L807 HydrophobicContact CB-CD1 4.11Å; A803-L807 VanDerWaalsContact O-CB 3.31Å; A803-L807 WeakPolarHBondContact O-CB 3.35Å; A803-L807 PolarHBondContact O-N 3.47Å; L807-Y819 HydrophobicContact CD1-CD2 4Å; L807-Y819 HydrophobicContact CD1-CE2 4Å; L807-Y819 HydrophobicContact CD2-CE2 4.41Å; L807-Y819 HydrophobicContact CG-CD2 4.23Å; L807-Y819 HydrophobicContact CG-CE2 3.72Å; L807-M822 HydrophobicContact CD1-CB 3.65Å; L807-M822 HydrophobicContact CD1-CG 4.4Å; L807-M822 HydrophobicContact CD2-CB 4.36Å; L807-V823 HydrophobicContact CD2-CB 4.37Å; L807-V823 HydrophobicContact CD2-CG2 3.56Å
808	T	84.9	Confident	83.1	Confident	43 Å²	43	42.3 Å²	42.3	26%	0.264	22%	0.218	S	C	.	.			trans	-110.9	155.9	172.8	54.1	0	0	0	0	111.5	E806 S810 F811 C812	E806-T808 HydrophobicContact CG-CG2 3.84Å; E806-T808 PolarHBondContact O-N 3.23Å; E806-T808 VanDerWaalsContact O-N 3.16Å; T808-S810 VanDerWaalsContact C-N 3.31Å; T808-S810 PolarHBondContact OG1-OG 3.29Å; T808-F811 PolarHBondContact O-N 3.44Å; T808-F811 WeakPolarHBondContact OG1-CB 3.39Å; T808-F811 PolarHBondContact OG1-N 3.32Å; T808-C812 PolarHBondContact O-N 3.36Å; T808-C812 VanDerWaalsContact O-N 3.16Å; T808-C812 PolarHBondContact O-SG 3.06Å
809	V	82.5	Confident	82.6	Confident	57 Å²	57	45 Å²	45	35%	0.345	23%	0.227	S	C	.	.	H	α-helix	trans	-62.4	-43	174.8	-177.1	0	0	0	0	110.1	D502 F811 C812 E813 Y819	D502-V809 WeakPolarHBondContact OD2-CG1 3.44Å; V809-F811 VanDerWaalsContact C-N 3.34Å; V809-F811 PolarHBondContact O-N 2.98Å; V809-C812 WeakPolarHBondContact O-CA 3.48Å; V809-C812 WeakPolarHBondContact O-CB 3.47Å; V809-C812 PolarHBondContact O-N 3.48Å; V809-E813 HydrophobicContact CG1-CG 4.4Å; V809-E813 WeakPolarHBondContact O-CG 3.26Å; V809-E813 PolarHBondContact O-N 3.01Å; V809-Y819 HydrophobicContact CB-CD2 4.48Å; V809-Y819 HydrophobicContact CG2-CD1 4.42Å; V809-Y819 HydrophobicContact CG2-CD2 3.88Å; V809-Y819 HydrophobicContact CG2-CE2 4.01Å; V809-Y819 HydrophobicContact CG2-CG 4.1Å
810	S	82.1	Confident	82	Confident	79 Å²	79	47.5 Å²	47.5	55%	0.552	24%	0.238	S	C	*	.	H	α-helix	trans	-59.8	-39.3	176.3	55.8	0	0	0	0	113.2	T808 E813 K814	T808-S810 VanDerWaalsContact C-N 3.31Å; T808-S810 PolarHBondContact OG1-OG 3.29Å; S810-E813 PolarHBondContact O-N 3.4Å; S810-K814 VanDerWaalsContact O-CB 3.31Å; S810-K814 WeakPolarHBondContact O-CB 3.34Å; S810-K814 PolarHBondContact O-N 2.83Å
811	F	85.2	Confident	81.7	Confident	36 Å²	36	47.5 Å²	47.5	16%	0.158	24%	0.238	C	C	.	.	H	α-helix	trans	-60	-47.1	172	173.9	-93.2	0	0	0	111.1	A802 A803 T808 V809 E813 K814 H815	A802-F811 HydrophobicContact CB-CE2 4.08Å; A802-F811 HydrophobicContact CB-CZ 3.7Å; A803-F811 HydrophobicContact CB-CE1 4.38Å; T808-F811 PolarHBondContact O-N 3.44Å; T808-F811 WeakPolarHBondContact OG1-CB 3.39Å; T808-F811 PolarHBondContact OG1-N 3.32Å; V809-F811 VanDerWaalsContact C-N 3.34Å; V809-F811 PolarHBondContact O-N 2.98Å; F811-E813 PolarHBondContact O-N 2.91Å; F811-K814 PolarHBondContact O-N 2.81Å; F811-H815 AromaticContact CD2-CD2 3.53Å; F811-H815 AromaticContact CD2-NE2 3.8Å; F811-H815 AromaticContact CE2-CD2 3.32Å; F811-H815 WeakPolarHBondContact CE2-CD2 3.48Å; F811-H815 AromaticContact CE2-NE2 3.43Å; F811-H815 WeakPolarHBondContact CE2-NE2 3.35Å; F811-H815 AromaticContact CZ-CD2 3.7Å; F811-H815 PolarHBondContact O-CD2 3.15Å; F811-H815 VanDerWaalsContact O-CD2 3.28Å; F811-H815 PolarHBondContact O-N 3.05Å; F811-H815 VanDerWaalsContact O-N 3.12Å
812	C	83.3	Confident	81.7	Confident	2 Å²	2	46.9 Å²	46.9	1%	0.014	24%	0.235	C	C	.	.	H	α-helix	trans	-61.9	-46.2	179.5	-66.4	0	0	0	0	111.3	T808 V809 K814 H815 G816 F817	T808-C812 PolarHBondContact O-N 3.36Å; T808-C812 VanDerWaalsContact O-N 3.16Å; T808-C812 PolarHBondContact O-SG 3.06Å; V809-C812 WeakPolarHBondContact O-CA 3.48Å; V809-C812 WeakPolarHBondContact O-CB 3.47Å; V809-C812 PolarHBondContact O-N 3.48Å; C812-K814 PolarHBondContact O-N 3.26Å; C812-H815 PolarHBondContact O-N 3.42Å; C812-G816 CarbonylContact O-C 3.56Å; C812-G816 WeakPolarHBondContact O-CA 3.39Å; C812-G816 PolarHBondContact O-N 3.17Å; C812-F817 CarbonylContact C-O 3.6Å; C812-F817 HydrophobicContact CB-CB 4.33Å; C812-F817 WeakPolarHBondContact CB-O 3.18Å; C812-F817 PolarHBondContact O-N 3.24Å
813	E	78.2	Confident	81.6	Confident	79 Å²	79	47.2 Å²	47.2	37%	0.369	23%	0.234	S	C	.	.	H	α-helix	trans	-60.7	-46.4	177.2	-66.8	-161.5	126	0	0	112.8	V809 S810 F811 H815 G816	V809-E813 HydrophobicContact CG1-CG 4.4Å; V809-E813 WeakPolarHBondContact O-CG 3.26Å; V809-E813 PolarHBondContact O-N 3.01Å; S810-E813 PolarHBondContact O-N 3.4Å; F811-E813 PolarHBondContact O-N 2.91Å; E813-H815 VanDerWaalsContact C-N 3.34Å; E813-H815 PolarHBondContact O-N 3.2Å; E813-G816 PolarHBondContact O-N 2.84Å; E813-G816 VanDerWaalsContact O-N 3.17Å
814	K	79.5	Confident	81.6	Confident	115 Å²	115	51.1 Å²	51.1	50%	0.5	25%	0.251	S	S	.	.	H	α-helix	trans	-59.4	-42.6	-179.4	-178.5	-179.4	-179.2	-179.8	0	112.6	S810 F811 C812	S810-K814 VanDerWaalsContact O-CB 3.31Å; S810-K814 WeakPolarHBondContact O-CB 3.34Å; S810-K814 PolarHBondContact O-N 2.83Å; F811-K814 PolarHBondContact O-N 2.81Å; C812-K814 PolarHBondContact O-N 3.26Å
815	H	78.6	Confident	82.1	Confident	23 Å²	23	49.4 Å²	49.4	11%	0.106	24%	0.243	C	C	.	.	H	α-helix	trans	-90	-5.5	-179.2	-68.4	-80.1	0	0	0	112.9	S777 R778 L781 F811 C812 E813 F817	S777-H815 PolarHBondContact OG-CE1 2.87Å; S777-H815 PolarHBondContact OG-ND1 3.29Å; R778-H815 PolarHBondContact NE-O 3.49Å; L781-H815 WeakPolarHBondContact CD1-ND1 3.33Å; F811-H815 AromaticContact CD2-CD2 3.53Å; F811-H815 AromaticContact CD2-NE2 3.8Å; F811-H815 AromaticContact CE2-CD2 3.32Å; F811-H815 WeakPolarHBondContact CE2-CD2 3.48Å; F811-H815 AromaticContact CE2-NE2 3.43Å; F811-H815 WeakPolarHBondContact CE2-NE2 3.35Å; F811-H815 AromaticContact CZ-CD2 3.7Å; F811-H815 PolarHBondContact O-CD2 3.15Å; F811-H815 VanDerWaalsContact O-CD2 3.28Å; F811-H815 PolarHBondContact O-N 3.05Å; F811-H815 VanDerWaalsContact O-N 3.12Å; C812-H815 PolarHBondContact O-N 3.42Å; E813-H815 VanDerWaalsContact C-N 3.34Å; E813-H815 PolarHBondContact O-N 3.2Å; H815-F817 HydrophobicContact CB-CD2 3.5Å; H815-F817 VanDerWaalsContact CB-CD2 3.5Å; H815-F817 HydrophobicContact CB-CE2 3.72Å
816	G	78.6	Confident	82.5	Confident	1 Å²	1	43.8 Å²	43.8	1%	0.01	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.5	39.9	-178.1	0	0	0	0	0	113.4	L754 C774 R778 C812 E813	L754-G816 WeakPolarHBondContact CB-O 3.43Å; L754-G816 PolarHBondContact N-O 3.21Å; C774-G816 VanDerWaalsContact SG-CA 3.55Å; R778-G816 PolarHBondContact NH2-O 2.82Å; C812-G816 CarbonylContact O-C 3.56Å; C812-G816 WeakPolarHBondContact O-CA 3.39Å; C812-G816 PolarHBondContact O-N 3.17Å; E813-G816 PolarHBondContact O-N 2.84Å; E813-G816 VanDerWaalsContact O-N 3.17Å
817	F	83.4	Confident	82.8	Confident	3 Å²	3	43.3 Å²	43.3	1%	0.013	21%	0.214	C	C	.	.	B	Isolated β-bridge	trans	-102.9	151.1	173.6	-73.1	-91.3	0	0	0	111.1	P752 L753 L754 L781 V795 L796 A799 C812 H815 Y819 M822	P752-F817 WeakPolarHBondContact O-CA 3.27Å; L753-F817 HydrophobicContact CD2-CD1 3.97Å; L753-F817 HydrophobicContact CD2-CE1 3.41Å; L753-F817 VanDerWaalsContact CD2-CE1 3.41Å; L753-F817 HydrophobicContact CD2-CE2 4.07Å; L753-F817 HydrophobicContact CD2-CZ 3.45Å; L753-F817 VanDerWaalsContact CD2-CZ 3.45Å; L753-F817 HydrophobicContact CG-CE1 4.29Å; L754-F817 WeakPolarHBondContact CD1-O 3.18Å; L781-F817 HydrophobicContact CD1-CE2 4.48Å; V795-F817 HydrophobicContact CG1-CE2 4.39Å; V795-F817 HydrophobicContact CG1-CZ 4Å; L796-F817 HydrophobicContact CD2-CE1 3.85Å; A799-F817 HydrophobicContact CB-CD1 4.36Å; A799-F817 HydrophobicContact CB-CD2 4.02Å; A799-F817 HydrophobicContact CB-CE1 3.65Å; A799-F817 HydrophobicContact CB-CE2 3.26Å; A799-F817 HydrophobicContact CB-CZ 3.03Å; C812-F817 CarbonylContact C-O 3.6Å; C812-F817 HydrophobicContact CB-CB 4.33Å; C812-F817 WeakPolarHBondContact CB-O 3.18Å; C812-F817 PolarHBondContact O-N 3.24Å; H815-F817 HydrophobicContact CB-CD2 3.5Å; H815-F817 VanDerWaalsContact CB-CD2 3.5Å; H815-F817 HydrophobicContact CB-CE2 3.72Å; F817-Y819 PolarHBondContact O-N 3.2Å; F817-M822 HydrophobicContact CB-CG 3.91Å; F817-M822 HydrophobicContact CB-SD 4.09Å; F817-M822 HydrophobicContact CD1-CG 4.46Å; F817-M822 HydrophobicContact CD1-SD 3.53Å; F817-M822 VanDerWaalsContact CD1-SD 3.53Å; F817-M822 HydrophobicContact CE1-SD 4.21Å; F817-M822 HydrophobicContact CG-CG 4.44Å; F817-M822 HydrophobicContact CG-SD 4Å
818	R	79.3	Confident	83.1	Confident	17 Å²	17	42.8 Å²	42.8	6%	0.064	21%	0.211	C	C	.	.			trans	-79.4	116.6	170.1	179.5	-169.9	-41.1	-149.4	-6.6	108.9	D505 D507 E751 P752 L754 K820 A821 M822	D505-R818 WeakPolarHBondContact OD1-CD 3.41Å; D505-R818 WeakPolarHBondContact OD1-CG 3.49Å; D505-R818 IonicContact OD1-CZ 3.29Å; D505-R818 IonicContact OD1-NE 2.9Å; D505-R818 PolarHBondContact OD1-NE 3.38Å; D505-R818 IonicContact OD1-NH1 2.6Å; D505-R818 PolarHBondContact OD1-NH1 3.42Å; D505-R818 IonicContact OD1-NH2 2.82Å; D505-R818 VanDerWaalsContact OD2-CD 3.24Å; D505-R818 WeakPolarHBondContact OD2-CD 3.4Å; D505-R818 WeakPolarHBondContact OD2-CG 3.31Å; D505-R818 IonicContact OD2-NE 2.73Å; D507-R818 IonicContact OD1-NH1 3.86Å; D507-R818 PolarHBondContact OD1-NH1 2.77Å; D507-R818 IonicContact OD1-NH2 2.6Å; E751-R818 PolarHBondContact O-NE 3.37Å; E751-R818 PolarHBondContact O-NH2 2.97Å; E751-R818 IonicContact OE2-NH2 2.81Å; E751-R818 PolarHBondContact OE2-NH2 2.88Å; P752-R818 PolarHBondContact O-N 3.23Å; L754-R818 HydrophobicContact CD2-CB 4.25Å; L754-R818 HydrophobicContact CG-CB 4.48Å; R818-K820 VanDerWaalsContact C-N 3.29Å; R818-K820 PolarHBondContact O-N 3Å; R818-A821 HydrophobicContact CB-CB 3.85Å; R818-A821 HydrophobicContact CG-CB 4.08Å; R818-A821 WeakPolarHBondContact O-CB 3.45Å; R818-A821 PolarHBondContact O-N 3.47Å; R818-M822 PolarHBondContact O-N 3.34Å
819	Y	81.9	Confident	83.3	Confident	98 Å²	98	41.3 Å²	41.3	38%	0.384	20%	0.201	S	C	.	.	H	α-helix	trans	-52.8	-45	-177.7	176.5	-99.5	0	0	0	112.8	L807 V809 F817 A821 M822 V823	L807-Y819 HydrophobicContact CD1-CD2 4Å; L807-Y819 HydrophobicContact CD1-CE2 4Å; L807-Y819 HydrophobicContact CD2-CE2 4.41Å; L807-Y819 HydrophobicContact CG-CD2 4.23Å; L807-Y819 HydrophobicContact CG-CE2 3.72Å; V809-Y819 HydrophobicContact CB-CD2 4.48Å; V809-Y819 HydrophobicContact CG2-CD1 4.42Å; V809-Y819 HydrophobicContact CG2-CD2 3.88Å; V809-Y819 HydrophobicContact CG2-CE2 4.01Å; V809-Y819 HydrophobicContact CG2-CG 4.1Å; F817-Y819 PolarHBondContact O-N 3.2Å; Y819-A821 PolarHBondContact O-N 3.31Å; Y819-M822 PolarHBondContact O-N 3.15Å; Y819-V823 HydrophobicContact CD1-CG2 4.37Å; Y819-V823 HydrophobicContact CE1-CG2 3.96Å; Y819-V823 WeakPolarHBondContact O-CG2 3.32Å; Y819-V823 PolarHBondContact O-N 3.28Å
820	K	75.8	Confident	83.6	Confident	51 Å²	51	44.1 Å²	44.1	22%	0.222	21%	0.205	C	C	.	.	H	α-helix	trans	-63.3	-41	177	-68.4	-177.2	-174.4	170.2	0	113.2	L543 R818 M822 V823 E824	L543-K820 PolarHBondContact O-NZ 2.85Å; R818-K820 VanDerWaalsContact C-N 3.29Å; R818-K820 PolarHBondContact O-N 3Å; K820-M822 VanDerWaalsContact C-N 3.28Å; K820-M822 PolarHBondContact O-N 3.43Å; K820-V823 PolarHBondContact O-N 3.14Å; K820-E824 WeakPolarHBondContact O-CG 3.44Å; K820-E824 PolarHBondContact O-N 3.24Å
821	A	83.4	Confident	83.8	Confident	2 Å²	2	43.1 Å²	43.1	2%	0.017	19%	0.192	C	C	.	.	H	α-helix	trans	-60.5	-43	176.2	0	0	0	0	0	110.1	V749 P752 R818 Y819 V823 E824 I825	V749-A821 HydrophobicContact CG1-CB 3.68Å; P752-A821 HydrophobicContact CB-CB 4.06Å; R818-A821 HydrophobicContact CB-CB 3.85Å; R818-A821 HydrophobicContact CG-CB 4.08Å; R818-A821 WeakPolarHBondContact O-CB 3.45Å; R818-A821 PolarHBondContact O-N 3.47Å; Y819-A821 PolarHBondContact O-N 3.31Å; A821-V823 PolarHBondContact O-N 2.99Å; A821-E824 CarbonylContact O-C 3.59Å; A821-E824 WeakPolarHBondContact O-CB 3.33Å; A821-E824 PolarHBondContact O-N 3.27Å; A821-E824 VanDerWaalsContact O-N 3.13Å; A821-I825 WeakPolarHBondContact O-CG1 3.3Å; A821-I825 PolarHBondContact O-N 2.83Å
822	M	87.6	Confident	84	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-61.2	-42.2	176.6	-62.9	-52.5	-65.4	0	0	112.4	A799 A803 L807 F817 R818 Y819 K820 E824 I825 C826	A799-M822 HydrophobicContact CB-CE 4.43Å; A799-M822 WeakPolarHBondContact O-CE 3.48Å; A803-M822 HydrophobicContact CB-CE 3.43Å; A803-M822 VanDerWaalsContact CB-CE 3.43Å; L807-M822 HydrophobicContact CD1-CB 3.65Å; L807-M822 HydrophobicContact CD1-CG 4.4Å; L807-M822 HydrophobicContact CD2-CB 4.36Å; F817-M822 HydrophobicContact CB-CG 3.91Å; F817-M822 HydrophobicContact CB-SD 4.09Å; F817-M822 HydrophobicContact CD1-CG 4.46Å; F817-M822 HydrophobicContact CD1-SD 3.53Å; F817-M822 VanDerWaalsContact CD1-SD 3.53Å; F817-M822 HydrophobicContact CE1-SD 4.21Å; F817-M822 HydrophobicContact CG-CG 4.44Å; F817-M822 HydrophobicContact CG-SD 4Å; R818-M822 PolarHBondContact O-N 3.34Å; Y819-M822 PolarHBondContact O-N 3.15Å; K820-M822 VanDerWaalsContact C-N 3.28Å; K820-M822 PolarHBondContact O-N 3.43Å; M822-E824 VanDerWaalsContact C-N 3.32Å; M822-E824 PolarHBondContact O-N 3.02Å; M822-I825 PolarHBondContact O-N 2.78Å; M822-I825 HydrophobicContact SD-CD1 3.96Å; M822-C826 PolarHBondContact O-N 3.33Å; M822-C826 PolarHBondContact O-SG 2.84Å; M822-C826 VanDerWaalsContact O-SG 3.32Å
823	V	85.9	Confident	84.3	Confident	37 Å²	37	42 Å²	42	22%	0.224	19%	0.187	C	C	.	.	H	α-helix	trans	-59.4	-44.2	173.3	175.5	0	0	0	0	111.2	L807 Y819 K820 A821 C826 K827	L807-V823 HydrophobicContact CD2-CB 4.37Å; L807-V823 HydrophobicContact CD2-CG2 3.56Å; Y819-V823 HydrophobicContact CD1-CG2 4.37Å; Y819-V823 HydrophobicContact CE1-CG2 3.96Å; Y819-V823 WeakPolarHBondContact O-CG2 3.32Å; Y819-V823 PolarHBondContact O-N 3.28Å; K820-V823 PolarHBondContact O-N 3.14Å; A821-V823 PolarHBondContact O-N 2.99Å; V823-C826 PolarHBondContact O-N 3.17Å; V823-K827 HydrophobicContact CG1-CD 4.27Å; V823-K827 WeakPolarHBondContact O-CG 3.38Å; V823-K827 PolarHBondContact O-N 3.11Å
824	E	82.9	Confident	84.7	Confident	85 Å²	85	44.4 Å²	44.4	40%	0.397	20%	0.197	S	C	.	.	H	α-helix	trans	-64.7	-40.6	177.5	-73.2	178.2	-169.5	0	0	112.2	V749 K820 A821 M822 K827 M828	V749-E824 HydrophobicContact CG1-CB 4.31Å; V749-E824 HydrophobicContact CG2-CB 4Å; K820-E824 WeakPolarHBondContact O-CG 3.44Å; K820-E824 PolarHBondContact O-N 3.24Å; A821-E824 CarbonylContact O-C 3.59Å; A821-E824 WeakPolarHBondContact O-CB 3.33Å; A821-E824 PolarHBondContact O-N 3.27Å; A821-E824 VanDerWaalsContact O-N 3.13Å; M822-E824 VanDerWaalsContact C-N 3.32Å; M822-E824 PolarHBondContact O-N 3.02Å; E824-K827 PolarHBondContact O-N 3.45Å; E824-M828 WeakPolarHBondContact O-CB 3.48Å; E824-M828 PolarHBondContact O-N 3.12Å
825	I	89.6	Confident	85	Confident	2 Å²	2	40.4 Å²	40.4	1%	0.01	18%	0.18	C	C	.	.	H	α-helix	trans	-60.6	-49	175.9	-68.4	169	0	0	0	110.2	A746 V749 P752 A821 M822 K827 M828 R829	A746-I825 HydrophobicContact CB-CD1 3.97Å; A746-I825 HydrophobicContact CB-CG1 4.46Å; A746-I825 HydrophobicContact CB-CG2 4.35Å; V749-I825 HydrophobicContact CB-CD1 4.44Å; V749-I825 HydrophobicContact CB-CG1 3.82Å; V749-I825 HydrophobicContact CG1-CG1 4.23Å; V749-I825 HydrophobicContact CG2-CG1 3.66Å; P752-I825 HydrophobicContact CB-CD1 3.94Å; A821-I825 WeakPolarHBondContact O-CG1 3.3Å; A821-I825 PolarHBondContact O-N 2.83Å; M822-I825 PolarHBondContact O-N 2.78Å; M822-I825 HydrophobicContact SD-CD1 3.96Å; I825-K827 VanDerWaalsContact C-N 3.3Å; I825-K827 PolarHBondContact O-N 3.17Å; I825-M828 PolarHBondContact O-N 3.27Å; I825-R829 WeakPolarHBondContact O-CB 3.44Å; I825-R829 PolarHBondContact O-N 3.05Å
826	C	88.3	Confident	85.5	Confident	11 Å²	11	39.7 Å²	39.7	7%	0.074	18%	0.178	C	C	.	.	H	α-helix	trans	-60.2	-40.6	177.5	-67	0	0	0	0	111.8	M822 V823 R830	M822-C826 PolarHBondContact O-N 3.33Å; M822-C826 PolarHBondContact O-SG 2.84Å; M822-C826 VanDerWaalsContact O-SG 3.32Å; V823-C826 PolarHBondContact O-N 3.17Å; C826-R830 WeakPolarHBondContact O-CG 3.49Å; C826-R830 PolarHBondContact O-N 3.4Å
827	K	85.6	Confident	85.9	Confident	123 Å²	123	41.5 Å²	41.5	54%	0.535	19%	0.187	S	C	.	.	H	α-helix	trans	-64.5	-46.1	175.4	-74.1	176.5	-179.4	-177.7	0	111.6	V823 E824 I825 R830 Q831	V823-K827 HydrophobicContact CG1-CD 4.27Å; V823-K827 WeakPolarHBondContact O-CG 3.38Å; V823-K827 PolarHBondContact O-N 3.11Å; E824-K827 PolarHBondContact O-N 3.45Å; I825-K827 VanDerWaalsContact C-N 3.3Å; I825-K827 PolarHBondContact O-N 3.17Å; K827-R830 PolarHBondContact O-N 3.44Å; K827-Q831 VanDerWaalsContact O-CG 3.26Å; K827-Q831 WeakPolarHBondContact O-CG 3.06Å; K827-Q831 PolarHBondContact O-N 3.4Å
828	M	87.5	Confident	86.1	Confident	34 Å²	34	45.3 Å²	45.3	17%	0.167	22%	0.219	C	C	.	.	H	α-helix	trans	-65	-41.5	-179.3	-171.5	167.7	-144.5	0	0	111.7	L720 S748 V749 E824 I825 Q831 L832	L720-M828 HydrophobicContact CD2-CE 4.04Å; S748-M828 WeakPolarHBondContact CB-SD 3.44Å; V749-M828 HydrophobicContact CG2-SD 4.36Å; E824-M828 WeakPolarHBondContact O-CB 3.48Å; E824-M828 PolarHBondContact O-N 3.12Å; I825-M828 PolarHBondContact O-N 3.27Å; M828-Q831 WeakPolarHBondContact O-CB 3.47Å; M828-Q831 PolarHBondContact O-N 2.82Å; M828-L832 HydrophobicContact CG-CD1 4.09Å; M828-L832 HydrophobicContact CG-CG 4.34Å; M828-L832 WeakPolarHBondContact O-CB 3.43Å; M828-L832 WeakPolarHBondContact O-CG 3.4Å; M828-L832 PolarHBondContact O-N 3.14Å
829	R	90.1	Very high	86.2	Confident	13 Å²	13	48.8 Å²	48.8	5%	0.049	24%	0.239	C	C	.	.	H	α-helix	trans	-58.4	-52.3	174.7	175.2	170.3	170.7	-155.6	-21.2	111.2	I741 S745 L801 E804 I825 Q831 L832 T833 T849 L851	I741-R829 HydrophobicContact CG2-CG 4.13Å; S745-R829 VanDerWaalsContact OG-CA 3.23Å; S745-R829 WeakPolarHBondContact OG-CA 3.47Å; S745-R829 PolarHBondContact OG-N 3.42Å; L801-R829 VanDerWaalsContact CD2-NH1 3.33Å; E804-R829 WeakPolarHBondContact OE1-CD 3.48Å; E804-R829 IonicContact OE1-CZ 3.65Å; E804-R829 IonicContact OE1-NE 3.95Å; E804-R829 PolarHBondContact OE1-NE 3.14Å; E804-R829 IonicContact OE1-NH1 3.1Å; E804-R829 PolarHBondContact OE1-NH1 2.93Å; E804-R829 IonicContact OE1-NH2 3.42Å; E804-R829 IonicContact OE2-CZ 2.85Å; E804-R829 IonicContact OE2-NH1 3.72Å; E804-R829 PolarHBondContact OE2-NH1 2.83Å; E804-R829 IonicContact OE2-NH2 3.62Å; E804-R829 PolarHBondContact OE2-NH2 3.35Å; I825-R829 WeakPolarHBondContact O-CB 3.44Å; I825-R829 PolarHBondContact O-N 3.05Å; R829-Q831 PolarHBondContact O-N 2.88Å; R829-L832 PolarHBondContact O-N 3.11Å; R829-T833 WeakPolarHBondContact O-CB 3.37Å; R829-T833 PolarHBondContact O-N 3.23Å; R829-T833 PolarHBondContact O-OG1 2.86Å; R829-T849 PolarHBondContact NH2-O 2.59Å; R829-L851 VanDerWaalsContact NH2-CD1 3.29Å
830	R	89	Confident	86.2	Confident	116 Å²	116	46.1 Å²	46.1	44%	0.438	23%	0.234	S	C	.	.	H	α-helix	trans	-57	-39.8	176.6	-69.4	174.3	-169.1	172.6	3.5	112	C826 K827 K834	C826-R830 WeakPolarHBondContact O-CG 3.49Å; C826-R830 PolarHBondContact O-N 3.4Å; K827-R830 PolarHBondContact O-N 3.44Å; R830-K834 WeakPolarHBondContact O-CG 3.15Å; R830-K834 PolarHBondContact O-N 3.34Å; R830-K834 VanDerWaalsContact O-N 3.14Å
831	Q	85.3	Confident	86	Confident	58 Å²	58	49.8 Å²	49.8	27%	0.271	26%	0.261	S	S	.	.	H	α-helix	trans	-66.8	-48	177.9	-74.4	170.3	-3.1	0	0	112.1	F305 K827 M828 R829 K834 I835	F305-Q831 HydrophobicContact CD2-CG 4.03Å; F305-Q831 HydrophobicContact CE2-CB 4.24Å; F305-Q831 HydrophobicContact CE2-CG 4.06Å; F305-Q831 HydrophobicContact CG-CG 4.33Å; F305-Q831 HydrophobicContact CZ-CB 4.17Å; F305-Q831 HydrophobicContact CZ-CG 4.41Å; K827-Q831 VanDerWaalsContact O-CG 3.26Å; K827-Q831 WeakPolarHBondContact O-CG 3.06Å; K827-Q831 PolarHBondContact O-N 3.4Å; M828-Q831 WeakPolarHBondContact O-CB 3.47Å; M828-Q831 PolarHBondContact O-N 2.82Å; R829-Q831 PolarHBondContact O-N 2.88Å; Q831-K834 WeakPolarHBondContact O-CB 3.32Å; Q831-K834 PolarHBondContact O-N 2.97Å; Q831-I835 VanDerWaalsContact O-CG1 3.31Å; Q831-I835 WeakPolarHBondContact O-CG1 3.3Å; Q831-I835 PolarHBondContact O-N 2.9Å
832	L	89.5	Confident	85.4	Confident	3 Å²	3	58.1 Å²	58.1	2%	0.016	30%	0.299	C	S	.	.	H	α-helix	trans	-64.6	-41.8	179.1	-72	175.8	0	0	0	111.4	P719 L720 I741 V744 M828 R829 K834 I835 V836	P719-L832 HydrophobicContact CG-CD2 4.44Å; L720-L832 HydrophobicContact CD1-CD1 4.24Å; L720-L832 HydrophobicContact CD1-CD2 3.91Å; L720-L832 HydrophobicContact CD2-CD1 4.05Å; L720-L832 HydrophobicContact CD2-CD2 4.11Å; L720-L832 HydrophobicContact CG-CD2 3.94Å; I741-L832 HydrophobicContact CG2-CB 3.67Å; I741-L832 HydrophobicContact CG2-CD1 4.3Å; V744-L832 HydrophobicContact CG1-CD1 4.36Å; M828-L832 HydrophobicContact CG-CD1 4.09Å; M828-L832 HydrophobicContact CG-CG 4.34Å; M828-L832 WeakPolarHBondContact O-CB 3.43Å; M828-L832 WeakPolarHBondContact O-CG 3.4Å; M828-L832 PolarHBondContact O-N 3.14Å; R829-L832 PolarHBondContact O-N 3.11Å; L832-K834 VanDerWaalsContact C-N 3.32Å; L832-K834 PolarHBondContact O-N 2.9Å; L832-I835 PolarHBondContact O-N 2.78Å; L832-I835 VanDerWaalsContact O-N 3.14Å; L832-V836 WeakPolarHBondContact O-CB 3.22Å; L832-V836 VanDerWaalsContact O-CG2 3.3Å; L832-V836 WeakPolarHBondContact O-CG2 3.26Å; L832-V836 PolarHBondContact O-N 3.17Å
833	T	89.9	Confident	84.4	Confident	11 Å²	11	59.3 Å²	59.3	7%	0.067	31%	0.309	C	S	.	.	H	α-helix	trans	-57.8	-44	174	-56.5	0	0	0	0	111.5	R829 I835 V836 N837 L845 I847	R829-T833 WeakPolarHBondContact O-CB 3.37Å; R829-T833 PolarHBondContact O-N 3.23Å; R829-T833 PolarHBondContact O-OG1 2.86Å; T833-I835 VanDerWaalsContact C-N 3.35Å; T833-I835 PolarHBondContact O-N 2.76Å; T833-V836 PolarHBondContact O-N 3.48Å; T833-N837 WeakPolarHBondContact O-CB 3.32Å; T833-N837 VanDerWaalsContact O-CG 3.25Å; T833-N837 PolarHBondContact O-N 3.37Å; T833-N837 PolarHBondContact O-OD1 2.82Å; T833-L845 HydrophobicContact CG2-CB 3.64Å; T833-L845 HydrophobicContact CG2-CD1 4.17Å; T833-I847 HydrophobicContact CG2-CG1 4.2Å
834	K	86.9	Confident	83.6	Confident	130 Å²	130	64.4 Å²	64.4	57%	0.565	34%	0.335	S	S	*	.	H	α-helix	trans	-60.4	-42	175	-75.7	178.4	179.4	-169.5	0	112.7	R830 Q831 L832 A838 I847	R830-K834 WeakPolarHBondContact O-CG 3.15Å; R830-K834 PolarHBondContact O-N 3.34Å; R830-K834 VanDerWaalsContact O-N 3.14Å; Q831-K834 WeakPolarHBondContact O-CB 3.32Å; Q831-K834 PolarHBondContact O-N 2.97Å; L832-K834 VanDerWaalsContact C-N 3.32Å; L832-K834 PolarHBondContact O-N 2.9Å; K834-A838 WeakPolarHBondContact O-CB 3.47Å; K834-A838 PolarHBondContact O-N 3.14Å; K834-A838 VanDerWaalsContact O-N 3.11Å; K834-I847 HydrophobicContact CG-CD1 3.78Å
835	I	86.3	Confident	83.3	Confident	30 Å²	30	61.8 Å²	61.8	15%	0.154	32%	0.324	C	S	.	.	H	α-helix	trans	-68.1	-45.3	179.3	-64.4	166.9	0	0	0	110.5	F305 L718 P719 Q831 L832 T833 A838 L839	F305-I835 HydrophobicContact CE1-CD1 3.58Å; F305-I835 HydrophobicContact CE1-CG1 4.25Å; F305-I835 HydrophobicContact CZ-CD1 3.92Å; L718-I835 HydrophobicContact CD2-CG2 4.27Å; P719-I835 HydrophobicContact CG-CD1 3.59Å; Q831-I835 VanDerWaalsContact O-CG1 3.31Å; Q831-I835 WeakPolarHBondContact O-CG1 3.3Å; Q831-I835 PolarHBondContact O-N 2.9Å; L832-I835 PolarHBondContact O-N 2.78Å; L832-I835 VanDerWaalsContact O-N 3.14Å; T833-I835 VanDerWaalsContact C-N 3.35Å; T833-I835 PolarHBondContact O-N 2.76Å; I835-A838 WeakPolarHBondContact O-CB 3.45Å; I835-A838 PolarHBondContact O-N 2.78Å; I835-A838 VanDerWaalsContact O-N 3.14Å; I835-L839 HydrophobicContact CG2-CD1 3.87Å; I835-L839 HydrophobicContact CG2-CG 4.34Å; I835-L839 WeakPolarHBondContact O-CG 3.47Å; I835-L839 PolarHBondContact O-N 2.89Å
836	V	89	Confident	82.3	Confident	9 Å²	9	64.3 Å²	64.3	6%	0.055	35%	0.345	C	S	.	.	H	α-helix	trans	-63.6	-43.8	-179.7	171.6	0	0	0	0	110.6	L718 V728 L737 I741 L832 T833 A838 L839 C840 A843 L845	L718-V836 HydrophobicContact CD2-CG2 4.36Å; V728-V836 HydrophobicContact CG1-CG2 3.96Å; L737-V836 HydrophobicContact CD1-CG1 4.35Å; L737-V836 HydrophobicContact CD2-CG1 3.9Å; L737-V836 HydrophobicContact CG-CG1 4.45Å; I741-V836 HydrophobicContact CD1-CB 4.3Å; I741-V836 HydrophobicContact CD1-CG1 4.42Å; I741-V836 HydrophobicContact CD1-CG2 4.08Å; L832-V836 WeakPolarHBondContact O-CB 3.22Å; L832-V836 VanDerWaalsContact O-CG2 3.3Å; L832-V836 WeakPolarHBondContact O-CG2 3.26Å; L832-V836 PolarHBondContact O-N 3.17Å; T833-V836 PolarHBondContact O-N 3.48Å; V836-A838 VanDerWaalsContact C-N 3.25Å; V836-A838 PolarHBondContact O-N 2.66Å; V836-L839 PolarHBondContact O-N 2.99Å; V836-L839 VanDerWaalsContact O-N 3.11Å; V836-C840 PolarHBondContact O-N 2.6Å; V836-A843 HydrophobicContact CG1-CB 4.4Å; V836-L845 HydrophobicContact CG1-CD1 4.27Å
837	N	87.7	Confident	81.3	Confident	38 Å²	38	68.1 Å²	68.1	20%	0.203	36%	0.364	C	S	.	.	H	α-helix	trans	-63.3	-31.1	174.5	-70	-2.2	0	0	0	112.7	T833 L845	T833-N837 WeakPolarHBondContact O-CB 3.32Å; T833-N837 VanDerWaalsContact O-CG 3.25Å; T833-N837 PolarHBondContact O-N 3.37Å; T833-N837 PolarHBondContact O-OD1 2.82Å; N837-L845 PolarHBondContact ND2-O 3.32Å; N837-L845 WeakPolarHBondContact OD1-CB 3.42Å; N837-L845 PolarHBondContact OD1-N 3.06Å
838	A	85.6	Confident	80.2	Confident	84 Å²	84	64.5 Å²	64.5	69%	0.694	36%	0.361	S	S	*	.	H	α-helix	trans	-75.3	-26.8	175.3	0	0	0	0	0	113	K834 I835 V836	K834-A838 WeakPolarHBondContact O-CB 3.47Å; K834-A838 PolarHBondContact O-N 3.14Å; K834-A838 VanDerWaalsContact O-N 3.11Å; I835-A838 WeakPolarHBondContact O-CB 3.45Å; I835-A838 PolarHBondContact O-N 2.78Å; I835-A838 VanDerWaalsContact O-N 3.14Å; V836-A838 VanDerWaalsContact C-N 3.25Å; V836-A838 PolarHBondContact O-N 2.66Å
839	L	83.1	Confident	79.1	Confident	89 Å²	89	66 Å²	66	47%	0.466	37%	0.372	S	S	.	.	H	α-helix	trans	-89.2	-31.2	178.1	-69.1	175.6	0	0	0	112.8	L717 L718 I835 V836	L717-L839 HydrophobicContact CB-CD1 4.06Å; L717-L839 HydrophobicContact CB-CD2 4.34Å; L717-L839 HydrophobicContact CD1-CD2 3.87Å; L718-L839 HydrophobicContact CD2-CD1 3.85Å; I835-L839 HydrophobicContact CG2-CD1 3.87Å; I835-L839 HydrophobicContact CG2-CG 4.34Å; I835-L839 WeakPolarHBondContact O-CG 3.47Å; I835-L839 PolarHBondContact O-N 2.89Å; V836-L839 PolarHBondContact O-N 2.99Å; V836-L839 VanDerWaalsContact O-N 3.11Å
840	C	80.5	Confident	78.3	Confident	42 Å²	42	71.7 Å²	71.7	28%	0.284	40%	0.399	S	S	.	.			trans	-134.3	100.4	-177.4	-177.6	0	0	0	0	108.6	V836 E842 A843	V836-C840 PolarHBondContact O-N 2.6Å; C840-E842 PolarHBondContact O-N 3.41Å; C840-A843 HydrophobicContact CB-CB 4.37Å; C840-A843 PolarHBondContact O-N 3.21Å
841	T	71.9	Confident	78	Confident	128 Å²	128	68 Å²	68	79%	0.785	39%	0.388	S	S	*	.	G	3₁₀ helix	trans	-63.7	-27.8	178.7	45.3	0	0	0	0	112.4	A843	T841-A843 VanDerWaalsContact C-N 3.28Å; T841-A843 PolarHBondContact O-N 3.23Å
842	E	71.4	Confident	78	Confident	178 Å²	178	73.4 Å²	73.4	83%	0.832	41%	0.411	S	S	*	.	G	3₁₀ helix	trans	-71	-18.7	180	-59.9	-178.6	173.7	0	0	114.1	C840 D844	C840-E842 PolarHBondContact O-N 3.41Å; E842-D844 VanDerWaalsContact C-N 3.28Å; E842-D844 PolarHBondContact O-N 3.41Å
843	A	66.9	Low	77.9	Confident	25 Å²	25	77.4 Å²	77.4	21%	0.207	44%	0.437	C	S	.	.	G	3₁₀ helix	trans	-70	-26.1	-174.8	0	0	0	0	0	113.2	L737 V836 C840 T841 L845	L737-A843 HydrophobicContact CD2-CB 3.83Å; V836-A843 HydrophobicContact CG1-CB 4.4Å; C840-A843 HydrophobicContact CB-CB 4.37Å; C840-A843 PolarHBondContact O-N 3.21Å; T841-A843 VanDerWaalsContact C-N 3.28Å; T841-A843 PolarHBondContact O-N 3.23Å; A843-L845 HydrophobicContact CB-CG 4.14Å; A843-L845 WeakPolarHBondContact O-CG 3.43Å; A843-L845 PolarHBondContact O-N 3.44Å
844	D	69.3	Low	78	Confident	144 Å²	144	77.5 Å²	77.5	77%	0.77	44%	0.438	S	S	*	.			trans	27.2	48.6	-176	-161.8	21	0	0	0	114.7	E842 A846	E842-D844 VanDerWaalsContact C-N 3.28Å; E842-D844 PolarHBondContact O-N 3.41Å; D844-A846 PolarHBondContact O-N 3.09Å
845	L	75.8	Confident	78.2	Confident	29 Å²	29	74.8 Å²	74.8	15%	0.152	43%	0.432	C	S	.	.	P	Polyproline II helix	trans	-77	116.5	-175.9	-63.5	173	0	0	0	109	L737 A738 I741 T833 V836 N837 A843 I847	L737-L845 HydrophobicContact CD2-CD1 3.77Å; L737-L845 HydrophobicContact CD2-CD2 4.4Å; L737-L845 HydrophobicContact CD2-CG 4.29Å; L737-L845 HydrophobicContact CG-CD1 3.89Å; A738-L845 HydrophobicContact CB-CD2 4.17Å; I741-L845 HydrophobicContact CD1-CD1 3.53Å; T833-L845 HydrophobicContact CG2-CB 3.64Å; T833-L845 HydrophobicContact CG2-CD1 4.17Å; V836-L845 HydrophobicContact CG1-CD1 4.27Å; N837-L845 PolarHBondContact ND2-O 3.32Å; N837-L845 WeakPolarHBondContact OD1-CB 3.42Å; N837-L845 PolarHBondContact OD1-N 3.06Å; A843-L845 HydrophobicContact CB-CG 4.14Å; A843-L845 WeakPolarHBondContact O-CG 3.43Å; A843-L845 PolarHBondContact O-N 3.44Å; L845-I847 PolarHBondContact O-N 2.95Å
846	A	68.9	Low	78.5	Confident	56 Å²	56	76.5 Å²	76.5	46%	0.463	44%	0.442	S	S	.	.	P	Polyproline II helix	trans	-63.4	127	176.2	0	0	0	0	0	111.2	D844 G848 T849	D844-A846 PolarHBondContact O-N 3.09Å; A846-G848 PolarHBondContact O-N 2.93Å; A846-T849 HydrophobicContact CB-CG2 3.25Å; A846-T849 PolarHBondContact O-OG1 2.94Å
847	I	67.1	Low	78.7	Confident	91 Å²	91	83.1 Å²	83.1	47%	0.467	47%	0.472	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	118.8	-177.2	-60.2	171.3	0	0	0	108.9	T833 K834 L845	T833-I847 HydrophobicContact CG2-CG1 4.2Å; K834-I847 HydrophobicContact CG-CD1 3.78Å; L845-I847 PolarHBondContact O-N 2.95Å
848	G	63.2	Low	79	Confident	46 Å²	46	83.2 Å²	83.2	47%	0.474	47%	0.471	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.5	17.9	175.7	0	0	0	0	0	114.7	A846	A846-G848 PolarHBondContact O-N 2.93Å
849	T	63.8	Low	79.3	Confident	65 Å²	65	79.2 Å²	79.2	40%	0.399	44%	0.438	S	S	.	.			trans	-72.7	139.7	170.9	45.9	0	0	0	0	111.6	R829 A846 L851	R829-T849 PolarHBondContact NH2-O 2.59Å; A846-T849 HydrophobicContact CB-CG2 3.25Å; A846-T849 PolarHBondContact O-OG1 2.94Å; T849-L851 PolarHBondContact O-N 3.24Å; T849-L851 VanDerWaalsContact O-N 3.11Å
850	Q	74.1	Confident	79.9	Confident	133 Å²	133	77.8 Å²	77.8	62%	0.621	43%	0.429	S	S	*	.			trans	-68.8	106.1	173	-63.2	178.3	7.4	0	0	108.5	Q805	Q805-Q850 HydrophobicContact CG-CG 4.25Å
851	L	81.9	Confident	80.6	Confident	40 Å²	40	77.9 Å²	77.9	21%	0.209	43%	0.427	C	S	.	.	P	Polyproline II helix	trans	-77.2	141.3	172.1	-61.8	167.7	0	0	0	109	A738 Y739 L801 R829 T849	A738-L851 HydrophobicContact CB-CD1 3.61Å; A738-L851 HydrophobicContact CB-CD2 3.87Å; A738-L851 HydrophobicContact CB-CG 4.4Å; Y739-L851 HydrophobicContact CD1-CD1 4.31Å; Y739-L851 HydrophobicContact CE1-CB 4.08Å; Y739-L851 HydrophobicContact CE1-CD1 4.35Å; L801-L851 HydrophobicContact CD2-CB 3.91Å; L801-L851 HydrophobicContact CD2-CD1 3.95Å; L801-L851 HydrophobicContact CD2-CG 4.47Å; R829-L851 VanDerWaalsContact NH2-CD1 3.29Å; T849-L851 PolarHBondContact O-N 3.24Å; T849-L851 VanDerWaalsContact O-N 3.11Å
852	K	86.3	Confident	81.7	Confident	170 Å²	170	71.8 Å²	71.8	74%	0.739	39%	0.389	S	S	*	.	P	Polyproline II helix	trans	-66.4	155.2	168	-65.4	-179.9	-178	176.4	0	109.1	Y739	Y739-K852 WeakPolarHBondContact CE1-O 3.3Å; Y739-K852 PolarHBondContact OH-O 3.11Å
853	P	86.8	Confident	82.8	Confident	88 Å²	88	63.3 Å²	63.3	57%	0.571	35%	0.35	S	S	*	.	P	Polyproline II helix	trans	-56.1	145	168.2	-23.5	34.2	0	0	0	110.9
854	P	90.7	Very high	84.2	Confident	12 Å²	12	64.5 Å²	64.5	8%	0.078	35%	0.351	C	S	.	.	P	Polyproline II helix	trans	-63.2	146.7	179.7	27.8	-36.1	0	0	0	111.3	Y739 M794 L797 Q858 L862	Y739-P854 HydrophobicContact CE1-CB 4.38Å; Y739-P854 HydrophobicContact CE2-CB 4.49Å; M794-P854 HydrophobicContact CE-CG 3.79Å; M794-P854 HydrophobicContact SD-CG 3.94Å; L797-P854 HydrophobicContact CD2-CG 3.92Å; P854-Q858 HydrophobicContact CB-CB 3.97Å; P854-L862 HydrophobicContact CB-CD1 4.39Å
855	T	92.3	Very high	85.4	Confident	74 Å²	74	58.3 Å²	58.3	45%	0.454	32%	0.318	S	S	.	.	P	Polyproline II helix	trans	-67.5	166.4	169.3	66.1	0	0	0	0	110.9	E857 Q858 A859	T855-E857 VanDerWaalsContact C-N 3.32Å; T855-E857 PolarHBondContact O-N 3.37Å; T855-Q858 PolarHBondContact O-N 3.03Å; T855-Q858 WeakPolarHBondContact OG1-CB 3.41Å; T855-Q858 VanDerWaalsContact OG1-CG 3.28Å; T855-Q858 WeakPolarHBondContact OG1-CG 3.3Å; T855-Q858 PolarHBondContact OG1-N 3.23Å; T855-A859 PolarHBondContact O-N 3.18Å
856	D	92.6	Very high	86.3	Confident	66 Å²	66	57 Å²	57	35%	0.353	31%	0.311	S	S	.	.	H	α-helix	trans	-65.2	-36.9	179	-151.9	51.6	0	0	0	111.8	H786 S787 A859 E860	H786-D856 WeakPolarHBondContact CA-OD1 3.44Å; H786-D856 WeakPolarHBondContact CB-O 3.35Å; H786-D856 IonicContact CD2-OD2 2.68Å; H786-D856 PolarHBondContact CD2-OD2 3.35Å; H786-D856 IonicContact CG-OD2 3.9Å; H786-D856 PolarHBondContact N-OD1 3.17Å; H786-D856 PolarHBondContact N-OD2 2.99Å; H786-D856 VanDerWaalsContact N-OD2 3.12Å; S787-D856 PolarHBondContact N-OD1 3.4Å; D856-A859 WeakPolarHBondContact O-CB 3.35Å; D856-A859 PolarHBondContact O-N 3.43Å; D856-A859 VanDerWaalsContact O-N 3.17Å; D856-E860 PolarHBondContact O-N 2.85Å
857	E	92.6	Very high	87.5	Confident	148 Å²	148	54.3 Å²	54.3	69%	0.692	29%	0.288	S	S	*	.	H	α-helix	trans	-62.4	-44.5	171.7	-65	173.8	-178.7	0	0	111.9	T855 A859 E860 L861	T855-E857 VanDerWaalsContact C-N 3.32Å; T855-E857 PolarHBondContact O-N 3.37Å; E857-A859 VanDerWaalsContact C-N 3.25Å; E857-A859 PolarHBondContact O-N 3.38Å; E857-E860 WeakPolarHBondContact O-CB 3.5Å; E857-E860 PolarHBondContact O-N 3.33Å; E857-E860 VanDerWaalsContact O-N 3.17Å; E857-L861 WeakPolarHBondContact O-CG 3.09Å; E857-L861 PolarHBondContact O-N 3.47Å
858	Q	93.4	Very high	88.8	Confident	39 Å²	39	50.4 Å²	50.4	18%	0.182	27%	0.269	C	S	.	.	H	α-helix	trans	-62.8	-35.2	173.9	-74.5	174.1	-25.8	0	0	111.5	L736 P854 T855 L861 L862	L736-Q858 HydrophobicContact CD2-CB 4.11Å; L736-Q858 HydrophobicContact CD2-CG 4.08Å; P854-Q858 HydrophobicContact CB-CB 3.97Å; T855-Q858 PolarHBondContact O-N 3.03Å; T855-Q858 WeakPolarHBondContact OG1-CB 3.41Å; T855-Q858 VanDerWaalsContact OG1-CG 3.28Å; T855-Q858 WeakPolarHBondContact OG1-CG 3.3Å; T855-Q858 PolarHBondContact OG1-N 3.23Å; Q858-L861 PolarHBondContact O-N 3.05Å; Q858-L862 WeakPolarHBondContact O-CB 3.37Å; Q858-L862 WeakPolarHBondContact O-CG 3.36Å; Q858-L862 PolarHBondContact O-N 3.05Å
859	A	93.9	Very high	90.1	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-64.1	-41.2	174.5	0	0	0	0	0	111.4	H786 M794 T855 D856 E857 L862 R863	H786-A859 HydrophobicContact CB-CB 4.34Å; M794-A859 HydrophobicContact CE-CB 3.47Å; M794-A859 VanDerWaalsContact CE-CB 3.47Å; T855-A859 PolarHBondContact O-N 3.18Å; D856-A859 WeakPolarHBondContact O-CB 3.35Å; D856-A859 PolarHBondContact O-N 3.43Å; D856-A859 VanDerWaalsContact O-N 3.17Å; E857-A859 VanDerWaalsContact C-N 3.25Å; E857-A859 PolarHBondContact O-N 3.38Å; A859-L862 PolarHBondContact O-N 3.06Å; A859-R863 WeakPolarHBondContact O-CG 3.47Å; A859-R863 PolarHBondContact O-N 3.49Å
860	E	94.8	Very high	91.5	Very high	59 Å²	59	45.3 Å²	45.3	28%	0.276	23%	0.229	S	C	.	.	H	α-helix	trans	-59.1	-49.1	173	-175	-179.5	-173	0	0	112.2	H786 D856 E857 L862 R863 Q864 W943	H786-E860 HydrophobicContact CB-CB 4.22Å; H786-E860 IonicContact NE2-OE2 2.72Å; D856-E860 PolarHBondContact O-N 2.85Å; E857-E860 WeakPolarHBondContact O-CB 3.5Å; E857-E860 PolarHBondContact O-N 3.33Å; E857-E860 VanDerWaalsContact O-N 3.17Å; E860-L862 VanDerWaalsContact C-N 3.31Å; E860-L862 PolarHBondContact O-N 3.16Å; E860-R863 WeakPolarHBondContact O-CA 3.49Å; E860-R863 WeakPolarHBondContact O-CB 3.25Å; E860-R863 PolarHBondContact O-N 3.3Å; E860-Q864 PolarHBondContact O-N 3.09Å; E860-Q864 VanDerWaalsContact O-N 3.08Å; E860-W943 HydrophobicContact CG-CH2 3.8Å; E860-W943 HydrophobicContact CG-CZ2 3.83Å
861	L	94.7	Very high	92.2	Very high	45 Å²	45	39 Å²	39	24%	0.236	20%	0.199	C	C	.	.	H	α-helix	trans	-64.3	-35.8	179.1	-65	159.6	0	0	0	112.3	Q734 L736 E857 Q858 R863 Q864 L865	Q734-L861 VanDerWaalsContact OE1-CD2 3.27Å; L736-L861 HydrophobicContact CD1-CB 3.65Å; L736-L861 HydrophobicContact CD1-CD1 4.33Å; L736-L861 HydrophobicContact CD2-CB 4.21Å; E857-L861 WeakPolarHBondContact O-CG 3.09Å; E857-L861 PolarHBondContact O-N 3.47Å; Q858-L861 PolarHBondContact O-N 3.05Å; L861-R863 VanDerWaalsContact C-N 3.3Å; L861-R863 PolarHBondContact O-N 3.03Å; L861-Q864 WeakPolarHBondContact O-CB 3.36Å; L861-Q864 PolarHBondContact O-N 2.97Å; L861-L865 WeakPolarHBondContact O-CB 3.34Å; L861-L865 PolarHBondContact O-N 3.02Å
862	L	94.9	Very high	92.4	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-63.8	-35.6	171.9	-74.6	169.5	0	0	0	111.7	L736 L790 L797 P854 Q858 A859 E860 L865 V866	L736-L862 HydrophobicContact CD2-CD2 4.49Å; L736-L862 HydrophobicContact CD2-CG 4.3Å; L790-L862 HydrophobicContact CD1-CB 4.44Å; L790-L862 HydrophobicContact CD2-CB 4.25Å; L790-L862 HydrophobicContact CD2-CD1 4.36Å; L797-L862 HydrophobicContact CD2-CD1 3.76Å; P854-L862 HydrophobicContact CB-CD1 4.39Å; Q858-L862 WeakPolarHBondContact O-CB 3.37Å; Q858-L862 WeakPolarHBondContact O-CG 3.36Å; Q858-L862 PolarHBondContact O-N 3.05Å; A859-L862 PolarHBondContact O-N 3.06Å; E860-L862 VanDerWaalsContact C-N 3.31Å; E860-L862 PolarHBondContact O-N 3.16Å; L862-L865 HydrophobicContact CD2-CD2 4.37Å; L862-L865 PolarHBondContact O-N 3.07Å; L862-V866 WeakPolarHBondContact O-CG2 3.4Å; L862-V866 PolarHBondContact O-N 3.01Å
863	R	95.7	Very high	92.6	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-63.9	-45.3	174.3	-65.2	-176.1	-58	129.9	-4.4	111.4	H786 L790 A859 E860 L861 L865 V866 L867 M937 A938 E940 W943	H786-R863 PolarHBondContact ND1-NH2 2.94Å; L790-R863 HydrophobicContact CB-CG 3.89Å; L790-R863 HydrophobicContact CD1-CB 4.46Å; L790-R863 HydrophobicContact CD1-CG 3.56Å; L790-R863 HydrophobicContact CG-CG 4.31Å; A859-R863 WeakPolarHBondContact O-CG 3.47Å; A859-R863 PolarHBondContact O-N 3.49Å; E860-R863 WeakPolarHBondContact O-CA 3.49Å; E860-R863 WeakPolarHBondContact O-CB 3.25Å; E860-R863 PolarHBondContact O-N 3.3Å; L861-R863 VanDerWaalsContact C-N 3.3Å; L861-R863 PolarHBondContact O-N 3.03Å; R863-L865 VanDerWaalsContact C-N 3.34Å; R863-L865 PolarHBondContact O-N 2.92Å; R863-V866 PolarHBondContact O-N 3.05Å; R863-L867 PolarHBondContact O-N 2.78Å; R863-M937 VanDerWaalsContact CA-SD 3.5Å; R863-M937 HydrophobicContact CB-CG 4.42Å; R863-M937 HydrophobicContact CB-SD 3.72Å; R863-M937 HydrophobicContact CG-CG 4Å; R863-M937 HydrophobicContact CG-SD 3.72Å; R863-A938 PolarHBondContact NH1-O 2.72Å; R863-A938 VanDerWaalsContact NH1-O 3.1Å; R863-E940 IonicContact CZ-OE1 3.59Å; R863-E940 VanDerWaalsContact CZ-OE1 3.29Å; R863-E940 IonicContact CZ-OE2 3.71Å; R863-E940 IonicContact NH1-OE1 2.85Å; R863-E940 PolarHBondContact NH1-OE1 2.77Å; R863-E940 IonicContact NH1-OE2 2.9Å; R863-E940 PolarHBondContact NH1-OE2 2.81Å; R863-E940 IonicContact NH2-OE1 3.62Å; R863-E940 PolarHBondContact NH2-OE1 2.81Å; R863-E940 IonicContact NH2-OE2 3.65Å; R863-W943 HydrophobicContact CB-CH2 4.16Å; R863-W943 HydrophobicContact CB-CZ3 3.79Å; R863-W943 VanDerWaalsContact NH2-CH2 3.28Å
864	Q	95	Very high	92.9	Very high	50 Å²	50	26.5 Å²	26.5	23%	0.234	14%	0.135	C	C	.	.	H	α-helix	trans	-58.4	-46.5	174.3	-68.8	-177.9	14.2	0	0	111.1	E860 L861 V866 L867 T868 W943 L947	E860-Q864 PolarHBondContact O-N 3.09Å; E860-Q864 VanDerWaalsContact O-N 3.08Å; L861-Q864 WeakPolarHBondContact O-CB 3.36Å; L861-Q864 PolarHBondContact O-N 2.97Å; Q864-V866 PolarHBondContact O-N 2.79Å; Q864-L867 WeakPolarHBondContact O-CB 3.4Å; Q864-L867 PolarHBondContact O-N 3.41Å; Q864-T868 PolarHBondContact O-N 2.82Å; Q864-W943 HydrophobicContact CG-CD2 3.86Å; Q864-W943 HydrophobicContact CG-CE3 3.71Å; Q864-W943 HydrophobicContact CG-CH2 3.65Å; Q864-W943 HydrophobicContact CG-CZ2 3.88Å; Q864-W943 HydrophobicContact CG-CZ3 3.6Å; Q864-L947 HydrophobicContact CB-CD1 3.5Å; Q864-L947 HydrophobicContact CG-CD1 3.83Å
865	L	94.6	Very high	93	Very high	14 Å²	14	26 Å²	26	7%	0.073	13%	0.131	C	C	.	.	H	α-helix	trans	-59.8	-47.1	178	-173.4	69.1	0	0	0	112.3	M727 L730 A731 A740 L861 L862 R863 L867 T868	M727-L865 HydrophobicContact CB-CD2 4.48Å; M727-L865 HydrophobicContact CB-CG 4.23Å; M727-L865 WeakPolarHBondContact O-CD1 3.25Å; L730-L865 HydrophobicContact CB-CD1 3.67Å; A731-L865 HydrophobicContact CB-CD2 3.79Å; A740-L865 HydrophobicContact CB-CD2 3.72Å; L861-L865 WeakPolarHBondContact O-CB 3.34Å; L861-L865 PolarHBondContact O-N 3.02Å; L862-L865 HydrophobicContact CD2-CD2 4.37Å; L862-L865 PolarHBondContact O-N 3.07Å; R863-L865 VanDerWaalsContact C-N 3.34Å; R863-L865 PolarHBondContact O-N 2.92Å; L865-L867 VanDerWaalsContact C-N 3.3Å; L865-L867 PolarHBondContact O-N 3.13Å; L865-T868 WeakPolarHBondContact O-CB 3.47Å; L865-T868 PolarHBondContact O-N 2.86Å; L865-T868 VanDerWaalsContact O-N 3.14Å; L865-T868 PolarHBondContact O-OG1 3Å
866	V	94.9	Very high	92.9	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-60.7	-40.2	177.5	173.8	0	0	0	0	111	M727 L743 L793 L862 R863 Q864 T868 G869 L870 V920 M937	M727-V866 HydrophobicContact CE-CB 4.1Å; M727-V866 HydrophobicContact CE-CG1 4.49Å; M727-V866 HydrophobicContact CE-CG2 3.49Å; M727-V866 VanDerWaalsContact CE-CG2 3.49Å; L743-V866 HydrophobicContact CD2-CG2 3.73Å; L793-V866 HydrophobicContact CD1-CB 4.4Å; L793-V866 HydrophobicContact CD1-CG1 3.77Å; L793-V866 HydrophobicContact CD1-CG2 3.91Å; L862-V866 WeakPolarHBondContact O-CG2 3.4Å; L862-V866 PolarHBondContact O-N 3.01Å; R863-V866 PolarHBondContact O-N 3.05Å; Q864-V866 PolarHBondContact O-N 2.79Å; V866-T868 VanDerWaalsContact C-N 3.26Å; V866-T868 PolarHBondContact O-N 2.87Å; V866-G869 PolarHBondContact O-N 2.83Å; V866-G869 VanDerWaalsContact O-N 3.14Å; V866-L870 HydrophobicContact CG1-CD1 3.9Å; V866-L870 HydrophobicContact CG1-CG 4.42Å; V866-L870 PolarHBondContact O-N 3.1Å; V866-V920 HydrophobicContact CG1-CG1 4.48Å; V866-M937 HydrophobicContact CB-CE 3.6Å; V866-M937 HydrophobicContact CB-SD 3.8Å; V866-M937 HydrophobicContact CG1-CE 3.38Å; V866-M937 HydrophobicContact CG1-SD 3.91Å; V866-M937 HydrophobicContact CG2-SD 4.26Å
867	L	95	Very high	92.8	Very high	0 Å²	0	25 Å²	25	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-59.3	-35.8	176.5	177.8	59.9	0	0	0	112.1	R863 Q864 L865 G869 C871 V874 V920 I939 W943 L944 L947	R863-L867 PolarHBondContact O-N 2.78Å; Q864-L867 WeakPolarHBondContact O-CB 3.4Å; Q864-L867 PolarHBondContact O-N 3.41Å; L865-L867 VanDerWaalsContact C-N 3.3Å; L865-L867 PolarHBondContact O-N 3.13Å; L867-G869 VanDerWaalsContact C-N 3.28Å; L867-G869 PolarHBondContact O-N 3.05Å; L867-C871 VanDerWaalsContact O-CA 3.29Å; L867-C871 WeakPolarHBondContact O-CA 3.05Å; L867-C871 VanDerWaalsContact O-CB 3.3Å; L867-C871 WeakPolarHBondContact O-CB 3.38Å; L867-C871 PolarHBondContact O-N 3.41Å; L867-V874 HydrophobicContact CD1-CG2 3.83Å; L867-V920 HydrophobicContact CD1-CG2 3.73Å; L867-I939 HydrophobicContact CD1-CD1 3.96Å; L867-I939 HydrophobicContact CD2-CD1 4.38Å; L867-W943 HydrophobicContact CD2-CB 3.87Å; L867-W943 HydrophobicContact CD2-CE3 4.41Å; L867-L944 HydrophobicContact CD1-CD2 3.99Å; L867-L944 HydrophobicContact CD2-CD2 4.21Å; L867-L947 HydrophobicContact CD2-CB 4.36Å; L867-L947 HydrophobicContact CD2-CD1 4.27Å
868	T	93.5	Very high	92.4	Very high	10 Å²	10	18.2 Å²	18.2	6%	0.061	8%	0.083	C	C	.	.	H	α-helix	trans	-63.8	-31.3	177.6	71.2	0	0	0	0	113.6	K726 L730 Q864 L865 V866 L947	K726-T868 WeakPolarHBondContact CD-O 3.34Å; K726-T868 WeakPolarHBondContact CE-O 3.48Å; K726-T868 PolarHBondContact NZ-O 2.95Å; L730-T868 HydrophobicContact CD1-CG2 4.11Å; Q864-T868 PolarHBondContact O-N 2.82Å; L865-T868 WeakPolarHBondContact O-CB 3.47Å; L865-T868 PolarHBondContact O-N 2.86Å; L865-T868 VanDerWaalsContact O-N 3.14Å; L865-T868 PolarHBondContact O-OG1 3Å; V866-T868 VanDerWaalsContact C-N 3.26Å; V866-T868 PolarHBondContact O-N 2.87Å; T868-L947 HydrophobicContact CG2-CB 4.05Å; T868-L947 HydrophobicContact CG2-CD2 4.15Å
869	G	91.9	Very high	91.3	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-90.8	-32.3	-179	0	0	0	0	0	113.6	R723 V866 L867	R723-G869 VanDerWaalsContact CB-O 3.24Å; R723-G869 WeakPolarHBondContact CB-O 3.37Å; R723-G869 VanDerWaalsContact CG-O 3.27Å; R723-G869 WeakPolarHBondContact CG-O 3.31Å; R723-G869 WeakPolarHBondContact O-CA 3.35Å; V866-G869 PolarHBondContact O-N 2.83Å; V866-G869 VanDerWaalsContact O-N 3.14Å; L867-G869 VanDerWaalsContact C-N 3.28Å; L867-G869 PolarHBondContact O-N 3.05Å
870	L	91.3	Very high	89.6	Confident	4 Å²	4	25.3 Å²	25.3	2%	0.021	12%	0.123	C	C	.	.	S	Bend	trans	-107.8	31.1	-179.9	-63.5	-178.2	0	0	0	112.3	Y724 V866 E872 N873 V920	Y724-L870 HydrophobicContact CE1-CD2 4.49Å; V866-L870 HydrophobicContact CG1-CD1 3.9Å; V866-L870 HydrophobicContact CG1-CG 4.42Å; V866-L870 PolarHBondContact O-N 3.1Å; L870-E872 PolarHBondContact O-N 3.11Å; L870-N873 HydrophobicContact CB-CB 4.43Å; L870-N873 PolarHBondContact O-N 2.86Å; L870-V920 HydrophobicContact CB-CG1 3.47Å; L870-V920 VanDerWaalsContact CB-CG1 3.47Å; L870-V920 HydrophobicContact CD1-CG1 3.7Å; L870-V920 HydrophobicContact CG-CG1 4.24Å
871	C	90	Very high	87.6	Confident	1 Å²	1	24 Å²	24	1%	0.007	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-6.4	-174.8	63.6	0	0	0	0	115.1	L867 A948 C951 Y980	L867-C871 VanDerWaalsContact O-CA 3.29Å; L867-C871 WeakPolarHBondContact O-CA 3.05Å; L867-C871 VanDerWaalsContact O-CB 3.3Å; L867-C871 WeakPolarHBondContact O-CB 3.38Å; L867-C871 PolarHBondContact O-N 3.41Å; C871-A948 HydrophobicContact CB-CB 3.68Å; C871-C951 PolarHBondContact O-SG 2.87Å; C871-Y980 PolarHBondContact O-OH 2.66Å
872	E	86.2	Confident	85.5	Confident	21 Å²	21	23.4 Å²	23.4	10%	0.098	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.1	-19.6	171.5	-61.9	-168.2	125.9	0	0	112.7	R687 K690 R723 L870 V874	R687-E872 WeakPolarHBondContact CD-OE2 3.47Å; R687-E872 WeakPolarHBondContact CG-OE1 3.35Å; R687-E872 WeakPolarHBondContact CG-OE2 3.19Å; K690-E872 WeakPolarHBondContact CD-OE1 3.22Å; K690-E872 IonicContact NZ-OE1 3.36Å; K690-E872 PolarHBondContact NZ-OE1 2.82Å; K690-E872 VanDerWaalsContact NZ-OE1 3.16Å; R723-E872 IonicContact CZ-OE2 3.45Å; R723-E872 IonicContact NH2-OE2 3.34Å; R723-E872 PolarHBondContact NH2-OE2 3.39Å; L870-E872 PolarHBondContact O-N 3.11Å; E872-V874 PolarHBondContact O-N 3.3Å
873	N	89.8	Confident	83.3	Confident	14 Å²	14	27.5 Å²	27.5	8%	0.075	15%	0.15	C	C	.	.			trans	-93.6	42.5	-177	-64.8	7	0	0	0	111	R723 L870 V920 Y921 Q922	R723-N873 VanDerWaalsContact NH1-CG 3.31Å; R723-N873 PolarHBondContact NH1-ND2 3.26Å; R723-N873 PolarHBondContact NH1-OD1 3.14Å; L870-N873 HydrophobicContact CB-CB 4.43Å; L870-N873 PolarHBondContact O-N 2.86Å; N873-V920 VanDerWaalsContact O-CA 3.3Å; N873-V920 WeakPolarHBondContact O-CA 3.37Å; N873-Y921 HydrophobicContact CB-CD1 4.29Å; N873-Y921 HydrophobicContact CB-CD2 4.07Å; N873-Y921 HydrophobicContact CB-CE1 4.09Å; N873-Y921 HydrophobicContact CB-CE2 3.84Å; N873-Y921 HydrophobicContact CB-CG 4.28Å; N873-Y921 WeakPolarHBondContact CB-O 3.49Å; N873-Y921 PolarHBondContact ND2-O 2.86Å; N873-Y921 WeakPolarHBondContact O-CD1 3.27Å; N873-Y921 WeakPolarHBondContact O-CE1 3.46Å; N873-Y921 PolarHBondContact O-N 2.83Å; N873-Q922 PolarHBondContact ND2-O 2.77Å
874	V	92.8	Very high	81.1	Confident	0 Å²	0	36 Å²	36	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	133.5	175.8	175.2	0	0	0	0	108.9	L867 E872 A897 W918 L919 V920 I939 L944 Y980 W985	L867-V874 HydrophobicContact CD1-CG2 3.83Å; E872-V874 PolarHBondContact O-N 3.3Å; V874-A897 PolarHBondContact O-N 3.32Å; V874-W918 HydrophobicContact CG1-CE3 3.79Å; V874-W918 HydrophobicContact CG1-CZ3 4.09Å; V874-L919 CarbonylContact C-O 3.4Å; V874-L919 WeakPolarHBondContact CA-O 3.37Å; V874-V920 HydrophobicContact CG2-CG2 3.95Å; V874-I939 HydrophobicContact CG1-CD1 3.86Å; V874-I939 HydrophobicContact CG2-CD1 4.08Å; V874-L944 HydrophobicContact CG1-CD2 4.39Å; V874-L944 HydrophobicContact CG2-CD2 4.12Å; V874-Y980 HydrophobicContact CB-CE1 3.71Å; V874-Y980 WeakPolarHBondContact CB-OH 3.31Å; V874-Y980 HydrophobicContact CG1-CE1 3.83Å; V874-Y980 HydrophobicContact CG2-CE1 4.27Å; V874-Y980 WeakPolarHBondContact CG2-OH 3.25Å; V874-W985 HydrophobicContact CG1-CZ3 4.39Å
875	A	92.4	Very high	79.1	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	140.5	174.3	0	0	0	0	0	111	Y894 R895 L919 Y921 M933	A875-Y894 HydrophobicContact CB-CD1 4.19Å; A875-R895 CarbonylContact C-O 3.54Å; A875-R895 WeakPolarHBondContact CA-O 3.47Å; A875-R895 WeakPolarHBondContact CB-O 3.28Å; A875-L919 HydrophobicContact CB-CD1 3.83Å; A875-L919 HydrophobicContact CB-CG 4.36Å; A875-L919 PolarHBondContact N-O 3.14Å; A875-L919 PolarHBondContact O-N 3.34Å; A875-Y921 HydrophobicContact CB-CD1 4.12Å; A875-Y921 HydrophobicContact CB-CE1 4.08Å; A875-M933 HydrophobicContact CB-CE 4.48Å; A875-M933 HydrophobicContact CB-SD 3.81Å
876	R	92.2	Very high	76.8	Confident	44 Å²	44	40.8 Å²	40.8	17%	0.166	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	137.9	175.8	-169.9	-175.5	178.4	-152.1	-10.2	110.1	A878 Y894 R895 E917 W918 W985	R876-A878 PolarHBondContact O-N 2.86Å; R876-Y894 VanDerWaalsContact C-CD1 3.49Å; R876-Y894 CarbonylContact O-C 3.52Å; R876-Y894 WeakPolarHBondContact O-CA 3.14Å; R876-R895 PolarHBondContact N-O 3.13Å; R876-R895 PolarHBondContact O-N 3.45Å; R876-E917 CarbonylContact C-O 3.41Å; R876-E917 WeakPolarHBondContact CA-O 3.27Å; R876-E917 HydrophobicContact CG-CG 4.45Å; R876-E917 IonicContact CZ-OE1 3.88Å; R876-E917 IonicContact NE-OE1 3.27Å; R876-E917 PolarHBondContact NE-OE1 3.29Å; R876-E917 IonicContact NH2-OE1 3.3Å; R876-E917 PolarHBondContact NH2-OE1 3.17Å; R876-W918 HydrophobicContact CB-CD2 4.37Å; R876-W918 HydrophobicContact CB-CE3 4.17Å; R876-W918 HydrophobicContact CB-CH2 4.49Å; R876-W918 HydrophobicContact CB-CZ3 4.26Å; R876-W918 VanDerWaalsContact CD-CZ2 3.48Å; R876-W918 HydrophobicContact CG-CD2 4.09Å; R876-W918 HydrophobicContact CG-CE3 4.37Å; R876-W918 HydrophobicContact CG-CH2 4.37Å; R876-W918 HydrophobicContact CG-CZ2 4.05Å; R876-W985 HydrophobicContact CB-CD2 4.07Å; R876-W985 HydrophobicContact CB-CE3 4.01Å; R876-W985 HydrophobicContact CB-CH2 4Å; R876-W985 HydrophobicContact CB-CZ2 4.04Å; R876-W985 HydrophobicContact CB-CZ3 3.98Å
877	R	90.3	Very high	74.6	Confident	77 Å²	77	44.5 Å²	44.5	29%	0.291	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62	132.2	176	-156.8	171.7	70.6	-156.4	-2.4	109.6	D879 Y894 Q915 E917	R877-D879 VanDerWaalsContact C-N 3.32Å; R877-D879 IonicContact CZ-OD2 3.01Å; R877-D879 IonicContact NE-OD1 2.68Å; R877-D879 IonicContact NE-OD2 3.62Å; R877-D879 PolarHBondContact NE-OD2 3.43Å; R877-D879 IonicContact NH2-OD2 3.52Å; R877-D879 PolarHBondContact NH2-OD2 2.85Å; R877-D879 PolarHBondContact O-N 3.08Å; R877-Y894 HydrophobicContact CB-CD1 4.15Å; R877-Y894 HydrophobicContact CB-CE1 3.72Å; R877-Y894 HydrophobicContact CG-CE1 4.13Å; R877-Y894 HydrophobicContact CG-CE2 4.24Å; R877-Q915 PolarHBondContact NH1-O 3.47Å; R877-E917 PolarHBondContact N-O 3.11Å
878	A	82.5	Confident	72.4	Confident	4 Å²	4	53.8 Å²	53.8	3%	0.033	30%	0.304	C	S	.	.			trans	-93.4	31	-166.5	0	0	0	0	0	114.2	R876 D880 C881 F882 A893 R895	R876-A878 PolarHBondContact O-N 2.86Å; A878-D880 VanDerWaalsContact C-N 3.27Å; A878-D880 PolarHBondContact O-N 3.49Å; A878-C881 PolarHBondContact O-N 3.47Å; A878-F882 HydrophobicContact CB-CD2 4Å; A878-F882 HydrophobicContact CB-CE2 3.57Å; A878-F882 WeakPolarHBondContact O-CD2 3.13Å; A878-A893 WeakPolarHBondContact CB-O 3.5Å; A878-A893 PolarHBondContact N-O 2.94Å; A878-R895 HydrophobicContact CB-CG 4.04Å
879	D	70.3	Confident	70.3	Confident	82 Å²	82	57.4 Å²	57.4	44%	0.439	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-40.4	-172.7	-64.1	-25.1	0	0	0	112.3	R877	R877-D879 VanDerWaalsContact C-N 3.32Å; R877-D879 IonicContact CZ-OD2 3.01Å; R877-D879 IonicContact NE-OD1 2.68Å; R877-D879 IonicContact NE-OD2 3.62Å; R877-D879 PolarHBondContact NE-OD2 3.43Å; R877-D879 IonicContact NH2-OD2 3.52Å; R877-D879 PolarHBondContact NH2-OD2 2.85Å; R877-D879 PolarHBondContact O-N 3.08Å
880	D	58.5	Low	68.9	Low	107 Å²	107	59 Å²	59	57%	0.572	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.1	-26.6	-175.3	-57.6	-33.1	0	0	0	113.2	A878 A883	A878-D880 VanDerWaalsContact C-N 3.27Å; A878-D880 PolarHBondContact O-N 3.49Å; D880-A883 PolarHBondContact O-N 3.48Å
881	C	52.7	Low	67.8	Low	32 Å²	32	69.4 Å²	69.4	22%	0.216	38%	0.378	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81	-24.3	-165.7	-56	0	0	0	0	114	A878 A883 T885	A878-C881 PolarHBondContact O-N 3.47Å; C881-A883 VanDerWaalsContact C-N 3.34Å; C881-T885 PolarHBondContact O-OG1 2.89Å
882	F	51.5	Low	67.3	Low	31 Å²	31	73.3 Å²	73.3	14%	0.136	40%	0.398	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-16.2	176.2	-67.9	-70.5	0	0	0	112.9	A878 Q884 C887 P889 A893	A878-F882 HydrophobicContact CB-CD2 4Å; A878-F882 HydrophobicContact CB-CE2 3.57Å; A878-F882 WeakPolarHBondContact O-CD2 3.13Å; F882-Q884 PolarHBondContact O-N 3.19Å; F882-C887 HydrophobicContact CD1-CB 4.45Å; F882-P889 HydrophobicContact CB-CB 4.05Å; F882-A893 HydrophobicContact CE2-CB 4.12Å
883	A	47.8	Very low	67.4	Low	87 Å²	87	72.4 Å²	72.4	72%	0.719	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-32.6	174.6	0	0	0	0	0	112	D880 C881	D880-A883 PolarHBondContact O-N 3.48Å; C881-A883 VanDerWaalsContact C-N 3.34Å
884	Q	50.2	Low	67.4	Low	178 Å²	178	71.8 Å²	71.8	83%	0.832	39%	0.391	S	S	*	.	S	Bend	trans	-86.4	-18.9	-174.7	-65.8	179.8	-1.5	0	0	114.6	F882	F882-Q884 PolarHBondContact O-N 3.19Å
885	T	52.5	Low	67.3	Low	84 Å²	84	75.6 Å²	75.6	52%	0.515	41%	0.406	S	S	.	.	S	Bend	trans	-103.4	2.5	-170.2	40.9	0	0	0	0	114.6	C881 C887	C881-T885 PolarHBondContact O-OG1 2.89Å; T885-C887 PolarHBondContact O-N 3.29Å
886	G	47.1	Very low	67	Low	80 Å²	80	76 Å²	76	83%	0.825	41%	0.409	S	S	*	.			trans	64.4	-7.5	-178.9	0	0	0	0	0	114.9
887	C	47.7	Very low	66.3	Low	78 Å²	78	74.7 Å²	74.7	53%	0.527	41%	0.407	S	S	.	.	S	Bend	trans	-69.3	133.3	170.9	-78.7	0	0	0	0	109.3	F882 T885 P889	F882-C887 HydrophobicContact CD1-CB 4.45Å; T885-C887 PolarHBondContact O-N 3.29Å; C887-P889 VanDerWaalsContact O-N 3.14Å
888	K	49.4	Very low	65.7	Low	195 Å²	195	72.8 Å²	72.8	85%	0.848	41%	0.408	S	S	*	.			trans	-48.1	125.8	175.6	-74.5	-178.7	178.3	178.9	0	108.6	S890	K888-S890 PolarHBondContact O-N 2.9Å
889	P	50.3	Low	65.4	Low	87 Å²	87	73 Å²	73	57%	0.565	41%	0.408	S	S	*	.			trans	-56.4	114.9	-179.9	21.5	-31.5	0	0	0	107.7	F882 C887 R891	F882-P889 HydrophobicContact CB-CB 4.05Å; C887-P889 VanDerWaalsContact O-N 3.14Å; P889-R891 PolarHBondContact O-N 2.85Å
890	S	60.7	Low	65.8	Low	34 Å²	34	78.4 Å²	78.4	24%	0.238	43%	0.431	C	S	.	.			trans	-68.4	88.5	168.1	167.5	0	0	0	0	106	K888 L892 A893 W904	K888-S890 PolarHBondContact O-N 2.9Å; S890-L892 PolarHBondContact O-N 2.91Å; S890-A893 WeakPolarHBondContact O-CB 3.33Å; S890-A893 PolarHBondContact O-N 2.88Å; S890-A893 VanDerWaalsContact OG-CB 3.23Å; S890-A893 WeakPolarHBondContact OG-CB 3.49Å; S890-W904 VanDerWaalsContact OG-CZ2 3.23Å; S890-W904 WeakPolarHBondContact OG-CZ2 3.38Å
891	R	68.9	Low	66.9	Low	221 Å²	221	77.2 Å²	77.2	83%	0.834	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.9	127.5	-179.9	-71.1	-175.9	176	176.8	-1.8	108.9	P889 A893	P889-R891 PolarHBondContact O-N 2.85Å; R891-A893 VanDerWaalsContact C-N 3.33Å; R891-A893 PolarHBondContact O-N 3.18Å
892	L	79.5	Confident	68.6	Low	84 Å²	84	77.9 Å²	77.9	44%	0.44	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.3	24.3	177.7	-48.3	172.2	0	0	0	115.4	S890 Q915	S890-L892 PolarHBondContact O-N 2.91Å; L892-Q915 HydrophobicContact CD2-CG 4.17Å
893	A	88.3	Confident	70.4	Confident	2 Å²	2	76.4 Å²	76.4	2%	0.017	42%	0.422	C	S	.	.			trans	-81.3	152.3	167.5	0	0	0	0	0	111.8	A878 F882 S890 R891 P902 L903 W904	A878-A893 WeakPolarHBondContact CB-O 3.5Å; A878-A893 PolarHBondContact N-O 2.94Å; F882-A893 HydrophobicContact CE2-CB 4.12Å; S890-A893 WeakPolarHBondContact O-CB 3.33Å; S890-A893 PolarHBondContact O-N 2.88Å; S890-A893 VanDerWaalsContact OG-CB 3.23Å; S890-A893 WeakPolarHBondContact OG-CB 3.49Å; R891-A893 VanDerWaalsContact C-N 3.33Å; R891-A893 PolarHBondContact O-N 3.18Å; A893-P902 HydrophobicContact CB-CB 4.03Å; A893-L903 CarbonylContact C-O 3.5Å; A893-L903 WeakPolarHBondContact CA-O 3.45Å; A893-W904 HydrophobicContact CB-CZ2 4.46Å
894	Y	90.9	Very high	72.4	Confident	0 Å²	0	74.7 Å²	74.7	0%	0	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	150.5	173.5	-73	-102.1	0	0	0	109.6	A875 R876 R877 L903 I905 Q915 P916 L919 M933	A875-Y894 HydrophobicContact CB-CD1 4.19Å; R876-Y894 VanDerWaalsContact C-CD1 3.49Å; R876-Y894 CarbonylContact O-C 3.52Å; R876-Y894 WeakPolarHBondContact O-CA 3.14Å; R877-Y894 HydrophobicContact CB-CD1 4.15Å; R877-Y894 HydrophobicContact CB-CE1 3.72Å; R877-Y894 HydrophobicContact CG-CE1 4.13Å; R877-Y894 HydrophobicContact CG-CE2 4.24Å; Y894-L903 PolarHBondContact N-O 3.27Å; Y894-L903 PolarHBondContact O-N 3.36Å; Y894-I905 HydrophobicContact CD2-CG1 4.4Å; Y894-I905 HydrophobicContact CE2-CD1 3.88Å; Y894-I905 HydrophobicContact CE2-CG1 3.87Å; Y894-Q915 WeakPolarHBondContact OH-CA 3.45Å; Y894-Q915 PolarHBondContact OH-OE1 3.02Å; Y894-P916 VanDerWaalsContact CE1-O 3.26Å; Y894-P916 WeakPolarHBondContact CE1-O 3.38Å; Y894-P916 PolarHBondContact OH-O 3.11Å; Y894-L919 HydrophobicContact CD1-CD2 3.78Å; Y894-L919 HydrophobicContact CD1-CG 4.04Å; Y894-L919 HydrophobicContact CE1-CD2 3.34Å; Y894-L919 HydrophobicContact CE1-CG 3.86Å; Y894-L919 HydrophobicContact CE2-CD2 4.21Å; Y894-L919 HydrophobicContact CG-CD2 4.41Å; Y894-M933 HydrophobicContact CD1-CE 4.32Å; Y894-M933 HydrophobicContact CD2-CE 3.79Å; Y894-M933 HydrophobicContact CG-CE 3.67Å
895	R	88.9	Confident	74.4	Confident	81 Å²	81	66.3 Å²	66.3	31%	0.306	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	137.2	165.4	-71.7	-179	178.5	-164.8	-0.3	108.1	A875 R876 A878 W985	A875-R895 CarbonylContact C-O 3.54Å; A875-R895 WeakPolarHBondContact CA-O 3.47Å; A875-R895 WeakPolarHBondContact CB-O 3.28Å; R876-R895 PolarHBondContact N-O 3.13Å; R876-R895 PolarHBondContact O-N 3.45Å; A878-R895 HydrophobicContact CB-CG 4.04Å; R895-W985 HydrophobicContact CB-CZ2 3.84Å; R895-W985 WeakPolarHBondContact O-CH2 3.3Å; R895-W985 WeakPolarHBondContact O-CZ2 3.14Å
896	S	86.8	Confident	76.1	Confident	9 Å²	9	63 Å²	63	6%	0.063	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	152.6	176.2	169	0	0	0	0	110.6	A898 Y921	S896-A898 PolarHBondContact O-N 2.88Å; S896-A898 PolarHBondContact OG-N 2.87Å; S896-Y921 PolarHBondContact OG-OH 3.31Å
897	A	78.6	Confident	77.9	Confident	15 Å²	15	62.8 Å²	62.8	12%	0.124	32%	0.321	C	S	.	.	S	Bend	trans	-65.2	-21.8	168.6	0	0	0	0	0	112.9	V874 Y980 W985	V874-A897 PolarHBondContact O-N 3.32Å; A897-Y980 HydrophobicContact CB-CE1 4.05Å; A897-W985 HydrophobicContact CB-CH2 4.47Å; A897-W985 HydrophobicContact CB-CZ3 4.38Å
898	A	76	Confident	79.5	Confident	38 Å²	38	60.5 Å²	60.5	31%	0.314	30%	0.304	S	S	.	.	S	Bend	trans	-104.7	-20	-176.5	0	0	0	0	0	114.2	S896	S896-A898 PolarHBondContact O-N 2.88Å; S896-A898 PolarHBondContact OG-N 2.87Å
899	V	78	Confident	81.4	Confident	7 Å²	7	51.5 Å²	51.5	4%	0.042	27%	0.266	C	S	.	.			trans	-132.6	123.9	-171.6	-173.7	0	0	0	0	110.4	I599 D901 L903 I924	I599-V899 HydrophobicContact CD1-CG1 4.04Å; I599-V899 HydrophobicContact CD1-CG2 3.69Å; I599-V899 HydrophobicContact CG1-CG2 4.04Å; V899-D901 HydrophobicContact CG1-CB 4.11Å; V899-L903 HydrophobicContact CG1-CD2 4.3Å; V899-I924 HydrophobicContact CB-CD1 4.43Å; V899-I924 HydrophobicContact CG2-CD1 3.64Å
900	E	78.9	Confident	83.4	Confident	197 Å²	197	48 Å²	48	92%	0.921	24%	0.243	S	C	*	.			trans	-72.1	-32.9	179.6	-64.2	-172	166.5	0	0	113
901	D	81.1	Confident	84.9	Confident	81 Å²	81	46.3 Å²	46.3	43%	0.433	23%	0.231	S	C	.	.	S	Bend	trans	-64.2	145.5	179.7	-76.6	-38.7	0	0	0	112.2	V899 L903 K931	V899-D901 HydrophobicContact CG1-CB 4.11Å; D901-L903 PolarHBondContact O-N 2.84Å; D901-K931 HydrophobicContact CB-CD 3.97Å; D901-K931 WeakPolarHBondContact OD2-CE 3.38Å; D901-K931 IonicContact OD2-NZ 3.92Å; D901-K931 PolarHBondContact OD2-NZ 2.85Å
902	P	87.1	Confident	85.9	Confident	46 Å²	46	39.6 Å²	39.6	30%	0.299	21%	0.208	S	C	.	.			trans	-62.8	135.4	175.1	27	-34.1	0	0	0	111	A893 W904	A893-P902 HydrophobicContact CB-CB 4.03Å; P902-W904 HydrophobicContact CB-CH2 3.96Å; P902-W904 HydrophobicContact CB-CZ2 4.35Å; P902-W904 HydrophobicContact CB-CZ3 4.35Å; P902-W904 HydrophobicContact CG-CH2 3.81Å; P902-W904 HydrophobicContact CG-CZ3 4.29Å; P902-W904 WeakPolarHBondContact O-CZ3 3.07Å
903	L	89.3	Confident	86.2	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.221	C	C	.	.	B	Isolated β-bridge	trans	-112.9	154.4	179.3	-55.6	-178.5	0	0	0	111.1	A893 Y894 V899 D901 Y921 I924 K931 M933	A893-L903 CarbonylContact C-O 3.5Å; A893-L903 WeakPolarHBondContact CA-O 3.45Å; Y894-L903 PolarHBondContact N-O 3.27Å; Y894-L903 PolarHBondContact O-N 3.36Å; V899-L903 HydrophobicContact CG1-CD2 4.3Å; D901-L903 PolarHBondContact O-N 2.84Å; L903-Y921 HydrophobicContact CD1-CE1 4.37Å; L903-I924 HydrophobicContact CD1-CD1 3.7Å; L903-I924 HydrophobicContact CD1-CG1 4.32Å; L903-I924 HydrophobicContact CD2-CD1 3.98Å; L903-I924 HydrophobicContact CD2-CG1 4.49Å; L903-I924 HydrophobicContact CD2-CG2 4.11Å; L903-K931 WeakPolarHBondContact CA-O 3.49Å; L903-K931 HydrophobicContact CD2-CB 3.6Å; L903-K931 HydrophobicContact CD2-CD 4.33Å; L903-M933 HydrophobicContact CB-CE 4.09Å; L903-M933 HydrophobicContact CB-CG 3.98Å; L903-M933 HydrophobicContact CB-SD 3.9Å; L903-M933 HydrophobicContact CD1-CG 3.98Å; L903-M933 HydrophobicContact CD1-SD 3.83Å
904	W	91	Very high	86.2	Confident	51 Å²	51	47.3 Å²	47.3	19%	0.193	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	149.8	174.5	-66.5	-89.5	0	0	0	111	S890 A893 P902 H906 K930 K931 C932 M933	S890-W904 VanDerWaalsContact OG-CZ2 3.23Å; S890-W904 WeakPolarHBondContact OG-CZ2 3.38Å; A893-W904 HydrophobicContact CB-CZ2 4.46Å; P902-W904 HydrophobicContact CB-CH2 3.96Å; P902-W904 HydrophobicContact CB-CZ2 4.35Å; P902-W904 HydrophobicContact CB-CZ3 4.35Å; P902-W904 HydrophobicContact CG-CH2 3.81Å; P902-W904 HydrophobicContact CG-CZ3 4.29Å; P902-W904 WeakPolarHBondContact O-CZ3 3.07Å; W904-H906 PolarHBondContact O-N 2.78Å; W904-K930 HydrophobicContact CD2-CB 4.46Å; W904-K930 HydrophobicContact CD2-CD 4.3Å; W904-K930 HydrophobicContact CE3-CB 3.8Å; W904-K930 HydrophobicContact CE3-CD 4.38Å; W904-K930 HydrophobicContact CE3-CG 4.22Å; W904-K930 HydrophobicContact CH2-CG 4.47Å; W904-K930 HydrophobicContact CZ3-CB 3.98Å; W904-K930 HydrophobicContact CZ3-CG 4.16Å; W904-K931 PolarHBondContact N-O 2.78Å; W904-C932 CarbonylContact O-C 3.53Å; W904-C932 WeakPolarHBondContact O-CA 3.37Å; W904-M933 PolarHBondContact O-N 2.99Å
905	I	91.5	Very high	86.1	Confident	3 Å²	3	48.1 Å²	48.1	2%	0.015	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	132.5	168.3	-61.5	175	0	0	0	108.5	Y894 F912 L919 M933 V936	Y894-I905 HydrophobicContact CD2-CG1 4.4Å; Y894-I905 HydrophobicContact CE2-CD1 3.88Å; Y894-I905 HydrophobicContact CE2-CG1 3.87Å; I905-F912 HydrophobicContact CB-CD2 4.35Å; I905-F912 HydrophobicContact CG2-CB 4.25Å; I905-F912 HydrophobicContact CG2-CD2 4.26Å; I905-F912 WeakPolarHBondContact O-CD2 2.9Å; I905-L919 HydrophobicContact CD1-CD2 3.67Å; I905-L919 HydrophobicContact CG1-CD2 3.81Å; I905-M933 HydrophobicContact CG1-CE 4.09Å; I905-V936 HydrophobicContact CG2-CG2 3.93Å
906	H	87.6	Confident	86.3	Confident	13 Å²	13	45.3 Å²	45.3	6%	0.06	24%	0.24	C	C	.	.			trans	-62.7	138.7	178.2	-170.2	-100.4	0	0	0	111.5	W904 T908 S909 C932 M933 L934	W904-H906 PolarHBondContact O-N 2.78Å; H906-T908 WeakPolarHBondContact CE1-CG2 3.39Å; H906-T908 PolarHBondContact CE1-OG1 3.18Å; H906-T908 WeakPolarHBondContact ND1-CG2 3.41Å; H906-T908 PolarHBondContact ND1-N 2.84Å; H906-T908 PolarHBondContact ND1-OG1 2.84Å; H906-T908 PolarHBondContact O-N 3.02Å; H906-S909 VanDerWaalsContact O-CB 3.3Å; H906-S909 WeakPolarHBondContact O-CB 2.94Å; H906-S909 PolarHBondContact O-N 3.4Å; H906-C932 HydrophobicContact CB-CB 4.07Å; H906-M933 VanDerWaalsContact CB-O 3.27Å; H906-M933 WeakPolarHBondContact CB-O 3.39Å; H906-M933 PolarHBondContact N-O 2.79Å; H906-L934 HydrophobicContact CB-CD2 3.51Å; H906-L934 VanDerWaalsContact CG-CD2 3.44Å
907	P	84.7	Confident	86.5	Confident	77 Å²	77	49.1 Å²	49.1	50%	0.5	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-20.8	-175.2	-27.7	35.9	0	0	0	115.7	S909 F912	P907-S909 VanDerWaalsContact C-N 3.32Å; P907-F912 HydrophobicContact CB-CE2 4.31Å; P907-F912 HydrophobicContact CB-CZ 4.46Å; P907-F912 HydrophobicContact CG-CE2 4.24Å
908	T	83.2	Confident	87.2	Confident	29 Å²	29	49 Å²	49	18%	0.178	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-8.4	179.5	68.1	0	0	0	0	113.5	P756 H906	P756-T908 VanDerWaalsContact CD-CG2 3.43Å; P756-T908 HydrophobicContact CG-CG2 4.14Å; H906-T908 WeakPolarHBondContact CE1-CG2 3.39Å; H906-T908 PolarHBondContact CE1-OG1 3.18Å; H906-T908 WeakPolarHBondContact ND1-CG2 3.41Å; H906-T908 PolarHBondContact ND1-N 2.84Å; H906-T908 PolarHBondContact ND1-OG1 2.84Å; H906-T908 PolarHBondContact O-N 3.02Å
909	S	89	Confident	88.1	Confident	6 Å²	6	47.1 Å²	47.1	4%	0.042	24%	0.238	C	C	.	.	S	Bend	trans	-70.2	144.6	179.5	179.4	0	0	0	0	111.2	D792 H906 P907 L911 F912 V936	D792-S909 VanDerWaalsContact CG-OG 3.26Å; D792-S909 VanDerWaalsContact OD1-CA 3.28Å; D792-S909 WeakPolarHBondContact OD1-CA 3.37Å; D792-S909 PolarHBondContact OD1-OG 3.42Å; D792-S909 WeakPolarHBondContact OD2-CB 3.44Å; D792-S909 PolarHBondContact OD2-OG 3.14Å; H906-S909 VanDerWaalsContact O-CB 3.3Å; H906-S909 WeakPolarHBondContact O-CB 2.94Å; H906-S909 PolarHBondContact O-N 3.4Å; P907-S909 VanDerWaalsContact C-N 3.32Å; S909-L911 PolarHBondContact O-N 2.73Å; S909-L911 PolarHBondContact OG-N 3.11Å; S909-F912 VanDerWaalsContact O-CB 3.25Å; S909-F912 WeakPolarHBondContact O-CB 3.29Å; S909-F912 PolarHBondContact O-N 3.34Å; S909-V936 WeakPolarHBondContact OG-CG2 3.45Å
910	V	91.1	Very high	88.9	Confident	13 Å²	13	46.9 Å²	46.9	8%	0.079	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-63.9	-32	172.1	176.7	0	0	0	0	111.4	R778 R779 A782 L788 D792 V795 F912	R778-V910 HydrophobicContact CB-CG2 4.36Å; R779-V910 HydrophobicContact CG-CG1 4.2Å; R779-V910 HydrophobicContact CG-CG2 4.42Å; A782-V910 HydrophobicContact CB-CB 4.35Å; A782-V910 HydrophobicContact CB-CG1 3.7Å; A782-V910 HydrophobicContact CB-CG2 4.19Å; L788-V910 HydrophobicContact CD1-CG1 3.44Å; L788-V910 VanDerWaalsContact CD1-CG1 3.44Å; D792-V910 PolarHBondContact OD1-N 3.34Å; V795-V910 HydrophobicContact CG2-CG2 3.81Å; V910-F912 VanDerWaalsContact C-N 3.27Å; V910-F912 PolarHBondContact O-N 3.07Å
911	L	92.1	Very high	89.6	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-82.3	-0.1	179.6	-63.7	-178.6	0	0	0	113.8	L788 S909 R913 A914 Q915 V936 A938	L788-L911 WeakPolarHBondContact O-CD2 3.21Å; S909-L911 PolarHBondContact O-N 2.73Å; S909-L911 PolarHBondContact OG-N 3.11Å; L911-R913 PolarHBondContact O-N 3.39Å; L911-R913 VanDerWaalsContact O-N 3.1Å; L911-A914 HydrophobicContact CD2-CB 4.09Å; L911-A914 PolarHBondContact O-N 3.36Å; L911-A914 VanDerWaalsContact O-N 3.07Å; L911-Q915 PolarHBondContact O-N 2.86Å; L911-V936 HydrophobicContact CB-CG2 4Å; L911-V936 HydrophobicContact CD1-CG2 4.15Å; L911-V936 HydrophobicContact CG-CG2 4.47Å; L911-A938 HydrophobicContact CD1-CB 4.31Å
912	F	89.5	Confident	89.9	Confident	80 Å²	80	34.9 Å²	34.9	35%	0.351	18%	0.178	S	C	.	.	G	3₁₀ helix	trans	-56.8	-29.7	-179.7	-177.5	-102.4	0	0	0	113.5	I905 P907 S909 V910 Q915	I905-F912 HydrophobicContact CB-CD2 4.35Å; I905-F912 HydrophobicContact CG2-CB 4.25Å; I905-F912 HydrophobicContact CG2-CD2 4.26Å; I905-F912 WeakPolarHBondContact O-CD2 2.9Å; P907-F912 HydrophobicContact CB-CE2 4.31Å; P907-F912 HydrophobicContact CB-CZ 4.46Å; P907-F912 HydrophobicContact CG-CE2 4.24Å; S909-F912 VanDerWaalsContact O-CB 3.25Å; S909-F912 WeakPolarHBondContact O-CB 3.29Å; S909-F912 PolarHBondContact O-N 3.34Å; V910-F912 VanDerWaalsContact C-N 3.27Å; V910-F912 PolarHBondContact O-N 3.07Å; F912-Q915 PolarHBondContact O-NE2 2.83Å
913	R	87.1	Confident	89.7	Confident	188 Å²	188	36.2 Å²	36.2	71%	0.709	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.7	-30.7	175.2	-68.4	-175.6	178.9	-179.8	-2.3	113.5	L911	L911-R913 PolarHBondContact O-N 3.39Å; L911-R913 VanDerWaalsContact O-N 3.1Å
914	A	88.2	Confident	89.4	Confident	59 Å²	59	37 Å²	37	49%	0.488	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-35.3	-176.8	0	0	0	0	0	112.2	L911	L911-A914 HydrophobicContact CD2-CB 4.09Å; L911-A914 PolarHBondContact O-N 3.36Å; L911-A914 VanDerWaalsContact O-N 3.07Å
915	Q	88.6	Confident	88.7	Confident	17 Å²	17	35.5 Å²	35.5	8%	0.079	18%	0.18	C	C	.	.			trans	48	57.6	175.8	-62.9	-72.9	-30.1	0	0	112.5	R877 L892 Y894 L911 F912	R877-Q915 PolarHBondContact NH1-O 3.47Å; L892-Q915 HydrophobicContact CD2-CG 4.17Å; Y894-Q915 WeakPolarHBondContact OH-CA 3.45Å; Y894-Q915 PolarHBondContact OH-OE1 3.02Å; L911-Q915 PolarHBondContact O-N 2.86Å; F912-Q915 PolarHBondContact O-NE2 2.83Å
916	P	92.6	Very high	87.9	Confident	23 Å²	23	37.5 Å²	37.5	15%	0.149	19%	0.191	C	C	.	.			trans	-58.8	151	-177.8	28.6	-37.2	0	0	0	111.4	Y894 L919 A938	Y894-P916 VanDerWaalsContact CE1-O 3.26Å; Y894-P916 WeakPolarHBondContact CE1-O 3.38Å; Y894-P916 PolarHBondContact OH-O 3.11Å; P916-L919 HydrophobicContact CG-CB 4.12Å; P916-L919 HydrophobicContact CG-CD2 4.27Å; P916-A938 HydrophobicContact CB-CB 3.72Å; P916-A938 HydrophobicContact CG-CB 3.91Å
917	E	91.6	Very high	87	Confident	89 Å²	89	38 Å²	38	42%	0.416	20%	0.196	S	C	.	.	S	Bend	trans	-63	-45.7	178.7	-173.4	-171.8	164.1	0	0	111.2	R876 R877	R876-E917 CarbonylContact C-O 3.41Å; R876-E917 WeakPolarHBondContact CA-O 3.27Å; R876-E917 HydrophobicContact CG-CG 4.45Å; R876-E917 IonicContact CZ-OE1 3.88Å; R876-E917 IonicContact NE-OE1 3.27Å; R876-E917 PolarHBondContact NE-OE1 3.29Å; R876-E917 IonicContact NH2-OE1 3.3Å; R876-E917 PolarHBondContact NH2-OE1 3.17Å; R877-E917 PolarHBondContact N-O 3.11Å
918	W	93.5	Very high	86.1	Confident	11 Å²	11	39.1 Å²	39.1	4%	0.042	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	133.5	179.3	-64.7	85.6	0	0	0	110.2	V874 R876 I939 L944 Y980 W985 L987	V874-W918 HydrophobicContact CG1-CE3 3.79Å; V874-W918 HydrophobicContact CG1-CZ3 4.09Å; R876-W918 HydrophobicContact CB-CD2 4.37Å; R876-W918 HydrophobicContact CB-CE3 4.17Å; R876-W918 HydrophobicContact CB-CH2 4.49Å; R876-W918 HydrophobicContact CB-CZ3 4.26Å; R876-W918 VanDerWaalsContact CD-CZ2 3.48Å; R876-W918 HydrophobicContact CG-CD2 4.09Å; R876-W918 HydrophobicContact CG-CE3 4.37Å; R876-W918 HydrophobicContact CG-CH2 4.37Å; R876-W918 HydrophobicContact CG-CZ2 4.05Å; W918-I939 HydrophobicContact CB-CD1 4.24Å; W918-I939 HydrophobicContact CB-CG1 3.6Å; W918-I939 PolarHBondContact O-N 3.24Å; W918-I939 VanDerWaalsContact O-N 3.12Å; W918-L944 HydrophobicContact CD2-CD1 4.43Å; W918-L944 HydrophobicContact CE3-CD1 3.77Å; W918-L944 HydrophobicContact CH2-CD1 4.06Å; W918-L944 HydrophobicContact CZ3-CD1 3.54Å; W918-Y980 HydrophobicContact CZ3-CD1 4.26Å; W918-W985 HydrophobicContact CE3-CE3 4.44Å; W918-W985 HydrophobicContact CH2-CB 3.76Å; W918-W985 HydrophobicContact CH2-CD2 4.17Å; W918-W985 AromaticContact CH2-CE3 3.67Å; W918-W985 HydrophobicContact CH2-CE3 3.67Å; W918-W985 HydrophobicContact CH2-CG 4.25Å; W918-W985 HydrophobicContact CZ2-CB 4.49Å; W918-W985 HydrophobicContact CZ3-CD2 4.32Å; W918-W985 AromaticContact CZ3-CE3 3.41Å; W918-W985 HydrophobicContact CZ3-CE3 3.41Å; W918-W985 VanDerWaalsContact CZ3-CE3 3.41Å; W918-W985 AromaticContact CZ3-CZ3 3.95Å; W918-W985 HydrophobicContact CZ3-CZ3 3.95Å; W918-L987 HydrophobicContact CH2-CD2 3.94Å; W918-L987 HydrophobicContact CZ2-CD2 4.26Å
919	L	95.1	Very high	85.5	Confident	0 Å²	0	41 Å²	41	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	159	176.9	64.7	80.1	0	0	0	112.1	V874 A875 Y894 I905 P916 Y921 M933 V936 M937	V874-L919 CarbonylContact C-O 3.4Å; V874-L919 WeakPolarHBondContact CA-O 3.37Å; A875-L919 HydrophobicContact CB-CD1 3.83Å; A875-L919 HydrophobicContact CB-CG 4.36Å; A875-L919 PolarHBondContact N-O 3.14Å; A875-L919 PolarHBondContact O-N 3.34Å; Y894-L919 HydrophobicContact CD1-CD2 3.78Å; Y894-L919 HydrophobicContact CD1-CG 4.04Å; Y894-L919 HydrophobicContact CE1-CD2 3.34Å; Y894-L919 HydrophobicContact CE1-CG 3.86Å; Y894-L919 HydrophobicContact CE2-CD2 4.21Å; Y894-L919 HydrophobicContact CG-CD2 4.41Å; I905-L919 HydrophobicContact CD1-CD2 3.67Å; I905-L919 HydrophobicContact CG1-CD2 3.81Å; P916-L919 HydrophobicContact CG-CB 4.12Å; P916-L919 HydrophobicContact CG-CD2 4.27Å; L919-Y921 HydrophobicContact CD1-CD1 4.22Å; L919-M933 HydrophobicContact CD1-CE 3.96Å; L919-M933 HydrophobicContact CD1-SD 3.79Å; L919-M933 HydrophobicContact CD2-CE 4.09Å; L919-V936 HydrophobicContact CD1-CG1 4.29Å; L919-M937 CarbonylContact C-O 3.56Å; L919-M937 WeakPolarHBondContact CA-O 3.31Å; L919-M937 VanDerWaalsContact CB-O 3.25Å; L919-M937 WeakPolarHBondContact CB-O 3.39Å
920	V	94.7	Very high	85	Confident	2 Å²	2	46 Å²	46	1%	0.012	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	143.5	166.6	172	0	0	0	0	108.3	V866 L867 L870 N873 V874 V936 M937 I939	V866-V920 HydrophobicContact CG1-CG1 4.48Å; L867-V920 HydrophobicContact CD1-CG2 3.73Å; L870-V920 HydrophobicContact CB-CG1 3.47Å; L870-V920 VanDerWaalsContact CB-CG1 3.47Å; L870-V920 HydrophobicContact CD1-CG1 3.7Å; L870-V920 HydrophobicContact CG-CG1 4.24Å; N873-V920 VanDerWaalsContact O-CA 3.3Å; N873-V920 WeakPolarHBondContact O-CA 3.37Å; V874-V920 HydrophobicContact CG2-CG2 3.95Å; V920-V936 VanDerWaalsContact O-CA 3.3Å; V920-V936 WeakPolarHBondContact O-CA 3.35Å; V920-M937 HydrophobicContact CB-CE 3.69Å; V920-M937 HydrophobicContact CG1-CE 4.12Å; V920-M937 HydrophobicContact CG2-CE 3.87Å; V920-M937 PolarHBondContact N-O 3.06Å; V920-M937 PolarHBondContact O-N 3.15Å; V920-I939 HydrophobicContact CB-CG2 4.48Å; V920-I939 HydrophobicContact CG2-CD1 4.12Å; V920-I939 HydrophobicContact CG2-CG2 3.67Å
921	Y	92.4	Very high	84.8	Confident	6 Å²	6	48.2 Å²	48.2	2%	0.024	25%	0.252	C	S	.	.			trans	-126	151.7	174.2	62.8	-92	0	0	0	111.6	N873 A875 S896 L903 L919 I924 M933	N873-Y921 HydrophobicContact CB-CD1 4.29Å; N873-Y921 HydrophobicContact CB-CD2 4.07Å; N873-Y921 HydrophobicContact CB-CE1 4.09Å; N873-Y921 HydrophobicContact CB-CE2 3.84Å; N873-Y921 HydrophobicContact CB-CG 4.28Å; N873-Y921 WeakPolarHBondContact CB-O 3.49Å; N873-Y921 PolarHBondContact ND2-O 2.86Å; N873-Y921 WeakPolarHBondContact O-CD1 3.27Å; N873-Y921 WeakPolarHBondContact O-CE1 3.46Å; N873-Y921 PolarHBondContact O-N 2.83Å; A875-Y921 HydrophobicContact CB-CD1 4.12Å; A875-Y921 HydrophobicContact CB-CE1 4.08Å; S896-Y921 PolarHBondContact OG-OH 3.31Å; L903-Y921 HydrophobicContact CD1-CE1 4.37Å; L919-Y921 HydrophobicContact CD1-CD1 4.22Å; Y921-I924 HydrophobicContact CD2-CD1 4.45Å; Y921-I924 HydrophobicContact CD2-CG1 3.93Å; Y921-I924 HydrophobicContact CE2-CD1 3.65Å; Y921-I924 HydrophobicContact CE2-CG1 3.6Å; Y921-M933 HydrophobicContact CD1-CG 4.12Å; Y921-M933 HydrophobicContact CD1-SD 3.53Å; Y921-M933 VanDerWaalsContact CD1-SD 3.53Å; Y921-M933 HydrophobicContact CD2-CG 4.46Å; Y921-M933 HydrophobicContact CE1-SD 4.13Å; Y921-M933 HydrophobicContact CG-CB 4.24Å; Y921-M933 HydrophobicContact CG-CG 3.97Å; Y921-M933 HydrophobicContact CG-SD 3.96Å
922	Q	88.5	Confident	84.5	Confident	20 Å²	20	48.5 Å²	48.5	9%	0.093	25%	0.254	C	S	.	.	S	Bend	trans	-82.9	-52.5	176.3	-166.3	-168.5	2.4	0	0	111.2	Y724 L747 N873 L934 N935	Y724-Q922 PolarHBondContact OH-NE2 2.57Å; L747-Q922 HydrophobicContact CD2-CG 4.29Å; L747-Q922 PolarHBondContact O-NE2 3.34Å; N873-Q922 PolarHBondContact ND2-O 2.77Å; Q922-L934 PolarHBondContact N-O 3.2Å; Q922-L934 VanDerWaalsContact N-O 3.14Å; Q922-N935 HydrophobicContact CB-CB 3.87Å; Q922-N935 PolarHBondContact OE1-ND2 2.8Å
923	E	81.8	Confident	84.5	Confident	73 Å²	73	44.7 Å²	44.7	34%	0.341	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	159	-172.9	-59.9	-171.6	162.8	0	0	111.3	L934	E923-L934 PolarHBondContact O-N 2.98Å
924	I	83.5	Confident	84.5	Confident	18 Å²	18	37.2 Å²	37.2	9%	0.092	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	129.2	174.3	-61.7	166.4	0	0	0	108.2	I599 V899 L903 Y921 K931 C932 M933	I599-I924 HydrophobicContact CD1-CD1 4.25Å; I599-I924 HydrophobicContact CG1-CD1 4.37Å; V899-I924 HydrophobicContact CB-CD1 4.43Å; V899-I924 HydrophobicContact CG2-CD1 3.64Å; L903-I924 HydrophobicContact CD1-CD1 3.7Å; L903-I924 HydrophobicContact CD1-CG1 4.32Å; L903-I924 HydrophobicContact CD2-CD1 3.98Å; L903-I924 HydrophobicContact CD2-CG1 4.49Å; L903-I924 HydrophobicContact CD2-CG2 4.11Å; Y921-I924 HydrophobicContact CD2-CD1 4.45Å; Y921-I924 HydrophobicContact CD2-CG1 3.93Å; Y921-I924 HydrophobicContact CE2-CD1 3.65Å; Y921-I924 HydrophobicContact CE2-CG1 3.6Å; I924-K931 HydrophobicContact CG2-CB 3.87Å; I924-K931 HydrophobicContact CG2-CG 4.49Å; I924-C932 WeakPolarHBondContact CA-O 3.45Å; I924-M933 HydrophobicContact CG1-CG 4.43Å
925	V	76.4	Confident	84.6	Confident	18 Å²	18	35.5 Å²	35.5	11%	0.109	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	136.2	177.7	159.1	0	0	0	0	109.5	P509 S927 C932 L934	P509-V925 HydrophobicContact CB-CG1 3.39Å; P509-V925 HydrophobicContact CG-CB 4.35Å; P509-V925 HydrophobicContact CG-CG1 3.31Å; P509-V925 HydrophobicContact CG-CG2 4.1Å; V925-S927 PolarHBondContact O-N 3.12Å; V925-C932 PolarHBondContact N-O 2.92Å; V925-C932 PolarHBondContact O-N 2.78Å; V925-L934 HydrophobicContact CB-CD1 4Å; V925-L934 HydrophobicContact CB-CG 4.37Å; V925-L934 HydrophobicContact CG2-CD1 3.43Å; V925-L934 VanDerWaalsContact CG2-CD1 3.43Å; V925-L934 HydrophobicContact CG2-CG 4.24Å
926	D	74.8	Confident	84.8	Confident	46 Å²	46	34.7 Å²	34.7	25%	0.246	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	114.7	169	-163.6	-8.5	0	0	0	108.6	P509 K601 G929	P509-D926 VanDerWaalsContact O-O 3.14Å; K601-D926 IonicContact NZ-OD2 2.57Å; K601-D926 PolarHBondContact NZ-OD2 2.68Å; K601-D926 VanDerWaalsContact NZ-OD2 3.1Å; D926-G929 VanDerWaalsContact OD1-CA 3.29Å; D926-G929 WeakPolarHBondContact OD1-CA 3.48Å; D926-G929 PolarHBondContact OD1-N 3.05Å
927	S	67.6	Low	84.9	Confident	23 Å²	23	33.6 Å²	33.6	16%	0.161	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	113.7	176.3	-174.4	0	0	0	0	107.4	V925 G929 K930	V925-S927 PolarHBondContact O-N 3.12Å; S927-G929 VanDerWaalsContact C-N 3.27Å; S927-G929 PolarHBondContact O-N 3.32Å; S927-K930 PolarHBondContact N-O 2.82Å; S927-K930 WeakPolarHBondContact O-CA 3.31Å; S927-K930 WeakPolarHBondContact O-CB 3.24Å; S927-K930 PolarHBondContact O-N 2.93Å
928	N	67.3	Low	85.1	Confident	101 Å²	101	29.5 Å²	29.5	54%	0.54	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.5	28.2	176.7	-117.4	-19.2	0	0	0	115.2	D512 K930	D512-N928 WeakPolarHBondContact CB-ND2 3.37Å; D512-N928 WeakPolarHBondContact CB-OD1 3.49Å; D512-N928 PolarHBondContact OD1-ND2 3.22Å; D512-N928 VanDerWaalsContact OD1-ND2 3.12Å; D512-N928 WeakPolarHBondContact OD2-CA 3.37Å; D512-N928 WeakPolarHBondContact OD2-CB 3.3Å; D512-N928 PolarHBondContact OD2-N 2.9Å; D512-N928 PolarHBondContact OD2-ND2 2.68Å; D512-N928 PolarHBondContact OD2-OD1 2.51Å; D512-N928 VanDerWaalsContact OD2-OD1 3.12Å; N928-K930 PolarHBondContact O-N 3.11Å
929	G	70.9	Confident	85.2	Confident	68 Å²	68	29.6 Å²	29.6	70%	0.701	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	75.9	7.6	-172.9	0	0	0	0	0	113.9	D926 S927	D926-G929 VanDerWaalsContact OD1-CA 3.29Å; D926-G929 WeakPolarHBondContact OD1-CA 3.48Å; D926-G929 PolarHBondContact OD1-N 3.05Å; S927-G929 VanDerWaalsContact C-N 3.27Å; S927-G929 PolarHBondContact O-N 3.32Å
930	K	78.8	Confident	85.1	Confident	110 Å²	110	32.1 Å²	32.1	48%	0.478	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	127.8	169.4	-67.1	-173.6	179.2	-175.6	0	109.4	W904 S927 N928 C932	W904-K930 HydrophobicContact CD2-CB 4.46Å; W904-K930 HydrophobicContact CD2-CD 4.3Å; W904-K930 HydrophobicContact CE3-CB 3.8Å; W904-K930 HydrophobicContact CE3-CD 4.38Å; W904-K930 HydrophobicContact CE3-CG 4.22Å; W904-K930 HydrophobicContact CH2-CG 4.47Å; W904-K930 HydrophobicContact CZ3-CB 3.98Å; W904-K930 HydrophobicContact CZ3-CG 4.16Å; S927-K930 PolarHBondContact N-O 2.82Å; S927-K930 WeakPolarHBondContact O-CA 3.31Å; S927-K930 WeakPolarHBondContact O-CB 3.24Å; S927-K930 PolarHBondContact O-N 2.93Å; N928-K930 PolarHBondContact O-N 3.11Å; K930-C932 PolarHBondContact O-N 2.52Å; K930-C932 PolarHBondContact O-SG 2.86Å
931	K	85.4	Confident	84.9	Confident	60 Å²	60	33.6 Å²	33.6	26%	0.261	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	107.2	173.6	-65.5	-175.2	177.6	-172.8	0	109.6	D901 L903 W904 I924	D901-K931 HydrophobicContact CB-CD 3.97Å; D901-K931 WeakPolarHBondContact OD2-CE 3.38Å; D901-K931 IonicContact OD2-NZ 3.92Å; D901-K931 PolarHBondContact OD2-NZ 2.85Å; L903-K931 WeakPolarHBondContact CA-O 3.49Å; L903-K931 HydrophobicContact CD2-CB 3.6Å; L903-K931 HydrophobicContact CD2-CD 4.33Å; W904-K931 PolarHBondContact N-O 2.78Å; I924-K931 HydrophobicContact CG2-CB 3.87Å; I924-K931 HydrophobicContact CG2-CG 4.49Å
932	C	86.9	Confident	84.7	Confident	7 Å²	7	39.5 Å²	39.5	5%	0.047	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	134.6	-177.3	-62.9	0	0	0	0	111.1	W904 H906 I924 V925 K930	W904-C932 CarbonylContact O-C 3.53Å; W904-C932 WeakPolarHBondContact O-CA 3.37Å; H906-C932 HydrophobicContact CB-CB 4.07Å; I924-C932 WeakPolarHBondContact CA-O 3.45Å; V925-C932 PolarHBondContact N-O 2.92Å; V925-C932 PolarHBondContact O-N 2.78Å; K930-C932 PolarHBondContact O-N 2.52Å; K930-C932 PolarHBondContact O-SG 2.86Å
933	M	89.8	Confident	84.9	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	132.1	174.6	-64	176.6	-65.8	0	0	110.2	A875 Y894 L903 W904 I905 H906 L919 Y921 I924 V936	A875-M933 HydrophobicContact CB-CE 4.48Å; A875-M933 HydrophobicContact CB-SD 3.81Å; Y894-M933 HydrophobicContact CD1-CE 4.32Å; Y894-M933 HydrophobicContact CD2-CE 3.79Å; Y894-M933 HydrophobicContact CG-CE 3.67Å; L903-M933 HydrophobicContact CB-CE 4.09Å; L903-M933 HydrophobicContact CB-CG 3.98Å; L903-M933 HydrophobicContact CB-SD 3.9Å; L903-M933 HydrophobicContact CD1-CG 3.98Å; L903-M933 HydrophobicContact CD1-SD 3.83Å; W904-M933 PolarHBondContact O-N 2.99Å; I905-M933 HydrophobicContact CG1-CE 4.09Å; H906-M933 VanDerWaalsContact CB-O 3.27Å; H906-M933 WeakPolarHBondContact CB-O 3.39Å; H906-M933 PolarHBondContact N-O 2.79Å; L919-M933 HydrophobicContact CD1-CE 3.96Å; L919-M933 HydrophobicContact CD1-SD 3.79Å; L919-M933 HydrophobicContact CD2-CE 4.09Å; Y921-M933 HydrophobicContact CD1-CG 4.12Å; Y921-M933 HydrophobicContact CD1-SD 3.53Å; Y921-M933 VanDerWaalsContact CD1-SD 3.53Å; Y921-M933 HydrophobicContact CD2-CG 4.46Å; Y921-M933 HydrophobicContact CE1-SD 4.13Å; Y921-M933 HydrophobicContact CG-CB 4.24Å; Y921-M933 HydrophobicContact CG-CG 3.97Å; Y921-M933 HydrophobicContact CG-SD 3.96Å; I924-M933 HydrophobicContact CG1-CG 4.43Å; M933-V936 HydrophobicContact CB-CG1 3.77Å
934	L	86.8	Confident	85.4	Confident	31 Å²	31	36.4 Å²	36.4	16%	0.162	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	154.3	176.4	-65.8	-179.2	0	0	0	111.7	H906 Q922 E923 V925	H906-L934 HydrophobicContact CB-CD2 3.51Å; H906-L934 VanDerWaalsContact CG-CD2 3.44Å; Q922-L934 PolarHBondContact N-O 3.2Å; Q922-L934 VanDerWaalsContact N-O 3.14Å; E923-L934 PolarHBondContact O-N 2.98Å; V925-L934 HydrophobicContact CB-CD1 4Å; V925-L934 HydrophobicContact CB-CG 4.37Å; V925-L934 HydrophobicContact CG2-CD1 3.43Å; V925-L934 VanDerWaalsContact CG2-CD1 3.43Å; V925-L934 HydrophobicContact CG2-CG 4.24Å
935	N	88.7	Confident	85.6	Confident	22 Å²	22	36.1 Å²	36.1	12%	0.118	20%	0.199	C	C	.	.	S	Bend	trans	51.1	60.4	177.9	-62.8	-28.2	0	0	0	112.3	L793 Q922	L793-N935 HydrophobicContact CD2-CB 4.13Å; Q922-N935 HydrophobicContact CB-CB 3.87Å; Q922-N935 PolarHBondContact OE1-ND2 2.8Å
936	V	93.2	Very high	86.1	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	23%	0.226	C	C	.	.			trans	-89.7	149.9	-172.7	-64	0	0	0	0	112.5	D792 I905 S909 L911 L919 V920 M933	D792-V936 PolarHBondContact N-O 3.34Å; D792-V936 PolarHBondContact OD2-N 3.01Å; I905-V936 HydrophobicContact CG2-CG2 3.93Å; S909-V936 WeakPolarHBondContact OG-CG2 3.45Å; L911-V936 HydrophobicContact CB-CG2 4Å; L911-V936 HydrophobicContact CD1-CG2 4.15Å; L911-V936 HydrophobicContact CG-CG2 4.47Å; L919-V936 HydrophobicContact CD1-CG1 4.29Å; V920-V936 VanDerWaalsContact O-CA 3.3Å; V920-V936 WeakPolarHBondContact O-CA 3.35Å; M933-V936 HydrophobicContact CB-CG1 3.77Å
937	M	95.3	Very high	86.8	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	139.2	179.8	170.4	-174.9	70.3	0	0	109.8	L790 L793 R863 V866 L919 V920 I939	L790-M937 HydrophobicContact CD1-CG 4.28Å; L790-M937 HydrophobicContact CD1-SD 3.71Å; L793-M937 HydrophobicContact CD1-CB 4.08Å; L793-M937 HydrophobicContact CD1-SD 4.03Å; R863-M937 VanDerWaalsContact CA-SD 3.5Å; R863-M937 HydrophobicContact CB-CG 4.42Å; R863-M937 HydrophobicContact CB-SD 3.72Å; R863-M937 HydrophobicContact CG-CG 4Å; R863-M937 HydrophobicContact CG-SD 3.72Å; V866-M937 HydrophobicContact CB-CE 3.6Å; V866-M937 HydrophobicContact CB-SD 3.8Å; V866-M937 HydrophobicContact CG1-CE 3.38Å; V866-M937 HydrophobicContact CG1-SD 3.91Å; V866-M937 HydrophobicContact CG2-SD 4.26Å; L919-M937 CarbonylContact C-O 3.56Å; L919-M937 WeakPolarHBondContact CA-O 3.31Å; L919-M937 VanDerWaalsContact CB-O 3.25Å; L919-M937 WeakPolarHBondContact CB-O 3.39Å; V920-M937 HydrophobicContact CB-CE 3.69Å; V920-M937 HydrophobicContact CG1-CE 4.12Å; V920-M937 HydrophobicContact CG2-CE 3.87Å; V920-M937 PolarHBondContact N-O 3.06Å; V920-M937 PolarHBondContact O-N 3.15Å; M937-I939 HydrophobicContact CE-CG2 3.88Å
938	A	96.4	Very high	87.8	Confident	4 Å²	4	38.1 Å²	38.1	3%	0.033	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	142.7	176	0	0	0	0	0	111.8	L789 R863 L911 P916	L789-A938 HydrophobicContact CB-CB 4.15Å; L789-A938 HydrophobicContact CD2-CB 3.86Å; L789-A938 PolarHBondContact O-N 3.03Å; R863-A938 PolarHBondContact NH1-O 2.72Å; R863-A938 VanDerWaalsContact NH1-O 3.1Å; L911-A938 HydrophobicContact CD1-CB 4.31Å; P916-A938 HydrophobicContact CB-CB 3.72Å; P916-A938 HydrophobicContact CG-CB 3.91Å
939	I	94.9	Very high	88.7	Confident	12 Å²	12	42.1 Å²	42.1	6%	0.062	23%	0.226	C	C	.	.			trans	-131.8	160.6	178.3	66.1	169.3	0	0	0	111.6	L867 V874 W918 V920 M937 W943 L944	L867-I939 HydrophobicContact CD1-CD1 3.96Å; L867-I939 HydrophobicContact CD2-CD1 4.38Å; V874-I939 HydrophobicContact CG1-CD1 3.86Å; V874-I939 HydrophobicContact CG2-CD1 4.08Å; W918-I939 HydrophobicContact CB-CD1 4.24Å; W918-I939 HydrophobicContact CB-CG1 3.6Å; W918-I939 PolarHBondContact O-N 3.24Å; W918-I939 VanDerWaalsContact O-N 3.12Å; V920-I939 HydrophobicContact CB-CG2 4.48Å; V920-I939 HydrophobicContact CG2-CD1 4.12Å; V920-I939 HydrophobicContact CG2-CG2 3.67Å; M937-I939 HydrophobicContact CE-CG2 3.88Å; I939-W943 HydrophobicContact CB-CE3 4.49Å; I939-L944 HydrophobicContact CD1-CD2 3.81Å; I939-L944 HydrophobicContact CD1-CG 4.34Å
940	E	92.9	Very high	89.3	Confident	53 Å²	53	41 Å²	41	25%	0.248	21%	0.214	C	C	.	.			trans	-98.5	138.8	175.1	-67.1	78.2	174.8	0	0	109.6	R863 E942 W943	R863-E940 IonicContact CZ-OE1 3.59Å; R863-E940 VanDerWaalsContact CZ-OE1 3.29Å; R863-E940 IonicContact CZ-OE2 3.71Å; R863-E940 IonicContact NH1-OE1 2.85Å; R863-E940 PolarHBondContact NH1-OE1 2.77Å; R863-E940 IonicContact NH1-OE2 2.9Å; R863-E940 PolarHBondContact NH1-OE2 2.81Å; R863-E940 IonicContact NH2-OE1 3.62Å; R863-E940 PolarHBondContact NH2-OE1 2.81Å; R863-E940 IonicContact NH2-OE2 3.65Å; E940-E942 PolarHBondContact O-N 2.79Å; E940-W943 HydrophobicContact CB-CD2 3.9Å; E940-W943 HydrophobicContact CB-CE3 4.45Å; E940-W943 HydrophobicContact CB-CG 4.13Å; E940-W943 HydrophobicContact CB-CZ2 4.42Å; E940-W943 VanDerWaalsContact CD-CZ2 3.41Å; E940-W943 HydrophobicContact CG-CZ2 4.2Å; E940-W943 PolarHBondContact O-N 2.61Å; E940-W943 VanDerWaalsContact OE2-CE3 3.31Å; E940-W943 WeakPolarHBondContact OE2-CH2 3.3Å; E940-W943 WeakPolarHBondContact OE2-CZ2 3.47Å; E940-W943 WeakPolarHBondContact OE2-CZ3 3.48Å
941	S	90.3	Very high	89.7	Confident	33 Å²	33	36.6 Å²	36.6	23%	0.231	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65	-27.5	-175.7	53.5	0	0	0	0	113.6	W943 L944	S941-W943 PolarHBondContact O-N 3.14Å; S941-L944 PolarHBondContact O-N 3.08Å
942	E	89.5	Confident	89.8	Confident	130 Å²	130	34.8 Å²	34.8	61%	0.607	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-31.1	179.9	-63	175.6	-173.6	0	0	112.1	E940 L944 P988	E940-E942 PolarHBondContact O-N 2.79Å; E942-L944 VanDerWaalsContact C-N 3.3Å; E942-L944 PolarHBondContact O-N 2.84Å; E942-P988 HydrophobicContact CG-CG 4.22Å
943	W	92.2	Very high	89.8	Confident	29 Å²	29	37.6 Å²	37.6	11%	0.11	21%	0.212	C	C	.	.	H	α-helix	trans	-72.7	-24.4	-177.1	-58.8	-7.7	0	0	0	113	E860 R863 Q864 L867 I939 E940 S941 V945 A946 L947	E860-W943 HydrophobicContact CG-CH2 3.8Å; E860-W943 HydrophobicContact CG-CZ2 3.83Å; R863-W943 HydrophobicContact CB-CH2 4.16Å; R863-W943 HydrophobicContact CB-CZ3 3.79Å; R863-W943 VanDerWaalsContact NH2-CH2 3.28Å; Q864-W943 HydrophobicContact CG-CD2 3.86Å; Q864-W943 HydrophobicContact CG-CE3 3.71Å; Q864-W943 HydrophobicContact CG-CH2 3.65Å; Q864-W943 HydrophobicContact CG-CZ2 3.88Å; Q864-W943 HydrophobicContact CG-CZ3 3.6Å; L867-W943 HydrophobicContact CD2-CB 3.87Å; L867-W943 HydrophobicContact CD2-CE3 4.41Å; I939-W943 HydrophobicContact CB-CE3 4.49Å; E940-W943 HydrophobicContact CB-CD2 3.9Å; E940-W943 HydrophobicContact CB-CE3 4.45Å; E940-W943 HydrophobicContact CB-CG 4.13Å; E940-W943 HydrophobicContact CB-CZ2 4.42Å; E940-W943 VanDerWaalsContact CD-CZ2 3.41Å; E940-W943 HydrophobicContact CG-CZ2 4.2Å; E940-W943 PolarHBondContact O-N 2.61Å; E940-W943 VanDerWaalsContact OE2-CE3 3.31Å; E940-W943 WeakPolarHBondContact OE2-CH2 3.3Å; E940-W943 WeakPolarHBondContact OE2-CZ2 3.47Å; E940-W943 WeakPolarHBondContact OE2-CZ3 3.48Å; S941-W943 PolarHBondContact O-N 3.14Å; W943-V945 VanDerWaalsContact C-N 3.27Å; W943-V945 PolarHBondContact O-N 3.09Å; W943-A946 PolarHBondContact O-N 2.75Å; W943-L947 HydrophobicContact CB-CD1 4.09Å; W943-L947 WeakPolarHBondContact O-CB 3.06Å; W943-L947 PolarHBondContact O-N 2.67Å
944	L	91.3	Very high	89.6	Confident	0 Å²	0	41 Å²	41	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-59.8	-39.5	-175.4	-70.1	170.5	0	0	0	111.6	L867 V874 W918 I939 S941 E942 A948 C952 Y980 L987	L867-L944 HydrophobicContact CD1-CD2 3.99Å; L867-L944 HydrophobicContact CD2-CD2 4.21Å; V874-L944 HydrophobicContact CG1-CD2 4.39Å; V874-L944 HydrophobicContact CG2-CD2 4.12Å; W918-L944 HydrophobicContact CD2-CD1 4.43Å; W918-L944 HydrophobicContact CE3-CD1 3.77Å; W918-L944 HydrophobicContact CH2-CD1 4.06Å; W918-L944 HydrophobicContact CZ3-CD1 3.54Å; I939-L944 HydrophobicContact CD1-CD2 3.81Å; I939-L944 HydrophobicContact CD1-CG 4.34Å; S941-L944 PolarHBondContact O-N 3.08Å; E942-L944 VanDerWaalsContact C-N 3.3Å; E942-L944 PolarHBondContact O-N 2.84Å; L944-A948 HydrophobicContact CD2-CB 4.46Å; L944-A948 CarbonylContact O-C 3.58Å; L944-A948 VanDerWaalsContact O-CA 3.22Å; L944-A948 WeakPolarHBondContact O-CA 3.41Å; L944-A948 VanDerWaalsContact O-CB 3.29Å; L944-A948 WeakPolarHBondContact O-CB 3.37Å; L944-A948 PolarHBondContact O-N 3Å; L944-C952 PolarHBondContact O-SG 3.23Å; L944-C952 VanDerWaalsContact O-SG 3.36Å; L944-Y980 HydrophobicContact CB-CD2 4.14Å; L944-Y980 HydrophobicContact CD1-CD2 4.32Å; L944-Y980 HydrophobicContact CD1-CG 4.23Å; L944-Y980 HydrophobicContact CD2-CD2 4.08Å; L944-Y980 HydrophobicContact CD2-CE2 3.73Å; L944-Y980 HydrophobicContact CG-CD2 4.42Å; L944-L987 HydrophobicContact CB-CD1 3.86Å; L944-L987 HydrophobicContact CB-CD2 4.36Å; L944-L987 HydrophobicContact CD1-CD1 4.5Å; L944-L987 HydrophobicContact CD1-CD2 3.59Å
945	V	87.4	Confident	89.5	Confident	11 Å²	11	41.5 Å²	41.5	7%	0.067	24%	0.241	C	C	.	.	H	α-helix	trans	-71.7	-39.7	-178.8	-172.8	0	0	0	0	112	W943 M954 C978 L987 Q990	W943-V945 VanDerWaalsContact C-N 3.27Å; W943-V945 PolarHBondContact O-N 3.09Å; V945-M954 HydrophobicContact CG1-CE 3.32Å; V945-M954 HydrophobicContact CG1-SD 4.39Å; V945-C978 HydrophobicContact CG2-CB 4.05Å; V945-L987 HydrophobicContact CG2-CB 4.35Å; V945-L987 HydrophobicContact CG2-CD1 3.47Å; V945-L987 VanDerWaalsContact CG2-CD1 3.47Å; V945-Q990 HydrophobicContact CB-CG 3.93Å; V945-Q990 HydrophobicContact CG1-CG 3.8Å; V945-Q990 HydrophobicContact CG2-CG 3.77Å
946	A	87.6	Confident	89.3	Confident	81 Å²	81	47.2 Å²	47.2	67%	0.669	27%	0.267	S	S	*	.	H	α-helix	trans	-74.1	-44.5	-179.4	0	0	0	0	0	112.6	W943	W943-A946 PolarHBondContact O-N 2.75Å
947	L	90.2	Very high	89.1	Confident	47 Å²	47	49.5 Å²	49.5	25%	0.246	28%	0.282	C	S	.	.	H	α-helix	trans	-99.8	-26	-168.7	-58.2	-178.2	0	0	0	113.7	Q864 L867 T868 W943	Q864-L947 HydrophobicContact CB-CD1 3.5Å; Q864-L947 HydrophobicContact CG-CD1 3.83Å; L867-L947 HydrophobicContact CD2-CB 4.36Å; L867-L947 HydrophobicContact CD2-CD1 4.27Å; T868-L947 HydrophobicContact CG2-CB 4.05Å; T868-L947 HydrophobicContact CG2-CD2 4.15Å; W943-L947 HydrophobicContact CB-CD1 4.09Å; W943-L947 WeakPolarHBondContact O-CB 3.06Å; W943-L947 PolarHBondContact O-N 2.67Å
948	A	88.6	Confident	88.7	Confident	2 Å²	2	51.2 Å²	51.2	2%	0.017	29%	0.291	C	S	.	.			trans	-119.9	36.1	-178	0	0	0	0	0	112.1	C871 L944 G950 C951 C952 Y980	C871-A948 HydrophobicContact CB-CB 3.68Å; L944-A948 HydrophobicContact CD2-CB 4.46Å; L944-A948 CarbonylContact O-C 3.58Å; L944-A948 VanDerWaalsContact O-CA 3.22Å; L944-A948 WeakPolarHBondContact O-CA 3.41Å; L944-A948 VanDerWaalsContact O-CB 3.29Å; L944-A948 WeakPolarHBondContact O-CB 3.37Å; L944-A948 PolarHBondContact O-N 3Å; A948-G950 PolarHBondContact O-N 3.07Å; A948-G950 VanDerWaalsContact O-N 3.09Å; A948-C951 PolarHBondContact O-N 2.98Å; A948-C952 PolarHBondContact O-N 2.89Å; A948-C952 PolarHBondContact O-SG 3.12Å; A948-C952 VanDerWaalsContact O-SG 3.37Å; A948-Y980 HydrophobicContact CB-CE2 4.08Å
949	R	84.9	Confident	88.2	Confident	184 Å²	184	59.8 Å²	59.8	69%	0.694	33%	0.328	S	S	*	.	G	3₁₀ helix	trans	-50.5	-37.9	-177.6	-170	174.7	180	-179.5	0.6	113.7	C951 C952	R949-C951 PolarHBondContact O-N 3.11Å; R949-C952 PolarHBondContact O-N 2.94Å; R949-C952 VanDerWaalsContact O-N 3.09Å
950	G	84	Confident	87.7	Confident	44 Å²	44	67 Å²	67	45%	0.454	36%	0.361	S	S	.	.	G	3₁₀ helix	trans	-64	-20.1	178.2	0	0	0	0	0	114.7	A948	A948-G950 PolarHBondContact O-N 3.07Å; A948-G950 VanDerWaalsContact O-N 3.09Å
951	C	86.3	Confident	87.5	Confident	19 Å²	19	67.4 Å²	67.4	13%	0.128	37%	0.368	C	S	.	.	G	3₁₀ helix	trans	-100.7	-0.3	176.3	-63	0	0	0	0	113.1	C871 A948 R949 Y980 G981	C871-C951 PolarHBondContact O-SG 2.87Å; A948-C951 PolarHBondContact O-N 2.98Å; R949-C951 PolarHBondContact O-N 3.11Å; C951-Y980 HydrophobicContact CB-CD2 4.2Å; C951-Y980 HydrophobicContact CB-CE2 3.58Å; C951-G981 PolarHBondContact O-N 3.14Å
952	C	89	Confident	87.4	Confident	21 Å²	21	68.4 Å²	68.4	14%	0.142	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	145.8	178.5	-59.8	0	0	0	0	110.2	L944 A948 R949 T979	L944-C952 PolarHBondContact O-SG 3.23Å; L944-C952 VanDerWaalsContact O-SG 3.36Å; A948-C952 PolarHBondContact O-N 2.89Å; A948-C952 PolarHBondContact O-SG 3.12Å; A948-C952 VanDerWaalsContact O-SG 3.37Å; R949-C952 PolarHBondContact O-N 2.94Å; R949-C952 VanDerWaalsContact O-N 3.09Å; C952-T979 CarbonylContact C-O 3.15Å; C952-T979 VanDerWaalsContact CA-O 3.27Å; C952-T979 WeakPolarHBondContact CA-O 3.5Å
953	S	86.3	Confident	87.5	Confident	67 Å²	67	62.6 Å²	62.6	47%	0.469	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	134.8	164.8	73.3	0	0	0	0	109.8	T979	S953-T979 PolarHBondContact N-O 3.26Å; S953-T979 PolarHBondContact O-N 3.18Å; S953-T979 PolarHBondContact OG-OG1 3.42Å
954	M	85.3	Confident	87.5	Confident	71 Å²	71	64.5 Å²	64.5	35%	0.35	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	132.2	-179.6	-58.1	-65.8	-169.4	0	0	108.9	V945 V976 C978 V992	V945-M954 HydrophobicContact CG1-CE 3.32Å; V945-M954 HydrophobicContact CG1-SD 4.39Å; M954-V976 HydrophobicContact SD-CG2 4.06Å; M954-C978 HydrophobicContact SD-CB 4.22Å; M954-C978 PolarHBondContact SD-SG 2.86Å; M954-V992 HydrophobicContact CE-CG1 4.41Å
955	G	84.8	Confident	87.6	Confident	41 Å²	41	65.2 Å²	65.2	42%	0.423	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	-175	171.8	0	0	0	0	0	113.1	D977	G955-D977 PolarHBondContact N-O 3.09Å
956	E	85.8	Confident	87.8	Confident	143 Å²	143	65.3 Å²	65.3	67%	0.668	37%	0.365	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.6	151.4	172.2	-65.3	178.7	-179	0	0	111	L958	E956-L958 PolarHBondContact O-N 3.24Å
957	P	87.6	Confident	87.9	Confident	48 Å²	48	68.1 Å²	68.1	31%	0.312	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-52.2	124.7	173.1	-27.7	35.9	0	0	0	112.1	C974 P995	P957-C974 HydrophobicContact CB-CB 4.18Å; P957-P995 HydrophobicContact CG-CG 4.03Å
958	L	88.2	Confident	87.8	Confident	35 Å²	35	72.3 Å²	72.3	18%	0.183	39%	0.392	C	S	.	.	P	Polyproline II helix	trans	-68.1	141.9	175.3	-63.7	175.3	0	0	0	109.8	E956 E960 H975 R989	E956-L958 PolarHBondContact O-N 3.24Å; L958-E960 VanDerWaalsContact C-N 3.34Å; L958-H975 HydrophobicContact CB-CB 4.45Å; L958-H975 VanDerWaalsContact CB-O 3.29Å; L958-H975 WeakPolarHBondContact CB-O 3.33Å; L958-H975 HydrophobicContact CD1-CB 4.18Å; L958-H975 WeakPolarHBondContact CG-O 3.45Å; L958-H975 PolarHBondContact N-O 3.27Å; L958-R989 HydrophobicContact CD1-CG 4.41Å
959	K	84.1	Confident	87.7	Confident	184 Å²	184	76.6 Å²	76.6	80%	0.8	41%	0.411	S	S	*	.	S	Bend	trans	-75.9	-28.1	173	-65.2	-179.7	-178.5	174.9	0	112	P961 A962	K959-P961 CarbonylContact O-C 3.52Å; K959-A962 WeakPolarHBondContact O-CA 3.24Å; K959-A962 PolarHBondContact O-N 2.7Å
960	E	85.3	Confident	88.1	Confident	165 Å²	165	69.7 Å²	69.7	77%	0.771	39%	0.387	S	S	*	.	S	Bend	trans	-131.6	120.9	-179.6	-68.9	-176	-178.9	0	0	109.6	L958	L958-E960 VanDerWaalsContact C-N 3.34Å
961	P	88.6	Confident	88.5	Confident	60 Å²	60	70.6 Å²	70.6	39%	0.39	38%	0.38	S	S	.	.	S	Bend	cis	-65.7	148.7	-5.4	30.6	-37.3	0	0	0	112.4	K959 H975	K959-P961 CarbonylContact O-C 3.52Å; P961-H975 HydrophobicContact CG-CB 4.01Å; P961-H975 VanDerWaalsContact CG-CE1 3.47Å; P961-H975 WeakPolarHBondContact CG-CE1 3.22Å; P961-H975 VanDerWaalsContact CG-CG 3.43Å; P961-H975 VanDerWaalsContact CG-ND1 3.28Å; P961-H975 WeakPolarHBondContact CG-ND1 3.35Å
962	A	87.9	Confident	88.9	Confident	55 Å²	55	69.7 Å²	69.7	46%	0.455	37%	0.373	S	S	.	.	P	Polyproline II helix	trans	-66	148.3	-178.8	0	0	0	0	0	111.4	K959	K959-A962 WeakPolarHBondContact O-CA 3.24Å; K959-A962 PolarHBondContact O-N 2.7Å
963	P	91.9	Very high	89.1	Confident	7 Å²	7	68.7 Å²	68.7	5%	0.045	37%	0.367	C	S	.	.	P	Polyproline II helix	trans	-55.2	141.6	171	-24.9	33	0	0	0	112.3	I972 V973 C974 Y1003	P963-I972 HydrophobicContact CB-CG2 3.88Å; P963-V973 CarbonylContact C-O 3.55Å; P963-V973 WeakPolarHBondContact CA-O 3.48Å; P963-V973 WeakPolarHBondContact CB-O 3.5Å; P963-C974 HydrophobicContact CB-CB 4.08Å; P963-C974 HydrophobicContact CG-CB 3.83Å; P963-Y1003 HydrophobicContact CB-CD1 3.87Å; P963-Y1003 HydrophobicContact CB-CD2 3.9Å; P963-Y1003 HydrophobicContact CB-CE1 3.9Å; P963-Y1003 HydrophobicContact CB-CE2 3.95Å; P963-Y1003 HydrophobicContact CB-CG 3.9Å; P963-Y1003 VanDerWaalsContact CD-CZ 3.49Å; P963-Y1003 WeakPolarHBondContact CD-OH 3.42Å; P963-Y1003 HydrophobicContact CG-CD1 4.4Å; P963-Y1003 HydrophobicContact CG-CD2 4.07Å; P963-Y1003 HydrophobicContact CG-CE1 3.96Å; P963-Y1003 HydrophobicContact CG-CE2 3.61Å; P963-Y1003 HydrophobicContact CG-CG 4.48Å; P963-Y1003 WeakPolarHBondContact O-CD1 3.49Å
964	F	91.4	Very high	89.3	Confident	69 Å²	69	65.5 Å²	65.5	30%	0.303	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	163.9	-176.8	65.2	-84.7	0	0	0	110.6	I972 V973 H975	F964-I972 WeakPolarHBondContact O-CA 3.17Å; F964-V973 HydrophobicContact CD1-CG2 3.91Å; F964-V973 HydrophobicContact CD2-CG2 3.76Å; F964-V973 HydrophobicContact CE1-CG2 3.58Å; F964-V973 HydrophobicContact CE2-CG2 3.43Å; F964-V973 VanDerWaalsContact CE2-CG2 3.43Å; F964-V973 HydrophobicContact CG-CG2 4Å; F964-V973 HydrophobicContact CZ-CG2 3.34Å; F964-V973 PolarHBondContact N-O 3.42Å; F964-V973 VanDerWaalsContact O-CG2 3.31Å; F964-V973 WeakPolarHBondContact O-CG2 3.45Å; F964-V973 PolarHBondContact O-N 3.47Å; F964-H975 AromaticContact CE1-CE1 3.86Å
965	Y	93.3	Very high	89.7	Confident	16 Å²	16	63.7 Å²	63.7	6%	0.063	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	125.6	175.9	177.6	-100	0	0	0	111.4	E967 D970 I972 F1004 V1013 K1057	Y965-E967 HydrophobicContact CE1-CB 4.37Å; Y965-D970 PolarHBondContact OH-OD1 3.19Å; Y965-I972 HydrophobicContact CD2-CD1 4.11Å; Y965-I972 HydrophobicContact CG-CD1 4.43Å; Y965-F1004 HydrophobicContact CE2-CE2 4.33Å; Y965-V1013 HydrophobicContact CD1-CG2 4.17Å; Y965-V1013 HydrophobicContact CD2-CG2 3.9Å; Y965-V1013 HydrophobicContact CE1-CB 4.4Å; Y965-V1013 HydrophobicContact CE1-CG2 4.35Å; Y965-V1013 HydrophobicContact CE2-CG1 4.21Å; Y965-V1013 HydrophobicContact CE2-CG2 4.08Å; Y965-V1013 HydrophobicContact CG-CG2 3.93Å; Y965-K1057 WeakPolarHBondContact OH-CB 3.28Å
966	S	92.3	Very high	89.9	Confident	13 Å²	13	61.9 Å²	61.9	9%	0.091	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	112.3	175.4	175.6	0	0	0	0	109.9	T968 K969 D970 Q971	S966-T968 VanDerWaalsContact C-N 3.28Å; S966-T968 PolarHBondContact O-N 3.46Å; S966-T968 PolarHBondContact OG-OG1 3.24Å; S966-K969 PolarHBondContact O-N 3.43Å; S966-K969 PolarHBondContact OG-N 3.46Å; S966-D970 PolarHBondContact O-N 2.88Å; S966-Q971 PolarHBondContact N-O 2.78Å
967	E	89	Confident	90.1	Very high	140 Å²	140	58.8 Å²	58.8	65%	0.654	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-36.5	178.9	-172.7	172.3	-163.3	0	0	112.2	Y965 K969	Y965-E967 HydrophobicContact CE1-CB 4.37Å; E967-K969 VanDerWaalsContact C-N 3.34Å; E967-K969 PolarHBondContact O-N 3.49Å
968	T	89.4	Confident	90.2	Very high	135 Å²	135	56.6 Å²	56.6	83%	0.828	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-31	178.7	51.1	0	0	0	0	113.7	S966	S966-T968 VanDerWaalsContact C-N 3.28Å; S966-T968 PolarHBondContact O-N 3.46Å; S966-T968 PolarHBondContact OG-OG1 3.24Å
969	K	87	Confident	90.3	Very high	92 Å²	92	56.7 Å²	56.7	40%	0.4	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.2	-6	-177.1	-68.4	176.4	178.4	168.4	0	112.6	S966 E967 Q971 V973 E991	S966-K969 PolarHBondContact O-N 3.43Å; S966-K969 PolarHBondContact OG-N 3.46Å; E967-K969 VanDerWaalsContact C-N 3.34Å; E967-K969 PolarHBondContact O-N 3.49Å; K969-Q971 VanDerWaalsContact C-N 3.29Å; K969-Q971 HydrophobicContact CB-CG 3.9Å; K969-Q971 WeakPolarHBondContact O-CG 3.3Å; K969-Q971 PolarHBondContact O-N 3.1Å; K969-V973 HydrophobicContact CD-CG1 3.83Å; K969-E991 PolarHBondContact NZ-O 2.85Å
970	D	92.2	Very high	90.6	Very high	38 Å²	38	48 Å²	48	20%	0.203	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	45.8	45.9	-174.3	-167.2	12.3	0	0	0	114.3	Y965 S966 S1056 K1057 E1058	Y965-D970 PolarHBondContact OH-OD1 3.19Å; S966-D970 PolarHBondContact O-N 2.88Å; D970-S1056 VanDerWaalsContact O-CB 3.23Å; D970-S1056 WeakPolarHBondContact O-CB 3.33Å; D970-S1056 WeakPolarHBondContact OD2-CB 3.43Å; D970-K1057 WeakPolarHBondContact OD1-CA 3.46Å; D970-K1057 WeakPolarHBondContact OD1-CB 3.4Å; D970-K1057 PolarHBondContact OD1-N 3.06Å; D970-K1057 PolarHBondContact OD2-N 3.34Å; D970-E1058 WeakPolarHBondContact OD2-CB 3.32Å; D970-E1058 PolarHBondContact OD2-N 3.43Å
971	Q	92.9	Very high	90.4	Very high	63 Å²	63	41.4 Å²	41.4	29%	0.294	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.4	165.3	-178.4	63.4	-169.9	-26.4	0	0	112.1	S966 K969 V973 Y1000	S966-Q971 PolarHBondContact N-O 2.78Å; K969-Q971 VanDerWaalsContact C-N 3.29Å; K969-Q971 HydrophobicContact CB-CG 3.9Å; K969-Q971 WeakPolarHBondContact O-CG 3.3Å; K969-Q971 PolarHBondContact O-N 3.1Å; Q971-V973 HydrophobicContact CG-CG1 4.36Å; Q971-Y1000 WeakPolarHBondContact CB-OH 3.36Å
972	I	93.8	Very high	89.9	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	126.5	169.4	-57.8	-59.6	0	0	0	109.6	P963 F964 Y965 H994 Y1000 Y1003 F1004 E1007	P963-I972 HydrophobicContact CB-CG2 3.88Å; F964-I972 WeakPolarHBondContact O-CA 3.17Å; Y965-I972 HydrophobicContact CD2-CD1 4.11Å; Y965-I972 HydrophobicContact CG-CD1 4.43Å; I972-H994 HydrophobicContact CB-CB 4.32Å; I972-H994 HydrophobicContact CG2-CB 3.87Å; I972-H994 PolarHBondContact O-N 2.86Å; I972-Y1000 HydrophobicContact CB-CD2 4.04Å; I972-Y1000 HydrophobicContact CB-CE2 3.65Å; I972-Y1000 HydrophobicContact CG1-CE1 4.26Å; I972-Y1000 HydrophobicContact CG1-CE2 4.18Å; I972-Y1000 PolarHBondContact N-OH 3.32Å; I972-Y1003 HydrophobicContact CG2-CG 4.36Å; I972-F1004 HydrophobicContact CD1-CB 4.31Å; I972-F1004 HydrophobicContact CD1-CD2 4.4Å; I972-F1004 HydrophobicContact CG1-CB 3.99Å; I972-F1004 HydrophobicContact CG1-CD2 4.3Å; I972-E1007 HydrophobicContact CD1-CB 4.47Å; I972-E1007 HydrophobicContact CD1-CG 4.11Å
973	V	93.2	Very high	89.4	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	148.1	176.5	-66	0	0	0	0	110.6	P963 F964 K969 Q971 V992	P963-V973 CarbonylContact C-O 3.55Å; P963-V973 WeakPolarHBondContact CA-O 3.48Å; P963-V973 WeakPolarHBondContact CB-O 3.5Å; F964-V973 HydrophobicContact CD1-CG2 3.91Å; F964-V973 HydrophobicContact CD2-CG2 3.76Å; F964-V973 HydrophobicContact CE1-CG2 3.58Å; F964-V973 HydrophobicContact CE2-CG2 3.43Å; F964-V973 VanDerWaalsContact CE2-CG2 3.43Å; F964-V973 HydrophobicContact CG-CG2 4Å; F964-V973 HydrophobicContact CZ-CG2 3.34Å; F964-V973 PolarHBondContact N-O 3.42Å; F964-V973 VanDerWaalsContact O-CG2 3.31Å; F964-V973 WeakPolarHBondContact O-CG2 3.45Å; F964-V973 PolarHBondContact O-N 3.47Å; K969-V973 HydrophobicContact CD-CG1 3.83Å; Q971-V973 HydrophobicContact CG-CG1 4.36Å; V973-V992 CarbonylContact C-O 3.58Å; V973-V992 VanDerWaalsContact CA-O 3.3Å; V973-V992 WeakPolarHBondContact CA-O 3.48Å
974	C	92.3	Very high	89.1	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	160.4	175.8	67.8	0	0	0	0	110.2	P957 P963 E991 V992 H994	P957-C974 HydrophobicContact CB-CB 4.18Å; P963-C974 HydrophobicContact CB-CB 4.08Å; P963-C974 HydrophobicContact CG-CB 3.83Å; C974-E991 WeakPolarHBondContact O-CA 3.28Å; C974-V992 PolarHBondContact N-O 3.04Å; C974-V992 PolarHBondContact O-N 2.83Å; C974-H994 HydrophobicContact CB-CB 4.23Å
975	H	92.1	Very high	88.9	Confident	33 Å²	33	45.6 Å²	45.6	15%	0.153	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	137.3	174.4	-73.2	68.8	0	0	0	109.9	L958 P961 F964 Q990 E991	L958-H975 HydrophobicContact CB-CB 4.45Å; L958-H975 VanDerWaalsContact CB-O 3.29Å; L958-H975 WeakPolarHBondContact CB-O 3.33Å; L958-H975 HydrophobicContact CD1-CB 4.18Å; L958-H975 WeakPolarHBondContact CG-O 3.45Å; L958-H975 PolarHBondContact N-O 3.27Å; P961-H975 HydrophobicContact CG-CB 4.01Å; P961-H975 VanDerWaalsContact CG-CE1 3.47Å; P961-H975 WeakPolarHBondContact CG-CE1 3.22Å; P961-H975 VanDerWaalsContact CG-CG 3.43Å; P961-H975 VanDerWaalsContact CG-ND1 3.28Å; P961-H975 WeakPolarHBondContact CG-ND1 3.35Å; F964-H975 AromaticContact CE1-CE1 3.86Å; H975-Q990 WeakPolarHBondContact CA-O 3.48Å; H975-E991 IonicContact CE1-OE1 3.85Å; H975-E991 IonicContact NE2-OE1 3.37Å
976	V	90.2	Very high	88.7	Confident	4 Å²	4	49.2 Å²	49.2	2%	0.024	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	145.5	174.7	-67.9	0	0	0	0	110.6	M954 R989 Q990 V992	M954-V976 HydrophobicContact SD-CG2 4.06Å; V976-R989 WeakPolarHBondContact O-CA 3.08Å; V976-Q990 HydrophobicContact CG2-CB 4.44Å; V976-Q990 PolarHBondContact N-O 3.1Å; V976-Q990 PolarHBondContact O-N 3.09Å; V976-Q990 VanDerWaalsContact O-N 3.13Å; V976-V992 HydrophobicContact CB-CG2 4.19Å; V976-V992 HydrophobicContact CG1-CG2 3.55Å; V976-V992 HydrophobicContact CG2-CB 4.26Å; V976-V992 HydrophobicContact CG2-CG1 3.67Å; V976-V992 HydrophobicContact CG2-CG2 3.55Å
977	D	90.2	Very high	88.5	Confident	77 Å²	77	49.3 Å²	49.3	41%	0.412	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	133.7	164.6	-70.1	-32.3	0	0	0	108.7	G955 R989	G955-D977 PolarHBondContact N-O 3.09Å; D977-R989 WeakPolarHBondContact OD1-CG 3.37Å; D977-R989 IonicContact OD1-NE 3.73Å; D977-R989 PolarHBondContact OD1-NE 3.22Å
978	C	88.7	Confident	88.4	Confident	2 Å²	2	45 Å²	45	1%	0.014	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	143.5	-178.2	-56.6	0	0	0	0	109.8	V945 M954 L987	V945-C978 HydrophobicContact CG2-CB 4.05Å; M954-C978 HydrophobicContact SD-CB 4.22Å; M954-C978 PolarHBondContact SD-SG 2.86Å; C978-L987 HydrophobicContact CB-CB 3.97Å; C978-L987 HydrophobicContact CB-CD1 4.41Å; C978-L987 PolarHBondContact O-N 3.27Å
979	T	90.7	Very high	88.3	Confident	38 Å²	38	45.9 Å²	45.9	23%	0.233	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	156.3	169.8	68.8	0	0	0	0	111.3	C952 S953 A984 W985	C952-T979 CarbonylContact C-O 3.15Å; C952-T979 VanDerWaalsContact CA-O 3.27Å; C952-T979 WeakPolarHBondContact CA-O 3.5Å; S953-T979 PolarHBondContact N-O 3.26Å; S953-T979 PolarHBondContact O-N 3.18Å; S953-T979 PolarHBondContact OG-OG1 3.42Å; T979-A984 HydrophobicContact CG2-CB 4.39Å; T979-W985 CarbonylContact C-O 3.52Å; T979-W985 VanDerWaalsContact CA-O 3.23Å; T979-W985 WeakPolarHBondContact CA-O 3.19Å
980	Y	89.8	Confident	88.2	Confident	0 Å²	0	44 Å²	44	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	136	-175.6	-180	-90.6	0	0	0	113.1	C871 V874 A897 W918 L944 A948 C951 A984 W985	C871-Y980 PolarHBondContact O-OH 2.66Å; V874-Y980 HydrophobicContact CB-CE1 3.71Å; V874-Y980 WeakPolarHBondContact CB-OH 3.31Å; V874-Y980 HydrophobicContact CG1-CE1 3.83Å; V874-Y980 HydrophobicContact CG2-CE1 4.27Å; V874-Y980 WeakPolarHBondContact CG2-OH 3.25Å; A897-Y980 HydrophobicContact CB-CE1 4.05Å; W918-Y980 HydrophobicContact CZ3-CD1 4.26Å; L944-Y980 HydrophobicContact CB-CD2 4.14Å; L944-Y980 HydrophobicContact CD1-CD2 4.32Å; L944-Y980 HydrophobicContact CD1-CG 4.23Å; L944-Y980 HydrophobicContact CD2-CD2 4.08Å; L944-Y980 HydrophobicContact CD2-CE2 3.73Å; L944-Y980 HydrophobicContact CG-CD2 4.42Å; A948-Y980 HydrophobicContact CB-CE2 4.08Å; C951-Y980 HydrophobicContact CB-CD2 4.2Å; C951-Y980 HydrophobicContact CB-CE2 3.58Å; Y980-A984 PolarHBondContact O-N 2.96Å; Y980-W985 AromaticContact CD1-CE3 3.77Å; Y980-W985 HydrophobicContact CD1-CE3 3.77Å; Y980-W985 HydrophobicContact CD1-CZ3 4.06Å; Y980-W985 HydrophobicContact CE1-CE3 4.3Å; Y980-W985 HydrophobicContact CE1-CZ3 4.13Å; Y980-W985 PolarHBondContact N-O 3.03Å; Y980-W985 PolarHBondContact O-N 3.27Å
981	G	82.2	Confident	88.1	Confident	27 Å²	27	46.3 Å²	46.3	28%	0.278	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.2	-177.4	174.6	0	0	0	0	0	114	C951 A983 A984	C951-G981 PolarHBondContact O-N 3.14Å; G981-A983 PolarHBondContact O-N 3Å; G981-A984 PolarHBondContact O-N 3.05Å; G981-A984 VanDerWaalsContact O-N 3.11Å
982	L	77.1	Confident	87.7	Confident	159 Å²	159	45 Å²	45	83%	0.832	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-28.3	179.9	-67.3	174.5	0	0	0	112.9	A984	L982-A984 PolarHBondContact O-N 2.85Å
983	A	78.3	Confident	87.5	Confident	56 Å²	56	47.2 Å²	47.2	46%	0.463	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-0.6	176.3	0	0	0	0	0	113.5	G981 W985	G981-A983 PolarHBondContact O-N 3Å; A983-W985 VanDerWaalsContact C-N 3.27Å; A983-W985 HydrophobicContact CB-CD2 4.32Å; A983-W985 HydrophobicContact CB-CG 4.39Å; A983-W985 HydrophobicContact CB-CZ2 4.12Å; A983-W985 PolarHBondContact O-N 3.39Å
984	A	84.4	Confident	87.3	Confident	51 Å²	51	47.9 Å²	47.9	42%	0.421	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	47	47	-179.5	0	0	0	0	0	112.8	T979 Y980 G981 L982	T979-A984 HydrophobicContact CG2-CB 4.39Å; Y980-A984 PolarHBondContact O-N 2.96Å; G981-A984 PolarHBondContact O-N 3.05Å; G981-A984 VanDerWaalsContact O-N 3.11Å; L982-A984 PolarHBondContact O-N 2.85Å
985	W	88.4	Confident	87.1	Confident	13 Å²	13	51 Å²	51	5%	0.049	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63	130.2	179.8	-64.6	-34.5	0	0	0	109.9	V874 R876 R895 A897 W918 T979 Y980 A983 L987	V874-W985 HydrophobicContact CG1-CZ3 4.39Å; R876-W985 HydrophobicContact CB-CD2 4.07Å; R876-W985 HydrophobicContact CB-CE3 4.01Å; R876-W985 HydrophobicContact CB-CH2 4Å; R876-W985 HydrophobicContact CB-CZ2 4.04Å; R876-W985 HydrophobicContact CB-CZ3 3.98Å; R895-W985 HydrophobicContact CB-CZ2 3.84Å; R895-W985 WeakPolarHBondContact O-CH2 3.3Å; R895-W985 WeakPolarHBondContact O-CZ2 3.14Å; A897-W985 HydrophobicContact CB-CH2 4.47Å; A897-W985 HydrophobicContact CB-CZ3 4.38Å; W918-W985 HydrophobicContact CE3-CE3 4.44Å; W918-W985 HydrophobicContact CH2-CB 3.76Å; W918-W985 HydrophobicContact CH2-CD2 4.17Å; W918-W985 AromaticContact CH2-CE3 3.67Å; W918-W985 HydrophobicContact CH2-CE3 3.67Å; W918-W985 HydrophobicContact CH2-CG 4.25Å; W918-W985 HydrophobicContact CZ2-CB 4.49Å; W918-W985 HydrophobicContact CZ3-CD2 4.32Å; W918-W985 AromaticContact CZ3-CE3 3.41Å; W918-W985 HydrophobicContact CZ3-CE3 3.41Å; W918-W985 VanDerWaalsContact CZ3-CE3 3.41Å; W918-W985 AromaticContact CZ3-CZ3 3.95Å; W918-W985 HydrophobicContact CZ3-CZ3 3.95Å; T979-W985 CarbonylContact C-O 3.52Å; T979-W985 VanDerWaalsContact CA-O 3.23Å; T979-W985 WeakPolarHBondContact CA-O 3.19Å; Y980-W985 AromaticContact CD1-CE3 3.77Å; Y980-W985 HydrophobicContact CD1-CE3 3.77Å; Y980-W985 HydrophobicContact CD1-CZ3 4.06Å; Y980-W985 HydrophobicContact CE1-CE3 4.3Å; Y980-W985 HydrophobicContact CE1-CZ3 4.13Å; Y980-W985 PolarHBondContact N-O 3.03Å; Y980-W985 PolarHBondContact O-N 3.27Å; A983-W985 VanDerWaalsContact C-N 3.27Å; A983-W985 HydrophobicContact CB-CD2 4.32Å; A983-W985 HydrophobicContact CB-CG 4.39Å; A983-W985 HydrophobicContact CB-CZ2 4.12Å; A983-W985 PolarHBondContact O-N 3.39Å; W985-L987 PolarHBondContact O-N 3.3Å
986	P	88.8	Confident	86.8	Confident	93 Å²	93	54.2 Å²	54.2	60%	0.604	32%	0.317	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.8	134.8	-179.1	27.7	-34.2	0	0	0	110.1
987	L	88	Confident	86.8	Confident	15 Å²	15	57.2 Å²	57.2	8%	0.079	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	162.1	174.7	-65.4	-172.9	0	0	0	110.7	W918 L944 V945 C978 W985	W918-L987 HydrophobicContact CH2-CD2 3.94Å; W918-L987 HydrophobicContact CZ2-CD2 4.26Å; L944-L987 HydrophobicContact CB-CD1 3.86Å; L944-L987 HydrophobicContact CB-CD2 4.36Å; L944-L987 HydrophobicContact CD1-CD1 4.5Å; L944-L987 HydrophobicContact CD1-CD2 3.59Å; V945-L987 HydrophobicContact CG2-CB 4.35Å; V945-L987 HydrophobicContact CG2-CD1 3.47Å; V945-L987 VanDerWaalsContact CG2-CD1 3.47Å; C978-L987 HydrophobicContact CB-CB 3.97Å; C978-L987 HydrophobicContact CB-CD1 4.41Å; C978-L987 PolarHBondContact O-N 3.27Å; W985-L987 PolarHBondContact O-N 3.3Å
988	P	85.9	Confident	86.7	Confident	49 Å²	49	58.3 Å²	58.3	32%	0.318	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55	143.1	171.8	-23.9	34.2	0	0	0	111.6	E942	E942-P988 HydrophobicContact CG-CG 4.22Å
989	R	87.7	Confident	86.7	Confident	153 Å²	153	61.1 Å²	61.1	58%	0.577	35%	0.351	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-55.8	141.7	176.9	-70.6	178.1	178.7	160.1	1.2	111	L958 V976 D977	L958-R989 HydrophobicContact CD1-CG 4.41Å; V976-R989 WeakPolarHBondContact O-CA 3.08Å; D977-R989 WeakPolarHBondContact OD1-CG 3.37Å; D977-R989 IonicContact OD1-NE 3.73Å; D977-R989 PolarHBondContact OD1-NE 3.22Å
990	Q	85.9	Confident	86.8	Confident	52 Å²	52	59.6 Å²	59.6	24%	0.243	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	143.8	-177.3	-66.7	-66.5	-43.9	0	0	112.2	V945 H975 V976 V992	V945-Q990 HydrophobicContact CB-CG 3.93Å; V945-Q990 HydrophobicContact CG1-CG 3.8Å; V945-Q990 HydrophobicContact CG2-CG 3.77Å; H975-Q990 WeakPolarHBondContact CA-O 3.48Å; V976-Q990 HydrophobicContact CG2-CB 4.44Å; V976-Q990 PolarHBondContact N-O 3.1Å; V976-Q990 PolarHBondContact O-N 3.09Å; V976-Q990 VanDerWaalsContact O-N 3.13Å; Q990-V992 HydrophobicContact CB-CG1 4.34Å; Q990-V992 PolarHBondContact O-N 3.4Å
991	E	88.7	Confident	87	Confident	88 Å²	88	60.6 Å²	60.6	41%	0.411	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	103.3	170.8	-67.4	-173.5	174.8	0	0	110.5	K969 C974 H975	K969-E991 PolarHBondContact NZ-O 2.85Å; C974-E991 WeakPolarHBondContact O-CA 3.28Å; H975-E991 IonicContact CE1-OE1 3.85Å; H975-E991 IonicContact NE2-OE1 3.37Å
992	V	86.1	Confident	87.4	Confident	35 Å²	35	60.7 Å²	60.7	21%	0.212	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	158.3	178.8	-60.1	0	0	0	0	110.9	M954 V973 C974 V976 Q990 H994	M954-V992 HydrophobicContact CE-CG1 4.41Å; V973-V992 CarbonylContact C-O 3.58Å; V973-V992 VanDerWaalsContact CA-O 3.3Å; V973-V992 WeakPolarHBondContact CA-O 3.48Å; C974-V992 PolarHBondContact N-O 3.04Å; C974-V992 PolarHBondContact O-N 2.83Å; V976-V992 HydrophobicContact CB-CG2 4.19Å; V976-V992 HydrophobicContact CG1-CG2 3.55Å; V976-V992 HydrophobicContact CG2-CB 4.26Å; V976-V992 HydrophobicContact CG2-CG1 3.67Å; V976-V992 HydrophobicContact CG2-CG2 3.55Å; Q990-V992 HydrophobicContact CB-CG1 4.34Å; Q990-V992 PolarHBondContact O-N 3.4Å; V992-H994 PolarHBondContact O-N 2.74Å
993	A	88.5	Confident	88.2	Confident	46 Å²	46	54.9 Å²	54.9	38%	0.38	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.8	133.4	169.8	0	0	0	0	0	109.7
994	H	89.2	Confident	88.9	Confident	14 Å²	14	52.2 Å²	52.2	7%	0.065	28%	0.282	C	S	.	.	P	Polyproline II helix	trans	-64.9	135.6	175.6	-171.6	-68.8	0	0	0	109	I972 C974 V992 V996 D997 Y1000	I972-H994 HydrophobicContact CB-CB 4.32Å; I972-H994 HydrophobicContact CG2-CB 3.87Å; I972-H994 PolarHBondContact O-N 2.86Å; C974-H994 HydrophobicContact CB-CB 4.23Å; V992-H994 PolarHBondContact O-N 2.74Å; H994-V996 PolarHBondContact O-N 3.12Å; H994-D997 IonicContact CE1-OD1 3.99Å; H994-D997 PolarHBondContact CE1-OD1 2.76Å; H994-D997 IonicContact CE1-OD2 2.81Å; H994-D997 IonicContact ND1-OD1 2.79Å; H994-Y1000 HydrophobicContact CB-CD2 3.9Å; H994-Y1000 HydrophobicContact CB-CE2 4.38Å; H994-Y1000 WeakPolarHBondContact O-CD2 3.46Å
995	P	87.7	Confident	89.4	Confident	67 Å²	67	49.8 Å²	49.8	44%	0.435	26%	0.262	S	S	.	.	P	Polyproline II helix	trans	-52.5	137.2	174.8	-25.7	33.7	0	0	0	111.2	P957 D997	P957-P995 HydrophobicContact CG-CG 4.03Å; P995-D997 VanDerWaalsContact C-N 3.33Å; P995-D997 PolarHBondContact O-N 2.86Å
996	V	86.9	Confident	89.6	Confident	99 Å²	99	49.5 Å²	49.5	60%	0.6	26%	0.262	S	S	*	.	S	Bend	trans	-73.6	90.3	179.4	-174.7	0	0	0	0	109	H994 Y1001 T1055	H994-V996 PolarHBondContact O-N 3.12Å; V996-Y1001 HydrophobicContact CG1-CE2 4.2Å; V996-T1055 HydrophobicContact CG1-CG2 4.27Å
997	D	88.9	Confident	89.8	Confident	68 Å²	68	45.9 Å²	45.9	36%	0.364	24%	0.237	S	C	.	.	S	Bend	trans	-131.6	-176.3	175.2	68.5	6.7	0	0	0	110.1	H994 P995 M999 Y1000 Y1001	H994-D997 IonicContact CE1-OD1 3.99Å; H994-D997 PolarHBondContact CE1-OD1 2.76Å; H994-D997 IonicContact CE1-OD2 2.81Å; H994-D997 IonicContact ND1-OD1 2.79Å; P995-D997 VanDerWaalsContact C-N 3.33Å; P995-D997 PolarHBondContact O-N 2.86Å; D997-M999 PolarHBondContact O-N 3.31Å; D997-M999 VanDerWaalsContact O-N 3.17Å; D997-M999 VanDerWaalsContact OD1-CA 3.31Å; D997-M999 WeakPolarHBondContact OD1-CA 3.24Å; D997-M999 VanDerWaalsContact OD1-CB 3.25Å; D997-M999 WeakPolarHBondContact OD1-CB 3.32Å; D997-M999 PolarHBondContact OD1-N 3.33Å; D997-Y1000 VanDerWaalsContact O-CB 3.23Å; D997-Y1000 WeakPolarHBondContact O-CB 3.45Å; D997-Y1000 PolarHBondContact O-N 2.85Å; D997-Y1000 VanDerWaalsContact O-N 3.09Å; D997-Y1000 PolarHBondContact OD1-N 2.85Å; D997-Y1001 WeakPolarHBondContact O-CD2 3.38Å; D997-Y1001 PolarHBondContact O-N 3.06Å
998	I	89.2	Confident	90.1	Very high	100 Å²	100	45.2 Å²	45.2	51%	0.513	23%	0.234	S	C	.	.	H	α-helix	trans	-59.7	-29	178.2	-64.4	168.8	0	0	0	111.8	R1002	I998-R1002 WeakPolarHBondContact O-CG 3.4Å; I998-R1002 PolarHBondContact O-N 3.45Å
999	M	89.3	Confident	90.4	Very high	60 Å²	60	42.9 Å²	42.9	30%	0.296	22%	0.218	S	C	.	.	H	α-helix	trans	-71	-37.4	177.7	-66.5	-61.7	-61.3	0	0	111.2	D997 Y1001 R1002 Y1003 F1032	D997-M999 PolarHBondContact O-N 3.31Å; D997-M999 VanDerWaalsContact O-N 3.17Å; D997-M999 VanDerWaalsContact OD1-CA 3.31Å; D997-M999 WeakPolarHBondContact OD1-CA 3.24Å; D997-M999 VanDerWaalsContact OD1-CB 3.25Å; D997-M999 WeakPolarHBondContact OD1-CB 3.32Å; D997-M999 PolarHBondContact OD1-N 3.33Å; M999-Y1001 VanDerWaalsContact C-N 3.33Å; M999-Y1001 PolarHBondContact O-N 3.15Å; M999-R1002 WeakPolarHBondContact O-CB 3.35Å; M999-R1002 PolarHBondContact O-N 3.14Å; M999-R1002 VanDerWaalsContact O-N 3.08Å; M999-Y1003 HydrophobicContact CB-CD2 4.49Å; M999-Y1003 HydrophobicContact CB-CE2 4.35Å; M999-Y1003 HydrophobicContact CE-CE2 3.93Å; M999-Y1003 WeakPolarHBondContact O-CD2 3.35Å; M999-Y1003 PolarHBondContact O-N 3.36Å; M999-F1032 HydrophobicContact CE-CD1 4.02Å
1000	Y	92.3	Very high	90.5	Very high	7 Å²	7	37.2 Å²	37.2	3%	0.027	20%	0.199	C	C	.	.	H	α-helix	trans	-50.4	-52.7	171.4	-172.6	-80.4	0	0	0	111.4	Q971 I972 H994 D997 R1002 Y1003 F1004 T1055	Q971-Y1000 WeakPolarHBondContact CB-OH 3.36Å; I972-Y1000 HydrophobicContact CB-CD2 4.04Å; I972-Y1000 HydrophobicContact CB-CE2 3.65Å; I972-Y1000 HydrophobicContact CG1-CE1 4.26Å; I972-Y1000 HydrophobicContact CG1-CE2 4.18Å; I972-Y1000 PolarHBondContact N-OH 3.32Å; H994-Y1000 HydrophobicContact CB-CD2 3.9Å; H994-Y1000 HydrophobicContact CB-CE2 4.38Å; H994-Y1000 WeakPolarHBondContact O-CD2 3.46Å; D997-Y1000 VanDerWaalsContact O-CB 3.23Å; D997-Y1000 WeakPolarHBondContact O-CB 3.45Å; D997-Y1000 PolarHBondContact O-N 2.85Å; D997-Y1000 VanDerWaalsContact O-N 3.09Å; D997-Y1000 PolarHBondContact OD1-N 2.85Å; Y1000-R1002 VanDerWaalsContact C-N 3.29Å; Y1000-R1002 PolarHBondContact O-N 3.16Å; Y1000-Y1003 PolarHBondContact O-N 2.98Å; Y1000-F1004 HydrophobicContact CE1-CB 4.37Å; Y1000-F1004 WeakPolarHBondContact O-CB 3.41Å; Y1000-F1004 PolarHBondContact O-N 3.38Å; Y1000-T1055 HydrophobicContact CD1-CG2 4.28Å; Y1000-T1055 HydrophobicContact CE1-CG2 3.86Å; Y1000-T1055 PolarHBondContact OH-O 2.83Å
1001	Y	92.9	Very high	90.8	Very high	20 Å²	20	35 Å²	35	8%	0.078	19%	0.19	C	C	.	.	H	α-helix	trans	-64.4	-32.2	180	-65.1	-78.8	0	0	0	112.8	V996 D997 M999 A1005 L1049 V1050 V1054 T1055	V996-Y1001 HydrophobicContact CG1-CE2 4.2Å; D997-Y1001 WeakPolarHBondContact O-CD2 3.38Å; D997-Y1001 PolarHBondContact O-N 3.06Å; M999-Y1001 VanDerWaalsContact C-N 3.33Å; M999-Y1001 PolarHBondContact O-N 3.15Å; Y1001-A1005 WeakPolarHBondContact O-CB 3.44Å; Y1001-A1005 PolarHBondContact O-N 3.15Å; Y1001-L1049 HydrophobicContact CD1-CB 4.1Å; Y1001-V1050 HydrophobicContact CD1-CG2 4.01Å; Y1001-V1050 HydrophobicContact CD2-CG2 3.63Å; Y1001-V1050 HydrophobicContact CE1-CG2 4.36Å; Y1001-V1050 HydrophobicContact CE2-CG2 4.02Å; Y1001-V1050 HydrophobicContact CG-CG2 3.63Å; Y1001-V1054 WeakPolarHBondContact CE1-O 3.32Å; Y1001-T1055 HydrophobicContact CE1-CG2 4.08Å
1002	R	92.3	Very high	90.8	Very high	29 Å²	29	37 Å²	37	11%	0.109	19%	0.193	C	C	.	.	H	α-helix	trans	-67.1	-43.7	174	-72.2	171	171.1	-168.1	-8.8	112.2	I998 M999 Y1000 S1006 L1031 F1032 L1046	I998-R1002 WeakPolarHBondContact O-CG 3.4Å; I998-R1002 PolarHBondContact O-N 3.45Å; M999-R1002 WeakPolarHBondContact O-CB 3.35Å; M999-R1002 PolarHBondContact O-N 3.14Å; M999-R1002 VanDerWaalsContact O-N 3.08Å; Y1000-R1002 VanDerWaalsContact C-N 3.29Å; Y1000-R1002 PolarHBondContact O-N 3.16Å; R1002-S1006 WeakPolarHBondContact O-CB 3.4Å; R1002-S1006 PolarHBondContact O-N 2.84Å; R1002-L1031 WeakPolarHBondContact CD-O 3.48Å; R1002-L1031 PolarHBondContact NE-O 3.03Å; R1002-F1032 HydrophobicContact CB-CD1 4.24Å; R1002-F1032 HydrophobicContact CB-CE1 3.93Å; R1002-L1046 HydrophobicContact CG-CD1 4Å; R1002-L1046 HydrophobicContact CG-CD2 4.07Å
1003	Y	92.7	Very high	91.1	Very high	38 Å²	38	35.4 Å²	35.4	15%	0.149	18%	0.184	C	C	.	.	H	α-helix	trans	-64.4	-46.7	174	-75.3	-70.5	0	0	0	111.1	P963 I972 M999 Y1000 A1005 S1006 E1007 F1032	P963-Y1003 HydrophobicContact CB-CD1 3.87Å; P963-Y1003 HydrophobicContact CB-CD2 3.9Å; P963-Y1003 HydrophobicContact CB-CE1 3.9Å; P963-Y1003 HydrophobicContact CB-CE2 3.95Å; P963-Y1003 HydrophobicContact CB-CG 3.9Å; P963-Y1003 VanDerWaalsContact CD-CZ 3.49Å; P963-Y1003 WeakPolarHBondContact CD-OH 3.42Å; P963-Y1003 HydrophobicContact CG-CD1 4.4Å; P963-Y1003 HydrophobicContact CG-CD2 4.07Å; P963-Y1003 HydrophobicContact CG-CE1 3.96Å; P963-Y1003 HydrophobicContact CG-CE2 3.61Å; P963-Y1003 HydrophobicContact CG-CG 4.48Å; P963-Y1003 WeakPolarHBondContact O-CD1 3.49Å; I972-Y1003 HydrophobicContact CG2-CG 4.36Å; M999-Y1003 HydrophobicContact CB-CD2 4.49Å; M999-Y1003 HydrophobicContact CB-CE2 4.35Å; M999-Y1003 HydrophobicContact CE-CE2 3.93Å; M999-Y1003 WeakPolarHBondContact O-CD2 3.35Å; M999-Y1003 PolarHBondContact O-N 3.36Å; Y1000-Y1003 PolarHBondContact O-N 2.98Å; Y1003-A1005 PolarHBondContact O-N 3.28Å; Y1003-S1006 WeakPolarHBondContact O-CB 3.25Å; Y1003-S1006 PolarHBondContact O-N 3.36Å; Y1003-S1006 VanDerWaalsContact O-N 3.15Å; Y1003-E1007 WeakPolarHBondContact O-CG 3.49Å; Y1003-E1007 PolarHBondContact O-N 3Å; Y1003-F1032 AromaticContact CD1-CE1 3.44Å; Y1003-F1032 HydrophobicContact CD1-CE1 3.44Å; Y1003-F1032 VanDerWaalsContact CD1-CE1 3.44Å; Y1003-F1032 AromaticContact CD1-CZ 3.37Å; Y1003-F1032 HydrophobicContact CD1-CZ 3.37Å; Y1003-F1032 HydrophobicContact CD2-CE1 4.03Å; Y1003-F1032 HydrophobicContact CE1-CD1 4.24Å; Y1003-F1032 AromaticContact CE1-CE1 3.38Å; Y1003-F1032 HydrophobicContact CE1-CE1 3.38Å; Y1003-F1032 HydrophobicContact CE1-CE2 4.48Å; Y1003-F1032 AromaticContact CE1-CZ 3.53Å; Y1003-F1032 HydrophobicContact CE1-CZ 3.53Å; Y1003-F1032 AromaticContact CE2-CE1 3.96Å; Y1003-F1032 HydrophobicContact CE2-CE1 3.96Å; Y1003-F1032 AromaticContact CG-CE1 3.74Å; Y1003-F1032 HydrophobicContact CG-CE1 3.74Å; Y1003-F1032 AromaticContact CG-CZ 4Å; Y1003-F1032 HydrophobicContact CG-CZ 4Å; Y1003-F1032 AromaticContact CZ-CE1 3.63Å
1004	F	94.1	Very high	91.2	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-59.1	-47	176.9	-170.8	-97.1	0	0	0	112.6	Y965 I972 Y1000 S1006 E1007 F1008 V1013 L1049 V1054 L1060	Y965-F1004 HydrophobicContact CE2-CE2 4.33Å; I972-F1004 HydrophobicContact CD1-CB 4.31Å; I972-F1004 HydrophobicContact CD1-CD2 4.4Å; I972-F1004 HydrophobicContact CG1-CB 3.99Å; I972-F1004 HydrophobicContact CG1-CD2 4.3Å; Y1000-F1004 HydrophobicContact CE1-CB 4.37Å; Y1000-F1004 WeakPolarHBondContact O-CB 3.41Å; Y1000-F1004 PolarHBondContact O-N 3.38Å; F1004-S1006 VanDerWaalsContact C-N 3.32Å; F1004-S1006 PolarHBondContact O-N 2.88Å; F1004-E1007 PolarHBondContact O-N 2.89Å; F1004-F1008 WeakPolarHBondContact O-CB 3.22Å; F1004-F1008 PolarHBondContact O-N 3.38Å; F1004-V1013 HydrophobicContact CD2-CG2 4.4Å; F1004-V1013 HydrophobicContact CE2-CG1 3.99Å; F1004-V1013 HydrophobicContact CE2-CG2 4.11Å; F1004-V1013 HydrophobicContact CZ-CG1 3.93Å; F1004-V1013 HydrophobicContact CZ-CG2 4.49Å; F1004-L1049 HydrophobicContact CD1-CD1 4.33Å; F1004-L1049 HydrophobicContact CD1-CD2 4.21Å; F1004-L1049 HydrophobicContact CE1-CD2 4.1Å; F1004-V1054 HydrophobicContact CE1-CG1 4.04Å; F1004-V1054 HydrophobicContact CZ-CG1 4.41Å; F1004-L1060 HydrophobicContact CE1-CD1 3.95Å; F1004-L1060 HydrophobicContact CE1-CG 4.37Å; F1004-L1060 HydrophobicContact CZ-CD1 3.71Å; F1004-L1060 HydrophobicContact CZ-CG 4.23Å
1005	A	93.1	Very high	91.2	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-61.5	-39.6	175.2	0	0	0	0	0	112.1	Y1001 Y1003 L1009 L1031 L1045 L1046 L1049	Y1001-A1005 WeakPolarHBondContact O-CB 3.44Å; Y1001-A1005 PolarHBondContact O-N 3.15Å; Y1003-A1005 PolarHBondContact O-N 3.28Å; A1005-L1009 WeakPolarHBondContact O-CB 3.46Å; A1005-L1009 VanDerWaalsContact O-CG 3.22Å; A1005-L1009 WeakPolarHBondContact O-CG 3.21Å; A1005-L1009 PolarHBondContact O-N 3.26Å; A1005-L1031 HydrophobicContact CB-CD1 3.77Å; A1005-L1045 HydrophobicContact CB-CD2 4.06Å; A1005-L1045 HydrophobicContact CB-CG 4.36Å; A1005-L1046 HydrophobicContact CB-CD2 3.84Å; A1005-L1049 HydrophobicContact CB-CD1 3.72Å
1006	S	93.1	Very high	91.2	Very high	7 Å²	7	36.3 Å²	36.3	5%	0.049	18%	0.18	C	C	.	.	H	α-helix	trans	-63.2	-49.6	177.1	-171.6	0	0	0	0	111.4	R1002 Y1003 F1004 F1008 L1009 E1010 P1028	R1002-S1006 WeakPolarHBondContact O-CB 3.4Å; R1002-S1006 PolarHBondContact O-N 2.84Å; Y1003-S1006 WeakPolarHBondContact O-CB 3.25Å; Y1003-S1006 PolarHBondContact O-N 3.36Å; Y1003-S1006 VanDerWaalsContact O-N 3.15Å; F1004-S1006 VanDerWaalsContact C-N 3.32Å; F1004-S1006 PolarHBondContact O-N 2.88Å; S1006-F1008 VanDerWaalsContact C-N 3.32Å; S1006-F1008 PolarHBondContact O-N 2.6Å; S1006-L1009 PolarHBondContact O-N 3.34Å; S1006-E1010 WeakPolarHBondContact O-CG 3.35Å; S1006-E1010 PolarHBondContact O-N 3.34Å; S1006-P1028 WeakPolarHBondContact OG-CB 3.47Å
1007	E	93.2	Very high	91.4	Very high	17 Å²	17	31.7 Å²	31.7	8%	0.079	15%	0.152	C	C	.	.	H	α-helix	trans	-68	-32	-180	-67	-65.8	169.4	0	0	112.6	I972 Y1003 F1004 G1011 R1012 V1013	I972-E1007 HydrophobicContact CD1-CB 4.47Å; I972-E1007 HydrophobicContact CD1-CG 4.11Å; Y1003-E1007 WeakPolarHBondContact O-CG 3.49Å; Y1003-E1007 PolarHBondContact O-N 3Å; F1004-E1007 PolarHBondContact O-N 2.89Å; E1007-G1011 PolarHBondContact O-N 3.37Å; E1007-R1012 PolarHBondContact O-N 3.05Å; E1007-R1012 IonicContact OE1-NE 3.9Å; E1007-R1012 WeakPolarHBondContact OE2-CB 3.48Å; E1007-R1012 WeakPolarHBondContact OE2-CD 3.5Å; E1007-R1012 WeakPolarHBondContact OE2-CG 3.44Å; E1007-R1012 IonicContact OE2-CZ 2.79Å; E1007-R1012 IonicContact OE2-NE 3.91Å; E1007-R1012 PolarHBondContact OE2-NE 3.43Å; E1007-V1013 HydrophobicContact CB-CG2 3.98Å; E1007-V1013 PolarHBondContact O-N 2.62Å
1008	F	93.7	Very high	91.4	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-64.6	-48.8	172	174.2	-105.2	0	0	0	111.5	F1004 S1006 E1010 G1011 V1013 I1014 L1017 L1060 W1064 Y1075 W1091	F1004-F1008 WeakPolarHBondContact O-CB 3.22Å; F1004-F1008 PolarHBondContact O-N 3.38Å; S1006-F1008 VanDerWaalsContact C-N 3.32Å; S1006-F1008 PolarHBondContact O-N 2.6Å; F1008-E1010 VanDerWaalsContact C-N 3.31Å; F1008-E1010 PolarHBondContact O-N 2.92Å; F1008-G1011 PolarHBondContact O-N 3.02Å; F1008-V1013 HydrophobicContact CB-CB 4.46Å; F1008-V1013 HydrophobicContact CB-CG2 4.17Å; F1008-V1013 HydrophobicContact CD2-CB 4.44Å; F1008-I1014 HydrophobicContact CE2-CG1 4.38Å; F1008-L1017 HydrophobicContact CD2-CD1 4.29Å; F1008-L1017 HydrophobicContact CE1-CD1 4.48Å; F1008-L1017 HydrophobicContact CE2-CD1 3.64Å; F1008-L1017 HydrophobicContact CZ-CD1 3.75Å; F1008-L1060 HydrophobicContact CD2-CD1 3.84Å; F1008-L1060 HydrophobicContact CE2-CD1 3.93Å; F1008-W1064 HydrophobicContact CE2-CH2 4.11Å; F1008-W1064 HydrophobicContact CE2-CZ2 4.29Å; F1008-W1064 HydrophobicContact CZ-CZ2 4.39Å; F1008-Y1075 HydrophobicContact CD1-CD2 4.43Å; F1008-Y1075 AromaticContact CE1-CD2 3.71Å; F1008-Y1075 HydrophobicContact CE1-CD2 3.71Å; F1008-Y1075 HydrophobicContact CE1-CE2 4.38Å; F1008-Y1075 HydrophobicContact CZ-CD2 4.27Å; F1008-W1091 HydrophobicContact CZ-CH2 4.1Å
1009	L	93	Very high	91.5	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-64.2	-34.9	177.3	-71.3	170.3	0	0	0	112.5	A1005 S1006 G1011 L1024 P1028 L1031 L1045 Y1075 W1078	A1005-L1009 WeakPolarHBondContact O-CB 3.46Å; A1005-L1009 VanDerWaalsContact O-CG 3.22Å; A1005-L1009 WeakPolarHBondContact O-CG 3.21Å; A1005-L1009 PolarHBondContact O-N 3.26Å; S1006-L1009 PolarHBondContact O-N 3.34Å; L1009-G1011 PolarHBondContact O-N 3.48Å; L1009-L1024 HydrophobicContact CD2-CD2 4.43Å; L1009-P1028 HydrophobicContact CB-CB 4.21Å; L1009-P1028 HydrophobicContact CB-CG 3.75Å; L1009-P1028 HydrophobicContact CD1-CB 4.25Å; L1009-P1028 HydrophobicContact CD1-CG 4.33Å; L1009-L1031 HydrophobicContact CD1-CD1 4.09Å; L1009-L1045 HydrophobicContact CD1-CD2 3.85Å; L1009-L1045 HydrophobicContact CD2-CD2 4.1Å; L1009-L1045 HydrophobicContact CG-CD2 4.01Å; L1009-Y1075 HydrophobicContact CD2-CD2 3.87Å; L1009-Y1075 HydrophobicContact CD2-CE2 4.01Å; L1009-W1078 HydrophobicContact CD1-CD2 3.58Å; L1009-W1078 HydrophobicContact CD1-CE3 3.59Å; L1009-W1078 HydrophobicContact CD1-CG 4.2Å; L1009-W1078 HydrophobicContact CD1-CH2 3.87Å; L1009-W1078 HydrophobicContact CD1-CZ2 3.89Å; L1009-W1078 HydrophobicContact CD1-CZ3 3.74Å; L1009-W1078 HydrophobicContact CD2-CB 3.83Å; L1009-W1078 HydrophobicContact CD2-CD2 3.95Å; L1009-W1078 HydrophobicContact CD2-CE3 4.46Å; L1009-W1078 HydrophobicContact CD2-CG 3.65Å; L1009-W1078 HydrophobicContact CG-CD2 4.44Å
1010	E	90.8	Very high	91.5	Very high	35 Å²	35	28.9 Å²	28.9	16%	0.164	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-9.8	175.1	-69.5	-173.6	161.1	0	0	113.5	S1006 F1008 R1012 P1028	S1006-E1010 WeakPolarHBondContact O-CG 3.35Å; S1006-E1010 PolarHBondContact O-N 3.34Å; F1008-E1010 VanDerWaalsContact C-N 3.31Å; F1008-E1010 PolarHBondContact O-N 2.92Å; E1010-R1012 HydrophobicContact CB-CG 4.41Å; E1010-R1012 IonicContact OE2-CZ 3.47Å; E1010-R1012 VanDerWaalsContact OE2-CZ 3.29Å; E1010-R1012 IonicContact OE2-NE 3.96Å; E1010-R1012 PolarHBondContact OE2-NE 2.9Å; E1010-R1012 VanDerWaalsContact OE2-NE 3.16Å; E1010-R1012 IonicContact OE2-NH2 3.08Å; E1010-R1012 PolarHBondContact OE2-NH2 3.29Å; E1010-P1028 HydrophobicContact CG-CB 4.23Å; E1010-P1028 HydrophobicContact CG-CG 3.81Å
1011	G	90.5	Very high	91.4	Very high	5 Å²	5	35.2 Å²	35.2	5%	0.052	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.5	21.7	179.5	0	0	0	0	0	114.3	E1007 F1008 L1009 I1014	E1007-G1011 PolarHBondContact O-N 3.37Å; F1008-G1011 PolarHBondContact O-N 3.02Å; L1009-G1011 PolarHBondContact O-N 3.48Å; G1011-I1014 CarbonylContact C-O 3.58Å; G1011-I1014 CarbonylContact O-C 3.46Å; G1011-I1014 VanDerWaalsContact O-O 3.05Å
1012	R	90.2	Very high	91.2	Very high	130 Å²	130	39.6 Å²	39.6	49%	0.491	20%	0.198	S	C	.	.	S	Bend	trans	-85.6	-28.6	176.4	-59.5	-161.6	-131.4	-129.1	2.1	113.3	E1007 E1010	E1007-R1012 PolarHBondContact O-N 3.05Å; E1007-R1012 IonicContact OE1-NE 3.9Å; E1007-R1012 WeakPolarHBondContact OE2-CB 3.48Å; E1007-R1012 WeakPolarHBondContact OE2-CD 3.5Å; E1007-R1012 WeakPolarHBondContact OE2-CG 3.44Å; E1007-R1012 IonicContact OE2-CZ 2.79Å; E1007-R1012 IonicContact OE2-NE 3.91Å; E1007-R1012 PolarHBondContact OE2-NE 3.43Å; E1010-R1012 HydrophobicContact CB-CG 4.41Å; E1010-R1012 IonicContact OE2-CZ 3.47Å; E1010-R1012 VanDerWaalsContact OE2-CZ 3.29Å; E1010-R1012 IonicContact OE2-NE 3.96Å; E1010-R1012 PolarHBondContact OE2-NE 2.9Å; E1010-R1012 VanDerWaalsContact OE2-NE 3.16Å; E1010-R1012 IonicContact OE2-NH2 3.08Å; E1010-R1012 PolarHBondContact OE2-NH2 3.29Å
1013	V	91.4	Very high	91.1	Very high	1 Å²	1	39.4 Å²	39.4	1%	0.006	20%	0.201	C	C	.	.	S	Bend	trans	-73.2	-41	172.8	-176.6	0	0	0	0	110.6	Y965 F1004 E1007 F1008 K1057 L1060	Y965-V1013 HydrophobicContact CD1-CG2 4.17Å; Y965-V1013 HydrophobicContact CD2-CG2 3.9Å; Y965-V1013 HydrophobicContact CE1-CB 4.4Å; Y965-V1013 HydrophobicContact CE1-CG2 4.35Å; Y965-V1013 HydrophobicContact CE2-CG1 4.21Å; Y965-V1013 HydrophobicContact CE2-CG2 4.08Å; Y965-V1013 HydrophobicContact CG-CG2 3.93Å; F1004-V1013 HydrophobicContact CD2-CG2 4.4Å; F1004-V1013 HydrophobicContact CE2-CG1 3.99Å; F1004-V1013 HydrophobicContact CE2-CG2 4.11Å; F1004-V1013 HydrophobicContact CZ-CG1 3.93Å; F1004-V1013 HydrophobicContact CZ-CG2 4.49Å; E1007-V1013 HydrophobicContact CB-CG2 3.98Å; E1007-V1013 PolarHBondContact O-N 2.62Å; F1008-V1013 HydrophobicContact CB-CB 4.46Å; F1008-V1013 HydrophobicContact CB-CG2 4.17Å; F1008-V1013 HydrophobicContact CD2-CB 4.44Å; V1013-K1057 HydrophobicContact CG1-CB 3.95Å; V1013-K1057 WeakPolarHBondContact O-CD 3.44Å; V1013-L1060 HydrophobicContact CG1-CD1 3.93Å
1014	I	91.2	Very high	90.9	Very high	3 Å²	3	38.9 Å²	38.9	2%	0.015	20%	0.2	C	C	.	.	S	Bend	trans	-129.2	108.5	179.7	-58.5	-70	0	0	0	108.9	F1008 G1011 K1016 L1017 K1057 W1064 P1093	F1008-I1014 HydrophobicContact CE2-CG1 4.38Å; G1011-I1014 CarbonylContact C-O 3.58Å; G1011-I1014 CarbonylContact O-C 3.46Å; G1011-I1014 VanDerWaalsContact O-O 3.05Å; I1014-K1016 HydrophobicContact CG2-CB 4.25Å; I1014-K1016 PolarHBondContact O-N 3.02Å; I1014-L1017 HydrophobicContact CB-CD1 4.19Å; I1014-L1017 HydrophobicContact CB-CG 4.27Å; I1014-L1017 HydrophobicContact CG2-CD1 4.44Å; I1014-L1017 HydrophobicContact CG2-CG 4.13Å; I1014-L1017 PolarHBondContact O-N 3.12Å; I1014-K1057 HydrophobicContact CD1-CD 4.27Å; I1014-K1057 HydrophobicContact CD1-CG 3.71Å; I1014-W1064 HydrophobicContact CD1-CH2 4.24Å; I1014-W1064 HydrophobicContact CD1-CZ3 3.81Å; I1014-W1064 HydrophobicContact CG1-CH2 3.95Å; I1014-W1064 HydrophobicContact CG1-CZ3 4.05Å; I1014-P1093 HydrophobicContact CG2-CB 3.91Å; I1014-P1093 HydrophobicContact CG2-CG 3.97Å; I1014-P1093 VanDerWaalsContact CG2-O 3.22Å; I1014-P1093 WeakPolarHBondContact CG2-O 3.41Å
1015	S	88.3	Confident	90.7	Very high	66 Å²	66	43.6 Å²	43.6	46%	0.462	23%	0.225	S	C	.	.	G	3₁₀ helix	trans	-59	-33.6	-172.7	69	0	0	0	0	113.4	L1017 A1018 E1095	S1015-L1017 PolarHBondContact O-N 3.36Å; S1015-A1018 WeakPolarHBondContact O-CB 3.25Å; S1015-A1018 PolarHBondContact O-N 3.4Å; S1015-E1095 WeakPolarHBondContact CB-OE1 3.27Å; S1015-E1095 PolarHBondContact OG-OE1 3.14Å
1016	K	87.9	Confident	90.5	Very high	77 Å²	77	45 Å²	45	34%	0.335	23%	0.233	S	C	.	.	G	3₁₀ helix	trans	-59.9	-27.4	176.9	-83.9	-170.3	170.2	-173.6	0	113.8	I1014 A1018 K1019 P1093 L1094	I1014-K1016 HydrophobicContact CG2-CB 4.25Å; I1014-K1016 PolarHBondContact O-N 3.02Å; K1016-A1018 VanDerWaalsContact C-N 3.33Å; K1016-K1019 WeakPolarHBondContact O-CG 3.49Å; K1016-P1093 HydrophobicContact CB-CB 4.04Å; K1016-L1094 WeakPolarHBondContact CD-O 3.5Å; K1016-L1094 WeakPolarHBondContact CE-O 3.44Å; K1016-L1094 PolarHBondContact NZ-O 2.97Å
1017	L	90.6	Very high	90.3	Very high	2 Å²	2	48.6 Å²	48.6	1%	0.01	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-80.8	-16.2	178.4	-63.8	-179.2	0	0	0	112.4	F1008 I1014 S1015 K1019 Y1020 Y1075 W1091 P1093	F1008-L1017 HydrophobicContact CD2-CD1 4.29Å; F1008-L1017 HydrophobicContact CE1-CD1 4.48Å; F1008-L1017 HydrophobicContact CE2-CD1 3.64Å; F1008-L1017 HydrophobicContact CZ-CD1 3.75Å; I1014-L1017 HydrophobicContact CB-CD1 4.19Å; I1014-L1017 HydrophobicContact CB-CG 4.27Å; I1014-L1017 HydrophobicContact CG2-CD1 4.44Å; I1014-L1017 HydrophobicContact CG2-CG 4.13Å; I1014-L1017 PolarHBondContact O-N 3.12Å; S1015-L1017 PolarHBondContact O-N 3.36Å; L1017-K1019 PolarHBondContact O-N 3.29Å; L1017-K1019 VanDerWaalsContact O-N 3.09Å; L1017-Y1020 HydrophobicContact CD2-CD2 4.29Å; L1017-Y1020 WeakPolarHBondContact O-CB 3.19Å; L1017-Y1020 PolarHBondContact O-N 2.96Å; L1017-Y1075 HydrophobicContact CD1-CD2 4.48Å; L1017-Y1075 HydrophobicContact CD1-CE2 3.99Å; L1017-Y1075 HydrophobicContact CD2-CE1 4.03Å; L1017-Y1075 HydrophobicContact CD2-CE2 4.49Å; L1017-W1091 HydrophobicContact CD1-CZ3 4.46Å; L1017-W1091 HydrophobicContact CD2-CZ3 4.11Å; L1017-P1093 HydrophobicContact CD1-CG 4.14Å; L1017-P1093 HydrophobicContact CD2-CB 3.81Å; L1017-P1093 HydrophobicContact CD2-CG 3.93Å; L1017-P1093 HydrophobicContact CG-CB 4.04Å; L1017-P1093 HydrophobicContact CG-CG 4.02Å
1018	A	90	Very high	90.2	Very high	47 Å²	47	48.1 Å²	48.1	39%	0.388	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	-58.7	-27.5	-178.9	0	0	0	0	0	113.3	S1015 K1016 Y1020 R1021	S1015-A1018 WeakPolarHBondContact O-CB 3.25Å; S1015-A1018 PolarHBondContact O-N 3.4Å; K1016-A1018 VanDerWaalsContact C-N 3.33Å; A1018-Y1020 PolarHBondContact O-N 3.27Å; A1018-R1021 VanDerWaalsContact O-CB 3.25Å; A1018-R1021 WeakPolarHBondContact O-CB 3.24Å; A1018-R1021 PolarHBondContact O-N 2.86Å
1019	K	90.1	Very high	89.9	Confident	114 Å²	114	51.2 Å²	51.2	50%	0.496	28%	0.277	S	S	.	.	G	3₁₀ helix	trans	-63.6	-22.8	175.6	68.9	-178.7	167.4	173	0	113.9	K1016 L1017 D1090	K1016-K1019 WeakPolarHBondContact O-CG 3.49Å; L1017-K1019 PolarHBondContact O-N 3.29Å; L1017-K1019 VanDerWaalsContact O-N 3.09Å; K1019-D1090 WeakPolarHBondContact CE-OD2 3.39Å; K1019-D1090 IonicContact NZ-OD1 3.74Å; K1019-D1090 PolarHBondContact NZ-OD1 2.9Å; K1019-D1090 IonicContact NZ-OD2 3.37Å; K1019-D1090 PolarHBondContact NZ-OD2 3.18Å
1020	Y	90.8	Very high	89.8	Confident	8 Å²	8	52.4 Å²	52.4	3%	0.031	28%	0.282	C	S	.	.	G	3₁₀ helix	trans	-92.3	-4	-179.4	-62.8	-62.2	0	0	0	113.5	L1017 A1018 S1022 S1023 L1024 Y1075 D1086 V1087 D1090	L1017-Y1020 HydrophobicContact CD2-CD2 4.29Å; L1017-Y1020 WeakPolarHBondContact O-CB 3.19Å; L1017-Y1020 PolarHBondContact O-N 2.96Å; A1018-Y1020 PolarHBondContact O-N 3.27Å; Y1020-S1022 VanDerWaalsContact C-N 3.28Å; Y1020-S1022 PolarHBondContact O-N 3.49Å; Y1020-S1023 WeakPolarHBondContact O-CA 3.45Å; Y1020-S1023 WeakPolarHBondContact O-CB 3.26Å; Y1020-S1023 PolarHBondContact O-N 2.93Å; Y1020-L1024 PolarHBondContact O-N 3.2Å; Y1020-Y1075 WeakPolarHBondContact CB-OH 3.32Å; Y1020-D1086 HydrophobicContact CE1-CB 3.98Å; Y1020-D1086 WeakPolarHBondContact OH-CB 3.34Å; Y1020-D1086 PolarHBondContact OH-O 2.82Å; Y1020-D1086 VanDerWaalsContact OH-O 3.09Å; Y1020-V1087 HydrophobicContact CD1-CG2 3.74Å; Y1020-V1087 HydrophobicContact CD2-CG2 3.95Å; Y1020-V1087 HydrophobicContact CE1-CG2 3.59Å; Y1020-V1087 HydrophobicContact CE2-CG2 3.79Å; Y1020-V1087 HydrophobicContact CG-CG2 3.93Å; Y1020-V1087 PolarHBondContact OH-N 3.05Å; Y1020-D1090 PolarHBondContact OH-OD2 2.99Å
1021	R	89.1	Confident	89.7	Confident	140 Å²	140	50.7 Å²	50.7	53%	0.528	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-54.4	-40.4	-177.8	-177.9	-178.7	176.3	-165	0.4	113.3	A1018 S1023	A1018-R1021 VanDerWaalsContact O-CB 3.25Å; A1018-R1021 WeakPolarHBondContact O-CB 3.24Å; A1018-R1021 PolarHBondContact O-N 2.86Å; R1021-S1023 PolarHBondContact O-N 3.01Å
1022	S	88.7	Confident	89.6	Confident	113 Å²	113	53.7 Å²	53.7	79%	0.79	29%	0.286	S	S	*	.	G	3₁₀ helix	trans	-73.2	-14.8	177.9	59.2	0	0	0	0	113.6	Y1020	Y1020-S1022 VanDerWaalsContact C-N 3.28Å; Y1020-S1022 PolarHBondContact O-N 3.49Å
1023	S	89.7	Confident	89.4	Confident	25 Å²	25	52.1 Å²	52.1	18%	0.175	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-100.5	5.2	-177	-54.5	0	0	0	0	113.1	Y1020 R1021 I1025 A1080	Y1020-S1023 WeakPolarHBondContact O-CA 3.45Å; Y1020-S1023 WeakPolarHBondContact O-CB 3.26Å; Y1020-S1023 PolarHBondContact O-N 2.93Å; R1021-S1023 PolarHBondContact O-N 3.01Å; S1023-I1025 PolarHBondContact O-N 3.19Å; S1023-A1080 PolarHBondContact O-N 3.21Å
1024	L	90.2	Very high	89	Confident	26 Å²	26	57.1 Å²	57.1	14%	0.136	32%	0.316	C	S	.	.	B	Isolated β-bridge	trans	-69.5	126.8	175.9	-69	168.4	0	0	0	110.4	L1009 Y1020 T1026 P1028 W1078 V1079	L1009-L1024 HydrophobicContact CD2-CD2 4.43Å; Y1020-L1024 PolarHBondContact O-N 3.2Å; L1024-T1026 PolarHBondContact O-N 3Å; L1024-P1028 HydrophobicContact CD1-CG 3.82Å; L1024-W1078 CarbonylContact C-O 3.52Å; L1024-W1078 VanDerWaalsContact CA-O 3.31Å; L1024-W1078 WeakPolarHBondContact CA-O 3.45Å; L1024-W1078 HydrophobicContact CD2-CB 3.9Å; L1024-V1079 HydrophobicContact CD2-CG2 4.26Å
1025	I	89.9	Confident	88.6	Confident	100 Å²	100	63.6 Å²	63.6	51%	0.513	34%	0.34	S	S	.	.	S	Bend	trans	-62.4	-30.7	179.9	-60.1	167.8	0	0	0	111	S1023 W1078 V1079 A1080	S1023-I1025 PolarHBondContact O-N 3.19Å; I1025-W1078 PolarHBondContact N-O 2.99Å; I1025-V1079 WeakPolarHBondContact CD1-O 3.45Å; I1025-A1080 HydrophobicContact CG1-CB 4.47Å
1026	T	88	Confident	88.2	Confident	29 Å²	29	60.5 Å²	60.5	18%	0.178	32%	0.318	C	S	.	.	S	Bend	trans	-142.2	138.6	-177.7	-52.2	0	0	0	0	109.3	L1024 I1030 K1041	L1024-T1026 PolarHBondContact O-N 3Å; T1026-I1030 HydrophobicContact CG2-CB 4.16Å; T1026-I1030 HydrophobicContact CG2-CD1 3.75Å; T1026-I1030 HydrophobicContact CG2-CG2 4.08Å; T1026-K1041 PolarHBondContact OG1-NZ 3.02Å
1027	P	89.8	Confident	87.6	Confident	82 Å²	82	65.8 Å²	65.8	53%	0.532	34%	0.336	S	S	.	.			trans	-61.7	136.9	178.1	24.3	-34.5	0	0	0	111.1	S1029 I1030	P1027-S1029 PolarHBondContact O-N 2.85Å; P1027-I1030 PolarHBondContact O-N 2.96Å; P1027-I1030 VanDerWaalsContact O-N 3.12Å
1028	P	90.3	Very high	87.2	Confident	8 Å²	8	72.8 Å²	72.8	5%	0.052	37%	0.373	C	S	.	.	G	3₁₀ helix	trans	-55.8	-22.5	-179.9	-31.3	40.1	0	0	0	114.8	S1006 L1009 E1010 L1024 I1030 L1031	S1006-P1028 WeakPolarHBondContact OG-CB 3.47Å; L1009-P1028 HydrophobicContact CB-CB 4.21Å; L1009-P1028 HydrophobicContact CB-CG 3.75Å; L1009-P1028 HydrophobicContact CD1-CB 4.25Å; L1009-P1028 HydrophobicContact CD1-CG 4.33Å; E1010-P1028 HydrophobicContact CG-CB 4.23Å; E1010-P1028 HydrophobicContact CG-CG 3.81Å; L1024-P1028 HydrophobicContact CD1-CG 3.82Å; P1028-I1030 PolarHBondContact O-N 2.84Å; P1028-L1031 WeakPolarHBondContact O-CB 3.33Å; P1028-L1031 WeakPolarHBondContact O-CG 3.48Å; P1028-L1031 PolarHBondContact O-N 3.26Å
1029	S	87.9	Confident	86.9	Confident	65 Å²	65	74.4 Å²	74.4	46%	0.455	37%	0.373	S	S	.	.	G	3₁₀ helix	trans	-50.4	-20.5	172	67.6	0	0	0	0	115.3	P1027 L1031 F1032	P1027-S1029 PolarHBondContact O-N 2.85Å; S1029-L1031 PolarHBondContact O-N 3.31Å; S1029-F1032 PolarHBondContact O-N 3.29Å
1030	I	89.2	Confident	86.6	Confident	24 Å²	24	73.7 Å²	73.7	12%	0.123	38%	0.382	C	S	.	.	G	3₁₀ helix	trans	-61.8	-27.6	175.1	-160.5	165.9	0	0	0	112.6	T1026 P1027 P1028 F1032 K1033 A1036 T1042 W1078	T1026-I1030 HydrophobicContact CG2-CB 4.16Å; T1026-I1030 HydrophobicContact CG2-CD1 3.75Å; T1026-I1030 HydrophobicContact CG2-CG2 4.08Å; P1027-I1030 PolarHBondContact O-N 2.96Å; P1027-I1030 VanDerWaalsContact O-N 3.12Å; P1028-I1030 PolarHBondContact O-N 2.84Å; I1030-F1032 PolarHBondContact O-N 3.09Å; I1030-F1032 VanDerWaalsContact O-N 3.08Å; I1030-K1033 WeakPolarHBondContact O-CB 3.43Å; I1030-K1033 PolarHBondContact O-N 3.36Å; I1030-A1036 WeakPolarHBondContact O-CB 3.47Å; I1030-T1042 HydrophobicContact CG2-CG2 4.3Å; I1030-W1078 HydrophobicContact CG2-CH2 3.56Å; I1030-W1078 HydrophobicContact CG2-CZ3 3.75Å
1031	L	89	Confident	86.5	Confident	0 Å²	0	74.5 Å²	74.5	0%	0	39%	0.385	C	S	.	.	G	3₁₀ helix	trans	-58.5	-23.5	180	-71.1	167.4	0	0	0	113.2	R1002 A1005 L1009 P1028 S1029 T1042 L1046 W1078	R1002-L1031 WeakPolarHBondContact CD-O 3.48Å; R1002-L1031 PolarHBondContact NE-O 3.03Å; A1005-L1031 HydrophobicContact CB-CD1 3.77Å; L1009-L1031 HydrophobicContact CD1-CD1 4.09Å; P1028-L1031 WeakPolarHBondContact O-CB 3.33Å; P1028-L1031 WeakPolarHBondContact O-CG 3.48Å; P1028-L1031 PolarHBondContact O-N 3.26Å; S1029-L1031 PolarHBondContact O-N 3.31Å; L1031-T1042 HydrophobicContact CD2-CG2 4.1Å; L1031-L1046 HydrophobicContact CD2-CD1 4.06Å; L1031-L1046 HydrophobicContact CD2-CD2 4.46Å; L1031-L1046 HydrophobicContact CD2-CG 4.2Å; L1031-W1078 HydrophobicContact CD1-CH2 4.49Å; L1031-W1078 HydrophobicContact CD2-CH2 3.99Å; L1031-W1078 HydrophobicContact CD2-CZ2 4.01Å; L1031-W1078 HydrophobicContact CG-CH2 3.97Å; L1031-W1078 HydrophobicContact CG-CZ2 4.45Å
1032	F	88.4	Confident	86.5	Confident	67 Å²	67	67.9 Å²	67.9	29%	0.294	36%	0.361	S	S	.	.	G	3₁₀ helix	trans	-92.9	-7.2	179.8	-52.5	-71.1	0	0	0	113.6	M999 R1002 Y1003 S1029 I1030	M999-F1032 HydrophobicContact CE-CD1 4.02Å; R1002-F1032 HydrophobicContact CB-CD1 4.24Å; R1002-F1032 HydrophobicContact CB-CE1 3.93Å; Y1003-F1032 AromaticContact CD1-CE1 3.44Å; Y1003-F1032 HydrophobicContact CD1-CE1 3.44Å; Y1003-F1032 VanDerWaalsContact CD1-CE1 3.44Å; Y1003-F1032 AromaticContact CD1-CZ 3.37Å; Y1003-F1032 HydrophobicContact CD1-CZ 3.37Å; Y1003-F1032 HydrophobicContact CD2-CE1 4.03Å; Y1003-F1032 HydrophobicContact CE1-CD1 4.24Å; Y1003-F1032 AromaticContact CE1-CE1 3.38Å; Y1003-F1032 HydrophobicContact CE1-CE1 3.38Å; Y1003-F1032 HydrophobicContact CE1-CE2 4.48Å; Y1003-F1032 AromaticContact CE1-CZ 3.53Å; Y1003-F1032 HydrophobicContact CE1-CZ 3.53Å; Y1003-F1032 AromaticContact CE2-CE1 3.96Å; Y1003-F1032 HydrophobicContact CE2-CE1 3.96Å; Y1003-F1032 AromaticContact CG-CE1 3.74Å; Y1003-F1032 HydrophobicContact CG-CE1 3.74Å; Y1003-F1032 AromaticContact CG-CZ 4Å; Y1003-F1032 HydrophobicContact CG-CZ 4Å; Y1003-F1032 AromaticContact CZ-CE1 3.63Å; S1029-F1032 PolarHBondContact O-N 3.29Å; I1030-F1032 PolarHBondContact O-N 3.09Å; I1030-F1032 VanDerWaalsContact O-N 3.08Å
1033	K	87.3	Confident	86.4	Confident	97 Å²	97	64.4 Å²	64.4	42%	0.422	34%	0.343	S	S	.	.	S	Bend	trans	-80.2	144.8	-179.4	-60.9	-62.6	-174.1	-177.8	0	111.3	I1030 W1035 A1036	I1030-K1033 WeakPolarHBondContact O-CB 3.43Å; I1030-K1033 PolarHBondContact O-N 3.36Å; K1033-W1035 VanDerWaalsContact C-N 3.27Å; K1033-W1035 HydrophobicContact CB-CD2 3.9Å; K1033-W1035 HydrophobicContact CB-CE3 4.2Å; K1033-W1035 HydrophobicContact CB-CH2 4.05Å; K1033-W1035 HydrophobicContact CB-CZ2 3.71Å; K1033-W1035 HydrophobicContact CB-CZ3 4.27Å; K1033-W1035 HydrophobicContact CD-CH2 3.75Å; K1033-W1035 HydrophobicContact CD-CZ2 3.87Å; K1033-W1035 HydrophobicContact CD-CZ3 4.42Å; K1033-W1035 HydrophobicContact CG-CH2 4.02Å; K1033-W1035 HydrophobicContact CG-CZ2 3.64Å; K1033-W1035 PolarHBondContact O-N 2.95Å; K1033-A1036 WeakPolarHBondContact O-CB 3.22Å; K1033-A1036 PolarHBondContact O-N 3.45Å
1034	P	82.1	Confident	86.4	Confident	107 Å²	107	65.1 Å²	65.1	70%	0.695	35%	0.348	S	S	*	.	G	3₁₀ helix	trans	-56.7	-37.2	-179.8	-26.7	34.5	0	0	0	114.2	A1036	P1034-A1036 VanDerWaalsContact C-N 3.28Å; P1034-A1036 PolarHBondContact O-N 2.74Å
1035	W	83.7	Confident	86.5	Confident	139 Å²	139	63.9 Å²	63.9	53%	0.527	34%	0.341	S	S	.	.	G	3₁₀ helix	trans	-81.6	1.3	-179.9	61.7	85.7	0	0	0	114.2	K1033 R1037 L1038	K1033-W1035 VanDerWaalsContact C-N 3.27Å; K1033-W1035 HydrophobicContact CB-CD2 3.9Å; K1033-W1035 HydrophobicContact CB-CE3 4.2Å; K1033-W1035 HydrophobicContact CB-CH2 4.05Å; K1033-W1035 HydrophobicContact CB-CZ2 3.71Å; K1033-W1035 HydrophobicContact CB-CZ3 4.27Å; K1033-W1035 HydrophobicContact CD-CH2 3.75Å; K1033-W1035 HydrophobicContact CD-CZ2 3.87Å; K1033-W1035 HydrophobicContact CD-CZ3 4.42Å; K1033-W1035 HydrophobicContact CG-CH2 4.02Å; K1033-W1035 HydrophobicContact CG-CZ2 3.64Å; K1033-W1035 PolarHBondContact O-N 2.95Å; W1035-R1037 PolarHBondContact O-N 2.98Å; W1035-L1038 HydrophobicContact CB-CD1 4.18Å; W1035-L1038 WeakPolarHBondContact O-CB 2.98Å; W1035-L1038 PolarHBondContact O-N 3.34Å
1036	A	79.1	Confident	86.6	Confident	1 Å²	1	60.2 Å²	60.2	1%	0.008	32%	0.323	C	S	.	.	G	3₁₀ helix	trans	-52.2	-42.1	176.3	0	0	0	0	0	110.8	I1030 K1033 P1034 L1038 Q1039 T1042	I1030-A1036 WeakPolarHBondContact O-CB 3.47Å; K1033-A1036 WeakPolarHBondContact O-CB 3.22Å; K1033-A1036 PolarHBondContact O-N 3.45Å; P1034-A1036 VanDerWaalsContact C-N 3.28Å; P1034-A1036 PolarHBondContact O-N 2.74Å; A1036-L1038 PolarHBondContact O-N 2.95Å; A1036-Q1039 WeakPolarHBondContact O-CB 3.5Å; A1036-Q1039 PolarHBondContact O-N 3.48Å; A1036-T1042 VanDerWaalsContact C-OG1 3.3Å; A1036-T1042 HydrophobicContact CB-CG2 4.35Å; A1036-T1042 PolarHBondContact O-OG1 3.47Å
1037	R	75.6	Confident	86.7	Confident	187 Å²	187	60.7 Å²	60.7	71%	0.706	33%	0.333	S	S	*	.	G	3₁₀ helix	trans	-55.5	-21	179	-66	-176.4	176.1	173.7	-0.3	114.9	W1035	W1035-R1037 PolarHBondContact O-N 2.98Å
1038	L	81.5	Confident	86.8	Confident	150 Å²	150	58.1 Å²	58.1	79%	0.785	32%	0.316	S	S	*	.	G	3₁₀ helix	trans	-82.1	-15	176.5	-63.4	169.8	0	0	0	112.8	W1035 A1036	W1035-L1038 HydrophobicContact CB-CD1 4.18Å; W1035-L1038 WeakPolarHBondContact O-CB 2.98Å; W1035-L1038 PolarHBondContact O-N 3.34Å; A1036-L1038 PolarHBondContact O-N 2.95Å
1039	Q	83.7	Confident	86.9	Confident	81 Å²	81	57.7 Å²	57.7	38%	0.379	31%	0.313	S	S	.	.	S	Bend	trans	-90.8	114.6	178.3	-64	-73	-53.5	0	0	109.4	A1036 K1041 T1042 G1043	A1036-Q1039 WeakPolarHBondContact O-CB 3.5Å; A1036-Q1039 PolarHBondContact O-N 3.48Å; Q1039-K1041 HydrophobicContact CB-CG 4.34Å; Q1039-K1041 PolarHBondContact O-N 3.33Å; Q1039-K1041 VanDerWaalsContact O-N 3.15Å; Q1039-T1042 HydrophobicContact CB-CG2 4.01Å; Q1039-T1042 PolarHBondContact O-N 2.84Å; Q1039-T1042 PolarHBondContact O-OG1 2.93Å; Q1039-G1043 PolarHBondContact O-N 3.19Å
1040	S	85.5	Confident	87.1	Confident	99 Å²	99	57.7 Å²	57.7	69%	0.692	31%	0.31	S	S	*	.	H	α-helix	trans	-48	-44.6	179.4	53.7	0	0	0	0	112.3	T1042 G1043 S1044	S1040-T1042 VanDerWaalsContact C-N 3.32Å; S1040-T1042 PolarHBondContact O-N 3.45Å; S1040-G1043 PolarHBondContact O-N 2.78Å; S1040-G1043 VanDerWaalsContact O-N 3.1Å; S1040-S1044 WeakPolarHBondContact O-CB 3.37Å; S1040-S1044 PolarHBondContact O-N 3.43Å
1041	K	87.9	Confident	87.2	Confident	24 Å²	24	60.7 Å²	60.7	10%	0.104	33%	0.333	C	S	.	.	H	α-helix	trans	-60.7	-31.9	-179.4	66.7	-177.4	179.6	-174	0	116.3	T1026 Q1039 L1045 E1077 W1078	T1026-K1041 PolarHBondContact OG1-NZ 3.02Å; Q1039-K1041 HydrophobicContact CB-CG 4.34Å; Q1039-K1041 PolarHBondContact O-N 3.33Å; Q1039-K1041 VanDerWaalsContact O-N 3.15Å; K1041-L1045 PolarHBondContact O-N 2.94Å; K1041-E1077 WeakPolarHBondContact CA-OE2 3.33Å; K1041-E1077 HydrophobicContact CB-CB 4.04Å; K1041-E1077 WeakPolarHBondContact CB-OE2 3.31Å; K1041-W1078 HydrophobicContact CG-CZ2 4.38Å; K1041-W1078 PolarHBondContact O-NE1 2.96Å
1042	T	88.1	Confident	87.3	Confident	2 Å²	2	63.1 Å²	63.1	1%	0.012	35%	0.346	C	S	.	.	H	α-helix	trans	-79	-36.8	176.1	70.7	0	0	0	0	110.8	I1030 L1031 A1036 Q1039 S1040 L1046 W1078	I1030-T1042 HydrophobicContact CG2-CG2 4.3Å; L1031-T1042 HydrophobicContact CD2-CG2 4.1Å; A1036-T1042 VanDerWaalsContact C-OG1 3.3Å; A1036-T1042 HydrophobicContact CB-CG2 4.35Å; A1036-T1042 PolarHBondContact O-OG1 3.47Å; Q1039-T1042 HydrophobicContact CB-CG2 4.01Å; Q1039-T1042 PolarHBondContact O-N 2.84Å; Q1039-T1042 PolarHBondContact O-OG1 2.93Å; S1040-T1042 VanDerWaalsContact C-N 3.32Å; S1040-T1042 PolarHBondContact O-N 3.45Å; T1042-L1046 VanDerWaalsContact O-CB 3.28Å; T1042-L1046 WeakPolarHBondContact O-CB 3.32Å; T1042-L1046 VanDerWaalsContact O-CG 3.29Å; T1042-L1046 WeakPolarHBondContact O-CG 3.4Å; T1042-L1046 PolarHBondContact O-N 3.25Å; T1042-W1078 HydrophobicContact CG2-CH2 3.87Å; T1042-W1078 HydrophobicContact CG2-CZ2 3.76Å
1043	G	87.3	Confident	87.3	Confident	40 Å²	40	67 Å²	67	41%	0.412	37%	0.365	S	S	.	.	H	α-helix	trans	-67.6	-40	177.8	0	0	0	0	0	112.3	Q1039 S1040 G1047	Q1039-G1043 PolarHBondContact O-N 3.19Å; S1040-G1043 PolarHBondContact O-N 2.78Å; S1040-G1043 VanDerWaalsContact O-N 3.1Å; G1043-G1047 WeakPolarHBondContact O-CA 3.4Å; G1043-G1047 PolarHBondContact O-N 3.32Å
1044	S	90.4	Very high	87.5	Confident	39 Å²	39	62.4 Å²	62.4	27%	0.273	35%	0.345	S	S	.	.	H	α-helix	trans	-60.7	-56.3	176.7	-164.3	0	0	0	0	111.1	S1040 G1047 V1048	S1040-S1044 WeakPolarHBondContact O-CB 3.37Å; S1040-S1044 PolarHBondContact O-N 3.43Å; S1044-G1047 PolarHBondContact O-N 3.1Å; S1044-V1048 WeakPolarHBondContact O-CG2 3.42Å; S1044-V1048 PolarHBondContact O-N 2.72Å; S1044-V1048 VanDerWaalsContact O-N 3.14Å
1045	L	92.1	Very high	87.8	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-61.8	-50.5	179.9	179.2	60	0	0	0	113	A1005 L1009 K1041 G1047 V1048 L1049 L1071 E1074 W1078	A1005-L1045 HydrophobicContact CB-CD2 4.06Å; A1005-L1045 HydrophobicContact CB-CG 4.36Å; L1009-L1045 HydrophobicContact CD1-CD2 3.85Å; L1009-L1045 HydrophobicContact CD2-CD2 4.1Å; L1009-L1045 HydrophobicContact CG-CD2 4.01Å; K1041-L1045 PolarHBondContact O-N 2.94Å; L1045-G1047 VanDerWaalsContact C-N 3.33Å; L1045-G1047 PolarHBondContact O-N 3.42Å; L1045-V1048 PolarHBondContact O-N 2.91Å; L1045-L1049 HydrophobicContact CD1-CD1 4.17Å; L1045-L1049 HydrophobicContact CD1-CG 4.46Å; L1045-L1049 HydrophobicContact CG-CD1 4.23Å; L1045-L1049 WeakPolarHBondContact O-CG 3.49Å; L1045-L1049 PolarHBondContact O-N 2.84Å; L1045-L1049 VanDerWaalsContact O-N 3.17Å; L1045-L1071 HydrophobicContact CD1-CD2 3.71Å; L1045-E1074 HydrophobicContact CB-CB 4.41Å; L1045-E1074 HydrophobicContact CD1-CB 4.19Å; L1045-W1078 HydrophobicContact CD2-CZ2 4.43Å
1046	L	91.2	Very high	88.1	Confident	24 Å²	24	53.8 Å²	53.8	13%	0.126	31%	0.307	C	S	.	.	H	α-helix	trans	-66.6	-36.3	-179.6	-69.5	173.3	0	0	0	111.9	R1002 A1005 L1031 T1042 L1049 V1050	R1002-L1046 HydrophobicContact CG-CD1 4Å; R1002-L1046 HydrophobicContact CG-CD2 4.07Å; A1005-L1046 HydrophobicContact CB-CD2 3.84Å; L1031-L1046 HydrophobicContact CD2-CD1 4.06Å; L1031-L1046 HydrophobicContact CD2-CD2 4.46Å; L1031-L1046 HydrophobicContact CD2-CG 4.2Å; T1042-L1046 VanDerWaalsContact O-CB 3.28Å; T1042-L1046 WeakPolarHBondContact O-CB 3.32Å; T1042-L1046 VanDerWaalsContact O-CG 3.29Å; T1042-L1046 WeakPolarHBondContact O-CG 3.4Å; T1042-L1046 PolarHBondContact O-N 3.25Å; L1046-L1049 PolarHBondContact O-N 3.14Å; L1046-V1050 WeakPolarHBondContact O-CB 3.4Å; L1046-V1050 WeakPolarHBondContact O-CG2 3.31Å; L1046-V1050 PolarHBondContact O-N 3.16Å
1047	G	90.2	Very high	88.7	Confident	39 Å²	39	55.2 Å²	55.2	40%	0.402	31%	0.313	S	S	.	.	H	α-helix	trans	-60.2	-47.4	178	0	0	0	0	0	111.9	G1043 S1044 L1045 V1050 S1051	G1043-G1047 WeakPolarHBondContact O-CA 3.4Å; G1043-G1047 PolarHBondContact O-N 3.32Å; S1044-G1047 PolarHBondContact O-N 3.1Å; L1045-G1047 VanDerWaalsContact C-N 3.33Å; L1045-G1047 PolarHBondContact O-N 3.42Å; G1047-V1050 PolarHBondContact O-N 3.12Å; G1047-S1051 VanDerWaalsContact O-CB 3.28Å; G1047-S1051 WeakPolarHBondContact O-CB 3.26Å; G1047-S1051 PolarHBondContact O-N 3.02Å; G1047-S1051 PolarHBondContact O-OG 2.79Å; G1047-S1051 VanDerWaalsContact O-OG 3.09Å
1048	V	92	Very high	89.4	Confident	27 Å²	27	51.8 Å²	51.8	16%	0.164	31%	0.305	C	S	.	.	H	α-helix	trans	-66.9	-39.5	179	176.1	0	0	0	0	112.1	S1044 L1045 S1051 N1052 F1070 L1071 E1074	S1044-V1048 WeakPolarHBondContact O-CG2 3.42Å; S1044-V1048 PolarHBondContact O-N 2.72Å; S1044-V1048 VanDerWaalsContact O-N 3.14Å; L1045-V1048 PolarHBondContact O-N 2.91Å; V1048-S1051 PolarHBondContact O-OG 2.82Å; V1048-N1052 PolarHBondContact O-N 3.11Å; V1048-N1052 PolarHBondContact O-ND2 2.86Å; V1048-F1070 HydrophobicContact CG1-CD2 4.34Å; V1048-F1070 HydrophobicContact CG1-CE2 3.49Å; V1048-F1070 VanDerWaalsContact CG1-CE2 3.49Å; V1048-F1070 HydrophobicContact CG1-CZ 3.76Å; V1048-L1071 HydrophobicContact CB-CD2 4Å; V1048-L1071 HydrophobicContact CG1-CD2 3.64Å; V1048-L1071 HydrophobicContact CG1-CG 4.23Å; V1048-E1074 HydrophobicContact CG2-CG 4.04Å
1049	L	92.9	Very high	89.9	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-65	-43.8	176.8	-71.5	171.8	0	0	0	112	Y1001 F1004 A1005 L1045 L1046 E1053 V1054 L1071	Y1001-L1049 HydrophobicContact CD1-CB 4.1Å; F1004-L1049 HydrophobicContact CD1-CD1 4.33Å; F1004-L1049 HydrophobicContact CD1-CD2 4.21Å; F1004-L1049 HydrophobicContact CE1-CD2 4.1Å; A1005-L1049 HydrophobicContact CB-CD1 3.72Å; L1045-L1049 HydrophobicContact CD1-CD1 4.17Å; L1045-L1049 HydrophobicContact CD1-CG 4.46Å; L1045-L1049 HydrophobicContact CG-CD1 4.23Å; L1045-L1049 WeakPolarHBondContact O-CG 3.49Å; L1045-L1049 PolarHBondContact O-N 2.84Å; L1045-L1049 VanDerWaalsContact O-N 3.17Å; L1046-L1049 PolarHBondContact O-N 3.14Å; L1049-E1053 PolarHBondContact O-N 2.9Å; L1049-V1054 HydrophobicContact CD2-CB 3.82Å; L1049-V1054 HydrophobicContact CD2-CG1 3.91Å; L1049-V1054 PolarHBondContact O-N 2.83Å; L1049-L1071 HydrophobicContact CD2-CD1 3.82Å
1050	V	92.3	Very high	90.2	Very high	65 Å²	65	41.6 Å²	41.6	39%	0.394	26%	0.256	S	S	.	.	H	α-helix	trans	-70	-45.5	179.3	173.3	0	0	0	0	111.1	Y1001 L1046 G1047 N1052 E1053	Y1001-V1050 HydrophobicContact CD1-CG2 4.01Å; Y1001-V1050 HydrophobicContact CD2-CG2 3.63Å; Y1001-V1050 HydrophobicContact CE1-CG2 4.36Å; Y1001-V1050 HydrophobicContact CE2-CG2 4.02Å; Y1001-V1050 HydrophobicContact CG-CG2 3.63Å; L1046-V1050 WeakPolarHBondContact O-CB 3.4Å; L1046-V1050 WeakPolarHBondContact O-CG2 3.31Å; L1046-V1050 PolarHBondContact O-N 3.16Å; G1047-V1050 PolarHBondContact O-N 3.12Å; V1050-N1052 PolarHBondContact O-N 3.35Å; V1050-E1053 PolarHBondContact O-N 3.14Å; V1050-E1053 VanDerWaalsContact O-N 3.13Å
1051	S	90.9	Very high	90.5	Very high	86 Å²	86	39.1 Å²	39.1	60%	0.601	24%	0.235	S	C	*	.	H	α-helix	trans	-65.4	-25.6	-176.4	66.3	0	0	0	0	113.9	G1047 V1048	G1047-S1051 VanDerWaalsContact O-CB 3.28Å; G1047-S1051 WeakPolarHBondContact O-CB 3.26Å; G1047-S1051 PolarHBondContact O-N 3.02Å; G1047-S1051 PolarHBondContact O-OG 2.79Å; G1047-S1051 VanDerWaalsContact O-OG 3.09Å; V1048-S1051 PolarHBondContact O-OG 2.82Å
1052	N	90.7	Very high	90.6	Very high	51 Å²	51	44.9 Å²	44.9	27%	0.273	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106	8.9	178.5	-63.1	-83.1	0	0	0	112.3	V1048 V1050 V1054 F1063 F1070	V1048-N1052 PolarHBondContact O-N 3.11Å; V1048-N1052 PolarHBondContact O-ND2 2.86Å; V1050-N1052 PolarHBondContact O-N 3.35Å; N1052-V1054 HydrophobicContact CB-CG2 3.88Å; N1052-V1054 PolarHBondContact O-N 2.92Å; N1052-V1054 VanDerWaalsContact O-N 3.11Å; N1052-F1063 HydrophobicContact CB-CE1 4.24Å; N1052-F1063 HydrophobicContact CB-CE2 4.17Å; N1052-F1063 HydrophobicContact CB-CZ 3.78Å; N1052-F1070 HydrophobicContact CB-CE2 4.42Å; N1052-F1070 HydrophobicContact CB-CZ 4.2Å
1053	E	89.9	Confident	90.7	Very high	150 Å²	150	46.9 Å²	46.9	70%	0.701	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.4	36.7	-179.9	-60.1	-175.5	168.8	0	0	114.2	L1049 V1050 T1055	L1049-E1053 PolarHBondContact O-N 2.9Å; V1050-E1053 PolarHBondContact O-N 3.14Å; V1050-E1053 VanDerWaalsContact O-N 3.13Å; E1053-T1055 PolarHBondContact O-N 2.95Å
1054	V	90.8	Very high	90.9	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	25%	0.246	C	C	.	.			trans	-75.6	111.2	-177.3	-178.2	0	0	0	0	109.7	Y1001 F1004 L1049 N1052 A1059 L1060 F1063 F1070	Y1001-V1054 WeakPolarHBondContact CE1-O 3.32Å; F1004-V1054 HydrophobicContact CE1-CG1 4.04Å; F1004-V1054 HydrophobicContact CZ-CG1 4.41Å; L1049-V1054 HydrophobicContact CD2-CB 3.82Å; L1049-V1054 HydrophobicContact CD2-CG1 3.91Å; L1049-V1054 PolarHBondContact O-N 2.83Å; N1052-V1054 HydrophobicContact CB-CG2 3.88Å; N1052-V1054 PolarHBondContact O-N 2.92Å; N1052-V1054 VanDerWaalsContact O-N 3.11Å; V1054-A1059 HydrophobicContact CG1-CB 4.27Å; V1054-L1060 HydrophobicContact CG1-CD2 3.58Å; V1054-L1060 HydrophobicContact CG1-CG 3.64Å; V1054-F1063 HydrophobicContact CG2-CD2 3.73Å; V1054-F1063 HydrophobicContact CG2-CE2 3.65Å; V1054-F1070 HydrophobicContact CG2-CE1 4.02Å; V1054-F1070 HydrophobicContact CG2-CZ 3.84Å
1055	T	87.6	Confident	90.8	Very high	42 Å²	42	51.3 Å²	51.3	26%	0.258	27%	0.267	S	S	.	.			trans	-122.6	-8.5	-173.2	48.6	0	0	0	0	114.7	V996 Y1000 Y1001 E1053	V996-T1055 HydrophobicContact CG1-CG2 4.27Å; Y1000-T1055 HydrophobicContact CD1-CG2 4.28Å; Y1000-T1055 HydrophobicContact CE1-CG2 3.86Å; Y1000-T1055 PolarHBondContact OH-O 2.83Å; Y1001-T1055 HydrophobicContact CE1-CG2 4.08Å; E1053-T1055 PolarHBondContact O-N 2.95Å
1056	S	90.9	Very high	90.6	Very high	22 Å²	22	57.7 Å²	57.7	15%	0.154	30%	0.297	C	S	.	.	S	Bend	trans	-145.1	163.4	-174.8	73.2	0	0	0	0	113	D970 E1058 A1059 L1060	D970-S1056 VanDerWaalsContact O-CB 3.23Å; D970-S1056 WeakPolarHBondContact O-CB 3.33Å; D970-S1056 WeakPolarHBondContact OD2-CB 3.43Å; S1056-E1058 VanDerWaalsContact C-N 3.29Å; S1056-A1059 PolarHBondContact O-N 3.04Å; S1056-A1059 WeakPolarHBondContact OG-CB 3.2Å; S1056-A1059 PolarHBondContact OG-N 3.08Å; S1056-L1060 PolarHBondContact O-N 3.29Å; S1056-L1060 VanDerWaalsContact O-N 3.14Å
1057	K	91.4	Very high	90.6	Very high	31 Å²	31	62.1 Å²	62.1	14%	0.135	32%	0.315	C	S	.	.	H	α-helix	trans	-58.6	-41.9	169.3	179	-178	-177.6	176.4	0	110.4	Y965 D970 V1013 I1014 A1059 L1060 I1061 E1095	Y965-K1057 WeakPolarHBondContact OH-CB 3.28Å; D970-K1057 WeakPolarHBondContact OD1-CA 3.46Å; D970-K1057 WeakPolarHBondContact OD1-CB 3.4Å; D970-K1057 PolarHBondContact OD1-N 3.06Å; D970-K1057 PolarHBondContact OD2-N 3.34Å; V1013-K1057 HydrophobicContact CG1-CB 3.95Å; V1013-K1057 WeakPolarHBondContact O-CD 3.44Å; I1014-K1057 HydrophobicContact CD1-CD 4.27Å; I1014-K1057 HydrophobicContact CD1-CG 3.71Å; K1057-A1059 VanDerWaalsContact C-N 3.33Å; K1057-A1059 PolarHBondContact O-N 3.22Å; K1057-L1060 WeakPolarHBondContact O-CB 3.32Å; K1057-L1060 PolarHBondContact O-N 3.25Å; K1057-I1061 HydrophobicContact CG-CD1 3.95Å; K1057-I1061 WeakPolarHBondContact O-CG1 3.49Å; K1057-I1061 PolarHBondContact O-N 2.75Å; K1057-E1095 IonicContact NZ-OE1 3.24Å; K1057-E1095 PolarHBondContact NZ-OE1 3.35Å; K1057-E1095 IonicContact NZ-OE2 3.9Å; K1057-E1095 PolarHBondContact NZ-OE2 3.47Å
1058	E	90.6	Very high	90.5	Very high	116 Å²	116	63.4 Å²	63.4	54%	0.542	32%	0.317	S	S	.	.	H	α-helix	trans	-61.4	-41.8	177.3	-165.6	-171.9	156	0	0	112	D970 S1056 L1060 I1061 R1062	D970-E1058 WeakPolarHBondContact OD2-CB 3.32Å; D970-E1058 PolarHBondContact OD2-N 3.43Å; S1056-E1058 VanDerWaalsContact C-N 3.29Å; E1058-L1060 PolarHBondContact O-N 3.28Å; E1058-I1061 PolarHBondContact O-N 3.22Å; E1058-R1062 WeakPolarHBondContact O-CB 3.41Å; E1058-R1062 PolarHBondContact O-N 3.19Å; E1058-R1062 IonicContact OE1-NH2 3.62Å; E1058-R1062 PolarHBondContact OE1-NH2 2.86Å
1059	A	90.8	Very high	90.4	Very high	16 Å²	16	68.1 Å²	68.1	13%	0.132	34%	0.341	C	S	.	.	H	α-helix	trans	-61	-44.5	175.7	0	0	0	0	0	111.2	V1054 S1056 K1057 I1061 R1062 F1063	V1054-A1059 HydrophobicContact CG1-CB 4.27Å; S1056-A1059 PolarHBondContact O-N 3.04Å; S1056-A1059 WeakPolarHBondContact OG-CB 3.2Å; S1056-A1059 PolarHBondContact OG-N 3.08Å; K1057-A1059 VanDerWaalsContact C-N 3.33Å; K1057-A1059 PolarHBondContact O-N 3.22Å; A1059-I1061 PolarHBondContact O-N 3.07Å; A1059-R1062 WeakPolarHBondContact O-CB 3.41Å; A1059-R1062 PolarHBondContact O-N 3.46Å; A1059-F1063 WeakPolarHBondContact O-CD2 3.48Å; A1059-F1063 PolarHBondContact O-N 3.14Å
1060	L	91.3	Very high	90.3	Very high	0 Å²	0	69 Å²	69	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-58.3	-47	174.8	-75.5	171.2	0	0	0	112.3	F1004 F1008 V1013 V1054 S1056 K1057 E1058 R1062 F1063 W1064 F1070 L1071	F1004-L1060 HydrophobicContact CE1-CD1 3.95Å; F1004-L1060 HydrophobicContact CE1-CG 4.37Å; F1004-L1060 HydrophobicContact CZ-CD1 3.71Å; F1004-L1060 HydrophobicContact CZ-CG 4.23Å; F1008-L1060 HydrophobicContact CD2-CD1 3.84Å; F1008-L1060 HydrophobicContact CE2-CD1 3.93Å; V1013-L1060 HydrophobicContact CG1-CD1 3.93Å; V1054-L1060 HydrophobicContact CG1-CD2 3.58Å; V1054-L1060 HydrophobicContact CG1-CG 3.64Å; S1056-L1060 PolarHBondContact O-N 3.29Å; S1056-L1060 VanDerWaalsContact O-N 3.14Å; K1057-L1060 WeakPolarHBondContact O-CB 3.32Å; K1057-L1060 PolarHBondContact O-N 3.25Å; E1058-L1060 PolarHBondContact O-N 3.28Å; L1060-R1062 VanDerWaalsContact C-N 3.31Å; L1060-R1062 PolarHBondContact O-N 3.41Å; L1060-F1063 PolarHBondContact O-N 3.18Å; L1060-W1064 HydrophobicContact CB-CE3 4.44Å; L1060-W1064 HydrophobicContact CB-CH2 4.45Å; L1060-W1064 HydrophobicContact CB-CZ3 4.26Å; L1060-W1064 PolarHBondContact O-N 3.02Å; L1060-F1070 HydrophobicContact CD2-CE1 4.17Å; L1060-L1071 HydrophobicContact CD2-CD1 3.42Å; L1060-L1071 VanDerWaalsContact CD2-CD1 3.42Å
1061	I	90.4	Very high	90.2	Very high	48 Å²	48	66 Å²	66	25%	0.246	33%	0.327	C	S	.	.	H	α-helix	trans	-62.5	-40.2	178.9	-67.6	167.9	0	0	0	110.7	K1057 E1058 A1059 W1064 K1065 L1094	K1057-I1061 HydrophobicContact CG-CD1 3.95Å; K1057-I1061 WeakPolarHBondContact O-CG1 3.49Å; K1057-I1061 PolarHBondContact O-N 2.75Å; E1058-I1061 PolarHBondContact O-N 3.22Å; A1059-I1061 PolarHBondContact O-N 3.07Å; I1061-W1064 PolarHBondContact O-N 2.86Å; I1061-K1065 WeakPolarHBondContact O-CG 3.36Å; I1061-K1065 PolarHBondContact O-N 2.74Å; I1061-L1094 HydrophobicContact CB-CD2 4.49Å; I1061-L1094 HydrophobicContact CG1-CD2 4.12Å; I1061-L1094 HydrophobicContact CG2-CD2 4.12Å
1062	R	90.4	Very high	90.3	Very high	145 Å²	145	62.2 Å²	62.2	55%	0.547	30%	0.299	S	S	.	.	H	α-helix	trans	-61.1	-47.2	175.5	-169.3	-179.3	-64.7	157.7	2.9	111.1	E1058 A1059 L1060 W1064 K1065 E1066	E1058-R1062 WeakPolarHBondContact O-CB 3.41Å; E1058-R1062 PolarHBondContact O-N 3.19Å; E1058-R1062 IonicContact OE1-NH2 3.62Å; E1058-R1062 PolarHBondContact OE1-NH2 2.86Å; A1059-R1062 WeakPolarHBondContact O-CB 3.41Å; A1059-R1062 PolarHBondContact O-N 3.46Å; L1060-R1062 VanDerWaalsContact C-N 3.31Å; L1060-R1062 PolarHBondContact O-N 3.41Å; R1062-W1064 PolarHBondContact O-N 3.42Å; R1062-K1065 WeakPolarHBondContact O-CB 3.46Å; R1062-K1065 PolarHBondContact O-N 3.24Å; R1062-E1066 PolarHBondContact O-N 3.11Å
1063	F	91.2	Very high	90.3	Very high	44 Å²	44	65.1 Å²	65.1	19%	0.193	32%	0.315	C	S	.	.	H	α-helix	trans	-64.1	-37	176	-82.3	-69.3	0	0	0	113.1	N1052 V1054 A1059 L1060 K1065 E1066 K1067 F1070	N1052-F1063 HydrophobicContact CB-CE1 4.24Å; N1052-F1063 HydrophobicContact CB-CE2 4.17Å; N1052-F1063 HydrophobicContact CB-CZ 3.78Å; V1054-F1063 HydrophobicContact CG2-CD2 3.73Å; V1054-F1063 HydrophobicContact CG2-CE2 3.65Å; A1059-F1063 WeakPolarHBondContact O-CD2 3.48Å; A1059-F1063 PolarHBondContact O-N 3.14Å; L1060-F1063 PolarHBondContact O-N 3.18Å; F1063-K1065 VanDerWaalsContact C-N 3.32Å; F1063-K1065 PolarHBondContact O-N 2.94Å; F1063-E1066 PolarHBondContact O-N 3.33Å; F1063-K1067 CarbonylContact O-C 3.58Å; F1063-K1067 WeakPolarHBondContact O-CA 3.23Å; F1063-K1067 PolarHBondContact O-N 3.08Å; F1063-F1070 HydrophobicContact CB-CD1 3.63Å; F1063-F1070 HydrophobicContact CB-CE1 3.86Å; F1063-F1070 HydrophobicContact CB-CG 4.07Å; F1063-F1070 HydrophobicContact CB-CZ 4.49Å; F1063-F1070 HydrophobicContact CD2-CE1 4.33Å; F1063-F1070 HydrophobicContact CG-CD1 4.3Å; F1063-F1070 HydrophobicContact CG-CE1 4.09Å; F1063-F1070 HydrophobicContact CG-CZ 4.3Å
1064	W	91.9	Very high	90.4	Very high	5 Å²	5	59.6 Å²	59.6	2%	0.019	29%	0.289	C	S	.	.	H	α-helix	trans	-69.1	-27.3	175.9	-74.8	-34.9	0	0	0	114	F1008 I1014 L1060 I1061 R1062 K1067 P1068 F1070 W1091 P1092 P1093 L1094	F1008-W1064 HydrophobicContact CE2-CH2 4.11Å; F1008-W1064 HydrophobicContact CE2-CZ2 4.29Å; F1008-W1064 HydrophobicContact CZ-CZ2 4.39Å; I1014-W1064 HydrophobicContact CD1-CH2 4.24Å; I1014-W1064 HydrophobicContact CD1-CZ3 3.81Å; I1014-W1064 HydrophobicContact CG1-CH2 3.95Å; I1014-W1064 HydrophobicContact CG1-CZ3 4.05Å; L1060-W1064 HydrophobicContact CB-CE3 4.44Å; L1060-W1064 HydrophobicContact CB-CH2 4.45Å; L1060-W1064 HydrophobicContact CB-CZ3 4.26Å; L1060-W1064 PolarHBondContact O-N 3.02Å; I1061-W1064 PolarHBondContact O-N 2.86Å; R1062-W1064 PolarHBondContact O-N 3.42Å; W1064-K1067 CarbonylContact O-C 3.58Å; W1064-P1068 WeakPolarHBondContact O-CA 3.43Å; W1064-F1070 PolarHBondContact NE1-O 3.49Å; W1064-W1091 AromaticContact CE2-CZ2 3.72Å; W1064-W1091 AromaticContact CZ2-CH2 3.78Å; W1064-W1091 HydrophobicContact CZ2-CH2 3.78Å; W1064-W1091 AromaticContact CZ2-CZ2 3.53Å; W1064-W1091 HydrophobicContact CZ2-CZ2 3.53Å; W1064-W1091 AromaticContact NE1-CE2 3.72Å; W1064-W1091 AromaticContact NE1-CZ2 3.44Å; W1064-W1091 AromaticContact NE1-NE1 3.65Å; W1064-P1092 HydrophobicContact CB-CB 4.01Å; W1064-P1092 HydrophobicContact CD2-CB 4.09Å; W1064-P1092 HydrophobicContact CG-CB 3.83Å; W1064-P1093 HydrophobicContact CH2-CG 3.36Å; W1064-P1093 HydrophobicContact CZ2-CG 3.84Å; W1064-P1093 HydrophobicContact CZ3-CG 3.8Å; W1064-L1094 HydrophobicContact CE3-CD2 3.95Å
1065	K	87.9	Confident	90.5	Very high	167 Å²	167	59.6 Å²	59.6	73%	0.726	29%	0.289	S	S	*	.	H	α-helix	trans	-67	-36.9	171.5	-73.5	176.2	179.9	-179.5	0	112	I1061 R1062 F1063	I1061-K1065 WeakPolarHBondContact O-CG 3.36Å; I1061-K1065 PolarHBondContact O-N 2.74Å; R1062-K1065 WeakPolarHBondContact O-CB 3.46Å; R1062-K1065 PolarHBondContact O-N 3.24Å; F1063-K1065 VanDerWaalsContact C-N 3.32Å; F1063-K1065 PolarHBondContact O-N 2.94Å
1066	E	88.4	Confident	90.7	Very high	133 Å²	133	58.5 Å²	58.5	62%	0.621	28%	0.282	S	S	*	.	H	α-helix	trans	-82.7	-41.2	178.4	-66.2	179.5	-174	0	0	112.8	R1062 F1063	R1062-E1066 PolarHBondContact O-N 3.11Å; F1063-E1066 PolarHBondContact O-N 3.33Å
1067	K	90	Very high	90.7	Very high	118 Å²	118	61.3 Å²	61.3	51%	0.513	29%	0.292	S	S	.	.			trans	-134.6	91.5	-175.2	-67.6	177.3	-173.1	169.1	0	108.7	F1063 W1064 N1069 F1070	F1063-K1067 CarbonylContact O-C 3.58Å; F1063-K1067 WeakPolarHBondContact O-CA 3.23Å; F1063-K1067 PolarHBondContact O-N 3.08Å; W1064-K1067 CarbonylContact O-C 3.58Å; K1067-N1069 PolarHBondContact O-N 3.42Å; K1067-F1070 HydrophobicContact CB-CB 4.09Å; K1067-F1070 WeakPolarHBondContact O-CB 3.35Å; K1067-F1070 PolarHBondContact O-N 2.94Å
1068	P	88.6	Confident	90.8	Very high	66 Å²	66	59.8 Å²	59.8	43%	0.429	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-27.5	-175.2	21.2	-32.5	0	0	0	113.1	W1064 W1091 P1092	W1064-P1068 WeakPolarHBondContact O-CA 3.43Å; P1068-W1091 PolarHBondContact O-NE1 3.19Å; P1068-P1092 HydrophobicContact CB-CG 4.44Å
1069	N	88.8	Confident	90.8	Very high	125 Å²	125	54.3 Å²	54.3	67%	0.668	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.9	3.5	179.4	-62.5	-19	0	0	0	114.3	K1067 L1071 C1072	K1067-N1069 PolarHBondContact O-N 3.42Å; N1069-L1071 PolarHBondContact O-N 3.02Å; N1069-C1072 VanDerWaalsContact O-CB 3.28Å; N1069-C1072 WeakPolarHBondContact O-CB 3.25Å; N1069-C1072 PolarHBondContact O-N 3.1Å; N1069-C1072 VanDerWaalsContact O-N 3.15Å
1070	F	91.2	Very high	90.8	Very high	20 Å²	20	55 Å²	55	9%	0.088	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	132.6	178.6	179.5	-107.8	0	0	0	110.7	V1048 N1052 V1054 L1060 F1063 W1064 K1067 C1072 W1091	V1048-F1070 HydrophobicContact CG1-CD2 4.34Å; V1048-F1070 HydrophobicContact CG1-CE2 3.49Å; V1048-F1070 VanDerWaalsContact CG1-CE2 3.49Å; V1048-F1070 HydrophobicContact CG1-CZ 3.76Å; N1052-F1070 HydrophobicContact CB-CE2 4.42Å; N1052-F1070 HydrophobicContact CB-CZ 4.2Å; V1054-F1070 HydrophobicContact CG2-CE1 4.02Å; V1054-F1070 HydrophobicContact CG2-CZ 3.84Å; L1060-F1070 HydrophobicContact CD2-CE1 4.17Å; F1063-F1070 HydrophobicContact CB-CD1 3.63Å; F1063-F1070 HydrophobicContact CB-CE1 3.86Å; F1063-F1070 HydrophobicContact CB-CG 4.07Å; F1063-F1070 HydrophobicContact CB-CZ 4.49Å; F1063-F1070 HydrophobicContact CD2-CE1 4.33Å; F1063-F1070 HydrophobicContact CG-CD1 4.3Å; F1063-F1070 HydrophobicContact CG-CE1 4.09Å; F1063-F1070 HydrophobicContact CG-CZ 4.3Å; W1064-F1070 PolarHBondContact NE1-O 3.49Å; K1067-F1070 HydrophobicContact CB-CB 4.09Å; K1067-F1070 WeakPolarHBondContact O-CB 3.35Å; K1067-F1070 PolarHBondContact O-N 2.94Å; F1070-C1072 PolarHBondContact O-N 3.27Å; F1070-C1072 VanDerWaalsContact O-N 3.15Å; F1070-W1091 WeakPolarHBondContact O-CZ2 3.48Å; F1070-W1091 PolarHBondContact O-NE1 3.18Å
1071	L	91.3	Very high	90.7	Very high	2 Å²	2	62.8 Å²	62.8	1%	0.01	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	63.2	1.6	-176.1	-70.8	172.5	0	0	0	117.1	L1045 V1048 L1049 L1060 N1069 E1074 Y1075 W1091	L1045-L1071 HydrophobicContact CD1-CD2 3.71Å; V1048-L1071 HydrophobicContact CB-CD2 4Å; V1048-L1071 HydrophobicContact CG1-CD2 3.64Å; V1048-L1071 HydrophobicContact CG1-CG 4.23Å; L1049-L1071 HydrophobicContact CD2-CD1 3.82Å; L1060-L1071 HydrophobicContact CD2-CD1 3.42Å; L1060-L1071 VanDerWaalsContact CD2-CD1 3.42Å; N1069-L1071 PolarHBondContact O-N 3.02Å; L1071-E1074 VanDerWaalsContact C-OE2 3.3Å; L1071-E1074 WeakPolarHBondContact CA-OE2 3.27Å; L1071-E1074 HydrophobicContact CD2-CB 4.16Å; L1071-E1074 HydrophobicContact CD2-CG 4.35Å; L1071-Y1075 VanDerWaalsContact O-CB 3.25Å; L1071-Y1075 WeakPolarHBondContact O-CB 3.41Å; L1071-Y1075 PolarHBondContact O-N 3.09Å; L1071-W1091 HydrophobicContact CB-CH2 4.43Å; L1071-W1091 HydrophobicContact CB-CZ2 4.11Å
1072	C	91.4	Very high	90.7	Very high	5 Å²	5	65.4 Å²	65.4	3%	0.034	33%	0.325	C	S	.	.	H	α-helix	trans	-65.3	-50.1	-177.2	-170.6	0	0	0	0	111.6	N1069 F1070 E1074 Y1075 L1076 W1091	N1069-C1072 VanDerWaalsContact O-CB 3.28Å; N1069-C1072 WeakPolarHBondContact O-CB 3.25Å; N1069-C1072 PolarHBondContact O-N 3.1Å; N1069-C1072 VanDerWaalsContact O-N 3.15Å; F1070-C1072 PolarHBondContact O-N 3.27Å; F1070-C1072 VanDerWaalsContact O-N 3.15Å; C1072-E1074 PolarHBondContact O-N 2.98Å; C1072-Y1075 PolarHBondContact O-N 3.25Å; C1072-L1076 VanDerWaalsContact O-CG 3.29Å; C1072-L1076 WeakPolarHBondContact O-CG 3.49Å; C1072-L1076 PolarHBondContact O-N 3.37Å; C1072-W1091 HydrophobicContact CB-CD2 3.99Å; C1072-W1091 HydrophobicContact CB-CG 4.07Å; C1072-W1091 HydrophobicContact CB-CZ2 4.17Å
1073	N	91.5	Very high	90.7	Very high	112 Å²	112	62.2 Å²	62.2	60%	0.599	32%	0.315	S	S	*	.	H	α-helix	trans	-63.5	-44.5	-179.5	-68.5	-24.9	0	0	0	111.2	Y1075 L1076 E1077	N1073-Y1075 VanDerWaalsContact C-N 3.28Å; N1073-Y1075 PolarHBondContact O-N 3.19Å; N1073-L1076 PolarHBondContact O-N 3.28Å; N1073-E1077 PolarHBondContact O-N 2.89Å
1074	E	92.5	Very high	90.6	Very high	35 Å²	35	62.4 Å²	62.4	16%	0.164	32%	0.316	C	S	.	.	H	α-helix	trans	-62.7	-36	179.2	-64.1	75	-169	0	0	111.3	L1045 V1048 L1071 C1072	L1045-E1074 HydrophobicContact CB-CB 4.41Å; L1045-E1074 HydrophobicContact CD1-CB 4.19Å; V1048-E1074 HydrophobicContact CG2-CG 4.04Å; L1071-E1074 VanDerWaalsContact C-OE2 3.3Å; L1071-E1074 WeakPolarHBondContact CA-OE2 3.27Å; L1071-E1074 HydrophobicContact CD2-CB 4.16Å; L1071-E1074 HydrophobicContact CD2-CG 4.35Å; C1072-E1074 PolarHBondContact O-N 2.98Å
1075	Y	92.5	Very high	90.5	Very high	0 Å²	0	68.2 Å²	68.2	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-74.3	-38.1	175.7	-174.7	-97.7	0	0	0	112.5	F1008 L1009 L1017 Y1020 L1071 C1072 N1073 E1077 W1078 V1079 V1087 W1091	F1008-Y1075 HydrophobicContact CD1-CD2 4.43Å; F1008-Y1075 AromaticContact CE1-CD2 3.71Å; F1008-Y1075 HydrophobicContact CE1-CD2 3.71Å; F1008-Y1075 HydrophobicContact CE1-CE2 4.38Å; F1008-Y1075 HydrophobicContact CZ-CD2 4.27Å; L1009-Y1075 HydrophobicContact CD2-CD2 3.87Å; L1009-Y1075 HydrophobicContact CD2-CE2 4.01Å; L1017-Y1075 HydrophobicContact CD1-CD2 4.48Å; L1017-Y1075 HydrophobicContact CD1-CE2 3.99Å; L1017-Y1075 HydrophobicContact CD2-CE1 4.03Å; L1017-Y1075 HydrophobicContact CD2-CE2 4.49Å; Y1020-Y1075 WeakPolarHBondContact CB-OH 3.32Å; L1071-Y1075 VanDerWaalsContact O-CB 3.25Å; L1071-Y1075 WeakPolarHBondContact O-CB 3.41Å; L1071-Y1075 PolarHBondContact O-N 3.09Å; C1072-Y1075 PolarHBondContact O-N 3.25Å; N1073-Y1075 VanDerWaalsContact C-N 3.28Å; N1073-Y1075 PolarHBondContact O-N 3.19Å; Y1075-E1077 PolarHBondContact O-N 3.22Å; Y1075-W1078 WeakPolarHBondContact O-CB 3.48Å; Y1075-W1078 PolarHBondContact O-N 2.94Å; Y1075-V1079 HydrophobicContact CD1-CG2 4.09Å; Y1075-V1079 HydrophobicContact CE1-CG2 3.58Å; Y1075-V1087 HydrophobicContact CD1-CG1 3.73Å; Y1075-V1087 HydrophobicContact CE1-CG1 3.86Å; Y1075-V1087 HydrophobicContact CE1-CG2 4.19Å; Y1075-W1091 AromaticContact CD1-CZ3 3.92Å; Y1075-W1091 HydrophobicContact CD1-CZ3 3.92Å; Y1075-W1091 HydrophobicContact CG-CH2 4.3Å; Y1075-W1091 HydrophobicContact CG-CZ3 4.01Å
1076	L	92.1	Very high	90.5	Very high	19 Å²	19	63.5 Å²	63.5	10%	0.099	33%	0.33	C	S	.	.	H	α-helix	trans	-61.3	-30.9	177.3	-72.4	170.5	0	0	0	112.9	C1072 N1073 W1078 V1079 H1084 V1087 L1088	C1072-L1076 VanDerWaalsContact O-CG 3.29Å; C1072-L1076 WeakPolarHBondContact O-CG 3.49Å; C1072-L1076 PolarHBondContact O-N 3.37Å; N1073-L1076 PolarHBondContact O-N 3.28Å; L1076-W1078 PolarHBondContact O-N 3.02Å; L1076-W1078 VanDerWaalsContact O-N 3.14Å; L1076-V1079 PolarHBondContact O-N 3.11Å; L1076-H1084 HydrophobicContact CD2-CB 3.93Å; L1076-H1084 PolarHBondContact O-CE1 2.81Å; L1076-H1084 PolarHBondContact O-NE2 3.19Å; L1076-V1087 HydrophobicContact CD2-CB 3.93Å; L1076-V1087 HydrophobicContact CD2-CG1 3.76Å; L1076-L1088 HydrophobicContact CD1-CD2 3.9Å; L1076-L1088 HydrophobicContact CD1-CG 4.15Å; L1076-L1088 HydrophobicContact CD2-CG 4.47Å
1077	E	91.3	Very high	90.6	Very high	80 Å²	80	57.2 Å²	57.2	37%	0.374	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-18.7	173.8	-70.4	-178.6	-178.1	0	0	113.7	K1041 N1073 Y1075	K1041-E1077 WeakPolarHBondContact CA-OE2 3.33Å; K1041-E1077 HydrophobicContact CB-CB 4.04Å; K1041-E1077 WeakPolarHBondContact CB-OE2 3.31Å; N1073-E1077 PolarHBondContact O-N 2.89Å; Y1075-E1077 PolarHBondContact O-N 3.22Å
1078	W	92.1	Very high	90.5	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.7	-21	179.9	-71.3	78.4	0	0	0	114	L1009 L1024 I1025 I1030 L1031 K1041 T1042 L1045 Y1075 L1076	L1009-W1078 HydrophobicContact CD1-CD2 3.58Å; L1009-W1078 HydrophobicContact CD1-CE3 3.59Å; L1009-W1078 HydrophobicContact CD1-CG 4.2Å; L1009-W1078 HydrophobicContact CD1-CH2 3.87Å; L1009-W1078 HydrophobicContact CD1-CZ2 3.89Å; L1009-W1078 HydrophobicContact CD1-CZ3 3.74Å; L1009-W1078 HydrophobicContact CD2-CB 3.83Å; L1009-W1078 HydrophobicContact CD2-CD2 3.95Å; L1009-W1078 HydrophobicContact CD2-CE3 4.46Å; L1009-W1078 HydrophobicContact CD2-CG 3.65Å; L1009-W1078 HydrophobicContact CG-CD2 4.44Å; L1024-W1078 CarbonylContact C-O 3.52Å; L1024-W1078 VanDerWaalsContact CA-O 3.31Å; L1024-W1078 WeakPolarHBondContact CA-O 3.45Å; L1024-W1078 HydrophobicContact CD2-CB 3.9Å; I1025-W1078 PolarHBondContact N-O 2.99Å; I1030-W1078 HydrophobicContact CG2-CH2 3.56Å; I1030-W1078 HydrophobicContact CG2-CZ3 3.75Å; L1031-W1078 HydrophobicContact CD1-CH2 4.49Å; L1031-W1078 HydrophobicContact CD2-CH2 3.99Å; L1031-W1078 HydrophobicContact CD2-CZ2 4.01Å; L1031-W1078 HydrophobicContact CG-CH2 3.97Å; L1031-W1078 HydrophobicContact CG-CZ2 4.45Å; K1041-W1078 HydrophobicContact CG-CZ2 4.38Å; K1041-W1078 PolarHBondContact O-NE1 2.96Å; T1042-W1078 HydrophobicContact CG2-CH2 3.87Å; T1042-W1078 HydrophobicContact CG2-CZ2 3.76Å; L1045-W1078 HydrophobicContact CD2-CZ2 4.43Å; Y1075-W1078 WeakPolarHBondContact O-CB 3.48Å; Y1075-W1078 PolarHBondContact O-N 2.94Å; L1076-W1078 PolarHBondContact O-N 3.02Å; L1076-W1078 VanDerWaalsContact O-N 3.14Å
1079	V	91	Very high	90.5	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	32%	0.317	C	S	.	.	B	Isolated β-bridge	trans	-97.9	143	-176	-179.6	0	0	0	0	110.5	L1024 I1025 Y1075 L1076 Q1081 K1083 H1084 V1087	L1024-V1079 HydrophobicContact CD2-CG2 4.26Å; I1025-V1079 WeakPolarHBondContact CD1-O 3.45Å; Y1075-V1079 HydrophobicContact CD1-CG2 4.09Å; Y1075-V1079 HydrophobicContact CE1-CG2 3.58Å; L1076-V1079 PolarHBondContact O-N 3.11Å; V1079-Q1081 PolarHBondContact O-N 3.18Å; V1079-K1083 HydrophobicContact CG1-CB 3.69Å; V1079-H1084 PolarHBondContact O-CD2 3.33Å; V1079-H1084 PolarHBondContact O-NE2 2.66Å; V1079-V1087 HydrophobicContact CG1-CG2 4.11Å; V1079-V1087 HydrophobicContact CG2-CG2 4.41Å
1080	A	90.9	Very high	90.4	Very high	30 Å²	30	57.2 Å²	57.2	25%	0.248	29%	0.294	C	S	.	.			trans	-55.8	137.9	175.4	0	0	0	0	0	111.6	S1023 I1025 S1082 K1083 H1084	S1023-A1080 PolarHBondContact O-N 3.21Å; I1025-A1080 HydrophobicContact CG1-CB 4.47Å; A1080-S1082 PolarHBondContact O-N 3.44Å; A1080-K1083 PolarHBondContact O-N 3.44Å; A1080-H1084 PolarHBondContact O-CD2 3.43Å; A1080-H1084 VanDerWaalsContact O-CD2 3.28Å
1081	Q	89.3	Confident	90.3	Very high	165 Å²	165	57.5 Å²	57.5	77%	0.771	30%	0.295	S	S	*	.	G	3₁₀ helix	trans	-54.2	-31.5	-176	-70.9	178.5	-5.7	0	0	113.5	V1079 K1083 H1084	V1079-Q1081 PolarHBondContact O-N 3.18Å; Q1081-K1083 PolarHBondContact O-N 2.86Å; Q1081-K1083 VanDerWaalsContact O-N 3.1Å; Q1081-H1084 WeakPolarHBondContact O-CB 3.27Å; Q1081-H1084 PolarHBondContact O-N 3.4Å
1082	S	90.6	Very high	90.1	Very high	103 Å²	103	59.2 Å²	59.2	72%	0.72	31%	0.306	S	S	*	.	G	3₁₀ helix	trans	-60.4	-18.7	175.9	56.8	0	0	0	0	114.4	A1080	A1080-S1082 PolarHBondContact O-N 3.44Å
1083	K	89.2	Confident	89.8	Confident	78 Å²	78	59 Å²	59	34%	0.339	31%	0.305	S	S	.	.	G	3₁₀ helix	trans	-109.9	1.9	-178.5	-70	-67.1	179.6	-178.3	0	113.7	V1079 A1080 Q1081 N1085 D1086 V1087	V1079-K1083 HydrophobicContact CG1-CB 3.69Å; A1080-K1083 PolarHBondContact O-N 3.44Å; Q1081-K1083 PolarHBondContact O-N 2.86Å; Q1081-K1083 VanDerWaalsContact O-N 3.1Å; K1083-N1085 VanDerWaalsContact C-N 3.34Å; K1083-N1085 PolarHBondContact O-N 3.08Å; K1083-D1086 HydrophobicContact CD-CB 4.46Å; K1083-D1086 WeakPolarHBondContact CD-OD2 3.49Å; K1083-D1086 IonicContact NZ-OD2 2.88Å; K1083-D1086 PolarHBondContact NZ-OD2 3.31Å; K1083-D1086 PolarHBondContact O-N 3.08Å; K1083-V1087 WeakPolarHBondContact O-CG2 3.43Å; K1083-V1087 PolarHBondContact O-N 3.35Å
1084	H	90.4	Very high	89.3	Confident	47 Å²	47	56.7 Å²	56.7	22%	0.218	29%	0.292	C	S	.	.	H	α-helix	trans	-60.8	-41.4	-179.2	-74.8	-163.5	0	0	0	112.5	L1076 V1079 A1080 Q1081 D1086 V1087 L1088	L1076-H1084 HydrophobicContact CD2-CB 3.93Å; L1076-H1084 PolarHBondContact O-CE1 2.81Å; L1076-H1084 PolarHBondContact O-NE2 3.19Å; V1079-H1084 PolarHBondContact O-CD2 3.33Å; V1079-H1084 PolarHBondContact O-NE2 2.66Å; A1080-H1084 PolarHBondContact O-CD2 3.43Å; A1080-H1084 VanDerWaalsContact O-CD2 3.28Å; Q1081-H1084 WeakPolarHBondContact O-CB 3.27Å; Q1081-H1084 PolarHBondContact O-N 3.4Å; H1084-D1086 PolarHBondContact O-N 3.22Å; H1084-V1087 PolarHBondContact O-N 2.95Å; H1084-L1088 WeakPolarHBondContact O-CB 3.3Å; H1084-L1088 VanDerWaalsContact O-CG 3.3Å; H1084-L1088 WeakPolarHBondContact O-CG 3.36Å; H1084-L1088 PolarHBondContact O-N 3.06Å
1085	N	88.9	Confident	88.2	Confident	128 Å²	128	59.1 Å²	59.1	68%	0.684	30%	0.303	S	S	*	.	H	α-helix	trans	-63.2	-40.7	177.1	-68.3	-25.7	0	0	0	112.2	K1083 F1089	K1083-N1085 VanDerWaalsContact C-N 3.34Å; K1083-N1085 PolarHBondContact O-N 3.08Å; N1085-F1089 WeakPolarHBondContact O-CB 3.36Å; N1085-F1089 PolarHBondContact O-N 3.28Å
1086	D	89.2	Confident	86.6	Confident	67 Å²	67	72 Å²	72	36%	0.358	36%	0.36	S	S	.	.	H	α-helix	trans	-63.4	-46.7	177.1	-62.7	-10.1	0	0	0	110	Y1020 K1083 H1084 F1089 D1090	Y1020-D1086 HydrophobicContact CE1-CB 3.98Å; Y1020-D1086 WeakPolarHBondContact OH-CB 3.34Å; Y1020-D1086 PolarHBondContact OH-O 2.82Å; Y1020-D1086 VanDerWaalsContact OH-O 3.09Å; K1083-D1086 HydrophobicContact CD-CB 4.46Å; K1083-D1086 WeakPolarHBondContact CD-OD2 3.49Å; K1083-D1086 IonicContact NZ-OD2 2.88Å; K1083-D1086 PolarHBondContact NZ-OD2 3.31Å; K1083-D1086 PolarHBondContact O-N 3.08Å; H1084-D1086 PolarHBondContact O-N 3.22Å; D1086-F1089 PolarHBondContact O-N 3.44Å; D1086-D1090 PolarHBondContact O-N 3.15Å; D1086-D1090 VanDerWaalsContact O-OD2 3.07Å
1087	V	89	Confident	86.3	Confident	1 Å²	1	74.7 Å²	74.7	1%	0.006	37%	0.373	C	S	.	.	H	α-helix	trans	-62.3	-46.1	178.7	172.6	0	0	0	0	111.5	Y1020 Y1075 L1076 V1079 K1083 H1084 F1089 D1090 W1091	Y1020-V1087 HydrophobicContact CD1-CG2 3.74Å; Y1020-V1087 HydrophobicContact CD2-CG2 3.95Å; Y1020-V1087 HydrophobicContact CE1-CG2 3.59Å; Y1020-V1087 HydrophobicContact CE2-CG2 3.79Å; Y1020-V1087 HydrophobicContact CG-CG2 3.93Å; Y1020-V1087 PolarHBondContact OH-N 3.05Å; Y1075-V1087 HydrophobicContact CD1-CG1 3.73Å; Y1075-V1087 HydrophobicContact CE1-CG1 3.86Å; Y1075-V1087 HydrophobicContact CE1-CG2 4.19Å; L1076-V1087 HydrophobicContact CD2-CB 3.93Å; L1076-V1087 HydrophobicContact CD2-CG1 3.76Å; V1079-V1087 HydrophobicContact CG1-CG2 4.11Å; V1079-V1087 HydrophobicContact CG2-CG2 4.41Å; K1083-V1087 WeakPolarHBondContact O-CG2 3.43Å; K1083-V1087 PolarHBondContact O-N 3.35Å; H1084-V1087 PolarHBondContact O-N 2.95Å; V1087-F1089 VanDerWaalsContact C-N 3.26Å; V1087-F1089 PolarHBondContact O-N 3.44Å; V1087-D1090 PolarHBondContact O-N 3.34Å; V1087-W1091 HydrophobicContact CG1-CE3 4.31Å; V1087-W1091 PolarHBondContact O-N 3.39Å; V1087-W1091 VanDerWaalsContact O-N 3.13Å
1088	L	89.2	Confident	86.1	Confident	89 Å²	89	74.4 Å²	74.4	47%	0.466	37%	0.372	S	S	.	.	H	α-helix	trans	-61.1	-36.1	178.4	-77.8	169.4	0	0	0	111.9	L1076 H1084 W1091	L1076-L1088 HydrophobicContact CD1-CD2 3.9Å; L1076-L1088 HydrophobicContact CD1-CG 4.15Å; L1076-L1088 HydrophobicContact CD2-CG 4.47Å; H1084-L1088 WeakPolarHBondContact O-CB 3.3Å; H1084-L1088 VanDerWaalsContact O-CG 3.3Å; H1084-L1088 WeakPolarHBondContact O-CG 3.36Å; H1084-L1088 PolarHBondContact O-N 3.06Å; L1088-W1091 PolarHBondContact O-N 2.98Å
1089	F	87.8	Confident	85.8	Confident	183 Å²	183	78.6 Å²	78.6	80%	0.803	39%	0.393	S	S	*	.	H	α-helix	trans	-68.6	-34.7	176.9	-176	-95.6	0	0	0	112.7	N1085 D1086 V1087	N1085-F1089 WeakPolarHBondContact O-CB 3.36Å; N1085-F1089 PolarHBondContact O-N 3.28Å; D1086-F1089 PolarHBondContact O-N 3.44Å; V1087-F1089 VanDerWaalsContact C-N 3.26Å; V1087-F1089 PolarHBondContact O-N 3.44Å
1090	D	86.7	Confident	85.4	Confident	38 Å²	38	83.2 Å²	83.2	20%	0.203	42%	0.416	C	S	.	.	H	α-helix	trans	-86.4	-3	177.9	-64.3	-65.9	0	0	0	114.4	K1019 Y1020 D1086 V1087 P1092 P1093	K1019-D1090 WeakPolarHBondContact CE-OD2 3.39Å; K1019-D1090 IonicContact NZ-OD1 3.74Å; K1019-D1090 PolarHBondContact NZ-OD1 2.9Å; K1019-D1090 IonicContact NZ-OD2 3.37Å; K1019-D1090 PolarHBondContact NZ-OD2 3.18Å; Y1020-D1090 PolarHBondContact OH-OD2 2.99Å; D1086-D1090 PolarHBondContact O-N 3.15Å; D1086-D1090 VanDerWaalsContact O-OD2 3.07Å; V1087-D1090 PolarHBondContact O-N 3.34Å; D1090-P1092 CarbonylContact O-C 3.51Å; D1090-P1092 VanDerWaalsContact O-O 3.1Å; D1090-P1093 WeakPolarHBondContact O-CA 3.1Å
1091	W	89.2	Confident	85.1	Confident	26 Å²	26	86.5 Å²	86.5	10%	0.098	43%	0.427	C	S	.	.			trans	-88.4	133.9	-176	-156.4	-87	0	0	0	111.7	F1008 L1017 W1064 P1068 F1070 L1071 C1072 Y1075 V1087 L1088 P1093	F1008-W1091 HydrophobicContact CZ-CH2 4.1Å; L1017-W1091 HydrophobicContact CD1-CZ3 4.46Å; L1017-W1091 HydrophobicContact CD2-CZ3 4.11Å; W1064-W1091 AromaticContact CE2-CZ2 3.72Å; W1064-W1091 AromaticContact CZ2-CH2 3.78Å; W1064-W1091 HydrophobicContact CZ2-CH2 3.78Å; W1064-W1091 AromaticContact CZ2-CZ2 3.53Å; W1064-W1091 HydrophobicContact CZ2-CZ2 3.53Å; W1064-W1091 AromaticContact NE1-CE2 3.72Å; W1064-W1091 AromaticContact NE1-CZ2 3.44Å; W1064-W1091 AromaticContact NE1-NE1 3.65Å; P1068-W1091 PolarHBondContact O-NE1 3.19Å; F1070-W1091 WeakPolarHBondContact O-CZ2 3.48Å; F1070-W1091 PolarHBondContact O-NE1 3.18Å; L1071-W1091 HydrophobicContact CB-CH2 4.43Å; L1071-W1091 HydrophobicContact CB-CZ2 4.11Å; C1072-W1091 HydrophobicContact CB-CD2 3.99Å; C1072-W1091 HydrophobicContact CB-CG 4.07Å; C1072-W1091 HydrophobicContact CB-CZ2 4.17Å; Y1075-W1091 AromaticContact CD1-CZ3 3.92Å; Y1075-W1091 HydrophobicContact CD1-CZ3 3.92Å; Y1075-W1091 HydrophobicContact CG-CH2 4.3Å; Y1075-W1091 HydrophobicContact CG-CZ3 4.01Å; V1087-W1091 HydrophobicContact CG1-CE3 4.31Å; V1087-W1091 PolarHBondContact O-N 3.39Å; V1087-W1091 VanDerWaalsContact O-N 3.13Å; L1088-W1091 PolarHBondContact O-N 2.98Å; W1091-P1093 HydrophobicContact CE3-CG 4.22Å; W1091-P1093 HydrophobicContact CZ3-CG 4.16Å
1092	P	87.2	Confident	84.8	Confident	38 Å²	38	81.3 Å²	81.3	25%	0.247	40%	0.404	C	S	.	.	S	Bend	cis	-72.8	141	-3.9	28.6	-33.9	0	0	0	112.5	W1064 P1068 D1090 L1094	W1064-P1092 HydrophobicContact CB-CB 4.01Å; W1064-P1092 HydrophobicContact CD2-CB 4.09Å; W1064-P1092 HydrophobicContact CG-CB 3.83Å; P1068-P1092 HydrophobicContact CB-CG 4.44Å; D1090-P1092 CarbonylContact O-C 3.51Å; D1090-P1092 VanDerWaalsContact O-O 3.1Å; P1092-L1094 HydrophobicContact CB-CG 4.21Å; P1092-L1094 HydrophobicContact CG-CD1 4.06Å; P1092-L1094 HydrophobicContact CG-CG 4.24Å; P1092-L1094 PolarHBondContact O-N 3.14Å
1093	P	85.4	Confident	84.4	Confident	1 Å²	1	79.7 Å²	79.7	1%	0.006	38%	0.381	C	S	.	.			trans	-78.7	54	-172.9	35	-38.9	0	0	0	112.6	I1014 K1016 L1017 W1064 D1090 W1091	I1014-P1093 HydrophobicContact CG2-CB 3.91Å; I1014-P1093 HydrophobicContact CG2-CG 3.97Å; I1014-P1093 VanDerWaalsContact CG2-O 3.22Å; I1014-P1093 WeakPolarHBondContact CG2-O 3.41Å; K1016-P1093 HydrophobicContact CB-CB 4.04Å; L1017-P1093 HydrophobicContact CD1-CG 4.14Å; L1017-P1093 HydrophobicContact CD2-CB 3.81Å; L1017-P1093 HydrophobicContact CD2-CG 3.93Å; L1017-P1093 HydrophobicContact CG-CB 4.04Å; L1017-P1093 HydrophobicContact CG-CG 4.02Å; W1064-P1093 HydrophobicContact CH2-CG 3.36Å; W1064-P1093 HydrophobicContact CZ2-CG 3.84Å; W1064-P1093 HydrophobicContact CZ3-CG 3.8Å; D1090-P1093 WeakPolarHBondContact O-CA 3.1Å; W1091-P1093 HydrophobicContact CE3-CG 4.22Å; W1091-P1093 HydrophobicContact CZ3-CG 4.16Å
1094	L	81.5	Confident	84	Confident	62 Å²	62	79.8 Å²	79.8	33%	0.325	39%	0.385	S	S	.	.			trans	-75.3	129.4	179.4	-62	173.4	0	0	0	110.8	K1016 I1061 W1064 P1092	K1016-L1094 WeakPolarHBondContact CD-O 3.5Å; K1016-L1094 WeakPolarHBondContact CE-O 3.44Å; K1016-L1094 PolarHBondContact NZ-O 2.97Å; I1061-L1094 HydrophobicContact CB-CD2 4.49Å; I1061-L1094 HydrophobicContact CG1-CD2 4.12Å; I1061-L1094 HydrophobicContact CG2-CD2 4.12Å; W1064-L1094 HydrophobicContact CE3-CD2 3.95Å; P1092-L1094 HydrophobicContact CB-CG 4.21Å; P1092-L1094 HydrophobicContact CG-CD1 4.06Å; P1092-L1094 HydrophobicContact CG-CG 4.24Å; P1092-L1094 PolarHBondContact O-N 3.14Å
1095	E	69.1	Low	83.5	Confident	86 Å²	86	82.6 Å²	82.6	40%	0.402	40%	0.398	S	S	.	.			trans	-63.6	140.4	167.8	-72.6	161.8	-173.9	0	0	109.2	S1015 K1057	S1015-E1095 WeakPolarHBondContact CB-OE1 3.27Å; S1015-E1095 PolarHBondContact OG-OE1 3.14Å; K1057-E1095 IonicContact NZ-OE1 3.24Å; K1057-E1095 PolarHBondContact NZ-OE1 3.35Å; K1057-E1095 IonicContact NZ-OE2 3.9Å; K1057-E1095 PolarHBondContact NZ-OE2 3.47Å
1096	K	58.7	Low	83	Confident	272 Å²	272	78.5 Å²	78.5	100%	1.183	37%	0.372	S	S	*	.			trans	-72.8	0	-176.5	-87.8	-170	178.2	-177.3	0	112.1

Retrieved 1,096 of 1,096 residues in 487.2 ms (Link to these results)

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